#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yww s ASN 2 N 0.00 0.05 -0.07 7.83 2.20 -1.26 -5.03 114.94 118.66 1yww s ASN 2 Ca 0.00 -0.32 0.09 0.00 -0.94 0.00 0.00 52.86 51.70 1yww s ASN 2 Cb 0.00 0.24 -0.13 0.00 -2.00 0.00 0.00 41.25 39.36 1yww s ASN 2 CO 0.00 -0.46 0.10 -1.20 -2.94 0.00 0.00 177.10 172.59 1yww n SER 3 N 1.05 2.58 -4.70 3.54 7.64 -1.26 -4.98 113.62 117.49 1yww n SER 3 Ca -0.21 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.25 1yww n SER 3 Cb 0.57 0.97 -0.03 0.00 -1.01 0.00 0.00 64.21 64.72 1yww n SER 3 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1yww s ASP 4 N -3.90 7.05 0.00 6.43 2.15 -1.26 -4.85 116.67 122.29 1yww s ASP 4 Ca -0.05 1.94 0.00 0.00 0.43 0.00 0.00 52.55 54.88 1yww s ASP 4 Cb 0.04 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1yww s ASP 4 CO 0.41 -0.53 0.00 0.52 -0.17 0.00 0.00 175.17 175.40 1yww n VAL 5 N 4.25 0.00 1.32 1.11 0.31 -1.26 -4.81 118.33 119.25 1yww n VAL 5 Ca 0.10 -0.08 0.13 0.00 -0.01 0.00 0.00 64.34 64.48 1yww n VAL 5 Cb 0.46 0.53 0.46 0.00 -0.91 0.00 0.00 33.84 34.38 1yww n VAL 5 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1yww n ILE 6 N -1.12 0.00 1.06 2.52 5.41 -1.26 -2.65 119.36 123.31 1yww n ILE 6 Ca 0.00 -0.12 0.11 0.00 1.00 0.00 0.00 62.75 63.74 1yww n ILE 6 Cb 0.00 0.27 0.56 0.00 -0.71 0.00 0.00 39.64 39.76 1yww n ILE 6 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1yww n LYS 7 N -0.64 0.33 -4.13 0.38 4.81 -1.26 -3.08 118.16 114.56 1yww n LYS 7 Ca 0.14 0.07 -0.11 0.00 -0.87 0.00 0.00 58.31 57.54 1yww n LYS 7 Cb 0.33 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 33.79 1yww n LYS 7 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1yww s GLY 8 N -2.55 1.12 -1.80 3.14 0.00 -1.09 -4.64 107.32 101.50 1yww s GLY 8 Ca 0.21 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.52 1yww s GLY 8 CO 0.33 -1.15 0.00 0.28 0.00 0.00 0.00 173.10 172.56 1yww n LYS 9 N -0.29 -1.25 -0.17 2.90 5.02 -1.26 -4.88 118.16 118.23 1yww n LYS 9 Ca 0.00 1.07 -0.02 0.00 -2.02 0.00 0.00 58.31 57.34 1yww n LYS 9 Cb 0.65 -5.35 0.07 0.00 -0.02 0.00 0.00 35.03 30.38 1yww n LYS 9 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1yww h TRP 10 N 0.00 0.26 0.00 2.13 2.91 -1.89 0.16 115.95 119.51 1yww h TRP 10 Ca -0.37 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.68 1yww h TRP 10 Cb 1.17 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.78 1yww h TRP 10 CO 0.49 0.05 0.00 1.63 -1.03 0.00 0.00 178.44 179.58 1yww n LYS 11 N -5.05 0.15 0.00 2.65 4.76 -1.26 -2.68 118.16 116.74 1yww n LYS 11 Ca 0.06 0.20 0.10 0.00 -2.87 0.00 0.00 58.31 55.80 1yww n LYS 11 Cb 0.24 -1.71 -0.09 0.00 -1.84 0.00 0.00 35.03 31.63 1yww n LYS 11 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1yww n GLN 12 N -1.98 0.17 -0.20 1.97 1.13 0.05 -4.11 117.38 114.41 1yww n GLN 12 Ca 0.05 -0.04 0.08 0.00 -1.94 0.00 0.00 57.00 55.15 1yww n GLN 12 Cb 0.35 -1.52 0.19 0.00 0.11 0.00 0.00 30.24 29.37 1yww n GLN 12 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1yww n LEU 13 N -1.71 3.14 0.09 1.08 4.77 0.33 -4.62 117.00 120.08 1yww n LEU 13 Ca 0.02 -1.76 -0.12 0.00 -0.03 0.00 0.00 56.01 54.12 1yww n LEU 13 Cb 0.39 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1yww n LEU 13 CO 0.43 0.74 0.76 0.71 -1.33 0.00 0.00 177.39 178.70 1yww h THR 14 N 3.06 0.63 -0.42 -5.08 1.35 -1.69 -0.59 112.91 110.16 1yww h THR 14 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.82 1yww h THR 14 Cb 0.81 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 67.83 1yww h THR 14 CO 0.00 0.00 0.08 1.23 -0.25 0.00 0.00 175.52 176.58 1yww h GLY 15 N -0.30 0.68 1.00 5.82 0.00 -1.89 0.52 103.07 108.90 1yww h GLY 15 Ca 0.03 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1yww h GLY 15 CO -0.10 0.35 0.08 0.50 0.00 0.00 0.00 176.54 177.37 1yww h LYS 16 N 0.61 0.88 -0.14 4.80 1.79 -1.74 -1.18 116.57 121.59 1yww h LYS 16 Ca 0.14 -0.24 -0.07 0.00 -2.18 0.00 0.00 60.65 58.30 1yww h LYS 16 Cb 0.27 -0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1yww h LYS 16 CO 0.00 0.86 -0.19 0.82 -1.08 0.00 0.00 179.45 179.87 1yww h ILE 17 N 0.77 1.36 0.00 1.86 2.04 -0.69 -3.04 117.51 119.80 1yww h ILE 17 Ca 0.16 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 1yww h ILE 17 Cb 0.41 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1yww h ILE 17 CO 0.01 0.41 -0.07 0.50 0.00 0.00 0.00 178.15 179.00 1yww h LYS 18 N -0.02 0.00 -0.51 2.37 3.64 -0.85 0.21 116.57 121.42 1yww h LYS 18 Ca 0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 1yww h LYS 18 Cb 0.74 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1yww h LYS 18 CO 0.04 0.07 -0.01 1.49 -2.27 0.00 0.00 179.45 178.77 1yww h GLU 19 N 0.00 0.86 0.00 1.90 4.57 -1.10 -3.33 114.58 117.49 1yww h GLU 19 Ca -0.00 -0.25 -0.05 0.00 -1.18 0.00 0.00 59.36 57.88 1yww h GLU 19 Cb 0.22 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1yww h GLU 19 CO 0.01 0.87 -0.40 -0.09 -1.18 0.00 0.00 179.01 178.22 1yww h ARG 20 N 0.80 0.00 -4.58 1.92 2.43 -1.02 -3.44 114.38 110.48 1yww h ARG 20 Ca 0.15 0.00 -0.70 0.00 -0.81 0.00 0.00 59.98 58.61 1yww h ARG 20 Cb 0.50 0.00 -0.28 0.00 -0.42 0.00 0.00 29.97 29.77 1yww h ARG 20 CO 0.02 0.48 -0.54 -1.58 -1.51 0.00 0.00 179.97 176.84 1yww s TRP 21 N -2.06 3.29 -1.27 2.20 0.51 0.57 -4.93 118.94 117.25 1yww s TRP 21 Ca -0.15 -1.39 0.28 0.00 -2.12 0.00 0.00 56.10 52.73 1yww s TRP 21 Cb 0.01 -2.55 1.08 0.00 -0.81 0.00 0.00 33.47 31.20 1yww s TRP 21 CO 0.36 -0.76 1.79 0.41 -0.51 0.00 0.00 176.95 178.24 1yww n GLY 22 N 4.88 -1.22 0.06 0.98 0.00 -1.25 -3.17 105.19 105.46 1yww n GLY 22 Ca -0.11 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 45.82 1yww n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yww n ASP 23 N -1.28 0.32 -4.54 1.61 9.92 -1.26 -4.65 116.55 116.67 1yww n ASP 23 Ca 0.10 -0.25 -0.42 0.00 -0.53 0.00 0.00 54.79 53.68 1yww n ASP 23 Cb 0.31 -0.14 -0.08 0.00 -0.64 0.00 0.00 41.12 40.57 1yww n ASP 23 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1yww s LEU 24 N -2.67 4.47 0.93 0.64 1.43 -1.19 -4.94 118.68 117.36 1yww s LEU 24 Ca 0.23 -0.22 -0.14 0.00 -1.03 0.00 0.00 54.13 52.97 1yww s LEU 24 Cb 0.19 -2.58 0.19 0.00 0.03 0.00 0.00 46.19 44.02 1yww s LEU 24 CO 0.52 -0.57 1.28 0.42 0.23 0.00 0.00 176.35 178.23 1yww s THR 25 N 2.45 2.01 0.33 5.49 -4.23 -1.26 -4.83 115.64 115.59 1yww s THR 25 Ca 0.18 -0.06 0.01 0.00 -1.18 0.00 0.00 61.69 60.65 1yww s THR 25 Cb -0.15 -2.96 0.27 0.00 1.34 0.00 0.00 72.50 71.00 1yww s THR 25 CO 0.15 0.00 1.97 -0.78 -0.54 0.00 0.00 174.62 175.41 1yww h ASP 26 N -1.50 0.82 -0.48 3.99 3.58 -1.97 -1.46 116.42 119.40 1yww h ASP 26 Ca -0.44 -0.01 -0.12 0.00 0.42 0.00 0.00 57.03 56.88 1yww h ASP 26 Cb 1.24 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.09 1yww h ASP 26 CO 0.40 0.57 -0.19 0.44 -2.88 0.00 0.00 179.24 177.58 1yww h ASP 27 N 0.95 0.99 -0.79 2.28 5.19 -1.98 -0.78 116.42 122.28 1yww h ASP 27 Ca 0.30 -0.39 -0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1yww h ASP 27 Cb 0.03 -0.27 -0.04 0.00 0.18 0.00 0.00 39.33 39.23 1yww h ASP 27 CO -0.08 1.15 0.48 0.44 -3.12 0.00 0.00 179.24 178.11 1yww h ASP 28 N 0.82 0.94 -0.02 6.45 3.32 -1.68 0.20 116.42 126.45 1yww h ASP 28 Ca 0.11 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1yww h ASP 28 Cb 0.76 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1yww h ASP 28 CO 0.06 0.72 -0.00 0.18 -1.72 0.00 0.00 179.24 178.48 1yww n LEU 29 N -4.38 1.86 -0.13 1.55 4.77 -0.63 -3.91 117.00 116.14 1yww n LEU 29 Ca 0.09 -0.62 -0.22 0.00 -0.03 0.00 0.00 56.01 55.23 1yww n LEU 29 Cb 0.06 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1yww n LEU 29 CO 0.37 0.31 -1.34 1.67 -1.33 0.00 0.00 177.39 177.07 1yww n GLN 30 N 0.46 0.58 -2.81 3.23 -0.06 -0.31 -4.76 117.38 113.71 1yww n GLN 30 Ca 0.18 0.19 -0.43 0.00 -2.00 0.00 0.00 57.00 54.94 1yww n GLN 30 Cb 0.41 -1.46 -0.03 0.00 -4.06 0.00 0.00 30.24 25.10 1yww n GLN 30 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1yww s ALA 31 N -2.48 3.10 -0.26 1.69 0.00 0.63 -4.91 121.76 119.53 1yww s ALA 31 Ca -0.34 -2.14 -0.27 0.00 0.00 0.00 0.00 51.96 49.20 1yww s ALA 31 Cb 0.11 -4.05 0.15 0.00 0.00 0.00 0.00 23.12 19.33 1yww s ALA 31 CO 0.51 -3.01 1.18 0.00 0.00 0.00 0.00 175.76 174.45 1yww s ALA 32 N 3.92 -2.05 0.20 0.00 0.00 -1.26 -4.83 121.76 117.73 1yww s ALA 32 Ca 0.30 1.76 0.03 0.00 0.00 0.00 0.00 51.96 54.04 1yww s ALA 32 Cb -0.10 -1.36 0.11 0.00 0.00 0.00 0.00 23.12 21.76 1yww s ALA 32 CO 0.02 -0.22 1.46 0.38 0.00 0.00 0.00 175.76 177.40 1yww h ASP 33 N 3.18 0.29 0.00 0.00 2.03 -2.00 -3.49 116.42 116.44 1yww h ASP 33 Ca -0.22 -0.20 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 1yww h ASP 33 Cb 1.18 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 1yww h ASP 33 CO 0.19 0.93 0.00 0.61 -1.03 0.00 0.00 179.24 179.95 1yww n GLY 34 N 0.58 0.57 3.61 7.15 0.00 -1.26 -4.99 105.19 110.86 1yww n GLY 34 Ca -0.03 -0.68 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 1yww n GLY 34 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1yww s HIS 35 N 0.00 -0.20 0.35 1.61 -3.43 -1.18 -4.24 115.29 108.20 1yww s HIS 35 Ca 0.00 0.36 0.10 0.00 -0.80 0.00 0.00 55.06 54.72 1yww s HIS 35 Cb 0.00 0.47 0.84 0.00 -1.43 0.00 0.00 32.58 32.46 1yww s HIS 35 CO 0.00 -0.18 1.84 0.00 -2.00 0.00 0.00 174.74 174.41 1yww h ALA 36 N 2.42 1.86 -0.50 -1.38 0.00 -1.97 0.09 119.26 119.77 1yww h ALA 36 Ca -0.14 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1yww h ALA 36 Cb 1.18 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1yww h ALA 36 CO 0.25 -0.14 0.33 1.49 0.00 0.00 0.00 179.25 181.19 1yww h GLU 37 N 0.67 0.56 0.00 0.00 4.81 -1.97 -1.46 114.58 117.19 1yww h GLU 37 Ca 0.49 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.57 1yww h GLU 37 Cb 0.84 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 1yww h GLU 37 CO -0.24 0.37 -0.55 -0.92 -0.73 0.00 0.00 179.01 176.95 1yww h TYR 38 N 0.58 0.00 -0.46 0.92 3.20 -1.38 -2.52 116.97 117.31 1yww h TYR 38 Ca 0.20 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.94 1yww h TYR 38 Cb 0.08 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1yww h TYR 38 CO -0.00 0.55 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.77 1yww h LEU 39 N 0.00 0.97 -0.73 2.82 4.07 -1.22 -1.04 115.31 120.18 1yww h LEU 39 Ca -0.01 -0.37 0.09 0.00 0.08 0.00 0.00 57.88 57.68 1yww h LEU 39 Cb 1.21 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 42.61 1yww h LEU 39 CO 0.07 1.15 0.37 0.58 -1.08 0.00 0.00 178.44 179.53 1yww h VAL 40 N 0.81 0.87 0.05 1.22 2.07 -1.09 0.17 116.25 120.34 1yww h VAL 40 Ca 0.10 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1yww h VAL 40 Cb 0.79 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1yww h VAL 40 CO 0.07 0.12 -0.02 1.23 0.02 0.00 0.00 177.57 178.98 1yww h GLY 41 N 0.64 -0.06 1.07 2.17 0.00 -1.04 -0.77 103.07 105.07 1yww h GLY 41 Ca 0.35 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 1yww h GLY 41 CO -0.26 -0.02 0.51 0.50 0.00 0.00 0.00 176.54 177.27 1yww h LYS 42 N -0.10 1.22 -0.36 4.80 1.79 -0.56 0.11 116.57 123.47 1yww h LYS 42 Ca -0.01 -0.13 -0.09 0.00 -2.18 0.00 0.00 60.65 58.25 1yww h LYS 42 Cb 0.09 -0.25 -0.02 0.00 -1.58 0.00 0.00 32.23 30.47 1yww h LYS 42 CO 0.01 0.88 -0.15 -0.07 -1.08 0.00 0.00 179.45 179.03 1yww h LEU 43 N 1.24 0.65 -0.19 2.94 3.38 -0.55 0.16 115.31 122.94 1yww h LEU 43 Ca 0.32 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1yww h LEU 43 Cb -0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1yww h LEU 43 CO -0.06 0.82 -0.02 1.56 0.09 0.00 0.00 178.44 180.84 1yww h GLN 44 N 0.59 0.34 -0.14 1.13 1.08 -0.30 -0.03 115.11 117.79 1yww h GLN 44 Ca 0.10 -0.12 -0.20 0.00 -1.45 0.00 0.00 58.65 56.98 1yww h GLN 44 Cb 0.60 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 28.01 1yww h GLN 44 CO 0.04 0.57 -0.68 0.93 -0.95 0.00 0.00 178.83 178.74 1yww h GLU 45 N 0.08 0.71 0.00 1.46 4.39 -0.59 -2.48 114.58 118.14 1yww h GLU 45 Ca 0.05 -0.57 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1yww h GLU 45 Cb 0.43 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1yww h GLU 45 CO 0.01 1.19 -0.12 0.00 -1.16 0.00 0.00 179.01 178.93 1yww h ARG 46 N 0.40 0.00 0.15 2.33 2.47 -0.77 -3.42 114.38 115.53 1yww h ARG 46 Ca -0.05 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 1yww h ARG 46 Cb 1.31 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.63 1yww h ARG 46 CO 0.14 0.00 -0.07 1.88 0.56 0.00 0.00 179.97 182.48 1yww h TYR 47 N -0.92 -0.18 0.00 3.04 0.05 -1.39 -3.49 116.97 114.08 1yww h TYR 47 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1yww h TYR 47 Cb 0.12 0.06 0.00 0.00 1.01 0.00 0.00 36.73 37.92 1yww h TYR 47 CO -0.05 0.13 0.00 0.41 -1.05 0.00 0.00 178.16 177.60 1yww n GLY 48 N 1.06 1.18 3.89 3.88 0.00 -0.14 -5.01 105.19 110.06 1yww n GLY 48 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1yww n GLY 48 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yww s TRP 49 N -2.00 3.57 0.68 1.61 0.51 -1.23 -5.00 118.94 117.09 1yww s TRP 49 Ca 0.00 1.01 -0.15 0.00 -2.12 0.00 0.00 56.10 54.84 1yww s TRP 49 Cb 0.00 -2.52 0.01 0.00 -0.81 0.00 0.00 33.47 30.15 1yww s TRP 49 CO 0.00 -0.50 1.12 -1.54 -0.51 0.00 0.00 176.95 175.52 1yww s SER 50 N -4.16 4.88 0.20 2.95 1.04 -1.26 -4.63 113.70 112.73 1yww s SER 50 Ca 0.51 2.05 -0.10 0.00 0.48 0.00 0.00 55.95 58.88 1yww s SER 50 Cb -0.11 -2.56 0.14 0.00 0.10 0.00 0.00 66.02 63.59 1yww s SER 50 CO 0.49 -1.79 1.82 0.50 0.98 0.00 0.00 173.24 175.25 1yww h LYS 51 N -0.14 1.00 -0.58 4.02 3.64 -1.97 0.60 116.57 123.15 1yww h LYS 51 Ca -0.47 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 58.80 1yww h LYS 51 Cb 1.25 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.85 1yww h LYS 51 CO 0.53 0.73 0.34 1.49 -2.27 0.00 0.00 179.45 180.27 1yww h GLU 52 N 0.99 0.80 -0.22 1.90 4.81 -1.99 0.29 114.58 121.16 1yww h GLU 52 Ca 0.26 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1yww h GLU 52 Cb 0.02 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1yww h GLU 52 CO -0.04 0.59 0.05 -0.09 -0.73 0.00 0.00 179.01 178.79 1yww h ARG 53 N 0.78 0.36 0.10 1.92 2.43 -1.82 -1.53 114.38 116.62 1yww h ARG 53 Ca 0.21 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1yww h ARG 53 Cb 0.01 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 1yww h ARG 53 CO -0.04 0.49 -0.23 0.00 -1.51 0.00 0.00 179.97 178.68 1yww h ALA 54 N 0.86 -0.38 -0.69 2.80 0.00 -0.64 0.16 119.26 121.36 1yww h ALA 54 Ca 0.07 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.10 1yww h ALA 54 Cb 0.29 0.38 -0.11 0.00 0.00 0.00 0.00 17.79 18.36 1yww h ALA 54 CO 0.00 -0.76 0.09 0.93 0.00 0.00 0.00 179.25 179.51 1yww h GLU 55 N -0.42 0.19 -0.09 0.00 4.39 -0.88 0.14 114.58 117.91 1yww h GLU 55 Ca 0.03 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1yww h GLU 55 Cb 0.46 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1yww h GLU 55 CO -0.14 0.12 -0.00 0.37 -1.16 0.00 0.00 179.01 178.20 1yww h GLN 56 N 0.19 0.15 0.00 2.33 4.15 -0.57 -2.72 115.11 118.64 1yww h GLN 56 Ca 0.38 -0.05 -0.05 0.00 0.77 0.00 0.00 58.65 59.70 1yww h GLN 56 Cb 0.64 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.31 1yww h GLN 56 CO -0.53 0.42 -0.24 0.93 -1.93 0.00 0.00 178.83 177.48 1yww h GLU 57 N -0.14 0.00 -0.24 1.69 5.08 -0.20 0.24 114.58 121.01 1yww h GLU 57 Ca 0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1yww h GLU 57 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1yww h GLU 57 CO 0.00 0.24 0.02 0.28 -1.00 0.00 0.00 179.01 178.55 1yww h VAL 58 N 0.00 1.24 -0.30 3.13 2.07 -0.65 0.62 116.25 122.37 1yww h VAL 58 Ca -0.00 -0.83 -0.15 0.00 0.82 0.00 0.00 66.70 66.54 1yww h VAL 58 Cb 0.81 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1yww h VAL 58 CO 0.03 0.26 -0.41 -0.09 0.02 0.00 0.00 177.57 177.38 1yww h ARG 59 N 0.21 0.73 -0.72 1.57 2.43 -1.15 -2.41 114.38 115.04 1yww h ARG 59 Ca 0.07 -0.39 0.09 0.00 -0.81 0.00 0.00 59.98 58.94 1yww h ARG 59 Cb 0.37 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 1yww h ARG 59 CO 0.01 1.01 0.48 0.22 -1.51 0.00 0.00 179.97 180.17 1yww h ASP 60 N 0.60 0.59 -0.32 -3.80 3.58 -0.37 0.49 116.42 117.18 1yww h ASP 60 Ca 0.05 0.01 -0.08 0.00 0.42 0.00 0.00 57.03 57.42 1yww h ASP 60 Cb 0.96 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 1yww h ASP 60 CO 0.09 0.36 -0.12 0.15 -2.88 0.00 0.00 179.24 176.84 1yww h PHE 61 N 0.66 0.74 0.00 0.28 3.57 -0.63 -2.08 116.94 119.47 1yww h PHE 61 Ca 0.33 -0.17 -0.07 0.00 3.53 0.00 0.00 57.97 61.58 1yww h PHE 61 Cb 0.41 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1yww h PHE 61 CO -0.00 0.85 -0.33 0.77 -2.23 0.00 0.00 178.31 177.36 1yww h SER 62 N 0.41 0.00 0.53 0.41 0.02 -0.58 -1.47 113.55 112.88 1yww h SER 62 Ca 0.07 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.90 1yww h SER 62 Cb 0.64 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1yww h SER 62 CO 0.04 0.33 -0.56 -0.78 -1.14 0.00 0.00 176.83 174.73 1yww h ASP 63 N 0.00 0.03 -0.25 3.07 3.58 0.01 -2.99 116.42 119.87 1yww h ASP 63 Ca -0.00 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1yww h ASP 63 Cb 0.63 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1yww h ASP 63 CO 0.04 0.58 0.00 0.54 -2.88 0.00 0.00 179.24 177.52 1yww n ARG 64 N -3.88 1.74 0.00 0.28 5.12 -0.58 -5.08 116.66 114.26 1yww n ARG 64 Ca -0.01 -1.14 0.12 0.00 -1.93 0.00 0.00 57.85 54.89 1yww n ARG 64 Cb 0.57 -1.33 0.73 0.00 -1.16 0.00 0.00 32.46 31.27 1yww n ARG 64 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98