#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 4.75 0.23 3.15 2.01 -1.26 -4.97 115.64 119.55 1yxb s THR 5 Ca 0.00 0.73 -0.06 0.00 0.31 0.00 0.00 61.69 62.67 1yxb s THR 5 Cb 0.00 -3.70 0.18 0.00 0.01 0.00 0.00 72.50 68.99 1yxb s THR 5 CO 0.00 -0.45 1.79 0.15 -0.69 0.00 0.00 174.62 175.43 1yxb h PHE 6 N 1.48 0.71 -0.16 4.92 3.57 -2.05 -1.59 116.94 123.82 1yxb h PHE 6 Ca -0.47 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.01 1yxb h PHE 6 Cb 1.18 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1yxb h PHE 6 CO 0.61 0.28 -0.12 0.93 -2.23 0.00 0.00 178.31 177.78 1yxb h GLU 7 N 0.68 0.24 0.02 1.11 5.08 -2.00 -2.21 114.58 117.50 1yxb h GLU 7 Ca 0.36 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.48 1yxb h GLU 7 Cb 0.33 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.57 1yxb h GLU 7 CO -0.25 0.38 -0.71 0.93 -1.00 0.00 0.00 179.01 178.36 1yxb h GLU 8 N 0.23 0.45 -0.15 2.33 5.08 -1.70 -3.03 114.58 117.80 1yxb h GLU 8 Ca 0.05 -0.51 -0.05 0.00 -1.00 0.00 0.00 59.36 57.85 1yxb h GLU 8 Cb 0.37 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1yxb h GLU 8 CO 0.02 1.16 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.99 1yxb h LEU 9 N -0.04 0.22 -0.45 1.33 3.38 -1.33 -2.56 115.31 115.86 1yxb h LEU 9 Ca -0.09 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 1yxb h LEU 9 Cb 1.42 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 1yxb h LEU 9 CO 0.14 0.37 -0.17 0.15 0.09 0.00 0.00 178.44 179.02 1yxb h PHE 10 N 0.22 1.03 0.00 1.13 3.57 -1.44 -2.61 116.94 118.84 1yxb h PHE 10 Ca 0.05 -0.24 -0.08 0.00 3.53 0.00 0.00 57.97 61.23 1yxb h PHE 10 Cb 0.36 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1yxb h PHE 10 CO 0.01 1.03 -0.36 1.15 -2.23 0.00 0.00 178.31 177.90 1yxb h THR 11 N 0.74 1.23 -0.56 4.41 2.02 -1.38 -2.13 112.91 117.24 1yxb h THR 11 Ca 0.11 -1.24 -0.07 0.00 0.77 0.00 0.00 66.41 65.98 1yxb h THR 11 Cb 0.73 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.79 1yxb h THR 11 CO 0.06 0.35 0.09 -0.33 0.37 0.00 0.00 175.52 176.06 1yxb h GLU 12 N 0.00 0.93 -0.14 6.66 4.39 -1.24 -2.95 114.58 122.23 1yxb h GLU 12 Ca -0.00 -0.25 -0.12 0.00 0.34 0.00 0.00 59.36 59.33 1yxb h GLU 12 Cb 0.65 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1yxb h GLU 12 CO 0.05 0.89 -0.44 -0.07 -1.16 0.00 0.00 179.01 178.28 1yxb h LEU 13 N 0.82 0.36 -1.24 1.33 3.38 -1.09 -2.77 115.31 116.10 1yxb h LEU 13 Ca 0.17 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1yxb h LEU 13 Cb 0.41 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1yxb h LEU 13 CO 0.01 0.75 0.00 1.56 0.09 0.00 0.00 178.44 180.86 1yxb h GLN 14 N 0.28 0.51 -0.08 1.13 4.20 -1.23 -2.48 115.11 117.44 1yxb h GLN 14 Ca 0.02 -0.11 -0.19 0.00 0.06 0.00 0.00 58.65 58.44 1yxb h GLN 14 Cb 0.89 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 28.60 1yxb h GLN 14 CO 0.07 0.54 -0.68 1.25 -0.67 0.00 0.00 178.83 179.35 1yxb h HIS 15 N 0.49 0.84 0.00 2.96 2.76 -1.39 -3.11 115.15 117.70 1yxb h HIS 15 Ca 0.11 -0.40 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 1yxb h HIS 15 Cb 0.32 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.16 1yxb h HIS 15 CO 0.01 1.21 0.00 0.87 -1.30 0.00 0.00 177.93 178.72 1yxb h LYS 16 N 0.23 0.00 -0.01 5.26 1.57 -1.32 -1.45 116.57 120.85 1yxb h LYS 16 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1yxb h LYS 16 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1yxb h LYS 16 CO 0.14 0.00 -0.24 0.00 -0.57 0.00 0.00 179.45 178.77 1yxb n ALA 17 N -1.82 3.06 0.35 3.86 0.00 -0.95 -4.05 120.51 120.95 1yxb n ALA 17 Ca 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 53.44 53.09 1yxb n ALA 17 Cb 0.16 -1.05 0.54 0.00 0.00 0.00 0.00 19.45 19.09 1yxb n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yxb h ALA 18 N 3.89 1.00 -3.00 0.00 0.00 -1.28 -3.51 119.26 116.37 1yxb h ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yxb h ALA 18 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1yxb h ALA 18 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1yxb n ASN 19 N -2.33 0.00 0.07 0.00 3.02 -1.26 -5.16 115.26 109.61 1yxb n ASN 19 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1yxb n ASN 19 Cb 0.20 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 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 -2.81 0.00 0.00 8.00 7.64 -1.26 -3.92 113.62 121.27 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 0.58 0.00 -3.34 1.43 1.74 -1.26 -5.06 116.66 110.74 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 4.85 -0.27 0.55 2.01 -1.25 -4.91 115.64 116.62 1yxb s THR 27 Ca 0.00 0.72 -0.13 0.00 0.31 0.00 0.00 61.69 62.59 1yxb s THR 27 Cb 0.00 -3.68 -0.07 0.00 0.01 0.00 0.00 72.50 68.76 1yxb s THR 27 CO 0.00 0.06 0.86 0.00 -0.69 0.00 0.00 174.62 174.85 1yxb n ALA 28 N 0.28 0.09 -3.26 7.40 0.00 -1.26 -4.88 120.51 118.89 1yxb n ALA 28 Ca -0.02 -0.02 -0.38 0.00 0.00 0.00 0.00 53.44 53.02 1yxb n ALA 28 Cb 0.52 -0.77 -0.02 0.00 0.00 0.00 0.00 19.45 19.18 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 2.82 3.60 0.05 0.00 -0.58 -1.26 -4.78 120.64 120.48 1yxb n GLU 29 Ca 0.21 -4.56 -0.16 0.00 -0.42 0.00 0.00 57.16 52.24 1yxb n GLU 29 Cb -0.00 -2.44 -0.06 0.00 -0.57 0.00 0.00 31.44 28.37 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 5.42 0.70 -1.40 -4.62 3.38 -1.96 -3.19 115.31 113.64 1yxb h LEU 30 Ca 0.19 -0.54 0.29 0.00 0.09 0.00 0.00 57.88 57.92 1yxb h LEU 30 Cb 0.69 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.13 1yxb h LEU 30 CO 1.10 1.33 0.70 0.58 0.09 0.00 0.00 178.44 182.24 1yxb h VAL 31 N 0.33 0.46 -0.19 1.22 2.07 -1.88 0.86 116.25 119.12 1yxb h VAL 31 Ca -0.09 -0.11 -0.10 0.00 0.82 0.00 0.00 66.70 67.22 1yxb h VAL 31 Cb 1.56 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1yxb h VAL 31 CO 0.17 0.06 -0.26 -0.78 0.02 0.00 0.00 177.57 176.79 1yxb h ASP 32 N 0.33 0.56 0.18 0.57 3.58 -1.96 -3.08 116.42 116.60 1yxb h ASP 32 Ca 0.62 -0.51 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1yxb h ASP 32 Cb 1.68 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 42.57 1yxb h ASP 32 CO -0.30 0.96 -0.23 0.11 -2.88 0.00 0.00 179.24 176.90 1yxb h LYS 33 N 0.18 0.09 0.00 0.28 1.57 -1.35 -3.49 116.57 113.85 1yxb h LYS 33 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1yxb h LYS 33 Cb 0.82 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1yxb h LYS 33 CO 0.06 0.31 0.00 0.41 -0.57 0.00 0.00 179.45 179.66 1yxb n GLY 34 N -0.79 0.58 0.28 3.86 0.00 0.17 -4.61 105.19 104.69 1yxb n GLY 34 Ca -0.02 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 0.95 -0.60 1.61 2.07 -1.88 -2.68 116.25 115.73 1yxb h VAL 35 Ca 0.00 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.31 1yxb h VAL 35 Cb 0.00 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 29.87 1yxb h VAL 35 CO 0.00 0.13 0.34 -0.74 0.02 0.00 0.00 177.57 177.33 1yxb h HIS 36 N 0.74 0.63 -0.37 1.57 -0.00 -1.97 0.32 115.15 116.08 1yxb h HIS 36 Ca 0.34 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.61 1yxb h HIS 36 Cb 0.25 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 1yxb h HIS 36 CO -0.07 0.33 -0.27 0.00 -0.00 0.00 0.00 177.93 177.92 1yxb h ALA 37 N 1.29 0.84 -0.18 5.26 0.00 -1.74 -2.45 119.26 122.27 1yxb h ALA 37 Ca 0.26 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 1yxb h ALA 37 Cb 0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1yxb h ALA 37 CO -0.14 0.64 -0.60 0.82 0.00 0.00 0.00 179.25 179.97 1yxb h ILE 38 N 0.65 1.32 -0.75 0.00 2.04 -1.12 -3.12 117.51 116.54 1yxb h ILE 38 Ca 0.08 -1.86 -0.03 0.00 1.00 0.00 0.00 64.86 64.05 1yxb h ILE 38 Cb 0.79 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 1yxb h ILE 38 CO 0.06 0.58 0.33 1.23 0.00 0.00 0.00 178.15 180.35 1yxb h GLY 39 N 1.00 1.16 1.00 5.37 0.00 -0.21 -1.21 103.07 110.17 1yxb h GLY 39 Ca -0.00 -0.59 0.01 0.00 0.00 0.00 0.00 47.33 46.75 1yxb h GLY 39 CO 0.11 0.56 0.46 0.50 0.00 0.00 0.00 176.54 178.17 1yxb h LYS 40 N 1.07 0.91 -0.62 4.80 1.57 -1.39 -1.66 116.57 121.25 1yxb h LYS 40 Ca 0.25 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.89 1yxb h LYS 40 Cb 0.15 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1yxb h LYS 40 CO -0.03 0.60 0.04 0.87 -0.57 0.00 0.00 179.45 180.36 1yxb h LYS 41 N 0.93 1.06 -0.55 3.15 1.79 -1.36 -0.52 116.57 121.08 1yxb h LYS 41 Ca 0.26 -0.32 -0.05 0.00 -2.18 0.00 0.00 60.65 58.36 1yxb h LYS 41 Cb -0.10 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.42 1yxb h LYS 41 CO -0.06 1.02 0.17 0.28 -1.08 0.00 0.00 179.45 179.77 1yxb h VAL 42 N 0.97 1.24 -0.26 0.50 2.07 -0.86 0.85 116.25 120.76 1yxb h VAL 42 Ca 0.18 -0.81 -0.16 0.00 0.82 0.00 0.00 66.70 66.73 1yxb h VAL 42 Cb 0.51 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1yxb h VAL 42 CO 0.02 0.30 -0.49 0.58 0.02 0.00 0.00 177.57 178.00 1yxb h VAL 43 N 0.76 1.30 -0.00 2.57 2.07 -1.23 -1.90 116.25 119.82 1yxb h VAL 43 Ca 0.18 -1.70 -0.24 0.00 0.82 0.00 0.00 66.70 65.76 1yxb h VAL 43 Cb 0.29 1.62 0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1yxb h VAL 43 CO -0.00 0.54 -0.96 1.05 0.02 0.00 0.00 177.57 178.22 1yxb h GLU 44 N 0.56 0.49 -0.16 1.57 4.11 -0.88 -3.14 114.58 117.13 1yxb h GLU 44 Ca 0.03 -0.53 -0.09 0.00 0.07 0.00 0.00 59.36 58.84 1yxb h GLU 44 Cb 1.05 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1yxb h GLU 44 CO 0.10 1.16 -0.28 0.93 0.07 0.00 0.00 179.01 180.99 1yxb h GLU 45 N 0.28 0.30 -0.76 1.06 4.39 -0.77 -2.07 114.58 117.02 1yxb h GLU 45 Ca -0.09 -0.11 -0.05 0.00 0.34 0.00 0.00 59.36 59.44 1yxb h GLU 45 Cb 1.60 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 30.20 1yxb h GLU 45 CO 0.17 0.56 0.26 0.00 -1.16 0.00 0.00 179.01 178.84 1yxb h ALA 46 N 1.44 0.99 -0.04 3.43 0.00 -1.36 0.16 119.26 123.88 1yxb h ALA 46 Ca 0.04 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 1yxb h ALA 46 Cb 0.64 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1yxb h ALA 46 CO 0.05 0.65 -0.50 0.00 0.00 0.00 0.00 179.25 179.45 1yxb h ALA 47 N 1.13 1.09 -0.10 0.00 0.00 -1.45 -1.67 119.26 118.27 1yxb h ALA 47 Ca 0.25 -0.47 -0.21 0.00 0.00 0.00 0.00 54.91 54.48 1yxb h ALA 47 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1yxb h ALA 47 CO -0.01 0.64 -0.78 0.93 0.00 0.00 0.00 179.25 180.03 1yxb h GLU 48 N 0.08 0.56 -0.24 0.00 5.08 -0.81 -3.19 114.58 116.06 1yxb h GLU 48 Ca 0.00 -0.48 -0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1yxb h GLU 48 Cb 0.92 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1yxb h GLU 48 CO 0.07 1.10 0.15 0.28 -1.00 0.00 0.00 179.01 179.61 1yxb h VAL 49 N 0.38 1.09 0.00 3.13 2.07 -0.41 0.16 116.25 122.66 1yxb h VAL 49 Ca -0.05 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1yxb h VAL 49 Cb 1.38 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1yxb h VAL 49 CO 0.15 0.08 0.00 1.87 0.02 0.00 0.00 177.57 179.69 1yxb n TRP 50 N -4.89 0.00 0.00 1.57 -0.00 -0.65 -0.94 117.44 112.52 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 0.05 -0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.36 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 0.42 0.00 0.14 5.87 0.00 0.04 -1.54 120.51 125.44 1yxb n ALA 52 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1yxb n ALA 52 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 19.45 19.95 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 1.77 0.10 0.00 0.00 -1.27 -0.23 119.26 119.63 1yxb h ALA 53 Ca 0.00 -0.07 -0.34 0.00 0.00 0.00 0.00 54.91 54.50 1yxb h ALA 53 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1yxb h ALA 53 CO 0.00 0.19 -1.82 1.49 0.00 0.00 0.00 179.25 179.10 1yxb h GLU 54 N 0.24 0.22 0.00 0.00 4.57 -1.53 -3.43 114.58 114.64 1yxb h GLU 54 Ca 0.06 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1yxb h GLU 54 Cb 0.09 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1yxb h GLU 54 CO -0.00 1.18 -1.45 0.66 -1.18 0.00 0.00 179.01 178.21 1yxb n TYR 55 N -3.69 0.00 -3.60 0.92 4.02 -1.21 -5.06 117.16 108.54 1yxb n TYR 55 Ca -0.31 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.37 1yxb n TYR 55 Cb 0.97 -0.26 0.02 0.00 -0.02 0.00 0.00 39.34 40.05 1yxb n TYR 55 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1yxb n GLU 56 N -1.86 0.77 -1.95 -0.72 -0.58 -0.10 -5.04 120.64 111.17 1yxb n GLU 56 Ca -0.02 -2.79 -0.29 0.00 -0.42 0.00 0.00 57.16 53.65 1yxb n GLU 56 Cb 0.32 0.16 0.10 0.00 -0.57 0.00 0.00 31.44 31.46 1yxb n GLU 56 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1yxb s GLY 57 N -3.90 1.64 0.24 0.62 0.00 -1.26 -4.78 107.32 99.87 1yxb s GLY 57 Ca 0.33 -0.79 -0.06 0.00 0.00 0.00 0.00 44.72 44.20 1yxb s GLY 57 CO 0.21 -0.26 1.85 0.50 0.00 0.00 0.00 173.10 175.40 1yxb h LYS 58 N -1.09 0.93 -0.36 2.90 1.57 -1.98 -2.01 116.57 116.52 1yxb h LYS 58 Ca -0.45 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.25 1yxb h LYS 58 Cb 1.31 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 1yxb h LYS 58 CO 0.60 0.61 0.13 0.22 -0.57 0.00 0.00 179.45 180.45 1yxb h ASP 59 N 0.95 0.50 -0.67 0.86 3.58 -1.99 -0.34 116.42 119.31 1yxb h ASP 59 Ca 0.36 -0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 1yxb h ASP 59 Cb 0.15 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 1yxb h ASP 59 CO -0.16 0.55 0.41 0.00 -2.88 0.00 0.00 179.24 177.16 1yxb h ALA 60 N 0.97 1.44 -0.37 -0.78 0.00 -1.88 -0.60 119.26 118.03 1yxb h ALA 60 Ca 0.12 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1yxb h ALA 60 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1yxb h ALA 60 CO -0.01 0.49 -0.38 0.00 0.00 0.00 0.00 179.25 179.35 1yxb h ALA 61 N 1.52 0.63 -0.58 0.00 0.00 -0.96 -2.26 119.26 117.60 1yxb h ALA 61 Ca 0.25 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1yxb h ALA 61 Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1yxb h ALA 61 CO -0.05 0.67 0.21 0.00 0.00 0.00 0.00 179.25 180.08 1yxb h ALA 62 N 0.83 0.75 -0.64 0.00 0.00 -0.54 -0.34 119.26 119.33 1yxb h ALA 62 Ca 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1yxb h ALA 62 Cb 0.96 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1yxb h ALA 62 CO 0.09 0.39 0.31 1.49 0.00 0.00 0.00 179.25 181.54 1yxb h GLU 63 N 0.80 0.92 -0.17 0.00 4.81 -1.01 -0.34 114.58 119.60 1yxb h GLU 63 Ca 0.19 -0.13 -0.11 0.00 -0.13 0.00 0.00 59.36 59.18 1yxb h GLU 63 Cb 0.24 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1yxb h GLU 63 CO -0.01 0.73 -0.36 0.93 -0.73 0.00 0.00 179.01 179.57 1yxb h GLU 64 N 0.88 0.37 -0.39 1.92 4.39 -1.15 -2.46 114.58 118.14 1yxb h GLU 64 Ca 0.22 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.64 1yxb h GLU 64 Cb 0.11 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 1yxb h GLU 64 CO -0.03 0.68 -0.24 0.82 -1.16 0.00 0.00 179.01 179.09 1yxb h ILE 65 N 0.31 1.27 -0.75 3.13 2.04 -0.55 -2.17 117.51 120.80 1yxb h ILE 65 Ca 0.03 -1.36 -0.06 0.00 1.00 0.00 0.00 64.86 64.47 1yxb h ILE 65 Cb 0.79 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 1yxb h ILE 65 CO 0.06 0.45 0.24 0.77 0.00 0.00 0.00 178.15 179.67 1yxb h SER 66 N 0.69 1.09 -0.65 1.72 4.64 -0.84 -0.69 113.55 119.51 1yxb h SER 66 Ca 0.09 -0.21 -0.06 0.00 -0.47 0.00 0.00 61.79 61.15 1yxb h SER 66 Cb 0.76 -0.29 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 1yxb h SER 66 CO 0.06 1.01 0.20 1.56 -0.87 0.00 0.00 176.83 178.79 1yxb h GLN 67 N 1.12 1.03 -0.52 4.77 1.08 -1.24 -0.57 115.11 120.78 1yxb h GLN 67 Ca 0.24 -0.22 -0.11 0.00 -1.45 0.00 0.00 58.65 57.12 1yxb h GLN 67 Cb 0.31 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.57 1yxb h GLN 67 CO -0.01 0.89 -0.10 1.25 -0.95 0.00 0.00 178.83 179.92 1yxb h LEU 68 N 0.99 0.99 -0.48 1.46 5.85 -0.72 -2.21 115.31 121.20 1yxb h LEU 68 Ca 0.22 -0.35 -0.11 0.00 0.84 0.00 0.00 57.88 58.48 1yxb h LEU 68 Cb 0.30 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1yxb h LEU 68 CO -0.01 1.11 -0.11 -0.07 -0.34 0.00 0.00 178.44 179.02 1yxb h LEU 69 N 0.85 0.93 -0.28 2.25 3.38 -0.92 -0.91 115.31 120.62 1yxb h LEU 69 Ca 0.13 -0.36 0.04 0.00 0.09 0.00 0.00 57.88 57.79 1yxb h LEU 69 Cb 0.66 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1yxb h LEU 69 CO 0.05 1.08 0.03 0.22 0.09 0.00 0.00 178.44 179.91 1yxb h TYR 70 N 0.78 0.05 -0.02 1.13 3.20 -0.91 0.09 116.97 121.29 1yxb h TYR 70 Ca 0.12 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 1yxb h TYR 70 Cb 0.66 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1yxb h TYR 70 CO 0.05 -0.00 -0.52 0.45 -1.64 0.00 0.00 178.16 176.50 1yxb h HIS 71 N 0.13 0.07 -0.46 -3.82 3.86 -1.27 -0.53 115.15 113.13 1yxb h HIS 71 Ca 0.13 -0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 1yxb h HIS 71 Cb 0.15 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 1yxb h HIS 71 CO -0.18 0.56 0.03 0.28 0.86 0.00 0.00 177.93 179.48 1yxb h VAL 72 N 0.04 1.26 -0.69 2.45 2.07 -0.59 -2.96 116.25 117.83 1yxb h VAL 72 Ca -0.00 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 1yxb h VAL 72 Cb 0.93 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1yxb h VAL 72 CO 0.07 0.35 0.37 1.56 0.02 0.00 0.00 177.57 179.94 1yxb h GLN 73 N 0.65 0.97 -5.14 1.57 4.20 -0.56 -3.43 115.11 113.36 1yxb h GLN 73 Ca 0.13 -0.12 -0.06 0.00 0.06 0.00 0.00 58.65 58.66 1yxb h GLN 73 Cb 0.46 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1yxb h GLN 73 CO 0.02 0.73 0.20 0.28 -0.67 0.00 0.00 178.83 179.39 1yxb n VAL 74 N -4.49 0.32 0.00 -0.54 0.31 -0.24 -4.67 118.33 109.01 1yxb n VAL 74 Ca 0.06 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1yxb n VAL 74 Cb 0.09 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 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 8.89 0.00 0.25 2.52 0.31 -1.26 -4.64 118.33 124.40 1yxb n VAL 77 Ca 0.42 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.85 1yxb n VAL 77 Cb 0.47 0.00 0.68 0.00 -0.91 0.00 0.00 33.84 34.07 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 1.44 -0.17 3.52 0.00 -1.95 -2.67 119.26 119.43 1yxb h ALA 78 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1yxb h ALA 78 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1yxb h ALA 78 CO 0.00 0.16 0.00 0.54 0.00 0.00 0.00 179.25 179.95 1yxb n ARG 79 N -3.88 1.77 -1.88 0.00 5.12 -1.26 -4.98 116.66 111.55 1yxb n ARG 79 Ca -0.02 -1.75 -0.10 0.00 -1.93 0.00 0.00 57.85 54.05 1yxb n ARG 79 Cb 0.22 -1.34 -0.02 0.00 -1.16 0.00 0.00 32.46 30.16 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 0.96 0.38 3.78 -0.13 0.00 -1.01 -5.01 105.19 104.16 1yxb n GLY 80 Ca 0.12 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.46 4.85 0.32 -0.61 1.01 -1.26 -5.02 121.20 118.02 1yxb s ILE 81 Ca 0.00 1.23 0.07 0.00 0.00 0.00 0.00 60.65 61.95 1yxb s ILE 81 Cb 0.00 -3.92 -0.02 0.00 0.01 0.00 0.00 42.46 38.53 1yxb s ILE 81 CO 0.00 0.47 0.32 -0.94 0.00 0.00 0.00 174.94 174.79 1yxb s SER 82 N -0.54 5.52 0.41 3.58 1.04 -1.26 -4.44 113.70 118.01 1yxb s SER 82 Ca 0.30 -0.36 0.08 0.00 0.48 0.00 0.00 55.95 56.44 1yxb s SER 82 Cb -0.19 -1.14 0.85 0.00 0.10 0.00 0.00 66.02 65.65 1yxb s SER 82 CO 0.18 -0.31 2.03 -0.07 0.98 0.00 0.00 173.24 176.05 1yxb h LEU 83 N 1.21 0.41 -0.59 2.42 3.38 -1.99 -1.74 115.31 118.40 1yxb h LEU 83 Ca -0.46 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.38 1yxb h LEU 83 Cb 1.25 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1yxb h LEU 83 CO 0.58 0.34 -0.07 0.44 0.09 0.00 0.00 178.44 179.82 1yxb h ASP 84 N 0.46 1.05 -0.41 -0.43 5.19 -1.97 0.32 116.42 120.63 1yxb h ASP 84 Ca 0.12 -0.33 0.01 0.00 -0.62 0.00 0.00 57.03 56.21 1yxb h ASP 84 Cb 0.04 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.24 1yxb h ASP 84 CO -0.02 1.13 0.25 0.44 -3.12 0.00 0.00 179.24 177.92 1yxb h ASP 85 N 0.94 0.42 -0.07 6.45 3.32 -1.73 -0.32 116.42 125.45 1yxb h ASP 85 Ca 0.15 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 1yxb h ASP 85 Cb 0.63 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1yxb h ASP 85 CO 0.04 0.30 -0.17 0.58 -1.72 0.00 0.00 179.24 178.28 1yxb h VAL 86 N 0.51 1.42 -0.63 -1.35 2.07 -1.27 -3.26 116.25 113.75 1yxb h VAL 86 Ca 0.16 -1.52 0.04 0.00 0.82 0.00 0.00 66.70 66.20 1yxb h VAL 86 Cb -0.02 2.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 1yxb h VAL 86 CO -0.06 0.42 0.42 1.88 0.02 0.00 0.00 177.57 180.25 1yxb h TYR 87 N -0.27 0.69 -0.54 1.57 0.99 -0.25 -0.71 116.97 118.46 1yxb h TYR 87 Ca -0.00 0.02 0.05 0.00 2.00 0.00 0.00 58.73 60.80 1yxb h TYR 87 Cb 0.77 -0.23 -0.03 0.00 1.00 0.00 0.00 36.73 38.24 1yxb h TYR 87 CO 0.12 0.39 0.36 0.00 -0.00 0.00 0.00 178.16 179.03 1yxb h ALA 88 N 1.64 1.83 0.00 3.88 0.00 -1.09 -2.06 119.26 123.45 1yxb h ALA 88 Ca 0.26 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.99 1yxb h ALA 88 Cb 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1yxb h ALA 88 CO -0.07 0.09 -1.00 0.45 0.00 0.00 0.00 179.25 178.72 1yxb h HIS 89 N 0.53 0.00 0.00 0.00 3.86 -1.23 -3.31 115.15 115.00 1yxb h HIS 89 Ca 0.23 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1yxb h HIS 89 Cb 0.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.70 1yxb h HIS 89 CO -0.00 0.64 0.00 1.28 0.86 0.00 0.00 177.93 180.70 1yxb n LEU 90 N -3.10 0.00 -0.43 2.43 4.77 -0.74 -5.13 117.00 114.79 1yxb n LEU 90 Ca -0.04 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.99 1yxb n LEU 90 Cb 0.83 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.96 1yxb n LEU 90 CO 0.43 0.00 0.42 0.18 -1.33 0.00 0.00 177.39 177.09