#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yul s SER 2 N 0.00 4.63 -1.34 1.61 0.01 -1.26 -4.11 113.70 113.24 2yul s SER 2 Ca 0.00 -1.27 -0.14 0.00 1.31 0.00 0.00 55.95 55.84 2yul s SER 2 Cb 0.00 -2.58 0.14 0.00 0.21 0.00 0.00 66.02 63.79 2yul s SER 2 CO 0.00 -3.45 0.36 -0.24 0.41 0.00 0.00 173.24 170.31 2yul n SER 3 N 15.75 -0.96 0.00 2.44 2.88 -1.26 -2.47 113.62 130.00 2yul n SER 3 Ca 0.43 -0.92 0.00 0.00 -1.33 0.00 0.00 58.87 57.06 2yul n SER 3 Cb 0.46 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.76 2yul n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yul n GLY 4 N -1.14 1.54 3.70 0.46 0.00 -1.26 -4.97 105.19 103.52 2yul n GLY 4 Ca 0.03 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 2yul n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yul n SER 5 N 0.00 -4.28 -4.73 1.61 2.88 -1.03 -4.92 113.62 103.16 2yul n SER 5 Ca 0.00 -0.68 -0.42 0.00 -1.33 0.00 0.00 58.87 56.44 2yul n SER 5 Cb 0.00 -4.49 -0.03 0.00 -0.75 0.00 0.00 64.21 58.94 2yul n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yul s SER 6 N -3.66 7.04 0.00 -3.46 0.01 -1.26 -4.87 113.70 107.49 2yul s SER 6 Ca 0.42 2.19 0.00 0.00 1.31 0.00 0.00 55.95 59.87 2yul s SER 6 Cb -0.20 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.44 2yul s SER 6 CO 0.78 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 174.59 2yul n GLY 7 N 2.70 3.26 3.03 3.44 0.00 -1.26 -5.08 105.19 111.27 2yul n GLY 7 Ca 0.07 -1.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.78 1.53 0.06 -0.61 1.09 -1.26 -5.04 121.20 115.19 2yul s ILE 8 Ca 0.00 -0.62 -0.38 0.00 -1.10 0.00 0.00 60.65 58.55 2yul s ILE 8 Cb 0.00 -1.43 -0.21 0.00 -1.06 0.00 0.00 42.46 39.77 2yul s ILE 8 CO 0.00 0.45 1.57 0.03 -0.10 0.00 0.00 174.94 176.89 2yul h ARG 9 N 7.85 -1.26 -4.81 2.79 3.08 -2.00 -3.45 114.38 116.58 2yul h ARG 9 Ca -0.36 0.09 -0.29 0.00 0.07 0.00 0.00 59.98 59.49 2yul h ARG 9 Cb 1.15 0.29 -0.18 0.00 0.08 0.00 0.00 29.97 31.31 2yul h ARG 9 CO 0.51 -0.84 -0.72 1.03 -1.07 0.00 0.00 179.97 178.88 2yul s ARG 10 N -5.98 0.78 1.25 0.04 3.00 -1.26 -5.16 118.95 111.62 2yul s ARG 10 Ca -0.20 -1.13 -0.21 0.00 0.00 0.00 0.00 55.73 54.20 2yul s ARG 10 Cb 0.02 -0.40 0.31 0.00 0.00 0.00 0.00 34.95 34.88 2yul s ARG 10 CO 0.60 0.05 1.11 -1.25 0.00 0.00 0.00 175.30 175.81 2yul s PRO 11 N -2.84 -1.59 0.03 3.54 0.04 -1.26 -5.09 135.00 127.83 2yul s PRO 11 Ca 0.04 -0.19 -0.01 0.00 0.04 0.00 0.00 61.00 60.88 2yul s PRO 11 Cb -0.02 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.93 2yul s PRO 11 CO -0.01 -3.93 -0.02 -1.64 0.04 0.00 0.00 177.00 171.44 2yul s MET 12 N -5.50 0.45 0.27 4.56 -1.94 -1.26 -5.04 119.30 110.83 2yul s MET 12 Ca 0.72 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.87 2yul s MET 12 Cb -0.08 0.16 0.05 0.00 2.01 0.00 0.00 34.83 36.97 2yul s MET 12 CO 0.56 -0.08 0.37 0.09 -0.01 0.00 0.00 175.02 175.95 2yul n ASN 13 N 0.97 0.69 -0.12 3.03 3.02 -1.26 -4.53 115.26 117.07 2yul n ASN 13 Ca -0.20 -1.54 -0.05 0.00 -0.03 0.00 0.00 54.58 52.76 2yul n ASN 13 Cb 0.58 -0.22 0.03 0.00 -0.61 0.00 0.00 39.78 39.55 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 -0.12 0.46 0.02 5.41 0.00 -1.90 0.41 119.26 123.53 2yul h ALA 14 Ca -0.12 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2yul h ALA 14 Cb 0.50 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2yul h ALA 14 CO 0.15 -0.26 -0.01 0.35 0.00 0.00 0.00 179.25 179.48 2yul h PHE 15 N 0.28 -0.02 -0.38 0.00 3.04 -1.95 -1.85 116.94 116.06 2yul h PHE 15 Ca 0.18 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.20 2yul h PHE 15 Cb 0.17 0.01 -0.06 0.00 2.56 0.00 0.00 35.95 38.63 2yul h PHE 15 CO -0.16 0.23 -0.01 0.52 -2.02 0.00 0.00 178.31 176.88 2yul h MET 16 N -0.27 0.09 0.41 1.11 2.86 -1.87 0.39 114.93 117.66 2yul h MET 16 Ca -0.00 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2yul h MET 16 Cb 0.26 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.90 2yul h MET 16 CO 0.00 0.06 -0.22 0.28 1.06 0.00 0.00 176.91 178.09 2yul h VAL 17 N 0.10 0.00 -1.17 -2.22 2.07 -0.88 -1.27 116.25 112.88 2yul h VAL 17 Ca 0.19 0.00 0.34 0.00 0.82 0.00 0.00 66.70 68.05 2yul h VAL 17 Cb 0.26 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.99 2yul h VAL 17 CO -0.32 0.00 0.84 -0.25 0.02 0.00 0.00 177.57 177.86 2yul h TRP 18 N -0.58 0.01 -0.32 1.57 7.01 -1.24 0.43 115.95 122.84 2yul h TRP 18 Ca -0.06 0.00 -0.17 0.00 2.11 0.00 0.00 58.89 60.77 2yul h TRP 18 Cb 0.46 -0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.51 2yul h TRP 18 CO 0.06 0.00 -0.47 0.00 -2.79 0.00 0.00 178.44 175.24 2yul h ALA 19 N 1.42 0.49 -1.68 2.65 0.00 -0.48 -2.92 119.26 118.74 2yul h ALA 19 Ca 0.56 -0.49 0.52 0.00 0.00 0.00 0.00 54.91 55.50 2yul h ALA 19 Cb 2.23 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 19.82 2yul h ALA 19 CO -0.01 0.65 1.16 0.36 0.00 0.00 0.00 179.25 181.41 2yul n LYS 20 N -4.05 -0.02 -0.08 0.00 2.85 0.15 -0.09 118.16 116.92 2yul n LYS 20 Ca -0.04 1.15 -0.07 0.00 -1.05 0.00 0.00 58.31 58.30 2yul n LYS 20 Cb 0.59 -2.46 -0.03 0.00 -0.65 0.00 0.00 35.03 32.48 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 -4.27 1.85 -0.17 -5.58 -0.08 -1.18 -4.23 116.55 102.89 2yul n ASP 21 Ca 0.42 0.55 -0.10 0.00 -1.51 0.00 0.00 54.79 54.14 2yul n ASP 21 Cb 1.79 -0.85 -0.06 0.00 2.34 0.00 0.00 41.12 44.35 2yul n ASP 21 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2yul h GLU 22 N -1.00 -0.29 -0.95 -0.67 4.22 -1.04 -0.63 114.58 114.22 2yul h GLU 22 Ca -0.04 0.02 0.18 0.00 0.08 0.00 0.00 59.36 59.59 2yul h GLU 22 Cb 0.70 0.07 -0.17 0.00 0.50 0.00 0.00 28.75 29.85 2yul h GLU 22 CO -0.02 -0.19 -0.28 -2.13 -2.18 0.00 0.00 179.01 174.20 2yul n ARG 23 N -5.40 -0.13 -0.33 1.92 0.63 0.87 0.99 116.66 115.21 2yul n ARG 23 Ca -0.00 1.48 0.22 0.00 -0.92 0.00 0.00 57.85 58.63 2yul n ARG 23 Cb 0.35 -2.20 0.43 0.00 0.45 0.00 0.00 32.46 31.49 2yul n ARG 23 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2yul h LYS 24 N 0.00 0.08 -0.09 -0.14 1.57 -1.28 1.67 116.57 118.39 2yul h LYS 24 Ca 0.41 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 59.07 2yul h LYS 24 Cb 0.65 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2yul h LYS 24 CO -0.97 0.06 -0.46 0.07 -0.57 0.00 0.00 179.45 177.58 2yul h ARG 25 N 0.09 0.21 -0.24 3.15 0.11 0.60 -2.92 114.38 115.37 2yul h ARG 25 Ca 0.71 -0.11 -0.09 0.00 0.10 0.00 0.00 59.98 60.59 2yul h ARG 25 Cb 1.67 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.75 2yul h ARG 25 CO -0.77 0.63 -0.20 -0.07 0.10 0.00 0.00 179.97 179.65 2yul h LEU 26 N 0.17 0.59 -0.11 0.08 3.38 0.27 -1.72 115.31 117.97 2yul h LEU 26 Ca 0.01 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.55 2yul h LEU 26 Cb 0.88 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2yul h LEU 26 CO 0.07 0.93 -0.05 0.00 0.09 0.00 0.00 178.44 179.47 2yul h ALA 27 N 0.68 0.04 -0.34 1.53 0.00 -0.94 0.48 119.26 120.73 2yul h ALA 27 Ca 0.04 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2yul h ALA 27 Cb 0.74 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2yul h ALA 27 CO 0.05 -0.51 -0.04 -0.56 0.00 0.00 0.00 179.25 178.19 2yul h GLN 28 N -0.04 0.54 -0.09 0.00 3.07 -1.54 -2.59 115.11 114.45 2yul h GLN 28 Ca 0.06 -0.13 -0.18 0.00 0.09 0.00 0.00 58.65 58.49 2yul h GLN 28 Cb 0.14 -0.07 -0.00 0.00 0.08 0.00 0.00 27.48 27.62 2yul h GLN 28 CO -0.14 0.60 -0.71 1.96 0.09 0.00 0.00 178.83 180.63 2yul h GLN 29 N 0.51 0.42 -2.86 0.06 4.20 -0.67 -3.38 115.11 113.38 2yul h GLN 29 Ca 0.10 -0.33 -0.61 0.00 0.06 0.00 0.00 58.65 57.87 2yul h GLN 29 Cb 0.40 0.07 -0.40 0.00 0.30 0.00 0.00 27.48 27.84 2yul h GLN 29 CO 0.02 0.97 -0.74 -0.80 -0.67 0.00 0.00 178.83 177.60 2yul s ASN 30 N -6.97 3.47 0.00 1.46 0.01 0.16 -4.94 114.94 108.14 2yul s ASN 30 Ca -0.06 -3.20 0.15 0.00 -0.71 0.00 0.00 52.86 49.04 2yul s ASN 30 Cb 0.11 -1.10 0.72 0.00 0.41 0.00 0.00 41.25 41.38 2yul s ASN 30 CO 0.84 -0.17 1.42 -0.81 -1.51 0.00 0.00 177.10 176.86 2yul n PRO 31 N 2.78 0.17 -0.00 -0.60 -0.04 -1.01 -2.14 135.00 134.16 2yul n PRO 31 Ca 0.18 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.88 2yul n PRO 31 Cb 0.38 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 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 -1.33 1.47 -4.89 3.54 8.00 -1.26 -5.00 116.55 117.08 2yul n ASP 32 Ca 0.06 -0.26 -0.29 0.00 0.71 0.00 0.00 54.79 55.02 2yul n ASP 32 Cb 0.13 1.43 -0.02 0.00 -0.02 0.00 0.00 41.12 42.64 2yul n ASP 32 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2yul s LEU 33 N -3.54 3.78 0.42 0.64 1.43 -0.91 -5.10 118.68 115.40 2yul s LEU 33 Ca -0.02 1.03 0.07 0.00 -1.03 0.00 0.00 54.13 54.18 2yul s LEU 33 Cb 0.09 -3.93 -0.07 0.00 0.03 0.00 0.00 46.19 42.31 2yul s LEU 33 CO 0.56 -0.44 0.06 -1.38 0.23 0.00 0.00 176.35 175.38 2yul s HIS 34 N -2.47 2.47 0.02 0.29 -3.43 -1.26 -4.92 115.29 105.99 2yul s HIS 34 Ca 0.49 -0.68 -0.04 0.00 -0.80 0.00 0.00 55.06 54.04 2yul s HIS 34 Cb -0.10 -1.81 -0.01 0.00 -1.43 0.00 0.00 32.58 29.23 2yul s HIS 34 CO 0.36 0.35 0.81 0.09 -2.00 0.00 0.00 174.74 174.35 2yul n ASN 35 N -1.07 -0.12 -0.29 7.38 3.02 -1.26 0.16 115.26 123.08 2yul n ASN 35 Ca -0.05 0.84 0.27 0.00 -0.03 0.00 0.00 54.58 55.61 2yul n ASN 35 Cb 0.66 -0.34 0.48 0.00 -0.61 0.00 0.00 39.78 39.97 2yul n ASN 35 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yul n ALA 36 N -2.86 0.89 0.05 5.41 0.00 -1.26 0.18 120.51 122.92 2yul n ALA 36 Ca 0.00 0.75 -0.20 0.00 0.00 0.00 0.00 53.44 53.99 2yul n ALA 36 Cb 0.03 -0.80 -0.14 0.00 0.00 0.00 0.00 19.45 18.54 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 0.33 -0.25 0.00 4.39 0.12 -3.33 114.58 115.84 2yul h GLU 37 Ca 0.66 -0.53 0.03 0.00 0.34 0.00 0.00 59.36 59.86 2yul h GLU 37 Cb 1.90 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 30.71 2yul h GLU 37 CO -0.51 1.24 0.09 -0.07 -1.16 0.00 0.00 179.01 178.59 2yul h LEU 38 N -0.30 0.09 -0.69 1.33 3.38 0.46 -2.85 115.31 116.74 2yul h LEU 38 Ca -0.14 0.03 0.11 0.00 0.09 0.00 0.00 57.88 57.97 2yul h LEU 38 Cb 1.63 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 42.27 2yul h LEU 38 CO 0.16 0.09 -0.37 -1.28 0.09 0.00 0.00 178.44 177.13 2yul h SER 39 N 0.20 -1.29 -1.58 -0.43 0.87 -0.79 0.48 113.55 111.02 2yul h SER 39 Ca 0.11 0.25 0.48 0.00 -1.23 0.00 0.00 61.79 61.40 2yul h SER 39 Cb 0.08 0.64 -0.08 0.00 -0.44 0.00 0.00 62.40 62.60 2yul h SER 39 CO -0.11 -0.30 1.11 0.29 -0.53 0.00 0.00 176.83 177.29 2yul n LYS 40 N -5.44 -0.01 -0.04 2.24 4.76 -1.07 0.24 118.16 118.84 2yul n LYS 40 Ca 0.05 0.97 -0.14 0.00 -2.87 0.00 0.00 58.31 56.32 2yul n LYS 40 Cb 0.36 -2.15 -0.14 0.00 -1.84 0.00 0.00 35.03 31.26 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 -3.85 0.69 0.26 1.97 2.81 0.16 -3.79 117.12 115.37 2yul n MET 41 Ca 0.38 0.21 0.12 0.00 -1.81 0.00 0.00 57.70 56.59 2yul n MET 41 Cb 1.65 -1.68 0.72 0.00 -0.71 0.00 0.00 33.22 33.20 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 0.01 4.03 3.38 0.41 -2.13 115.31 121.03 2yul h LEU 42 Ca -0.42 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 2yul h LEU 42 Cb 2.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.80 2yul h LEU 42 CO 0.05 0.11 -0.00 1.23 0.09 0.00 0.00 178.44 179.92 2yul h GLY 43 N 0.69 -0.01 0.69 0.83 0.00 -0.91 -2.47 103.07 101.89 2yul h GLY 43 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 2yul h GLY 43 CO 0.01 -0.00 0.62 0.07 0.00 0.00 0.00 176.54 177.24 2yul h LYS 44 N -0.99 1.00 0.00 4.80 2.10 -1.63 -0.49 116.57 121.36 2yul h LYS 44 Ca -0.00 -0.06 -0.14 0.00 -2.00 0.00 0.00 60.65 58.45 2yul h LYS 44 Cb 0.68 -0.23 -0.02 0.00 -0.90 0.00 0.00 32.23 31.77 2yul h LYS 44 CO 0.00 0.66 -0.64 0.77 -2.00 0.00 0.00 179.45 178.24 2yul h SER 45 N 1.03 0.00 0.02 7.07 0.02 -1.51 -2.98 113.55 117.21 2yul h SER 45 Ca 0.43 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2yul h SER 45 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2yul h SER 45 CO -0.19 0.64 -0.01 -0.25 -1.14 0.00 0.00 176.83 175.88 2yul h TRP 46 N 0.00 -0.03 -1.11 3.45 2.91 -0.62 -2.93 115.95 117.62 2yul h TRP 46 Ca -0.01 -0.00 0.33 0.00 1.13 0.00 0.00 58.89 60.34 2yul h TRP 46 Cb 1.20 0.01 -0.12 0.00 -0.51 0.00 0.00 29.16 29.74 2yul h TRP 46 CO 0.00 -0.02 0.69 0.87 -1.03 0.00 0.00 178.44 178.95 2yul h LYS 47 N -0.05 0.29 -0.84 2.65 1.57 -1.46 0.47 116.57 119.19 2yul h LYS 47 Ca -0.00 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.82 2yul h LYS 47 Cb 0.02 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.21 2yul h LYS 47 CO 0.01 0.19 0.52 0.00 -0.57 0.00 0.00 179.45 179.60 2yul h ALA 48 N 1.68 1.15 -2.20 3.86 0.00 -1.55 -3.43 119.26 118.77 2yul h ALA 48 Ca 0.70 -0.01 -0.54 0.00 0.00 0.00 0.00 54.91 55.06 2yul h ALA 48 Cb 1.84 -0.23 0.21 0.00 0.00 0.00 0.00 17.79 19.61 2yul h ALA 48 CO -0.43 0.28 -0.65 1.28 0.00 0.00 0.00 179.25 179.73 2yul n LEU 49 N -4.62 -0.52 -4.91 0.00 4.77 0.16 -5.01 117.00 106.87 2yul n LEU 49 Ca 0.12 0.36 -0.20 0.00 -0.03 0.00 0.00 56.01 56.26 2yul n LEU 49 Cb 0.16 -1.17 -0.02 0.00 -2.33 0.00 0.00 43.42 40.06 2yul n LEU 49 CO 0.31 -3.75 0.03 0.42 -1.33 0.00 0.00 177.39 173.08 2yul s THR 50 N -2.30 2.82 0.13 -5.08 -4.23 -1.26 -4.95 115.64 100.78 2yul s THR 50 Ca 0.57 -1.25 -0.29 0.00 -1.18 0.00 0.00 61.69 59.54 2yul s THR 50 Cb -0.23 -3.02 -0.05 0.00 1.34 0.00 0.00 72.50 70.55 2yul s THR 50 CO 0.67 -0.01 1.58 0.25 -0.54 0.00 0.00 174.62 176.57 2yul h LEU 51 N 0.94 -1.34 -1.79 4.79 7.12 -1.97 0.17 115.31 123.22 2yul h LEU 51 Ca -0.41 0.18 0.22 0.00 0.13 0.00 0.00 57.88 58.00 2yul h LEU 51 Cb 1.27 0.55 -0.05 0.00 -0.53 0.00 0.00 40.66 41.90 2yul h LEU 51 CO 0.54 -0.42 0.59 0.00 -0.13 0.00 0.00 178.44 179.02 2yul h ALA 52 N 0.16 2.53 -0.06 1.25 0.00 -1.99 0.45 119.26 121.59 2yul h ALA 52 Ca 0.08 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 2yul h ALA 52 Cb 0.62 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2yul h ALA 52 CO -0.43 -0.78 -0.82 0.93 0.00 0.00 0.00 179.25 178.16 2yul h GLU 53 N 0.17 0.48 -0.00 0.00 4.39 -1.16 -3.08 114.58 115.38 2yul h GLU 53 Ca 0.42 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2yul h GLU 53 Cb 1.38 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2yul h GLU 53 CO -0.08 1.07 -0.26 1.63 -1.16 0.00 0.00 179.01 180.21 2yul n LYS 54 N -3.82 0.05 -0.04 2.33 5.02 0.55 -4.03 118.16 118.22 2yul n LYS 54 Ca -0.06 -0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.13 2yul n LYS 54 Cb 0.76 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.25 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 0.05 -0.06 -0.07 1.97 9.65 -0.18 2.31 114.38 128.04 2yul h ARG 55 Ca 0.00 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.77 2yul h ARG 55 Cb 0.49 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.07 2yul h ARG 55 CO 0.00 -0.04 -0.47 -1.00 2.80 0.00 0.00 179.97 181.26 2yul h PRO 56 N -0.06 0.17 0.00 0.20 0.13 -1.74 -0.87 132.00 129.83 2yul h PRO 56 Ca 0.11 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2yul h PRO 56 Cb 0.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.36 2yul h PRO 56 CO -0.25 0.61 -0.57 1.19 -0.23 0.00 0.00 178.00 178.75 2yul n PHE 57 N -3.98 0.07 -0.04 1.56 3.72 -0.86 -3.58 117.46 114.34 2yul n PHE 57 Ca -0.02 0.02 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 2yul n PHE 57 Cb 0.51 -0.28 -0.13 0.00 -0.94 0.00 0.00 39.48 38.63 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 -1.58 1.66 0.76 -4.37 0.31 0.77 -3.46 118.33 112.41 2yul n VAL 58 Ca 0.05 -0.66 0.12 0.00 -0.01 0.00 0.00 64.34 63.84 2yul n VAL 58 Cb 0.35 -1.49 0.49 0.00 -0.91 0.00 0.00 33.84 32.28 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 -3.33 0.05 -0.07 5.55 -0.58 -0.35 -3.04 120.64 118.87 2yul n GLU 59 Ca -0.35 0.14 -0.06 0.00 -0.42 0.00 0.00 57.16 56.47 2yul n GLU 59 Cb 1.04 -1.58 -0.02 0.00 -0.57 0.00 0.00 31.44 30.31 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 0.46 -0.33 3.49 2.13 -1.24 -4.01 120.64 119.48 2yul n GLU 60 Ca 0.05 0.51 0.13 0.00 0.66 0.00 0.00 57.16 58.52 2yul n GLU 60 Cb 0.30 -1.68 0.31 0.00 0.27 0.00 0.00 31.44 30.64 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 -0.96 1.56 0.17 4.31 0.00 -1.66 -1.83 119.26 120.85 2yul h ALA 61 Ca -0.03 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2yul h ALA 61 Cb 0.60 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2yul h ALA 61 CO -0.02 -0.20 -0.46 1.49 0.00 0.00 0.00 179.25 180.06 2yul h GLU 62 N 0.58 -0.70 -0.89 0.00 4.57 -1.74 0.70 114.58 117.11 2yul h GLU 62 Ca 0.57 0.05 0.22 0.00 -1.18 0.00 0.00 59.36 59.01 2yul h GLU 62 Cb 0.98 0.16 -0.12 0.00 -0.16 0.00 0.00 28.75 29.61 2yul h GLU 62 CO -0.44 -0.47 0.39 0.00 -1.18 0.00 0.00 179.01 177.30 2yul h ARG 63 N -0.73 0.38 -0.26 1.92 3.08 -1.47 0.77 114.38 118.07 2yul h ARG 63 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 2yul h ARG 63 Cb 0.73 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 2yul h ARG 63 CO -0.23 0.25 0.04 -0.07 -1.07 0.00 0.00 179.97 178.89 2yul h LEU 64 N 0.39 0.42 0.74 3.04 3.38 -1.08 -1.48 115.31 120.73 2yul h LEU 64 Ca 0.56 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2yul h LEU 64 Cb 1.05 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2yul h LEU 64 CO -0.53 0.58 -0.44 -0.09 0.09 0.00 0.00 178.44 178.05 2yul h ARG 65 N 0.25 -1.07 -0.40 1.13 2.43 0.13 -1.86 114.38 115.00 2yul h ARG 65 Ca 0.08 0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.44 2yul h ARG 65 Cb 0.34 0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 2yul h ARG 65 CO 0.01 -0.71 0.29 -0.39 -1.51 0.00 0.00 179.97 177.66 2yul h VAL 66 N -1.11 0.76 0.00 0.20 -1.51 -1.05 0.43 116.25 113.97 2yul h VAL 66 Ca -0.10 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 2yul h VAL 66 Cb 0.89 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 2yul h VAL 66 CO 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.45 2yul n GLN 67 N -4.36 0.18 -0.07 5.19 6.02 -0.56 -1.28 117.38 122.50 2yul n GLN 67 Ca 0.07 0.26 -0.16 0.00 -0.01 0.00 0.00 57.00 57.15 2yul n GLN 67 Cb 0.48 -1.76 -0.14 0.00 1.02 0.00 0.00 30.24 29.85 2yul n GLN 67 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2yul n HIS 68 N -2.09 0.47 0.09 1.08 -0.00 0.14 -4.30 115.22 110.62 2yul n HIS 68 Ca 0.04 0.12 -0.02 0.00 0.46 0.00 0.00 57.72 58.33 2yul n HIS 68 Cb 0.33 -1.07 -0.05 0.00 -0.12 0.00 0.00 29.99 29.08 2yul n HIS 68 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2yul h MET 69 N 0.02 0.00 -0.55 1.57 -0.00 -1.27 -3.28 114.93 111.42 2yul h MET 69 Ca -0.49 0.00 0.02 0.00 -0.00 0.00 0.00 59.70 59.23 2yul h MET 69 Cb 2.03 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 33.60 2yul h MET 69 CO 0.01 0.68 0.36 -0.56 -0.00 0.00 0.00 176.91 177.40 2yul h GLN 70 N 0.00 0.67 0.00 -0.10 3.07 -1.38 -0.81 115.11 116.55 2yul h GLN 70 Ca -0.03 -0.04 -0.02 0.00 0.09 0.00 0.00 58.65 58.65 2yul h GLN 70 Cb 1.58 -0.15 -0.00 0.00 0.08 0.00 0.00 27.48 28.99 2yul h GLN 70 CO 0.09 0.44 -0.11 0.22 0.09 0.00 0.00 178.83 179.56 2yul h ASP 71 N 0.69 0.00 -2.69 0.06 1.82 -1.75 -3.41 116.42 111.15 2yul h ASP 71 Ca 0.21 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.69 2yul h ASP 71 Cb 0.00 0.00 -0.30 0.00 0.68 0.00 0.00 39.33 39.71 2yul h ASP 71 CO -0.05 0.11 -0.46 -1.38 -1.61 0.00 0.00 179.24 175.85 2yul s HIS 72 N -4.59 -0.59 -1.96 0.28 -3.43 -0.31 -5.01 115.29 99.68 2yul s HIS 72 Ca -0.04 1.20 0.16 0.00 -0.80 0.00 0.00 55.06 55.57 2yul s HIS 72 Cb 0.15 0.11 0.92 0.00 -1.43 0.00 0.00 32.58 32.32 2yul s HIS 72 CO 0.64 -0.42 1.35 -0.35 -2.00 0.00 0.00 174.74 173.96 2yul n PRO 73 N 5.37 0.47 0.22 -0.38 -0.04 -1.23 -3.40 135.00 136.00 2yul n PRO 73 Ca -0.07 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.51 2yul n PRO 73 Cb 0.50 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 33.06 2yul n PRO 73 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2yul h ASN 74 N 0.00 0.00 0.14 3.54 2.35 -1.95 -1.63 115.58 118.03 2yul h ASN 74 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2yul h ASN 74 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2yul h ASN 74 CO 0.00 0.00 -0.07 0.10 -1.65 0.00 0.00 177.43 175.81 2yul h TYR 75 N 0.00 -0.17 -0.35 1.19 -0.00 -1.86 -3.46 116.97 112.31 2yul h TYR 75 Ca 0.00 -0.00 0.21 0.00 -0.00 0.00 0.00 58.73 58.94 2yul h TYR 75 Cb 0.42 0.06 -0.20 0.00 -0.00 0.00 0.00 36.73 37.00 2yul h TYR 75 CO 0.00 0.29 0.03 0.15 -0.00 0.00 0.00 178.16 178.63 2yul s LYS 76 N -3.51 0.20 -0.32 0.10 1.02 -0.62 -5.13 119.74 111.49 2yul s LYS 76 Ca -0.13 0.28 -0.02 0.00 0.02 0.00 0.00 55.97 56.12 2yul s LYS 76 Cb 0.00 0.14 0.11 0.00 -0.52 0.00 0.00 37.83 37.56 2yul s LYS 76 CO 0.51 -0.30 0.13 -1.12 -0.92 0.00 0.00 175.35 173.65 2yul s SER 77 N 2.95 3.76 -0.93 2.83 0.01 -1.21 -4.93 113.70 116.18 2yul s SER 77 Ca 0.13 -1.65 -0.24 0.00 1.31 0.00 0.00 55.95 55.49 2yul s SER 77 Cb -0.07 -0.68 0.03 0.00 0.21 0.00 0.00 66.02 65.52 2yul s SER 77 CO -0.17 -0.40 0.54 0.61 0.41 0.00 0.00 173.24 174.22 2yul n GLY 78 N 4.81 -0.73 0.19 3.44 0.00 -1.26 -4.78 105.19 106.86 2yul n GLY 78 Ca -0.01 0.30 0.14 0.00 0.00 0.00 0.00 46.02 46.45 2yul n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yul h PRO 79 N -1.31 0.00 0.00 1.61 0.13 -1.99 -3.36 132.00 127.07 2yul h PRO 79 Ca -0.57 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.54 2yul h PRO 79 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2yul h PRO 79 CO 0.40 0.00 -0.55 0.45 -0.23 0.00 0.00 178.00 178.07 2yul n SER 80 N -2.57 0.71 -3.45 1.44 2.88 -1.26 -5.13 113.62 106.25 2yul n SER 80 Ca 0.01 0.10 -0.12 0.00 -1.33 0.00 0.00 58.87 57.53 2yul n SER 80 Cb 0.25 -0.23 -0.02 0.00 -0.75 0.00 0.00 64.21 63.46 2yul n SER 80 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yul s SER 81 N -5.63 -0.53 0.00 -3.46 0.01 -1.26 -5.27 113.70 97.56 2yul s SER 81 Ca -0.03 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2yul s SER 81 Cb 0.01 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.79 2yul s SER 81 CO 0.03 -0.87 0.01 0.61 0.41 0.00 0.00 173.24 173.43