#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx3 s ALA 2 N 0.00 3.56 0.74 3.17 0.00 -1.26 -4.32 121.76 123.65 1yx3 s ALA 2 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 51.56 1yx3 s ALA 2 Cb 0.00 -2.45 0.15 0.00 0.00 0.00 0.00 23.12 20.82 1yx3 s ALA 2 CO 0.00 0.07 1.01 -3.47 0.00 0.00 0.00 175.76 173.37 1yx3 n ASP 3 N 3.61 1.36 -3.71 0.00 -0.08 -0.81 -4.83 116.55 112.09 1yx3 n ASP 3 Ca -0.11 -2.15 -0.16 0.00 -1.51 0.00 0.00 54.79 50.87 1yx3 n ASP 3 Cb 0.52 -0.66 -0.16 0.00 2.34 0.00 0.00 41.12 43.17 1yx3 n ASP 3 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1yx3 s THR 4 N -3.13 -0.14 -0.14 5.18 -4.23 -1.26 -0.04 115.64 111.89 1yx3 s THR 4 Ca 0.67 0.28 -0.13 0.00 -1.18 0.00 0.00 61.69 61.33 1yx3 s THR 4 Cb -0.04 -0.23 -0.05 0.00 1.34 0.00 0.00 72.50 73.53 1yx3 s THR 4 CO 0.44 0.12 0.28 0.27 -0.54 0.00 0.00 174.62 175.19 1yx3 s ILE 5 N 1.70 5.30 -0.45 2.99 -4.36 -0.10 -4.81 121.20 121.47 1yx3 s ILE 5 Ca -0.03 0.52 -0.25 0.00 -0.26 0.00 0.00 60.65 60.63 1yx3 s ILE 5 Cb -0.12 -3.61 0.03 0.00 1.25 0.00 0.00 42.46 40.01 1yx3 s ILE 5 CO -0.05 0.44 0.91 -0.70 0.24 0.00 0.00 174.94 175.78 1yx3 s GLU 6 N 0.11 3.54 -0.21 0.37 2.56 -1.26 -0.36 118.70 123.45 1yx3 s GLU 6 Ca 0.17 0.16 0.01 0.00 0.00 0.00 0.00 54.97 55.30 1yx3 s GLU 6 Cb -0.13 -3.92 0.05 0.00 2.00 0.00 0.00 34.13 32.13 1yx3 s GLU 6 CO 0.05 -1.19 -0.09 0.08 -0.56 0.00 0.00 175.26 173.55 1yx3 s VAL 7 N 3.68 1.57 0.00 3.70 1.01 0.16 -4.93 120.40 125.59 1yx3 s VAL 7 Ca 0.36 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1yx3 s VAL 7 Cb -0.10 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1yx3 s VAL 7 CO 0.25 0.09 0.00 -0.67 0.00 0.00 0.00 175.10 174.78 1yx3 n ASP 8 N 4.70 0.00 -0.45 3.32 2.03 -1.26 -1.33 116.55 123.56 1yx3 n ASP 8 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1yx3 n ASP 8 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1yx3 n ASP 8 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1yx3 n GLY 9 N 0.00 0.94 3.08 0.27 0.00 -1.26 -5.12 105.19 103.10 1yx3 n GLY 9 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1yx3 n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yx3 s LYS 10 N 0.00 1.19 -0.46 1.61 1.02 -0.44 -5.10 119.74 117.57 1yx3 s LYS 10 Ca 0.00 -0.47 -0.20 0.00 0.02 0.00 0.00 55.97 55.32 1yx3 s LYS 10 Cb 0.00 -1.12 0.03 0.00 -0.52 0.00 0.00 37.83 36.23 1yx3 s LYS 10 CO 0.00 0.24 0.62 -0.65 -0.92 0.00 0.00 175.35 174.64 1yx3 s GLN 11 N -0.14 3.21 -0.31 1.68 -0.21 -1.26 -0.67 119.66 121.97 1yx3 s GLN 11 Ca 0.02 -0.56 -0.20 0.00 0.02 0.00 0.00 55.36 54.64 1yx3 s GLN 11 Cb -0.07 -3.99 -0.01 0.00 1.00 0.00 0.00 33.01 29.93 1yx3 s GLN 11 CO 0.00 -1.06 0.61 -0.06 -2.12 0.00 0.00 175.29 172.66 1yx3 s PHE 12 N 2.72 3.21 0.15 0.91 0.08 0.51 -4.80 117.98 120.77 1yx3 s PHE 12 Ca 0.19 0.54 -0.31 0.00 0.12 0.00 0.00 56.93 57.48 1yx3 s PHE 12 Cb -0.16 -2.98 -0.09 0.00 -0.57 0.00 0.00 43.02 39.23 1yx3 s PHE 12 CO 0.16 -0.48 1.45 0.00 -0.10 0.00 0.00 175.22 176.26 1yx3 s ALA 13 N 2.58 3.65 0.04 5.36 0.00 -1.26 -0.92 121.76 131.21 1yx3 s ALA 13 Ca 0.24 1.23 0.08 0.00 0.00 0.00 0.00 51.96 53.51 1yx3 s ALA 13 Cb -0.15 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 1yx3 s ALA 13 CO 0.12 -0.68 -0.24 0.14 0.00 0.00 0.00 175.76 175.11 1yx3 s VAL 14 N 0.89 2.36 0.91 0.00 -7.23 0.95 -2.10 120.40 116.18 1yx3 s VAL 14 Ca 0.65 -1.30 -0.11 0.00 -1.81 0.00 0.00 61.98 59.41 1yx3 s VAL 14 Cb -0.40 -1.94 0.14 0.00 0.56 0.00 0.00 36.38 34.74 1yx3 s VAL 14 CO 0.33 0.37 1.10 -0.62 -0.31 0.00 0.00 175.10 175.97 1yx3 s ASP 15 N -1.27 3.18 0.60 4.85 2.15 0.15 -1.93 116.67 124.40 1yx3 s ASP 15 Ca 0.13 1.83 0.30 0.00 0.43 0.00 0.00 52.55 55.24 1yx3 s ASP 15 Cb -0.10 -2.42 1.71 0.00 -0.30 0.00 0.00 42.92 41.81 1yx3 s ASP 15 CO 0.03 -2.88 2.09 1.05 -0.17 0.00 0.00 175.17 175.29 1yx3 h GLU 16 N -1.71 0.00 -0.55 4.34 4.11 -1.89 0.13 114.58 119.01 1yx3 h GLU 16 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1yx3 h GLU 16 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1yx3 h GLU 16 CO 0.48 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.95 1yx3 n GLU 17 N -3.64 2.50 -1.79 1.06 1.02 -1.26 -4.96 120.64 113.58 1yx3 n GLU 17 Ca 0.01 -2.31 0.00 0.00 -0.02 0.00 0.00 57.16 54.84 1yx3 n GLU 17 Cb 0.33 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1yx3 n GLU 17 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yx3 n GLY 18 N 1.53 0.45 2.99 0.62 0.00 0.45 -5.07 105.19 106.16 1yx3 n GLY 18 Ca 0.21 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 1yx3 n GLY 18 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yx3 s TYR 19 N -2.78 0.57 -0.13 1.61 1.51 -1.25 -4.89 117.35 111.98 1yx3 s TYR 19 Ca 0.00 -0.17 -0.29 0.00 -1.01 0.00 0.00 57.07 55.60 1yx3 s TYR 19 Cb 0.00 -0.36 -0.06 0.00 -0.11 0.00 0.00 41.96 41.43 1yx3 s TYR 19 CO 0.00 -0.02 2.07 -1.17 -1.11 0.00 0.00 175.55 175.32 1yx3 s LEU 20 N -0.39 3.83 0.06 -1.29 2.96 -1.26 0.31 118.68 122.91 1yx3 s LEU 20 Ca 0.00 2.12 0.21 0.00 -0.22 0.00 0.00 54.13 56.24 1yx3 s LEU 20 Cb -0.04 -3.52 -0.16 0.00 0.50 0.00 0.00 46.19 42.98 1yx3 s LEU 20 CO -0.00 -1.58 0.74 -1.54 -1.32 0.00 0.00 176.35 172.65 1yx3 n SER 21 N 9.92 0.53 -4.56 3.68 3.41 -0.89 -4.22 113.62 121.49 1yx3 n SER 21 Ca 0.25 0.22 -0.43 0.00 -0.26 0.00 0.00 58.87 58.65 1yx3 n SER 21 Cb 0.44 0.88 -0.01 0.00 -0.26 0.00 0.00 64.21 65.26 1yx3 n SER 21 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1yx3 s ASN 22 N -5.23 6.75 -1.32 4.04 3.84 -1.17 -4.89 114.94 116.95 1yx3 s ASN 22 Ca -0.04 -2.18 -0.14 0.00 0.21 0.00 0.00 52.86 50.71 1yx3 s ASN 22 Cb 0.10 -2.55 0.11 0.00 -0.55 0.00 0.00 41.25 38.36 1yx3 s ASN 22 CO 0.83 -1.23 1.86 0.18 -2.79 0.00 0.00 177.10 175.95 1yx3 n LEU 23 N 8.21 5.99 -0.01 3.21 4.77 -1.26 -4.53 117.00 133.38 1yx3 n LEU 23 Ca 0.42 -4.28 -0.04 0.00 -0.03 0.00 0.00 56.01 52.08 1yx3 n LEU 23 Cb 0.47 -1.63 -0.01 0.00 -2.33 0.00 0.00 43.42 39.92 1yx3 n LEU 23 CO 0.71 0.86 -0.31 -3.20 -1.33 0.00 0.00 177.39 174.11 1yx3 n ASN 24 N 6.02 1.43 0.01 -1.43 2.85 -1.26 -5.03 115.26 117.85 1yx3 n ASN 24 Ca 0.45 0.22 0.00 0.00 -0.11 0.00 0.00 54.58 55.14 1yx3 n ASN 24 Cb 0.41 -0.50 0.00 0.00 1.24 0.00 0.00 39.78 40.93 1yx3 n ASN 24 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1yx3 n ASP 25 N -3.88 -0.00 -1.43 1.20 2.03 -1.26 -5.15 116.55 108.06 1yx3 n ASP 25 Ca -0.07 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1yx3 n ASP 25 Cb 0.24 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 1yx3 n ASP 25 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1yx3 n TRP 26 N -2.61 -3.00 -4.21 -0.67 -0.00 -1.26 -5.06 117.44 100.64 1yx3 n TRP 26 Ca 0.00 1.80 -0.30 0.00 -0.00 0.00 0.00 57.50 59.00 1yx3 n TRP 26 Cb 0.06 -3.02 -0.09 0.00 -0.00 0.00 0.00 31.31 28.26 1yx3 n TRP 26 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 177.69 177.83 1yx3 s VAL 27 N -0.34 3.49 0.53 5.87 -7.23 -1.26 -5.02 120.40 116.44 1yx3 s VAL 27 Ca 0.00 -1.25 0.26 0.00 -1.81 0.00 0.00 61.98 59.19 1yx3 s VAL 27 Cb 0.00 -2.65 0.42 0.00 0.56 0.00 0.00 36.38 34.71 1yx3 s VAL 27 CO 0.00 0.09 1.96 -0.65 -0.31 0.00 0.00 175.10 176.19 1yx3 h PRO 28 N 3.50 0.03 -0.04 4.82 0.11 -1.97 0.67 132.00 139.12 1yx3 h PRO 28 Ca -0.48 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.64 1yx3 h PRO 28 Cb 1.17 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1yx3 h PRO 28 CO 0.54 0.02 0.04 0.78 -0.21 0.00 0.00 178.00 179.16 1yx3 h GLY 29 N 0.03 0.00 1.10 -0.55 0.00 -1.99 -0.94 103.07 100.72 1yx3 h GLY 29 Ca 0.31 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.59 1yx3 h GLY 29 CO -0.01 0.00 0.27 -2.08 0.00 0.00 0.00 176.54 174.72 1yx3 h VAL 30 N 0.00 1.26 -0.48 4.60 2.07 -1.22 -0.55 116.25 121.92 1yx3 h VAL 30 Ca 0.02 -0.85 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 1yx3 h VAL 30 Cb 0.10 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 1yx3 h VAL 30 CO -0.00 0.34 -0.09 0.00 0.02 0.00 0.00 177.57 177.84 1yx3 h ALA 31 N 1.19 0.65 0.48 1.67 0.00 -1.30 -0.91 119.26 121.03 1yx3 h ALA 31 Ca 0.25 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1yx3 h ALA 31 Cb 0.26 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1yx3 h ALA 31 CO -0.01 0.54 -0.23 -0.44 0.00 0.00 0.00 179.25 179.11 1yx3 h ASP 32 N 0.75 -0.54 0.25 0.00 3.32 -1.09 0.25 116.42 119.36 1yx3 h ASP 32 Ca 0.12 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1yx3 h ASP 32 Cb 0.64 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1yx3 h ASP 32 CO 0.04 -0.38 -0.29 1.62 -1.72 0.00 0.00 179.24 178.52 1yx3 h VAL 33 N -0.65 1.22 0.05 -1.35 3.04 -1.11 -1.61 116.25 115.85 1yx3 h VAL 33 Ca -0.07 -1.05 -0.00 0.00 -1.01 0.00 0.00 66.70 64.57 1yx3 h VAL 33 Cb 0.49 1.52 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1yx3 h VAL 33 CO 0.11 0.30 -0.02 -0.03 -1.01 0.00 0.00 177.57 176.92 1yx3 h MET 34 N 0.06 -0.07 -0.21 4.17 1.85 -0.96 -2.58 114.93 117.19 1yx3 h MET 34 Ca 0.01 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1yx3 h MET 34 Cb 0.54 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.57 1yx3 h MET 34 CO 0.04 0.33 0.14 0.00 -0.40 0.00 0.00 176.91 177.02 1yx3 h ALA 35 N 0.44 1.86 -0.40 0.39 0.00 -0.72 -1.03 119.26 119.80 1yx3 h ALA 35 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1yx3 h ALA 35 Cb 0.42 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1yx3 h ALA 35 CO 0.01 0.12 0.19 -0.22 0.00 0.00 0.00 179.25 179.36 1yx3 h LYS 36 N 0.27 0.58 -0.40 0.00 3.64 -1.18 0.12 116.57 119.60 1yx3 h LYS 36 Ca 0.08 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 1yx3 h LYS 36 Cb -0.01 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1yx3 h LYS 36 CO -0.02 0.51 -0.27 1.96 -2.27 0.00 0.00 179.45 179.36 1yx3 h GLN 37 N 0.51 0.86 -0.00 1.90 4.20 -0.82 -2.51 115.11 119.24 1yx3 h GLN 37 Ca 0.14 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.47 1yx3 h GLN 37 Cb 0.12 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1yx3 h GLN 37 CO -0.02 1.02 -0.02 -0.25 -0.67 0.00 0.00 178.83 178.89 1yx3 n ASP 38 N -4.09 0.17 -3.28 1.46 9.92 -0.59 -4.93 116.55 115.22 1yx3 n ASP 38 Ca -0.00 -0.59 -0.15 0.00 -0.53 0.00 0.00 54.79 53.52 1yx3 n ASP 38 Cb 0.47 -0.13 0.08 0.00 -0.64 0.00 0.00 41.12 40.90 1yx3 n ASP 38 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1yx3 n ASN 39 N -1.05 -5.06 -3.98 -2.24 5.15 -0.34 -5.03 115.26 102.70 1yx3 n ASN 39 Ca 0.18 -0.67 -0.09 0.00 -0.60 0.00 0.00 54.58 53.40 1yx3 n ASN 39 Cb 0.21 -5.11 -0.11 0.00 -0.53 0.00 0.00 39.78 34.24 1yx3 n ASN 39 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1yx3 s LEU 40 N -5.66 2.19 0.29 1.20 2.96 0.27 -5.04 118.68 114.89 1yx3 s LEU 40 Ca 0.30 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.72 1yx3 s LEU 40 Cb -0.04 0.19 -0.02 0.00 0.50 0.00 0.00 46.19 46.81 1yx3 s LEU 40 CO 0.72 -0.35 0.44 -1.61 -1.32 0.00 0.00 176.35 174.23 1yx3 s GLU 41 N -1.82 3.35 -0.26 1.98 8.01 -1.26 -4.29 118.70 124.41 1yx3 s GLU 41 Ca -0.13 -0.73 0.02 0.00 0.01 0.00 0.00 54.97 54.14 1yx3 s GLU 41 Cb -0.07 -2.82 0.07 0.00 -4.31 0.00 0.00 34.13 27.00 1yx3 s GLU 41 CO -0.02 0.26 -0.05 -0.51 0.01 0.00 0.00 175.26 174.94 1yx3 s LEU 42 N -4.12 3.10 0.00 1.80 1.43 -1.26 -5.00 118.68 114.64 1yx3 s LEU 42 Ca 0.38 -1.39 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 1yx3 s LEU 42 Cb -0.09 -1.34 0.08 0.00 0.03 0.00 0.00 46.19 44.87 1yx3 s LEU 42 CO 0.31 -0.25 0.54 0.35 0.23 0.00 0.00 176.35 177.53 1yx3 n THR 43 N 4.55 0.00 -0.32 5.49 -2.24 -1.26 -4.81 114.28 115.69 1yx3 n THR 43 Ca -0.10 -0.73 0.06 0.00 -2.27 0.00 0.00 64.05 61.01 1yx3 n THR 43 Cb 0.43 -1.26 0.25 0.00 -2.10 0.00 0.00 70.33 67.65 1yx3 n THR 43 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1yx3 h GLU 44 N 0.00 0.96 -0.02 -0.78 4.39 -1.99 -1.05 114.58 116.09 1yx3 h GLU 44 Ca -0.18 -0.06 -0.24 0.00 0.34 0.00 0.00 59.36 59.22 1yx3 h GLU 44 Cb 0.61 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1yx3 h GLU 44 CO 0.17 0.64 -0.97 0.93 -1.16 0.00 0.00 179.01 178.62 1yx3 h GLU 45 N 0.99 0.59 0.09 2.33 5.08 -1.99 -2.28 114.58 119.38 1yx3 h GLU 45 Ca 0.44 -0.61 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1yx3 h GLU 45 Cb 0.36 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1yx3 h GLU 45 CO -0.19 1.22 -0.04 0.45 -1.00 0.00 0.00 179.01 179.45 1yx3 h HIS 46 N 0.34 -0.11 -0.29 4.33 3.86 -1.78 -1.65 115.15 119.85 1yx3 h HIS 46 Ca -0.10 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1yx3 h HIS 46 Cb 1.61 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 30.11 1yx3 h HIS 46 CO 0.08 -0.05 0.17 -1.49 0.86 0.00 0.00 177.93 177.50 1yx3 h TRP 47 N -0.14 0.37 -0.07 2.45 4.06 -1.23 0.01 115.95 121.40 1yx3 h TRP 47 Ca -0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1yx3 h TRP 47 Cb 0.11 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.14 1yx3 h TRP 47 CO -0.07 0.25 0.02 0.22 -3.56 0.00 0.00 178.44 175.31 1yx3 h ASP 48 N 0.40 0.10 -0.72 -3.49 1.82 -1.01 -1.49 116.42 112.03 1yx3 h ASP 48 Ca 0.11 -0.20 -0.01 0.00 -0.39 0.00 0.00 57.03 56.53 1yx3 h ASP 48 Cb -0.01 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 39.94 1yx3 h ASP 48 CO -0.02 0.27 0.40 0.40 -1.61 0.00 0.00 179.24 178.68 1yx3 h ILE 49 N -0.08 1.22 -0.01 2.25 1.08 -0.61 0.13 117.51 121.48 1yx3 h ILE 49 Ca 0.02 -0.54 0.02 0.00 -0.39 0.00 0.00 64.86 63.98 1yx3 h ILE 49 Cb 0.21 0.27 -0.03 0.00 -3.07 0.00 0.00 36.82 34.19 1yx3 h ILE 49 CO -0.00 0.24 -0.14 0.40 -0.69 0.00 0.00 178.15 177.96 1yx3 h ILE 50 N 0.99 0.64 -0.27 -0.67 2.04 -0.87 -0.12 117.51 119.25 1yx3 h ILE 50 Ca 0.25 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 66.02 1yx3 h ILE 50 Cb 0.03 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1yx3 h ILE 50 CO -0.04 0.00 -0.22 0.78 0.00 0.00 0.00 178.15 178.67 1yx3 h ASN 51 N -0.23 0.51 -0.48 1.72 2.35 -1.03 -2.64 115.58 115.77 1yx3 h ASN 51 Ca 0.05 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.62 1yx3 h ASN 51 Cb 0.30 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1yx3 h ASN 51 CO -0.15 0.74 0.22 0.15 -1.65 0.00 0.00 177.43 176.74 1yx3 h PHE 52 N 0.46 0.70 -0.55 1.19 3.57 -0.21 -0.27 116.94 121.83 1yx3 h PHE 52 Ca 0.07 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1yx3 h PHE 52 Cb 0.64 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1yx3 h PHE 52 CO 0.02 0.57 0.09 -0.07 -2.23 0.00 0.00 178.31 176.69 1yx3 h LEU 53 N 0.64 0.83 -0.10 0.59 3.38 -0.88 0.39 115.31 120.16 1yx3 h LEU 53 Ca 0.16 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1yx3 h LEU 53 Cb 0.14 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1yx3 h LEU 53 CO -0.02 0.84 0.06 -0.09 0.09 0.00 0.00 178.44 179.32 1yx3 h ARG 54 N 0.84 0.13 -0.79 1.13 2.43 -1.10 -0.63 114.38 116.39 1yx3 h ARG 54 Ca 0.17 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 1yx3 h ARG 54 Cb 0.37 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 1yx3 h ARG 54 CO 0.01 0.11 0.32 0.93 -1.51 0.00 0.00 179.97 179.83 1yx3 h GLU 55 N 0.11 1.18 -0.49 0.20 5.08 -0.64 0.19 114.58 120.22 1yx3 h GLU 55 Ca 0.03 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1yx3 h GLU 55 Cb 0.01 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1yx3 h GLU 55 CO -0.01 0.95 0.28 -0.92 -1.00 0.00 0.00 179.01 178.32 1yx3 h TYR 56 N 1.15 0.65 -0.19 4.33 5.03 0.02 0.24 116.97 128.19 1yx3 h TYR 56 Ca 0.27 -0.01 -0.20 0.00 2.58 0.00 0.00 58.73 61.37 1yx3 h TYR 56 Cb 0.21 -0.21 0.01 0.00 1.55 0.00 0.00 36.73 38.28 1yx3 h TYR 56 CO 0.02 0.46 -0.65 -0.92 -1.32 0.00 0.00 178.16 175.75 1yx3 h TYR 57 N 0.65 1.03 0.00 -3.82 3.20 -0.89 0.13 116.97 117.27 1yx3 h TYR 57 Ca 0.17 -0.42 -0.07 0.00 3.14 0.00 0.00 58.73 61.55 1yx3 h TYR 57 Cb 0.01 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 1yx3 h TYR 57 CO -0.03 1.25 -0.35 1.49 -1.64 0.00 0.00 178.16 178.88 1yx3 h GLU 58 N 0.52 0.00 0.00 1.82 4.81 -0.37 0.20 114.58 121.57 1yx3 h GLU 58 Ca -0.03 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1yx3 h GLU 58 Cb 1.28 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1yx3 h GLU 58 CO 0.14 0.35 -0.76 1.49 -0.73 0.00 0.00 179.01 179.50 1yx3 h GLU 59 N 0.00 0.00 0.00 1.92 4.57 -0.51 -3.41 114.58 117.14 1yx3 h GLU 59 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1yx3 h GLU 59 Cb 0.68 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 1yx3 h GLU 59 CO 0.05 0.34 -0.84 0.66 -1.18 0.00 0.00 179.01 178.04 1yx3 n TYR 60 N -4.56 0.02 -2.17 0.92 4.01 0.46 -4.96 117.16 110.89 1yx3 n TYR 60 Ca -0.16 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.40 1yx3 n TYR 60 Cb 0.40 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.29 1yx3 n TYR 60 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1yx3 n GLN 61 N -1.54 -1.43 -4.19 -0.72 1.13 0.71 -4.98 117.38 106.37 1yx3 n GLN 61 Ca 0.04 0.95 -0.16 0.00 -1.94 0.00 0.00 57.00 55.90 1yx3 n GLN 61 Cb 0.34 -5.42 -0.14 0.00 0.11 0.00 0.00 30.24 25.13 1yx3 n GLN 61 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 1yx3 s ILE 62 N -2.87 0.55 -0.32 5.09 2.07 -1.26 -5.02 121.20 119.44 1yx3 s ILE 62 Ca 0.00 -0.52 -0.15 0.00 -1.41 0.00 0.00 60.65 58.57 1yx3 s ILE 62 Cb 0.00 -0.51 -0.02 0.00 0.13 0.00 0.00 42.46 42.06 1yx3 s ILE 62 CO 0.00 0.00 0.38 0.00 -1.91 0.00 0.00 174.94 173.42 1yx3 s ALA 63 N -0.50 3.51 0.31 1.50 0.00 -1.26 -4.08 121.76 121.24 1yx3 s ALA 63 Ca -0.01 -1.08 -0.24 0.00 0.00 0.00 0.00 51.96 50.64 1yx3 s ALA 63 Cb -0.05 -2.82 -0.10 0.00 0.00 0.00 0.00 23.12 20.16 1yx3 s ALA 63 CO 0.00 -0.98 0.89 -1.25 0.00 0.00 0.00 175.76 174.42 1yx3 s PRO 64 N 2.08 4.47 1.01 0.00 0.04 -1.26 -4.87 135.00 136.47 1yx3 s PRO 64 Ca 0.13 1.20 -0.16 0.00 0.04 0.00 0.00 61.00 62.21 1yx3 s PRO 64 Cb -0.16 -2.75 0.21 0.00 0.04 0.00 0.00 34.50 31.83 1yx3 s PRO 64 CO 0.11 0.27 1.25 0.00 0.04 0.00 0.00 177.00 178.67 1yx3 s ALA 65 N -1.65 1.81 0.15 8.56 0.00 -1.26 -4.66 121.76 124.70 1yx3 s ALA 65 Ca 0.50 -1.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.22 1yx3 s ALA 65 Cb -0.17 -2.83 0.03 0.00 0.00 0.00 0.00 23.12 20.15 1yx3 s ALA 65 CO 0.22 -2.67 1.70 0.28 0.00 0.00 0.00 175.76 175.29 1yx3 h VAL 66 N -1.84 0.75 -0.07 0.00 2.07 -1.98 0.29 116.25 115.48 1yx3 h VAL 66 Ca -0.45 -0.02 -0.16 0.00 0.82 0.00 0.00 66.70 66.90 1yx3 h VAL 66 Cb 1.26 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1yx3 h VAL 66 CO 0.41 0.01 -0.64 0.03 0.02 0.00 0.00 177.57 177.39 1yx3 h ARG 67 N 0.05 0.28 -0.22 1.57 3.08 -1.99 -1.45 114.38 115.70 1yx3 h ARG 67 Ca 0.14 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 1yx3 h ARG 67 Cb 0.20 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1yx3 h ARG 67 CO -0.26 0.83 -0.08 0.28 -1.07 0.00 0.00 179.97 179.67 1yx3 h VAL 68 N 0.20 1.30 -0.96 2.04 2.07 -1.76 -2.94 116.25 116.20 1yx3 h VAL 68 Ca -0.01 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1yx3 h VAL 68 Cb 1.17 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 32.46 1yx3 h VAL 68 CO 0.10 0.34 0.60 0.25 0.02 0.00 0.00 177.57 178.89 1yx3 h LEU 69 N 0.16 1.13 -0.41 2.57 5.85 -0.35 -2.52 115.31 121.73 1yx3 h LEU 69 Ca 0.05 -0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1yx3 h LEU 69 Cb 0.55 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 1yx3 h LEU 69 CO 0.03 0.84 -0.15 0.74 -0.34 0.00 0.00 178.44 179.56 1yx3 h THR 70 N 1.31 0.50 -0.02 1.05 2.02 -1.09 0.14 112.91 116.82 1yx3 h THR 70 Ca 0.35 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.42 1yx3 h THR 70 Cb -0.10 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 1yx3 h THR 70 CO -0.07 0.00 -0.50 0.11 0.37 0.00 0.00 175.52 175.43 1yx3 h LYS 71 N -0.06 0.04 -0.10 6.66 1.57 -1.33 -2.77 116.57 120.57 1yx3 h LYS 71 Ca 0.20 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.77 1yx3 h LYS 71 Cb 0.37 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 1yx3 h LYS 71 CO -0.46 0.53 -0.73 0.00 -0.57 0.00 0.00 179.45 178.22 1yx3 h ALA 72 N 1.47 0.53 -0.69 3.86 0.00 -0.86 -3.15 119.26 120.41 1yx3 h ALA 72 Ca -0.00 -0.60 -0.06 0.00 0.00 0.00 0.00 54.91 54.24 1yx3 h ALA 72 Cb 0.89 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1yx3 h ALA 72 CO 0.07 0.74 0.18 0.28 0.00 0.00 0.00 179.25 180.51 1yx3 h VAL 73 N 0.35 1.26 -0.65 0.00 2.07 -0.55 -3.00 116.25 115.73 1yx3 h VAL 73 Ca -0.03 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 66.63 1yx3 h VAL 73 Cb 1.32 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 31.56 1yx3 h VAL 73 CO 0.13 0.36 0.30 1.23 0.02 0.00 0.00 177.57 179.62 1yx3 h GLY 74 N 1.08 0.95 2.00 2.17 0.00 -1.45 -0.40 103.07 107.41 1yx3 h GLY 74 Ca 0.22 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1yx3 h GLY 74 CO -0.00 0.05 0.00 0.58 0.00 0.00 0.00 176.54 177.17 1yx3 n LYS 75 N -4.90 0.06 -0.03 4.80 2.85 -1.17 -1.32 118.16 118.45 1yx3 n LYS 75 Ca 0.09 0.07 -0.14 0.00 -1.05 0.00 0.00 58.31 57.28 1yx3 n LYS 75 Cb 0.25 -1.57 -0.11 0.00 -0.65 0.00 0.00 35.03 32.94 1yx3 n LYS 75 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1yx3 h LYS 76 N 0.00 0.11 -0.23 -1.58 1.63 -0.94 -3.31 116.57 112.24 1yx3 h LYS 76 Ca 0.00 -0.10 -0.10 0.00 -0.85 0.00 0.00 60.65 59.60 1yx3 h LYS 76 Cb 0.54 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.19 1yx3 h LYS 76 CO 0.00 0.78 -0.24 -0.07 -3.45 0.00 0.00 179.45 176.47 1yx3 h LEU 77 N -0.52 0.61 0.00 5.20 -0.00 -1.38 -3.48 115.31 115.74 1yx3 h LEU 77 Ca -0.01 -0.48 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1yx3 h LEU 77 Cb 0.81 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.29 1yx3 h LEU 77 CO 0.02 0.97 0.00 0.61 -0.00 0.00 0.00 178.44 180.04 1yx3 n GLY 78 N 0.19 1.88 0.00 0.83 0.00 -0.43 -5.04 105.19 102.62 1yx3 n GLY 78 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1yx3 n GLY 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yx3 n LYS 79 N -0.07 1.73 -2.07 1.61 5.02 -1.26 -4.93 118.16 118.19 1yx3 n LYS 79 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 1yx3 n LYS 79 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 1yx3 n LYS 79 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1yx3 s GLU 80 N -1.76 2.57 -0.41 1.97 0.41 -1.26 -4.77 118.70 115.45 1yx3 s GLU 80 Ca 0.00 -0.58 0.05 0.00 -0.41 0.00 0.00 54.97 54.03 1yx3 s GLU 80 Cb 0.00 -5.13 0.17 0.00 -1.78 0.00 0.00 34.13 27.39 1yx3 s GLU 80 CO 0.00 -3.52 0.48 0.21 -0.49 0.00 0.00 175.26 171.93 1yx3 s LYS 81 N 6.78 0.78 0.00 1.61 2.47 -1.26 -5.03 119.74 125.09 1yx3 s LYS 81 Ca 0.69 -0.94 0.00 0.00 -1.56 0.00 0.00 55.97 54.16 1yx3 s LYS 81 Cb -0.05 -0.54 0.00 0.00 -1.46 0.00 0.00 37.83 35.78 1yx3 s LYS 81 CO 0.03 -1.24 0.00 0.41 0.16 0.00 0.00 175.35 174.71 1yx3 n GLY 82 N 3.89 0.35 2.81 5.54 0.00 -1.26 -3.85 105.19 112.67 1yx3 n GLY 82 Ca 0.15 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1yx3 n GLY 82 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yx3 s ASN 83 N 0.00 1.16 0.00 1.61 3.84 -1.26 -4.44 114.94 115.86 1yx3 s ASN 83 Ca 0.00 -0.50 0.00 0.00 0.21 0.00 0.00 52.86 52.57 1yx3 s ASN 83 Cb 0.00 0.72 0.00 0.00 -0.55 0.00 0.00 41.25 41.42 1yx3 s ASN 83 CO 0.00 -0.36 0.00 -0.24 -2.79 0.00 0.00 177.10 173.71 1yx3 n SER 84 N 5.33 0.00 0.13 -4.21 2.88 -1.26 -2.69 113.62 113.80 1yx3 n SER 84 Ca -0.02 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.67 1yx3 n SER 84 Cb 0.48 0.00 0.69 0.00 -0.75 0.00 0.00 64.21 64.63 1yx3 n SER 84 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1yx3 h LYS 85 N 0.00 0.00 -0.68 -1.46 2.10 -1.98 -1.22 116.57 113.33 1yx3 h LYS 85 Ca 0.00 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.68 1yx3 h LYS 85 Cb 0.00 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.29 1yx3 h LYS 85 CO 0.00 0.00 0.43 -0.92 -2.00 0.00 0.00 179.45 176.96 1yx3 h TYR 86 N 0.00 0.80 0.04 0.07 3.20 -1.91 0.16 116.97 119.33 1yx3 h TYR 86 Ca 0.13 0.02 -0.23 0.00 3.14 0.00 0.00 58.73 61.79 1yx3 h TYR 86 Cb 0.52 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1yx3 h TYR 86 CO 0.00 0.46 -1.09 -0.07 -1.64 0.00 0.00 178.16 175.82 1yx3 h LEU 87 N 0.84 0.12 -0.83 2.82 3.38 -1.51 -0.98 115.31 119.15 1yx3 h LEU 87 Ca 0.27 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1yx3 h LEU 87 Cb 0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1yx3 h LEU 87 CO -0.10 1.10 -0.44 1.88 0.09 0.00 0.00 178.44 180.97 1yx3 h TYR 88 N 0.02 0.39 -0.12 1.13 -1.99 -1.20 0.61 116.97 115.81 1yx3 h TYR 88 Ca -0.05 -0.11 -0.22 0.00 2.00 0.00 0.00 58.73 60.35 1yx3 h TYR 88 Cb 1.83 -0.08 0.01 0.00 2.00 0.00 0.00 36.73 40.49 1yx3 h TYR 88 CO 0.02 0.71 -0.79 1.03 -0.00 0.00 0.00 178.16 179.13 1yx3 h SER 89 N 0.27 0.80 -0.14 3.88 0.87 -0.63 -3.29 113.55 115.31 1yx3 h SER 89 Ca 0.02 -0.54 -0.03 0.00 -1.23 0.00 0.00 61.79 60.01 1yx3 h SER 89 Cb 0.88 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1yx3 h SER 89 CO 0.07 1.32 -0.03 0.25 -0.53 0.00 0.00 176.83 177.91 1yx3 h LEU 90 N 0.45 0.27 -7.70 2.23 5.85 -0.93 -3.39 115.31 112.10 1yx3 h LEU 90 Ca -0.05 -0.36 -0.67 0.00 0.84 0.00 0.00 57.88 57.64 1yx3 h LEU 90 Cb 1.40 -0.07 -0.39 0.00 0.37 0.00 0.00 40.66 41.97 1yx3 h LEU 90 CO 0.15 0.57 -0.66 -0.36 -0.34 0.00 0.00 178.44 177.80 1yx3 s PHE 91 N -4.78 3.67 -0.51 1.25 0.08 0.18 -4.96 117.98 112.92 1yx3 s PHE 91 Ca -0.14 -2.87 0.22 0.00 0.12 0.00 0.00 56.93 54.26 1yx3 s PHE 91 Cb 0.05 -3.00 0.95 0.00 -0.57 0.00 0.00 43.02 40.45 1yx3 s PHE 91 CO 0.72 -0.94 1.66 -2.30 -0.10 0.00 0.00 175.22 174.27 1yx3 n PRO 92 N 4.23 0.16 -0.31 0.24 -0.02 -1.24 -2.09 135.00 135.98 1yx3 n PRO 92 Ca 0.03 0.43 0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1yx3 n PRO 92 Cb 0.41 -1.84 0.27 0.00 -0.02 0.00 0.00 33.50 32.32 1yx3 n PRO 92 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1yx3 n TYR 93 N -2.15 0.82 0.00 6.00 4.01 -1.26 -4.98 117.16 119.59 1yx3 n TYR 93 Ca 0.02 -0.50 0.00 0.00 -0.16 0.00 0.00 57.90 57.26 1yx3 n TYR 93 Cb 0.19 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 1yx3 n TYR 93 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yx3 n GLY 94 N 1.27 2.45 0.14 2.72 0.00 -0.89 -4.71 105.19 106.18 1yx3 n GLY 94 Ca 0.20 -0.94 -0.04 0.00 0.00 0.00 0.00 46.02 45.24 1yx3 n GLY 94 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1yx3 h PRO 95 N 0.00 -0.15 -0.48 1.61 0.11 -1.75 -1.70 132.00 129.64 1yx3 h PRO 95 Ca 0.00 0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.00 1yx3 h PRO 95 Cb 0.00 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 1yx3 h PRO 95 CO 0.00 -0.10 -0.16 0.00 -0.21 0.00 0.00 178.00 177.53 1yx3 h ALA 96 N -1.01 0.67 -0.35 -0.75 0.00 -1.92 -2.15 119.26 113.75 1yx3 h ALA 96 Ca 0.01 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1yx3 h ALA 96 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1yx3 h ALA 96 CO -0.15 0.62 0.19 0.87 0.00 0.00 0.00 179.25 180.78 1yx3 h LYS 97 N 0.81 0.48 0.05 0.00 1.57 -1.87 0.27 116.57 117.88 1yx3 h LYS 97 Ca 0.12 -0.05 -0.22 0.00 -1.87 0.00 0.00 60.65 58.62 1yx3 h LYS 97 Cb 0.73 -0.10 0.02 0.00 0.08 0.00 0.00 32.23 32.96 1yx3 h LYS 97 CO 0.06 0.39 -0.90 1.96 -0.57 0.00 0.00 179.45 180.39 1yx3 h GLN 98 N 0.44 0.53 -0.39 3.15 1.08 -1.34 -2.45 115.11 116.12 1yx3 h GLN 98 Ca 0.12 -0.63 0.01 0.00 -1.45 0.00 0.00 58.65 56.70 1yx3 h GLN 98 Cb 0.05 0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.65 1yx3 h GLN 98 CO -0.02 1.25 0.26 0.00 -0.95 0.00 0.00 178.83 179.36 1yx3 h ALA 99 N 0.30 0.50 -0.28 3.87 0.00 -1.25 -1.22 119.26 121.19 1yx3 h ALA 99 Ca -0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1yx3 h ALA 99 Cb 1.60 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1yx3 h ALA 99 CO 0.18 -0.06 -0.40 0.00 0.00 0.00 0.00 179.25 178.97 1yx3 h ARG 101 N 0.55 0.74 -0.01 0.00 2.43 -1.00 0.43 114.38 117.53 1yx3 h ARG 101 Ca 0.05 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1yx3 h ARG 101 Cb 0.92 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 1yx3 h ARG 101 CO 0.08 0.49 -0.67 0.74 -1.51 0.00 0.00 179.97 179.10 1yx3 h PHE 102 N 0.76 0.05 0.00 2.20 0.04 -1.08 -2.94 116.94 115.98 1yx3 h PHE 102 Ca 0.29 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.03 1yx3 h PHE 102 Cb 0.10 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1yx3 h PHE 102 CO -0.06 0.70 0.00 0.00 -0.60 0.00 0.00 178.31 178.35 1yx3 h ALA 103 N 1.30 1.00 0.00 2.45 0.00 -0.38 -3.36 119.26 120.27 1yx3 h ALA 103 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1yx3 h ALA 103 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yx3 h ALA 103 CO 0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.75 1yx3 n GLY 104 N 0.84 1.02 3.90 0.00 0.00 -0.09 -4.79 105.19 106.07 1yx3 n GLY 104 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1yx3 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yx3 s LEU 105 N 0.00 4.16 0.00 0.99 1.43 0.13 -4.41 118.68 120.98 1yx3 s LEU 105 Ca 0.00 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 1yx3 s LEU 105 Cb 0.00 -3.45 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1yx3 s LEU 105 CO 0.00 -0.08 0.00 -0.81 0.23 0.00 0.00 176.35 175.69 1yx3 n PRO 106 N -0.45 -0.02 -2.67 1.29 -0.04 -1.26 -3.85 135.00 128.01 1yx3 n PRO 106 Ca -0.02 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.01 1yx3 n PRO 106 Cb 0.53 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.96 1yx3 n PRO 106 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1yx3 s LYS 107 N -2.05 3.84 0.54 0.54 2.20 -1.26 -4.73 119.74 118.83 1yx3 s LYS 107 Ca 0.00 0.70 -0.18 0.00 -0.36 0.00 0.00 55.97 56.12 1yx3 s LYS 107 Cb 0.00 -3.83 -0.06 0.00 -1.51 0.00 0.00 37.83 32.43 1yx3 s LYS 107 CO 0.00 -1.13 1.06 -2.14 -0.36 0.00 0.00 175.35 172.78 1yx3 s PRO 108 N 3.95 3.52 0.02 4.03 0.02 -1.26 -5.07 135.00 140.22 1yx3 s PRO 108 Ca 0.44 1.34 -0.28 0.00 0.02 0.00 0.00 61.00 62.53 1yx3 s PRO 108 Cb -0.10 -2.05 0.08 0.00 0.02 0.00 0.00 34.50 32.45 1yx3 s PRO 108 CO 0.23 -0.66 0.71 -0.08 -0.33 0.00 0.00 177.00 176.87 1yx3 s THR 109 N -2.14 0.00 0.16 0.99 -1.32 -1.26 -5.10 115.64 106.97 1yx3 s THR 109 Ca 0.67 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 61.01 1yx3 s THR 109 Cb -0.17 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.83 1yx3 s THR 109 CO 0.28 0.00 0.39 -0.83 -2.21 0.00 0.00 174.62 172.25 1yx3 s GLY 110 N -1.95 0.05 0.00 6.08 0.00 -1.26 -5.08 107.32 105.16 1yx3 s GLY 110 Ca -0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 44.72 44.27 1yx3 s GLY 110 CO -0.02 -0.50 -0.00 0.00 0.00 0.00 0.00 173.10 172.58