#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 -1.22 -0.12 1.61 7.64 -1.26 -4.73 113.62 115.54 2yul n SER 2 Ca 0.00 -0.51 -0.23 0.00 1.01 0.00 0.00 58.87 59.14 2yul n SER 2 Cb 0.00 -1.10 -0.09 0.00 -1.01 0.00 0.00 64.21 62.01 2yul n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yul n SER 3 N -1.58 1.91 0.00 6.43 3.41 -1.26 -5.12 113.62 117.41 2yul n SER 3 Ca 0.06 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2yul n SER 3 Cb 0.37 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2yul n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yul n GLY 4 N 1.37 0.71 3.54 5.00 0.00 -1.26 -5.13 105.19 109.42 2yul n GLY 4 Ca -0.39 -1.58 -0.14 0.00 0.00 0.00 0.00 46.02 43.91 2yul n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yul s SER 5 N -0.82 -0.52 -0.08 1.61 1.04 -1.26 -5.10 113.70 108.57 2yul s SER 5 Ca 0.00 0.51 -0.06 0.00 0.48 0.00 0.00 55.95 56.87 2yul s SER 5 Cb 0.00 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 2yul s SER 5 CO 0.00 -0.52 -0.13 -0.24 0.98 0.00 0.00 173.24 173.33 2yul n SER 6 N 0.69 1.03 0.00 7.02 2.88 -1.26 -5.02 113.62 118.96 2yul n SER 6 Ca -0.15 0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2yul n SER 6 Cb 0.58 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.35 2yul n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yul n GLY 7 N 1.62 0.97 3.05 0.46 0.00 -1.26 -5.12 105.19 104.92 2yul n GLY 7 Ca -0.05 -0.59 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 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 2.54 0.73 0.06 -0.61 1.09 -1.26 -5.06 121.20 118.68 2yul s ILE 8 Ca 0.00 -0.67 -0.11 0.00 -1.10 0.00 0.00 60.65 58.77 2yul s ILE 8 Cb 0.00 -0.66 -0.02 0.00 -1.06 0.00 0.00 42.46 40.71 2yul s ILE 8 CO 0.00 0.01 0.90 0.54 -0.10 0.00 0.00 174.94 176.29 2yul n ARG 9 N 2.31 -0.16 -3.60 2.79 1.74 -1.26 -4.81 116.66 113.67 2yul n ARG 9 Ca -0.17 0.89 -0.03 0.00 -0.77 0.00 0.00 57.85 57.78 2yul n ARG 9 Cb 0.56 -1.32 -0.02 0.00 -1.02 0.00 0.00 32.46 30.66 2yul n ARG 9 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2yul s ARG 10 N -4.18 0.33 1.07 5.56 1.04 -1.26 -5.18 118.95 116.33 2yul s ARG 10 Ca -0.04 -0.14 -0.14 0.00 -1.04 0.00 0.00 55.73 54.36 2yul s ARG 10 Cb 0.04 0.14 0.22 0.00 -2.04 0.00 0.00 34.95 33.31 2yul s ARG 10 CO 0.22 -0.14 1.10 -1.25 -0.04 0.00 0.00 175.30 175.18 2yul s PRO 11 N -2.41 -0.14 0.06 3.89 0.04 -1.26 -5.07 135.00 130.11 2yul s PRO 11 Ca 0.11 0.33 -0.06 0.00 0.04 0.00 0.00 61.00 61.41 2yul s PRO 11 Cb 0.01 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.85 2yul s PRO 11 CO -0.04 -3.07 0.12 -1.64 0.04 0.00 0.00 177.00 172.41 2yul s MET 12 N -5.09 0.71 0.58 4.56 1.00 -1.26 -4.98 119.30 114.82 2yul s MET 12 Ca 0.67 -0.91 0.09 0.00 0.00 0.00 0.00 55.69 55.54 2yul s MET 12 Cb -0.16 0.28 0.09 0.00 0.00 0.00 0.00 34.83 35.03 2yul s MET 12 CO 0.57 -0.19 0.75 0.54 0.00 0.00 0.00 175.02 176.69 2yul s ASN 13 N -2.56 4.97 0.27 3.03 2.20 -1.26 -4.45 114.94 117.14 2yul s ASN 13 Ca 0.01 -0.96 -0.00 0.00 -0.94 0.00 0.00 52.86 50.97 2yul s ASN 13 Cb 0.03 0.42 0.58 0.00 -2.00 0.00 0.00 41.25 40.28 2yul s ASN 13 CO -0.08 -1.36 1.73 0.00 -2.94 0.00 0.00 177.10 174.45 2yul h ALA 14 N 0.23 1.26 0.32 3.54 0.00 -1.90 0.16 119.26 122.88 2yul h ALA 14 Ca -0.30 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2yul h ALA 14 Cb 1.29 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.17 2yul h ALA 14 CO 0.43 -0.22 -0.16 0.35 0.00 0.00 0.00 179.25 179.66 2yul h PHE 15 N 0.48 -0.40 0.70 0.00 3.57 -1.95 -2.41 116.94 116.94 2yul h PHE 15 Ca 0.48 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.94 2yul h PHE 15 Cb 0.79 0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.67 2yul h PHE 15 CO -0.14 -0.18 -0.40 0.52 -2.23 0.00 0.00 178.31 175.88 2yul h MET 16 N -0.53 -0.98 -0.85 1.11 2.86 -1.70 -1.04 114.93 113.80 2yul h MET 16 Ca -0.04 0.07 0.08 0.00 -2.06 0.00 0.00 59.70 57.74 2yul h MET 16 Cb 0.40 0.22 -0.10 0.00 0.06 0.00 0.00 31.60 32.18 2yul h MET 16 CO 0.07 -0.65 -0.50 0.28 1.06 0.00 0.00 176.91 177.17 2yul n VAL 17 N -4.92 -0.57 0.25 -2.22 0.31 0.48 0.21 118.33 111.87 2yul n VAL 17 Ca -0.12 2.21 0.16 0.00 -0.01 0.00 0.00 64.34 66.57 2yul n VAL 17 Cb 0.41 -2.74 0.86 0.00 -0.91 0.00 0.00 33.84 31.47 2yul n VAL 17 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 2yul h TRP 18 N 0.00 0.00 0.03 3.52 7.01 -1.41 -0.51 115.95 124.59 2yul h TRP 18 Ca 0.14 0.00 -0.21 0.00 2.11 0.00 0.00 58.89 60.92 2yul h TRP 18 Cb 0.35 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.39 2yul h TRP 18 CO -0.97 0.00 -0.97 0.00 -2.79 0.00 0.00 178.44 173.71 2yul h ALA 19 N 1.89 0.41 -1.54 2.65 0.00 0.38 -3.19 119.26 119.87 2yul h ALA 19 Ca 0.04 -0.80 0.45 0.00 0.00 0.00 0.00 54.91 54.60 2yul h ALA 19 Cb 0.22 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2yul h ALA 19 CO -0.00 1.01 1.11 1.57 0.00 0.00 0.00 179.25 182.94 2yul h LYS 20 N 0.07 0.00 0.03 0.00 2.10 0.15 0.59 116.57 119.51 2yul h LYS 20 Ca -0.05 -0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.26 2yul h LYS 20 Cb 1.65 -0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.93 2yul h LYS 20 CO 0.14 0.00 -1.92 -3.47 -2.00 0.00 0.00 179.45 172.21 2yul n ASP 21 N -4.08 1.97 0.43 7.07 2.03 -1.23 -4.17 116.55 118.57 2yul n ASP 21 Ca 0.34 0.27 -0.17 0.00 0.52 0.00 0.00 54.79 55.76 2yul n ASP 21 Cb 1.59 -0.83 -0.08 0.00 -0.72 0.00 0.00 41.12 41.08 2yul n ASP 21 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2yul h GLU 22 N -0.60 -1.06 -0.90 -0.67 4.39 -0.93 -3.08 114.58 111.73 2yul h GLU 22 Ca -0.48 0.07 0.22 0.00 0.34 0.00 0.00 59.36 59.51 2yul h GLU 22 Cb 1.64 0.24 -0.17 0.00 -0.10 0.00 0.00 28.75 30.36 2yul h GLU 22 CO -0.17 -0.71 -0.08 -2.13 -1.16 0.00 0.00 179.01 174.76 2yul n ARG 23 N -5.19 -0.08 -0.33 2.33 0.63 0.19 0.87 116.66 115.08 2yul n ARG 23 Ca -0.14 1.38 0.14 0.00 -0.92 0.00 0.00 57.85 58.31 2yul n ARG 23 Cb 0.43 -2.13 0.29 0.00 0.45 0.00 0.00 32.46 31.50 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 0.04 -0.16 -0.14 1.79 -1.69 1.44 116.57 117.85 2yul h LYS 24 Ca 0.50 -0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.88 2yul h LYS 24 Cb 0.94 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.57 2yul h LYS 24 CO -0.88 0.03 -0.29 0.07 -1.08 0.00 0.00 179.45 177.30 2yul h ARG 25 N 0.04 0.30 -0.21 3.15 0.11 0.38 -2.84 114.38 115.32 2yul h ARG 25 Ca 0.59 -0.11 -0.05 0.00 0.10 0.00 0.00 59.98 60.50 2yul h ARG 25 Cb 1.22 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 32.28 2yul h ARG 25 CO -0.86 0.57 -0.08 -0.07 0.10 0.00 0.00 179.97 179.63 2yul h LEU 26 N 0.27 0.43 -0.17 0.08 3.38 0.20 -0.87 115.31 118.62 2yul h LEU 26 Ca 0.04 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2yul h LEU 26 Cb 0.65 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2yul h LEU 26 CO 0.05 0.73 -0.06 0.00 0.09 0.00 0.00 178.44 179.25 2yul h ALA 27 N 0.71 0.10 -0.19 1.53 0.00 -0.82 0.60 119.26 121.19 2yul h ALA 27 Ca 0.05 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2yul h ALA 27 Cb 0.56 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2yul h ALA 27 CO 0.03 -0.49 -0.24 -0.56 0.00 0.00 0.00 179.25 177.99 2yul h GLN 28 N -0.03 0.35 -0.02 0.00 3.07 -1.51 -2.64 115.11 114.33 2yul h GLN 28 Ca 0.09 -0.12 -0.17 0.00 0.09 0.00 0.00 58.65 58.54 2yul h GLN 28 Cb 0.16 -0.03 -0.01 0.00 0.08 0.00 0.00 27.48 27.68 2yul h GLN 28 CO -0.19 0.57 -0.76 1.96 0.09 0.00 0.00 178.83 180.50 2yul h GLN 29 N 0.32 0.18 -2.73 0.06 4.20 -0.38 -3.38 115.11 113.37 2yul h GLN 29 Ca 0.05 -0.16 -0.60 0.00 0.06 0.00 0.00 58.65 58.00 2yul h GLN 29 Cb 0.60 0.04 -0.40 0.00 0.30 0.00 0.00 27.48 28.02 2yul h GLN 29 CO 0.04 0.85 -0.80 -0.80 -0.67 0.00 0.00 178.83 177.46 2yul s ASN 30 N -6.90 3.01 0.00 1.46 0.01 0.20 -4.94 114.94 107.78 2yul s ASN 30 Ca -0.03 -3.11 0.15 0.00 -0.71 0.00 0.00 52.86 49.16 2yul s ASN 30 Cb 0.11 -0.90 0.72 0.00 0.41 0.00 0.00 41.25 41.58 2yul s ASN 30 CO 0.81 -0.18 1.42 -0.81 -1.51 0.00 0.00 177.10 176.82 2yul n PRO 31 N 2.87 0.17 -0.00 -0.60 -0.04 -1.02 -2.14 135.00 134.23 2yul n PRO 31 Ca 0.21 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.90 2yul n PRO 31 Cb 0.40 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.26 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 1.49 -4.88 3.54 8.00 -1.26 -5.00 116.55 117.12 2yul n ASP 32 Ca 0.06 -0.23 -0.30 0.00 0.71 0.00 0.00 54.79 55.04 2yul n ASP 32 Cb 0.13 1.46 -0.02 0.00 -0.02 0.00 0.00 41.12 42.66 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 -3.59 3.78 0.43 0.64 1.43 -0.91 -5.10 118.68 115.36 2yul s LEU 33 Ca -0.02 1.09 0.06 0.00 -1.03 0.00 0.00 54.13 54.23 2yul s LEU 33 Cb 0.09 -3.99 -0.06 0.00 0.03 0.00 0.00 46.19 42.26 2yul s LEU 33 CO 0.57 -0.44 0.05 -1.38 0.23 0.00 0.00 176.35 175.38 2yul s HIS 34 N -2.46 2.43 0.01 0.29 -3.43 -1.26 -4.92 115.29 105.95 2yul s HIS 34 Ca 0.50 -0.69 -0.01 0.00 -0.80 0.00 0.00 55.06 54.06 2yul s HIS 34 Cb -0.10 -1.80 -0.00 0.00 -1.43 0.00 0.00 32.58 29.24 2yul s HIS 34 CO 0.35 0.34 0.77 -1.71 -2.00 0.00 0.00 174.74 172.48 2yul n ASN 35 N -1.08 -0.04 -0.27 7.38 4.05 -1.26 0.16 115.26 124.19 2yul n ASN 35 Ca -0.06 0.78 0.25 0.00 0.45 0.00 0.00 54.58 56.00 2yul n ASN 35 Cb 0.66 -0.36 0.45 0.00 1.23 0.00 0.00 39.78 41.76 2yul n ASN 35 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2yul n ALA 36 N -2.78 0.84 0.08 5.20 0.00 -1.26 0.22 120.51 122.80 2yul n ALA 36 Ca 0.00 0.70 -0.21 0.00 0.00 0.00 0.00 53.44 53.92 2yul n ALA 36 Cb 0.01 -0.75 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 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 0.38 -0.19 0.00 4.39 0.11 -3.33 114.58 115.94 2yul h GLU 37 Ca 0.62 -0.63 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2yul h GLU 37 Cb 1.79 0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 30.66 2yul h GLU 37 CO -0.47 1.30 0.12 -0.07 -1.16 0.00 0.00 179.01 178.73 2yul h LEU 38 N -0.21 0.22 -0.71 1.33 3.38 0.54 -3.02 115.31 116.84 2yul h LEU 38 Ca -0.17 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 57.88 2yul h LEU 38 Cb 1.78 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 42.35 2yul h LEU 38 CO 0.19 0.18 -0.41 -1.28 0.09 0.00 0.00 178.44 177.20 2yul h SER 39 N 0.24 -1.45 -1.52 -0.43 0.87 -0.63 0.51 113.55 111.14 2yul h SER 39 Ca 0.07 0.26 0.46 0.00 -1.23 0.00 0.00 61.79 61.35 2yul h SER 39 Cb -0.01 0.69 -0.08 0.00 -0.44 0.00 0.00 62.40 62.57 2yul h SER 39 CO -0.01 -0.31 1.07 0.29 -0.53 0.00 0.00 176.83 177.34 2yul n LYS 40 N -5.42 -0.01 -0.04 2.24 4.76 -1.14 0.24 118.16 118.80 2yul n LYS 40 Ca 0.04 0.95 -0.15 0.00 -2.87 0.00 0.00 58.31 56.28 2yul n LYS 40 Cb 0.36 -2.10 -0.14 0.00 -1.84 0.00 0.00 35.03 31.31 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 -3.84 0.69 0.27 1.97 2.81 0.17 -3.65 117.12 115.55 2yul n MET 41 Ca 0.37 0.22 0.16 0.00 -1.81 0.00 0.00 57.70 56.64 2yul n MET 41 Cb 1.59 -1.69 0.74 0.00 -0.71 0.00 0.00 33.22 33.16 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 0.03 0.00 0.01 4.03 3.38 0.43 -2.89 115.31 120.29 2yul h LEU 42 Ca -0.42 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 2yul h LEU 42 Cb 2.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.78 2yul h LEU 42 CO 0.05 0.07 -0.44 1.23 0.09 0.00 0.00 178.44 179.44 2yul h GLY 43 N 1.47 0.02 0.58 0.83 0.00 -0.49 -2.77 103.07 102.70 2yul h GLY 43 Ca -0.00 -0.05 0.13 0.00 0.00 0.00 0.00 47.33 47.41 2yul h GLY 43 CO 0.01 0.05 0.57 0.07 0.00 0.00 0.00 176.54 177.24 2yul h LYS 44 N -0.96 0.73 0.00 4.80 2.10 -1.61 0.55 116.57 122.18 2yul h LYS 44 Ca -0.12 -0.04 -0.17 0.00 -2.00 0.00 0.00 60.65 58.32 2yul h LYS 44 Cb 1.13 -0.16 -0.02 0.00 -0.90 0.00 0.00 32.23 32.28 2yul h LYS 44 CO -0.05 0.48 -0.80 0.77 -2.00 0.00 0.00 179.45 177.85 2yul h SER 45 N 0.75 0.00 0.02 7.07 0.02 -1.64 -3.18 113.55 116.59 2yul h SER 45 Ca 0.44 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.39 2yul h SER 45 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2yul h SER 45 CO -0.20 0.80 -0.01 -0.25 -1.14 0.00 0.00 176.83 176.03 2yul h TRP 46 N 0.00 -0.02 -1.42 3.45 2.91 -0.68 -3.03 115.95 117.15 2yul h TRP 46 Ca -0.01 -0.00 0.45 0.00 1.13 0.00 0.00 58.89 60.46 2yul h TRP 46 Cb 1.53 0.01 -0.12 0.00 -0.51 0.00 0.00 29.16 30.07 2yul h TRP 46 CO 0.00 -0.02 0.95 0.87 -1.03 0.00 0.00 178.44 179.21 2yul h LYS 47 N -0.06 0.06 -0.63 2.65 1.57 -1.18 1.09 116.57 120.07 2yul h LYS 47 Ca -0.00 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2yul h LYS 47 Cb 0.02 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 2yul h LYS 47 CO 0.00 0.04 0.20 0.00 -0.57 0.00 0.00 179.45 179.13 2yul h ALA 48 N 1.49 0.82 -2.14 3.86 0.00 -1.62 -3.44 119.26 118.23 2yul h ALA 48 Ca 0.83 -0.20 -0.53 0.00 0.00 0.00 0.00 54.91 55.01 2yul h ALA 48 Cb 2.76 -0.24 0.22 0.00 0.00 0.00 0.00 17.79 20.53 2yul h ALA 48 CO -0.33 0.48 -0.60 1.28 0.00 0.00 0.00 179.25 180.08 2yul n LEU 49 N -4.38 -0.36 -4.92 0.00 4.77 0.37 -5.02 117.00 107.45 2yul n LEU 49 Ca 0.04 0.30 -0.23 0.00 -0.03 0.00 0.00 56.01 56.09 2yul n LEU 49 Cb 0.21 -1.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 2yul n LEU 49 CO 0.40 -3.61 0.10 0.42 -1.33 0.00 0.00 177.39 173.37 2yul s THR 50 N -2.39 2.02 0.10 -5.08 -4.23 -1.26 -4.97 115.64 99.83 2yul s THR 50 Ca 0.57 -1.35 -0.34 0.00 -1.18 0.00 0.00 61.69 59.40 2yul s THR 50 Cb -0.21 -2.37 -0.14 0.00 1.34 0.00 0.00 72.50 71.12 2yul s THR 50 CO 0.67 0.00 1.58 0.25 -0.54 0.00 0.00 174.62 176.58 2yul h LEU 51 N 0.70 -1.29 -1.83 4.79 7.12 -1.98 -0.90 115.31 121.92 2yul h LEU 51 Ca -0.36 0.12 0.24 0.00 0.13 0.00 0.00 57.88 58.01 2yul h LEU 51 Cb 1.29 0.45 -0.05 0.00 -0.53 0.00 0.00 40.66 41.82 2yul h LEU 51 CO 0.54 -0.58 0.63 0.00 -0.13 0.00 0.00 178.44 178.90 2yul h ALA 52 N -0.53 2.64 -0.15 1.25 0.00 -1.99 0.35 119.26 120.83 2yul h ALA 52 Ca -0.02 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2yul h ALA 52 Cb 0.77 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2yul h ALA 52 CO -0.14 -0.91 -0.59 0.93 0.00 0.00 0.00 179.25 178.54 2yul h GLU 53 N 0.13 0.48 -0.00 0.00 4.39 -1.60 -2.91 114.58 115.07 2yul h GLU 53 Ca 0.45 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.83 2yul h GLU 53 Cb 1.55 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.25 2yul h GLU 53 CO -0.07 0.93 -0.23 1.63 -1.16 0.00 0.00 179.01 180.12 2yul n LYS 54 N -3.92 0.36 -0.00 2.33 5.02 0.98 -4.06 118.16 118.87 2yul n LYS 54 Ca -0.03 -0.15 -0.10 0.00 -2.02 0.00 0.00 58.31 56.01 2yul n LYS 54 Cb 0.63 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.10 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 0.37 -0.09 0.00 1.97 9.65 -0.64 2.39 114.38 128.03 2yul h ARG 55 Ca 0.00 0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 58.80 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 -0.06 -0.40 -1.00 2.80 0.00 0.00 179.97 181.31 2yul h PRO 56 N -0.09 0.00 0.00 0.20 0.13 -1.73 -1.16 132.00 129.35 2yul h PRO 56 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2yul h PRO 56 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.33 2yul h PRO 56 CO -0.17 0.40 -0.82 1.19 -0.23 0.00 0.00 178.00 178.37 2yul n PHE 57 N -3.80 0.06 -0.04 1.56 3.72 -0.87 -3.84 117.46 114.25 2yul n PHE 57 Ca -0.01 0.02 -0.17 0.00 -0.05 0.00 0.00 57.45 57.24 2yul n PHE 57 Cb 0.47 -0.20 -0.14 0.00 -0.94 0.00 0.00 39.48 38.67 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 -1.61 1.65 0.77 -4.37 0.31 0.80 -3.16 118.33 112.72 2yul n VAL 58 Ca 0.04 -0.69 0.12 0.00 -0.01 0.00 0.00 64.34 63.80 2yul n VAL 58 Cb 0.36 -1.39 0.50 0.00 -0.91 0.00 0.00 33.84 32.39 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 -3.27 0.05 -0.09 5.55 -0.58 -0.46 -3.12 120.64 118.72 2yul n GLU 59 Ca -0.31 0.13 -0.10 0.00 -0.42 0.00 0.00 57.16 56.46 2yul n GLU 59 Cb 1.05 -1.57 -0.04 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 -1.65 0.51 -0.27 3.49 2.13 -1.25 -4.22 120.64 119.38 2yul n GLU 60 Ca 0.05 0.36 0.08 0.00 0.66 0.00 0.00 57.16 58.32 2yul n GLU 60 Cb 0.30 -1.56 0.21 0.00 0.27 0.00 0.00 31.44 30.66 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 -0.97 1.00 -0.13 4.31 0.00 -1.65 -1.38 119.26 120.45 2yul h ALA 61 Ca -0.09 0.22 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2yul h ALA 61 Cb 0.89 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 2yul h ALA 61 CO -0.05 -0.42 -0.50 1.49 0.00 0.00 0.00 179.25 179.77 2yul h GLU 62 N 0.18 -0.53 -0.62 0.00 4.57 -1.77 -0.18 114.58 116.23 2yul h GLU 62 Ca 0.47 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.81 2yul h GLU 62 Cb 0.86 0.12 -0.11 0.00 -0.16 0.00 0.00 28.75 29.46 2yul h GLU 62 CO -0.63 -0.36 -0.08 0.00 -1.18 0.00 0.00 179.01 176.76 2yul h ARG 63 N -0.55 0.05 -0.30 1.92 3.08 -1.43 -0.29 114.38 116.85 2yul h ARG 63 Ca 0.05 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.14 2yul h ARG 63 Cb 0.67 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 2yul h ARG 63 CO -0.42 0.03 0.04 -0.07 -1.07 0.00 0.00 179.97 178.48 2yul h LEU 64 N 0.05 -0.03 0.65 3.04 3.38 -0.95 0.13 115.31 121.58 2yul h LEU 64 Ca 0.31 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.32 2yul h LEU 64 Cb 0.50 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2yul h LEU 64 CO -0.60 0.02 -0.49 -0.09 0.09 0.00 0.00 178.44 177.37 2yul h ARG 65 N 0.14 -1.06 -0.43 1.13 2.43 0.53 -1.79 114.38 115.34 2yul h ARG 65 Ca 0.14 0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.50 2yul h ARG 65 Cb 0.17 0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2yul h ARG 65 CO -0.21 -0.71 0.31 -0.39 -1.51 0.00 0.00 179.97 177.46 2yul h VAL 66 N -1.10 0.81 0.00 0.20 -1.51 -0.99 0.23 116.25 113.89 2yul h VAL 66 Ca -0.08 -0.02 -0.04 0.00 -1.23 0.00 0.00 66.70 65.33 2yul h VAL 66 Cb 0.92 0.75 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 2yul h VAL 66 CO 0.02 0.01 -0.17 1.56 -1.23 0.00 0.00 177.57 177.76 2yul h GLN 67 N 0.06 0.00 0.14 5.19 4.20 -0.02 -0.88 115.11 123.80 2yul h GLN 67 Ca 0.20 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.57 2yul h GLN 67 Cb 0.73 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 2yul h GLN 67 CO -0.01 0.17 -1.77 1.25 -0.67 0.00 0.00 178.83 177.80 2yul h HIS 68 N 0.00 0.54 -0.27 2.96 2.76 0.23 -3.33 115.15 118.04 2yul h HIS 68 Ca -0.00 -0.39 -0.17 0.00 -2.20 0.00 0.00 60.37 57.60 2yul h HIS 68 Cb 0.61 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2yul h HIS 68 CO 0.00 1.59 -0.51 0.52 -1.30 0.00 0.00 177.93 178.23 2yul h MET 69 N 0.08 0.82 -0.48 5.26 2.86 -1.24 -3.05 114.93 119.18 2yul h MET 69 Ca -0.34 -0.52 0.12 0.00 -2.06 0.00 0.00 59.70 56.90 2yul h MET 69 Cb 2.06 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 33.76 2yul h MET 69 CO 0.14 1.15 0.34 -0.56 1.06 0.00 0.00 176.91 179.04 2yul h GLN 70 N 0.58 0.09 0.00 1.72 3.07 -1.32 0.20 115.11 119.45 2yul h GLN 70 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.75 2yul h GLN 70 Cb 1.12 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.66 2yul h GLN 70 CO 0.11 0.06 0.00 -0.44 0.09 0.00 0.00 178.83 178.65 2yul h ASP 71 N 0.09 0.00 -2.54 0.06 3.32 -1.64 -3.40 116.42 112.30 2yul h ASP 71 Ca 0.23 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.19 2yul h ASP 71 Cb 0.78 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.07 2yul h ASP 71 CO -0.02 0.00 -0.34 -1.38 -1.72 0.00 0.00 179.24 175.78 2yul s HIS 72 N -4.04 -0.83 -2.00 4.55 -3.43 0.72 -5.01 115.29 105.25 2yul s HIS 72 Ca -0.04 1.58 0.08 0.00 -0.80 0.00 0.00 55.06 55.88 2yul s HIS 72 Cb 0.12 0.35 0.45 0.00 -1.43 0.00 0.00 32.58 32.07 2yul s HIS 72 CO 0.43 -0.49 0.90 -0.35 -2.00 0.00 0.00 174.74 173.23 2yul n PRO 73 N 5.28 0.49 0.00 -0.38 -0.04 -1.25 -4.02 135.00 135.07 2yul n PRO 73 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 2yul n PRO 73 Cb 0.50 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.74 0.00 -0.25 3.54 3.02 -1.26 -2.43 115.26 117.14 2yul n ASN 74 Ca 0.06 0.98 -0.01 0.00 -0.03 0.00 0.00 54.58 55.58 2yul n ASN 74 Cb 0.03 -0.48 0.02 0.00 -0.61 0.00 0.00 39.78 38.74 2yul n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yul n TYR 75 N -2.38 0.00 -3.55 3.10 4.11 -1.26 -4.58 117.16 112.61 2yul n TYR 75 Ca 0.00 0.80 0.03 0.00 -0.00 0.00 0.00 57.90 58.73 2yul n TYR 75 Cb 0.00 -0.73 -0.06 0.00 -0.00 0.00 0.00 39.34 38.55 2yul n TYR 75 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.86 175.27 2yul s LYS 76 N -5.60 0.05 -0.44 -3.48 -2.85 -1.02 -5.12 119.74 101.28 2yul s LYS 76 Ca -0.09 0.09 0.02 0.00 -1.00 0.00 0.00 55.97 54.99 2yul s LYS 76 Cb 0.13 0.02 0.15 0.00 -2.06 0.00 0.00 37.83 36.07 2yul s LYS 76 CO 0.46 -0.01 0.28 -1.54 0.10 0.00 0.00 175.35 174.64 2yul s SER 77 N 1.27 3.14 0.00 0.03 1.04 -1.17 -4.85 113.70 113.15 2yul s SER 77 Ca -0.06 -2.76 0.00 0.00 0.48 0.00 0.00 55.95 53.61 2yul s SER 77 Cb -0.02 -0.82 0.00 0.00 0.10 0.00 0.00 66.02 65.28 2yul s SER 77 CO -0.11 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2yul n GLY 78 N 3.33 -0.69 3.61 7.32 0.00 -1.26 -4.95 105.19 112.55 2yul n GLY 78 Ca 0.15 -2.10 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 2yul n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yul s PRO 79 N 0.00 3.50 -0.05 1.61 0.04 -1.26 -4.94 135.00 133.91 2yul s PRO 79 Ca 0.00 1.40 -0.29 0.00 0.04 0.00 0.00 61.00 62.14 2yul s PRO 79 Cb 0.00 -4.12 -0.07 0.00 0.04 0.00 0.00 34.50 30.35 2yul s PRO 79 CO 0.00 -1.65 1.96 -1.54 0.04 0.00 0.00 177.00 175.81 2yul s SER 80 N 5.18 6.25 0.19 6.66 1.04 -1.26 -4.98 113.70 126.78 2yul s SER 80 Ca 0.74 2.37 0.09 0.00 0.48 0.00 0.00 55.95 59.64 2yul s SER 80 Cb -0.21 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.34 2yul s SER 80 CO 0.32 -1.26 -0.19 -0.44 0.98 0.00 0.00 173.24 172.66 2yul s SER 81 N 5.15 2.87 0.00 7.02 0.01 -1.26 -5.22 113.70 122.27 2yul s SER 81 Ca 0.88 -0.90 0.29 0.00 1.31 0.00 0.00 55.95 57.53 2yul s SER 81 Cb -0.38 -0.18 1.35 0.00 0.21 0.00 0.00 66.02 67.02 2yul s SER 81 CO 0.38 -0.02 1.92 0.61 0.41 0.00 0.00 173.24 176.53