#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 5.02 -0.17 3.17 3.84 -1.26 -5.06 114.94 120.48 1yww s ASN 2 Ca 0.00 -1.40 -0.08 0.00 0.21 0.00 0.00 52.86 51.58 1yww s ASN 2 Cb 0.00 -1.75 0.07 0.00 -0.55 0.00 0.00 41.25 39.01 1yww s ASN 2 CO 0.00 -0.32 0.40 -0.44 -2.79 0.00 0.00 177.10 173.95 1yww s SER 3 N 1.37 -0.40 -0.98 -4.21 0.01 -1.26 -5.09 113.70 103.15 1yww s SER 3 Ca -0.02 0.89 -0.22 0.00 1.31 0.00 0.00 55.95 57.92 1yww s SER 3 Cb -0.20 0.90 0.08 0.00 0.21 0.00 0.00 66.02 67.01 1yww s SER 3 CO -0.01 -0.20 1.32 -0.62 0.41 0.00 0.00 173.24 174.14 1yww s ASP 4 N 1.76 6.53 0.00 2.44 -1.08 -1.26 -4.75 116.67 120.31 1yww s ASP 4 Ca -0.07 -1.63 0.28 0.00 -0.52 0.00 0.00 52.55 50.61 1yww s ASP 4 Cb -0.10 -2.51 1.12 0.00 -1.46 0.00 0.00 42.92 39.97 1yww s ASP 4 CO -0.12 -1.36 1.79 1.33 0.52 0.00 0.00 175.17 177.33 1yww n VAL 5 N 6.37 0.00 -0.02 1.11 0.24 -1.26 -3.93 118.33 120.85 1yww n VAL 5 Ca 0.28 -0.06 -0.17 0.00 -2.04 0.00 0.00 64.34 62.35 1yww n VAL 5 Cb 0.50 -0.02 -0.09 0.00 -1.47 0.00 0.00 33.84 32.76 1yww n VAL 5 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1yww h ILE 6 N 0.60 1.38 0.00 1.34 2.04 -1.94 -2.85 117.51 118.08 1yww h ILE 6 Ca 0.00 -1.92 -0.03 0.00 1.00 0.00 0.00 64.86 63.91 1yww h ILE 6 Cb 0.40 2.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1yww h ILE 6 CO 0.00 0.57 -0.13 0.07 0.00 0.00 0.00 178.15 178.67 1yww h LYS 7 N 0.08 0.00 0.06 2.37 2.10 -1.79 -0.50 116.57 118.88 1yww h LYS 7 Ca -0.05 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1yww h LYS 7 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1yww h LYS 7 CO 0.11 0.13 -0.03 0.78 -2.00 0.00 0.00 179.45 178.44 1yww h GLY 8 N 0.65 -0.08 -3.89 0.07 0.00 -1.70 -3.29 103.07 94.82 1yww h GLY 8 Ca -0.00 0.03 -0.47 0.00 0.00 0.00 0.00 47.33 46.89 1yww h GLY 8 CO 0.02 -0.03 0.58 0.28 0.00 0.00 0.00 176.54 177.39 1yww n LYS 9 N -4.83 2.44 0.19 4.80 4.76 -1.09 -4.75 118.16 119.69 1yww n LYS 9 Ca -0.08 -3.03 -0.15 0.00 -2.87 0.00 0.00 58.31 52.18 1yww n LYS 9 Cb 0.30 -2.17 -0.07 0.00 -1.84 0.00 0.00 35.03 31.25 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 1.24 -0.93 0.00 2.13 2.91 -1.16 0.47 115.95 120.60 1yww h TRP 10 Ca 0.57 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.60 1yww h TRP 10 Cb 2.76 0.37 0.00 0.00 -0.51 0.00 0.00 29.16 31.78 1yww h TRP 10 CO 1.54 -0.47 0.00 1.17 -1.03 0.00 0.00 178.44 179.64 1yww n LYS 11 N -5.45 0.16 -0.08 2.65 4.81 -1.26 -1.13 118.16 117.87 1yww n LYS 11 Ca -0.09 0.16 -0.18 0.00 -0.87 0.00 0.00 58.31 57.33 1yww n LYS 11 Cb 0.35 -1.50 -0.13 0.00 0.02 0.00 0.00 35.03 33.77 1yww n LYS 11 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1yww n GLN 12 N -1.35 0.69 0.16 1.64 0.00 -0.39 -4.38 117.38 113.76 1yww n GLN 12 Ca 0.06 0.18 0.13 0.00 -0.00 0.00 0.00 57.00 57.38 1yww n GLN 12 Cb 0.14 -1.59 0.40 0.00 0.00 0.00 0.00 30.24 29.19 1yww n GLN 12 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1yww h LEU 13 N 0.02 0.00 -0.61 1.69 3.38 0.84 -3.31 115.31 117.32 1yww h LEU 13 Ca -0.52 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.57 1yww h LEU 13 Cb 1.97 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.60 1yww h LEU 13 CO -0.02 0.00 -0.16 0.71 0.09 0.00 0.00 178.44 179.06 1yww h THR 14 N 0.00 0.37 -0.56 0.22 1.35 -1.33 0.33 112.91 113.30 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 0.71 0.37 -0.03 0.00 -1.73 0.00 0.00 68.15 67.47 1yww h THR 14 CO 0.00 0.00 0.20 1.23 -0.25 0.00 0.00 175.52 176.70 1yww h GLY 15 N -0.01 0.88 1.99 5.82 0.00 -1.86 -0.12 103.07 109.77 1yww h GLY 15 Ca 0.29 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 47.02 1yww h GLY 15 CO -0.63 0.43 -0.70 0.50 0.00 0.00 0.00 176.54 176.14 1yww h LYS 16 N 0.80 0.01 -0.20 4.80 1.57 -1.13 -1.33 116.57 121.08 1yww h LYS 16 Ca 0.19 -0.01 -0.17 0.00 -1.87 0.00 0.00 60.65 58.80 1yww h LYS 16 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1yww h LYS 16 CO -0.01 0.70 -0.52 0.82 -0.57 0.00 0.00 179.45 179.87 1yww h ILE 17 N 0.01 1.31 -0.16 1.86 2.04 0.08 0.49 117.51 123.14 1yww h ILE 17 Ca -0.01 -1.74 -0.04 0.00 1.00 0.00 0.00 64.86 64.08 1yww h ILE 17 Cb 1.23 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 1yww h ILE 17 CO 0.09 0.55 -0.06 0.50 0.00 0.00 0.00 178.15 179.23 1yww h LYS 18 N 0.42 0.23 -0.11 2.37 3.64 -0.93 0.40 116.57 122.60 1yww h LYS 18 Ca -0.01 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.18 1yww h LYS 18 Cb 1.13 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1yww h LYS 18 CO 0.11 0.31 -0.54 1.49 -2.27 0.00 0.00 179.45 178.55 1yww h GLU 19 N 0.23 0.56 -0.19 1.90 4.22 -1.08 -3.08 114.58 117.14 1yww h GLU 19 Ca 0.05 -0.46 -0.02 0.00 0.08 0.00 0.00 59.36 59.01 1yww h GLU 19 Cb 0.26 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1yww h GLU 19 CO 0.01 1.08 0.03 -0.09 -2.18 0.00 0.00 179.01 177.86 1yww h ARG 20 N 0.17 0.31 -4.63 1.92 9.65 -0.38 -3.38 114.38 118.04 1yww h ARG 20 Ca -0.04 -0.08 -0.66 0.00 -1.10 0.00 0.00 59.98 58.10 1yww h ARG 20 Cb 1.19 -0.04 -0.40 0.00 -1.39 0.00 0.00 29.97 29.33 1yww h ARG 20 CO 0.11 0.47 -0.73 -1.58 2.80 0.00 0.00 179.97 181.04 1yww s TRP 21 N -5.18 3.60 0.38 2.20 0.51 0.14 -4.98 118.94 115.62 1yww s TRP 21 Ca -0.14 -2.88 0.24 0.00 -2.12 0.00 0.00 56.10 51.20 1yww s TRP 21 Cb 0.07 -2.78 1.27 0.00 -0.81 0.00 0.00 33.47 31.21 1yww s TRP 21 CO 0.72 -0.94 2.01 0.78 -0.51 0.00 0.00 176.95 179.01 1yww h GLY 22 N 7.65 0.00 2.00 0.98 0.00 -1.73 -1.94 103.07 110.03 1yww h GLY 22 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 1yww h GLY 22 CO 0.51 0.00 -0.02 -1.80 0.00 0.00 0.00 176.54 175.23 1yww h ASP 23 N 0.00 0.00 -3.24 0.19 3.58 -1.94 -3.43 116.42 111.58 1yww h ASP 23 Ca -0.00 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 56.90 1yww h ASP 23 Cb 0.41 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.44 1yww h ASP 23 CO 0.02 0.02 0.56 -0.76 -2.88 0.00 0.00 179.24 176.20 1yww s LEU 24 N -6.24 4.30 -0.06 2.28 1.43 -0.73 -5.00 118.68 114.66 1yww s LEU 24 Ca 0.02 1.69 -0.30 0.00 -1.03 0.00 0.00 54.13 54.52 1yww s LEU 24 Cb 0.08 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.72 1yww s LEU 24 CO 0.58 -0.44 1.00 -0.89 0.23 0.00 0.00 176.35 176.83 1yww s THR 25 N 1.73 4.80 0.21 5.49 2.01 -1.26 -4.71 115.64 123.91 1yww s THR 25 Ca 0.52 2.03 -0.09 0.00 0.31 0.00 0.00 61.69 64.47 1yww s THR 25 Cb -0.22 -4.30 0.16 0.00 0.01 0.00 0.00 72.50 68.14 1yww s THR 25 CO 0.23 0.07 1.81 -0.78 -0.69 0.00 0.00 174.62 175.26 1yww h ASP 26 N 6.98 0.59 -0.72 3.53 3.58 -1.94 -1.20 116.42 127.24 1yww h ASP 26 Ca -0.35 0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.18 1yww h ASP 26 Cb 1.18 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 42.10 1yww h ASP 26 CO 0.81 0.38 0.47 0.44 -2.88 0.00 0.00 179.24 178.46 1yww h ASP 27 N 0.72 0.68 0.07 2.28 5.19 -1.93 0.19 116.42 123.62 1yww h ASP 27 Ca 0.31 -0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.53 1yww h ASP 27 Cb 0.19 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.56 1yww h ASP 27 CO -0.19 0.45 -0.69 0.44 -3.12 0.00 0.00 179.24 176.14 1yww h ASP 28 N 0.78 0.65 -0.11 6.45 5.19 -1.69 -3.24 116.42 124.46 1yww h ASP 28 Ca 0.30 -0.40 -0.04 0.00 -0.62 0.00 0.00 57.03 56.27 1yww h ASP 28 Cb 0.20 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1yww h ASP 28 CO -0.10 1.16 -0.07 -0.07 -3.12 0.00 0.00 179.24 177.04 1yww h LEU 29 N 0.40 0.25 -3.87 1.55 3.38 -0.29 -3.28 115.31 113.45 1yww h LEU 29 Ca -0.02 -0.44 -0.10 0.00 0.09 0.00 0.00 57.88 57.41 1yww h LEU 29 Cb 1.27 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1yww h LEU 29 CO 0.13 0.64 -0.12 1.67 0.09 0.00 0.00 178.44 180.85 1yww n GLN 30 N -4.68 1.28 0.00 1.13 7.27 0.57 -4.43 117.38 118.51 1yww n GLN 30 Ca -0.07 -0.50 0.00 0.00 0.07 0.00 0.00 57.00 56.50 1yww n GLN 30 Cb 0.30 -1.61 0.00 0.00 2.41 0.00 0.00 30.24 31.33 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 2.26 0.04 -0.96 1.69 0.00 -1.24 -4.97 120.51 117.32 1yww n ALA 31 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1yww n ALA 31 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 -3.00 2.04 -0.16 0.00 0.00 -1.26 -4.99 120.51 113.14 1yww n ALA 32 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1yww n ALA 32 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1yww n ALA 32 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1yww h ASP 33 N 0.00 -0.22 0.00 0.00 5.19 -1.98 -3.45 116.42 115.97 1yww h ASP 33 Ca 0.00 0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1yww h ASP 33 Cb 0.00 0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.72 1yww h ASP 33 CO 0.00 -0.07 0.00 0.61 -3.12 0.00 0.00 179.24 176.66 1yww n GLY 34 N -1.31 1.36 3.30 2.75 0.00 -1.26 -4.93 105.19 105.09 1yww n GLY 34 Ca 0.05 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1yww n GLY 34 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1yww n HIS 35 N 0.00 -1.70 -0.31 1.61 1.44 -1.26 -4.49 115.22 110.51 1yww n HIS 35 Ca 0.00 0.20 0.17 0.00 -2.01 0.00 0.00 57.72 56.08 1yww n HIS 35 Cb 0.00 -1.63 0.35 0.00 0.12 0.00 0.00 29.99 28.83 1yww n HIS 35 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1yww h ALA 36 N -1.72 1.51 0.00 1.59 0.00 -1.94 0.53 119.26 119.23 1yww h ALA 36 Ca -0.48 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1yww h ALA 36 Cb 1.33 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 1yww h ALA 36 CO 0.34 -0.51 -0.00 0.93 0.00 0.00 0.00 179.25 180.01 1yww h GLU 37 N 0.24 0.00 0.07 0.00 4.39 -1.98 -1.00 114.58 116.30 1yww h GLU 37 Ca 0.62 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 60.06 1yww h GLU 37 Cb 1.32 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 1yww h GLU 37 CO -0.65 0.00 -1.23 -0.92 -1.16 0.00 0.00 179.01 175.05 1yww h TYR 38 N 0.00 0.27 -0.25 4.33 3.20 -0.18 -2.41 116.97 121.94 1yww h TYR 38 Ca -0.00 -0.20 -0.00 0.00 3.14 0.00 0.00 58.73 61.67 1yww h TYR 38 Cb 0.08 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 1yww h TYR 38 CO 0.00 1.18 0.14 -0.07 -1.64 0.00 0.00 178.16 177.77 1yww h LEU 39 N 0.04 0.31 -0.61 2.82 4.07 -1.21 -1.17 115.31 119.56 1yww h LEU 39 Ca -0.12 -0.07 0.07 0.00 0.08 0.00 0.00 57.88 57.84 1yww h LEU 39 Cb 1.91 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 43.51 1yww h LEU 39 CO 0.16 0.29 0.30 0.58 -1.08 0.00 0.00 178.44 178.69 1yww h VAL 40 N 0.30 0.89 -0.54 1.22 2.07 -1.47 0.27 116.25 118.98 1yww h VAL 40 Ca 0.09 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1yww h VAL 40 Cb 0.05 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 1yww h VAL 40 CO -0.02 0.10 0.34 1.23 0.02 0.00 0.00 177.57 179.24 1yww h GLY 41 N 0.54 0.77 1.77 2.17 0.00 -1.02 0.49 103.07 107.78 1yww h GLY 41 Ca 0.29 -0.26 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 1yww h GLY 41 CO -0.23 0.23 -0.66 0.50 0.00 0.00 0.00 176.54 176.39 1yww h LYS 42 N 0.68 0.23 -0.28 4.80 1.79 -0.63 0.96 116.57 124.11 1yww h LYS 42 Ca 0.21 -0.17 -0.07 0.00 -2.18 0.00 0.00 60.65 58.44 1yww h LYS 42 Cb -0.01 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 1yww h LYS 42 CO -0.08 0.80 -0.13 -0.07 -1.08 0.00 0.00 179.45 178.90 1yww h LEU 43 N 0.16 0.45 -0.11 2.94 3.38 -0.04 0.29 115.31 122.38 1yww h LEU 43 Ca -0.01 -0.11 -0.24 0.00 0.09 0.00 0.00 57.88 57.61 1yww h LEU 43 Cb 1.18 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.83 1yww h LEU 43 CO 0.10 0.61 -0.85 1.56 0.09 0.00 0.00 178.44 179.95 1yww h GLN 44 N 0.43 0.77 -0.05 1.13 1.08 -0.63 0.17 115.11 118.00 1yww h GLN 44 Ca 0.08 -0.68 -0.01 0.00 -1.45 0.00 0.00 58.65 56.59 1yww h GLN 44 Cb 0.48 0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 28.07 1yww h GLN 44 CO 0.03 1.28 0.00 1.49 -0.95 0.00 0.00 178.83 180.68 1yww h GLU 45 N 0.49 0.09 0.06 1.46 4.81 -0.42 -2.90 114.58 118.16 1yww h GLU 45 Ca -0.08 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1yww h GLU 45 Cb 1.49 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.86 1yww h GLU 45 CO 0.17 0.35 -0.03 0.00 -0.73 0.00 0.00 179.01 178.78 1yww h ARG 46 N -0.18 -0.08 0.00 1.92 2.47 -0.55 -3.44 114.38 114.53 1yww h ARG 46 Ca 0.02 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1yww h ARG 46 Cb 0.31 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 1yww h ARG 46 CO 0.00 -0.05 0.00 0.66 0.56 0.00 0.00 179.97 181.14 1yww n TYR 47 N -3.42 0.00 0.00 3.04 4.01 -0.34 -5.06 117.16 115.39 1yww n TYR 47 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1yww n TYR 47 Cb 0.03 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 38.77 1yww n TYR 47 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yww n GLY 48 N 2.19 0.75 0.00 2.72 0.00 0.44 -4.94 105.19 106.36 1yww n GLY 48 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.17 -3.16 1.61 8.01 -1.26 -5.01 117.44 115.46 1yww n TRP 49 Ca 0.00 0.00 -0.33 0.00 -1.31 0.00 0.00 57.50 55.86 1yww n TRP 49 Cb 0.00 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.24 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 -0.96 6.82 0.34 -0.99 1.04 -1.26 -4.94 113.70 113.76 1yww s SER 50 Ca 0.00 1.27 0.03 0.00 0.48 0.00 0.00 55.95 57.73 1yww s SER 50 Cb 0.00 -2.37 0.64 0.00 0.10 0.00 0.00 66.02 64.39 1yww s SER 50 CO 0.00 -0.13 1.98 0.50 0.98 0.00 0.00 173.24 176.57 1yww h LYS 51 N 2.57 0.84 -0.83 4.02 3.64 -1.98 0.33 116.57 125.17 1yww h LYS 51 Ca -0.48 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 58.83 1yww h LYS 51 Cb 1.18 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.77 1yww h LYS 51 CO 0.66 0.56 0.42 1.49 -2.27 0.00 0.00 179.45 180.31 1yww h GLU 52 N 0.87 1.17 -0.53 1.90 4.81 -1.99 0.43 114.58 121.24 1yww h GLU 52 Ca 0.28 -0.16 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 1yww h GLU 52 Cb 0.04 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 1yww h GLU 52 CO -0.08 0.88 -0.13 -0.09 -0.73 0.00 0.00 179.01 178.87 1yww h ARG 53 N 1.16 1.03 -0.28 1.92 2.43 -1.61 -1.84 114.38 117.19 1yww h ARG 53 Ca 0.29 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 1yww h ARG 53 Cb 0.08 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1yww h ARG 53 CO -0.04 1.09 0.13 0.00 -1.51 0.00 0.00 179.97 179.64 1yww h ALA 54 N 0.91 0.37 -0.61 2.80 0.00 -0.40 -2.57 119.26 119.75 1yww h ALA 54 Ca 0.13 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.05 1yww h ALA 54 Cb 0.71 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 1yww h ALA 54 CO 0.05 -0.07 0.19 0.93 0.00 0.00 0.00 179.25 180.35 1yww h GLU 55 N 0.32 0.33 -0.53 0.00 5.08 0.01 0.37 114.58 120.17 1yww h GLU 55 Ca 0.10 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1yww h GLU 55 Cb 0.12 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1yww h GLU 55 CO -0.01 0.22 0.34 0.37 -1.00 0.00 0.00 179.01 178.93 1yww h GLN 56 N 0.34 0.70 -0.11 2.33 5.75 -1.09 0.31 115.11 123.33 1yww h GLN 56 Ca 0.32 -0.05 -0.17 0.00 -0.15 0.00 0.00 58.65 58.60 1yww h GLN 56 Cb 0.43 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1yww h GLN 56 CO -0.35 0.47 -0.65 0.93 -2.65 0.00 0.00 178.83 176.58 1yww h GLU 57 N 0.71 0.43 -0.44 1.69 4.39 -1.03 -0.69 114.58 119.64 1yww h GLU 57 Ca 0.19 -0.31 -0.04 0.00 0.34 0.00 0.00 59.36 59.54 1yww h GLU 57 Cb -0.07 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1yww h GLU 57 CO -0.04 0.93 0.12 0.28 -1.16 0.00 0.00 179.01 179.14 1yww h VAL 58 N 0.31 1.23 0.00 3.13 2.07 -0.55 -1.82 116.25 120.62 1yww h VAL 58 Ca -0.01 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1yww h VAL 58 Cb 1.20 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 1yww h VAL 58 CO 0.11 0.27 -0.21 0.03 0.02 0.00 0.00 177.57 177.80 1yww h ARG 59 N 0.58 0.00 -0.33 1.57 3.08 -0.84 -0.48 114.38 117.96 1yww h ARG 59 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1yww h ARG 59 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1yww h ARG 59 CO -0.00 0.21 0.12 0.22 -1.07 0.00 0.00 179.97 179.45 1yww h ASP 60 N 0.00 0.46 -0.32 7.04 3.58 -0.73 -0.17 116.42 126.28 1yww h ASP 60 Ca -0.00 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.20 1yww h ASP 60 Cb 0.74 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 1yww h ASP 60 CO 0.03 0.51 -0.04 0.15 -2.88 0.00 0.00 179.24 177.01 1yww h PHE 61 N 0.38 0.74 -0.07 0.28 3.57 -0.70 -2.04 116.94 119.09 1yww h PHE 61 Ca 0.11 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1yww h PHE 61 Cb 0.20 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1yww h PHE 61 CO -0.00 0.72 -0.21 0.77 -2.23 0.00 0.00 178.31 177.36 1yww h SER 62 N 0.65 0.12 0.57 0.41 0.02 -0.82 -1.52 113.55 112.97 1yww h SER 62 Ca 0.12 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 1yww h SER 62 Cb 0.46 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1yww h SER 62 CO 0.02 0.34 -0.41 -0.78 -1.14 0.00 0.00 176.83 174.86 1yww h ASP 63 N 0.11 0.00 0.82 3.07 3.58 -0.32 -2.43 116.42 121.26 1yww h ASP 63 Ca 0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.47 1yww h ASP 63 Cb 0.44 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.49 1yww h ASP 63 CO 0.03 0.41 0.00 -1.14 -2.88 0.00 0.00 179.24 175.66 1yww n ARG 64 N -3.82 0.16 0.00 0.28 0.63 -0.59 -5.10 116.66 108.22 1yww n ARG 64 Ca -0.01 0.01 0.13 0.00 -0.92 0.00 0.00 57.85 57.06 1yww n ARG 64 Cb 0.47 -1.50 0.34 0.00 0.45 0.00 0.00 32.46 32.22 1yww n ARG 64 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40