#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 4.13 0.00 0.03 -1.52 -1.26 -4.99 119.66 116.05 1wnb s GLN 2 Ca 0.00 -0.24 0.02 0.00 -1.95 0.00 0.00 55.36 53.19 1wnb s GLN 2 Cb 0.00 -3.49 0.03 0.00 -0.22 0.00 0.00 33.01 29.34 1wnb s GLN 2 CO 0.00 0.17 0.79 -2.39 -0.25 0.00 0.00 175.29 173.60 1wnb n HIS 3 N 3.94 0.04 -3.48 0.91 1.44 -1.26 -4.64 115.22 112.17 1wnb n HIS 3 Ca -0.15 -0.24 -0.34 0.00 -2.01 0.00 0.00 57.72 54.98 1wnb n HIS 3 Cb 0.52 -0.02 -0.06 0.00 0.12 0.00 0.00 29.99 30.55 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 -0.55 3.85 0.43 -1.40 1.02 -1.26 -4.65 119.74 117.18 1wnb s LYS 4 Ca 0.03 0.30 -0.24 0.00 0.02 0.00 0.00 55.97 56.08 1wnb s LYS 4 Cb 0.02 -2.93 -0.08 0.00 -0.52 0.00 0.00 37.83 34.32 1wnb s LYS 4 CO 0.02 0.50 1.14 -0.51 -0.92 0.00 0.00 175.35 175.58 1wnb s LEU 5 N -2.05 4.08 -0.37 3.17 1.43 0.94 -4.77 118.68 121.10 1wnb s LEU 5 Ca 0.37 2.24 -0.13 0.00 -1.03 0.00 0.00 54.13 55.58 1wnb s LEU 5 Cb -0.14 -4.18 0.01 0.00 0.03 0.00 0.00 46.19 41.90 1wnb s LEU 5 CO 0.19 -0.75 0.26 -0.22 0.23 0.00 0.00 176.35 176.05 1wnb s LEU 6 N -2.82 4.78 -0.12 1.79 0.20 -0.68 -0.57 118.68 121.27 1wnb s LEU 6 Ca 0.61 -0.72 -0.00 0.00 0.69 0.00 0.00 54.13 54.71 1wnb s LEU 6 Cb -0.27 -2.12 0.02 0.00 -0.43 0.00 0.00 46.19 43.39 1wnb s LEU 6 CO 0.34 -0.35 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.33 1wnb s ILE 7 N 1.67 1.11 -1.47 6.68 1.01 -0.49 -0.44 121.20 129.28 1wnb s ILE 7 Ca 0.05 -0.35 -0.13 0.00 0.00 0.00 0.00 60.65 60.23 1wnb s ILE 7 Cb -0.18 -1.11 0.09 0.00 0.01 0.00 0.00 42.46 41.27 1wnb s ILE 7 CO 0.09 0.38 0.72 -3.20 0.00 0.00 0.00 174.94 172.93 1wnb n ASN 8 N 4.87 -4.13 0.00 3.58 5.15 -1.26 -1.39 115.26 122.08 1wnb n ASN 8 Ca -0.14 -0.64 0.00 0.00 -0.60 0.00 0.00 54.58 53.21 1wnb n ASN 8 Cb 0.50 -3.36 0.00 0.00 -0.53 0.00 0.00 39.78 36.39 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 -1.40 0.73 3.23 8.20 0.00 -1.26 -4.40 105.19 110.29 1wnb n GLY 9 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.64 1.53 -0.27 1.61 0.41 -0.48 -4.91 118.70 115.95 1wnb s GLU 10 Ca 0.00 -0.83 -0.22 0.00 -0.41 0.00 0.00 54.97 53.52 1wnb s GLU 10 Cb 0.00 -1.55 -0.01 0.00 -1.78 0.00 0.00 34.13 30.79 1wnb s GLU 10 CO 0.00 0.41 0.70 -0.51 -0.49 0.00 0.00 175.26 175.37 1wnb s LEU 11 N -0.81 4.09 0.02 1.80 1.43 -1.26 -1.40 118.68 122.55 1wnb s LEU 11 Ca 0.08 0.71 0.04 0.00 -1.03 0.00 0.00 54.13 53.92 1wnb s LEU 11 Cb -0.08 -2.95 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 1wnb s LEU 11 CO 0.00 -0.47 -0.12 0.68 0.23 0.00 0.00 176.35 176.68 1wnb s VAL 12 N 2.67 0.92 0.32 -1.59 -7.23 0.27 -4.92 120.40 110.84 1wnb s VAL 12 Ca 0.29 -0.76 -0.29 0.00 -1.81 0.00 0.00 61.98 59.40 1wnb s VAL 12 Cb -0.15 -0.82 -0.12 0.00 0.56 0.00 0.00 36.38 35.85 1wnb s VAL 12 CO 0.10 0.06 1.55 -1.20 -0.31 0.00 0.00 175.10 175.29 1wnb n SER 13 N 2.26 3.77 -4.50 4.85 7.64 -1.26 -0.04 113.62 126.34 1wnb n SER 13 Ca -0.17 1.18 -0.41 0.00 1.01 0.00 0.00 58.87 60.48 1wnb n SER 13 Cb 0.55 -1.59 0.01 0.00 -1.01 0.00 0.00 64.21 62.17 1wnb n SER 13 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wnb n GLY 14 N 1.55 -1.10 0.29 0.23 0.00 -1.25 -4.87 105.19 100.03 1wnb n GLY 14 Ca 0.06 0.06 0.03 0.00 0.00 0.00 0.00 46.02 46.17 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 0.39 1.62 -0.04 1.61 1.02 -1.06 -4.82 120.64 119.36 1wnb n GLU 15 Ca 0.11 -1.39 0.00 0.00 -0.02 0.00 0.00 57.16 55.86 1wnb n GLU 15 Cb 0.40 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 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 0.15 0.23 3.82 0.62 0.00 0.82 -4.73 105.19 106.11 1wnb n GLY 16 Ca 0.05 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 1wnb n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wnb s GLU 17 N 0.72 4.21 0.04 1.61 2.02 -1.26 -4.10 118.70 121.93 1wnb s GLU 17 Ca 0.00 1.07 -0.30 0.00 0.02 0.00 0.00 54.97 55.76 1wnb s GLU 17 Cb 0.00 -2.21 -0.04 0.00 0.10 0.00 0.00 34.13 31.98 1wnb s GLU 17 CO 0.00 -0.01 1.02 0.15 0.02 0.00 0.00 175.26 176.44 1wnb s LYS 18 N -3.16 4.56 -0.02 1.61 1.02 -1.26 -0.76 119.74 121.73 1wnb s LYS 18 Ca 0.61 1.49 0.07 0.00 0.02 0.00 0.00 55.97 58.16 1wnb s LYS 18 Cb -0.09 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 1wnb s LYS 18 CO 0.14 -0.03 -0.22 -0.65 -0.92 0.00 0.00 175.35 173.66 1wnb s GLN 19 N 0.79 1.87 0.26 1.68 -1.52 0.21 -4.87 119.66 118.07 1wnb s GLN 19 Ca 0.52 -0.80 -0.28 0.00 -1.95 0.00 0.00 55.36 52.85 1wnb s GLN 19 Cb -0.23 -1.78 -0.09 0.00 -0.22 0.00 0.00 33.01 30.69 1wnb s GLN 19 CO 0.29 0.47 0.91 -1.25 -0.25 0.00 0.00 175.29 175.46 1wnb s PRO 20 N -0.48 4.72 -0.14 2.91 0.04 -1.26 -0.94 135.00 139.84 1wnb s PRO 20 Ca 0.07 1.38 -0.01 0.00 0.04 0.00 0.00 61.00 62.48 1wnb s PRO 20 Cb -0.09 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.32 1wnb s PRO 20 CO -0.00 0.45 -0.11 0.08 0.04 0.00 0.00 177.00 177.45 1wnb s VAL 21 N -1.32 3.17 0.07 -0.36 1.01 -0.01 -4.93 120.40 118.04 1wnb s VAL 21 Ca 0.43 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1wnb s VAL 21 Cb -0.23 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1wnb s VAL 21 CO 0.28 0.51 0.19 -0.31 0.00 0.00 0.00 175.10 175.78 1wnb s TYR 22 N 0.42 3.44 -0.51 5.22 1.51 -1.26 -0.16 117.35 126.01 1wnb s TYR 22 Ca -0.09 0.20 -0.23 0.00 -1.01 0.00 0.00 57.07 55.95 1wnb s TYR 22 Cb -0.16 -1.72 0.04 0.00 -0.11 0.00 0.00 41.96 40.01 1wnb s TYR 22 CO 0.05 0.57 0.83 1.21 -1.11 0.00 0.00 175.55 177.10 1wnb s ASN 23 N -2.54 6.34 0.00 2.29 3.04 0.34 -4.73 114.94 119.68 1wnb s ASN 23 Ca 0.34 -0.40 0.22 0.00 0.04 0.00 0.00 52.86 53.05 1wnb s ASN 23 Cb -0.13 -2.39 1.09 0.00 -1.54 0.00 0.00 41.25 38.28 1wnb s ASN 23 CO 0.27 -1.07 1.70 -0.81 -3.04 0.00 0.00 177.10 174.15 1wnb n PRO 24 N 6.98 0.29 0.20 0.43 -0.04 -1.26 0.30 135.00 141.90 1wnb n PRO 24 Ca 0.00 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 1wnb n PRO 24 Cb 0.47 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.79 1wnb n PRO 24 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wnb h ALA 25 N 3.01 0.95 0.00 0.55 0.00 -1.90 -1.30 119.26 120.58 1wnb h ALA 25 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1wnb h ALA 25 Cb 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1wnb h ALA 25 CO 0.00 0.35 -0.32 0.25 0.00 0.00 0.00 179.25 179.53 1wnb n THR 26 N -3.36 0.00 -0.97 0.00 -2.24 -0.92 -3.88 114.28 102.91 1wnb n THR 26 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1wnb n THR 26 Cb 0.50 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 0.82 0.54 3.81 3.38 0.00 0.15 -3.33 105.19 110.55 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 -2.25 6.21 -0.16 1.61 1.01 -1.23 -4.80 116.67 117.07 1wnb s ASP 28 Ca 0.00 1.83 -0.22 0.00 0.71 0.00 0.00 52.55 54.87 1wnb s ASP 28 Cb 0.00 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.36 1wnb s ASP 28 CO 0.00 -0.87 0.67 -0.69 0.21 0.00 0.00 175.17 174.48 1wnb s VAL 29 N -2.24 5.02 -0.06 -1.27 1.01 -1.26 -0.50 120.40 121.09 1wnb s VAL 29 Ca 0.65 1.29 -0.25 0.00 0.00 0.00 0.00 61.98 63.67 1wnb s VAL 29 Cb -0.15 -3.99 -0.25 0.00 0.00 0.00 0.00 36.38 32.00 1wnb s VAL 29 CO 0.27 0.14 0.97 -0.07 0.00 0.00 0.00 175.10 176.41 1wnb h LEU 30 N 7.82 0.22 -7.91 3.92 3.38 -0.87 -3.47 115.31 118.39 1wnb h LEU 30 Ca -0.34 -0.83 0.25 0.00 0.09 0.00 0.00 57.88 57.06 1wnb h LEU 30 Cb 1.15 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.78 1wnb h LEU 30 CO 0.78 1.02 0.74 -1.48 0.09 0.00 0.00 178.44 179.59 1wnb s LEU 31 N -8.40 -0.00 -0.08 1.67 0.05 -1.23 -5.03 118.68 105.65 1wnb s LEU 31 Ca -0.16 -0.43 0.02 0.00 0.05 0.00 0.00 54.13 53.61 1wnb s LEU 31 Cb 0.00 1.70 -0.02 0.00 -2.05 0.00 0.00 46.19 45.81 1wnb s LEU 31 CO 0.74 -0.63 -0.12 -1.61 -0.55 0.00 0.00 176.35 174.18 1wnb s GLU 32 N -2.13 2.84 -0.05 1.48 2.02 -1.26 -0.83 118.70 120.77 1wnb s GLU 32 Ca 0.25 -0.65 0.04 0.00 0.02 0.00 0.00 54.97 54.63 1wnb s GLU 32 Cb -0.01 -2.52 0.00 0.00 0.10 0.00 0.00 34.13 31.70 1wnb s GLU 32 CO 0.02 0.51 -0.17 0.42 0.02 0.00 0.00 175.26 176.06 1wnb s ILE 33 N -0.43 1.47 0.07 -1.63 1.01 -0.11 -4.85 121.20 116.73 1wnb s ILE 33 Ca 0.05 -0.72 -0.31 0.00 0.00 0.00 0.00 60.65 59.68 1wnb s ILE 33 Cb -0.12 -1.28 -0.06 0.00 0.01 0.00 0.00 42.46 41.02 1wnb s ILE 33 CO 0.02 0.42 1.19 0.00 0.00 0.00 0.00 174.94 176.58 1wnb s ALA 34 N 0.19 3.39 0.69 9.38 0.00 -1.26 -0.62 121.76 133.53 1wnb s ALA 34 Ca -0.08 0.85 -0.17 0.00 0.00 0.00 0.00 51.96 52.56 1wnb s ALA 34 Cb -0.13 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.56 1wnb s ALA 34 CO 0.03 -0.43 1.26 -1.21 0.00 0.00 0.00 175.76 175.42 1wnb s GLU 35 N 1.00 2.33 0.36 0.00 2.02 0.06 -3.96 118.70 120.50 1wnb s GLU 35 Ca 0.58 1.95 -0.28 0.00 0.02 0.00 0.00 54.97 57.24 1wnb s GLU 35 Cb -0.29 -1.83 -0.11 0.00 0.10 0.00 0.00 34.13 31.99 1wnb s GLU 35 CO 0.29 -1.74 1.45 0.00 0.02 0.00 0.00 175.26 175.28 1wnb n ALA 36 N -2.29 2.12 -1.70 5.21 0.00 -0.19 -0.12 120.51 123.54 1wnb n ALA 36 Ca 0.15 0.35 -0.29 0.00 0.00 0.00 0.00 53.44 53.65 1wnb n ALA 36 Cb 0.49 -2.38 0.10 0.00 0.00 0.00 0.00 19.45 17.66 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 -0.12 4.19 0.37 0.00 1.04 -1.26 -4.48 113.70 113.45 1wnb s SER 37 Ca 0.55 0.96 0.07 0.00 0.48 0.00 0.00 55.95 58.01 1wnb s SER 37 Cb -0.50 -1.55 0.73 0.00 0.10 0.00 0.00 66.02 64.79 1wnb s SER 37 CO 0.62 -2.12 1.92 0.00 0.98 0.00 0.00 173.24 174.64 1wnb h ALA 38 N -1.20 1.49 -0.66 5.32 0.00 -1.95 -0.44 119.26 121.81 1wnb h ALA 38 Ca -0.48 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.19 1wnb h ALA 38 Cb 1.31 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1wnb h ALA 38 CO 0.63 0.37 0.14 0.93 0.00 0.00 0.00 179.25 181.32 1wnb h GLU 39 N 0.38 1.07 -0.46 0.00 5.08 -1.99 -1.36 114.58 117.32 1wnb h GLU 39 Ca 0.09 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 58.05 1wnb h GLU 39 Cb 0.29 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1wnb h GLU 39 CO 0.01 0.97 -0.21 1.96 -1.00 0.00 0.00 179.01 180.74 1wnb h GLN 40 N 1.00 0.95 -0.11 2.33 4.20 -1.60 0.15 115.11 122.02 1wnb h GLN 40 Ca 0.21 -0.41 0.04 0.00 0.06 0.00 0.00 58.65 58.55 1wnb h GLN 40 Cb 0.39 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.09 1wnb h GLN 40 CO 0.01 1.08 -0.21 0.28 -0.67 0.00 0.00 178.83 179.31 1wnb h VAL 41 N 0.80 0.47 -0.26 -0.54 2.07 -1.10 0.13 116.25 117.83 1wnb h VAL 41 Ca 0.10 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.63 1wnb h VAL 41 Cb 0.79 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1wnb h VAL 41 CO 0.07 0.00 0.15 -0.78 0.02 0.00 0.00 177.57 177.02 1wnb h ASP 42 N -0.28 0.25 -0.96 0.57 3.58 -1.07 -2.13 116.42 116.38 1wnb h ASP 42 Ca 0.10 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.55 1wnb h ASP 42 Cb 0.42 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.37 1wnb h ASP 42 CO -0.28 0.18 0.61 0.00 -2.88 0.00 0.00 179.24 176.87 1wnb h ALA 43 N 1.11 1.27 -0.13 -0.78 0.00 -0.43 -1.17 119.26 119.13 1wnb h ALA 43 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wnb h ALA 43 Cb -0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1wnb h ALA 43 CO -0.04 0.65 0.08 0.00 0.00 0.00 0.00 179.25 179.94 1wnb h ALA 44 N 1.36 0.16 -0.68 0.00 0.00 -0.22 -0.47 119.26 119.42 1wnb h ALA 44 Ca 0.35 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1wnb h ALA 44 Cb -0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1wnb h ALA 44 CO -0.07 -0.34 0.42 0.28 0.00 0.00 0.00 179.25 179.54 1wnb h VAL 45 N 0.16 1.19 -0.73 0.00 2.07 -1.05 -1.41 116.25 116.48 1wnb h VAL 45 Ca 0.05 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 1wnb h VAL 45 Cb 0.00 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 1wnb h VAL 45 CO -0.01 0.20 0.29 0.03 0.02 0.00 0.00 177.57 178.09 1wnb h ARG 46 N 0.93 1.09 -0.38 1.57 3.08 -1.04 -0.61 114.38 119.01 1wnb h ARG 46 Ca 0.25 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1wnb h ARG 46 Cb -0.05 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1wnb h ARG 46 CO -0.05 0.89 0.05 0.00 -1.07 0.00 0.00 179.97 179.80 1wnb h ALA 47 N 1.24 0.50 -0.60 0.04 0.00 -0.79 -0.57 119.26 119.08 1wnb h ALA 47 Ca 0.25 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1wnb h ALA 47 Cb 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1wnb h ALA 47 CO -0.02 0.22 0.37 0.00 0.00 0.00 0.00 179.25 179.82 1wnb h ALA 48 N 0.91 0.77 -0.14 0.00 0.00 -1.07 0.15 119.26 119.88 1wnb h ALA 48 Ca 0.11 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1wnb h ALA 48 Cb 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1wnb h ALA 48 CO 0.01 0.11 -0.51 0.22 0.00 0.00 0.00 179.25 179.08 1wnb h ASP 49 N 0.73 0.43 0.71 0.00 3.58 -0.93 -0.59 116.42 120.34 1wnb h ASP 49 Ca 0.24 -0.21 -0.17 0.00 0.42 0.00 0.00 57.03 57.30 1wnb h ASP 49 Cb 0.01 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 1wnb h ASP 49 CO -0.10 0.86 -0.79 0.00 -2.88 0.00 0.00 179.24 176.34 1wnb h ALA 50 N 1.15 0.68 -0.05 -0.78 0.00 -0.79 -3.16 119.26 116.31 1wnb h ALA 50 Ca 0.01 -0.70 -0.09 0.00 0.00 0.00 0.00 54.91 54.13 1wnb h ALA 50 Cb 1.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1wnb h ALA 50 CO 0.09 0.94 -0.38 0.00 0.00 0.00 0.00 179.25 179.90 1wnb h ALA 51 N 1.17 1.28 -0.87 0.00 0.00 0.08 -3.17 119.26 117.75 1wnb h ALA 51 Ca -0.02 -0.36 0.11 0.00 0.00 0.00 0.00 54.91 54.64 1wnb h ALA 51 Cb 1.39 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.04 1wnb h ALA 51 CO 0.11 0.51 0.56 0.35 0.00 0.00 0.00 179.25 180.79 1wnb h PHE 52 N 0.09 0.88 -0.76 0.00 3.57 -1.10 -1.07 116.94 118.55 1wnb h PHE 52 Ca 0.01 0.02 0.15 0.00 3.53 0.00 0.00 57.97 61.69 1wnb h PHE 52 Cb 0.71 -0.28 -0.14 0.00 2.79 0.00 0.00 35.95 39.02 1wnb h PHE 52 CO 0.01 0.38 -0.17 0.00 -2.23 0.00 0.00 178.31 176.29 1wnb h ALA 53 N 1.58 0.52 0.11 2.41 0.00 -1.68 0.01 119.26 122.21 1wnb h ALA 53 Ca 0.42 0.29 -0.37 0.00 0.00 0.00 0.00 54.91 55.25 1wnb h ALA 53 Cb 0.53 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1wnb h ALA 53 CO -0.18 -0.41 -2.04 0.39 0.00 0.00 0.00 179.25 177.00 1wnb n GLU 54 N -5.49 0.75 -0.10 0.00 1.02 -1.16 -4.35 120.64 111.31 1wnb n GLU 54 Ca 0.11 0.25 -0.02 0.00 -0.02 0.00 0.00 57.16 57.47 1wnb n GLU 54 Cb 0.39 -1.69 0.21 0.00 -0.02 0.00 0.00 31.44 30.34 1wnb n GLU 54 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 1wnb h TRP 55 N 0.06 0.78 0.00 -0.32 2.91 -0.84 -1.76 115.95 116.78 1wnb h TRP 55 Ca -0.44 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.51 1wnb h TRP 55 Cb 2.02 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 30.44 1wnb h TRP 55 CO 0.07 0.68 0.00 0.41 -1.03 0.00 0.00 178.44 178.57 1wnb n GLY 56 N -0.85 -0.83 0.33 2.65 0.00 -0.04 -2.64 105.19 103.80 1wnb n GLY 56 Ca 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.42 2.37 -1.51 1.61 6.02 -0.67 -4.78 117.38 118.99 1wnb n GLN 57 Ca 0.04 -1.63 -0.32 0.00 -0.01 0.00 0.00 57.00 55.08 1wnb n GLN 57 Cb 0.13 -1.14 0.07 0.00 1.02 0.00 0.00 30.24 30.31 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 -0.91 3.20 0.55 5.09 -4.23 -1.08 -5.03 115.64 113.23 1wnb s THR 58 Ca 0.12 0.49 -0.16 0.00 -1.18 0.00 0.00 61.69 60.95 1wnb s THR 58 Cb 0.06 -2.98 -0.06 0.00 1.34 0.00 0.00 72.50 70.86 1wnb s THR 58 CO 0.08 -0.42 1.02 0.42 -0.54 0.00 0.00 174.62 175.18 1wnb s THR 59 N -2.56 4.23 0.38 3.99 -4.23 -1.26 -4.96 115.64 111.23 1wnb s THR 59 Ca 0.65 1.05 0.16 0.00 -1.18 0.00 0.00 61.69 62.37 1wnb s THR 59 Cb -0.20 -3.58 0.37 0.00 1.34 0.00 0.00 72.50 70.43 1wnb s THR 59 CO 0.48 -0.63 1.76 -0.65 -0.54 0.00 0.00 174.62 175.04 1wnb h PRO 60 N 0.67 0.43 -0.08 3.99 0.11 -1.94 -2.30 132.00 132.88 1wnb h PRO 60 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1wnb h PRO 60 Cb 1.20 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1wnb h PRO 60 CO 0.60 0.29 0.04 -0.22 -0.21 0.00 0.00 178.00 178.49 1wnb h LYS 61 N 0.44 0.08 -0.38 1.05 3.64 -1.92 -1.48 116.57 118.01 1wnb h LYS 61 Ca 0.61 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 60.02 1wnb h LYS 61 Cb 1.44 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.20 1wnb h LYS 61 CO -0.34 0.05 0.16 0.28 -2.27 0.00 0.00 179.45 177.33 1wnb h VAL 62 N 0.08 0.94 -0.53 2.00 2.07 -1.80 -1.81 116.25 117.20 1wnb h VAL 62 Ca 0.03 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 1wnb h VAL 62 Cb 0.00 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1wnb h VAL 62 CO -0.02 0.06 0.08 0.03 0.02 0.00 0.00 177.57 177.74 1wnb h ARG 63 N 0.34 0.88 -0.83 1.57 3.08 -1.42 -1.92 114.38 116.07 1wnb h ARG 63 Ca 0.16 -0.24 0.05 0.00 0.07 0.00 0.00 59.98 60.02 1wnb h ARG 63 Cb 0.10 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 1wnb h ARG 63 CO -0.14 0.86 0.55 0.00 -1.07 0.00 0.00 179.97 180.17 1wnb h ALA 64 N 0.98 1.53 -0.18 0.04 0.00 -1.12 -1.13 119.26 119.38 1wnb h ALA 64 Ca 0.16 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1wnb h ALA 64 Cb 0.41 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1wnb h ALA 64 CO 0.01 0.37 -0.38 0.93 0.00 0.00 0.00 179.25 180.18 1wnb h GLU 65 N 0.99 0.40 -0.24 0.00 5.08 -0.60 -0.97 114.58 119.24 1wnb h GLU 65 Ca 0.34 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 1wnb h GLU 65 Cb 0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1wnb h GLU 65 CO -0.11 0.72 -0.17 0.00 -1.00 0.00 0.00 179.01 178.45 1wnb h LEU 67 N 0.25 0.74 -1.12 0.00 3.38 -1.02 -1.23 115.31 116.30 1wnb h LEU 67 Ca 0.05 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 1wnb h LEU 67 Cb 0.70 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1wnb h LEU 67 CO 0.05 0.47 -0.01 -0.07 0.09 0.00 0.00 178.44 178.97 1wnb h LEU 68 N 0.87 0.57 -0.24 1.67 3.38 -1.13 -0.60 115.31 119.83 1wnb h LEU 68 Ca 0.35 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 1wnb h LEU 68 Cb 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1wnb h LEU 68 CO -0.18 0.65 0.07 0.50 0.09 0.00 0.00 178.44 179.57 1wnb h LYS 69 N 0.57 0.37 -0.64 1.13 3.11 -0.98 -1.32 116.57 118.82 1wnb h LYS 69 Ca 0.12 -0.08 -0.06 0.00 -2.81 0.00 0.00 60.65 57.81 1wnb h LYS 69 Cb 0.38 -0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 31.53 1wnb h LYS 69 CO 0.01 0.46 0.15 1.25 -2.81 0.00 0.00 179.45 178.51 1wnb h LEU 70 N 0.22 0.97 -1.12 5.20 5.85 -1.11 -1.55 115.31 123.77 1wnb h LEU 70 Ca 0.08 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.60 1wnb h LEU 70 Cb 0.24 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1wnb h LEU 70 CO -0.00 0.96 0.60 0.00 -0.34 0.00 0.00 178.44 179.65 1wnb h ALA 71 N 1.05 1.43 -0.49 1.25 0.00 -0.98 -1.80 119.26 119.72 1wnb h ALA 71 Ca 0.20 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1wnb h ALA 71 Cb 0.37 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1wnb h ALA 71 CO 0.00 0.47 -0.07 -0.44 0.00 0.00 0.00 179.25 179.21 1wnb h ASP 72 N 1.13 0.91 -0.55 0.00 3.32 -0.82 -1.46 116.42 118.94 1wnb h ASP 72 Ca 0.37 -0.34 -0.11 0.00 0.02 0.00 0.00 57.03 56.97 1wnb h ASP 72 Cb 0.05 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1wnb h ASP 72 CO -0.12 1.03 -0.07 0.58 -1.72 0.00 0.00 179.24 178.95 1wnb h VAL 73 N 0.76 1.27 -0.44 -1.35 2.07 -0.91 -1.34 116.25 116.31 1wnb h VAL 73 Ca 0.13 -1.22 -0.07 0.00 0.82 0.00 0.00 66.70 66.36 1wnb h VAL 73 Cb 0.61 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1wnb h VAL 73 CO 0.04 0.43 -0.02 0.40 0.02 0.00 0.00 177.57 178.45 1wnb h ILE 74 N 0.93 1.26 -0.11 4.57 2.04 -1.19 -2.59 117.51 122.43 1wnb h ILE 74 Ca 0.15 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 64.94 1wnb h ILE 74 Cb 0.62 1.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1wnb h ILE 74 CO 0.04 0.37 0.05 -0.08 0.00 0.00 0.00 178.15 178.53 1wnb h GLU 75 N 0.63 0.15 -0.13 2.37 4.81 -1.11 -1.87 114.58 119.42 1wnb h GLU 75 Ca 0.12 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1wnb h GLU 75 Cb 0.52 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1wnb h GLU 75 CO 0.03 0.20 0.16 0.93 -0.73 0.00 0.00 179.01 179.60 1wnb h GLU 76 N 0.06 0.00 -0.29 1.92 5.08 -1.26 -1.44 114.58 118.65 1wnb h GLU 76 Ca 0.04 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 1wnb h GLU 76 Cb 0.10 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.26 1wnb h GLU 76 CO -0.01 0.00 -0.12 0.09 -1.00 0.00 0.00 179.01 177.97 1wnb n ASN 77 N -3.69 2.48 -0.19 1.42 4.13 -0.79 -4.83 115.26 113.78 1wnb n ASN 77 Ca 0.00 -3.72 -0.05 0.00 1.68 0.00 0.00 54.58 52.50 1wnb n ASN 77 Cb 0.27 -0.61 0.05 0.00 -1.54 0.00 0.00 39.78 37.96 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 1.03 0.80 0.92 7.41 0.00 -0.50 -1.99 103.07 110.74 1wnb h GLY 78 Ca 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1wnb h GLY 78 CO 0.32 0.19 0.12 -1.61 0.00 0.00 0.00 176.54 175.56 1wnb h GLN 79 N 0.64 0.48 -0.34 4.80 -0.00 -1.88 -1.80 115.11 117.01 1wnb h GLN 79 Ca 0.23 -0.09 -0.05 0.00 -0.00 0.00 0.00 58.65 58.74 1wnb h GLN 79 Cb 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.45 1wnb h GLN 79 CO -0.12 0.50 0.02 0.28 0.00 0.00 0.00 178.83 179.51 1wnb h VAL 80 N 0.36 1.25 -0.42 2.39 2.07 -1.85 -1.95 116.25 118.10 1wnb h VAL 80 Ca 0.11 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 66.78 1wnb h VAL 80 Cb 0.20 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 1wnb h VAL 80 CO -0.01 0.30 0.08 -0.26 0.02 0.00 0.00 177.57 177.70 1wnb h PHE 81 N 0.40 0.12 -0.72 1.57 0.04 -1.35 -0.80 116.94 116.20 1wnb h PHE 81 Ca 0.10 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.84 1wnb h PHE 81 Cb 0.41 0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 1wnb h PHE 81 CO 0.03 0.00 0.25 0.00 -0.60 0.00 0.00 178.31 177.99 1wnb h ALA 82 N 1.32 1.08 0.13 2.45 0.00 -1.22 0.53 119.26 123.56 1wnb h ALA 82 Ca 0.20 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wnb h ALA 82 Cb 0.25 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1wnb h ALA 82 CO -0.27 0.64 -0.09 0.93 0.00 0.00 0.00 179.25 180.45 1wnb h GLU 83 N 1.06 -0.22 -0.47 0.00 5.08 -0.97 -1.01 114.58 118.06 1wnb h GLU 83 Ca 0.24 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1wnb h GLU 83 Cb 0.26 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1wnb h GLU 83 CO -0.01 -0.14 0.30 -0.07 -1.00 0.00 0.00 179.01 178.09 1wnb h LEU 84 N -0.22 0.55 -0.99 1.33 3.38 -0.84 -0.34 115.31 118.17 1wnb h LEU 84 Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1wnb h LEU 84 Cb 0.20 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1wnb h LEU 84 CO 0.00 0.42 0.49 -0.08 0.09 0.00 0.00 178.44 179.36 1wnb h GLU 85 N 0.64 1.19 -0.15 1.13 4.57 -0.81 -0.55 114.58 120.60 1wnb h GLU 85 Ca 0.17 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1wnb h GLU 85 Cb -0.05 -0.24 -0.00 0.00 -0.16 0.00 0.00 28.75 28.30 1wnb h GLU 85 CO -0.04 0.86 -0.04 1.03 -1.18 0.00 0.00 179.01 179.64 1wnb h SER 86 N 1.20 0.29 -0.77 1.04 0.87 -0.46 -0.06 113.55 115.66 1wnb h SER 86 Ca 0.31 -0.37 -0.04 0.00 -1.23 0.00 0.00 61.79 60.45 1wnb h SER 86 Cb 0.00 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 1wnb h SER 86 CO -0.05 0.60 0.32 0.03 -0.53 0.00 0.00 176.83 177.19 1wnb h ARG 87 N -0.02 1.15 -0.00 2.24 3.08 -0.93 -0.25 114.38 119.65 1wnb h ARG 87 Ca 0.04 -0.20 -0.18 0.00 0.07 0.00 0.00 59.98 59.70 1wnb h ARG 87 Cb 0.47 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1wnb h ARG 87 CO 0.02 0.93 -0.83 -0.97 -1.07 0.00 0.00 179.97 178.04 1wnb h ASN 88 N 1.13 0.17 0.00 7.04 -0.73 -0.89 -3.38 115.58 118.91 1wnb h ASN 88 Ca 0.26 -0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.30 1wnb h ASN 88 Cb 0.20 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 38.74 1wnb h ASN 88 CO -0.02 0.92 -0.06 0.00 -0.37 0.00 0.00 177.43 177.90 1wnb n GLY 90 N 1.08 0.43 3.77 0.00 0.00 -0.11 -4.76 105.19 105.61 1wnb n GLY 90 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1wnb n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wnb s LYS 91 N -1.22 4.16 0.30 1.61 1.02 -1.23 -4.15 119.74 120.23 1wnb s LYS 91 Ca 0.00 2.50 -0.30 0.00 0.02 0.00 0.00 55.97 58.19 1wnb s LYS 91 Cb 0.00 -3.01 -0.12 0.00 -0.52 0.00 0.00 37.83 34.18 1wnb s LYS 91 CO 0.00 -0.50 1.57 -2.30 -0.92 0.00 0.00 175.35 173.20 1wnb n PRO 92 N 1.14 2.65 -0.13 -1.68 -0.02 -1.26 -4.62 135.00 131.08 1wnb n PRO 92 Ca 0.03 0.94 -0.05 0.00 -2.02 0.00 0.00 63.50 62.40 1wnb n PRO 92 Cb 0.39 -2.71 0.03 0.00 -0.02 0.00 0.00 33.50 31.19 1wnb n PRO 92 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wnb h LEU 93 N 4.59 0.20 -0.91 2.45 5.85 -1.36 -2.21 115.31 123.92 1wnb h LEU 93 Ca -0.47 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.31 1wnb h LEU 93 Cb 1.23 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 1wnb h LEU 93 CO 0.78 0.15 0.60 1.12 -0.34 0.00 0.00 178.44 180.75 1wnb h HIS 94 N 0.34 1.13 0.18 1.25 2.07 -1.90 -1.06 115.15 117.16 1wnb h HIS 94 Ca 0.19 0.03 -0.01 0.00 -2.85 0.00 0.00 60.37 57.73 1wnb h HIS 94 Cb 0.16 -0.38 0.00 0.00 2.57 0.00 0.00 27.41 29.76 1wnb h HIS 94 CO -0.14 0.69 -0.09 0.77 -3.07 0.00 0.00 177.93 176.10 1wnb h SER 95 N 1.21 -0.21 -0.94 3.10 0.02 -1.89 -0.16 113.55 114.68 1wnb h SER 95 Ca 0.34 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.29 1wnb h SER 95 Cb -0.10 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 62.45 1wnb h SER 95 CO -0.09 -0.13 0.62 0.00 -1.14 0.00 0.00 176.83 176.10 1wnb h ALA 96 N 0.55 1.20 0.07 3.77 0.00 -0.89 -0.42 119.26 123.54 1wnb h ALA 96 Ca -0.02 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1wnb h ALA 96 Cb 0.21 -0.38 0.02 0.00 0.00 0.00 0.00 17.79 17.63 1wnb h ALA 96 CO 0.04 0.60 -0.76 0.35 0.00 0.00 0.00 179.25 179.48 1wnb h PHE 97 N 1.28 0.64 0.03 0.00 3.57 -1.16 -1.46 116.94 119.84 1wnb h PHE 97 Ca 0.35 -0.40 -0.22 0.00 3.53 0.00 0.00 57.97 61.23 1wnb h PHE 97 Cb -0.14 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 1wnb h PHE 97 CO -0.00 1.25 -1.01 -0.91 -2.23 0.00 0.00 178.31 175.41 1wnb h ASN 98 N -0.15 0.15 0.00 0.41 2.35 -1.01 -3.36 115.58 113.97 1wnb h ASN 98 Ca -0.11 -0.15 -0.17 0.00 -0.55 0.00 0.00 56.30 55.31 1wnb h ASN 98 Cb 1.51 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 39.81 1wnb h ASN 98 CO 0.15 1.06 -1.56 0.47 -1.65 0.00 0.00 177.43 175.90 1wnb n ASP 99 N -3.48 1.94 -0.03 5.81 8.00 -0.17 -4.67 116.55 123.95 1wnb n ASP 99 Ca -0.03 0.34 -0.13 0.00 0.71 0.00 0.00 54.79 55.69 1wnb n ASP 99 Cb 0.91 -0.78 -0.11 0.00 -0.02 0.00 0.00 41.12 41.13 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 0.07 -1.24 5.08 -1.35 -3.22 114.58 112.89 1wnb h GLU 100 Ca -0.26 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1wnb h GLU 100 Cb 1.22 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 1wnb h GLU 100 CO -0.16 0.65 -0.25 0.82 -1.00 0.00 0.00 179.01 179.08 1wnb h ILE 101 N -0.78 0.45 -0.98 3.13 1.08 -1.44 -1.04 117.51 117.92 1wnb h ILE 101 Ca -0.00 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 1wnb h ILE 101 Cb 0.70 0.45 -0.07 0.00 -3.07 0.00 0.00 36.82 34.83 1wnb h ILE 101 CO 0.01 0.00 0.63 -0.65 -0.69 0.00 0.00 178.15 177.44 1wnb h PRO 102 N -0.42 1.05 -0.30 2.37 0.11 -1.76 -1.98 132.00 131.06 1wnb h PRO 102 Ca 0.04 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.00 1wnb h PRO 102 Cb 0.47 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 1wnb h PRO 102 CO -0.17 0.70 -0.19 0.00 -0.21 0.00 0.00 178.00 178.13 1wnb h ALA 103 N 1.48 1.11 -0.17 -0.75 0.00 -1.50 -2.05 119.26 117.38 1wnb h ALA 103 Ca 0.45 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1wnb h ALA 103 Cb 0.28 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1wnb h ALA 103 CO -0.21 0.55 -0.12 0.82 0.00 0.00 0.00 179.25 180.29 1wnb h ILE 104 N 0.50 1.33 -0.66 0.00 2.04 -0.76 -1.95 117.51 118.00 1wnb h ILE 104 Ca 0.08 -1.24 0.08 0.00 1.00 0.00 0.00 64.86 64.78 1wnb h ILE 104 Cb 0.61 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 1wnb h ILE 104 CO 0.04 0.37 0.34 0.58 0.00 0.00 0.00 178.15 179.48 1wnb h VAL 105 N 0.04 0.90 -0.07 1.67 2.07 -1.29 -2.25 116.25 117.31 1wnb h VAL 105 Ca 0.03 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 1wnb h VAL 105 Cb 0.63 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1wnb h VAL 105 CO 0.03 0.11 -0.23 -0.78 0.02 0.00 0.00 177.57 176.72 1wnb h ASP 106 N 0.60 0.11 -0.44 0.57 -0.00 -1.27 -1.81 116.42 114.19 1wnb h ASP 106 Ca 0.31 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.03 57.29 1wnb h ASP 106 Cb 0.28 -0.03 -0.02 0.00 -0.00 0.00 0.00 39.33 39.56 1wnb h ASP 106 CO -0.23 0.35 0.18 0.58 -0.00 0.00 0.00 179.24 180.12 1wnb h VAL 107 N 0.10 1.20 -0.21 2.25 2.07 -0.74 0.38 116.25 121.29 1wnb h VAL 107 Ca 0.02 -0.60 -0.06 0.00 0.82 0.00 0.00 66.70 66.89 1wnb h VAL 107 Cb 0.47 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1wnb h VAL 107 CO 0.03 0.22 -0.09 -0.26 0.02 0.00 0.00 177.57 177.50 1wnb h PHE 108 N 0.56 0.50 -0.59 1.57 -1.00 -1.25 -0.34 116.94 116.40 1wnb h PHE 108 Ca 0.15 -0.12 0.01 0.00 2.81 0.00 0.00 57.97 60.82 1wnb h PHE 108 Cb 0.17 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 39.59 1wnb h PHE 108 CO -0.00 0.70 0.39 0.00 -1.61 0.00 0.00 178.31 177.79 1wnb h ARG 109 N 0.14 0.77 -0.28 1.51 3.08 -1.23 0.06 114.38 118.42 1wnb h ARG 109 Ca 0.05 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.10 1wnb h ARG 109 Cb 0.56 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 1wnb h ARG 109 CO 0.03 0.51 0.04 0.35 -1.07 0.00 0.00 179.97 179.83 1wnb h PHE 110 N 0.79 0.07 -0.09 3.04 3.57 -0.02 -2.64 116.94 121.66 1wnb h PHE 110 Ca 0.22 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.60 1wnb h PHE 110 Cb -0.09 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1wnb h PHE 110 CO -0.03 0.00 -0.56 0.74 -2.23 0.00 0.00 178.31 176.23 1wnb h PHE 111 N 0.14 0.32 -0.27 0.41 -1.00 -0.62 -0.39 116.94 115.53 1wnb h PHE 111 Ca 0.13 -0.11 0.07 0.00 2.81 0.00 0.00 57.97 60.86 1wnb h PHE 111 Cb 0.15 -0.06 -0.07 0.00 3.61 0.00 0.00 35.95 39.58 1wnb h PHE 111 CO -0.18 0.75 -0.23 0.00 -1.61 0.00 0.00 178.31 177.04 1wnb h ALA 112 N 1.22 -0.09 -0.26 2.45 0.00 -0.92 0.87 119.26 122.53 1wnb h ALA 112 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1wnb h ALA 112 Cb 1.04 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1wnb h ALA 112 CO 0.09 -0.65 -0.09 0.78 0.00 0.00 0.00 179.25 179.38 1wnb h GLY 113 N -0.23 0.57 1.80 0.00 0.00 -1.06 -3.06 103.07 101.09 1wnb h GLY 113 Ca 0.15 -0.48 0.02 0.00 0.00 0.00 0.00 47.33 47.01 1wnb h GLY 113 CO -0.40 0.44 0.08 0.00 0.00 0.00 0.00 176.54 176.66 1wnb h ALA 114 N 0.76 1.59 0.00 3.60 0.00 -0.85 -2.15 119.26 122.21 1wnb h ALA 114 Ca 0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1wnb h ALA 114 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1wnb h ALA 114 CO 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 179.25 179.15 1wnb h ALA 115 N 1.90 1.17 -0.23 0.00 0.00 -0.72 -2.29 119.26 119.10 1wnb h ALA 115 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1wnb h ALA 115 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1wnb h ALA 115 CO -0.00 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.81 1wnb n ARG 116 N -3.35 1.90 -0.59 0.00 1.74 -0.81 -4.57 116.66 110.98 1wnb n ARG 116 Ca -0.02 -1.80 0.06 0.00 -0.77 0.00 0.00 57.85 55.31 1wnb n ARG 116 Cb 0.12 -1.33 0.19 0.00 -1.02 0.00 0.00 32.46 30.41 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 -2.99 4.28 0.71 0.00 1.43 -1.26 -5.01 118.68 115.85 1wnb s LEU 118 Ca 0.37 2.00 -0.12 0.00 -1.03 0.00 0.00 54.13 55.34 1wnb s LEU 118 Cb 0.36 -3.55 0.03 0.00 0.03 0.00 0.00 46.19 43.05 1wnb s LEU 118 CO -0.06 -0.76 1.09 0.20 0.23 0.00 0.00 176.35 177.04 1wnb s ASN 119 N 2.19 4.90 0.00 2.29 0.01 -1.26 -5.08 114.94 117.98 1wnb s ASN 119 Ca 0.63 1.86 0.00 0.00 -0.71 0.00 0.00 52.86 54.64 1wnb s ASN 119 Cb -0.29 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 38.84 1wnb s ASN 119 CO 0.24 -1.77 0.00 0.61 -1.51 0.00 0.00 177.10 174.66 1wnb n GLY 120 N -1.05 3.55 3.90 0.66 0.00 -1.26 -4.98 105.19 106.01 1wnb n GLY 120 Ca 0.09 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1wnb n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wnb s LEU 121 N 0.00 4.28 0.02 0.99 1.43 -1.26 -5.06 118.68 119.09 1wnb s LEU 121 Ca 0.00 0.56 -0.34 0.00 -1.03 0.00 0.00 54.13 53.31 1wnb s LEU 121 Cb 0.00 -3.24 -0.13 0.00 0.03 0.00 0.00 46.19 42.85 1wnb s LEU 121 CO 0.00 0.08 1.72 0.00 0.23 0.00 0.00 176.35 178.37 1wnb n ALA 122 N 0.17 0.97 -1.77 4.21 0.00 -1.26 -4.50 120.51 118.34 1wnb n ALA 122 Ca -0.03 0.37 -0.39 0.00 0.00 0.00 0.00 53.44 53.39 1wnb n ALA 122 Cb 0.52 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.55 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 2.48 3.25 0.00 0.00 0.00 -1.26 -4.91 121.76 121.32 1wnb s ALA 123 Ca 0.86 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.92 1wnb s ALA 123 Cb -0.71 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 18.98 1wnb s ALA 123 CO 0.46 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1wnb n GLY 124 N 0.71 -0.90 3.36 0.00 0.00 -0.16 -4.98 105.19 103.23 1wnb n GLY 124 Ca 0.03 -1.08 -0.46 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.61 3.47 0.12 1.61 8.01 -1.26 -0.71 118.70 128.33 1wnb s GLU 125 Ca 0.00 -2.08 0.26 0.00 0.01 0.00 0.00 54.97 53.16 1wnb s GLU 125 Cb 0.00 -4.51 0.63 0.00 -4.31 0.00 0.00 34.13 25.95 1wnb s GLU 125 CO 0.00 -1.44 1.56 0.66 0.01 0.00 0.00 175.26 176.05 1wnb n TYR 126 N 5.01 0.54 -3.96 1.61 4.02 -1.26 -4.58 117.16 118.55 1wnb n TYR 126 Ca 0.11 0.16 -0.19 0.00 -0.01 0.00 0.00 57.90 57.96 1wnb n TYR 126 Cb 0.46 -0.68 -0.17 0.00 -0.02 0.00 0.00 39.34 38.94 1wnb n TYR 126 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1wnb s LEU 127 N -4.02 1.06 0.13 7.72 2.96 -1.26 -5.10 118.68 120.18 1wnb s LEU 127 Ca 0.09 -0.06 -0.35 0.00 -0.22 0.00 0.00 54.13 53.59 1wnb s LEU 127 Cb 0.14 -0.33 -0.16 0.00 0.50 0.00 0.00 46.19 46.35 1wnb s LEU 127 CO 0.65 -0.11 1.33 -0.62 -1.32 0.00 0.00 176.35 176.28 1wnb n GLU 128 N 4.35 1.37 -1.17 1.98 4.71 -1.26 -1.71 120.64 128.91 1wnb n GLU 128 Ca -0.21 0.49 -0.06 0.00 -0.01 0.00 0.00 57.16 57.37 1wnb n GLU 128 Cb 0.50 -2.11 -0.03 0.00 -1.01 0.00 0.00 31.44 28.80 1wnb n GLU 128 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1wnb n GLY 129 N 2.47 0.83 2.83 0.62 0.00 -1.26 -4.99 105.19 105.69 1wnb n GLY 129 Ca 0.17 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 1wnb n GLY 129 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wnb s HIS 130 N -2.21 0.53 -0.27 1.61 3.76 -0.69 -0.75 115.29 117.27 1wnb s HIS 130 Ca 0.00 -0.10 -0.14 0.00 -0.15 0.00 0.00 55.06 54.67 1wnb s HIS 130 Cb 0.00 -0.58 -0.04 0.00 1.11 0.00 0.00 32.58 33.07 1wnb s HIS 130 CO 0.00 -0.19 0.34 0.99 -0.85 0.00 0.00 174.74 175.03 1wnb s THR 131 N 1.19 5.20 -0.15 1.30 2.01 -0.20 -3.98 115.64 121.01 1wnb s THR 131 Ca -0.07 0.51 -0.07 0.00 0.31 0.00 0.00 61.69 62.36 1wnb s THR 131 Cb -0.14 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 1wnb s THR 131 CO -0.02 0.18 0.11 -0.44 -0.69 0.00 0.00 174.62 173.76 1wnb s SER 132 N 1.63 6.12 0.17 3.53 0.01 0.11 -0.32 113.70 124.95 1wnb s SER 132 Ca 0.14 0.32 0.07 0.00 1.31 0.00 0.00 55.95 57.78 1wnb s SER 132 Cb -0.16 -2.00 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 1wnb s SER 132 CO 0.10 0.31 -0.15 0.00 0.41 0.00 0.00 173.24 173.91 1wnb s MET 133 N -0.42 1.20 -0.15 12.44 0.23 -0.23 -0.99 119.30 131.37 1wnb s MET 133 Ca 0.11 -1.44 -0.01 0.00 -1.03 0.00 0.00 55.69 53.33 1wnb s MET 133 Cb -0.12 -1.04 -0.01 0.00 -1.53 0.00 0.00 34.83 32.13 1wnb s MET 133 CO 0.02 0.19 -0.13 0.42 -2.03 0.00 0.00 175.02 173.48 1wnb s ILE 134 N -2.60 2.94 0.44 3.16 -1.09 -1.26 -1.37 121.20 121.42 1wnb s ILE 134 Ca 0.17 -0.68 0.07 0.00 -2.23 0.00 0.00 60.65 57.98 1wnb s ILE 134 Cb -0.02 -2.25 -0.02 0.00 -1.58 0.00 0.00 42.46 38.59 1wnb s ILE 134 CO 0.05 0.51 0.34 -0.13 -1.23 0.00 0.00 174.94 174.48 1wnb s ARG 135 N 0.70 2.41 -0.33 2.79 0.52 0.03 -4.74 118.95 120.33 1wnb s ARG 135 Ca -0.06 -1.69 -0.01 0.00 -0.52 0.00 0.00 55.73 53.45 1wnb s ARG 135 Cb -0.15 -2.24 0.12 0.00 0.52 0.00 0.00 34.95 33.19 1wnb s ARG 135 CO 0.02 -0.26 0.16 1.03 0.02 0.00 0.00 175.30 176.27 1wnb s ARG 136 N -4.11 0.56 0.22 3.54 0.52 -1.26 -1.21 118.95 117.21 1wnb s ARG 136 Ca 0.44 -1.08 0.06 0.00 -0.52 0.00 0.00 55.73 54.63 1wnb s ARG 136 Cb -0.01 -1.55 -0.04 0.00 0.52 0.00 0.00 34.95 33.87 1wnb s ARG 136 CO 0.26 -1.09 0.20 -0.51 0.02 0.00 0.00 175.30 174.18 1wnb s ASP 137 N 1.46 5.64 0.83 0.23 1.01 -0.66 -4.86 116.67 120.32 1wnb s ASP 137 Ca 0.13 -0.17 -0.11 0.00 0.71 0.00 0.00 52.55 53.11 1wnb s ASP 137 Cb -0.19 -1.48 0.09 0.00 1.01 0.00 0.00 42.92 42.34 1wnb s ASP 137 CO -0.18 -0.01 1.09 -2.16 0.21 0.00 0.00 175.17 174.12 1wnb s PRO 138 N -3.62 1.79 -0.00 8.23 0.04 -1.24 -0.05 135.00 140.14 1wnb s PRO 138 Ca 0.32 0.88 0.04 0.00 0.04 0.00 0.00 61.00 62.28 1wnb s PRO 138 Cb -0.09 -1.87 -0.25 0.00 0.04 0.00 0.00 34.50 32.34 1wnb s PRO 138 CO 0.25 -1.89 0.82 -0.07 0.04 0.00 0.00 177.00 176.15 1wnb h LEU 139 N -1.29 0.19 0.00 -3.56 3.38 -1.87 -3.42 115.31 108.73 1wnb h LEU 139 Ca -0.47 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1wnb h LEU 139 Cb 1.26 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1wnb h LEU 139 CO 0.55 1.26 0.00 0.61 0.09 0.00 0.00 178.44 180.95 1wnb n GLY 140 N 1.60 0.14 3.65 0.83 0.00 -1.26 -4.89 105.19 105.26 1wnb n GLY 140 Ca -0.15 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 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 4.99 -0.22 1.61 1.01 -1.26 -2.36 120.40 124.18 1wnb s VAL 141 Ca 0.00 1.20 -0.09 0.00 0.00 0.00 0.00 61.98 63.09 1wnb s VAL 141 Cb 0.00 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 1wnb s VAL 141 CO 0.00 0.07 0.12 -0.69 0.00 0.00 0.00 175.10 174.60 1wnb s VAL 142 N 2.18 5.19 -0.30 2.92 1.01 -0.37 -0.50 120.40 130.53 1wnb s VAL 142 Ca 0.28 0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 1wnb s VAL 142 Cb -0.16 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 1wnb s VAL 142 CO 0.10 0.40 0.54 0.00 0.00 0.00 0.00 175.10 176.14 1wnb s ALA 143 N 0.72 3.54 -0.14 5.51 0.00 -0.40 -1.43 121.76 129.57 1wnb s ALA 143 Ca 0.07 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.29 1wnb s ALA 143 Cb -0.13 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 1wnb s ALA 143 CO 0.02 -0.96 -0.10 -1.12 0.00 0.00 0.00 175.76 173.59 1wnb s SER 144 N 1.64 4.20 -0.27 0.00 0.01 -0.22 -1.41 113.70 117.64 1wnb s SER 144 Ca 0.22 -0.29 -0.02 0.00 1.31 0.00 0.00 55.95 57.17 1wnb s SER 144 Cb -0.15 -1.66 0.03 0.00 0.21 0.00 0.00 66.02 64.45 1wnb s SER 144 CO 0.11 0.16 -0.03 -0.63 0.41 0.00 0.00 173.24 173.26 1wnb s ILE 145 N 0.42 3.00 -0.00 1.44 -1.09 -0.21 0.58 121.20 125.34 1wnb s ILE 145 Ca -0.08 -1.13 -0.02 0.00 -2.23 0.00 0.00 60.65 57.18 1wnb s ILE 145 Cb -0.15 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.08 1wnb s ILE 145 CO 0.04 0.08 0.17 0.00 -1.23 0.00 0.00 174.94 174.00 1wnb s ALA 146 N 1.31 3.93 0.72 9.38 0.00 -0.43 -2.30 121.76 134.37 1wnb s ALA 146 Ca -0.02 -0.78 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 1wnb s ALA 146 Cb -0.18 -1.85 0.11 0.00 0.00 0.00 0.00 23.12 21.20 1wnb s ALA 146 CO -0.03 0.75 1.01 -1.25 0.00 0.00 0.00 175.76 176.24 1wnb s PRO 147 N -1.96 1.80 0.04 0.00 0.04 -1.20 -2.67 135.00 131.04 1wnb s PRO 147 Ca 0.27 -0.74 0.25 0.00 0.04 0.00 0.00 61.00 60.83 1wnb s PRO 147 Cb -0.13 -2.24 0.58 0.00 0.04 0.00 0.00 34.50 32.76 1wnb s PRO 147 CO 0.19 -1.42 1.48 -2.67 0.04 0.00 0.00 177.00 174.62 1wnb n TRP 148 N -2.91 0.17 -0.04 0.56 4.27 -1.26 -4.04 117.44 114.18 1wnb n TRP 148 Ca 0.12 0.05 -0.14 0.00 -3.89 0.00 0.00 57.50 53.64 1wnb n TRP 148 Cb 0.60 -0.41 -0.09 0.00 -1.36 0.00 0.00 31.31 30.05 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 0.37 -2.75 -0.67 -1.07 -1.96 -3.39 115.58 106.11 1wnb h ASN 149 Ca 0.00 -0.61 -0.61 0.00 0.07 0.00 0.00 56.30 55.16 1wnb h ASN 149 Cb 0.57 -0.11 -0.40 0.00 -2.07 0.00 0.00 38.32 36.31 1wnb h ASN 149 CO 0.00 0.91 -0.75 -1.22 0.07 0.00 0.00 177.43 176.44 1wnb n TYR 150 N -4.48 1.46 0.36 4.14 4.01 -1.26 -5.04 117.16 116.35 1wnb n TYR 150 Ca -0.08 -3.88 -0.19 0.00 -0.16 0.00 0.00 57.90 53.59 1wnb n TYR 150 Cb 0.46 -0.24 -0.10 0.00 -0.31 0.00 0.00 39.34 39.14 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 5.45 -1.07 0.12 -0.72 0.11 -1.76 -0.68 132.00 133.45 1wnb h PRO 151 Ca 0.20 0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.38 1wnb h PRO 151 Cb 0.82 0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1wnb h PRO 151 CO 0.57 -0.71 -0.06 1.25 -0.21 0.00 0.00 178.00 178.84 1wnb h LEU 152 N -1.11 -0.13 -1.27 2.35 6.46 -1.92 -1.66 115.31 118.03 1wnb h LEU 152 Ca -0.08 -0.16 0.11 0.00 -0.12 0.00 0.00 57.88 57.63 1wnb h LEU 152 Cb 0.92 0.03 -0.06 0.00 -0.73 0.00 0.00 40.66 40.82 1wnb h LEU 152 CO 0.02 0.08 0.56 -0.03 -0.62 0.00 0.00 178.44 178.45 1wnb h MET 153 N -0.35 0.75 0.00 1.25 4.05 -1.93 0.21 114.93 118.92 1wnb h MET 153 Ca -0.02 -0.05 -0.16 0.00 -0.28 0.00 0.00 59.70 59.20 1wnb h MET 153 Cb 0.28 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 1wnb h MET 153 CO 0.03 0.50 -0.76 0.52 0.23 0.00 0.00 176.91 177.43 1wnb h MET 154 N 0.77 0.00 -0.41 0.39 2.86 -0.96 -0.66 114.93 116.93 1wnb h MET 154 Ca 0.41 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.97 1wnb h MET 154 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1wnb h MET 154 CO -0.18 0.76 -0.08 0.00 1.06 0.00 0.00 176.91 178.47 1wnb h ALA 155 N 1.24 0.56 -0.76 6.32 0.00 -0.30 -1.80 119.26 124.51 1wnb h ALA 155 Ca -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1wnb h ALA 155 Cb 1.50 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1wnb h ALA 155 CO 0.10 0.42 0.35 0.00 0.00 0.00 0.00 179.25 180.12 1wnb h ALA 156 N 0.85 0.99 -0.09 0.00 0.00 -0.80 0.36 119.26 120.56 1wnb h ALA 156 Ca 0.11 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1wnb h ALA 156 Cb 0.61 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1wnb h ALA 156 CO 0.04 0.57 -0.11 -1.49 0.00 0.00 0.00 179.25 178.26 1wnb h TRP 157 N 1.09 0.15 0.10 0.00 4.06 -0.85 -1.70 115.95 118.79 1wnb h TRP 157 Ca 0.26 -0.01 -0.27 0.00 2.06 0.00 0.00 58.89 60.93 1wnb h TRP 157 Cb 0.15 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.26 1wnb h TRP 157 CO 0.01 0.26 -1.41 0.87 -3.56 0.00 0.00 178.44 174.61 1wnb h LYS 158 N 0.14 0.22 0.24 0.49 1.57 -0.99 -3.39 116.57 114.85 1wnb h LYS 158 Ca 0.03 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.43 1wnb h LYS 158 Cb 0.29 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1wnb h LYS 158 CO 0.02 1.18 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.89 1wnb h LEU 159 N -0.36 -0.27 0.08 2.94 3.38 -0.20 -3.21 115.31 117.67 1wnb h LEU 159 Ca -0.31 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.54 1wnb h LEU 159 Cb 1.72 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 42.50 1wnb h LEU 159 CO 0.03 -0.00 -0.27 0.00 0.09 0.00 0.00 178.44 178.29 1wnb h ALA 160 N 0.16 -0.43 -0.50 1.53 0.00 -1.52 -1.64 119.26 116.86 1wnb h ALA 160 Ca -0.03 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1wnb h ALA 160 Cb 0.40 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1wnb h ALA 160 CO 0.05 -0.80 -0.09 -1.00 0.00 0.00 0.00 179.25 177.42 1wnb h PRO 161 N -0.46 0.94 -0.53 0.00 0.13 -1.75 -1.65 132.00 128.70 1wnb h PRO 161 Ca 0.04 -0.35 0.02 0.00 -0.87 0.00 0.00 66.00 64.84 1wnb h PRO 161 Cb 0.50 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.54 1wnb h PRO 161 CO -0.18 1.01 0.33 0.00 -0.23 0.00 0.00 178.00 178.92 1wnb h ALA 162 N 0.91 0.67 -0.11 -0.56 0.00 -1.51 -0.93 119.26 117.73 1wnb h ALA 162 Ca 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1wnb h ALA 162 Cb 0.64 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1wnb h ALA 162 CO 0.04 0.05 -0.01 -0.07 0.00 0.00 0.00 179.25 179.26 1wnb h LEU 163 N 0.65 0.20 -1.93 0.00 3.38 -1.34 -1.33 115.31 114.95 1wnb h LEU 163 Ca 0.21 -0.34 0.10 0.00 0.09 0.00 0.00 57.88 57.94 1wnb h LEU 163 Cb -0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1wnb h LEU 163 CO -0.08 0.49 0.29 0.00 0.09 0.00 0.00 178.44 179.23 1wnb h ALA 164 N 0.72 2.28 -0.00 1.53 0.00 -1.13 -0.20 119.26 122.46 1wnb h ALA 164 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1wnb h ALA 164 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1wnb h ALA 164 CO 0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 179.25 178.85 1wnb n ALA 165 N -2.59 2.43 -0.34 0.00 0.00 -0.37 -4.81 120.51 114.83 1wnb n ALA 165 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1wnb n ALA 165 Cb 0.43 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1wnb n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wnb n GLY 166 N 1.44 0.81 3.91 0.00 0.00 -0.08 -3.71 105.19 107.56 1wnb n GLY 166 Ca 0.09 -0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.18 6.38 0.28 1.61 -0.87 -0.51 -3.78 114.94 115.87 1wnb s ASN 167 Ca 0.00 0.69 -0.07 0.00 -1.57 0.00 0.00 52.86 51.91 1wnb s ASN 167 Cb 0.00 -2.14 -0.06 0.00 -0.02 0.00 0.00 41.25 39.03 1wnb s ASN 167 CO 0.00 -0.29 0.58 0.00 -2.57 0.00 0.00 177.10 174.81 1wnb s VAL 169 N -2.04 1.04 -0.25 0.00 1.01 0.24 -1.24 120.40 119.17 1wnb s VAL 169 Ca 0.46 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1wnb s VAL 169 Cb -0.11 -0.88 0.06 0.00 0.00 0.00 0.00 36.38 35.45 1wnb s VAL 169 CO 0.27 0.24 -0.06 -0.69 0.00 0.00 0.00 175.10 174.86 1wnb s VAL 170 N -0.41 1.73 -0.21 2.92 1.01 -0.51 -0.78 120.40 124.14 1wnb s VAL 170 Ca 0.04 -1.39 -0.11 0.00 0.00 0.00 0.00 61.98 60.52 1wnb s VAL 170 Cb -0.06 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 1wnb s VAL 170 CO -0.00 -0.12 0.16 -0.22 0.00 0.00 0.00 175.10 174.92 1wnb s LEU 171 N 1.29 4.17 -0.34 3.92 2.96 0.31 -1.06 118.68 129.93 1wnb s LEU 171 Ca -0.06 0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 53.97 1wnb s LEU 171 Cb -0.19 -2.13 0.02 0.00 0.50 0.00 0.00 46.19 44.39 1wnb s LEU 171 CO -0.06 0.12 0.14 -0.75 -1.32 0.00 0.00 176.35 174.48 1wnb s LYS 172 N 0.70 2.86 1.02 1.98 2.20 0.20 -1.61 119.74 127.09 1wnb s LYS 172 Ca 0.09 -1.03 -0.12 0.00 -0.36 0.00 0.00 55.97 54.54 1wnb s LYS 172 Cb -0.12 -3.55 0.20 0.00 -1.51 0.00 0.00 37.83 32.84 1wnb s LYS 172 CO 0.01 -0.61 1.08 -2.14 -0.36 0.00 0.00 175.35 173.33 1wnb s PRO 173 N 1.50 0.26 0.31 4.03 0.02 -1.26 -1.31 135.00 138.55 1wnb s PRO 173 Ca 0.01 0.68 -0.29 0.00 0.02 0.00 0.00 61.00 61.43 1wnb s PRO 173 Cb -0.19 -1.70 -0.10 0.00 0.02 0.00 0.00 34.50 32.53 1wnb s PRO 173 CO 0.05 -2.89 1.37 0.45 -0.33 0.00 0.00 177.00 175.65 1wnb s SER 174 N -3.20 6.67 0.21 2.53 0.15 -1.09 -4.61 113.70 114.36 1wnb s SER 174 Ca 0.66 2.74 0.16 0.00 0.70 0.00 0.00 55.95 60.20 1wnb s SER 174 Cb -0.20 -2.64 0.80 0.00 -1.71 0.00 0.00 66.02 62.27 1wnb s SER 174 CO 0.59 -0.64 1.48 -1.84 1.20 0.00 0.00 173.24 174.04 1wnb n GLU 175 N 1.22 0.10 0.11 5.44 0.00 -1.25 -2.17 120.64 124.08 1wnb n GLU 175 Ca 0.02 0.55 -0.21 0.00 0.00 0.00 0.00 57.16 57.52 1wnb n GLU 175 Cb 0.41 -1.80 -0.15 0.00 0.00 0.00 0.00 31.44 29.90 1wnb n GLU 175 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1wnb h ILE 176 N 0.00 1.23 -2.05 3.84 1.08 -1.91 -3.42 117.51 116.28 1wnb h ILE 176 Ca 0.00 -2.76 -0.56 0.00 -0.39 0.00 0.00 64.86 61.15 1wnb h ILE 176 Cb 0.07 2.91 -0.40 0.00 -3.07 0.00 0.00 36.82 36.33 1wnb h ILE 176 CO 0.00 0.84 -1.01 0.35 -0.69 0.00 0.00 178.15 177.64 1wnb n THR 177 N -3.59 0.07 1.11 -0.27 -2.24 -0.92 -4.54 114.28 103.89 1wnb n THR 177 Ca -0.17 -4.36 0.12 0.00 -2.27 0.00 0.00 64.05 57.37 1wnb n THR 177 Cb 1.07 -1.77 0.22 0.00 -2.10 0.00 0.00 70.33 67.75 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 1.12 0.63 -0.12 -0.78 -0.04 -1.19 -4.44 135.00 130.18 1wnb n PRO 178 Ca 0.23 -0.43 -0.09 0.00 -0.04 0.00 0.00 63.50 63.17 1wnb n PRO 178 Cb 0.52 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1wnb n PRO 178 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1wnb h LEU 179 N 1.04 0.48 -0.63 1.53 3.38 -1.91 -0.35 115.31 118.86 1wnb h LEU 179 Ca 0.00 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 1wnb h LEU 179 Cb 0.55 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1wnb h LEU 179 CO 0.00 0.52 -0.60 0.71 0.09 0.00 0.00 178.44 179.16 1wnb h THR 180 N 0.42 1.37 -0.58 0.22 1.35 -1.88 -0.72 112.91 113.10 1wnb h THR 180 Ca 0.12 -1.95 0.04 0.00 -0.55 0.00 0.00 66.41 64.06 1wnb h THR 180 Cb 0.19 1.97 -0.04 0.00 -1.73 0.00 0.00 68.15 68.53 1wnb h THR 180 CO -0.01 0.58 0.33 0.00 -0.25 0.00 0.00 175.52 176.17 1wnb h ALA 181 N 1.15 0.75 0.00 6.62 0.00 -1.73 -0.47 119.26 125.58 1wnb h ALA 181 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1wnb h ALA 181 Cb 1.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1wnb h ALA 181 CO 0.10 0.03 -0.44 -0.07 0.00 0.00 0.00 179.25 178.86 1wnb h LEU 182 N 0.64 0.00 -0.31 0.00 3.38 -0.84 -1.27 115.31 116.91 1wnb h LEU 182 Ca 0.24 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 1wnb h LEU 182 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1wnb h LEU 182 CO -0.13 0.41 -0.00 0.50 0.09 0.00 0.00 178.44 179.31 1wnb h LYS 183 N 0.00 0.55 -0.73 1.13 1.63 -1.01 -2.75 116.57 115.38 1wnb h LYS 183 Ca -0.01 -0.18 0.09 0.00 -0.85 0.00 0.00 60.65 59.71 1wnb h LYS 183 Cb 1.32 -0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 32.83 1wnb h LYS 183 CO 0.05 0.69 0.38 1.25 -3.45 0.00 0.00 179.45 178.37 1wnb h LEU 184 N 0.35 0.51 -0.37 5.20 5.85 -0.90 -0.63 115.31 125.32 1wnb h LEU 184 Ca 0.09 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1wnb h LEU 184 Cb 0.44 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 1wnb h LEU 184 CO 0.02 0.29 -0.02 0.00 -0.34 0.00 0.00 178.44 178.39 1wnb h ALA 185 N 1.43 0.31 0.48 1.25 0.00 -1.21 0.58 119.26 122.10 1wnb h ALA 185 Ca 0.36 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.36 1wnb h ALA 185 Cb 0.36 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1wnb h ALA 185 CO -0.26 -0.41 -0.23 1.49 0.00 0.00 0.00 179.25 179.84 1wnb h GLU 186 N 0.07 -0.62 -0.15 0.00 4.81 -1.11 -2.25 114.58 115.34 1wnb h GLU 186 Ca 0.18 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 1wnb h GLU 186 Cb 0.26 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1wnb h GLU 186 CO -0.32 -0.38 -0.16 -0.07 -0.73 0.00 0.00 179.01 177.35 1wnb h LEU 187 N -0.71 0.24 -0.31 1.64 3.38 -0.68 -3.16 115.31 115.71 1wnb h LEU 187 Ca -0.07 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1wnb h LEU 187 Cb 0.53 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1wnb h LEU 187 CO 0.11 0.43 -0.44 0.00 0.09 0.00 0.00 178.44 178.62 1wnb n ALA 188 N -2.49 3.47 -0.25 1.53 0.00 0.20 -4.66 120.51 118.30 1wnb n ALA 188 Ca -0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 53.44 53.00 1wnb n ALA 188 Cb 0.30 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 18.71 1wnb n ALA 188 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1wnb n LYS 189 N -0.99 -0.16 -0.16 0.00 4.81 -0.85 -1.18 118.16 119.63 1wnb n LYS 189 Ca 0.09 1.01 0.12 0.00 -0.87 0.00 0.00 58.31 58.65 1wnb n LYS 189 Cb 0.35 -1.49 0.19 0.00 0.02 0.00 0.00 35.03 34.10 1wnb n LYS 189 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1wnb n ASP 190 N -4.95 3.36 0.00 3.14 8.00 -1.26 -4.57 116.55 120.26 1wnb n ASP 190 Ca 0.06 -1.98 -0.18 0.00 0.71 0.00 0.00 54.79 53.40 1wnb n ASP 190 Cb 0.26 -0.21 -0.09 0.00 -0.02 0.00 0.00 41.12 41.05 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 4.38 1.31 -2.54 0.53 2.04 -1.46 -3.44 117.51 118.33 1wnb h ILE 191 Ca 0.00 -2.06 -0.54 0.00 1.00 0.00 0.00 64.86 63.26 1wnb h ILE 191 Cb 0.97 2.26 -0.04 0.00 -0.74 0.00 0.00 36.82 39.27 1wnb h ILE 191 CO 0.00 0.64 -0.50 -0.36 0.00 0.00 0.00 178.15 177.92 1wnb s PHE 192 N -3.50 3.33 0.76 1.37 0.40 -1.26 -4.92 117.98 114.16 1wnb s PHE 192 Ca -0.11 0.03 -0.15 0.00 -0.60 0.00 0.00 56.93 56.10 1wnb s PHE 192 Cb 0.07 -1.58 0.02 0.00 0.51 0.00 0.00 43.02 42.04 1wnb s PHE 192 CO 0.89 0.51 0.92 -2.30 0.70 0.00 0.00 175.22 175.94 1wnb n PRO 193 N -0.63 0.34 -1.68 0.24 -0.02 -1.26 -4.87 135.00 127.13 1wnb n PRO 193 Ca -0.08 0.18 -0.49 0.00 -2.02 0.00 0.00 63.50 61.09 1wnb n PRO 193 Cb 0.55 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.78 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 -2.76 0.72 0.00 3.55 0.00 -1.26 -1.77 120.51 118.99 1wnb n ALA 194 Ca 0.12 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1wnb n ALA 194 Cb 0.50 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.55 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 4.03 1.43 0.18 0.00 0.00 -1.26 -4.65 105.19 104.92 1wnb n GLY 195 Ca 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.14 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 1.37 -4.10 1.61 2.07 -1.64 -3.17 116.25 112.39 1wnb h VAL 196 Ca 0.00 -2.07 -0.64 0.00 0.82 0.00 0.00 66.70 64.81 1wnb h VAL 196 Cb 0.00 2.05 -0.31 0.00 -1.52 0.00 0.00 31.29 31.51 1wnb h VAL 196 CO 0.00 0.62 -0.87 -0.69 0.02 0.00 0.00 177.57 176.66 1wnb s VAL 197 N -3.69 1.79 -0.01 2.57 1.01 -1.26 -0.59 120.40 120.22 1wnb s VAL 197 Ca -0.06 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 60.99 1wnb s VAL 197 Cb 0.11 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1wnb s VAL 197 CO 0.84 0.50 0.02 0.20 0.00 0.00 0.00 175.10 176.66 1wnb s ASN 198 N -0.19 0.03 -0.13 3.32 0.01 0.04 -4.50 114.94 113.51 1wnb s ASN 198 Ca -0.01 0.02 0.00 0.00 -0.71 0.00 0.00 52.86 52.17 1wnb s ASN 198 Cb -0.12 -0.02 0.02 0.00 0.41 0.00 0.00 41.25 41.54 1wnb s ASN 198 CO 0.02 -0.06 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.82 1wnb s ILE 199 N 0.46 1.28 0.47 0.60 1.01 0.42 -0.53 121.20 124.91 1wnb s ILE 199 Ca -0.04 -0.45 0.08 0.00 0.00 0.00 0.00 60.65 60.24 1wnb s ILE 199 Cb -0.06 -1.24 0.03 0.00 0.01 0.00 0.00 42.46 41.20 1wnb s ILE 199 CO -0.01 0.41 0.57 -0.76 0.00 0.00 0.00 174.94 175.15 1wnb s LEU 200 N 1.54 3.37 -0.01 2.97 1.43 -0.63 -1.69 118.68 125.65 1wnb s LEU 200 Ca 0.04 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 52.49 1wnb s LEU 200 Cb -0.13 -2.12 -0.01 0.00 0.03 0.00 0.00 46.19 43.97 1wnb s LEU 200 CO -0.08 -0.92 -0.11 0.12 0.23 0.00 0.00 176.35 175.58 1wnb s PHE 201 N -2.50 1.05 0.00 0.29 2.19 -1.26 -4.34 117.98 113.40 1wnb s PHE 201 Ca 0.53 -0.21 0.00 0.00 0.33 0.00 0.00 56.93 57.58 1wnb s PHE 201 Cb -0.07 -0.69 0.00 0.00 -1.31 0.00 0.00 43.02 40.96 1wnb s PHE 201 CO 0.32 -0.04 0.00 0.41 1.83 0.00 0.00 175.22 177.75 1wnb n GLY 202 N 2.88 0.40 3.81 13.12 0.00 -1.26 -1.02 105.19 123.12 1wnb n GLY 202 Ca -0.15 -1.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 1wnb n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wnb s ARG 203 N -1.45 3.47 0.29 1.61 0.52 -1.26 -3.97 118.95 118.16 1wnb s ARG 203 Ca 0.00 1.21 -0.00 0.00 -0.52 0.00 0.00 55.73 56.42 1wnb s ARG 203 Cb 0.00 -2.05 0.68 0.00 0.52 0.00 0.00 34.95 34.09 1wnb s ARG 203 CO 0.00 -0.69 1.59 0.78 0.02 0.00 0.00 175.30 177.00 1wnb h GLY 204 N 0.70 1.16 1.05 -3.53 0.00 -1.95 -0.41 103.07 100.09 1wnb h GLY 204 Ca -0.47 0.13 -0.31 0.00 0.00 0.00 0.00 47.33 46.68 1wnb h GLY 204 CO 0.58 -0.45 -1.38 0.50 0.00 0.00 0.00 176.54 175.79 1wnb h LYS 205 N 0.05 0.46 0.00 4.80 1.57 -1.94 0.17 116.57 121.68 1wnb h LYS 205 Ca 0.55 -0.78 -0.16 0.00 -1.87 0.00 0.00 60.65 58.39 1wnb h LYS 205 Cb 1.10 0.29 -0.03 0.00 0.08 0.00 0.00 32.23 33.68 1wnb h LYS 205 CO -0.85 1.38 -0.95 1.79 -0.57 0.00 0.00 179.45 180.24 1wnb h THR 206 N 0.01 0.98 0.00 -0.16 1.35 -1.94 -3.37 112.91 109.77 1wnb h THR 206 Ca -0.25 -2.50 0.00 0.00 -0.55 0.00 0.00 66.41 63.11 1wnb h THR 206 Cb 2.03 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 70.88 1wnb h THR 206 CO 0.23 0.56 -0.86 0.52 -0.25 0.00 0.00 175.52 175.71 1wnb n VAL 207 N -3.16 0.00 0.18 6.82 0.31 -0.21 -4.70 118.33 117.58 1wnb n VAL 207 Ca -0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.16 1wnb n VAL 207 Cb 0.84 -0.90 -0.08 0.00 -0.91 0.00 0.00 33.84 32.79 1wnb n VAL 207 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1wnb h GLY 208 N 0.00 -1.15 0.27 2.92 0.00 -1.01 -2.55 103.07 101.55 1wnb h GLY 208 Ca 0.00 0.56 0.07 0.00 0.00 0.00 0.00 47.33 47.96 1wnb h GLY 208 CO 0.00 -0.34 -0.08 -0.55 0.00 0.00 0.00 176.54 175.57 1wnb h ASP 209 N -0.71 -0.33 0.70 0.19 3.32 -0.84 0.10 116.42 118.85 1wnb h ASP 209 Ca -0.03 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1wnb h ASP 209 Cb 0.64 0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 1wnb h ASP 209 CO -0.11 -0.12 -0.12 1.55 -1.72 0.00 0.00 179.24 178.73 1wnb h PRO 210 N 0.01 0.00 0.00 3.56 0.13 -1.81 -1.74 132.00 132.15 1wnb h PRO 210 Ca 0.18 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1wnb h PRO 210 Cb 0.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.40 1wnb h PRO 210 CO -0.38 0.12 -0.00 1.25 -0.23 0.00 0.00 178.00 178.76 1wnb h LEU 211 N 0.00 -0.00 -1.13 1.56 5.85 -0.78 -3.03 115.31 117.78 1wnb h LEU 211 Ca -0.00 -0.90 -0.01 0.00 0.84 0.00 0.00 57.88 57.80 1wnb h LEU 211 Cb 0.50 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 1wnb h LEU 211 CO 0.02 0.95 -0.07 0.71 -0.34 0.00 0.00 178.44 179.71 1wnb h THR 212 N -1.00 0.16 -0.05 1.05 1.35 -0.83 -2.80 112.91 110.79 1wnb h THR 212 Ca -0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1wnb h THR 212 Cb 0.90 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 1wnb h THR 212 CO 0.00 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 1wnb n GLY 213 N 0.25 0.27 3.75 5.82 0.00 -0.66 -4.84 105.19 109.78 1wnb n GLY 213 Ca 0.01 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 1wnb n GLY 213 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1wnb s HIS 214 N -1.96 2.77 0.56 1.61 5.04 -1.06 -4.93 115.29 117.32 1wnb s HIS 214 Ca 0.36 0.84 0.25 0.00 -1.54 0.00 0.00 55.06 54.96 1wnb s HIS 214 Cb 0.20 -4.04 1.50 0.00 0.04 0.00 0.00 32.58 30.29 1wnb s HIS 214 CO 0.32 -3.45 2.10 -1.35 -2.34 0.00 0.00 174.74 170.02 1wnb h PRO 215 N 4.73 0.00 0.00 2.88 0.11 -1.92 -3.07 132.00 134.73 1wnb h PRO 215 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1wnb h PRO 215 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1wnb h PRO 215 CO 0.78 0.00 -0.36 0.87 -0.21 0.00 0.00 178.00 179.08 1wnb h LYS 216 N 0.00 0.00 -6.47 1.05 1.79 -1.96 -3.45 116.57 107.53 1wnb h LYS 216 Ca 0.10 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 58.04 1wnb h LYS 216 Cb 0.47 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.13 1wnb h LYS 216 CO -0.00 0.00 0.69 0.08 -1.08 0.00 0.00 179.45 179.13 1wnb s VAL 217 N -3.15 3.71 -0.04 0.50 1.01 -1.16 -4.18 120.40 117.08 1wnb s VAL 217 Ca 0.08 1.20 0.15 0.00 0.00 0.00 0.00 61.98 63.41 1wnb s VAL 217 Cb 0.12 -3.77 -0.23 0.00 0.00 0.00 0.00 36.38 32.51 1wnb s VAL 217 CO 0.67 0.07 0.28 0.54 0.00 0.00 0.00 175.10 176.66 1wnb n ARG 218 N 4.31 0.70 -3.95 2.72 5.12 0.34 -4.95 116.66 120.95 1wnb n ARG 218 Ca 0.11 -0.11 -0.10 0.00 -1.93 0.00 0.00 57.85 55.82 1wnb n ARG 218 Cb 0.44 -1.37 -0.12 0.00 -1.16 0.00 0.00 32.46 30.26 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 -2.93 0.23 -0.12 5.56 1.75 -1.13 -2.84 119.30 119.82 1wnb s MET 219 Ca -0.06 -0.45 0.03 0.00 -1.25 0.00 0.00 55.69 53.96 1wnb s MET 219 Cb 0.09 0.08 0.01 0.00 2.84 0.00 0.00 34.83 37.85 1wnb s MET 219 CO 0.63 -0.04 -0.21 0.08 -0.65 0.00 0.00 175.02 174.83 1wnb s VAL 220 N -1.08 1.96 -0.21 10.11 1.01 -0.43 -1.27 120.40 130.48 1wnb s VAL 220 Ca -0.12 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 1wnb s VAL 220 Cb -0.07 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.59 1wnb s VAL 220 CO -0.01 0.53 -0.10 -0.55 0.00 0.00 0.00 175.10 174.97 1wnb s SER 221 N 0.68 3.89 -0.10 3.32 0.15 -0.50 -1.01 113.70 120.13 1wnb s SER 221 Ca -0.11 -0.60 0.03 0.00 0.70 0.00 0.00 55.95 55.97 1wnb s SER 221 Cb -0.16 -1.63 0.01 0.00 -1.71 0.00 0.00 66.02 62.52 1wnb s SER 221 CO 0.02 -0.04 -0.21 -0.22 1.20 0.00 0.00 173.24 173.99 1wnb s LEU 222 N 1.37 1.97 -0.28 3.45 2.96 -0.21 -1.04 118.68 126.91 1wnb s LEU 222 Ca 0.04 -0.50 -0.06 0.00 -0.22 0.00 0.00 54.13 53.39 1wnb s LEU 222 Cb -0.14 -1.28 0.01 0.00 0.50 0.00 0.00 46.19 45.28 1wnb s LEU 222 CO -0.07 0.11 0.05 -0.89 -1.32 0.00 0.00 176.35 174.24 1wnb s THR 223 N 0.52 3.81 0.00 3.68 2.01 -0.97 -1.82 115.64 122.88 1wnb s THR 223 Ca -0.15 -0.69 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1wnb s THR 223 Cb -0.17 -2.94 0.00 0.00 0.01 0.00 0.00 72.50 69.40 1wnb s THR 223 CO 0.06 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.73 1wnb n GLY 224 N 4.84 1.29 3.85 4.40 0.00 -0.99 -3.27 105.19 115.31 1wnb n GLY 224 Ca -0.15 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 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 2.00 5.27 0.16 1.61 1.04 -1.26 -4.10 113.70 118.42 1wnb s SER 225 Ca 0.00 1.27 -0.13 0.00 0.48 0.00 0.00 55.95 57.57 1wnb s SER 225 Cb 0.00 -2.09 0.05 0.00 0.10 0.00 0.00 66.02 64.07 1wnb s SER 225 CO 0.00 -1.47 1.70 0.40 0.98 0.00 0.00 173.24 174.85 1wnb h ILE 226 N -0.74 1.22 -0.36 -1.02 2.04 -1.90 -1.45 117.51 115.30 1wnb h ILE 226 Ca -0.45 -0.71 0.07 0.00 1.00 0.00 0.00 64.86 64.77 1wnb h ILE 226 Cb 1.24 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 37.95 1wnb h ILE 226 CO 0.61 0.27 -0.13 0.00 0.00 0.00 0.00 178.15 178.90 1wnb h ALA 227 N 1.05 0.17 0.19 1.87 0.00 -1.95 0.43 119.26 121.02 1wnb h ALA 227 Ca 0.17 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1wnb h ALA 227 Cb 0.22 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1wnb h ALA 227 CO -0.01 -0.50 -0.10 1.15 0.00 0.00 0.00 179.25 179.79 1wnb h THR 228 N -0.06 0.80 -0.23 0.00 2.02 -1.91 0.08 112.91 113.60 1wnb h THR 228 Ca 0.18 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.41 1wnb h THR 228 Cb 0.33 0.80 -0.07 0.00 -1.74 0.00 0.00 68.15 67.47 1wnb h THR 228 CO -0.40 0.00 -0.46 1.23 0.37 0.00 0.00 175.52 176.26 1wnb h GLY 229 N -0.26 -0.77 0.45 2.16 0.00 -0.78 0.10 103.07 103.97 1wnb h GLY 229 Ca -0.03 0.58 0.15 0.00 0.00 0.00 0.00 47.33 48.03 1wnb h GLY 229 CO 0.04 -0.20 0.59 -2.09 0.00 0.00 0.00 176.54 174.88 1wnb h GLU 230 N -0.46 0.70 -0.29 4.80 4.81 0.16 -0.50 114.58 123.80 1wnb h GLU 230 Ca 0.08 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.09 1wnb h GLU 230 Cb 0.63 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 1wnb h GLU 230 CO -0.47 0.46 -0.54 1.25 -0.73 0.00 0.00 179.01 178.98 1wnb h HIS 231 N 0.72 1.09 -0.35 0.92 2.76 -0.02 -2.13 115.15 118.15 1wnb h HIS 231 Ca 0.47 -0.39 -0.09 0.00 -2.20 0.00 0.00 60.37 58.17 1wnb h HIS 231 Cb 0.75 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 1wnb h HIS 231 CO -0.00 1.21 -0.16 0.82 -1.30 0.00 0.00 177.93 178.50 1wnb h ILE 232 N 0.67 1.25 0.50 6.26 2.04 0.66 -1.52 117.51 127.38 1wnb h ILE 232 Ca 0.02 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.69 1wnb h ILE 232 Cb 1.14 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1wnb h ILE 232 CO 0.12 0.39 -0.24 0.40 0.00 0.00 0.00 178.15 178.82 1wnb h ILE 233 N 0.57 0.46 -0.82 -0.67 2.04 -1.13 -1.94 117.51 116.02 1wnb h ILE 233 Ca 0.09 -0.27 0.07 0.00 1.00 0.00 0.00 64.86 65.75 1wnb h ILE 233 Cb 0.59 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1wnb h ILE 233 CO 0.04 0.04 0.54 0.28 0.00 0.00 0.00 178.15 179.05 1wnb h SER 234 N -0.85 0.79 0.81 1.72 0.02 -1.37 -2.07 113.55 112.60 1wnb h SER 234 Ca -0.07 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.78 1wnb h SER 234 Cb 0.59 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1wnb h SER 234 CO 0.11 0.51 -0.49 -0.74 -1.14 0.00 0.00 176.83 175.09 1wnb h HIS 235 N 0.90 0.00 -0.20 3.45 6.17 -1.09 -3.06 115.15 121.33 1wnb h HIS 235 Ca 0.36 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.44 1wnb h HIS 235 Cb 0.23 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.16 1wnb h HIS 235 CO -0.00 0.49 0.00 0.25 0.71 0.00 0.00 177.93 179.37 1wnb n THR 236 N -3.60 0.45 -0.24 6.26 -2.24 -0.74 -4.58 114.28 109.57 1wnb n THR 236 Ca -0.00 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.05 1wnb n THR 236 Cb 0.57 0.93 0.12 0.00 -2.10 0.00 0.00 70.33 69.86 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 2.56 0.96 -0.06 6.98 0.00 -1.26 -2.44 119.26 125.99 1wnb h ALA 237 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1wnb h ALA 237 Cb 0.66 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1wnb h ALA 237 CO 0.00 0.01 0.19 0.66 0.00 0.00 0.00 179.25 180.11 1wnb h SER 238 N 0.66 0.00 -0.17 0.00 4.64 -1.81 -2.05 113.55 114.82 1wnb h SER 238 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1wnb h SER 238 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1wnb h SER 238 CO -0.23 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.19 1wnb n SER 239 N -3.24 2.79 -3.47 4.97 3.41 -0.94 -4.99 113.62 112.15 1wnb n SER 239 Ca -0.01 -2.45 -0.25 0.00 -0.26 0.00 0.00 58.87 55.90 1wnb n SER 239 Cb 0.27 -0.28 0.02 0.00 -0.26 0.00 0.00 64.21 63.95 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 -0.37 -1.65 -1.97 -1.33 2.08 -0.77 -4.86 119.36 110.48 1wnb n ILE 240 Ca 0.12 0.00 -0.39 0.00 0.56 0.00 0.00 62.75 63.03 1wnb n ILE 240 Cb 0.53 -2.65 0.01 0.00 -0.75 0.00 0.00 39.64 36.78 1wnb n ILE 240 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1wnb s LYS 241 N -6.15 3.79 0.24 0.38 1.02 -1.18 -4.92 119.74 112.91 1wnb s LYS 241 Ca 0.47 2.20 -0.31 0.00 0.02 0.00 0.00 55.97 58.35 1wnb s LYS 241 Cb -0.24 -2.65 -0.12 0.00 -0.52 0.00 0.00 37.83 34.31 1wnb s LYS 241 CO 0.58 -0.66 1.63 -2.13 -0.92 0.00 0.00 175.35 173.86 1wnb n ARG 242 N -0.13 2.61 -4.50 1.68 3.00 -1.13 -4.92 116.66 113.26 1wnb n ARG 242 Ca 0.05 0.94 -0.25 0.00 -0.00 0.00 0.00 57.85 58.59 1wnb n ARG 242 Cb 0.44 -2.74 -0.10 0.00 0.00 0.00 0.00 32.46 30.06 1wnb n ARG 242 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1wnb s THR 243 N 0.62 2.38 -0.15 5.15 -4.23 -1.26 -1.32 115.64 116.82 1wnb s THR 243 Ca 0.71 -2.32 -0.05 0.00 -1.18 0.00 0.00 61.69 58.85 1wnb s THR 243 Cb -0.54 -2.45 0.07 0.00 1.34 0.00 0.00 72.50 70.92 1wnb s THR 243 CO 0.40 -0.31 0.29 -2.28 -0.54 0.00 0.00 174.62 172.18 1wnb s HIS 244 N -2.55 -0.49 -0.05 3.99 2.46 -0.18 -4.95 115.29 113.52 1wnb s HIS 244 Ca 0.31 1.01 -0.02 0.00 0.47 0.00 0.00 55.06 56.83 1wnb s HIS 244 Cb -0.02 -0.00 0.03 0.00 -0.13 0.00 0.00 32.58 32.47 1wnb s HIS 244 CO 0.16 -0.40 0.08 1.41 -2.47 0.00 0.00 174.74 173.51 1wnb s MET 245 N 2.45 -0.05 -0.33 2.88 1.75 -0.97 -1.04 119.30 123.98 1wnb s MET 245 Ca 0.02 0.40 0.03 0.00 -1.25 0.00 0.00 55.69 54.89 1wnb s MET 245 Cb -0.12 -0.43 0.09 0.00 2.84 0.00 0.00 34.83 37.21 1wnb s MET 245 CO -0.10 -0.31 0.03 -2.00 -0.65 0.00 0.00 175.02 172.00 1wnb s GLU 246 N 2.07 1.62 -0.22 4.11 -6.30 -0.75 -0.30 118.70 118.94 1wnb s GLU 246 Ca 0.03 -1.80 0.14 0.00 -2.50 0.00 0.00 54.97 50.84 1wnb s GLU 246 Cb -0.12 -3.18 0.47 0.00 0.00 0.00 0.00 34.13 31.29 1wnb s GLU 246 CO -0.04 -0.89 1.37 1.28 0.02 0.00 0.00 175.26 177.00 1wnb n LEU 247 N 4.30 3.57 0.00 2.70 4.77 -0.07 -2.35 117.00 129.92 1wnb n LEU 247 Ca 0.01 -3.42 0.00 0.00 -0.03 0.00 0.00 56.01 52.57 1wnb n LEU 247 Cb 0.42 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1wnb n LEU 247 CO 0.22 0.98 0.00 0.61 -1.33 0.00 0.00 177.39 177.88 1wnb n GLY 248 N -0.99 -2.26 3.91 -0.72 0.00 -1.26 -4.10 105.19 99.78 1wnb n GLY 248 Ca 0.25 -2.14 -0.02 0.00 0.00 0.00 0.00 46.02 44.11 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 0.00 0.08 -0.35 -0.02 0.00 -1.25 -4.45 107.32 101.34 1wnb s GLY 249 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 44.72 44.43 1wnb s GLY 249 CO 0.00 3.09 0.23 1.25 0.00 0.00 0.00 173.10 177.67 1wnb s LYS 250 N -2.11 0.51 -0.16 2.90 2.47 -1.26 -4.65 119.74 117.45 1wnb s LYS 250 Ca 0.24 -1.13 -0.29 0.00 -1.56 0.00 0.00 55.97 53.23 1wnb s LYS 250 Cb -0.02 -1.16 -0.01 0.00 -1.46 0.00 0.00 37.83 35.17 1wnb s LYS 250 CO 0.04 -1.18 1.19 0.00 0.16 0.00 0.00 175.35 175.56 1wnb s ALA 251 N 1.28 3.63 0.13 3.13 0.00 -1.25 -4.87 121.76 123.80 1wnb s ALA 251 Ca 0.17 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1wnb s ALA 251 Cb -0.21 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 1wnb s ALA 251 CO -0.05 -1.04 1.25 -1.25 0.00 0.00 0.00 175.76 174.67 1wnb s PRO 252 N 3.13 4.42 -0.45 0.00 0.05 -1.26 -2.65 135.00 138.24 1wnb s PRO 252 Ca 0.52 1.90 -0.07 0.00 0.05 0.00 0.00 61.00 63.40 1wnb s PRO 252 Cb -0.21 -3.27 0.11 0.00 0.05 0.00 0.00 34.50 31.19 1wnb s PRO 252 CO 0.14 -0.23 0.30 0.08 0.05 0.00 0.00 177.00 177.33 1wnb s VAL 253 N 0.57 3.92 -0.31 -0.36 1.01 0.21 -0.55 120.40 124.89 1wnb s VAL 253 Ca 0.58 -1.85 -0.15 0.00 0.00 0.00 0.00 61.98 60.55 1wnb s VAL 253 Cb -0.33 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1wnb s VAL 253 CO 0.33 -0.74 0.37 -0.63 0.00 0.00 0.00 175.10 174.44 1wnb s ILE 254 N 1.30 5.16 -0.28 2.22 1.01 0.06 -1.09 121.20 129.58 1wnb s ILE 254 Ca 0.06 0.33 0.03 0.00 0.00 0.00 0.00 60.65 61.07 1wnb s ILE 254 Cb -0.25 -3.76 0.07 0.00 0.01 0.00 0.00 42.46 38.53 1wnb s ILE 254 CO -0.02 0.03 -0.06 -0.69 0.00 0.00 0.00 174.94 174.21 1wnb s VAL 255 N 2.07 2.12 0.54 2.92 1.01 0.01 0.47 120.40 129.54 1wnb s VAL 255 Ca 0.14 -1.79 -0.06 0.00 0.00 0.00 0.00 61.98 60.27 1wnb s VAL 255 Cb -0.16 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 1wnb s VAL 255 CO 0.11 -0.20 0.85 -0.36 0.00 0.00 0.00 175.10 175.50 1wnb s PHE 256 N 1.08 3.41 0.45 5.22 0.40 -0.68 -1.23 117.98 126.62 1wnb s PHE 256 Ca -0.03 0.73 0.28 0.00 -0.60 0.00 0.00 56.93 57.31 1wnb s PHE 256 Cb -0.20 -2.52 1.34 0.00 0.51 0.00 0.00 43.02 42.15 1wnb s PHE 256 CO -0.06 -0.55 1.71 -0.44 0.70 0.00 0.00 175.22 176.57 1wnb h ASP 257 N 0.02 0.27 -0.43 1.36 3.32 -1.89 -1.51 116.42 117.56 1wnb h ASP 257 Ca -0.46 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1wnb h ASP 257 Cb 1.23 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1wnb h ASP 257 CO 0.61 -0.03 0.00 -0.90 -1.72 0.00 0.00 179.24 177.20 1wnb n ASP 258 N -4.53 2.90 -4.73 6.45 5.75 -1.26 -4.87 116.55 116.26 1wnb n ASP 258 Ca 0.31 -2.17 -0.33 0.00 -0.01 0.00 0.00 54.79 52.60 1wnb n ASP 258 Cb 1.21 -0.40 0.10 0.00 -1.03 0.00 0.00 41.12 41.00 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 -1.59 2.08 -0.65 2.12 0.00 -0.57 -3.57 121.76 119.58 1wnb s ALA 259 Ca 0.32 0.61 -0.26 0.00 0.00 0.00 0.00 51.96 52.63 1wnb s ALA 259 Cb 0.19 -3.39 0.04 0.00 0.00 0.00 0.00 23.12 19.95 1wnb s ALA 259 CO 0.18 -1.93 1.16 0.34 0.00 0.00 0.00 175.76 175.51 1wnb s ASP 260 N -2.58 6.29 0.18 0.00 -1.08 -1.26 -4.88 116.67 113.33 1wnb s ASP 260 Ca 0.68 -0.30 -0.11 0.00 -0.52 0.00 0.00 52.55 52.30 1wnb s ASP 260 Cb -0.23 -2.52 0.08 0.00 -1.46 0.00 0.00 42.92 38.78 1wnb s ASP 260 CO 0.50 -1.58 1.70 0.40 0.52 0.00 0.00 175.17 176.71 1wnb h ILE 261 N 6.07 1.25 -0.76 4.11 1.08 -1.96 -0.94 117.51 126.35 1wnb h ILE 261 Ca -0.27 -0.89 0.04 0.00 -0.39 0.00 0.00 64.86 63.35 1wnb h ILE 261 Cb 1.06 0.64 -0.05 0.00 -3.07 0.00 0.00 36.82 35.40 1wnb h ILE 261 CO 1.21 0.34 0.48 -0.33 -0.69 0.00 0.00 178.15 179.15 1wnb h GLU 262 N 0.91 0.89 -0.50 2.37 3.07 -1.99 0.12 114.58 119.45 1wnb h GLU 262 Ca 0.20 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.36 58.95 1wnb h GLU 262 Cb 0.33 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 28.02 1wnb h GLU 262 CO -0.00 0.59 0.10 0.00 -1.40 0.00 0.00 179.01 178.31 1wnb h ALA 263 N 1.33 0.66 -0.27 3.43 0.00 -1.78 -1.42 119.26 121.22 1wnb h ALA 263 Ca 0.31 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1wnb h ALA 263 Cb 0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1wnb h ALA 263 CO -0.12 0.37 0.02 0.28 0.00 0.00 0.00 179.25 179.79 1wnb h VAL 264 N 0.70 0.83 0.42 0.00 2.07 -0.68 0.13 116.25 119.71 1wnb h VAL 264 Ca 0.16 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 1wnb h VAL 264 Cb 0.36 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1wnb h VAL 264 CO 0.01 0.02 -0.26 0.58 0.02 0.00 0.00 177.57 177.93 1wnb h VAL 265 N 0.10 0.46 0.00 2.57 2.07 -0.68 0.67 116.25 121.44 1wnb h VAL 265 Ca 0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 1wnb h VAL 265 Cb 0.15 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1wnb h VAL 265 CO -0.20 0.00 -0.05 -0.08 0.02 0.00 0.00 177.57 177.26 1wnb h GLU 266 N -0.65 0.00 0.12 1.57 4.81 -1.11 -0.54 114.58 118.78 1wnb h GLU 266 Ca -0.05 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1wnb h GLU 266 Cb 0.54 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1wnb h GLU 266 CO 0.04 0.05 -0.06 0.78 -0.73 0.00 0.00 179.01 179.09 1wnb h GLY 267 N 0.15 -0.16 1.90 1.92 0.00 -0.30 -3.29 103.07 103.28 1wnb h GLY 267 Ca -0.00 0.06 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 1wnb h GLY 267 CO 0.01 -0.06 -0.54 -2.08 0.00 0.00 0.00 176.54 173.86 1wnb h VAL 268 N -0.72 1.38 -0.90 4.60 2.07 -0.38 0.19 116.25 122.50 1wnb h VAL 268 Ca -0.02 -1.85 0.09 0.00 0.82 0.00 0.00 66.70 65.75 1wnb h VAL 268 Cb 0.53 1.96 -0.06 0.00 -1.52 0.00 0.00 31.29 32.20 1wnb h VAL 268 CO 0.03 0.54 0.58 -0.09 0.02 0.00 0.00 177.57 178.65 1wnb h ARG 269 N 0.09 0.88 0.00 1.57 2.43 -1.21 0.91 114.38 119.04 1wnb h ARG 269 Ca -0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1wnb h ARG 269 Cb 0.99 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1wnb h ARG 269 CO 0.08 0.58 -0.03 1.15 -1.51 0.00 0.00 179.97 180.24 1wnb h THR 270 N 0.91 1.18 0.00 0.20 2.02 -1.52 -3.37 112.91 112.32 1wnb h THR 270 Ca 0.41 -1.89 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1wnb h THR 270 Cb 0.39 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.03 1wnb h THR 270 CO -0.18 0.40 -0.04 0.49 0.37 0.00 0.00 175.52 176.56 1wnb n PHE 271 N -4.66 0.58 0.11 3.16 3.72 0.64 -0.75 117.46 120.26 1wnb n PHE 271 Ca -0.07 0.17 0.01 0.00 -0.05 0.00 0.00 57.45 57.51 1wnb n PHE 271 Cb 0.33 -0.77 -0.01 0.00 -0.94 0.00 0.00 39.48 38.09 1wnb n PHE 271 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1wnb h GLY 272 N 4.69 0.00 0.00 1.37 0.00 0.68 0.40 103.07 110.22 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 -3.15 0.00 -1.92 5.60 4.02 -1.08 -4.25 117.16 116.38 1wnb n TYR 273 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.47 1wnb n TYR 273 Cb 0.78 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.08 1wnb n TYR 273 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1wnb s TYR 274 N -0.14 2.81 -1.59 -0.72 6.14 0.07 -1.52 117.35 122.40 1wnb s TYR 274 Ca 0.00 1.15 -0.01 0.00 0.64 0.00 0.00 57.07 58.85 1wnb s TYR 274 Cb 0.00 -3.90 0.00 0.00 0.42 0.00 0.00 41.96 38.48 1wnb s TYR 274 CO 0.00 -2.71 0.19 -1.71 0.64 0.00 0.00 175.55 171.96 1wnb n ASN 275 N 1.14 -5.67 -2.49 4.32 5.15 -1.26 -1.78 115.26 114.67 1wnb n ASN 275 Ca 0.03 -0.10 -0.13 0.00 -0.60 0.00 0.00 54.58 53.78 1wnb n ASN 275 Cb 0.40 -4.63 -0.01 0.00 -0.53 0.00 0.00 39.78 35.01 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 -2.44 -0.79 -1.00 5.20 0.00 -0.57 -1.47 120.51 119.43 1wnb n ALA 276 Ca -0.19 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1wnb n ALA 276 Cb 0.65 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1wnb n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wnb n GLY 277 N -0.83 0.36 2.85 0.00 0.00 -0.73 -1.47 105.19 105.37 1wnb n GLY 277 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.82 4.13 -3.82 1.61 6.02 -0.54 -3.34 117.38 119.62 1wnb n GLN 278 Ca 0.00 -3.94 -0.13 0.00 -0.01 0.00 0.00 57.00 52.93 1wnb n GLN 278 Cb 0.15 -2.73 -0.13 0.00 1.02 0.00 0.00 30.24 28.55 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 -0.24 -0.11 0.03 1.08 -1.08 -1.26 -4.83 116.67 110.26 1wnb s ASP 279 Ca 0.38 0.23 0.23 0.00 -0.52 0.00 0.00 52.55 52.87 1wnb s ASP 279 Cb 0.10 0.21 0.94 0.00 -1.46 0.00 0.00 42.92 42.71 1wnb s ASP 279 CO 0.02 -0.06 1.72 0.00 0.52 0.00 0.00 175.17 177.37 1wnb n THR 281 N -1.60 2.11 -1.61 0.00 -2.24 -1.26 -3.96 114.28 105.72 1wnb n THR 281 Ca 0.05 -1.81 -0.43 0.00 -2.27 0.00 0.00 64.05 59.60 1wnb n THR 281 Cb 0.27 -0.17 -0.00 0.00 -2.10 0.00 0.00 70.33 68.33 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 -0.47 0.08 -2.62 6.98 0.00 -1.12 -4.68 120.51 118.69 1wnb n ALA 282 Ca 0.20 0.32 -0.43 0.00 0.00 0.00 0.00 53.44 53.53 1wnb n ALA 282 Cb 0.82 -2.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.20 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 -1.16 3.35 -0.04 0.00 0.00 0.13 -3.93 121.76 120.12 1wnb s ALA 283 Ca 0.60 -2.92 0.07 0.00 0.00 0.00 0.00 51.96 49.71 1wnb s ALA 283 Cb -0.63 -4.59 -0.11 0.00 0.00 0.00 0.00 23.12 17.79 1wnb s ALA 283 CO 0.59 -3.27 0.11 0.00 0.00 0.00 0.00 175.76 173.20 1wnb s ARG 285 N -2.39 1.85 -0.17 0.00 3.52 -1.09 -1.89 118.95 118.77 1wnb s ARG 285 Ca -0.03 -2.11 -0.21 0.00 -0.13 0.00 0.00 55.73 53.24 1wnb s ARG 285 Cb 0.04 -3.39 -0.03 0.00 -1.56 0.00 0.00 34.95 30.01 1wnb s ARG 285 CO 0.32 -1.04 0.62 0.42 -0.81 0.00 0.00 175.30 174.81 1wnb s ILE 286 N 0.57 5.04 -0.31 4.11 1.01 0.38 0.66 121.20 132.67 1wnb s ILE 286 Ca 0.12 1.20 -0.12 0.00 0.00 0.00 0.00 60.65 61.86 1wnb s ILE 286 Cb -0.22 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1wnb s ILE 286 CO -0.05 0.15 0.20 -0.31 0.00 0.00 0.00 174.94 174.94 1wnb s TYR 287 N 1.63 3.21 -0.16 3.97 1.51 -0.25 -0.11 117.35 127.15 1wnb s TYR 287 Ca 0.30 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 56.26 1wnb s TYR 287 Cb -0.16 -2.41 0.02 0.00 -0.11 0.00 0.00 41.96 39.30 1wnb s TYR 287 CO 0.11 -0.28 -0.18 0.00 -1.11 0.00 0.00 175.55 174.09 1wnb s ALA 288 N 1.72 2.15 0.65 3.71 0.00 0.56 -0.81 121.76 129.74 1wnb s ALA 288 Ca 0.06 -1.09 -0.18 0.00 0.00 0.00 0.00 51.96 50.75 1wnb s ALA 288 Cb -0.17 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.83 1wnb s ALA 288 CO 0.10 -0.32 1.30 -1.14 0.00 0.00 0.00 175.76 175.70 1wnb s GLN 289 N 1.30 2.55 0.48 0.00 0.74 -0.37 -2.20 119.66 122.18 1wnb s GLN 289 Ca 0.04 2.07 0.14 0.00 0.05 0.00 0.00 55.36 57.66 1wnb s GLN 289 Cb -0.13 -1.85 1.14 0.00 1.10 0.00 0.00 33.01 33.27 1wnb s GLN 289 CO -0.11 -1.60 2.09 0.87 -0.55 0.00 0.00 175.29 175.99 1wnb h LYS 290 N 0.55 0.06 -0.19 1.67 1.57 -1.31 -1.15 116.57 117.78 1wnb h LYS 290 Ca -0.51 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1wnb h LYS 290 Cb 1.34 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.62 1wnb h LYS 290 CO 0.53 0.10 0.11 0.78 -0.57 0.00 0.00 179.45 180.40 1wnb h GLY 291 N 0.23 0.26 -1.30 3.86 0.00 -1.89 -3.14 103.07 101.09 1wnb h GLY 291 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1wnb h GLY 291 CO 0.00 0.08 -0.02 0.29 0.00 0.00 0.00 176.54 176.89 1wnb n ILE 292 N -4.98 0.00 -0.02 2.60 -6.64 -0.64 -4.66 119.36 105.02 1wnb n ILE 292 Ca -0.03 -0.39 -0.09 0.00 -1.77 0.00 0.00 62.75 60.47 1wnb n ILE 292 Cb 0.04 1.09 -0.02 0.00 -1.44 0.00 0.00 39.64 39.31 1wnb n ILE 292 CO 0.00 0.00 0.00 0.22 -1.77 0.00 0.00 176.55 175.00 1wnb h TYR 293 N 3.68 -0.42 -0.21 4.28 3.20 -1.19 -0.34 116.97 125.96 1wnb h TYR 293 Ca 0.00 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.72 1wnb h TYR 293 Cb 0.79 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 1wnb h TYR 293 CO 0.00 -0.24 -0.58 -0.44 -1.64 0.00 0.00 178.16 175.27 1wnb h ASP 294 N -0.19 0.73 -0.08 -2.11 3.32 -1.83 -1.30 116.42 114.96 1wnb h ASP 294 Ca 0.11 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 1wnb h ASP 294 Cb 0.35 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 1wnb h ASP 294 CO -0.28 1.15 0.01 0.74 -1.72 0.00 0.00 179.24 179.13 1wnb h THR 295 N 0.49 1.22 -0.16 0.35 2.02 -1.80 -2.03 112.91 113.01 1wnb h THR 295 Ca 0.00 -0.67 0.04 0.00 0.77 0.00 0.00 66.41 66.55 1wnb h THR 295 Cb 1.14 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 69.03 1wnb h THR 295 CO 0.11 0.19 -0.07 0.25 0.37 0.00 0.00 175.52 176.38 1wnb h LEU 296 N -0.11 -0.23 -0.44 2.58 5.85 -0.91 -1.95 115.31 120.10 1wnb h LEU 296 Ca 0.02 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1wnb h LEU 296 Cb 0.29 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1wnb h LEU 296 CO 0.00 -0.09 0.19 0.58 -0.34 0.00 0.00 178.44 178.78 1wnb h VAL 297 N -0.05 0.92 0.61 1.05 2.07 -1.22 0.37 116.25 120.01 1wnb h VAL 297 Ca 0.08 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1wnb h VAL 297 Cb 0.17 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1wnb h VAL 297 CO -0.19 0.07 -0.50 -0.08 0.02 0.00 0.00 177.57 176.89 1wnb h GLU 298 N 0.39 -1.04 -0.97 1.57 4.81 -1.22 -1.10 114.58 117.01 1wnb h GLU 298 Ca 0.20 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1wnb h GLU 298 Cb 0.14 0.24 -0.05 0.00 0.63 0.00 0.00 28.75 29.71 1wnb h GLU 298 CO -0.17 -0.69 0.62 0.87 -0.73 0.00 0.00 179.01 178.91 1wnb h LYS 299 N -1.08 1.30 -0.10 1.92 1.57 -1.20 -1.52 116.57 117.46 1wnb h LYS 299 Ca -0.08 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.58 1wnb h LYS 299 Cb 0.91 -0.28 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1wnb h LYS 299 CO -0.00 0.89 -0.00 1.25 -0.57 0.00 0.00 179.45 181.01 1wnb h LEU 300 N 1.33 0.18 -0.57 2.94 5.85 -0.26 -1.42 115.31 123.37 1wnb h LEU 300 Ca 0.35 -0.31 0.12 0.00 0.84 0.00 0.00 57.88 58.87 1wnb h LEU 300 Cb -0.10 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 40.78 1wnb h LEU 300 CO -0.07 0.45 0.01 1.23 -0.34 0.00 0.00 178.44 179.71 1wnb h GLY 301 N -0.10 0.60 1.35 3.75 0.00 -0.91 -0.20 103.07 107.56 1wnb h GLY 301 Ca 0.03 0.07 -0.07 0.00 0.00 0.00 0.00 47.33 47.36 1wnb h GLY 301 CO 0.01 -0.17 0.05 0.00 0.00 0.00 0.00 176.54 176.42 1wnb h ALA 302 N 1.51 1.14 -0.20 3.60 0.00 -1.12 -2.35 119.26 121.84 1wnb h ALA 302 Ca 0.29 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1wnb h ALA 302 Cb 0.46 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1wnb h ALA 302 CO -0.48 0.56 -0.12 0.00 0.00 0.00 0.00 179.25 179.21 1wnb h ALA 303 N 1.29 0.29 -0.85 0.00 0.00 -0.45 -3.27 119.26 116.27 1wnb h ALA 303 Ca 0.16 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1wnb h ALA 303 Cb 0.40 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1wnb h ALA 303 CO 0.01 0.14 0.54 0.28 0.00 0.00 0.00 179.25 180.22 1wnb h VAL 304 N 0.13 1.10 0.00 0.00 2.07 -0.96 -2.70 116.25 115.88 1wnb h VAL 304 Ca 0.04 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1wnb h VAL 304 Cb 0.62 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1wnb h VAL 304 CO 0.03 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.81 1wnb h ALA 305 N 1.37 1.00 -0.00 1.67 0.00 -1.47 -1.50 119.26 120.32 1wnb h ALA 305 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1wnb h ALA 305 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1wnb h ALA 305 CO -0.14 0.00 -0.35 0.25 0.00 0.00 0.00 179.25 179.01 1wnb n THR 306 N -2.87 0.00 -1.66 0.00 -2.24 -1.02 -4.90 114.28 101.59 1wnb n THR 306 Ca -0.02 -0.07 -0.53 0.00 -2.27 0.00 0.00 64.05 61.16 1wnb n THR 306 Cb 0.11 0.31 -0.06 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 -1.02 2.37 -4.59 3.22 4.77 -0.57 -4.91 117.00 116.26 1wnb n LEU 307 Ca 0.09 1.08 -0.39 0.00 -0.03 0.00 0.00 56.01 56.76 1wnb n LEU 307 Cb 0.34 -1.22 -0.10 0.00 -2.33 0.00 0.00 43.42 40.11 1wnb n LEU 307 CO 0.30 -0.57 0.00 -0.75 -1.33 0.00 0.00 177.39 175.04 1wnb s LYS 308 N 2.31 3.91 0.46 3.23 2.20 -1.26 -4.93 119.74 125.65 1wnb s LYS 308 Ca 0.91 -0.14 0.03 0.00 -0.36 0.00 0.00 55.97 56.41 1wnb s LYS 308 Cb -0.94 -3.69 0.01 0.00 -1.51 0.00 0.00 37.83 31.71 1wnb s LYS 308 CO 0.54 -0.31 0.65 -1.12 -0.36 0.00 0.00 175.35 174.75 1wnb s SER 309 N 1.69 5.64 0.00 1.43 0.01 -1.26 -0.36 113.70 120.84 1wnb s SER 309 Ca 0.12 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.34 1wnb s SER 309 Cb -0.16 -1.09 0.00 0.00 0.21 0.00 0.00 66.02 64.98 1wnb s SER 309 CO 0.11 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.56 1wnb n GLY 310 N -2.04 -1.70 3.74 3.44 0.00 -1.26 -4.89 105.19 102.48 1wnb n GLY 310 Ca 0.05 -1.47 -0.42 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 s ALA 311 N -1.59 3.71 0.34 4.61 0.00 -1.26 -4.89 121.76 122.68 1wnb s ALA 311 Ca 0.00 1.44 0.10 0.00 0.00 0.00 0.00 51.96 53.50 1wnb s ALA 311 Cb 0.00 -3.61 0.87 0.00 0.00 0.00 0.00 23.12 20.38 1wnb s ALA 311 CO 0.00 -0.85 1.79 -1.35 0.00 0.00 0.00 175.76 175.35 1wnb h PRO 312 N 5.24 0.61 -0.93 0.00 0.11 -1.87 -1.89 132.00 133.28 1wnb h PRO 312 Ca -0.46 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 1wnb h PRO 312 Cb 1.22 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1wnb h PRO 312 CO 0.81 0.41 0.03 -0.40 -0.21 0.00 0.00 178.00 178.63 1wnb n ASP 313 N -4.70 2.26 -4.45 -2.05 5.68 -1.26 -0.93 116.55 111.10 1wnb n ASP 313 Ca 0.23 -2.23 -0.34 0.00 -0.50 0.00 0.00 54.79 51.95 1wnb n ASP 313 Cb 0.65 -0.55 -0.13 0.00 -1.14 0.00 0.00 41.12 39.96 1wnb n ASP 313 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1wnb s ASP 314 N -0.03 4.66 0.50 -1.12 -1.08 -0.71 -4.96 116.67 113.93 1wnb s ASP 314 Ca 0.12 -0.20 0.27 0.00 -0.52 0.00 0.00 52.55 52.22 1wnb s ASP 314 Cb 0.09 -1.77 1.37 0.00 -1.46 0.00 0.00 42.92 41.15 1wnb s ASP 314 CO 0.03 0.12 1.88 -0.08 0.52 0.00 0.00 175.17 177.64 1wnb h GLU 315 N 7.09 0.11 0.00 4.34 4.57 -1.88 -1.92 114.58 126.90 1wnb h GLU 315 Ca -0.33 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 1wnb h GLU 315 Cb 1.19 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1wnb h GLU 315 CO 0.61 0.07 0.00 -1.13 -1.18 0.00 0.00 179.01 177.38 1wnb n SER 316 N -4.35 0.65 -4.72 1.04 3.41 -1.26 -4.84 113.62 103.55 1wnb n SER 316 Ca 0.19 0.56 -0.42 0.00 -0.26 0.00 0.00 58.87 58.94 1wnb n SER 316 Cb 0.88 -0.74 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 1wnb n SER 316 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1wnb s THR 317 N -3.08 2.94 -0.12 6.66 2.01 -0.72 -4.80 115.64 118.52 1wnb s THR 317 Ca 0.11 0.69 0.03 0.00 0.31 0.00 0.00 61.69 62.83 1wnb s THR 317 Cb 0.14 -3.44 -0.09 0.00 0.01 0.00 0.00 72.50 69.11 1wnb s THR 317 CO 0.58 0.06 -0.08 -0.62 -0.69 0.00 0.00 174.62 173.88 1wnb n GLU 318 N 3.74 0.84 -4.04 4.92 1.02 0.51 -4.88 120.64 122.75 1wnb n GLU 318 Ca 0.12 0.05 -0.34 0.00 -0.02 0.00 0.00 57.16 56.98 1wnb n GLU 318 Cb 0.40 -1.25 -0.15 0.00 -0.02 0.00 0.00 31.44 30.42 1wnb n GLU 318 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1wnb s LEU 319 N -5.48 2.52 0.00 -4.62 2.96 -0.57 -4.79 118.68 108.69 1wnb s LEU 319 Ca -0.14 -0.65 0.03 0.00 -0.22 0.00 0.00 54.13 53.15 1wnb s LEU 319 Cb 0.04 -1.57 0.09 0.00 0.50 0.00 0.00 46.19 45.25 1wnb s LEU 319 CO 0.32 -0.03 0.64 0.61 -1.32 0.00 0.00 176.35 176.57 1wnb n GLY 320 N 4.66 1.19 3.76 7.98 0.00 -1.26 -4.14 105.19 117.37 1wnb n GLY 320 Ca -0.19 -2.08 -0.30 0.00 0.00 0.00 0.00 46.02 43.44 1wnb n GLY 320 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wnb s PRO 321 N -4.10 1.72 1.11 1.61 0.04 -1.26 -4.60 135.00 129.51 1wnb s PRO 321 Ca 0.45 0.78 -0.14 0.00 0.04 0.00 0.00 61.00 62.13 1wnb s PRO 321 Cb -0.03 -1.87 0.25 0.00 0.04 0.00 0.00 34.50 32.89 1wnb s PRO 321 CO 0.29 -1.91 1.06 -0.51 0.04 0.00 0.00 177.00 175.97 1wnb s LEU 322 N -6.00 1.02 0.31 -3.56 1.43 -0.15 -4.77 118.68 106.97 1wnb s LEU 322 Ca 0.62 1.20 0.17 0.00 -1.03 0.00 0.00 54.13 55.08 1wnb s LEU 322 Cb -0.16 -3.18 0.20 0.00 0.03 0.00 0.00 46.19 43.08 1wnb s LEU 322 CO 0.56 -3.77 1.51 0.77 0.23 0.00 0.00 176.35 175.64 1wnb h SER 323 N -2.33 0.00 -5.03 2.29 4.64 -1.86 -3.42 113.55 107.84 1wnb h SER 323 Ca -0.56 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.78 1wnb h SER 323 Cb 1.33 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.39 1wnb h SER 323 CO 0.52 0.43 0.22 -0.94 -0.87 0.00 0.00 176.83 176.19 1wnb s SER 324 N -6.42 -0.12 0.07 4.97 1.04 -1.26 -4.78 113.70 107.20 1wnb s SER 324 Ca 0.04 -0.85 -0.23 0.00 0.48 0.00 0.00 55.95 55.39 1wnb s SER 324 Cb 0.08 0.77 -0.14 0.00 0.10 0.00 0.00 66.02 66.83 1wnb s SER 324 CO 0.73 -1.47 1.61 0.25 0.98 0.00 0.00 173.24 175.33 1wnb h LEU 325 N 2.02 0.10 -1.52 2.42 5.85 -1.96 -2.41 115.31 119.80 1wnb h LEU 325 Ca -0.25 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.34 1wnb h LEU 325 Cb 1.25 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 1wnb h LEU 325 CO 0.31 0.23 0.35 0.00 -0.34 0.00 0.00 178.44 178.98 1wnb h ALA 326 N 0.87 1.70 -0.06 1.25 0.00 -1.99 0.03 119.26 121.07 1wnb h ALA 326 Ca 0.02 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1wnb h ALA 326 Cb 0.16 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wnb h ALA 326 CO -0.00 0.25 -0.88 1.25 0.00 0.00 0.00 179.25 179.87 1wnb h HIS 327 N 0.64 0.83 -0.49 0.00 -0.00 -1.94 -1.49 115.15 112.69 1wnb h HIS 327 Ca 0.21 -0.41 -0.02 0.00 -0.00 0.00 0.00 60.37 60.15 1wnb h HIS 327 Cb 0.04 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.31 1wnb h HIS 327 CO -0.00 1.23 0.24 1.25 -0.00 0.00 0.00 177.93 180.65 1wnb h LEU 328 N 0.37 0.61 -0.16 0.26 5.85 -0.91 -0.87 115.31 120.46 1wnb h LEU 328 Ca -0.07 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 1wnb h LEU 328 Cb 1.51 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1wnb h LEU 328 CO 0.17 0.52 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.42 1wnb h GLU 329 N 0.69 0.31 -0.34 1.25 4.39 -0.59 -2.30 114.58 117.98 1wnb h GLU 329 Ca 0.17 -0.11 0.07 0.00 0.34 0.00 0.00 59.36 59.83 1wnb h GLU 329 Cb 0.06 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.63 1wnb h GLU 329 CO -0.02 0.58 -0.11 0.00 -1.16 0.00 0.00 179.01 178.29 1wnb h ARG 330 N 0.01 -0.04 -0.30 2.33 3.08 -1.00 -2.02 114.38 116.44 1wnb h ARG 330 Ca 0.04 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1wnb h ARG 330 Cb 0.46 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1wnb h ARG 330 CO 0.01 -0.03 0.09 0.28 -1.07 0.00 0.00 179.97 179.26 1wnb h VAL 331 N -0.04 1.21 -0.27 2.04 2.07 -1.15 -2.06 116.25 118.05 1wnb h VAL 331 Ca 0.17 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1wnb h VAL 331 Cb 0.30 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1wnb h VAL 331 CO -0.37 0.22 0.07 1.23 0.02 0.00 0.00 177.57 178.74 1wnb h GLY 332 N 0.33 0.40 2.00 2.17 0.00 -1.22 -1.73 103.07 105.02 1wnb h GLY 332 Ca 0.10 -0.19 -0.17 0.00 0.00 0.00 0.00 47.33 47.07 1wnb h GLY 332 CO -0.00 0.18 -0.80 1.70 0.00 0.00 0.00 176.54 177.62 1wnb h LYS 333 N 0.38 0.00 -0.37 4.80 3.11 -1.08 -1.70 116.57 121.71 1wnb h LYS 333 Ca 0.09 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.78 1wnb h LYS 333 Cb 0.14 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.36 1wnb h LYS 333 CO -0.00 0.80 -0.37 0.00 -2.81 0.00 0.00 179.45 177.07 1wnb h ALA 334 N 1.20 0.65 -0.45 5.00 0.00 -0.62 -1.84 119.26 123.20 1wnb h ALA 334 Ca -0.01 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1wnb h ALA 334 Cb 1.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1wnb h ALA 334 CO 0.10 0.67 -0.04 0.28 0.00 0.00 0.00 179.25 180.27 1wnb h VAL 335 N 0.71 1.27 -0.85 0.00 2.07 -1.44 -2.38 116.25 115.64 1wnb h VAL 335 Ca 0.06 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 1wnb h VAL 335 Cb 0.94 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1wnb h VAL 335 CO 0.09 0.38 0.42 -0.33 0.02 0.00 0.00 177.57 178.15 1wnb h GLU 336 N 0.67 1.21 0.00 1.57 4.39 -1.17 -2.00 114.58 119.25 1wnb h GLU 336 Ca 0.12 -0.17 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 1wnb h GLU 336 Cb 0.55 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1wnb h GLU 336 CO 0.03 0.92 -0.34 0.93 -1.16 0.00 0.00 179.01 179.40 1wnb h GLU 337 N 1.20 0.00 -0.30 2.33 5.08 -1.23 -2.50 114.58 119.16 1wnb h GLU 337 Ca 0.29 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.59 1wnb h GLU 337 Cb 0.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1wnb h GLU 337 CO -0.04 0.34 -0.05 0.00 -1.00 0.00 0.00 179.01 178.25 1wnb h ALA 338 N 1.66 0.41 -0.06 3.43 0.00 -0.90 -3.15 119.26 120.65 1wnb h ALA 338 Ca -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1wnb h ALA 338 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1wnb h ALA 338 CO 0.04 0.22 -0.05 0.87 0.00 0.00 0.00 179.25 180.34 1wnb h LYS 339 N 0.35 0.08 -0.01 0.00 1.57 -1.09 -2.86 116.57 114.60 1wnb h LYS 339 Ca 0.08 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1wnb h LYS 339 Cb 0.53 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1wnb h LYS 339 CO 0.03 0.14 -0.00 0.00 -0.57 0.00 0.00 179.45 179.04 1wnb n ALA 340 N -2.52 2.59 0.13 3.86 0.00 -0.97 -3.20 120.51 120.41 1wnb n ALA 340 Ca -0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 53.44 53.00 1wnb n ALA 340 Cb 0.16 -1.21 0.23 0.00 0.00 0.00 0.00 19.45 18.63 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 2.06 1.35 0.00 0.00 1.03 -1.49 -3.47 112.91 112.39 1wnb h THR 341 Ca 0.00 -1.70 0.00 0.00 -0.01 0.00 0.00 66.41 64.70 1wnb h THR 341 Cb 0.44 1.87 0.00 0.00 -1.07 0.00 0.00 68.15 69.39 1wnb h THR 341 CO 0.00 0.50 0.00 0.61 -0.01 0.00 0.00 175.52 176.62 1wnb n GLY 342 N -0.06 0.73 0.00 2.99 0.00 -1.19 -4.87 105.19 102.79 1wnb n GLY 342 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.37 1.61 -0.00 -1.26 -5.03 115.22 105.17 1wnb n HIS 343 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.34 1wnb n HIS 343 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 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 -0.11 5.20 -0.17 0.61 1.01 -1.26 -4.68 121.20 121.80 1wnb s ILE 344 Ca 0.00 0.86 -0.08 0.00 0.00 0.00 0.00 60.65 61.43 1wnb s ILE 344 Cb 0.00 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1wnb s ILE 344 CO 0.00 0.36 0.10 -0.54 0.00 0.00 0.00 174.94 174.86 1wnb s LYS 345 N 0.48 3.87 -0.48 2.79 1.02 -0.56 -4.76 119.74 122.11 1wnb s LYS 345 Ca 0.24 -0.25 -0.29 0.00 0.02 0.00 0.00 55.97 55.69 1wnb s LYS 345 Cb -0.15 -3.26 0.02 0.00 -0.52 0.00 0.00 37.83 33.93 1wnb s LYS 345 CO 0.09 0.44 1.22 0.08 -0.92 0.00 0.00 175.35 176.25 1wnb s VAL 346 N -0.06 4.10 0.03 3.17 1.01 -1.26 -1.25 120.40 126.15 1wnb s VAL 346 Ca 0.09 1.11 -0.17 0.00 0.00 0.00 0.00 61.98 63.00 1wnb s VAL 346 Cb -0.12 -4.52 -0.26 0.00 0.00 0.00 0.00 36.38 31.48 1wnb s VAL 346 CO 0.00 -0.99 1.10 0.40 0.00 0.00 0.00 175.10 175.60 1wnb h ILE 347 N 6.29 1.36 -3.00 2.22 1.08 -0.59 -3.47 117.51 121.41 1wnb h ILE 347 Ca -0.24 -2.27 -0.06 0.00 -0.39 0.00 0.00 64.86 61.89 1wnb h ILE 347 Cb 1.07 2.64 -0.15 0.00 -3.07 0.00 0.00 36.82 37.31 1wnb h ILE 347 CO 1.13 0.68 -0.02 0.28 -0.69 0.00 0.00 178.15 179.53 1wnb s THR 348 N -3.08 0.04 0.00 -0.27 -1.32 -1.23 -4.98 115.64 104.80 1wnb s THR 348 Ca -0.11 -0.37 0.00 0.00 -1.21 0.00 0.00 61.69 60.00 1wnb s THR 348 Cb 0.04 -1.01 0.00 0.00 -1.51 0.00 0.00 72.50 70.02 1wnb s THR 348 CO 0.88 -0.20 0.00 0.61 -2.21 0.00 0.00 174.62 173.69 1wnb n GLY 349 N 0.25 0.67 1.95 6.08 0.00 -1.23 -1.92 105.19 110.99 1wnb n GLY 349 Ca -0.18 -0.83 -0.02 0.00 0.00 0.00 0.00 46.02 45.00 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 0.43 3.38 -0.02 0.00 -1.26 -4.97 105.19 102.75 1wnb n GLY 350 Ca 0.00 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 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 -4.36 0.90 0.33 1.61 2.02 -1.26 -5.02 118.70 112.92 1wnb s GLU 351 Ca 0.01 -0.04 -0.29 0.00 0.02 0.00 0.00 54.97 54.68 1wnb s GLU 351 Cb -0.01 0.41 -0.10 0.00 0.10 0.00 0.00 34.13 34.53 1wnb s GLU 351 CO 0.02 -0.28 1.33 0.15 0.02 0.00 0.00 175.26 176.49 1wnb s LYS 352 N -1.55 4.33 0.39 1.61 1.02 -1.26 -0.47 119.74 123.80 1wnb s LYS 352 Ca -0.11 2.26 -0.23 0.00 0.02 0.00 0.00 55.97 57.91 1wnb s LYS 352 Cb -0.02 -3.06 -0.10 0.00 -0.52 0.00 0.00 37.83 34.13 1wnb s LYS 352 CO 0.05 -0.23 0.98 0.50 -0.92 0.00 0.00 175.35 175.73 1wnb s ARG 353 N -1.80 4.30 0.38 1.68 3.52 0.51 -4.82 118.95 122.73 1wnb s ARG 353 Ca 0.50 1.31 -0.27 0.00 -0.13 0.00 0.00 55.73 57.13 1wnb s ARG 353 Cb -0.41 -2.47 -0.10 0.00 -1.56 0.00 0.00 34.95 30.42 1wnb s ARG 353 CO 0.54 0.02 1.35 0.15 -0.81 0.00 0.00 175.30 176.54 1wnb s LYS 354 N -2.63 4.08 0.00 5.12 1.02 -1.26 -4.78 119.74 121.29 1wnb s LYS 354 Ca 0.57 2.27 0.00 0.00 0.02 0.00 0.00 55.97 58.83 1wnb s LYS 354 Cb -0.16 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 1wnb s LYS 354 CO 0.21 -0.44 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 1wnb n GLY 355 N 0.66 1.19 3.96 -3.33 0.00 -1.26 -5.04 105.19 101.37 1wnb n GLY 355 Ca 0.02 -2.28 -0.22 0.00 0.00 0.00 0.00 46.02 43.54 1wnb n GLY 355 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wnb s ASN 356 N 0.00 5.73 0.00 1.61 0.01 -1.26 -4.90 114.94 116.12 1wnb s ASN 356 Ca 0.00 0.16 0.00 0.00 -0.71 0.00 0.00 52.86 52.31 1wnb s ASN 356 Cb 0.00 -1.34 0.00 0.00 0.41 0.00 0.00 41.25 40.32 1wnb s ASN 356 CO 0.00 -0.77 0.00 0.61 -1.51 0.00 0.00 177.10 175.43 1wnb n GLY 357 N -2.08 -0.87 2.75 0.66 0.00 -1.21 -4.46 105.19 99.98 1wnb n GLY 357 Ca 0.03 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.55 3.24 -3.06 1.61 4.01 -0.49 -4.90 117.16 117.01 1wnb n TYR 358 Ca 0.00 -2.96 -0.40 0.00 -0.16 0.00 0.00 57.90 54.39 1wnb n TYR 358 Cb 0.00 -0.87 -0.05 0.00 -0.31 0.00 0.00 39.34 38.12 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 -3.96 3.53 0.05 -0.72 1.51 -1.26 -0.98 117.35 115.52 1wnb s TYR 359 Ca 0.45 1.18 0.07 0.00 -1.01 0.00 0.00 57.07 57.76 1wnb s TYR 359 Cb 0.29 -2.80 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1wnb s TYR 359 CO -0.20 0.03 -0.19 -0.47 -1.11 0.00 0.00 175.55 173.61 1wnb s TYR 360 N 1.07 2.53 0.26 2.71 5.04 -1.26 -0.36 117.35 127.34 1wnb s TYR 360 Ca 0.35 -0.27 -0.29 0.00 -2.44 0.00 0.00 57.07 54.42 1wnb s TYR 360 Cb -0.17 -1.44 -0.09 0.00 0.35 0.00 0.00 41.96 40.60 1wnb s TYR 360 CO 0.16 0.26 1.28 0.00 -1.34 0.00 0.00 175.55 175.90 1wnb s ALA 361 N -0.94 3.50 0.13 3.97 0.00 0.39 -4.83 121.76 123.98 1wnb s ALA 361 Ca 0.15 1.13 -0.31 0.00 0.00 0.00 0.00 51.96 52.93 1wnb s ALA 361 Cb -0.10 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 1wnb s ALA 361 CO 0.05 -0.52 1.78 -1.25 0.00 0.00 0.00 175.76 175.82 1wnb s PRO 362 N -0.96 4.15 -0.04 0.00 0.04 -1.26 -4.20 135.00 132.73 1wnb s PRO 362 Ca 0.52 2.55 0.04 0.00 0.04 0.00 0.00 61.00 64.15 1wnb s PRO 362 Cb -0.37 -3.48 -0.00 0.00 0.04 0.00 0.00 34.50 30.69 1wnb s PRO 362 CO 0.44 -0.80 -0.17 0.99 0.04 0.00 0.00 177.00 177.50 1wnb s THR 363 N 2.37 1.42 -0.11 1.26 2.01 0.21 -3.52 115.64 119.28 1wnb s THR 363 Ca 0.78 -0.71 -0.00 0.00 0.31 0.00 0.00 61.69 62.07 1wnb s THR 363 Cb -0.46 -1.22 0.02 0.00 0.01 0.00 0.00 72.50 70.86 1wnb s THR 363 CO 0.35 0.41 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.38 1wnb s LEU 364 N 0.03 1.25 -0.12 4.42 2.96 -0.81 -1.45 118.68 124.96 1wnb s LEU 364 Ca -0.04 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1wnb s LEU 364 Cb -0.11 -0.86 -0.02 0.00 0.50 0.00 0.00 46.19 45.71 1wnb s LEU 364 CO 0.02 -0.10 -0.13 -0.76 -1.32 0.00 0.00 176.35 174.06 1wnb s LEU 365 N 1.61 2.72 0.22 -0.68 1.43 0.17 0.24 118.68 124.38 1wnb s LEU 365 Ca 0.03 -0.31 0.10 0.00 -1.03 0.00 0.00 54.13 52.92 1wnb s LEU 365 Cb -0.13 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 1wnb s LEU 365 CO -0.07 0.18 -0.20 0.00 0.23 0.00 0.00 176.35 176.49 1wnb s ALA 366 N 0.24 2.41 -0.27 4.21 0.00 -0.38 -0.67 121.76 127.30 1wnb s ALA 366 Ca -0.09 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.18 1wnb s ALA 366 Cb -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1wnb s ALA 366 CO 0.05 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.51 1wnb n GLY 367 N -0.12 0.58 3.77 0.00 0.00 -0.77 -1.50 105.19 107.16 1wnb n GLY 367 Ca -0.09 -0.48 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 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 3.23 0.19 4.61 0.00 -0.96 -4.59 121.76 122.24 1wnb s ALA 368 Ca 0.00 1.08 0.06 0.00 0.00 0.00 0.00 51.96 53.10 1wnb s ALA 368 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1wnb s ALA 368 CO 0.00 -0.62 0.12 -0.51 0.00 0.00 0.00 175.76 174.75 1wnb s LEU 369 N -2.36 3.71 0.43 0.00 1.43 -1.26 -4.16 118.68 116.47 1wnb s LEU 369 Ca 0.56 -0.21 0.28 0.00 -1.03 0.00 0.00 54.13 53.72 1wnb s LEU 369 Cb -0.34 -2.30 1.39 0.00 0.03 0.00 0.00 46.19 44.96 1wnb s LEU 369 CO 0.43 0.05 1.63 -0.61 0.23 0.00 0.00 176.35 178.08 1wnb h GLN 370 N 2.26 0.11 -0.02 1.70 5.75 -1.96 -0.73 115.11 122.22 1wnb h GLN 370 Ca -0.48 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1wnb h GLN 370 Cb 1.21 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.74 1wnb h GLN 370 CO 0.62 0.07 -0.17 -0.25 -2.65 0.00 0.00 178.83 176.45 1wnb n ASP 371 N -4.73 2.10 -4.77 -0.69 8.00 -1.26 -4.59 116.55 110.61 1wnb n ASP 371 Ca 0.36 -1.59 -0.36 0.00 0.71 0.00 0.00 54.79 53.91 1wnb n ASP 371 Cb 1.37 0.15 -0.00 0.00 -0.02 0.00 0.00 41.12 42.62 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 -2.21 5.98 0.37 -2.24 1.01 -0.28 -4.89 116.67 114.42 1wnb s ASP 372 Ca 0.27 2.28 0.05 0.00 0.71 0.00 0.00 52.55 55.87 1wnb s ASP 372 Cb 0.20 -2.60 0.75 0.00 1.01 0.00 0.00 42.92 42.28 1wnb s ASP 372 CO 0.41 -1.05 2.00 0.00 0.21 0.00 0.00 175.17 176.75 1wnb h ALA 373 N 1.74 1.67 0.00 5.23 0.00 -1.92 -2.21 119.26 123.78 1wnb h ALA 373 Ca -0.50 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1wnb h ALA 373 Cb 1.25 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wnb h ALA 373 CO 0.59 0.26 -0.02 0.97 0.00 0.00 0.00 179.25 181.06 1wnb h ILE 374 N 0.72 0.61 0.04 0.00 6.09 -1.90 0.18 117.51 123.26 1wnb h ILE 374 Ca 0.24 -0.07 -0.36 0.00 -1.37 0.00 0.00 64.86 63.31 1wnb h ILE 374 Cb 0.08 1.04 -0.05 0.00 0.47 0.00 0.00 36.82 38.36 1wnb h ILE 374 CO -0.07 0.02 -2.14 0.52 -3.07 0.00 0.00 178.15 173.41 1wnb n VAL 375 N -3.94 1.60 0.28 2.19 0.31 -0.91 -4.41 118.33 113.44 1wnb n VAL 375 Ca -0.03 -0.70 0.12 0.00 -0.01 0.00 0.00 64.34 63.72 1wnb n VAL 375 Cb 0.10 -1.26 0.05 0.00 -0.91 0.00 0.00 33.84 31.81 1wnb n VAL 375 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wnb n GLN 376 N -3.19 0.49 -5.08 5.55 1.13 -0.88 -4.91 117.38 110.48 1wnb n GLN 376 Ca -0.33 0.10 -0.32 0.00 -1.94 0.00 0.00 57.00 54.51 1wnb n GLN 376 Cb 1.05 -1.77 -0.16 0.00 0.11 0.00 0.00 30.24 29.47 1wnb n GLN 376 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1wnb s LYS 377 N -3.30 3.12 0.09 -1.09 1.02 0.61 -4.86 119.74 115.34 1wnb s LYS 377 Ca 0.02 -0.84 -0.35 0.00 0.02 0.00 0.00 55.97 54.82 1wnb s LYS 377 Cb 0.11 -2.38 -0.15 0.00 -0.52 0.00 0.00 37.83 34.89 1wnb s LYS 377 CO 0.77 0.17 1.53 -1.91 -0.92 0.00 0.00 175.35 174.99 1wnb n GLU 378 N 3.57 1.75 -0.12 1.68 2.13 -1.26 -4.77 120.64 123.62 1wnb n GLU 378 Ca -0.19 0.63 -0.18 0.00 0.66 0.00 0.00 57.16 58.08 1wnb n GLU 378 Cb 0.53 -2.36 -0.10 0.00 0.27 0.00 0.00 31.44 29.78 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 3.31 1.33 -2.69 6.31 0.31 -1.26 -5.03 118.33 120.61 1wnb n VAL 379 Ca 0.18 -0.48 -0.11 0.00 -0.01 0.00 0.00 64.34 63.93 1wnb n VAL 379 Cb 0.25 -1.41 0.02 0.00 -0.91 0.00 0.00 33.84 31.78 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 -3.35 -1.02 -4.21 3.52 7.35 -1.26 -4.80 117.46 113.69 1wnb n PHE 380 Ca -0.42 0.29 -0.18 0.00 -0.76 0.00 0.00 57.45 56.38 1wnb n PHE 380 Cb 0.92 -2.73 -0.06 0.00 0.35 0.00 0.00 39.48 37.95 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 -2.91 2.07 -1.11 7.13 0.00 -1.21 -4.16 107.32 107.13 1wnb s GLY 381 Ca 0.17 -1.89 -0.11 0.00 0.00 0.00 0.00 44.72 42.88 1wnb s GLY 381 CO 0.21 -1.30 2.27 -1.55 0.00 0.00 0.00 173.10 172.73 1wnb n PRO 382 N -0.62 2.41 -3.73 2.90 -0.04 -0.54 -4.25 135.00 131.13 1wnb n PRO 382 Ca 0.05 -1.85 -0.16 0.00 -0.04 0.00 0.00 63.50 61.51 1wnb n PRO 382 Cb 0.62 -2.73 -0.16 0.00 -0.04 0.00 0.00 33.50 31.18 1wnb n PRO 382 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1wnb s VAL 383 N 3.46 -0.10 -0.03 0.52 1.01 -1.26 -0.62 120.40 123.38 1wnb s VAL 383 Ca 0.51 0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.79 1wnb s VAL 383 Cb 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.35 1wnb s VAL 383 CO -0.01 0.11 -0.12 -0.69 0.00 0.00 0.00 175.10 174.39 1wnb s VAL 384 N 1.51 1.01 0.12 2.92 1.01 -0.53 -4.80 120.40 121.65 1wnb s VAL 384 Ca -0.04 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.52 1wnb s VAL 384 Cb -0.12 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1wnb s VAL 384 CO -0.04 0.30 -0.03 -0.94 0.00 0.00 0.00 175.10 174.39 1wnb s SER 385 N 0.13 4.74 -0.11 3.32 1.04 -0.79 0.44 113.70 122.46 1wnb s SER 385 Ca -0.03 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.10 1wnb s SER 385 Cb -0.09 -1.02 0.02 0.00 0.10 0.00 0.00 66.02 65.02 1wnb s SER 385 CO 0.01 0.15 -0.14 -0.69 0.98 0.00 0.00 173.24 173.54 1wnb s VAL 386 N -1.42 1.44 -0.16 5.02 1.01 0.16 -0.47 120.40 125.98 1wnb s VAL 386 Ca 0.25 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.64 1wnb s VAL 386 Cb -0.11 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.96 1wnb s VAL 386 CO 0.17 0.43 -0.19 -0.89 0.00 0.00 0.00 175.10 174.62 1wnb s THR 387 N 1.01 2.27 0.23 3.92 2.01 0.84 -1.84 115.64 124.07 1wnb s THR 387 Ca -0.06 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 60.74 1wnb s THR 387 Cb -0.15 -1.94 -0.09 0.00 0.01 0.00 0.00 72.50 70.34 1wnb s THR 387 CO -0.02 0.53 1.23 -2.16 -0.69 0.00 0.00 174.62 173.51 1wnb s PRO 388 N 0.97 4.47 0.24 4.92 0.04 -1.26 -0.33 135.00 144.06 1wnb s PRO 388 Ca -0.03 1.96 0.07 0.00 0.04 0.00 0.00 61.00 63.04 1wnb s PRO 388 Cb -0.15 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.15 1wnb s PRO 388 CO -0.04 -0.09 -0.09 -0.59 0.04 0.00 0.00 177.00 176.22 1wnb s PHE 389 N -0.37 1.82 -0.27 0.56 -0.12 -0.93 -4.86 117.98 113.82 1wnb s PHE 389 Ca 0.52 -0.66 -0.10 0.00 -0.05 0.00 0.00 56.93 56.64 1wnb s PHE 389 Cb -0.35 -0.96 -0.14 0.00 -0.63 0.00 0.00 43.02 40.95 1wnb s PHE 389 CO 0.40 0.30 -0.28 -0.25 -0.05 0.00 0.00 175.22 175.33 1wnb n ASP 390 N -0.48 1.96 -3.99 1.98 8.00 -1.26 -0.85 116.55 121.91 1wnb n ASP 390 Ca -0.07 0.21 -0.09 0.00 0.71 0.00 0.00 54.79 55.56 1wnb n ASP 390 Cb 0.62 -0.72 -0.08 0.00 -0.02 0.00 0.00 41.12 40.92 1wnb n ASP 390 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wnb s ASN 391 N -7.20 0.24 0.20 -2.24 4.22 -1.26 -4.81 114.94 104.09 1wnb s ASN 391 Ca -0.37 -0.88 -0.11 0.00 -2.14 0.00 0.00 52.86 49.36 1wnb s ASN 391 Cb 0.13 0.31 0.21 0.00 1.28 0.00 0.00 41.25 43.18 1wnb s ASN 391 CO 0.53 -0.72 1.78 -0.08 -2.04 0.00 0.00 177.10 176.57 1wnb h GLU 392 N 2.84 0.51 -0.36 3.55 4.81 -1.99 -1.55 114.58 122.39 1wnb h GLU 392 Ca -0.34 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 58.76 1wnb h GLU 392 Cb 1.19 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1wnb h GLU 392 CO 0.58 0.34 -0.18 1.49 -0.73 0.00 0.00 179.01 180.50 1wnb h GLU 393 N 0.53 0.76 -0.10 1.92 4.81 -1.99 -1.67 114.58 118.83 1wnb h GLU 393 Ca 0.27 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1wnb h GLU 393 Cb 0.23 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1wnb h GLU 393 CO -0.21 0.95 0.06 0.37 -0.73 0.00 0.00 179.01 179.46 1wnb h GLN 394 N 0.54 0.13 -0.19 1.92 4.15 -1.95 -1.72 115.11 118.00 1wnb h GLN 394 Ca 0.08 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.36 1wnb h GLN 394 Cb 0.73 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.38 1wnb h GLN 394 CO 0.05 0.10 -0.44 -0.24 -1.93 0.00 0.00 178.83 176.37 1wnb h VAL 395 N 0.13 1.31 -0.64 2.39 3.04 -1.21 0.16 116.25 121.42 1wnb h VAL 395 Ca 0.04 -1.63 -0.05 0.00 -1.01 0.00 0.00 66.70 64.04 1wnb h VAL 395 Cb -0.00 1.65 -0.03 0.00 -2.01 0.00 0.00 31.29 30.90 1wnb h VAL 395 CO -0.01 0.50 0.19 0.58 -1.01 0.00 0.00 177.57 177.82 1wnb h VAL 396 N 0.37 1.25 -0.68 1.51 2.07 -1.23 0.32 116.25 119.86 1wnb h VAL 396 Ca 0.03 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.61 1wnb h VAL 396 Cb 0.93 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1wnb h VAL 396 CO 0.08 0.34 0.20 0.78 0.02 0.00 0.00 177.57 178.98 1wnb h ASN 397 N 0.93 1.01 -0.27 0.57 2.35 -1.19 -0.58 115.58 118.41 1wnb h ASN 397 Ca 0.21 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1wnb h ASN 397 Cb 0.32 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1wnb h ASN 397 CO -0.00 0.96 0.13 -0.50 -1.65 0.00 0.00 177.43 176.37 1wnb h TRP 398 N 1.00 0.38 -0.70 1.19 6.55 -0.53 -2.30 115.95 121.55 1wnb h TRP 398 Ca 0.22 -0.02 -0.06 0.00 0.95 0.00 0.00 58.89 59.98 1wnb h TRP 398 Cb 0.32 -0.12 -0.03 0.00 -0.86 0.00 0.00 29.16 28.47 1wnb h TRP 398 CO 0.02 0.35 0.21 0.00 -1.05 0.00 0.00 178.44 177.97 1wnb h ALA 399 N 1.00 0.92 0.00 1.49 0.00 -0.14 -2.71 119.26 119.82 1wnb h ALA 399 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1wnb h ALA 399 Cb 0.10 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1wnb h ALA 399 CO -0.01 0.61 0.00 0.09 0.00 0.00 0.00 179.25 179.94 1wnb n ASN 400 N -4.29 0.19 -3.67 0.00 3.02 -0.24 -4.13 115.26 106.13 1wnb n ASN 400 Ca 0.05 0.53 -0.41 0.00 -0.03 0.00 0.00 54.58 54.72 1wnb n ASN 400 Cb 0.23 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 1wnb n ASN 400 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wnb n ASP 401 N -1.69 6.86 -4.07 6.41 2.03 -0.87 -4.89 116.55 120.32 1wnb n ASP 401 Ca 0.05 -3.22 -0.08 0.00 0.52 0.00 0.00 54.79 52.06 1wnb n ASP 401 Cb 0.28 -1.37 -0.10 0.00 -0.72 0.00 0.00 41.12 39.21 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 0.09 0.49 0.00 1.67 0.15 -1.26 -5.01 113.70 109.84 1wnb s SER 402 Ca 0.45 -0.89 0.23 0.00 0.70 0.00 0.00 55.95 56.45 1wnb s SER 402 Cb 0.14 0.17 0.52 0.00 -1.71 0.00 0.00 66.02 65.14 1wnb s SER 402 CO -0.05 -0.52 1.44 0.00 1.20 0.00 0.00 173.24 175.32 1wnb n GLN 403 N 0.44 2.18 -3.65 5.44 10.64 -1.26 -4.91 117.38 126.26 1wnb n GLN 403 Ca -0.16 -1.76 -0.21 0.00 -1.83 0.00 0.00 57.00 53.04 1wnb n GLN 403 Cb 0.60 -1.47 -0.01 0.00 -0.86 0.00 0.00 30.24 28.50 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 -1.74 3.37 0.00 2.61 2.02 -1.26 -0.59 117.35 121.76 1wnb s TYR 404 Ca 0.35 0.04 0.02 0.00 -0.37 0.00 0.00 57.07 57.10 1wnb s TYR 404 Cb 0.21 -1.79 0.03 0.00 -0.40 0.00 0.00 41.96 40.00 1wnb s TYR 404 CO 0.30 0.21 0.78 0.41 -1.57 0.00 0.00 175.55 175.68 1wnb n GLY 405 N -1.60 0.76 0.07 0.71 0.00 -1.21 -4.86 105.19 99.07 1wnb n GLY 405 Ca -0.05 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 1wnb n GLY 405 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wnb h LEU 406 N 0.06 0.00 -8.07 0.99 5.85 -1.82 0.96 115.31 113.28 1wnb h LEU 406 Ca -0.25 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.27 1wnb h LEU 406 Cb 1.25 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 42.17 1wnb h LEU 406 CO -0.11 0.86 -0.24 0.00 -0.34 0.00 0.00 178.44 178.61 1wnb s ALA 407 N -2.63 -0.15 -0.15 1.25 0.00 -1.26 -1.53 121.76 117.29 1wnb s ALA 407 Ca -0.15 -0.81 -0.34 0.00 0.00 0.00 0.00 51.96 50.65 1wnb s ALA 407 Cb 0.02 0.93 0.14 0.00 0.00 0.00 0.00 23.12 24.20 1wnb s ALA 407 CO 0.27 -0.71 1.24 -1.54 0.00 0.00 0.00 175.76 175.02 1wnb s SER 408 N -2.97 -0.11 0.09 0.00 1.04 -0.61 -4.04 113.70 107.10 1wnb s SER 408 Ca 0.18 -0.04 -0.11 0.00 0.48 0.00 0.00 55.95 56.46 1wnb s SER 408 Cb 0.02 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.29 1wnb s SER 408 CO 0.02 -0.24 0.26 -0.94 0.98 0.00 0.00 173.24 173.32 1wnb s SER 409 N -2.39 -0.00 -0.05 7.02 1.04 0.28 -1.08 113.70 118.52 1wnb s SER 409 Ca 0.11 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 56.08 1wnb s SER 409 Cb 0.01 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1wnb s SER 409 CO -0.04 -0.73 -0.15 0.54 0.98 0.00 0.00 173.24 173.84 1wnb s VAL 410 N -3.58 1.27 -0.23 5.02 0.11 -0.01 -0.76 120.40 122.22 1wnb s VAL 410 Ca 0.02 -0.60 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 1wnb s VAL 410 Cb 0.03 -1.12 0.05 0.00 -1.53 0.00 0.00 36.38 33.81 1wnb s VAL 410 CO -0.10 0.38 -0.13 0.26 -3.33 0.00 0.00 175.10 172.18 1wnb s TRP 411 N 0.32 2.93 -0.12 1.54 0.52 0.18 -0.59 118.94 123.72 1wnb s TRP 411 Ca -0.09 -1.99 -0.30 0.00 0.02 0.00 0.00 56.10 53.74 1wnb s TRP 411 Cb -0.13 -1.85 0.11 0.00 -1.15 0.00 0.00 33.47 30.45 1wnb s TRP 411 CO 0.03 -0.83 0.88 -0.08 0.02 0.00 0.00 176.95 176.97 1wnb s THR 412 N 1.22 0.00 -0.25 2.01 -1.32 -1.26 -1.69 115.64 114.35 1wnb s THR 412 Ca -0.04 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.66 1wnb s THR 412 Cb -0.18 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.85 1wnb s THR 412 CO -0.08 0.00 1.12 0.11 -2.21 0.00 0.00 174.62 173.57 1wnb h LYS 413 N 2.72 0.00 -6.39 7.08 1.57 -1.94 -3.46 116.57 116.15 1wnb h LYS 413 Ca -0.22 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.02 1wnb h LYS 413 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1wnb h LYS 413 CO 0.34 0.05 0.82 0.34 -0.57 0.00 0.00 179.45 180.43 1wnb s ASP 414 N -5.58 6.85 0.12 0.86 2.15 -1.26 -4.95 116.67 114.86 1wnb s ASP 414 Ca 0.01 2.13 -0.18 0.00 0.43 0.00 0.00 52.55 54.93 1wnb s ASP 414 Cb 0.09 -2.56 -0.04 0.00 -0.30 0.00 0.00 42.92 40.10 1wnb s ASP 414 CO 0.77 -0.71 1.68 0.58 -0.17 0.00 0.00 175.17 177.32 1wnb h VAL 415 N 4.86 1.16 -0.12 1.11 2.07 -2.00 -2.58 116.25 120.75 1wnb h VAL 415 Ca -0.38 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 66.69 1wnb h VAL 415 Cb 1.18 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1wnb h VAL 415 CO 0.90 0.17 -0.50 1.23 0.02 0.00 0.00 177.57 179.38 1wnb h GLY 416 N 0.34 -0.96 0.98 2.17 0.00 -2.00 -2.13 103.07 101.47 1wnb h GLY 416 Ca 0.10 0.63 -0.01 0.00 0.00 0.00 0.00 47.33 48.04 1wnb h GLY 416 CO -0.01 -0.21 0.28 -0.09 0.00 0.00 0.00 176.54 176.50 1wnb h ARG 417 N -0.57 0.72 -1.00 4.80 2.43 -1.99 0.65 114.38 119.42 1wnb h ARG 417 Ca 0.05 -0.09 0.05 0.00 -0.81 0.00 0.00 59.98 59.18 1wnb h ARG 417 Cb 0.67 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.02 1wnb h ARG 417 CO -0.42 0.57 0.65 0.00 -1.51 0.00 0.00 179.97 179.26 1wnb h ALA 418 N 1.11 1.38 -0.07 2.80 0.00 -1.23 -1.23 119.26 122.02 1wnb h ALA 418 Ca 0.18 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1wnb h ALA 418 Cb 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1wnb h ALA 418 CO -0.03 0.49 -0.23 0.45 0.00 0.00 0.00 179.25 179.93 1wnb h HIS 419 N 1.21 0.37 -0.45 0.00 3.86 -0.92 -2.34 115.15 116.89 1wnb h HIS 419 Ca 0.42 -0.15 0.09 0.00 -1.16 0.00 0.00 60.37 59.57 1wnb h HIS 419 Cb 0.10 -0.06 -0.09 0.00 1.06 0.00 0.00 27.41 28.41 1wnb h HIS 419 CO -0.00 0.85 -0.20 0.00 0.86 0.00 0.00 177.93 179.43 1wnb h ARG 420 N -0.21 -0.11 -0.24 2.45 3.08 -0.74 -1.16 114.38 117.45 1wnb h ARG 420 Ca -0.01 0.01 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 1wnb h ARG 420 Cb 0.86 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1wnb h ARG 420 CO 0.05 -0.07 -0.62 0.28 -1.07 0.00 0.00 179.97 178.54 1wnb h VAL 421 N -0.11 1.28 -0.92 2.04 2.07 -1.29 -2.62 116.25 116.69 1wnb h VAL 421 Ca 0.21 -1.81 0.02 0.00 0.82 0.00 0.00 66.70 65.94 1wnb h VAL 421 Cb 0.44 1.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 1wnb h VAL 421 CO -0.52 0.58 0.61 0.28 0.02 0.00 0.00 177.57 178.55 1wnb h SER 422 N 0.62 1.04 -0.10 0.57 0.02 -1.30 -1.63 113.55 112.77 1wnb h SER 422 Ca -0.01 -0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.81 1wnb h SER 422 Cb 1.23 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 1wnb h SER 422 CO 0.13 0.74 -0.31 0.00 -1.14 0.00 0.00 176.83 176.25 1wnb h ALA 423 N 1.44 0.94 0.00 3.77 0.00 -1.14 -3.28 119.26 120.99 1wnb h ALA 423 Ca 0.35 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1wnb h ALA 423 Cb -0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1wnb h ALA 423 CO -0.09 0.61 -0.89 0.00 0.00 0.00 0.00 179.25 178.88 1wnb h ARG 424 N 0.50 0.00 -6.73 0.00 3.08 -1.07 -3.47 114.38 106.69 1wnb h ARG 424 Ca 0.06 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.59 1wnb h ARG 424 Cb 0.79 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.88 1wnb h ARG 424 CO 0.06 0.26 0.71 -0.51 -1.07 0.00 0.00 179.97 179.42 1wnb s LEU 425 N -5.95 4.40 -1.06 3.04 1.43 -0.65 -4.90 118.68 114.99 1wnb s LEU 425 Ca 0.01 2.56 -0.03 0.00 -1.03 0.00 0.00 54.13 55.64 1wnb s LEU 425 Cb 0.08 -3.62 0.24 0.00 0.03 0.00 0.00 46.19 42.92 1wnb s LEU 425 CO 0.77 -0.62 2.09 0.00 0.23 0.00 0.00 176.35 178.83 1wnb n GLN 426 N 2.36 4.69 -4.10 1.70 6.02 -1.26 -4.91 117.38 121.88 1wnb n GLN 426 Ca 0.06 -4.00 -0.17 0.00 -0.01 0.00 0.00 57.00 52.88 1wnb n GLN 426 Cb 0.41 -2.48 -0.15 0.00 1.02 0.00 0.00 30.24 29.05 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 -3.13 0.48 0.64 1.08 1.51 -1.26 -4.54 117.35 112.12 1wnb s TYR 427 Ca 0.47 -0.09 0.32 0.00 -1.01 0.00 0.00 57.07 56.75 1wnb s TYR 427 Cb 0.23 -0.39 1.72 0.00 -0.11 0.00 0.00 41.96 43.41 1wnb s TYR 427 CO -0.16 -0.07 2.02 0.78 -1.11 0.00 0.00 175.55 177.01 1wnb h GLY 428 N 6.53 0.00 -4.77 0.71 0.00 -0.42 -3.41 103.07 101.71 1wnb h GLY 428 Ca -0.33 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 1wnb h GLY 428 CO 0.49 0.00 -0.23 0.00 0.00 0.00 0.00 176.54 176.81 1wnb s THR 430 N -0.70 0.62 0.23 0.00 2.01 -1.26 -1.57 115.64 114.97 1wnb s THR 430 Ca -0.08 -0.13 -0.00 0.00 0.31 0.00 0.00 61.69 61.79 1wnb s THR 430 Cb -0.04 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 1wnb s THR 430 CO 0.03 0.26 0.42 0.26 -0.69 0.00 0.00 174.62 174.90 1wnb s TRP 431 N 1.19 3.48 -0.17 4.92 0.51 -0.24 -4.97 118.94 123.66 1wnb s TRP 431 Ca -0.06 0.33 0.01 0.00 -2.12 0.00 0.00 56.10 54.25 1wnb s TRP 431 Cb -0.14 -1.85 0.03 0.00 -0.81 0.00 0.00 33.47 30.70 1wnb s TRP 431 CO -0.02 0.33 -0.12 0.08 -0.51 0.00 0.00 176.95 176.72 1wnb s VAL 432 N -1.96 1.60 -1.52 4.03 1.01 -1.26 -0.83 120.40 121.47 1wnb s VAL 432 Ca 0.39 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 1wnb s VAL 432 Cb -0.11 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.68 1wnb s VAL 432 CO 0.30 0.31 0.07 0.59 0.00 0.00 0.00 175.10 176.37 1wnb n ASN 433 N 4.73 -5.24 -1.99 3.32 3.02 0.25 -4.93 115.26 114.42 1wnb n ASN 433 Ca -0.16 0.02 -0.01 0.00 -0.03 0.00 0.00 54.58 54.39 1wnb n ASN 433 Cb 0.48 -4.37 0.01 0.00 -0.61 0.00 0.00 39.78 35.29 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 -3.86 0.00 -3.70 3.41 5.66 -1.26 -5.03 114.28 109.50 1wnb n THR 434 Ca -0.20 -0.25 -0.08 0.00 -3.05 0.00 0.00 64.05 60.47 1wnb n THR 434 Cb 0.65 0.34 -0.02 0.00 -1.55 0.00 0.00 70.33 69.75 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 -4.38 -0.30 0.00 1.09 2.46 -1.26 -4.67 115.29 108.23 1wnb s HIS 435 Ca 0.10 -0.05 0.00 0.00 0.47 0.00 0.00 55.06 55.57 1wnb s HIS 435 Cb -0.01 0.65 0.00 0.00 -0.13 0.00 0.00 32.58 33.09 1wnb s HIS 435 CO 0.02 -1.04 0.00 0.34 -2.47 0.00 0.00 174.74 171.59 1wnb n PHE 436 N -0.43 0.00 -2.30 3.88 -0.00 -1.26 -4.98 117.46 112.38 1wnb n PHE 436 Ca -0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.94 1wnb n PHE 436 Cb 0.61 -0.03 -0.02 0.00 -0.00 0.00 0.00 39.48 40.04 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 0.00 4.09 0.12 -4.13 -1.94 -1.26 -5.02 119.30 111.16 1wnb s MET 437 Ca 0.00 1.68 0.11 0.00 -1.71 0.00 0.00 55.69 55.76 1wnb s MET 437 Cb 0.00 -3.87 -0.04 0.00 2.01 0.00 0.00 34.83 32.93 1wnb s MET 437 CO 0.00 -0.91 -0.26 -0.51 -0.01 0.00 0.00 175.02 173.33 1wnb s LEU 438 N 4.04 2.33 0.03 -0.03 1.43 -1.26 -5.12 118.68 120.10 1wnb s LEU 438 Ca 0.61 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1wnb s LEU 438 Cb -0.23 -1.26 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 1wnb s LEU 438 CO 0.21 0.19 0.02 0.68 0.23 0.00 0.00 176.35 177.68 1wnb s VAL 439 N -1.03 0.13 0.52 -1.59 -7.23 -1.26 -5.07 120.40 104.86 1wnb s VAL 439 Ca 0.14 -1.05 0.20 0.00 -1.81 0.00 0.00 61.98 59.46 1wnb s VAL 439 Cb -0.10 -0.59 0.28 0.00 0.56 0.00 0.00 36.38 36.53 1wnb s VAL 439 CO 0.06 -0.58 2.15 0.28 -0.31 0.00 0.00 175.10 176.70 1wnb h SER 440 N 4.19 0.00 1.54 4.85 0.02 -1.96 -2.00 113.55 120.19 1wnb h SER 440 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 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 0.46 0.03 0.00 -0.33 -1.14 0.00 0.00 176.83 175.86 1wnb h GLU 441 N 0.00 0.00 -5.57 3.45 3.07 -1.96 -0.40 114.58 113.17 1wnb h GLU 441 Ca -0.00 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 58.20 1wnb h GLU 441 Cb 0.07 0.00 -0.22 0.00 -0.84 0.00 0.00 28.75 27.76 1wnb h GLU 441 CO 0.00 0.00 -0.70 -1.64 -1.40 0.00 0.00 179.01 175.27 1wnb s MET 442 N -3.16 3.31 0.42 2.33 -1.94 -0.75 -4.33 119.30 115.18 1wnb s MET 442 Ca 0.09 -0.57 -0.24 0.00 -1.71 0.00 0.00 55.69 53.26 1wnb s MET 442 Cb 0.10 -2.74 -0.08 0.00 2.01 0.00 0.00 34.83 34.12 1wnb s MET 442 CO 0.60 0.37 1.14 -1.25 -0.01 0.00 0.00 175.02 175.86 1wnb s PRO 443 N -0.01 3.96 -0.12 2.03 0.04 -1.26 -4.42 135.00 135.22 1wnb s PRO 443 Ca -0.01 1.73 0.02 0.00 0.04 0.00 0.00 61.00 62.78 1wnb s PRO 443 Cb -0.14 -2.53 0.01 0.00 0.04 0.00 0.00 34.50 31.89 1wnb s PRO 443 CO 0.03 -0.37 -0.18 -1.58 0.04 0.00 0.00 177.00 174.94 1wnb s HIS 444 N -1.53 2.27 0.00 0.56 2.46 0.21 -4.95 115.29 114.31 1wnb s HIS 444 Ca 0.60 -1.09 0.00 0.00 0.47 0.00 0.00 55.06 55.04 1wnb s HIS 444 Cb -0.28 -1.59 0.00 0.00 -0.13 0.00 0.00 32.58 30.59 1wnb s HIS 444 CO 0.34 -0.52 0.00 0.41 -2.47 0.00 0.00 174.74 172.50 1wnb n GLY 445 N 4.09 2.26 0.00 1.59 0.00 -1.26 -0.23 105.19 111.64 1wnb n GLY 445 Ca -0.19 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.64 2.63 3.45 -0.02 0.00 -1.26 -4.06 105.19 105.29 1wnb n GLY 446 Ca 0.00 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.54 1.62 5.62 1.61 -2.07 -1.08 -4.34 119.66 119.47 1wnb s GLN 447 Ca 0.00 -1.57 0.00 0.00 -1.82 0.00 0.00 55.36 51.97 1wnb s GLN 447 Cb 0.00 0.41 0.00 0.00 -1.09 0.00 0.00 33.01 32.33 1wnb s GLN 447 CO 0.00 -0.64 0.00 1.63 -1.32 0.00 0.00 175.29 174.96 1wnb n LYS 448 N -0.44 0.00 0.00 9.60 5.02 -1.26 -2.79 118.16 128.29 1wnb n LYS 448 Ca 0.01 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.44 1wnb n LYS 448 Cb 0.63 0.00 0.71 0.00 -0.02 0.00 0.00 35.03 36.35 1wnb n LYS 448 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wnb n LEU 449 N 0.00 0.19 0.05 -0.35 4.32 0.24 -2.16 117.00 119.28 1wnb n LEU 449 Ca 0.00 0.15 0.08 0.00 -0.02 0.00 0.00 56.01 56.22 1wnb n LEU 449 Cb 0.00 -0.23 0.34 0.00 -1.62 0.00 0.00 43.42 41.92 1wnb n LEU 449 CO 0.00 0.04 0.75 -1.20 -1.22 0.00 0.00 177.39 175.75 1wnb n SER 450 N -1.14 0.22 0.00 -1.43 7.64 -1.12 -4.65 113.62 113.15 1wnb n SER 450 Ca 0.15 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.59 1wnb n SER 450 Cb 0.25 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1wnb n SER 450 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wnb n GLY 451 N -0.24 0.09 3.82 0.23 0.00 -0.92 -0.89 105.19 107.29 1wnb n GLY 451 Ca 0.02 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.07 0.00 1.61 -0.85 0.59 -2.96 117.35 115.68 1wnb s TYR 452 Ca 0.00 -0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.16 1wnb s TYR 452 Cb 0.00 0.72 0.00 0.00 0.38 0.00 0.00 41.96 43.06 1wnb s TYR 452 CO 0.00 -1.17 0.00 0.41 -1.52 0.00 0.00 175.55 173.27 1wnb n GLY 453 N -0.51 -2.45 3.08 5.49 0.00 -1.26 -2.30 105.19 107.24 1wnb n GLY 453 Ca -0.05 -1.46 -0.18 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.75 0.77 -0.02 1.61 -0.14 -1.26 -4.19 119.74 113.75 1wnb s LYS 454 Ca 0.00 -0.60 -0.02 0.00 -1.36 0.00 0.00 55.97 53.99 1wnb s LYS 454 Cb 0.00 -0.72 -0.04 0.00 -1.68 0.00 0.00 37.83 35.39 1wnb s LYS 454 CO 0.00 0.18 0.15 -0.51 -0.76 0.00 0.00 175.35 174.41 1wnb s ASP 455 N -0.89 6.16 0.34 2.83 1.01 0.68 -4.18 116.67 122.61 1wnb s ASP 455 Ca -0.00 0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.56 1wnb s ASP 455 Cb -0.07 -1.89 0.00 0.00 1.01 0.00 0.00 42.92 41.97 1wnb s ASP 455 CO 0.01 0.28 0.00 0.23 0.21 0.00 0.00 175.17 175.90 1wnb n MET 456 N 1.14 -2.31 -0.70 8.23 2.81 -1.26 -0.62 117.12 124.41 1wnb n MET 456 Ca -0.13 1.68 0.09 0.00 -1.81 0.00 0.00 57.70 57.53 1wnb n MET 456 Cb 0.53 -2.77 -0.04 0.00 -0.71 0.00 0.00 33.22 30.24 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 -3.76 -4.07 -0.29 7.83 3.41 -0.16 -2.77 113.62 113.81 1wnb n SER 457 Ca -0.02 0.57 0.16 0.00 -0.26 0.00 0.00 58.87 59.31 1wnb n SER 457 Cb 0.50 -2.31 0.41 0.00 -0.26 0.00 0.00 64.21 62.56 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 -0.68 0.60 -1.41 1.04 3.38 -1.86 -1.67 115.31 114.71 1wnb h LEU 458 Ca -0.06 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.11 1wnb h LEU 458 Cb 0.66 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 1wnb h LEU 458 CO 0.03 0.24 0.54 1.88 0.09 0.00 0.00 178.44 181.22 1wnb h TYR 459 N 0.60 0.68 0.00 1.13 0.05 -1.94 -0.15 116.97 117.34 1wnb h TYR 459 Ca 0.51 0.02 -0.14 0.00 0.05 0.00 0.00 58.73 59.17 1wnb h TYR 459 Cb 0.99 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.50 1wnb h TYR 459 CO -0.00 0.26 -0.68 0.78 -1.05 0.00 0.00 178.16 177.47 1wnb h GLY 460 N 0.58 0.00 0.93 3.88 0.00 -1.12 -1.71 103.07 105.64 1wnb h GLY 460 Ca 0.41 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.60 1wnb h GLY 460 CO -0.16 0.00 -0.44 -2.00 0.00 0.00 0.00 176.54 173.94 1wnb h LEU 461 N 0.00 0.68 -1.33 3.11 5.85 -1.25 -3.32 115.31 119.05 1wnb h LEU 461 Ca -0.01 -0.58 0.02 0.00 0.84 0.00 0.00 57.88 58.16 1wnb h LEU 461 Cb 1.39 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 1wnb h LEU 461 CO 0.09 1.14 0.47 -0.33 -0.34 0.00 0.00 178.44 179.46 1wnb h GLU 462 N 0.26 0.87 0.00 1.25 5.08 -0.79 -1.84 114.58 119.41 1wnb h GLU 462 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1wnb h GLU 462 Cb 1.05 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1wnb h GLU 462 CO 0.09 0.58 0.19 -0.44 -1.00 0.00 0.00 179.01 178.43 1wnb h ASP 463 N 0.90 0.00 -0.34 1.42 3.32 -1.41 -1.89 116.42 118.42 1wnb h ASP 463 Ca 0.27 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.19 1wnb h ASP 463 Cb -0.02 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.46 1wnb h ASP 463 CO -0.07 0.00 -0.02 -1.22 -1.72 0.00 0.00 179.24 176.21 1wnb n TYR 464 N -2.33 1.09 -4.30 4.55 4.01 -0.69 -4.99 117.16 114.50 1wnb n TYR 464 Ca -0.01 -1.35 -0.17 0.00 -0.16 0.00 0.00 57.90 56.21 1wnb n TYR 464 Cb 0.22 -0.44 -0.10 0.00 -0.31 0.00 0.00 39.34 38.71 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 -3.10 1.47 -0.15 -0.72 -4.23 -0.71 -4.15 115.64 104.05 1wnb s THR 465 Ca 0.44 -2.10 -0.03 0.00 -1.18 0.00 0.00 61.69 58.82 1wnb s THR 465 Cb 0.38 -1.91 -0.03 0.00 1.34 0.00 0.00 72.50 72.28 1wnb s THR 465 CO 0.03 -0.64 -0.05 0.54 -0.54 0.00 0.00 174.62 173.96 1wnb s VAL 466 N -3.03 3.75 0.13 2.29 0.11 0.92 -4.93 120.40 119.65 1wnb s VAL 466 Ca 0.19 -0.41 -0.29 0.00 -2.93 0.00 0.00 61.98 58.54 1wnb s VAL 466 Cb 0.00 -2.63 -0.07 0.00 -1.53 0.00 0.00 36.38 32.15 1wnb s VAL 466 CO 0.04 0.50 0.90 -0.69 -3.33 0.00 0.00 175.10 172.52 1wnb s VAL 467 N 0.35 4.44 -0.02 2.04 1.01 -1.26 -1.65 120.40 125.30 1wnb s VAL 467 Ca -0.05 1.96 0.02 0.00 0.00 0.00 0.00 61.98 63.91 1wnb s VAL 467 Cb -0.14 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1wnb s VAL 467 CO 0.03 0.39 -0.08 -0.13 0.00 0.00 0.00 175.10 175.31 1wnb s ARG 468 N -0.38 0.88 -0.40 2.72 0.52 -0.35 -4.98 118.95 116.96 1wnb s ARG 468 Ca 0.43 -0.28 -0.17 0.00 -0.52 0.00 0.00 55.73 55.18 1wnb s ARG 468 Cb -0.23 -0.84 0.01 0.00 0.52 0.00 0.00 34.95 34.41 1wnb s ARG 468 CO 0.29 0.11 0.45 -1.58 0.02 0.00 0.00 175.30 174.59 1wnb s HIS 469 N 0.18 3.17 -0.20 -0.53 5.65 -1.26 -0.79 115.29 121.50 1wnb s HIS 469 Ca -0.03 -0.19 -0.07 0.00 0.25 0.00 0.00 55.06 55.03 1wnb s HIS 469 Cb -0.08 -2.90 -0.03 0.00 -1.18 0.00 0.00 32.58 28.39 1wnb s HIS 469 CO 0.00 -0.64 0.05 0.08 -0.65 0.00 0.00 174.74 173.59 1wnb s VAL 470 N 2.22 4.47 -0.12 0.89 1.01 -0.47 -4.99 120.40 123.40 1wnb s VAL 470 Ca 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1wnb s VAL 470 Cb -0.16 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.20 1wnb s VAL 470 CO 0.14 0.42 -0.11 -0.32 0.00 0.00 0.00 175.10 175.22 1wnb s MET 471 N 0.84 1.92 -0.28 2.72 0.00 -1.26 -1.07 119.30 122.16 1wnb s MET 471 Ca 0.03 -0.42 -0.06 0.00 0.00 0.00 0.00 55.69 55.24 1wnb s MET 471 Cb -0.14 -1.80 0.01 0.00 0.00 0.00 0.00 34.83 32.90 1wnb s MET 471 CO 0.02 -0.21 0.06 0.08 0.00 0.00 0.00 175.02 174.97 1wnb s VAL 472 N 1.45 3.80 0.22 10.11 1.01 0.57 -4.93 120.40 132.63 1wnb s VAL 472 Ca 0.02 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 1wnb s VAL 472 Cb -0.13 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 1wnb s VAL 472 CO -0.07 0.11 1.31 -0.75 0.00 0.00 0.00 175.10 175.70 1wnb s LYS 473 N 1.48 4.39 0.00 2.72 2.20 -1.26 -1.03 119.74 128.23 1wnb s LYS 473 Ca 0.02 2.08 0.21 0.00 -0.36 0.00 0.00 55.97 57.92 1wnb s LYS 473 Cb -0.17 -3.17 1.23 0.00 -1.51 0.00 0.00 37.83 34.21 1wnb s LYS 473 CO 0.01 -0.23 1.61 0.72 -0.36 0.00 0.00 175.35 177.10