#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yul n SER 2 N 0.00 3.17 -3.81 1.61 3.41 -1.26 -5.00 113.62 111.74 2yul n SER 2 Ca 0.00 -0.04 -0.22 0.00 -0.26 0.00 0.00 58.87 58.35 2yul n SER 2 Cb 0.00 0.09 -0.17 0.00 -0.26 0.00 0.00 64.21 63.87 2yul n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2yul s SER 3 N -4.68 1.34 0.00 4.04 0.15 -1.26 -5.00 113.70 108.29 2yul s SER 3 Ca -0.11 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2yul s SER 3 Cb 0.03 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.90 2yul s SER 3 CO 0.26 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2yul n GLY 4 N 4.75 1.05 3.70 9.45 0.00 -1.26 -5.11 105.19 117.77 2yul n GLY 4 Ca -0.14 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 2yul n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yul s SER 5 N 0.00 6.60 -0.22 1.61 0.15 -1.26 -4.96 113.70 115.62 2yul s SER 5 Ca 0.00 0.72 -0.05 0.00 0.70 0.00 0.00 55.95 57.32 2yul s SER 5 Cb 0.00 -2.27 -0.12 0.00 -1.71 0.00 0.00 66.02 61.91 2yul s SER 5 CO 0.00 -0.05 -0.24 -1.20 1.20 0.00 0.00 173.24 172.94 2yul n SER 6 N 4.08 1.99 0.00 5.45 7.64 -1.26 -5.13 113.62 126.39 2yul n SER 6 Ca -0.07 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.89 2yul n SER 6 Cb 0.51 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2yul n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yul n GLY 7 N 2.03 2.36 3.13 0.23 0.00 -1.26 -5.10 105.19 106.58 2yul n GLY 7 Ca -0.42 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 43.58 2yul n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yul s ILE 8 N -1.74 1.93 0.32 -0.61 1.01 -1.26 -5.01 121.20 115.85 2yul s ILE 8 Ca 0.00 -0.89 0.11 0.00 0.00 0.00 0.00 60.65 59.86 2yul s ILE 8 Cb 0.00 -1.73 0.32 0.00 0.01 0.00 0.00 42.46 41.06 2yul s ILE 8 CO 0.00 0.52 1.67 -0.09 0.00 0.00 0.00 174.94 177.05 2yul h ARG 9 N 7.49 0.35 -6.13 2.79 9.65 -2.08 -3.39 114.38 123.05 2yul h ARG 9 Ca -0.35 -0.02 -0.61 0.00 -1.10 0.00 0.00 59.98 57.91 2yul h ARG 9 Cb 1.18 -0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 29.61 2yul h ARG 9 CO 0.56 0.23 -0.56 1.03 2.80 0.00 0.00 179.97 184.02 2yul s ARG 10 N -5.75 3.03 0.87 0.20 3.00 -1.26 -5.12 118.95 113.93 2yul s ARG 10 Ca -0.11 -0.69 -0.15 0.00 0.00 0.00 0.00 55.73 54.78 2yul s ARG 10 Cb 0.29 -2.78 0.22 0.00 0.00 0.00 0.00 34.95 32.67 2yul s ARG 10 CO 0.79 0.54 0.77 -0.35 0.00 0.00 0.00 175.30 177.05 2yul n PRO 11 N 0.09 -2.52 -4.23 3.54 -0.04 -1.26 -5.09 135.00 125.49 2yul n PRO 11 Ca -0.08 -1.24 -0.20 0.00 -0.04 0.00 0.00 63.50 61.95 2yul n PRO 11 Cb 0.53 -1.16 -0.12 0.00 -0.04 0.00 0.00 33.50 32.71 2yul n PRO 11 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2yul s MET 12 N -4.76 0.90 0.23 0.54 -1.94 -1.26 -5.05 119.30 107.95 2yul s MET 12 Ca 0.50 -0.95 0.02 0.00 -1.71 0.00 0.00 55.69 53.55 2yul s MET 12 Cb -0.05 -0.94 0.04 0.00 2.01 0.00 0.00 34.83 35.89 2yul s MET 12 CO 0.38 0.22 0.31 0.09 -0.01 0.00 0.00 175.02 176.01 2yul n ASN 13 N 1.38 0.62 -0.27 3.03 3.02 -1.26 -4.53 115.26 117.25 2yul n ASN 13 Ca -0.20 -1.48 0.00 0.00 -0.03 0.00 0.00 54.58 52.87 2yul n ASN 13 Cb 0.54 -0.18 0.13 0.00 -0.61 0.00 0.00 39.78 39.66 2yul n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yul h ALA 14 N -0.01 1.06 -0.02 5.41 0.00 -1.90 0.14 119.26 123.94 2yul h ALA 14 Ca -0.10 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2yul h ALA 14 Cb 0.43 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2yul h ALA 14 CO 0.13 0.13 -0.01 0.35 0.00 0.00 0.00 179.25 179.85 2yul h PHE 15 N 0.80 0.04 0.08 0.00 3.04 -1.95 -2.61 116.94 116.34 2yul h PHE 15 Ca 0.35 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.31 2yul h PHE 15 Cb 0.23 -0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.71 2yul h PHE 15 CO -0.06 0.46 -0.17 0.52 -2.02 0.00 0.00 178.31 177.04 2yul h MET 16 N -0.40 -0.31 0.09 1.11 2.86 -1.85 0.21 114.93 116.65 2yul h MET 16 Ca 0.00 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2yul h MET 16 Cb 0.45 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 2yul h MET 16 CO 0.00 -0.21 -0.43 0.28 1.06 0.00 0.00 176.91 177.62 2yul h VAL 17 N -0.32 0.00 -0.29 -2.22 2.07 -0.78 0.23 116.25 114.94 2yul h VAL 17 Ca 0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 2yul h VAL 17 Cb 0.35 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2yul h VAL 17 CO -0.11 0.00 0.28 -0.25 0.02 0.00 0.00 177.57 177.51 2yul h TRP 18 N -0.60 0.00 -0.10 1.57 7.01 -1.39 -0.79 115.95 121.64 2yul h TRP 18 Ca -0.00 0.00 -0.19 0.00 2.11 0.00 0.00 58.89 60.80 2yul h TRP 18 Cb 0.61 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.68 2yul h TRP 18 CO -0.43 0.00 -0.68 0.00 -2.79 0.00 0.00 178.44 174.54 2yul h ALA 19 N 1.72 0.22 -1.18 2.65 0.00 0.95 -3.11 119.26 120.51 2yul h ALA 19 Ca 0.14 -0.57 0.39 0.00 0.00 0.00 0.00 54.91 54.86 2yul h ALA 19 Cb 0.69 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.38 2yul h ALA 19 CO -0.00 0.53 0.79 0.36 0.00 0.00 0.00 179.25 180.94 2yul n LYS 20 N -4.07 -0.02 -0.06 0.00 2.85 0.63 -0.23 118.16 117.25 2yul n LYS 20 Ca -0.08 0.91 -0.05 0.00 -1.05 0.00 0.00 58.31 58.04 2yul n LYS 20 Cb 0.70 -1.88 -0.02 0.00 -0.65 0.00 0.00 35.03 33.18 2yul n LYS 20 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2yul n ASP 21 N -3.99 1.59 -0.30 -5.58 2.03 -1.22 -4.17 116.55 104.90 2yul n ASP 21 Ca 0.32 0.52 -0.07 0.00 0.52 0.00 0.00 54.79 56.08 2yul n ASP 21 Cb 1.29 -0.80 -0.03 0.00 -0.72 0.00 0.00 41.12 40.87 2yul n ASP 21 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2yul h GLU 22 N -0.87 -0.11 -0.92 -0.67 4.22 -1.00 0.21 114.58 115.44 2yul h GLU 22 Ca 0.00 0.01 0.23 0.00 0.08 0.00 0.00 59.36 59.67 2yul h GLU 22 Cb 0.53 0.03 -0.17 0.00 0.50 0.00 0.00 28.75 29.64 2yul h GLU 22 CO 0.00 -0.08 -0.03 -0.09 -2.18 0.00 0.00 179.01 176.63 2yul h ARG 23 N -0.12 0.04 -0.92 1.92 2.43 -0.84 0.48 114.38 117.37 2yul h ARG 23 Ca 0.22 -0.00 0.27 0.00 -0.81 0.00 0.00 59.98 59.65 2yul h ARG 23 Cb 0.54 -0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 29.93 2yul h ARG 23 CO -0.83 0.02 0.27 0.87 -1.51 0.00 0.00 179.97 178.80 2yul h LYS 24 N 0.04 0.16 -0.16 0.20 1.57 -0.74 1.07 116.57 118.72 2yul h LYS 24 Ca 0.52 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 59.20 2yul h LYS 24 Cb 0.97 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 2yul h LYS 24 CO -0.86 0.11 -0.27 0.07 -0.57 0.00 0.00 179.45 177.93 2yul h ARG 25 N 0.17 0.29 -0.46 3.15 0.11 -0.04 -2.90 114.38 114.71 2yul h ARG 25 Ca 0.61 -0.10 -0.09 0.00 0.10 0.00 0.00 59.98 60.50 2yul h ARG 25 Cb 1.31 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 32.35 2yul h ARG 25 CO -0.70 0.55 -0.06 -0.07 0.10 0.00 0.00 179.97 179.78 2yul h LEU 26 N 0.26 0.85 0.06 0.08 3.38 0.13 -1.07 115.31 119.00 2yul h LEU 26 Ca 0.04 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2yul h LEU 26 Cb 0.62 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2yul h LEU 26 CO 0.04 0.99 -0.06 0.00 0.09 0.00 0.00 178.44 179.50 2yul h ALA 27 N 0.89 -0.11 -0.06 1.53 0.00 -1.01 0.65 119.26 121.14 2yul h ALA 27 Ca 0.12 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2yul h ALA 27 Cb 0.59 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2yul h ALA 27 CO 0.04 -0.58 -0.27 -0.56 0.00 0.00 0.00 179.25 177.88 2yul h GLN 28 N -0.14 0.10 0.00 0.00 3.07 -1.50 -2.47 115.11 114.18 2yul h GLN 28 Ca 0.01 -0.03 -0.20 0.00 0.09 0.00 0.00 58.65 58.52 2yul h GLN 28 Cb 0.14 -0.01 -0.03 0.00 0.08 0.00 0.00 27.48 27.66 2yul h GLN 28 CO -0.02 0.36 -0.94 1.96 0.09 0.00 0.00 178.83 180.28 2yul h GLN 29 N 0.09 0.02 -2.62 0.06 4.20 -0.66 -3.39 115.11 112.80 2yul h GLN 29 Ca 0.01 -0.02 -0.60 0.00 0.06 0.00 0.00 58.65 58.10 2yul h GLN 29 Cb 0.53 0.01 -0.39 0.00 0.30 0.00 0.00 27.48 27.92 2yul h GLN 29 CO 0.04 0.95 -0.85 -0.80 -0.67 0.00 0.00 178.83 177.49 2yul s ASN 30 N -6.76 2.60 0.00 1.46 0.01 0.22 -4.95 114.94 107.53 2yul s ASN 30 Ca 0.00 -2.99 0.15 0.00 -0.71 0.00 0.00 52.86 49.31 2yul s ASN 30 Cb 0.10 -0.73 0.73 0.00 0.41 0.00 0.00 41.25 41.76 2yul s ASN 30 CO 0.81 -0.19 1.42 -0.81 -1.51 0.00 0.00 177.10 176.82 2yul n PRO 31 N 3.00 0.18 -0.00 -0.60 -0.04 -0.97 -2.16 135.00 134.40 2yul n PRO 31 Ca 0.22 0.16 0.07 0.00 -0.04 0.00 0.00 63.50 63.91 2yul n PRO 31 Cb 0.42 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.28 2yul n PRO 31 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2yul n ASP 32 N -1.32 1.57 -4.88 3.54 9.92 -1.26 -5.00 116.55 119.13 2yul n ASP 32 Ca 0.06 -0.18 -0.30 0.00 -0.53 0.00 0.00 54.79 53.84 2yul n ASP 32 Cb 0.13 1.49 -0.03 0.00 -0.64 0.00 0.00 41.12 42.07 2yul n ASP 32 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2yul s LEU 33 N -3.66 3.77 0.42 0.64 1.43 -0.92 -5.10 118.68 115.26 2yul s LEU 33 Ca -0.03 1.15 0.07 0.00 -1.03 0.00 0.00 54.13 54.29 2yul s LEU 33 Cb 0.09 -4.05 -0.07 0.00 0.03 0.00 0.00 46.19 42.20 2yul s LEU 33 CO 0.57 -0.45 0.07 -1.38 0.23 0.00 0.00 176.35 175.39 2yul s HIS 34 N -2.46 2.49 0.00 0.29 -3.43 -1.26 -4.91 115.29 106.00 2yul s HIS 34 Ca 0.51 -0.67 0.00 0.00 -0.80 0.00 0.00 55.06 54.11 2yul s HIS 34 Cb -0.10 -1.83 0.00 0.00 -1.43 0.00 0.00 32.58 29.22 2yul s HIS 34 CO 0.34 0.34 0.71 -1.71 -2.00 0.00 0.00 174.74 172.42 2yul n ASN 35 N -1.09 0.00 -0.25 7.38 5.15 -1.26 0.16 115.26 125.36 2yul n ASN 35 Ca -0.05 0.71 0.24 0.00 -0.60 0.00 0.00 54.58 54.88 2yul n ASN 35 Cb 0.66 -0.35 0.43 0.00 -0.53 0.00 0.00 39.78 39.99 2yul n ASN 35 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2yul n ALA 36 N -2.71 0.78 0.06 5.20 0.00 -1.26 0.22 120.51 122.80 2yul n ALA 36 Ca 0.00 0.70 -0.20 0.00 0.00 0.00 0.00 53.44 53.94 2yul n ALA 36 Cb 0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 19.45 18.58 2yul n ALA 36 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2yul h GLU 37 N 0.00 0.37 -0.19 0.00 4.39 0.12 -3.32 114.58 115.95 2yul h GLU 37 Ca 0.61 -0.57 0.02 0.00 0.34 0.00 0.00 59.36 59.76 2yul h GLU 37 Cb 1.68 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 30.51 2yul h GLU 37 CO -0.50 1.25 0.04 -0.07 -1.16 0.00 0.00 179.01 178.57 2yul h LEU 38 N -0.22 0.01 -0.69 1.33 3.38 0.54 -2.87 115.31 116.80 2yul h LEU 38 Ca -0.15 0.03 0.11 0.00 0.09 0.00 0.00 57.88 57.96 2yul h LEU 38 Cb 1.66 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 42.33 2yul h LEU 38 CO 0.17 0.03 -0.38 -1.28 0.09 0.00 0.00 178.44 177.07 2yul h SER 39 N 0.11 -1.35 -1.59 -0.43 0.87 -0.88 0.48 113.55 110.76 2yul h SER 39 Ca 0.09 0.25 0.47 0.00 -1.23 0.00 0.00 61.79 61.37 2yul h SER 39 Cb 0.08 0.66 -0.07 0.00 -0.44 0.00 0.00 62.40 62.62 2yul h SER 39 CO -0.11 -0.31 1.13 0.29 -0.53 0.00 0.00 176.83 177.30 2yul n LYS 40 N -5.43 -0.00 -0.05 2.24 4.76 -1.08 0.24 118.16 118.84 2yul n LYS 40 Ca 0.05 0.93 -0.15 0.00 -2.87 0.00 0.00 58.31 56.26 2yul n LYS 40 Cb 0.36 -2.09 -0.14 0.00 -1.84 0.00 0.00 35.03 31.32 2yul n LYS 40 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2yul n MET 41 N -3.71 0.69 0.28 1.97 2.81 0.16 -3.77 117.12 115.54 2yul n MET 41 Ca 0.37 0.19 0.15 0.00 -1.81 0.00 0.00 57.70 56.60 2yul n MET 41 Cb 1.64 -1.65 0.79 0.00 -0.71 0.00 0.00 33.22 33.29 2yul n MET 41 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2yul h LEU 42 N 0.02 0.00 0.00 4.03 3.38 0.42 -2.59 115.31 120.57 2yul h LEU 42 Ca -0.45 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 2yul h LEU 42 Cb 2.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.79 2yul h LEU 42 CO 0.04 0.09 -0.21 1.23 0.09 0.00 0.00 178.44 179.67 2yul h GLY 43 N 0.92 0.00 0.61 0.83 0.00 -0.81 -2.67 103.07 101.95 2yul h GLY 43 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 2yul h GLY 43 CO 0.01 0.00 0.58 0.07 0.00 0.00 0.00 176.54 177.20 2yul h LYS 44 N -1.00 0.78 0.00 4.80 2.10 -1.63 -0.05 116.57 121.58 2yul h LYS 44 Ca -0.05 -0.05 -0.18 0.00 -2.00 0.00 0.00 60.65 58.37 2yul h LYS 44 Cb 0.93 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 32.06 2yul h LYS 44 CO -0.03 0.52 -0.83 0.77 -2.00 0.00 0.00 179.45 177.87 2yul h SER 45 N 0.81 0.07 0.03 7.07 0.02 -1.59 -3.02 113.55 116.92 2yul h SER 45 Ca 0.44 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.33 2yul h SER 45 Cb 0.55 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2yul h SER 45 CO -0.20 0.86 -0.01 -0.25 -1.14 0.00 0.00 176.83 176.09 2yul h TRP 46 N 0.03 -0.03 -1.17 3.45 2.91 -0.69 -2.87 115.95 117.58 2yul h TRP 46 Ca -0.02 -0.00 0.34 0.00 1.13 0.00 0.00 58.89 60.34 2yul h TRP 46 Cb 1.46 0.01 -0.10 0.00 -0.51 0.00 0.00 29.16 30.02 2yul h TRP 46 CO 0.01 -0.02 0.76 0.87 -1.03 0.00 0.00 178.44 179.03 2yul h LYS 47 N -0.05 0.23 -0.98 2.65 1.57 -1.38 0.58 116.57 119.18 2yul h LYS 47 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2yul h LYS 47 Cb 0.03 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.24 2yul h LYS 47 CO 0.01 0.15 0.62 0.00 -0.57 0.00 0.00 179.45 179.66 2yul h ALA 48 N 1.59 1.24 -2.46 3.86 0.00 -1.55 -3.44 119.26 118.50 2yul h ALA 48 Ca 0.68 -0.09 -0.56 0.00 0.00 0.00 0.00 54.91 54.95 2yul h ALA 48 Cb 2.01 -0.40 0.19 0.00 0.00 0.00 0.00 17.79 19.59 2yul h ALA 48 CO -0.31 0.66 -0.32 1.28 0.00 0.00 0.00 179.25 180.56 2yul n LEU 49 N -4.37 1.22 -5.00 0.00 4.77 0.20 -5.00 117.00 108.82 2yul n LEU 49 Ca 0.11 0.58 -0.23 0.00 -0.03 0.00 0.00 56.01 56.44 2yul n LEU 49 Cb 0.03 -1.25 0.10 0.00 -2.33 0.00 0.00 43.42 39.97 2yul n LEU 49 CO 0.37 -2.96 0.51 0.42 -1.33 0.00 0.00 177.39 174.40 2yul s THR 50 N -1.95 2.17 0.08 -5.08 -4.23 -1.26 -4.94 115.64 100.42 2yul s THR 50 Ca 0.66 -0.65 -0.32 0.00 -1.18 0.00 0.00 61.69 60.20 2yul s THR 50 Cb -0.33 -2.51 -0.17 0.00 1.34 0.00 0.00 72.50 70.82 2yul s THR 50 CO 0.58 0.00 1.63 0.25 -0.54 0.00 0.00 174.62 176.53 2yul h LEU 51 N -0.40 -0.78 -2.11 4.79 7.12 -1.97 -1.91 115.31 120.05 2yul h LEU 51 Ca -0.36 0.04 0.08 0.00 0.13 0.00 0.00 57.88 57.78 2yul h LEU 51 Cb 1.27 0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.61 2yul h LEU 51 CO 0.41 -0.50 0.27 0.00 -0.13 0.00 0.00 178.44 178.48 2yul h ALA 52 N -0.39 2.04 -0.16 1.25 0.00 -2.00 0.46 119.26 120.47 2yul h ALA 52 Ca -0.07 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 2yul h ALA 52 Cb 0.65 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2yul h ALA 52 CO 0.08 -0.42 -0.58 0.93 0.00 0.00 0.00 179.25 179.26 2yul h GLU 53 N 0.00 0.51 -0.00 0.00 4.39 -1.75 -2.91 114.58 114.82 2yul h GLU 53 Ca 0.14 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.50 2yul h GLU 53 Cb 0.67 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 2yul h GLU 53 CO -0.00 0.94 -0.23 1.63 -1.16 0.00 0.00 179.01 180.19 2yul n LYS 54 N -3.93 0.30 0.01 2.33 5.02 0.04 -4.04 118.16 117.89 2yul n LYS 54 Ca -0.03 -0.12 -0.10 0.00 -2.02 0.00 0.00 58.31 56.03 2yul n LYS 54 Cb 0.62 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.09 2yul n LYS 54 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2yul h ARG 55 N 0.30 -0.08 0.00 1.97 9.65 -1.04 2.40 114.38 127.58 2yul h ARG 55 Ca 0.00 0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.83 2yul h ARG 55 Cb 0.45 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 2yul h ARG 55 CO 0.00 -0.05 -0.24 -1.00 2.80 0.00 0.00 179.97 181.48 2yul h PRO 56 N -0.08 0.00 -0.00 0.20 0.13 -1.72 -1.31 132.00 129.22 2yul h PRO 56 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2yul h PRO 56 Cb 0.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.29 2yul h PRO 56 CO -0.13 0.24 -0.94 1.19 -0.23 0.00 0.00 178.00 178.14 2yul n PHE 57 N -3.52 0.00 -0.05 1.56 3.72 -0.86 -4.04 117.46 114.28 2yul n PHE 57 Ca -0.01 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.23 2yul n PHE 57 Cb 0.40 -0.02 -0.14 0.00 -0.94 0.00 0.00 39.48 38.78 2yul n PHE 57 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2yul n VAL 58 N -1.44 1.63 0.73 -4.37 0.31 0.80 -3.46 118.33 112.54 2yul n VAL 58 Ca 0.04 -0.68 0.11 0.00 -0.01 0.00 0.00 64.34 63.80 2yul n VAL 58 Cb 0.34 -1.38 0.48 0.00 -0.91 0.00 0.00 33.84 32.37 2yul n VAL 58 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2yul n GLU 59 N -3.26 0.05 -0.08 5.55 -0.58 -0.52 -3.01 120.64 118.80 2yul n GLU 59 Ca -0.33 0.15 -0.06 0.00 -0.42 0.00 0.00 57.16 56.50 2yul n GLU 59 Cb 1.05 -1.57 -0.02 0.00 -0.57 0.00 0.00 31.44 30.32 2yul n GLU 59 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2yul n GLU 60 N -1.67 0.47 -0.30 3.49 2.13 -1.26 -3.86 120.64 119.64 2yul n GLU 60 Ca 0.05 0.47 0.23 0.00 0.66 0.00 0.00 57.16 58.57 2yul n GLU 60 Cb 0.28 -1.64 0.54 0.00 0.27 0.00 0.00 31.44 30.89 2yul n GLU 60 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2yul h ALA 61 N -0.99 2.34 -0.50 4.31 0.00 -1.66 0.34 119.26 123.11 2yul h ALA 61 Ca -0.01 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2yul h ALA 61 Cb 0.63 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2yul h ALA 61 CO -0.01 -0.71 -0.01 1.49 0.00 0.00 0.00 179.25 180.02 2yul h GLU 62 N 0.34 0.84 0.00 0.00 4.81 -1.73 -0.46 114.58 118.38 2yul h GLU 62 Ca 0.56 -0.23 -0.09 0.00 -0.13 0.00 0.00 59.36 59.46 2yul h GLU 62 Cb 1.52 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.80 2yul h GLU 62 CO -0.23 0.84 -0.45 0.00 -0.73 0.00 0.00 179.01 178.44 2yul h ARG 63 N 0.78 0.00 0.13 1.92 3.08 -0.45 -2.75 114.38 117.09 2yul h ARG 63 Ca 0.15 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.99 2yul h ARG 63 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.55 2yul h ARG 63 CO 0.02 0.45 -0.91 -0.07 -1.07 0.00 0.00 179.97 178.40 2yul h LEU 64 N 0.00 0.57 0.26 3.04 3.38 -0.99 -3.04 115.31 118.53 2yul h LEU 64 Ca -0.00 -0.91 0.01 0.00 0.09 0.00 0.00 57.88 57.06 2yul h LEU 64 Cb 0.81 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2yul h LEU 64 CO 0.06 1.43 -0.33 -0.09 0.09 0.00 0.00 178.44 179.60 2yul h ARG 65 N -0.20 -0.62 -0.84 1.13 2.43 -1.05 -1.23 114.38 113.99 2yul h ARG 65 Ca -0.15 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.15 2yul h ARG 65 Cb 1.69 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 31.31 2yul h ARG 65 CO 0.17 -0.41 0.50 -0.39 -1.51 0.00 0.00 179.97 178.33 2yul h VAL 66 N -0.64 0.94 0.00 0.20 -1.51 -1.63 0.14 116.25 113.75 2yul h VAL 66 Ca -0.00 -0.29 -0.00 0.00 -1.23 0.00 0.00 66.70 65.18 2yul h VAL 66 Cb 0.61 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.79 2yul h VAL 66 CO -0.10 0.15 -0.00 1.56 -1.23 0.00 0.00 177.57 177.95 2yul h GLN 67 N 0.85 0.00 0.03 5.19 4.20 -1.32 1.00 115.11 125.06 2yul h GLN 67 Ca 0.40 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.85 2yul h GLN 67 Cb 0.33 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 2yul h GLN 67 CO -0.23 0.00 -1.33 1.25 -0.67 0.00 0.00 178.83 177.85 2yul h HIS 68 N 0.00 0.11 0.00 2.96 2.76 0.46 -3.33 115.15 118.10 2yul h HIS 68 Ca -0.00 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.09 2yul h HIS 68 Cb 0.23 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.19 2yul h HIS 68 CO 0.00 1.09 -1.26 0.00 -1.30 0.00 0.00 177.93 176.46 2yul n MET 69 N -3.28 0.18 -0.21 5.26 -0.00 -0.75 -4.33 117.12 113.98 2yul n MET 69 Ca -0.09 -0.05 0.10 0.00 -0.00 0.00 0.00 57.70 57.66 2yul n MET 69 Cb 1.00 -1.51 0.39 0.00 -0.00 0.00 0.00 33.22 33.10 2yul n MET 69 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 175.97 175.41 2yul h GLN 70 N 0.00 0.64 -0.34 3.17 3.07 0.90 0.09 115.11 122.66 2yul h GLN 70 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 58.65 58.68 2yul h GLN 70 Cb 0.64 -0.15 -0.02 0.00 0.08 0.00 0.00 27.48 28.04 2yul h GLN 70 CO 0.00 0.43 0.13 -0.44 0.09 0.00 0.00 178.83 179.03 2yul h ASP 71 N 0.66 0.43 -3.25 0.06 5.19 -1.76 -3.41 116.42 114.34 2yul h ASP 71 Ca 0.37 -0.04 -0.34 0.00 -0.62 0.00 0.00 57.03 56.40 2yul h ASP 71 Cb 0.54 -0.11 -0.37 0.00 0.18 0.00 0.00 39.33 39.57 2yul h ASP 71 CO -0.14 0.40 -0.70 -1.38 -3.12 0.00 0.00 179.24 174.30 2yul s HIS 72 N -5.22 -0.02 -2.00 4.55 -3.43 0.02 -5.01 115.29 104.18 2yul s HIS 72 Ca -0.08 0.37 0.05 0.00 -0.80 0.00 0.00 55.06 54.61 2yul s HIS 72 Cb 0.17 -0.39 0.32 0.00 -1.43 0.00 0.00 32.58 31.25 2yul s HIS 72 CO 0.74 -0.21 0.78 -0.35 -2.00 0.00 0.00 174.74 173.70 2yul n PRO 73 N 5.22 0.49 -0.93 -0.38 -0.04 -1.24 -4.34 135.00 133.78 2yul n PRO 73 Ca -0.05 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.14 2yul n PRO 73 Cb 0.50 -1.17 -0.03 0.00 -0.04 0.00 0.00 33.50 32.76 2yul n PRO 73 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2yul n ASN 74 N -0.67 6.17 -4.14 3.54 3.02 -1.26 -4.80 115.26 117.12 2yul n ASN 74 Ca 0.04 -2.40 -0.11 0.00 -0.03 0.00 0.00 54.58 52.09 2yul n ASN 74 Cb 0.02 -1.25 -0.09 0.00 -0.61 0.00 0.00 39.78 37.85 2yul n ASN 74 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 2yul s TYR 75 N 2.84 0.90 0.18 3.10 -0.85 -1.26 -5.12 117.35 117.13 2yul s TYR 75 Ca 0.51 -1.20 -0.19 0.00 -0.52 0.00 0.00 57.07 55.67 2yul s TYR 75 Cb 0.14 -0.40 -0.12 0.00 0.38 0.00 0.00 41.96 41.96 2yul s TYR 75 CO -0.04 -0.64 0.29 1.17 -1.52 0.00 0.00 175.55 174.81 2yul n LYS 76 N -0.22 0.00 -3.59 -3.49 4.81 -1.26 -4.96 118.16 109.46 2yul n LYS 76 Ca -0.02 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.37 2yul n LYS 76 Cb 0.64 -0.71 -0.02 0.00 0.02 0.00 0.00 35.03 34.96 2yul n LYS 76 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2yul s SER 77 N -0.71 -0.17 0.00 3.14 1.04 -1.26 -5.17 113.70 110.58 2yul s SER 77 Ca 0.44 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2yul s SER 77 Cb -0.60 0.17 0.00 0.00 0.10 0.00 0.00 66.02 65.68 2yul s SER 77 CO 0.41 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.98 2yul n GLY 78 N -0.00 4.06 0.13 7.32 0.00 -1.26 -4.90 105.19 110.54 2yul n GLY 78 Ca -0.01 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.55 2yul n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yul n PRO 79 N -1.97 0.19 -1.31 1.61 -0.04 -1.26 -4.84 135.00 127.38 2yul n PRO 79 Ca 0.00 0.43 -0.55 0.00 -0.04 0.00 0.00 63.50 63.33 2yul n PRO 79 Cb 0.00 -1.87 -0.09 0.00 -0.04 0.00 0.00 33.50 31.50 2yul n PRO 79 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2yul n SER 80 N -2.23 0.87 -4.78 3.54 7.64 -1.26 -4.91 113.62 112.49 2yul n SER 80 Ca 0.02 0.83 -0.30 0.00 1.01 0.00 0.00 58.87 60.43 2yul n SER 80 Cb 0.23 -0.76 -0.06 0.00 -1.01 0.00 0.00 64.21 62.60 2yul n SER 80 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yul s SER 81 N 3.67 5.53 0.00 6.43 0.15 -1.26 -5.16 113.70 123.05 2yul s SER 81 Ca 0.95 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 57.59 2yul s SER 81 Cb -1.28 -1.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 2yul s SER 81 CO 0.64 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.86