#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 0.37 0.26 7.83 6.94 -1.26 -5.01 115.26 124.39 1yww n ASN 2 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 54.58 54.65 1yww n ASN 2 Cb 0.00 0.00 0.65 0.00 -2.36 0.00 0.00 39.78 38.07 1yww n ASN 2 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1yww h SER 3 N 0.00 0.00 -1.06 0.53 0.02 -2.06 -3.34 113.55 107.64 1yww h SER 3 Ca 0.00 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.29 1yww h SER 3 Cb 0.00 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.45 1yww h SER 3 CO 0.00 0.03 1.89 -1.81 -1.14 0.00 0.00 176.83 175.80 1yww s ASP 4 N -6.94 6.74 0.02 3.07 1.01 -1.26 -4.68 116.67 114.63 1yww s ASP 4 Ca -0.05 -2.15 0.27 0.00 0.71 0.00 0.00 52.55 51.33 1yww s ASP 4 Cb 0.17 -2.56 1.13 0.00 1.01 0.00 0.00 42.92 42.66 1yww s ASP 4 CO 0.66 -1.25 1.86 1.33 0.21 0.00 0.00 175.17 177.98 1yww n VAL 5 N 6.42 0.18 1.10 -1.27 0.24 -1.26 -2.69 118.33 121.05 1yww n VAL 5 Ca 0.42 0.01 0.11 0.00 -2.04 0.00 0.00 64.34 62.84 1yww n VAL 5 Cb 0.47 -0.57 0.35 0.00 -1.47 0.00 0.00 33.84 32.62 1yww n VAL 5 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1yww n ILE 6 N -1.58 0.22 0.18 1.34 5.41 -1.26 -3.85 119.36 119.81 1yww n ILE 6 Ca 0.06 -0.41 0.05 0.00 1.00 0.00 0.00 62.75 63.45 1yww n ILE 6 Cb 0.33 0.56 0.32 0.00 -0.71 0.00 0.00 39.64 40.13 1yww n ILE 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1yww h LYS 7 N 2.76 0.00 -6.35 0.38 3.64 -1.60 -3.21 116.57 112.18 1yww h LYS 7 Ca 0.00 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 58.76 1yww h LYS 7 Cb 0.60 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.27 1yww h LYS 7 CO 0.00 0.40 -0.77 0.20 -2.27 0.00 0.00 179.45 177.02 1yww s GLY 8 N -4.37 1.80 -1.38 5.01 0.00 -1.25 -4.69 107.32 102.44 1yww s GLY 8 Ca -0.00 -1.76 0.00 0.00 0.00 0.00 0.00 44.72 42.96 1yww s GLY 8 CO 0.70 -1.82 0.00 0.28 0.00 0.00 0.00 173.10 172.25 1yww n LYS 9 N -0.33 -1.20 -0.32 2.90 5.02 -1.26 -4.89 118.16 118.08 1yww n LYS 9 Ca -0.08 0.80 0.12 0.00 -2.02 0.00 0.00 58.31 57.13 1yww n LYS 9 Cb 0.58 -5.12 0.29 0.00 -0.02 0.00 0.00 35.03 30.76 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 0.86 0.00 2.13 2.91 -1.84 0.90 115.95 120.91 1yww h TRP 10 Ca -0.36 0.04 -0.12 0.00 1.13 0.00 0.00 58.89 59.58 1yww h TRP 10 Cb 1.22 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 29.62 1yww h TRP 10 CO 0.41 0.13 -0.55 0.87 -1.03 0.00 0.00 178.44 178.27 1yww h LYS 11 N 0.60 0.00 0.23 2.65 6.56 -1.91 -2.74 116.57 121.96 1yww h LYS 11 Ca 0.54 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.80 1yww h LYS 11 Cb 0.90 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.59 1yww h LYS 11 CO -0.42 0.55 -1.49 1.96 -2.06 0.00 0.00 179.45 177.98 1yww h GLN 12 N 0.00 0.49 0.00 3.15 4.20 -1.43 -3.31 115.11 118.22 1yww h GLN 12 Ca -0.01 -0.84 0.00 0.00 0.06 0.00 0.00 58.65 57.86 1yww h GLN 12 Cb 0.98 0.31 0.00 0.00 0.30 0.00 0.00 27.48 29.07 1yww h GLN 12 CO 0.07 1.40 0.00 -0.07 -0.67 0.00 0.00 178.83 179.56 1yww h LEU 13 N 0.13 0.00 -0.56 1.46 3.38 -0.82 -3.19 115.31 115.72 1yww h LEU 13 Ca -0.26 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.83 1yww h LEU 13 Cb 2.14 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.79 1yww h LEU 13 CO 0.26 0.00 -0.11 0.71 0.09 0.00 0.00 178.44 179.39 1yww h THR 14 N 0.00 0.46 -0.69 0.22 1.35 -1.57 -1.01 112.91 111.67 1yww h THR 14 Ca 0.00 -0.01 0.08 0.00 -0.55 0.00 0.00 66.41 65.93 1yww h THR 14 Cb 0.44 0.44 -0.06 0.00 -1.73 0.00 0.00 68.15 67.23 1yww h THR 14 CO 0.00 0.00 0.37 1.23 -0.25 0.00 0.00 175.52 176.87 1yww h GLY 15 N 0.02 1.03 1.87 5.82 0.00 -1.80 0.11 103.07 110.12 1yww h GLY 15 Ca 0.27 -0.24 -0.18 0.00 0.00 0.00 0.00 47.33 47.18 1yww h GLY 15 CO -0.55 0.11 -0.82 0.50 0.00 0.00 0.00 176.54 175.77 1yww h LYS 16 N 0.65 0.12 -0.50 4.80 1.57 -1.54 0.11 116.57 121.78 1yww h LYS 16 Ca 0.33 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.90 1yww h LYS 16 Cb 0.27 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1yww h LYS 16 CO -0.22 0.87 -0.01 0.82 -0.57 0.00 0.00 179.45 180.34 1yww h ILE 17 N 0.07 1.26 -0.15 1.86 2.04 -0.76 -1.76 117.51 120.06 1yww h ILE 17 Ca -0.03 -1.10 -0.06 0.00 1.00 0.00 0.00 64.86 64.67 1yww h ILE 17 Cb 1.43 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1yww h ILE 17 CO 0.12 0.38 -0.20 0.50 0.00 0.00 0.00 178.15 178.96 1yww h LYS 18 N 0.74 0.26 -0.24 2.37 3.64 -0.47 -2.76 116.57 120.11 1yww h LYS 18 Ca 0.14 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.33 1yww h LYS 18 Cb 0.53 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1yww h LYS 18 CO 0.03 0.45 -0.31 0.93 -2.27 0.00 0.00 179.45 178.28 1yww h GLU 19 N 0.24 0.64 0.35 1.90 5.08 -0.54 -2.29 114.58 119.96 1yww h GLU 19 Ca 0.04 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 1yww h GLU 19 Cb 0.49 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1yww h GLU 19 CO 0.03 0.97 -0.17 -0.09 -1.00 0.00 0.00 179.01 178.76 1yww h ARG 20 N 0.35 -0.45 0.08 2.33 2.43 -1.09 -3.38 114.38 114.65 1yww h ARG 20 Ca 0.03 0.03 -0.28 0.00 -0.81 0.00 0.00 59.98 58.95 1yww h ARG 20 Cb 0.89 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1yww h ARG 20 CO 0.07 -0.18 -1.46 -1.49 -1.51 0.00 0.00 179.97 175.40 1yww h TRP 21 N -1.03 0.32 0.00 2.20 6.55 -1.67 -3.48 115.95 118.84 1yww h TRP 21 Ca -0.05 -0.24 0.00 0.00 0.95 0.00 0.00 58.89 59.55 1yww h TRP 21 Cb 0.49 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 1yww h TRP 21 CO 0.03 1.57 0.00 0.41 -1.05 0.00 0.00 178.44 179.40 1yww n GLY 22 N 1.71 2.14 0.26 1.49 0.00 -0.86 -4.76 105.19 105.18 1yww n GLY 22 Ca -0.28 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.32 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 0.86 -2.18 1.61 3.58 -1.92 -3.43 116.42 114.94 1yww h ASP 23 Ca 0.00 -0.35 -0.57 0.00 0.42 0.00 0.00 57.03 56.53 1yww h ASP 23 Cb 0.00 -0.24 0.02 0.00 1.72 0.00 0.00 39.33 40.83 1yww h ASP 23 CO 0.00 1.10 1.21 0.18 -2.88 0.00 0.00 179.24 178.85 1yww n LEU 24 N -4.08 3.80 0.00 2.28 4.77 -1.26 -4.97 117.00 117.54 1yww n LEU 24 Ca -0.01 0.86 -0.21 0.00 -0.03 0.00 0.00 56.01 56.62 1yww n LEU 24 Cb 0.49 -1.47 0.13 0.00 -2.33 0.00 0.00 43.42 40.24 1yww n LEU 24 CO 0.46 0.03 0.57 0.35 -1.33 0.00 0.00 177.39 177.47 1yww n THR 25 N 5.62 0.00 0.20 -5.08 -2.24 -1.26 -4.77 114.28 106.74 1yww n THR 25 Ca 0.22 -1.15 0.05 0.00 -2.27 0.00 0.00 64.05 60.91 1yww n THR 25 Cb 0.37 -1.20 0.49 0.00 -2.10 0.00 0.00 70.33 67.89 1yww n THR 25 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1yww h ASP 26 N -0.86 0.06 -0.30 3.42 3.58 -1.96 -1.70 116.42 118.67 1yww h ASP 26 Ca -0.31 -0.01 -0.08 0.00 0.42 0.00 0.00 57.03 57.05 1yww h ASP 26 Cb 1.02 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 42.04 1yww h ASP 26 CO 0.28 0.21 -0.08 -0.78 -2.88 0.00 0.00 179.24 176.00 1yww h ASP 27 N 0.07 0.67 1.10 2.28 3.58 -1.93 -2.79 116.42 119.40 1yww h ASP 27 Ca 0.01 -0.18 -0.13 0.00 0.42 0.00 0.00 57.03 57.15 1yww h ASP 27 Cb 0.29 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 1yww h ASP 27 CO 0.02 0.79 -0.63 0.44 -2.88 0.00 0.00 179.24 176.98 1yww h ASP 28 N 0.64 0.00 -0.54 2.28 3.32 -1.68 -3.15 116.42 117.28 1yww h ASP 28 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1yww h ASP 28 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1yww h ASP 28 CO 0.03 0.63 0.00 0.18 -1.72 0.00 0.00 179.24 178.36 1yww n LEU 29 N -3.40 4.36 -4.35 1.55 4.77 -0.85 -4.87 117.00 114.21 1yww n LEU 29 Ca 0.01 -2.20 -0.18 0.00 -0.03 0.00 0.00 56.01 53.60 1yww n LEU 29 Cb 0.73 -0.57 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 1yww n LEU 29 CO 0.42 0.67 -0.37 -1.10 -1.33 0.00 0.00 177.39 175.67 1yww s GLN 30 N -1.98 1.35 -0.65 3.23 -1.52 -1.07 -4.88 119.66 114.14 1yww s GLN 30 Ca 0.44 -1.65 -0.01 0.00 -1.95 0.00 0.00 55.36 52.19 1yww s GLN 30 Cb 0.30 -0.88 -0.01 0.00 -0.22 0.00 0.00 33.01 32.20 1yww s GLN 30 CO 0.19 0.03 0.60 0.00 -0.25 0.00 0.00 175.29 175.86 1yww n ALA 31 N -0.42 -2.26 -2.58 6.09 0.00 -1.26 -4.95 120.51 115.13 1yww n ALA 31 Ca -0.07 0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1yww n ALA 31 Cb 0.62 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.97 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 -3.07 -0.25 0.21 0.00 0.00 -1.26 -5.02 121.76 112.37 1yww s ALA 32 Ca 0.09 -0.60 0.16 0.00 0.00 0.00 0.00 51.96 51.60 1yww s ALA 32 Cb -0.01 0.51 0.58 0.00 0.00 0.00 0.00 23.12 24.19 1yww s ALA 32 CO 0.60 -0.52 1.70 -0.44 0.00 0.00 0.00 175.76 177.10 1yww h ASP 33 N 2.73 0.00 -2.10 0.00 5.19 -1.98 -3.49 116.42 116.76 1yww h ASP 33 Ca -0.34 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 1yww h ASP 33 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1yww h ASP 33 CO 0.56 0.45 0.00 0.61 -3.12 0.00 0.00 179.24 177.74 1yww n GLY 34 N 0.22 -2.04 3.64 2.75 0.00 -1.26 -4.96 105.19 103.54 1yww n GLY 34 Ca -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.02 0.36 1.61 -3.43 -1.21 -3.79 115.29 108.80 1yww s HIS 35 Ca 0.00 0.02 0.04 0.00 -0.80 0.00 0.00 55.06 54.32 1yww s HIS 35 Cb 0.00 0.50 0.67 0.00 -1.43 0.00 0.00 32.58 32.33 1yww s HIS 35 CO 0.00 -0.03 1.98 0.00 -2.00 0.00 0.00 174.74 174.69 1yww h ALA 36 N 2.01 1.53 -0.57 -1.38 0.00 -1.92 -1.49 119.26 117.43 1yww h ALA 36 Ca -0.04 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.89 1yww h ALA 36 Cb 1.15 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1yww h ALA 36 CO 0.20 0.39 0.39 0.93 0.00 0.00 0.00 179.25 181.15 1yww h GLU 37 N 0.68 0.31 -0.28 0.00 5.08 -2.00 -1.37 114.58 117.01 1yww h GLU 37 Ca 0.17 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.33 1yww h GLU 37 Cb 0.04 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1yww h GLU 37 CO -0.03 0.21 -0.54 -0.92 -1.00 0.00 0.00 179.01 176.73 1yww h TYR 38 N 0.32 1.08 -0.73 4.33 3.20 -1.68 -2.29 116.97 121.20 1yww h TYR 38 Ca 0.27 -0.39 -0.06 0.00 3.14 0.00 0.00 58.73 61.69 1yww h TYR 38 Cb 0.62 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 1yww h TYR 38 CO -0.00 1.21 0.23 -0.07 -1.64 0.00 0.00 178.16 177.89 1yww h LEU 39 N 0.63 1.05 -0.26 2.82 4.07 -1.31 -0.83 115.31 121.48 1yww h LEU 39 Ca 0.01 -0.19 0.05 0.00 0.08 0.00 0.00 57.88 57.83 1yww h LEU 39 Cb 1.15 -0.27 -0.05 0.00 1.08 0.00 0.00 40.66 42.56 1yww h LEU 39 CO 0.12 0.97 -0.05 0.58 -1.08 0.00 0.00 178.44 178.98 1yww h VAL 40 N 1.08 0.75 -0.56 1.22 2.07 -1.16 0.33 116.25 119.98 1yww h VAL 40 Ca 0.24 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 1yww h VAL 40 Cb 0.30 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1yww h VAL 40 CO -0.01 0.00 0.34 1.23 0.02 0.00 0.00 177.57 179.16 1yww h GLY 41 N 0.01 0.81 1.60 2.17 0.00 -1.00 -0.87 103.07 105.80 1yww h GLY 41 Ca 0.13 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1yww h GLY 41 CO -0.26 0.32 -0.20 0.50 0.00 0.00 0.00 176.54 176.90 1yww h LYS 42 N 0.75 0.47 -0.25 4.80 1.79 -0.65 -0.22 116.57 123.27 1yww h LYS 42 Ca 0.20 -0.16 -0.15 0.00 -2.18 0.00 0.00 60.65 58.36 1yww h LYS 42 Cb -0.02 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 1yww h LYS 42 CO -0.04 0.65 -0.47 -0.07 -1.08 0.00 0.00 179.45 178.45 1yww h LEU 43 N 0.42 0.71 -0.76 2.94 3.38 0.04 0.13 115.31 122.18 1yww h LEU 43 Ca 0.07 -0.34 -0.13 0.00 0.09 0.00 0.00 57.88 57.56 1yww h LEU 43 Cb 0.59 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1yww h LEU 43 CO 0.04 1.06 -0.61 1.56 0.09 0.00 0.00 178.44 180.58 1yww h GLN 44 N 0.52 0.04 0.16 1.13 4.20 -0.89 0.30 115.11 120.57 1yww h GLN 44 Ca 0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1yww h GLN 44 Cb 1.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.80 1yww h GLN 44 CO 0.09 0.64 -0.07 1.49 -0.67 0.00 0.00 178.83 180.31 1yww h GLU 45 N 0.03 -0.20 0.44 1.46 4.57 -0.79 -2.50 114.58 117.59 1yww h GLU 45 Ca -0.01 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 1yww h GLU 45 Cb 1.08 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1yww h GLU 45 CO 0.08 0.22 -0.21 0.00 -1.18 0.00 0.00 179.01 177.93 1yww h ARG 46 N -0.89 -0.56 0.00 1.92 2.47 -0.80 -3.39 114.38 113.12 1yww h ARG 46 Ca -0.02 0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.71 1yww h ARG 46 Cb 0.52 0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 28.96 1yww h ARG 46 CO 0.03 -0.37 -0.20 1.88 0.56 0.00 0.00 179.97 181.88 1yww h TYR 47 N -1.15 0.00 -0.22 3.04 -1.99 -1.26 -3.49 116.97 111.89 1yww h TYR 47 Ca -0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1yww h TYR 47 Cb 0.45 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.18 1yww h TYR 47 CO 0.00 0.80 0.00 0.41 -0.00 0.00 0.00 178.16 179.37 1yww n GLY 48 N 1.62 0.66 3.98 3.88 0.00 -0.08 -4.99 105.19 110.26 1yww n GLY 48 Ca -0.11 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.56 1.61 0.36 1.61 0.51 -1.24 -4.96 118.94 115.27 1yww s TRP 49 Ca 0.00 -0.15 -0.05 0.00 -2.12 0.00 0.00 56.10 53.78 1yww s TRP 49 Cb 0.00 -3.20 -0.05 0.00 -0.81 0.00 0.00 33.47 29.41 1yww s TRP 49 CO 0.00 -1.88 0.64 0.45 -0.51 0.00 0.00 176.95 175.65 1yww s SER 50 N -4.76 6.39 0.14 2.95 0.15 -1.26 -4.63 113.70 112.68 1yww s SER 50 Ca 0.68 0.78 -0.18 0.00 0.70 0.00 0.00 55.95 57.93 1yww s SER 50 Cb -0.05 -2.18 0.02 0.00 -1.71 0.00 0.00 66.02 62.10 1yww s SER 50 CO 0.46 -0.33 1.75 0.50 1.20 0.00 0.00 173.24 176.81 1yww h LYS 51 N 1.12 0.21 0.00 5.44 3.64 -1.99 -1.21 116.57 123.78 1yww h LYS 51 Ca -0.48 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 58.80 1yww h LYS 51 Cb 1.20 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 1yww h LYS 51 CO 0.64 0.14 -0.42 1.05 -2.27 0.00 0.00 179.45 178.59 1yww h GLU 52 N 0.22 0.00 -0.12 1.90 9.09 -1.99 -0.40 114.58 123.29 1yww h GLU 52 Ca 0.13 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.51 1yww h GLU 52 Cb 0.11 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1yww h GLU 52 CO -0.14 0.42 -0.03 -0.09 0.05 0.00 0.00 179.01 179.22 1yww h ARG 53 N 0.00 0.23 -0.52 1.06 2.43 -1.87 -1.93 114.38 113.78 1yww h ARG 53 Ca -0.00 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1yww h ARG 53 Cb 1.13 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 1yww h ARG 53 CO 0.05 0.54 0.34 0.00 -1.51 0.00 0.00 179.97 179.39 1yww h ALA 54 N 0.68 0.66 -0.72 2.80 0.00 -0.90 -1.24 119.26 120.55 1yww h ALA 54 Ca 0.03 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1yww h ALA 54 Cb 0.46 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1yww h ALA 54 CO 0.01 0.08 0.40 0.93 0.00 0.00 0.00 179.25 180.68 1yww h GLU 55 N 0.68 0.70 -0.47 0.00 5.08 -1.06 0.14 114.58 119.65 1yww h GLU 55 Ca 0.20 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1yww h GLU 55 Cb -0.05 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1yww h GLU 55 CO -0.06 0.46 0.26 1.96 -1.00 0.00 0.00 179.01 180.64 1yww h GLN 56 N 0.72 0.66 -0.14 2.33 4.20 -0.65 0.14 115.11 122.38 1yww h GLN 56 Ca 0.33 -0.07 -0.15 0.00 0.06 0.00 0.00 58.65 58.82 1yww h GLN 56 Cb 0.25 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1yww h GLN 56 CO -0.21 0.51 -0.55 0.93 -0.67 0.00 0.00 178.83 178.85 1yww h GLU 57 N 0.63 0.42 -0.27 1.46 5.08 -0.54 0.12 114.58 121.48 1yww h GLU 57 Ca 0.17 -0.26 -0.15 0.00 -1.00 0.00 0.00 59.36 58.12 1yww h GLU 57 Cb 0.04 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1yww h GLU 57 CO -0.03 0.86 -0.43 0.28 -1.00 0.00 0.00 179.01 178.68 1yww h VAL 58 N 0.32 1.30 -0.80 3.13 2.07 -0.61 -1.07 116.25 120.58 1yww h VAL 58 Ca 0.01 -1.62 -0.04 0.00 0.82 0.00 0.00 66.70 65.86 1yww h VAL 58 Cb 1.06 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.35 1yww h VAL 58 CO 0.10 0.52 0.33 -0.09 0.02 0.00 0.00 177.57 178.44 1yww h ARG 59 N 0.54 1.19 -0.81 1.57 2.43 -0.38 -1.40 114.38 117.52 1yww h ARG 59 Ca 0.04 -0.21 -0.03 0.00 -0.81 0.00 0.00 59.98 58.97 1yww h ARG 59 Cb 0.97 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.29 1yww h ARG 59 CO 0.09 0.96 0.37 0.22 -1.51 0.00 0.00 179.97 180.10 1yww h ASP 60 N 1.16 1.06 -0.98 -3.80 1.82 -0.52 0.03 116.42 115.20 1yww h ASP 60 Ca 0.27 -0.13 0.03 0.00 -0.39 0.00 0.00 57.03 56.80 1yww h ASP 60 Cb 0.20 -0.27 -0.05 0.00 0.68 0.00 0.00 39.33 39.88 1yww h ASP 60 CO -0.02 0.91 0.65 0.15 -1.61 0.00 0.00 179.24 179.31 1yww h PHE 61 N 1.15 1.22 -0.22 0.28 3.57 -0.62 -0.23 116.94 122.09 1yww h PHE 61 Ca 0.28 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.68 1yww h PHE 61 Cb 0.14 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 1yww h PHE 61 CO 0.02 0.73 -0.39 0.77 -2.23 0.00 0.00 178.31 177.21 1yww h SER 62 N 1.28 0.53 0.17 0.41 0.02 -0.24 -3.09 113.55 112.62 1yww h SER 62 Ca 0.38 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1yww h SER 62 Cb -0.06 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.34 1yww h SER 62 CO -0.10 0.86 -0.08 0.44 -1.14 0.00 0.00 176.83 176.81 1yww h ASP 63 N 0.42 -0.19 -0.62 3.07 3.32 -0.35 -3.28 116.42 118.79 1yww h ASP 63 Ca 0.04 -0.17 -0.71 0.00 0.02 0.00 0.00 57.03 56.21 1yww h ASP 63 Cb 0.86 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.40 1yww h ASP 63 CO 0.07 0.07 3.03 0.54 -1.72 0.00 0.00 179.24 181.23 1yww n ARG 64 N -5.09 4.04 0.00 3.56 1.74 -0.16 -5.10 116.66 115.65 1yww n ARG 64 Ca -0.09 -2.89 0.00 0.00 -0.77 0.00 0.00 57.85 54.10 1yww n ARG 64 Cb 0.19 -2.77 0.00 0.00 -1.02 0.00 0.00 32.46 28.86 1yww n ARG 64 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39