#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yxb s THR 5 N 0.00 4.62 0.23 3.15 2.01 -1.26 -4.96 115.64 119.43 1yxb s THR 5 Ca 0.00 1.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.96 1yxb s THR 5 Cb 0.00 -3.66 0.19 0.00 0.01 0.00 0.00 72.50 69.04 1yxb s THR 5 CO 0.00 -0.40 1.79 0.15 -0.69 0.00 0.00 174.62 175.47 1yxb h PHE 6 N 1.65 0.70 -0.14 4.92 3.57 -2.05 -1.79 116.94 123.80 1yxb h PHE 6 Ca -0.48 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.00 1yxb h PHE 6 Cb 1.18 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1yxb h PHE 6 CO 0.62 0.26 -0.15 0.93 -2.23 0.00 0.00 178.31 177.74 1yxb h GLU 7 N 0.66 0.22 -0.02 1.11 5.08 -2.00 -2.29 114.58 117.34 1yxb h GLU 7 Ca 0.37 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.53 1yxb h GLU 7 Cb 0.37 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.60 1yxb h GLU 7 CO -0.26 0.38 -0.53 0.93 -1.00 0.00 0.00 179.01 178.53 1yxb h GLU 8 N 0.21 0.40 -0.11 2.33 5.08 -1.73 -3.02 114.58 117.74 1yxb h GLU 8 Ca 0.04 -0.40 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 1yxb h GLU 8 Cb 0.40 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1yxb h GLU 8 CO 0.02 1.06 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.77 1yxb h LEU 9 N -0.10 0.19 -0.44 1.33 3.38 -1.35 -2.68 115.31 115.63 1yxb h LEU 9 Ca -0.06 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1yxb h LEU 9 Cb 1.23 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1yxb h LEU 9 CO 0.11 0.45 -0.20 0.15 0.09 0.00 0.00 178.44 179.03 1yxb h PHE 10 N 0.17 1.06 0.00 1.13 3.57 -1.46 -2.51 116.94 118.91 1yxb h PHE 10 Ca 0.03 -0.26 -0.06 0.00 3.53 0.00 0.00 57.97 61.20 1yxb h PHE 10 Cb 0.55 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1yxb h PHE 10 CO 0.01 1.06 -0.31 1.15 -2.23 0.00 0.00 178.31 177.99 1yxb h THR 11 N 0.75 0.95 -0.43 4.41 2.02 -1.38 -2.07 112.91 117.17 1yxb h THR 11 Ca 0.10 -1.17 -0.09 0.00 0.77 0.00 0.00 66.41 66.02 1yxb h THR 11 Cb 0.77 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 1yxb h THR 11 CO 0.06 0.30 -0.08 -0.33 0.37 0.00 0.00 175.52 175.84 1yxb h GLU 12 N 0.00 0.81 -0.21 6.66 4.39 -1.21 -2.98 114.58 122.04 1yxb h GLU 12 Ca -0.00 -0.30 -0.11 0.00 0.34 0.00 0.00 59.36 59.28 1yxb h GLU 12 Cb 0.66 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 1yxb h GLU 12 CO 0.04 0.92 -0.36 -0.07 -1.16 0.00 0.00 179.01 178.38 1yxb h LEU 13 N 0.64 0.48 -1.32 1.33 3.38 -1.08 -2.71 115.31 116.02 1yxb h LEU 13 Ca 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1yxb h LEU 13 Cb 0.61 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1yxb h LEU 13 CO 0.04 0.80 0.19 1.56 0.09 0.00 0.00 178.44 181.11 1yxb h GLN 14 N 0.39 0.65 -0.10 1.13 4.20 -1.26 -2.37 115.11 117.75 1yxb h GLN 14 Ca 0.04 -0.09 -0.22 0.00 0.06 0.00 0.00 58.65 58.45 1yxb h GLN 14 Cb 0.81 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.48 1yxb h GLN 14 CO 0.07 0.54 -0.78 1.25 -0.67 0.00 0.00 178.83 179.23 1yxb h HIS 15 N 0.65 0.98 0.00 2.96 2.76 -1.38 -3.05 115.15 118.06 1yxb h HIS 15 Ca 0.16 -0.46 0.00 0.00 -2.20 0.00 0.00 60.37 57.87 1yxb h HIS 15 Cb 0.13 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 28.95 1yxb h HIS 15 CO 0.01 1.29 0.00 0.87 -1.30 0.00 0.00 177.93 178.80 1yxb h LYS 16 N 0.39 0.00 -0.01 5.26 1.57 -1.26 -1.85 116.57 120.68 1yxb h LYS 16 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1yxb h LYS 16 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1yxb h LYS 16 CO 0.16 0.00 -0.20 0.00 -0.57 0.00 0.00 179.45 178.84 1yxb n ALA 17 N -1.87 2.97 0.39 3.86 0.00 -0.91 -3.97 120.51 120.98 1yxb n ALA 17 Ca 0.01 -0.45 0.11 0.00 0.00 0.00 0.00 53.44 53.11 1yxb n ALA 17 Cb 0.19 -1.10 0.48 0.00 0.00 0.00 0.00 19.45 19.03 1yxb n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yxb n ALA 18 N -0.29 1.63 -2.85 0.00 0.00 -0.69 -5.08 120.51 113.23 1yxb n ALA 18 Ca 0.14 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1yxb n ALA 18 Cb 0.37 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1yxb n ALA 18 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1yxb n ASN 19 N -2.18 0.00 0.06 0.00 3.02 -1.25 -5.16 115.26 109.74 1yxb n ASN 19 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1yxb n ASN 19 Cb 0.22 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 1yxb n ASN 19 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1yxb n THR 24 N 0.00 0.00 0.00 3.41 -1.04 -1.26 -5.09 114.28 110.30 1yxb n THR 24 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1yxb n THR 24 Cb 0.00 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 1yxb n THR 24 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1yxb n SER 25 N -2.74 0.00 0.00 8.00 7.64 -1.26 -3.92 113.62 121.34 1yxb n SER 25 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1yxb n SER 25 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1yxb n SER 25 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1yxb n ARG 26 N 0.52 0.00 -3.36 1.43 1.74 -1.26 -5.06 116.66 110.67 1yxb n ARG 26 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 1yxb n ARG 26 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 1yxb n ARG 26 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1yxb s THR 27 N 0.00 4.87 -0.26 0.55 2.01 -1.25 -4.91 115.64 116.64 1yxb s THR 27 Ca 0.00 0.70 -0.11 0.00 0.31 0.00 0.00 61.69 62.58 1yxb s THR 27 Cb 0.00 -3.68 -0.07 0.00 0.01 0.00 0.00 72.50 68.77 1yxb s THR 27 CO 0.00 0.07 0.80 0.00 -0.69 0.00 0.00 174.62 174.80 1yxb n ALA 28 N 0.30 0.08 -3.18 7.40 0.00 -1.26 -4.86 120.51 118.99 1yxb n ALA 28 Ca -0.02 -0.04 -0.38 0.00 0.00 0.00 0.00 53.44 53.01 1yxb n ALA 28 Cb 0.52 -0.70 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 1yxb n ALA 28 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yxb n GLU 29 N 2.59 3.73 0.17 0.00 -0.58 -1.26 -4.75 120.64 120.54 1yxb n GLU 29 Ca 0.20 -4.59 0.06 0.00 -0.42 0.00 0.00 57.16 52.41 1yxb n GLU 29 Cb 0.00 -2.43 0.11 0.00 -0.57 0.00 0.00 31.44 28.56 1yxb n GLU 29 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1yxb h LEU 30 N 5.10 0.00 -1.99 -4.62 3.38 -1.96 -3.21 115.31 112.01 1yxb h LEU 30 Ca 0.20 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1yxb h LEU 30 Cb 0.65 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1yxb h LEU 30 CO 1.14 0.34 0.27 0.58 0.09 0.00 0.00 178.44 180.87 1yxb h VAL 31 N 0.00 0.81 -0.09 1.22 2.07 -1.87 0.10 116.25 118.50 1yxb h VAL 31 Ca -0.00 -0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.38 1yxb h VAL 31 Cb 1.21 0.80 0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1yxb h VAL 31 CO 0.04 0.00 -0.48 -0.78 0.02 0.00 0.00 177.57 176.37 1yxb h ASP 32 N 0.01 0.58 -0.04 0.57 3.58 -1.97 -3.17 116.42 115.97 1yxb h ASP 32 Ca 0.18 -0.65 -0.06 0.00 0.42 0.00 0.00 57.03 56.92 1yxb h ASP 32 Cb 0.71 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.58 1yxb h ASP 32 CO -0.00 1.14 -0.11 0.11 -2.88 0.00 0.00 179.24 177.49 1yxb h LYS 33 N 0.06 0.33 0.00 0.28 1.57 -1.32 -3.49 116.57 114.00 1yxb h LYS 33 Ca -0.04 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1yxb h LYS 33 Cb 1.13 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1yxb h LYS 33 CO 0.10 0.46 0.00 0.41 -0.57 0.00 0.00 179.45 179.85 1yxb n GLY 34 N -0.81 -3.14 0.21 3.86 0.00 -0.11 -4.62 105.19 100.58 1yxb n GLY 34 Ca -0.00 -2.17 -0.02 0.00 0.00 0.00 0.00 46.02 43.83 1yxb n GLY 34 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1yxb h VAL 35 N 0.00 0.77 -0.37 1.61 2.07 -1.88 -2.57 116.25 115.88 1yxb h VAL 35 Ca 0.00 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.47 1yxb h VAL 35 Cb 0.00 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 1yxb h VAL 35 CO 0.00 0.06 0.05 -0.74 0.02 0.00 0.00 177.57 176.96 1yxb h HIS 36 N 0.33 0.07 -0.63 1.57 -0.00 -1.97 0.29 115.15 114.79 1yxb h HIS 36 Ca 0.27 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.60 1yxb h HIS 36 Cb 0.33 0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.73 1yxb h HIS 36 CO -0.19 -0.02 0.15 0.00 -0.00 0.00 0.00 177.93 177.87 1yxb h ALA 37 N 1.30 1.06 -0.19 5.26 0.00 -1.77 -2.05 119.26 122.88 1yxb h ALA 37 Ca 0.18 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1yxb h ALA 37 Cb 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1yxb h ALA 37 CO -0.26 0.62 -0.60 0.82 0.00 0.00 0.00 179.25 179.82 1yxb h ILE 38 N 0.95 1.31 -0.80 0.00 2.04 -1.08 -3.17 117.51 116.77 1yxb h ILE 38 Ca 0.20 -1.85 -0.04 0.00 1.00 0.00 0.00 64.86 64.17 1yxb h ILE 38 Cb 0.35 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 1yxb h ILE 38 CO 0.00 0.58 0.34 1.23 0.00 0.00 0.00 178.15 180.30 1yxb h GLY 39 N 0.96 1.26 0.73 5.37 0.00 -0.13 -0.81 103.07 110.46 1yxb h GLY 39 Ca -0.00 -0.67 0.05 0.00 0.00 0.00 0.00 47.33 46.71 1yxb h GLY 39 CO 0.12 0.63 0.34 0.50 0.00 0.00 0.00 176.54 178.13 1yxb h LYS 40 N 1.15 0.63 -0.34 4.80 1.57 -1.38 -1.81 116.57 121.18 1yxb h LYS 40 Ca 0.27 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1yxb h LYS 40 Cb 0.18 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1yxb h LYS 40 CO -0.03 0.42 0.08 0.87 -0.57 0.00 0.00 179.45 180.22 1yxb h LYS 41 N 0.65 0.55 -0.46 3.15 1.79 -1.40 -0.48 116.57 120.36 1yxb h LYS 41 Ca 0.27 -0.13 0.03 0.00 -2.18 0.00 0.00 60.65 58.64 1yxb h LYS 41 Cb 0.14 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.68 1yxb h LYS 41 CO -0.16 0.60 0.26 0.28 -1.08 0.00 0.00 179.45 179.35 1yxb h VAL 42 N 0.40 1.01 -0.52 0.50 2.07 -0.89 0.12 116.25 118.94 1yxb h VAL 42 Ca 0.11 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 1yxb h VAL 42 Cb 0.30 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1yxb h VAL 42 CO 0.00 0.09 -0.02 0.58 0.02 0.00 0.00 177.57 178.24 1yxb h VAL 43 N 0.51 1.27 -0.08 2.57 2.07 -1.27 -1.40 116.25 119.91 1yxb h VAL 43 Ca 0.19 -1.12 -0.16 0.00 0.82 0.00 0.00 66.70 66.43 1yxb h VAL 43 Cb 0.06 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1yxb h VAL 43 CO -0.11 0.40 -0.65 1.05 0.02 0.00 0.00 177.57 178.27 1yxb h GLU 44 N 0.80 0.32 -0.11 1.57 4.11 -0.77 -2.99 114.58 117.50 1yxb h GLU 44 Ca 0.14 -0.24 -0.14 0.00 0.07 0.00 0.00 59.36 59.19 1yxb h GLU 44 Cb 0.55 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1yxb h GLU 44 CO 0.03 0.86 -0.55 0.93 0.07 0.00 0.00 179.01 180.35 1yxb h GLU 45 N 0.23 0.33 -0.17 1.06 4.39 -0.66 -1.57 114.58 118.19 1yxb h GLU 45 Ca -0.01 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.47 1yxb h GLU 45 Cb 1.19 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 1yxb h GLU 45 CO 0.11 0.79 0.08 0.00 -1.16 0.00 0.00 179.01 178.83 1yxb h ALA 46 N 1.16 0.22 -0.49 3.43 0.00 -1.20 0.21 119.26 122.59 1yxb h ALA 46 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1yxb h ALA 46 Cb 1.05 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1yxb h ALA 46 CO 0.09 -0.21 0.20 0.00 0.00 0.00 0.00 179.25 179.33 1yxb h ALA 47 N 0.94 1.43 -0.42 0.00 0.00 -1.38 -0.79 119.26 119.04 1yxb h ALA 47 Ca 0.06 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1yxb h ALA 47 Cb 0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1yxb h ALA 47 CO -0.01 0.44 -0.22 0.93 0.00 0.00 0.00 179.25 180.39 1yxb h GLU 48 N 0.70 0.90 -0.19 0.00 5.08 -0.75 -3.03 114.58 117.28 1yxb h GLU 48 Ca 0.17 -0.40 0.03 0.00 -1.00 0.00 0.00 59.36 58.16 1yxb h GLU 48 Cb 0.13 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1yxb h GLU 48 CO -0.02 1.05 0.02 0.28 -1.00 0.00 0.00 179.01 179.34 1yxb h VAL 49 N 0.72 0.89 0.00 3.13 2.07 0.13 0.55 116.25 123.74 1yxb h VAL 49 Ca 0.09 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1yxb h VAL 49 Cb 0.79 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1yxb h VAL 49 CO 0.07 0.02 0.00 1.87 0.02 0.00 0.00 177.57 179.54 1yxb n TRP 50 N -5.11 0.00 0.00 1.57 -0.00 -0.37 -0.67 117.44 112.86 1yxb n TRP 50 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.47 1yxb n TRP 50 Cb 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 31.31 31.40 1yxb n TRP 50 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1yxb n ALA 52 N 0.53 0.00 -0.09 5.87 0.00 0.18 -1.48 120.51 125.53 1yxb n ALA 52 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1yxb n ALA 52 Cb 0.00 0.00 0.34 0.00 0.00 0.00 0.00 19.45 19.79 1yxb n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yxb h ALA 53 N 0.00 1.59 0.04 0.00 0.00 -1.12 -0.02 119.26 119.75 1yxb h ALA 53 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1yxb h ALA 53 Cb 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1yxb h ALA 53 CO 0.00 0.37 -0.51 1.49 0.00 0.00 0.00 179.25 180.60 1yxb h GLU 54 N 0.75 0.08 0.00 0.00 4.57 -1.51 -3.42 114.58 115.04 1yxb h GLU 54 Ca 0.20 -0.14 -0.13 0.00 -1.18 0.00 0.00 59.36 58.11 1yxb h GLU 54 Cb -0.07 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1yxb h GLU 54 CO -0.04 1.07 -1.98 0.66 -1.18 0.00 0.00 179.01 177.53 1yxb n TYR 55 N -4.42 0.00 -3.22 0.92 4.02 -1.21 -5.05 117.16 108.20 1yxb n TYR 55 Ca -0.16 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.52 1yxb n TYR 55 Cb 0.62 -0.60 0.05 0.00 -0.02 0.00 0.00 39.34 39.40 1yxb n TYR 55 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1yxb s GLU 56 N -2.92 2.23 0.93 -0.72 0.41 -0.02 -5.04 118.70 113.56 1yxb s GLU 56 Ca -0.07 -1.78 -0.15 0.00 -0.41 0.00 0.00 54.97 52.55 1yxb s GLU 56 Cb 0.09 -2.51 0.17 0.00 -1.78 0.00 0.00 34.13 30.10 1yxb s GLU 56 CO 0.74 -0.89 1.27 0.20 -0.49 0.00 0.00 175.26 176.09 1yxb s GLY 57 N -4.63 1.71 0.22 -1.39 0.00 -1.26 -4.76 107.32 97.22 1yxb s GLY 57 Ca 0.56 -1.01 -0.09 0.00 0.00 0.00 0.00 44.72 44.19 1yxb s GLY 57 CO 0.36 -0.32 1.89 0.50 0.00 0.00 0.00 173.10 175.53 1yxb h LYS 58 N -1.53 1.12 -0.47 2.90 1.57 -1.97 -1.94 116.57 116.25 1yxb h LYS 58 Ca -0.45 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.17 1yxb h LYS 58 Cb 1.27 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.31 1yxb h LYS 58 CO 0.46 0.75 -0.02 0.22 -0.57 0.00 0.00 179.45 180.30 1yxb h ASP 59 N 1.15 0.84 -0.78 0.86 3.58 -1.99 -1.12 116.42 118.95 1yxb h ASP 59 Ca 0.31 -0.32 -0.04 0.00 0.42 0.00 0.00 57.03 57.40 1yxb h ASP 59 Cb -0.12 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.67 1yxb h ASP 59 CO -0.07 0.95 0.32 0.00 -2.88 0.00 0.00 179.24 177.57 1yxb h ALA 60 N 0.91 1.08 -0.54 -0.78 0.00 -1.88 -0.80 119.26 117.24 1yxb h ALA 60 Ca 0.13 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1yxb h ALA 60 Cb 0.53 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1yxb h ALA 60 CO 0.03 0.66 -0.06 0.00 0.00 0.00 0.00 179.25 179.88 1yxb h ALA 61 N 1.20 0.87 -0.14 0.00 0.00 -1.15 -1.93 119.26 118.09 1yxb h ALA 61 Ca 0.26 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1yxb h ALA 61 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1yxb h ALA 61 CO -0.02 0.65 -0.35 0.00 0.00 0.00 0.00 179.25 179.53 1yxb h ALA 62 N 1.03 1.14 -0.20 0.00 0.00 -0.75 -0.24 119.26 120.24 1yxb h ALA 62 Ca 0.15 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1yxb h ALA 62 Cb 0.60 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1yxb h ALA 62 CO 0.04 0.56 -0.20 1.49 0.00 0.00 0.00 179.25 181.14 1yxb h GLU 63 N 0.26 0.49 -0.44 0.00 4.81 -0.83 -1.36 114.58 117.51 1yxb h GLU 63 Ca 0.03 -0.26 -0.06 0.00 -0.13 0.00 0.00 59.36 58.94 1yxb h GLU 63 Cb 0.74 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 1yxb h GLU 63 CO 0.06 0.84 0.03 0.93 -0.73 0.00 0.00 179.01 180.13 1yxb h GLU 64 N 0.17 0.70 -0.54 1.92 4.39 -1.18 -2.23 114.58 117.82 1yxb h GLU 64 Ca 0.03 -0.17 -0.11 0.00 0.34 0.00 0.00 59.36 59.46 1yxb h GLU 64 Cb 0.75 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 1yxb h GLU 64 CO 0.05 0.70 -0.09 0.82 -1.16 0.00 0.00 179.01 179.33 1yxb h ILE 65 N 0.67 1.27 -0.83 3.13 2.04 -0.91 -1.97 117.51 120.91 1yxb h ILE 65 Ca 0.14 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 1yxb h ILE 65 Cb 0.37 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 1yxb h ILE 65 CO 0.01 0.44 0.44 0.77 0.00 0.00 0.00 178.15 179.81 1yxb h SER 66 N 0.90 1.04 -0.75 1.72 4.64 -0.74 -0.40 113.55 119.97 1yxb h SER 66 Ca 0.15 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1yxb h SER 66 Cb 0.64 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.43 1yxb h SER 66 CO 0.04 0.85 0.36 1.56 -0.87 0.00 0.00 176.83 178.77 1yxb h GLN 67 N 1.16 1.08 0.13 4.77 1.08 -1.15 -0.54 115.11 121.64 1yxb h GLN 67 Ca 0.29 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.32 1yxb h GLN 67 Cb 0.05 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 1yxb h GLN 67 CO -0.04 0.85 -0.06 1.25 -0.95 0.00 0.00 178.83 179.87 1yxb h LEU 68 N 1.06 -0.14 -1.22 1.46 5.85 -0.79 -2.30 115.31 119.22 1yxb h LEU 68 Ca 0.26 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1yxb h LEU 68 Cb 0.12 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 1yxb h LEU 68 CO -0.03 0.01 0.54 -0.07 -0.34 0.00 0.00 178.44 178.55 1yxb h LEU 69 N -0.29 0.87 -0.23 2.25 3.38 -0.82 0.07 115.31 120.53 1yxb h LEU 69 Ca -0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1yxb h LEU 69 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1yxb h LEU 69 CO 0.03 0.59 0.11 0.22 0.09 0.00 0.00 178.44 179.48 1yxb h TYR 70 N 1.00 0.33 -0.12 1.13 3.20 -0.97 -0.35 116.97 121.20 1yxb h TYR 70 Ca 0.34 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.08 1yxb h TYR 70 Cb 0.08 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 1yxb h TYR 70 CO -0.00 0.33 -0.39 0.45 -1.64 0.00 0.00 178.16 176.90 1yxb h HIS 71 N 0.24 0.31 -0.42 -3.82 3.86 -0.82 -0.64 115.15 113.85 1yxb h HIS 71 Ca 0.08 -0.08 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1yxb h HIS 71 Cb 0.12 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 1yxb h HIS 71 CO -0.02 0.62 0.08 0.28 0.86 0.00 0.00 177.93 179.75 1yxb h VAL 72 N 0.22 1.24 -0.65 2.45 2.07 -0.69 -2.72 116.25 118.18 1yxb h VAL 72 Ca 0.02 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1yxb h VAL 72 Cb 0.79 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1yxb h VAL 72 CO 0.06 0.30 0.32 1.56 0.02 0.00 0.00 177.57 179.83 1yxb h GLN 73 N 0.55 0.91 -5.20 1.57 4.20 -0.67 -3.43 115.11 113.04 1yxb h GLN 73 Ca 0.13 -0.11 -0.22 0.00 0.06 0.00 0.00 58.65 58.51 1yxb h GLN 73 Cb 0.36 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1yxb h GLN 73 CO 0.01 0.70 0.68 0.28 -0.67 0.00 0.00 178.83 179.83 1yxb n VAL 74 N -4.35 0.92 0.00 -0.54 0.31 -0.28 -4.67 118.33 109.72 1yxb n VAL 74 Ca 0.06 -0.94 0.00 0.00 -0.01 0.00 0.00 64.34 63.45 1yxb n VAL 74 Cb 0.12 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 30.96 1yxb n VAL 74 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1yxb n VAL 77 N 8.25 0.00 0.23 2.52 0.31 -1.26 -4.67 118.33 123.71 1yxb n VAL 77 Ca 0.44 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.84 1yxb n VAL 77 Cb 0.46 0.00 0.56 0.00 -0.91 0.00 0.00 33.84 33.95 1yxb n VAL 77 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yxb h ALA 78 N 0.00 1.57 -0.29 3.52 0.00 -1.94 -2.73 119.26 119.39 1yxb h ALA 78 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1yxb h ALA 78 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yxb h ALA 78 CO 0.00 0.22 0.00 0.54 0.00 0.00 0.00 179.25 180.01 1yxb n ARG 79 N -4.12 2.11 -1.78 0.00 5.12 -1.26 -4.98 116.66 111.75 1yxb n ARG 79 Ca -0.02 -1.95 -0.12 0.00 -1.93 0.00 0.00 57.85 53.82 1yxb n ARG 79 Cb 0.25 -1.38 -0.03 0.00 -1.16 0.00 0.00 32.46 30.14 1yxb n ARG 79 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yxb n GLY 80 N 1.03 0.60 3.79 -0.13 0.00 -1.03 -5.00 105.19 104.45 1yxb n GLY 80 Ca 0.14 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 1yxb n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yxb s ILE 81 N -2.53 4.74 0.34 -0.61 1.01 -1.26 -5.02 121.20 117.87 1yxb s ILE 81 Ca 0.00 1.28 0.07 0.00 0.00 0.00 0.00 60.65 62.01 1yxb s ILE 81 Cb 0.00 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 1yxb s ILE 81 CO 0.00 0.52 0.29 -0.94 0.00 0.00 0.00 174.94 174.81 1yxb s SER 82 N -0.88 5.28 0.38 3.58 1.04 -1.26 -4.42 113.70 117.42 1yxb s SER 82 Ca 0.30 -0.50 0.08 0.00 0.48 0.00 0.00 55.95 56.31 1yxb s SER 82 Cb -0.20 -0.97 0.76 0.00 0.10 0.00 0.00 66.02 65.71 1yxb s SER 82 CO 0.19 -0.35 1.94 -0.07 0.98 0.00 0.00 173.24 175.93 1yxb h LEU 83 N 1.25 0.35 -0.61 2.42 3.38 -1.99 -1.85 115.31 118.25 1yxb h LEU 83 Ca -0.45 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.35 1yxb h LEU 83 Cb 1.25 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1yxb h LEU 83 CO 0.59 0.42 -0.13 0.44 0.09 0.00 0.00 178.44 179.84 1yxb h ASP 84 N 0.36 0.96 -0.05 -0.43 5.19 -1.97 0.22 116.42 120.70 1yxb h ASP 84 Ca 0.08 -0.32 0.01 0.00 -0.62 0.00 0.00 57.03 56.18 1yxb h ASP 84 Cb 0.27 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 1yxb h ASP 84 CO 0.01 1.09 -0.01 0.44 -3.12 0.00 0.00 179.24 177.65 1yxb h ASP 85 N 0.85 -0.04 -0.04 6.45 3.32 -1.75 -0.07 116.42 125.14 1yxb h ASP 85 Ca 0.13 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1yxb h ASP 85 Cb 0.68 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1yxb h ASP 85 CO 0.05 -0.01 -0.01 0.58 -1.72 0.00 0.00 179.24 178.13 1yxb h VAL 86 N 0.01 1.29 -0.55 -1.35 2.07 -1.32 -3.14 116.25 113.26 1yxb h VAL 86 Ca 0.03 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1yxb h VAL 86 Cb 0.04 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 1yxb h VAL 86 CO -0.05 0.24 0.37 1.88 0.02 0.00 0.00 177.57 180.03 1yxb h TYR 87 N -0.26 0.54 -0.29 1.57 0.99 -0.47 -0.33 116.97 118.73 1yxb h TYR 87 Ca 0.01 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.79 1yxb h TYR 87 Cb 0.39 -0.18 -0.01 0.00 1.00 0.00 0.00 36.73 37.93 1yxb h TYR 87 CO 0.05 0.30 0.19 0.00 -0.00 0.00 0.00 178.16 178.70 1yxb h ALA 88 N 1.69 1.94 0.00 3.88 0.00 -0.95 -2.03 119.26 123.79 1yxb h ALA 88 Ca 0.24 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.91 1yxb h ALA 88 Cb 0.24 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1yxb h ALA 88 CO -0.07 0.02 -1.30 0.45 0.00 0.00 0.00 179.25 178.35 1yxb h HIS 89 N 0.26 0.00 0.00 0.00 3.86 -1.12 -3.32 115.15 114.83 1yxb h HIS 89 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1yxb h HIS 89 Cb 0.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.62 1yxb h HIS 89 CO -0.00 0.84 0.00 1.28 0.86 0.00 0.00 177.93 180.91 1yxb n LEU 90 N -3.11 0.00 -0.47 2.43 4.77 -0.76 -5.14 117.00 114.72 1yxb n LEU 90 Ca -0.08 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.95 1yxb n LEU 90 Cb 0.93 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.07 1yxb n LEU 90 CO 0.44 0.00 0.44 0.18 -1.33 0.00 0.00 177.39 177.12