#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yww n ASN 2 N 0.00 -0.09 -2.35 3.17 2.85 -1.26 -4.96 115.26 112.62 1yww n ASN 2 Ca 0.00 0.08 -0.17 0.00 -0.11 0.00 0.00 54.58 54.38 1yww n ASN 2 Cb 0.00 0.20 -0.12 0.00 1.24 0.00 0.00 39.78 41.10 1yww n ASN 2 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1yww n SER 3 N -1.83 5.51 -4.54 1.20 7.64 -1.26 -4.86 113.62 115.48 1yww n SER 3 Ca 0.00 -2.42 -0.41 0.00 1.01 0.00 0.00 58.87 57.05 1yww n SER 3 Cb 0.00 -1.32 -0.03 0.00 -1.01 0.00 0.00 64.21 61.85 1yww n SER 3 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1yww s ASP 4 N 2.18 6.31 0.37 6.43 1.01 -1.26 -4.81 116.67 126.90 1yww s ASP 4 Ca 0.61 -0.95 0.27 0.00 0.71 0.00 0.00 52.55 53.20 1yww s ASP 4 Cb 0.26 -2.54 1.21 0.00 1.01 0.00 0.00 42.92 42.86 1yww s ASP 4 CO -0.01 -1.64 1.82 -0.37 0.21 0.00 0.00 175.17 175.18 1yww h VAL 5 N 6.27 0.00 0.00 -1.27 -1.51 -1.96 -2.48 116.25 115.30 1yww h VAL 5 Ca -0.09 -0.26 -0.05 0.00 -1.23 0.00 0.00 66.70 65.07 1yww h VAL 5 Cb 1.04 1.05 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 1yww h VAL 5 CO 1.31 0.00 -0.23 0.40 -1.23 0.00 0.00 177.57 177.82 1yww h ILE 6 N 0.00 0.95 -0.67 7.19 2.04 -1.87 -2.11 117.51 123.04 1yww h ILE 6 Ca 0.00 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.05 1yww h ILE 6 Cb 0.33 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1yww h ILE 6 CO 0.00 0.23 0.44 0.50 0.00 0.00 0.00 178.15 179.32 1yww h LYS 7 N 0.00 0.75 0.00 2.37 1.63 -1.39 -2.55 116.57 117.39 1yww h LYS 7 Ca -0.00 -0.05 -0.32 0.00 -0.85 0.00 0.00 60.65 59.44 1yww h LYS 7 Cb 0.47 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.88 1yww h LYS 7 CO 0.03 0.50 -1.94 0.41 -3.45 0.00 0.00 179.45 175.00 1yww n GLY 8 N -1.45 -0.56 1.60 5.01 0.00 -0.99 -4.50 105.19 104.31 1yww n GLY 8 Ca 0.09 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1yww n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yww n LYS 9 N -4.34 1.61 -0.24 1.61 5.02 -0.83 -4.52 118.16 116.48 1yww n LYS 9 Ca -0.41 -1.46 0.04 0.00 -2.02 0.00 0.00 58.31 54.46 1yww n LYS 9 Cb 0.75 -1.57 0.16 0.00 -0.02 0.00 0.00 35.03 34.35 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 0.49 0.39 0.00 2.13 2.91 -1.68 -0.07 115.95 120.12 1yww h TRP 10 Ca 0.31 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.37 1yww h TRP 10 Cb 1.91 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 30.49 1yww h TRP 10 CO 0.78 0.02 0.00 1.63 -1.03 0.00 0.00 178.44 179.84 1yww n LYS 11 N -5.05 0.10 -0.08 2.65 4.76 -1.26 -2.17 118.16 117.11 1yww n LYS 11 Ca 0.12 0.29 -0.07 0.00 -2.87 0.00 0.00 58.31 55.79 1yww n LYS 11 Cb 0.38 -1.68 -0.16 0.00 -1.84 0.00 0.00 35.03 31.74 1yww n LYS 11 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1yww n GLN 12 N -1.86 0.68 -0.01 1.97 -0.06 -0.18 -4.30 117.38 113.62 1yww n GLN 12 Ca 0.03 0.00 0.14 0.00 -2.00 0.00 0.00 57.00 55.18 1yww n GLN 12 Cb 0.23 -1.56 0.71 0.00 -4.06 0.00 0.00 30.24 25.57 1yww n GLN 12 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1yww n LEU 13 N -2.72 0.65 0.07 1.69 4.77 -0.35 -3.93 117.00 117.17 1yww n LEU 13 Ca -0.27 -0.23 -0.12 0.00 -0.03 0.00 0.00 56.01 55.36 1yww n LEU 13 Cb 1.07 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 42.10 1yww n LEU 13 CO 0.44 0.11 0.68 0.71 -1.33 0.00 0.00 177.39 178.00 1yww h THR 14 N 0.99 0.39 0.00 -5.08 1.35 -1.68 0.31 112.91 109.19 1yww h THR 14 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1yww h THR 14 Cb 0.21 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.02 1yww h THR 14 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1yww n GLY 15 N -1.38 -1.30 0.13 5.82 0.00 -1.25 -1.70 105.19 105.51 1yww n GLY 15 Ca -0.05 0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 1yww n GLY 15 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yww h LYS 16 N 0.00 0.32 -0.31 1.61 3.11 -1.42 -1.77 116.57 118.11 1yww h LYS 16 Ca 0.00 -0.55 -0.05 0.00 -2.81 0.00 0.00 60.65 57.25 1yww h LYS 16 Cb 0.41 0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.83 1yww h LYS 16 CO 0.00 1.21 0.00 0.82 -2.81 0.00 0.00 179.45 178.67 1yww h ILE 17 N 0.09 1.26 -0.39 2.00 2.04 -0.23 -1.88 117.51 120.40 1yww h ILE 17 Ca -0.33 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 64.59 1yww h ILE 17 Cb 2.07 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 1yww h ILE 17 CO 0.16 0.30 0.25 0.50 0.00 0.00 0.00 178.15 179.36 1yww h LYS 18 N 0.35 0.52 0.00 2.37 3.64 -1.45 -0.93 116.57 121.06 1yww h LYS 18 Ca 0.09 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 1yww h LYS 18 Cb 0.43 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1yww h LYS 18 CO 0.02 0.35 -0.24 1.49 -2.27 0.00 0.00 179.45 178.79 1yww h GLU 19 N 0.53 0.00 0.00 1.90 4.81 -0.74 -2.41 114.58 118.67 1yww h GLU 19 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1yww h GLU 19 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1yww h GLU 19 CO -0.03 0.24 0.00 -2.13 -0.73 0.00 0.00 179.01 176.36 1yww n ARG 20 N -3.81 0.00 -0.04 1.92 0.63 -0.64 -4.79 116.66 109.93 1yww n ARG 20 Ca -0.02 0.21 -0.18 0.00 -0.92 0.00 0.00 57.85 56.94 1yww n ARG 20 Cb 0.34 -0.67 -0.13 0.00 0.45 0.00 0.00 32.46 32.45 1yww n ARG 20 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1yww h TRP 21 N 0.00 0.18 0.00 -0.14 6.55 -1.35 -3.48 115.95 117.71 1yww h TRP 21 Ca 0.00 -0.13 0.00 0.00 0.95 0.00 0.00 58.89 59.71 1yww h TRP 21 Cb 0.00 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.29 1yww h TRP 21 CO 0.00 1.25 0.00 0.41 -1.05 0.00 0.00 178.44 179.05 1yww n GLY 22 N 1.61 1.55 0.21 1.49 0.00 -0.90 -4.70 105.19 104.44 1yww n GLY 22 Ca -0.17 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 45.73 1yww n GLY 22 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1yww h ASP 23 N 0.00 0.00 -2.63 1.61 3.58 -1.92 -3.41 116.42 113.65 1yww h ASP 23 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 1yww h ASP 23 Cb 0.00 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.08 1yww h ASP 23 CO 0.00 0.29 1.04 -0.76 -2.88 0.00 0.00 179.24 176.93 1yww s LEU 24 N -8.00 4.38 0.73 2.28 1.43 -1.26 -4.99 118.68 113.25 1yww s LEU 24 Ca -0.03 2.65 -0.10 0.00 -1.03 0.00 0.00 54.13 55.63 1yww s LEU 24 Cb 0.14 -3.57 0.05 0.00 0.03 0.00 0.00 46.19 42.84 1yww s LEU 24 CO 0.69 -0.94 1.08 0.42 0.23 0.00 0.00 176.35 177.83 1yww s THR 25 N 2.40 2.59 0.39 5.49 -4.23 -1.26 -4.83 115.64 116.18 1yww s THR 25 Ca 0.77 0.02 0.19 0.00 -1.18 0.00 0.00 61.69 61.48 1yww s THR 25 Cb -0.44 -3.15 0.19 0.00 1.34 0.00 0.00 72.50 70.44 1yww s THR 25 CO 0.34 -0.19 1.95 -0.78 -0.54 0.00 0.00 174.62 175.40 1yww h ASP 26 N -0.73 0.00 0.22 3.99 3.58 -1.95 -1.36 116.42 120.17 1yww h ASP 26 Ca -0.45 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 56.92 1yww h ASP 26 Cb 1.30 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.34 1yww h ASP 26 CO 0.63 0.23 -0.30 0.44 -2.88 0.00 0.00 179.24 177.36 1yww h ASP 27 N 0.00 0.13 0.18 2.28 5.19 -1.95 -0.77 116.42 121.49 1yww h ASP 27 Ca -0.00 -0.04 -0.14 0.00 -0.62 0.00 0.00 57.03 56.23 1yww h ASP 27 Cb 0.48 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1yww h ASP 27 CO 0.03 0.44 -0.52 0.44 -3.12 0.00 0.00 179.24 176.51 1yww h ASP 28 N 0.12 0.41 -0.34 6.45 3.32 -1.62 -3.24 116.42 121.53 1yww h ASP 28 Ca 0.02 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1yww h ASP 28 Cb 0.60 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1yww h ASP 28 CO 0.04 0.86 0.00 0.18 -1.72 0.00 0.00 179.24 178.60 1yww n LEU 29 N -3.95 3.40 -0.12 1.55 4.77 -0.93 -4.04 117.00 117.69 1yww n LEU 29 Ca -0.02 -1.44 0.08 0.00 -0.03 0.00 0.00 56.01 54.60 1yww n LEU 29 Cb 0.57 -0.21 0.11 0.00 -2.33 0.00 0.00 43.42 41.56 1yww n LEU 29 CO 0.45 0.71 0.52 1.67 -1.33 0.00 0.00 177.39 179.41 1yww n GLN 30 N 1.47 1.23 0.00 3.23 7.27 -0.34 -4.86 117.38 125.37 1yww n GLN 30 Ca 0.18 -2.29 0.00 0.00 0.07 0.00 0.00 57.00 54.96 1yww n GLN 30 Cb 0.60 -1.33 0.00 0.00 2.41 0.00 0.00 30.24 31.92 1yww n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1yww n ALA 31 N -1.18 0.00 -2.44 1.69 0.00 -1.23 -5.01 120.51 112.33 1yww n ALA 31 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1yww n ALA 31 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1yww n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yww n ALA 32 N -1.99 0.00 -1.48 0.00 0.00 -1.26 -5.09 120.51 110.69 1yww n ALA 32 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 1yww n ALA 32 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 1yww n ALA 32 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1yww s ASP 33 N -1.00 5.07 -0.21 0.00 2.15 -1.26 -4.95 116.67 116.46 1yww s ASP 33 Ca 0.00 1.94 0.06 0.00 0.43 0.00 0.00 52.55 54.98 1yww s ASP 33 Cb 0.00 -2.54 0.49 0.00 -0.30 0.00 0.00 42.92 40.56 1yww s ASP 33 CO 0.00 -1.66 1.43 0.61 -0.17 0.00 0.00 175.17 175.39 1yww n GLY 34 N -0.75 2.97 3.74 2.66 0.00 -1.26 -4.77 105.19 107.79 1yww n GLY 34 Ca 0.10 -0.64 -0.36 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.13 2.24 0.27 1.61 -3.43 -1.26 -3.14 115.29 109.44 1yww s HIS 35 Ca 0.36 1.50 -0.01 0.00 -0.80 0.00 0.00 55.06 56.10 1yww s HIS 35 Cb 0.29 -3.59 0.50 0.00 -1.43 0.00 0.00 32.58 28.35 1yww s HIS 35 CO 0.09 -2.57 1.81 0.00 -2.00 0.00 0.00 174.74 172.07 1yww h ALA 36 N 0.74 1.35 -0.35 -1.38 0.00 -1.96 0.52 119.26 118.18 1yww h ALA 36 Ca -0.51 0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.55 1yww h ALA 36 Cb 1.32 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1yww h ALA 36 CO 0.54 0.10 0.28 0.93 0.00 0.00 0.00 179.25 181.10 1yww h GLU 37 N 0.83 0.00 -0.27 0.00 4.39 -1.97 -0.48 114.58 117.09 1yww h GLU 37 Ca 0.46 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 60.02 1yww h GLU 37 Cb 0.50 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1yww h GLU 37 CO -0.29 0.00 -0.38 -0.92 -1.16 0.00 0.00 179.01 176.26 1yww h TYR 38 N 0.00 0.90 -0.18 4.33 3.20 -1.19 0.18 116.97 124.21 1yww h TYR 38 Ca 0.17 -0.30 -0.04 0.00 3.14 0.00 0.00 58.73 61.70 1yww h TYR 38 Cb 0.73 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 1yww h TYR 38 CO 0.00 1.07 -0.03 -0.07 -1.64 0.00 0.00 178.16 177.49 1yww h LEU 39 N 0.47 0.34 -0.35 2.82 4.07 -1.27 -1.07 115.31 120.31 1yww h LEU 39 Ca 0.03 -0.35 0.07 0.00 0.08 0.00 0.00 57.88 57.70 1yww h LEU 39 Cb 0.98 -0.09 -0.06 0.00 1.08 0.00 0.00 40.66 42.56 1yww h LEU 39 CO 0.09 0.61 -0.03 0.58 -1.08 0.00 0.00 178.44 178.62 1yww h VAL 40 N 0.06 0.71 -0.49 1.22 2.07 -1.06 0.13 116.25 118.90 1yww h VAL 40 Ca 0.05 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 1yww h VAL 40 Cb 0.46 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1yww h VAL 40 CO 0.02 0.01 0.30 1.23 0.02 0.00 0.00 177.57 179.14 1yww h GLY 41 N 0.06 0.71 2.00 2.17 0.00 -0.56 -1.98 103.07 105.47 1yww h GLY 41 Ca 0.17 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1yww h GLY 41 CO -0.31 0.28 -0.46 0.50 0.00 0.00 0.00 176.54 176.56 1yww h LYS 42 N 0.65 0.00 -0.08 4.80 1.57 -0.68 0.13 116.57 122.97 1yww h LYS 42 Ca 0.18 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1yww h LYS 42 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1yww h LYS 42 CO -0.03 0.46 -0.42 -0.07 -0.57 0.00 0.00 179.45 178.82 1yww h LEU 43 N 0.00 0.19 -0.27 2.94 3.38 -0.49 0.62 115.31 121.68 1yww h LEU 43 Ca -0.00 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 1yww h LEU 43 Cb 0.96 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1yww h LEU 43 CO 0.06 0.59 -0.76 1.56 0.09 0.00 0.00 178.44 179.99 1yww h GLN 44 N 0.15 0.00 0.38 1.13 4.20 -0.58 0.19 115.11 120.58 1yww h GLN 44 Ca 0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1yww h GLN 44 Cb 0.81 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.59 1yww h GLN 44 CO 0.06 0.76 -0.18 0.93 -0.67 0.00 0.00 178.83 179.73 1yww h GLU 45 N 0.00 -0.49 0.04 1.46 5.08 -0.33 -2.98 114.58 117.36 1yww h GLU 45 Ca -0.01 0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 1yww h GLU 45 Cb 1.46 0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.83 1yww h GLU 45 CO 0.10 -0.33 -0.47 -0.09 -1.00 0.00 0.00 179.01 177.22 1yww h ARG 46 N -0.82 0.25 0.04 2.33 9.65 -1.01 -3.37 114.38 121.46 1yww h ARG 46 Ca -0.05 -0.32 -0.37 0.00 -1.10 0.00 0.00 59.98 58.13 1yww h ARG 46 Cb 0.39 0.10 -0.05 0.00 -1.39 0.00 0.00 29.97 29.02 1yww h ARG 46 CO 0.09 1.07 -2.25 0.66 2.80 0.00 0.00 179.97 182.33 1yww n TYR 47 N -4.34 0.51 -2.06 2.20 4.02 -0.74 -5.02 117.16 111.73 1yww n TYR 47 Ca -0.11 0.12 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 1yww n TYR 47 Cb 0.63 -1.07 0.00 0.00 -0.02 0.00 0.00 39.34 38.88 1yww n TYR 47 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1yww n GLY 48 N 2.08 0.93 3.91 2.72 0.00 0.60 -4.98 105.19 110.45 1yww n GLY 48 Ca -0.38 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.83 3.02 0.53 1.61 0.51 -1.16 -4.94 118.94 115.69 1yww s TRP 49 Ca 0.00 0.65 -0.17 0.00 -2.12 0.00 0.00 56.10 54.45 1yww s TRP 49 Cb 0.00 -3.22 -0.06 0.00 -0.81 0.00 0.00 33.47 29.38 1yww s TRP 49 CO 0.00 -1.43 1.02 -1.12 -0.51 0.00 0.00 176.95 174.92 1yww s SER 50 N -4.49 6.24 0.26 2.95 0.01 -1.26 -4.56 113.70 112.85 1yww s SER 50 Ca 0.60 1.76 -0.04 0.00 1.31 0.00 0.00 55.95 59.57 1yww s SER 50 Cb -0.11 -2.53 0.31 0.00 0.21 0.00 0.00 66.02 63.90 1yww s SER 50 CO 0.47 -0.85 1.88 0.50 0.41 0.00 0.00 173.24 175.65 1yww h LYS 51 N 0.94 1.13 -0.62 12.44 3.64 -1.97 0.24 116.57 132.36 1yww h LYS 51 Ca -0.48 -0.13 0.06 0.00 -1.27 0.00 0.00 60.65 58.83 1yww h LYS 51 Cb 1.21 -0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 32.75 1yww h LYS 51 CO 0.59 0.83 0.33 1.49 -2.27 0.00 0.00 179.45 180.43 1yww h GLU 52 N 1.14 0.60 -0.30 1.90 4.81 -1.99 0.26 114.58 120.99 1yww h GLU 52 Ca 0.29 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.34 1yww h GLU 52 Cb 0.04 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 1yww h GLU 52 CO -0.04 0.40 -0.36 -0.09 -0.73 0.00 0.00 179.01 178.18 1yww h ARG 53 N 0.62 0.78 0.09 1.92 2.43 -1.67 -0.74 114.38 117.80 1yww h ARG 53 Ca 0.28 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1yww h ARG 53 Cb 0.19 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1yww h ARG 53 CO -0.19 1.06 -0.09 0.00 -1.51 0.00 0.00 179.97 179.24 1yww h ALA 54 N 0.71 -0.18 -0.54 2.80 0.00 -0.10 0.24 119.26 122.18 1yww h ALA 54 Ca 0.04 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.01 1yww h ALA 54 Cb 0.95 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 1yww h ALA 54 CO 0.09 -0.61 0.19 0.93 0.00 0.00 0.00 179.25 179.85 1yww h GLU 55 N -0.21 0.36 -0.48 0.00 4.39 -0.47 0.17 114.58 118.34 1yww h GLU 55 Ca 0.01 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1yww h GLU 55 Cb 0.20 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1yww h GLU 55 CO -0.03 0.24 0.28 0.37 -1.16 0.00 0.00 179.01 178.71 1yww h GLN 56 N 0.37 0.66 -0.55 2.33 4.15 -0.63 0.93 115.11 122.37 1yww h GLN 56 Ca 0.27 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.56 1yww h GLN 56 Cb 0.30 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 1yww h GLN 56 CO -0.27 0.49 0.11 0.93 -1.93 0.00 0.00 178.83 178.16 1yww h GLU 57 N 0.64 0.90 -0.17 1.69 4.39 0.01 -0.07 114.58 121.98 1yww h GLU 57 Ca 0.17 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1yww h GLU 57 Cb 0.01 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1yww h GLU 57 CO -0.03 0.86 0.05 0.28 -1.16 0.00 0.00 179.01 179.01 1yww h VAL 58 N 0.80 1.19 -0.23 3.13 2.07 -0.34 0.32 116.25 123.19 1yww h VAL 58 Ca 0.17 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 1yww h VAL 58 Cb 0.39 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1yww h VAL 58 CO 0.01 0.18 0.01 0.03 0.02 0.00 0.00 177.57 177.81 1yww h ARG 59 N 0.09 0.33 -0.00 1.57 3.08 -0.75 -1.37 114.38 117.32 1yww h ARG 59 Ca 0.05 -0.05 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 1yww h ARG 59 Cb 0.24 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1yww h ARG 59 CO -0.00 0.35 -0.83 0.22 -1.07 0.00 0.00 179.97 178.64 1yww h ASP 60 N 0.32 0.15 -0.41 7.04 3.58 -0.64 -3.07 116.42 123.38 1yww h ASP 60 Ca 0.08 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.37 1yww h ASP 60 Cb 0.21 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 1yww h ASP 60 CO 0.00 0.91 0.11 0.15 -2.88 0.00 0.00 179.24 177.54 1yww h PHE 61 N 0.06 0.68 0.00 0.28 3.57 0.69 -2.28 116.94 119.94 1yww h PHE 61 Ca -0.03 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1yww h PHE 61 Cb 1.44 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1yww h PHE 61 CO 0.02 0.64 0.00 -1.13 -2.23 0.00 0.00 178.31 175.60 1yww n SER 62 N -4.57 0.64 0.17 0.41 3.41 -0.72 -2.24 113.62 110.72 1yww n SER 62 Ca -0.00 0.68 0.01 0.00 -0.26 0.00 0.00 58.87 59.31 1yww n SER 62 Cb 0.19 -0.81 0.32 0.00 -0.26 0.00 0.00 64.21 63.65 1yww n SER 62 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1yww h ASP 63 N 0.00 0.04 -0.39 4.04 3.58 -1.31 -2.83 116.42 119.55 1yww h ASP 63 Ca 0.00 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1yww h ASP 63 Cb 0.29 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 1yww h ASP 63 CO 0.00 0.44 0.00 0.54 -2.88 0.00 0.00 179.24 177.34 1yww n ARG 64 N -4.06 3.70 0.00 0.28 1.74 -0.95 -5.13 116.66 112.25 1yww n ARG 64 Ca -0.02 -2.98 0.11 0.00 -0.77 0.00 0.00 57.85 54.20 1yww n ARG 64 Cb 0.44 -2.02 0.10 0.00 -1.02 0.00 0.00 32.46 29.95 1yww n ARG 64 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39