#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 1.61 -0.31 7.83 4.22 -1.26 -5.08 114.94 121.95 1yww s ASN 2 Ca 0.00 -0.27 0.01 0.00 -2.14 0.00 0.00 52.86 50.47 1yww s ASN 2 Cb 0.00 -0.75 0.15 0.00 1.28 0.00 0.00 41.25 41.93 1yww s ASN 2 CO 0.00 0.02 0.36 -0.55 -2.04 0.00 0.00 177.10 174.89 1yww s SER 3 N 0.71 1.01 0.00 3.54 0.15 -1.26 -4.97 113.70 112.88 1yww s SER 3 Ca -0.14 -0.76 0.02 0.00 0.70 0.00 0.00 55.95 55.77 1yww s SER 3 Cb -0.16 0.79 0.03 0.00 -1.71 0.00 0.00 66.02 64.97 1yww s SER 3 CO 0.03 -0.35 0.88 -0.90 1.20 0.00 0.00 173.24 174.11 1yww n ASP 4 N 5.12 0.04 0.06 5.45 5.68 -1.26 -4.84 116.55 126.79 1yww n ASP 4 Ca 0.02 -1.74 0.21 0.00 -0.50 0.00 0.00 54.79 52.77 1yww n ASP 4 Cb 0.48 -0.14 0.74 0.00 -1.14 0.00 0.00 41.12 41.05 1yww n ASP 4 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 1yww h VAL 5 N 6.42 0.47 -0.51 2.12 3.04 -1.97 -2.45 116.25 123.38 1yww h VAL 5 Ca -0.03 0.00 0.04 0.00 -1.01 0.00 0.00 66.70 65.70 1yww h VAL 5 Cb 1.33 0.67 -0.04 0.00 -2.01 0.00 0.00 31.29 31.24 1yww h VAL 5 CO -0.00 0.00 0.26 0.40 -1.01 0.00 0.00 177.57 177.22 1yww h ILE 6 N 0.00 0.96 0.00 3.17 1.08 -1.90 -2.38 117.51 118.44 1yww h ILE 6 Ca 0.22 -0.18 -0.10 0.00 -0.39 0.00 0.00 64.86 64.41 1yww h ILE 6 Cb 1.07 0.40 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 1yww h ILE 6 CO -0.00 0.09 -0.47 0.07 -0.69 0.00 0.00 178.15 177.15 1yww h LYS 7 N 0.51 0.00 -0.06 2.37 2.10 -1.36 -1.59 116.57 118.54 1yww h LYS 7 Ca 0.23 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.65 1yww h LYS 7 Cb 0.13 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.46 1yww h LYS 7 CO -0.15 0.47 -0.86 0.78 -2.00 0.00 0.00 179.45 177.69 1yww h GLY 8 N 1.79 0.63 -2.99 0.07 0.00 -1.55 -3.17 103.07 97.85 1yww h GLY 8 Ca -0.00 -0.99 0.00 0.00 0.00 0.00 0.00 47.33 46.34 1yww h GLY 8 CO 0.06 0.88 0.00 0.28 0.00 0.00 0.00 176.54 177.76 1yww n LYS 9 N -3.84 3.98 -0.18 4.80 4.76 -0.98 -4.73 118.16 121.97 1yww n LYS 9 Ca -0.07 -2.94 -0.02 0.00 -2.87 0.00 0.00 58.31 52.41 1yww n LYS 9 Cb 0.79 -1.98 0.04 0.00 -1.84 0.00 0.00 35.03 32.04 1yww n LYS 9 CO 0.00 0.00 0.00 2.35 -1.37 0.00 0.00 177.40 178.38 1yww h TRP 10 N 3.76 -0.35 0.00 2.13 2.91 -1.26 0.47 115.95 123.61 1yww h TRP 10 Ca 0.00 0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.07 1yww h TRP 10 Cb 1.58 0.24 0.00 0.00 -0.51 0.00 0.00 29.16 30.47 1yww h TRP 10 CO 0.82 -0.25 0.00 0.87 -1.03 0.00 0.00 178.44 178.85 1yww h LYS 11 N -0.02 0.00 0.00 2.65 1.79 -1.86 -1.09 116.57 118.04 1yww h LYS 11 Ca 0.26 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.37 1yww h LYS 11 Cb 0.42 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.00 1yww h LYS 11 CO -0.57 0.00 -2.30 0.94 -1.08 0.00 0.00 179.45 176.44 1yww n GLN 12 N -2.74 0.68 0.15 3.15 7.27 0.24 -4.35 117.38 121.78 1yww n GLN 12 Ca 0.00 0.05 0.13 0.00 0.07 0.00 0.00 57.00 57.25 1yww n GLN 12 Cb 0.23 -1.56 0.40 0.00 2.41 0.00 0.00 30.24 31.71 1yww n GLN 12 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1yww h LEU 13 N 0.00 0.00 -1.34 1.69 3.38 0.50 -3.27 115.31 116.28 1yww h LEU 13 Ca -0.52 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.56 1yww h LEU 13 Cb 2.19 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.88 1yww h LEU 13 CO 0.03 0.00 0.53 0.71 0.09 0.00 0.00 178.44 179.80 1yww h THR 14 N 0.00 0.92 0.00 0.22 1.35 -1.42 0.66 112.91 114.64 1yww h THR 14 Ca 0.00 -0.25 -0.10 0.00 -0.55 0.00 0.00 66.41 65.51 1yww h THR 14 Cb 0.71 0.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.26 1yww h THR 14 CO 0.00 0.13 -0.48 1.23 -0.25 0.00 0.00 175.52 176.15 1yww h GLY 15 N 0.72 0.00 1.37 5.82 0.00 -1.86 -2.41 103.07 106.71 1yww h GLY 15 Ca 0.38 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.45 1yww h GLY 15 CO -0.15 0.00 -1.44 0.50 0.00 0.00 0.00 176.54 175.45 1yww h LYS 16 N 0.00 0.00 -0.53 4.80 1.57 -0.93 -2.51 116.57 118.97 1yww h LYS 16 Ca -0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1yww h LYS 16 Cb 1.03 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1yww h LYS 16 CO 0.06 0.69 0.12 0.82 -0.57 0.00 0.00 179.45 180.58 1yww h ILE 17 N 0.00 1.24 0.00 1.86 2.04 0.18 -0.84 117.51 122.00 1yww h ILE 17 Ca -0.18 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1yww h ILE 17 Cb 1.92 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1yww h ILE 17 CO 0.10 0.32 0.00 0.50 0.00 0.00 0.00 178.15 179.07 1yww h LYS 18 N 0.75 0.00 -0.00 2.37 3.64 -1.48 0.30 116.57 122.14 1yww h LYS 18 Ca 0.17 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.35 1yww h LYS 18 Cb 0.35 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1yww h LYS 18 CO 0.00 0.00 -0.74 1.49 -2.27 0.00 0.00 179.45 177.93 1yww h GLU 19 N 0.00 0.51 -0.06 1.90 4.57 -0.93 -3.15 114.58 117.42 1yww h GLU 19 Ca 0.00 -0.54 -0.11 0.00 -1.18 0.00 0.00 59.36 57.53 1yww h GLU 19 Cb 0.50 0.15 0.01 0.00 -0.16 0.00 0.00 28.75 29.25 1yww h GLU 19 CO 0.00 1.18 -0.39 0.00 -1.18 0.00 0.00 179.01 178.62 1yww h ARG 20 N 0.06 0.37 -4.73 1.92 2.47 -0.80 -3.41 114.38 110.27 1yww h ARG 20 Ca -0.09 -0.32 -0.66 0.00 -1.26 0.00 0.00 59.98 57.65 1yww h ARG 20 Cb 1.44 0.07 -0.39 0.00 -1.65 0.00 0.00 29.97 29.44 1yww h ARG 20 CO 0.15 0.97 -0.74 -1.58 0.56 0.00 0.00 179.97 179.32 1yww s TRP 21 N -3.56 3.61 -1.48 3.04 0.51 0.10 -4.99 118.94 116.18 1yww s TRP 21 Ca -0.14 -2.81 0.30 0.00 -2.12 0.00 0.00 56.10 51.33 1yww s TRP 21 Cb 0.04 -2.65 1.55 0.00 -0.81 0.00 0.00 33.47 31.60 1yww s TRP 21 CO 0.79 -0.93 2.06 0.41 -0.51 0.00 0.00 176.95 178.77 1yww n GLY 22 N 4.31 -1.25 0.01 0.98 0.00 -1.19 -2.87 105.19 105.18 1yww n GLY 22 Ca -0.01 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1yww n GLY 22 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yww n ASP 23 N -1.25 0.64 -4.64 1.61 2.03 -1.26 -4.80 116.55 108.88 1yww n ASP 23 Ca 0.15 -0.39 -0.43 0.00 0.52 0.00 0.00 54.79 54.64 1yww n ASP 23 Cb 0.23 0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 41.11 1yww n ASP 23 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1yww s LEU 24 N -3.23 4.02 0.66 -2.67 1.43 -1.14 -5.04 118.68 112.72 1yww s LEU 24 Ca 0.09 1.02 -0.08 0.00 -1.03 0.00 0.00 54.13 54.13 1yww s LEU 24 Cb 0.16 -3.40 0.03 0.00 0.03 0.00 0.00 46.19 43.01 1yww s LEU 24 CO 0.76 -0.74 1.00 0.42 0.23 0.00 0.00 176.35 178.01 1yww s THR 25 N 3.32 3.15 0.32 5.49 -4.23 -1.26 -4.67 115.64 117.76 1yww s THR 25 Ca 0.41 0.05 0.25 0.00 -1.18 0.00 0.00 61.69 61.23 1yww s THR 25 Cb -0.13 -3.31 0.26 0.00 1.34 0.00 0.00 72.50 70.65 1yww s THR 25 CO 0.12 -0.36 1.97 -2.24 -0.54 0.00 0.00 174.62 173.58 1yww h ASP 26 N -0.46 0.00 0.23 3.99 3.04 -1.96 -2.11 116.42 119.15 1yww h ASP 26 Ca -0.45 0.00 -0.15 0.00 -3.24 0.00 0.00 57.03 53.19 1yww h ASP 26 Cb 1.28 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.56 1yww h ASP 26 CO 0.62 0.18 -0.56 -0.78 -2.04 0.00 0.00 179.24 176.65 1yww h ASP 27 N 0.00 0.39 0.49 4.15 3.58 -1.93 0.31 116.42 123.41 1yww h ASP 27 Ca -0.00 -0.21 -0.11 0.00 0.42 0.00 0.00 57.03 57.13 1yww h ASP 27 Cb 0.49 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 1yww h ASP 27 CO 0.02 0.87 -0.52 0.44 -2.88 0.00 0.00 179.24 177.17 1yww h ASP 28 N 0.26 0.03 0.01 2.28 3.32 -1.76 -3.35 116.42 117.22 1yww h ASP 28 Ca 0.00 -0.02 -0.37 0.00 0.02 0.00 0.00 57.03 56.66 1yww h ASP 28 Cb 1.06 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.55 1yww h ASP 28 CO 0.09 0.55 -2.05 0.18 -1.72 0.00 0.00 179.24 176.29 1yww n LEU 29 N -3.93 2.04 -3.25 1.55 4.77 -1.11 -4.50 117.00 112.57 1yww n LEU 29 Ca -0.01 0.33 -0.36 0.00 -0.03 0.00 0.00 56.01 55.93 1yww n LEU 29 Cb 0.53 -0.90 -0.03 0.00 -2.33 0.00 0.00 43.42 40.69 1yww n LEU 29 CO 0.41 0.51 3.22 0.00 -1.33 0.00 0.00 177.39 180.20 1yww n GLN 30 N -4.20 3.44 -0.32 3.23 6.02 0.11 -2.94 117.38 122.71 1yww n GLN 30 Ca -0.45 -2.06 -0.01 0.00 -0.01 0.00 0.00 57.00 54.48 1yww n GLN 30 Cb 0.83 -2.73 -0.01 0.00 1.02 0.00 0.00 30.24 29.36 1yww n GLN 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yww n ALA 31 N 3.62 0.80 -2.38 -1.58 0.00 -1.26 -4.86 120.51 114.85 1yww n ALA 31 Ca 0.73 -0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.92 1yww n ALA 31 Cb 0.24 -0.06 -0.10 0.00 0.00 0.00 0.00 19.45 19.53 1yww n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yww s ALA 32 N 0.00 2.10 0.03 0.00 0.00 -1.15 -5.06 121.76 117.67 1yww s ALA 32 Ca 0.00 -1.82 -0.28 0.00 0.00 0.00 0.00 51.96 49.87 1yww s ALA 32 Cb 0.00 0.92 -0.17 0.00 0.00 0.00 0.00 23.12 23.88 1yww s ALA 32 CO 0.00 -0.41 1.35 0.22 0.00 0.00 0.00 175.76 176.92 1yww h ASP 33 N 2.20 -0.55 0.00 0.00 1.82 -1.99 -3.49 116.42 114.42 1yww h ASP 33 Ca -0.38 -0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.20 1yww h ASP 33 Cb 1.25 0.14 0.00 0.00 0.68 0.00 0.00 39.33 41.40 1yww h ASP 33 CO 0.61 -0.24 0.00 0.61 -1.61 0.00 0.00 179.24 178.61 1yww n GLY 34 N -0.77 0.90 3.75 -0.78 0.00 -1.26 -4.89 105.19 102.14 1yww n GLY 34 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.10 2.44 0.25 1.61 -3.43 -1.26 -3.08 115.29 110.73 1yww s HIS 35 Ca 0.00 1.59 -0.03 0.00 -0.80 0.00 0.00 55.06 55.82 1yww s HIS 35 Cb 0.00 -3.13 0.50 0.00 -1.43 0.00 0.00 32.58 28.52 1yww s HIS 35 CO 0.00 -1.95 1.72 0.00 -2.00 0.00 0.00 174.74 172.51 1yww h ALA 36 N -0.94 1.10 0.00 -1.38 0.00 -1.91 -0.11 119.26 116.03 1yww h ALA 36 Ca -0.44 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1yww h ALA 36 Cb 1.24 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1yww h ALA 36 CO 0.51 -0.25 -0.00 0.93 0.00 0.00 0.00 179.25 180.44 1yww h GLU 37 N 0.41 0.00 -0.02 0.00 4.39 -1.98 -0.79 114.58 116.59 1yww h GLU 37 Ca 0.44 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.97 1yww h GLU 37 Cb 0.71 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 1yww h GLU 37 CO -0.44 0.00 -0.75 -0.92 -1.16 0.00 0.00 179.01 175.74 1yww h TYR 38 N 0.00 0.20 -0.47 4.33 5.03 -1.35 -1.74 116.97 122.98 1yww h TYR 38 Ca -0.00 -0.10 -0.01 0.00 2.58 0.00 0.00 58.73 61.20 1yww h TYR 38 Cb 0.00 -0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.24 1yww h TYR 38 CO 0.00 0.84 0.24 -0.07 -1.32 0.00 0.00 178.16 177.84 1yww h LEU 39 N 0.09 0.60 -0.66 2.82 4.07 -1.19 -0.32 115.31 120.72 1yww h LEU 39 Ca -0.02 -0.12 0.07 0.00 0.08 0.00 0.00 57.88 57.89 1yww h LEU 39 Cb 1.32 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.85 1yww h LEU 39 CO 0.11 0.55 0.35 0.58 -1.08 0.00 0.00 178.44 178.95 1yww h VAL 40 N 0.61 0.92 -0.19 1.22 2.07 -1.19 0.23 116.25 119.93 1yww h VAL 40 Ca 0.16 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1yww h VAL 40 Cb 0.10 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1yww h VAL 40 CO -0.02 0.12 0.12 1.23 0.02 0.00 0.00 177.57 179.03 1yww h GLY 41 N 0.63 0.28 1.43 2.17 0.00 -0.86 -1.33 103.07 105.40 1yww h GLY 41 Ca 0.31 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 1yww h GLY 41 CO -0.21 0.11 0.33 0.50 0.00 0.00 0.00 176.54 177.28 1yww h LYS 42 N 0.23 0.75 0.00 4.80 1.79 -0.40 0.35 116.57 124.09 1yww h LYS 42 Ca 0.07 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.40 1yww h LYS 42 Cb 0.02 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.50 1yww h LYS 42 CO -0.01 0.53 -0.39 -0.07 -1.08 0.00 0.00 179.45 178.43 1yww h LEU 43 N 0.77 0.00 0.09 2.94 3.38 -0.12 0.22 115.31 122.59 1yww h LEU 43 Ca 0.20 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.05 1yww h LEU 43 Cb -0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.74 1yww h LEU 43 CO -0.04 0.39 -0.54 1.56 0.09 0.00 0.00 178.44 179.89 1yww h GLN 44 N 0.00 0.21 -0.17 1.13 1.08 -0.20 -0.28 115.11 116.89 1yww h GLN 44 Ca -0.00 -0.35 0.00 0.00 -1.45 0.00 0.00 58.65 56.85 1yww h GLN 44 Cb 0.74 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 28.29 1yww h GLN 44 CO 0.05 1.15 0.11 1.49 -0.95 0.00 0.00 178.83 180.68 1yww h GLU 45 N -0.55 0.22 0.09 1.46 4.81 -0.18 -2.75 114.58 117.68 1yww h GLU 45 Ca -0.09 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 58.98 1yww h GLU 45 Cb 1.41 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.75 1yww h GLU 45 CO 0.10 0.16 -0.67 -0.09 -0.73 0.00 0.00 179.01 177.78 1yww h ARG 46 N 0.21 0.19 0.00 1.92 9.65 -0.71 -3.44 114.38 122.20 1yww h ARG 46 Ca 0.06 -0.32 0.00 0.00 -1.10 0.00 0.00 59.98 58.62 1yww h ARG 46 Cb -0.01 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1yww h ARG 46 CO -0.01 1.15 0.00 0.66 2.80 0.00 0.00 179.97 184.57 1yww n TYR 47 N -4.26 0.00 0.00 2.20 4.02 -0.80 -5.07 117.16 113.24 1yww n TYR 47 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 1yww n TYR 47 Cb 0.72 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.04 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 2.41 0.72 0.00 2.72 0.00 -0.18 -4.95 105.19 105.91 1yww n GLY 48 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1yww n GLY 48 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1yww n TRP 49 N 0.00 -0.66 -2.95 1.61 8.01 -1.26 -5.02 117.44 117.17 1yww n TRP 49 Ca 0.00 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.89 1yww n TRP 49 Cb 0.00 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.27 1yww n TRP 49 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 1yww s SER 50 N -0.81 6.48 0.34 -0.99 1.04 -1.26 -4.92 113.70 113.59 1yww s SER 50 Ca 0.00 1.02 0.09 0.00 0.48 0.00 0.00 55.95 57.54 1yww s SER 50 Cb 0.00 -2.28 0.62 0.00 0.10 0.00 0.00 66.02 64.47 1yww s SER 50 CO 0.00 -0.37 1.80 0.50 0.98 0.00 0.00 173.24 176.15 1yww h LYS 51 N 1.27 0.19 0.05 4.02 3.64 -1.98 0.34 116.57 124.11 1yww h LYS 51 Ca -0.47 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 58.86 1yww h LYS 51 Cb 1.19 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 1yww h LYS 51 CO 0.64 0.48 -0.24 1.49 -2.27 0.00 0.00 179.45 179.55 1yww h GLU 52 N 0.17 -0.39 -0.25 1.90 4.22 -1.99 -0.48 114.58 117.76 1yww h GLU 52 Ca 0.02 0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.44 1yww h GLU 52 Cb 0.63 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1yww h GLU 52 CO 0.05 -0.26 -0.05 -0.09 -2.18 0.00 0.00 179.01 176.47 1yww h ARG 53 N -0.41 0.47 -0.47 1.92 2.43 -1.78 -2.02 114.38 114.52 1yww h ARG 53 Ca 0.05 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1yww h ARG 53 Cb 0.46 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1yww h ARG 53 CO -0.18 0.69 0.23 0.00 -1.51 0.00 0.00 179.97 179.20 1yww h ALA 54 N 0.77 0.59 -0.41 2.80 0.00 -0.25 -0.45 119.26 122.31 1yww h ALA 54 Ca 0.06 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1yww h ALA 54 Cb 0.51 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1yww h ALA 54 CO 0.02 -0.13 -0.19 0.93 0.00 0.00 0.00 179.25 179.88 1yww h GLU 55 N 0.45 0.80 -0.69 0.00 5.08 -1.04 -0.97 114.58 118.22 1yww h GLU 55 Ca 0.21 -0.31 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1yww h GLU 55 Cb 0.13 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 1yww h GLU 55 CO -0.15 0.93 0.42 1.96 -1.00 0.00 0.00 179.01 181.17 1yww h GLN 56 N 0.71 0.79 -0.55 2.33 1.08 -0.80 0.24 115.11 118.91 1yww h GLN 56 Ca 0.10 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.22 1yww h GLN 56 Cb 0.70 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.93 1yww h GLN 56 CO 0.05 0.52 0.18 0.93 -0.95 0.00 0.00 178.83 179.57 1yww h GLU 57 N 0.82 0.81 -0.56 1.46 3.07 -0.67 -0.65 114.58 118.86 1yww h GLU 57 Ca 0.28 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 58.92 1yww h GLU 57 Cb 0.05 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 1yww h GLU 57 CO -0.12 0.69 0.01 0.28 -1.40 0.00 0.00 179.01 178.48 1yww h VAL 58 N 0.79 1.26 -0.63 3.13 2.07 -0.22 -2.08 116.25 120.57 1yww h VAL 58 Ca 0.18 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.64 1yww h VAL 58 Cb 0.21 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1yww h VAL 58 CO -0.01 0.39 0.39 0.03 0.02 0.00 0.00 177.57 178.39 1yww h ARG 59 N 0.86 0.73 -0.80 1.57 2.47 0.05 -1.23 114.38 118.03 1yww h ARG 59 Ca 0.16 -0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.87 1yww h ARG 59 Cb 0.52 -0.16 -0.05 0.00 -1.65 0.00 0.00 29.97 28.63 1yww h ARG 59 CO 0.03 0.48 0.51 0.22 0.56 0.00 0.00 179.97 181.77 1yww h ASP 60 N 0.75 0.85 0.08 7.04 3.58 -0.89 0.22 116.42 128.04 1yww h ASP 60 Ca 0.26 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.70 1yww h ASP 60 Cb 0.05 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.91 1yww h ASP 60 CO -0.12 0.59 -0.04 0.15 -2.88 0.00 0.00 179.24 176.94 1yww h PHE 61 N 1.00 -0.10 -0.11 0.28 3.57 -0.80 -2.38 116.94 118.41 1yww h PHE 61 Ca 0.32 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 1yww h PHE 61 Cb 0.00 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1yww h PHE 61 CO -0.03 0.15 -0.06 0.77 -2.23 0.00 0.00 178.31 176.91 1yww h SER 62 N -0.34 0.14 -0.47 0.41 0.02 -1.00 -2.80 113.55 109.52 1yww h SER 62 Ca -0.01 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 1yww h SER 62 Cb 0.29 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 1yww h SER 62 CO 0.02 0.23 0.10 -0.78 -1.14 0.00 0.00 176.83 175.26 1yww h ASP 63 N 0.15 0.72 -0.17 3.07 1.82 -0.30 -2.47 116.42 119.24 1yww h ASP 63 Ca 0.04 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.44 1yww h ASP 63 Cb 0.21 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 40.04 1yww h ASP 63 CO 0.01 0.77 0.00 0.54 -1.61 0.00 0.00 179.24 178.95 1yww n ARG 64 N -4.48 1.95 0.00 0.28 3.00 -0.92 -5.09 116.66 111.40 1yww n ARG 64 Ca 0.01 -0.84 0.13 0.00 -0.01 0.00 0.00 57.85 57.13 1yww n ARG 64 Cb 0.23 -1.59 0.25 0.00 0.00 0.00 0.00 32.46 31.35 1yww n ARG 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91