#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys8 s SER 2 N 0.00 6.92 -0.26 1.61 1.04 -1.26 -5.05 113.70 116.70 2ys8 s SER 2 Ca 0.00 1.10 -0.06 0.00 0.48 0.00 0.00 55.95 57.47 2ys8 s SER 2 Cb 0.00 -2.37 -0.01 0.00 0.10 0.00 0.00 66.02 63.74 2ys8 s SER 2 CO 0.00 -0.03 0.03 -0.44 0.98 0.00 0.00 173.24 173.79 2ys8 s SER 3 N 0.47 4.84 0.00 7.02 0.01 -1.26 -4.59 113.70 120.19 2ys8 s SER 3 Ca 0.33 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2ys8 s SER 3 Cb -0.17 -1.84 0.00 0.00 0.21 0.00 0.00 66.02 64.22 2ys8 s SER 3 CO 0.16 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.34 2ys8 n GLY 4 N 4.85 3.97 3.03 3.44 0.00 -1.26 -5.11 105.19 114.10 2ys8 n GLY 4 Ca -0.16 -0.61 -0.19 0.00 0.00 0.00 0.00 46.02 45.06 2ys8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ys8 s SER 5 N 0.00 1.12 0.67 1.61 0.15 -1.26 -5.15 113.70 110.83 2ys8 s SER 5 Ca 0.00 -0.17 -0.11 0.00 0.70 0.00 0.00 55.95 56.37 2ys8 s SER 5 Cb 0.00 -0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.15 2ys8 s SER 5 CO 0.00 0.11 1.06 -0.44 1.20 0.00 0.00 173.24 175.17 2ys8 s SER 6 N -0.17 5.78 0.00 5.45 0.01 -1.26 -4.94 113.70 118.57 2ys8 s SER 6 Ca 0.03 1.35 0.00 0.00 1.31 0.00 0.00 55.95 58.64 2ys8 s SER 6 Cb -0.04 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2ys8 s SER 6 CO -0.00 -1.15 0.00 0.61 0.41 0.00 0.00 173.24 173.10 2ys8 n GLY 7 N -2.69 -0.54 3.33 3.44 0.00 -1.26 -5.11 105.19 102.36 2ys8 n GLY 7 Ca 0.07 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 2ys8 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ys8 s SER 8 N -4.00 3.77 0.32 1.61 0.01 -1.26 -5.12 113.70 109.03 2ys8 s SER 8 Ca 0.00 -0.38 0.05 0.00 1.31 0.00 0.00 55.95 56.93 2ys8 s SER 8 Cb 0.00 -1.53 -0.03 0.00 0.21 0.00 0.00 66.02 64.67 2ys8 s SER 8 CO 0.00 0.17 0.22 -0.55 0.41 0.00 0.00 173.24 173.49 2ys8 s SER 9 N 0.31 1.59 -0.05 2.44 0.15 -1.26 -5.00 113.70 111.89 2ys8 s SER 9 Ca -0.12 -1.66 -0.02 0.00 0.70 0.00 0.00 55.95 54.85 2ys8 s SER 9 Cb -0.16 0.50 0.04 0.00 -1.71 0.00 0.00 66.02 64.68 2ys8 s SER 9 CO 0.06 -0.99 0.10 0.00 1.20 0.00 0.00 173.24 173.62 2ys8 s ALA 10 N -3.54 -0.12 -0.08 5.45 0.00 -1.26 -5.06 121.76 117.15 2ys8 s ALA 10 Ca 0.37 0.53 -0.25 0.00 0.00 0.00 0.00 51.96 52.61 2ys8 s ALA 10 Cb 0.03 -0.37 -0.21 0.00 0.00 0.00 0.00 23.12 22.57 2ys8 s ALA 10 CO 0.22 -0.14 0.91 0.77 0.00 0.00 0.00 175.76 177.52 2ys8 h SER 11 N 7.27 -0.03 -0.70 0.00 0.02 -2.02 -3.44 113.55 114.65 2ys8 h SER 11 Ca -0.44 -0.67 -0.55 0.00 -0.84 0.00 0.00 61.79 59.29 2ys8 h SER 11 Cb 1.13 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.66 2ys8 h SER 11 CO 0.45 0.70 -0.24 0.72 -1.14 0.00 0.00 176.83 177.31 2ys8 s PHE 12 N -3.05 1.64 0.49 3.45 -0.12 -1.26 -4.95 117.98 114.17 2ys8 s PHE 12 Ca -0.16 -0.78 0.03 0.00 -0.05 0.00 0.00 56.93 55.97 2ys8 s PHE 12 Cb -0.01 -2.02 0.02 0.00 -0.63 0.00 0.00 43.02 40.38 2ys8 s PHE 12 CO 0.61 -0.66 0.69 0.95 -0.05 0.00 0.00 175.22 176.76 2ys8 s THR 13 N -2.72 3.09 0.11 -4.49 -4.23 -1.26 -4.98 115.64 101.17 2ys8 s THR 13 Ca 0.44 -0.73 -0.21 0.00 -1.18 0.00 0.00 61.69 60.00 2ys8 s THR 13 Cb -0.03 -3.12 -0.10 0.00 1.34 0.00 0.00 72.50 70.59 2ys8 s THR 13 CO 0.27 -0.07 1.75 0.11 -0.54 0.00 0.00 174.62 176.14 2ys8 h LYS 14 N 0.32 0.10 -0.19 3.99 1.57 -2.00 -2.42 116.57 117.93 2ys8 h LYS 14 Ca -0.43 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.38 2ys8 h LYS 14 Cb 1.28 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.51 2ys8 h LYS 14 CO 0.52 0.07 -0.46 0.93 -0.57 0.00 0.00 179.45 179.93 2ys8 h GLU 15 N 0.10 -0.43 -0.19 3.15 5.08 -1.99 0.20 114.58 120.50 2ys8 h GLU 15 Ca 0.05 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2ys8 h GLU 15 Cb 0.02 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.29 2ys8 h GLU 15 CO -0.04 -0.28 -0.49 1.96 -1.00 0.00 0.00 179.01 179.16 2ys8 h GLN 16 N -0.44 -0.49 -0.54 2.33 4.20 -1.86 -0.77 115.11 117.55 2ys8 h GLN 16 Ca 0.04 0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.89 2ys8 h GLN 16 Cb 0.55 0.11 -0.10 0.00 0.30 0.00 0.00 27.48 28.34 2ys8 h GLN 16 CO -0.41 -0.32 -0.14 0.00 -0.67 0.00 0.00 178.83 177.28 2ys8 h ALA 17 N -0.04 0.34 -0.55 3.87 0.00 -0.98 -0.38 119.26 121.53 2ys8 h ALA 17 Ca 0.07 0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.28 2ys8 h ALA 17 Cb 0.65 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.79 2ys8 h ALA 17 CO -0.46 -0.44 0.13 -0.44 0.00 0.00 0.00 179.25 178.04 2ys8 h ASP 18 N -0.01 0.04 0.82 0.00 3.32 0.34 0.31 116.42 121.24 2ys8 h ASP 18 Ca 0.26 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 2ys8 h ASP 18 Cb 0.40 0.12 0.01 0.00 0.22 0.00 0.00 39.33 40.08 2ys8 h ASP 18 CO -0.56 0.04 -0.42 0.00 -1.72 0.00 0.00 179.24 176.58 2ys8 h ALA 19 N 1.42 -1.29 -0.81 3.45 0.00 0.28 -0.85 119.26 121.46 2ys8 h ALA 19 Ca 0.28 -0.25 0.14 0.00 0.00 0.00 0.00 54.91 55.08 2ys8 h ALA 19 Cb 0.38 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 2ys8 h ALA 19 CO -0.34 -1.22 0.53 0.82 0.00 0.00 0.00 179.25 179.04 2ys8 h ILE 20 N -1.13 0.83 -0.66 0.00 2.04 -0.99 0.16 117.51 117.76 2ys8 h ILE 20 Ca -0.11 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 2ys8 h ILE 20 Cb 0.88 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2ys8 h ILE 20 CO 0.17 0.10 0.12 -0.09 0.00 0.00 0.00 178.15 178.45 2ys8 h ARG 21 N 0.56 1.07 -0.01 2.37 2.43 -0.12 -2.31 114.38 118.37 2ys8 h ARG 21 Ca 0.40 -0.27 -0.12 0.00 -0.81 0.00 0.00 59.98 59.18 2ys8 h ARG 21 Cb 0.75 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2ys8 h ARG 21 CO -0.16 0.97 -0.46 0.00 -1.51 0.00 0.00 179.97 178.82 2ys8 h ARG 22 N 1.01 0.33 -0.77 0.20 3.08 0.42 -2.49 114.38 116.14 2ys8 h ARG 22 Ca 0.20 -0.34 0.13 0.00 0.07 0.00 0.00 59.98 60.05 2ys8 h ARG 22 Cb 0.41 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.46 2ys8 h ARG 22 CO 0.01 1.02 0.36 0.82 -1.07 0.00 0.00 179.97 181.11 2ys8 h ILE 23 N -0.24 0.72 0.00 2.04 2.04 -0.73 2.04 117.51 123.39 2ys8 h ILE 23 Ca -0.05 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 2ys8 h ILE 23 Cb 1.18 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2ys8 h ILE 23 CO 0.09 0.10 -0.13 0.08 0.00 0.00 0.00 178.15 178.29 2ys8 h ARG 24 N 0.53 0.00 -0.26 2.37 0.11 -1.48 -3.09 114.38 112.56 2ys8 h ARG 24 Ca 0.41 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.49 2ys8 h ARG 24 Cb 0.58 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.66 2ys8 h ARG 24 CO -0.36 0.13 0.00 0.09 0.10 0.00 0.00 179.97 179.93 2ys8 n ASN 25 N -3.17 3.64 -4.91 0.08 3.02 0.55 -5.01 115.26 109.46 2ys8 n ASN 25 Ca 0.02 -2.82 -0.27 0.00 -0.03 0.00 0.00 54.58 51.48 2ys8 n ASN 25 Cb 0.50 -0.48 -0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2ys8 n ASN 25 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2ys8 s SER 26 N -1.78 6.27 0.00 6.41 0.01 0.66 -4.94 113.70 120.33 2ys8 s SER 26 Ca 0.38 0.92 0.02 0.00 1.31 0.00 0.00 55.95 58.58 2ys8 s SER 26 Cb 0.29 -2.24 -0.00 0.00 0.21 0.00 0.00 66.02 64.28 2ys8 s SER 26 CO 0.10 -0.57 0.35 0.29 0.41 0.00 0.00 173.24 173.82 2ys8 n LYS 27 N -2.22 2.59 -3.58 12.44 4.01 -1.26 -5.02 118.16 125.12 2ys8 n LYS 27 Ca 0.00 -0.34 -0.09 0.00 -0.51 0.00 0.00 58.31 57.38 2ys8 n LYS 27 Cb 0.55 -0.84 -0.02 0.00 -0.51 0.00 0.00 35.03 34.22 2ys8 n LYS 27 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2ys8 s ASP 28 N -0.66 -0.39 0.26 4.39 1.01 -1.26 -5.04 116.67 114.97 2ys8 s ASP 28 Ca 0.02 -0.18 -0.04 0.00 0.71 0.00 0.00 52.55 53.06 2ys8 s ASP 28 Cb 0.02 0.55 0.36 0.00 1.01 0.00 0.00 42.92 44.86 2ys8 s ASP 28 CO 0.06 -0.94 1.90 0.28 0.21 0.00 0.00 175.17 176.67 2ys8 h SER 29 N 2.00 1.08 -0.87 0.27 0.02 -1.97 -1.32 113.55 112.76 2ys8 h SER 29 Ca -0.26 -0.00 0.21 0.00 -0.84 0.00 0.00 61.79 60.89 2ys8 h SER 29 Cb 1.27 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 63.51 2ys8 h SER 29 CO 0.31 0.72 0.59 -0.50 -1.14 0.00 0.00 176.83 176.81 2ys8 h TRP 30 N 1.24 0.39 -0.04 3.45 -0.00 -1.96 -0.33 115.95 118.71 2ys8 h TRP 30 Ca 0.41 0.01 -0.13 0.00 -0.00 0.00 0.00 58.89 59.19 2ys8 h TRP 30 Cb 0.06 -0.12 0.01 0.00 -0.00 0.00 0.00 29.16 29.10 2ys8 h TRP 30 CO -0.00 0.10 -0.47 0.22 -0.00 0.00 0.00 178.44 178.30 2ys8 h ASP 31 N 0.30 0.49 0.39 -3.49 1.82 -1.50 0.53 116.42 114.96 2ys8 h ASP 31 Ca 0.44 -0.70 -0.02 0.00 -0.39 0.00 0.00 57.03 56.36 2ys8 h ASP 31 Cb 1.26 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 41.12 2ys8 h ASP 31 CO -0.13 1.12 -0.19 0.24 -1.61 0.00 0.00 179.24 178.67 2ys8 h MET 32 N -0.10 -0.51 -0.04 0.28 2.86 -0.92 -3.09 114.93 113.41 2ys8 h MET 32 Ca -0.05 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2ys8 h MET 32 Cb 1.15 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 2ys8 h MET 32 CO 0.09 -0.34 -0.15 -0.07 1.06 0.00 0.00 176.91 177.50 2ys8 h LEU 33 N -0.54 0.05 -0.58 1.22 3.38 -1.32 -3.47 115.31 114.06 2ys8 h LEU 33 Ca -0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2ys8 h LEU 33 Cb 0.41 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2ys8 h LEU 33 CO 0.09 0.21 0.00 0.61 0.09 0.00 0.00 178.44 179.44 2ys8 n GLY 34 N -1.03 0.80 3.49 0.83 0.00 0.08 -4.79 105.19 104.57 2ys8 n GLY 34 Ca -0.02 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.07 2ys8 n GLY 34 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ys8 s VAL 35 N -2.58 1.75 0.43 1.61 -7.23 -0.61 -5.01 120.40 108.77 2ys8 s VAL 35 Ca 0.00 -2.10 -0.15 0.00 -1.81 0.00 0.00 61.98 57.92 2ys8 s VAL 35 Cb 0.00 -2.64 -0.08 0.00 0.56 0.00 0.00 36.38 34.22 2ys8 s VAL 35 CO 0.00 -0.18 0.86 -1.59 -0.31 0.00 0.00 175.10 173.89 2ys8 s LYS 36 N -3.73 3.94 0.00 4.82 0.00 -1.26 -4.53 119.74 118.99 2ys8 s LYS 36 Ca 0.32 0.77 0.10 0.00 0.00 0.00 0.00 55.97 57.16 2ys8 s LYS 36 Cb 0.05 -2.28 0.60 0.00 0.00 0.00 0.00 37.83 36.20 2ys8 s LYS 36 CO 0.15 -0.08 1.04 -0.35 0.00 0.00 0.00 175.35 176.10 2ys8 n PRO 37 N -1.12 0.49 -0.45 1.78 -0.04 -1.26 -2.47 135.00 131.93 2ys8 n PRO 37 Ca 0.05 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.57 2ys8 n PRO 37 Cb 0.54 -1.32 0.19 0.00 -0.04 0.00 0.00 33.50 32.87 2ys8 n PRO 37 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ys8 n GLY 38 N -0.02 4.99 3.95 0.55 0.00 -1.26 -5.04 105.19 108.35 2ys8 n GLY 38 Ca 0.08 -1.24 -0.23 0.00 0.00 0.00 0.00 46.02 44.63 2ys8 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ys8 s ALA 39 N -3.11 3.65 0.43 4.61 0.00 -1.03 -5.11 121.76 121.19 2ys8 s ALA 39 Ca 0.37 -1.09 0.08 0.00 0.00 0.00 0.00 51.96 51.32 2ys8 s ALA 39 Cb 0.34 -2.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 2ys8 s ALA 39 CO -0.02 -0.73 0.43 -1.12 0.00 0.00 0.00 175.76 174.31 2ys8 s SER 40 N -4.36 5.13 0.27 0.00 0.01 -1.26 -4.90 113.70 108.59 2ys8 s SER 40 Ca 0.54 -0.72 -0.01 0.00 1.31 0.00 0.00 55.95 57.07 2ys8 s SER 40 Cb -0.10 -0.51 0.60 0.00 0.21 0.00 0.00 66.02 66.22 2ys8 s SER 40 CO 0.40 -0.72 1.65 -0.09 0.41 0.00 0.00 173.24 174.89 2ys8 h ARG 41 N 0.92 0.19 -0.98 12.44 2.43 -1.97 0.42 114.38 127.82 2ys8 h ARG 41 Ca -0.41 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.83 2ys8 h ARG 41 Cb 1.27 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.71 2ys8 h ARG 41 CO 0.55 0.12 0.63 0.22 -1.51 0.00 0.00 179.97 179.98 2ys8 h ASP 42 N 0.19 0.99 0.61 -3.80 3.58 -1.98 0.03 116.42 116.04 2ys8 h ASP 42 Ca 0.50 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.93 2ys8 h ASP 42 Cb 0.95 -0.19 0.01 0.00 1.72 0.00 0.00 39.33 41.82 2ys8 h ASP 42 CO -0.64 0.61 -0.29 -0.33 -2.88 0.00 0.00 179.24 175.71 2ys8 h GLU 43 N 1.12 -0.79 -0.91 0.28 4.39 -0.60 0.12 114.58 118.19 2ys8 h GLU 43 Ca 0.44 0.05 0.20 0.00 0.34 0.00 0.00 59.36 60.39 2ys8 h GLU 43 Cb 0.22 0.18 -0.11 0.00 -0.10 0.00 0.00 28.75 28.94 2ys8 h GLU 43 CO -0.19 -0.52 0.46 0.28 -1.16 0.00 0.00 179.01 177.88 2ys8 h VAL 44 N -1.14 0.59 -0.20 3.13 2.07 -1.11 0.24 116.25 119.83 2ys8 h VAL 44 Ca -0.08 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 2ys8 h VAL 44 Cb 0.62 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2ys8 h VAL 44 CO 0.14 0.10 -0.19 0.78 0.02 0.00 0.00 177.57 178.41 2ys8 h ASN 45 N 0.54 0.51 -0.52 0.57 2.35 -0.99 0.59 115.58 118.63 2ys8 h ASN 45 Ca 0.54 -0.48 0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2ys8 h ASN 45 Cb 0.94 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.14 2ys8 h ASN 45 CO -0.45 0.88 0.34 0.11 -1.65 0.00 0.00 177.43 176.66 2ys8 h LYS 46 N 0.15 0.68 -0.26 0.81 1.79 0.80 0.50 116.57 121.04 2ys8 h LYS 46 Ca 0.03 -0.04 -0.16 0.00 -2.18 0.00 0.00 60.65 58.30 2ys8 h LYS 46 Cb 0.74 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 2ys8 h LYS 46 CO 0.05 0.45 -0.46 0.00 -1.08 0.00 0.00 179.45 178.41 2ys8 h ALA 47 N 1.19 0.41 -0.53 3.86 0.00 -0.61 -2.89 119.26 120.69 2ys8 h ALA 47 Ca 0.19 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 2ys8 h ALA 47 Cb -0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2ys8 h ALA 47 CO -0.04 0.55 0.21 -0.92 0.00 0.00 0.00 179.25 179.05 2ys8 h TYR 48 N 0.52 0.77 0.12 0.00 5.03 -0.63 -2.53 116.97 120.26 2ys8 h TYR 48 Ca 0.02 -0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 2ys8 h TYR 48 Cb 1.06 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 39.10 2ys8 h TYR 48 CO 0.08 0.60 -0.06 0.00 -1.32 0.00 0.00 178.16 177.46 2ys8 h ARG 49 N 0.76 -0.16 -1.54 1.82 3.08 -0.85 0.16 114.38 117.65 2ys8 h ARG 49 Ca 0.18 0.01 0.45 0.00 0.07 0.00 0.00 59.98 60.70 2ys8 h ARG 49 Cb 0.16 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.17 2ys8 h ARG 49 CO -0.02 -0.11 1.08 1.57 -1.07 0.00 0.00 179.97 181.43 2ys8 h LYS 50 N -0.21 0.04 0.08 0.04 2.10 -1.55 0.95 116.57 118.02 2ys8 h LYS 50 Ca -0.02 -0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2ys8 h LYS 50 Cb 0.13 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 2ys8 h LYS 50 CO 0.03 0.02 -0.04 1.25 -2.00 0.00 0.00 179.45 178.71 2ys8 h LEU 51 N 0.04 -0.09 -0.85 7.07 5.85 -1.34 -3.18 115.31 122.81 2ys8 h LEU 51 Ca 0.77 -0.40 0.21 0.00 0.84 0.00 0.00 57.88 59.30 2ys8 h LEU 51 Cb 2.92 0.02 -0.15 0.00 0.37 0.00 0.00 40.66 43.82 2ys8 h LEU 51 CO -0.10 0.56 0.02 0.00 -0.34 0.00 0.00 178.44 178.59 2ys8 h ALA 52 N -0.49 0.95 -0.30 1.25 0.00 0.18 0.95 119.26 121.80 2ys8 h ALA 52 Ca -0.01 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2ys8 h ALA 52 Cb 0.48 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2ys8 h ALA 52 CO 0.02 -0.47 0.15 0.28 0.00 0.00 0.00 179.25 179.23 2ys8 h VAL 53 N 0.08 1.10 0.05 0.00 2.07 -1.47 0.95 116.25 119.04 2ys8 h VAL 53 Ca 0.49 -0.29 -0.24 0.00 0.82 0.00 0.00 66.70 67.48 2ys8 h VAL 53 Cb 0.92 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2ys8 h VAL 53 CO -0.76 0.12 -1.05 0.25 0.02 0.00 0.00 177.57 176.15 2ys8 h LEU 54 N 0.41 0.41 -2.35 2.57 5.85 0.79 -3.20 115.31 119.79 2ys8 h LEU 54 Ca 0.11 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2ys8 h LEU 54 Cb 0.04 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.94 2ys8 h LEU 54 CO -0.02 1.22 0.00 0.18 -0.34 0.00 0.00 178.44 179.49 2ys8 n LEU 55 N -3.63 3.45 -4.61 2.25 4.77 0.69 -4.60 117.00 115.31 2ys8 n LEU 55 Ca -0.06 -1.64 -0.43 0.00 -0.03 0.00 0.00 56.01 53.85 2ys8 n LEU 55 Cb 0.91 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 2ys8 n LEU 55 CO 0.51 0.82 0.60 1.57 -1.33 0.00 0.00 177.39 179.57 2ys8 n HIS 56 N 1.41 1.28 0.02 -1.77 -0.00 0.32 -4.56 115.22 111.93 2ys8 n HIS 56 Ca 0.21 0.61 -0.06 0.00 0.46 0.00 0.00 57.72 58.94 2ys8 n HIS 56 Cb 0.57 -2.25 0.12 0.00 -0.12 0.00 0.00 29.99 28.31 2ys8 n HIS 56 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2ys8 h PRO 57 N 1.78 0.47 -0.01 1.57 0.13 -1.86 0.91 132.00 135.00 2ys8 h PRO 57 Ca -0.43 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2ys8 h PRO 57 Cb 1.33 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2ys8 h PRO 57 CO 0.59 0.82 -0.05 -3.47 -0.23 0.00 0.00 178.00 175.65 2ys8 n ASP 58 N -4.01 0.82 -0.01 1.44 2.03 -1.26 -3.82 116.55 111.75 2ys8 n ASP 58 Ca -0.02 -1.08 -0.00 0.00 0.52 0.00 0.00 54.79 54.21 2ys8 n ASP 58 Cb 0.53 -0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.90 2ys8 n ASP 58 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2ys8 n LYS 59 N -0.48 2.82 -3.94 -0.67 4.76 -1.04 -4.95 118.16 114.66 2ys8 n LYS 59 Ca 0.18 -0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.31 2ys8 n LYS 59 Cb 0.28 -1.05 -0.15 0.00 -1.84 0.00 0.00 35.03 32.26 2ys8 n LYS 59 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ys8 n VAL 61 N 4.52 0.62 -1.62 0.00 0.24 -1.26 -4.49 118.33 116.34 2ys8 n VAL 61 Ca -0.04 -0.34 -0.35 0.00 -2.04 0.00 0.00 64.34 61.56 2ys8 n VAL 61 Cb 0.43 -0.30 0.07 0.00 -1.47 0.00 0.00 33.84 32.57 2ys8 n VAL 61 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ys8 s ALA 62 N -1.53 2.27 -0.70 2.33 0.00 -1.26 -4.90 121.76 117.97 2ys8 s ALA 62 Ca 0.14 0.97 0.20 0.00 0.00 0.00 0.00 51.96 53.27 2ys8 s ALA 62 Cb 0.10 -3.48 0.83 0.00 0.00 0.00 0.00 23.12 20.57 2ys8 s ALA 62 CO 0.05 -1.66 1.60 -0.35 0.00 0.00 0.00 175.76 175.41 2ys8 n PRO 63 N -2.31 0.11 -0.01 0.00 -0.04 -1.26 -3.19 135.00 128.30 2ys8 n PRO 63 Ca 0.14 0.35 -0.00 0.00 -0.04 0.00 0.00 63.50 63.95 2ys8 n PRO 63 Cb 0.50 -1.72 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 2ys8 n PRO 63 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ys8 n GLY 64 N -0.03 -0.21 0.35 0.55 0.00 -1.26 -4.70 105.19 99.90 2ys8 n GLY 64 Ca 0.03 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.09 2ys8 n GLY 64 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ys8 h SER 65 N 0.00 -0.57 0.28 1.61 4.64 -1.85 0.15 113.55 117.81 2ys8 h SER 65 Ca -0.07 0.28 -0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2ys8 h SER 65 Cb 0.84 0.51 -0.03 0.00 -0.31 0.00 0.00 62.40 63.41 2ys8 h SER 65 CO 0.00 -0.35 -0.48 -0.08 -0.87 0.00 0.00 176.83 175.06 2ys8 h GLU 66 N 0.01 -0.78 -0.80 4.77 4.81 -1.81 -1.12 114.58 119.67 2ys8 h GLU 66 Ca 0.58 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.96 2ys8 h GLU 66 Cb 1.13 0.18 -0.06 0.00 0.63 0.00 0.00 28.75 30.64 2ys8 h GLU 66 CO -0.94 -0.52 0.52 -0.44 -0.73 0.00 0.00 179.01 176.90 2ys8 h ASP 67 N -0.81 0.64 0.17 1.04 3.32 -1.21 -2.33 116.42 117.25 2ys8 h ASP 67 Ca -0.03 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.05 2ys8 h ASP 67 Cb 0.75 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 2ys8 h ASP 67 CO -0.16 0.38 -0.21 0.00 -1.72 0.00 0.00 179.24 177.53 2ys8 h ALA 68 N 1.60 -0.39 -0.48 3.45 0.00 0.00 -2.32 119.26 121.13 2ys8 h ALA 68 Ca 0.37 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.33 2ys8 h ALA 68 Cb 0.48 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 2ys8 h ALA 68 CO -0.14 -0.75 -0.06 0.35 0.00 0.00 0.00 179.25 178.65 2ys8 h PHE 69 N -0.42 -0.13 -0.21 0.00 3.57 -0.68 -1.44 116.94 117.62 2ys8 h PHE 69 Ca 0.01 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.61 2ys8 h PHE 69 Cb 0.41 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.22 2ys8 h PHE 69 CO -0.17 -0.16 -0.26 0.87 -2.23 0.00 0.00 178.31 176.36 2ys8 h LYS 70 N 0.06 -0.28 -0.27 1.11 6.56 -1.30 -2.11 116.57 120.34 2ys8 h LYS 70 Ca 0.24 0.02 0.06 0.00 -1.06 0.00 0.00 60.65 59.90 2ys8 h LYS 70 Cb 0.36 0.06 -0.06 0.00 -0.57 0.00 0.00 32.23 32.03 2ys8 h LYS 70 CO -0.44 -0.19 -0.10 0.00 -2.06 0.00 0.00 179.45 176.65 2ys8 h ALA 71 N 0.69 0.13 -0.72 3.86 0.00 -0.82 -2.43 119.26 119.97 2ys8 h ALA 71 Ca 0.13 0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.26 2ys8 h ALA 71 Cb 0.48 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.42 2ys8 h ALA 71 CO -0.38 -0.51 -0.37 0.28 0.00 0.00 0.00 179.25 178.28 2ys8 h VAL 72 N -0.06 0.11 0.22 0.00 2.07 -0.62 0.80 116.25 118.78 2ys8 h VAL 72 Ca 0.14 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.67 2ys8 h VAL 72 Cb 0.26 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 2ys8 h VAL 72 CO -0.31 0.00 -0.32 0.58 0.02 0.00 0.00 177.57 177.54 2ys8 h VAL 73 N -0.12 0.33 -0.80 2.57 2.07 -1.09 0.26 116.25 119.47 2ys8 h VAL 73 Ca 0.26 0.00 0.23 0.00 0.82 0.00 0.00 66.70 68.01 2ys8 h VAL 73 Cb 0.56 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2ys8 h VAL 73 CO -0.78 0.00 0.57 0.78 0.02 0.00 0.00 177.57 178.16 2ys8 h ASN 74 N -0.61 0.02 0.03 0.57 2.35 -0.78 -0.53 115.58 116.64 2ys8 h ASN 74 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2ys8 h ASN 74 Cb 0.59 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.96 2ys8 h ASN 74 CO -0.12 0.01 -0.01 0.00 -1.65 0.00 0.00 177.43 175.65 2ys8 h ALA 75 N 1.60 -0.04 0.01 -0.83 0.00 0.33 -3.12 119.26 117.22 2ys8 h ALA 75 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2ys8 h ALA 75 Cb 1.49 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2ys8 h ALA 75 CO -0.01 -0.04 -0.10 -0.09 0.00 0.00 0.00 179.25 179.01 2ys8 h ARG 76 N -0.87 -0.12 -0.88 0.00 2.43 -0.16 0.21 114.38 114.99 2ys8 h ARG 76 Ca -0.00 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.31 2ys8 h ARG 76 Cb 0.03 0.03 -0.14 0.00 -0.42 0.00 0.00 29.97 29.47 2ys8 h ARG 76 CO 0.01 -0.08 -0.40 1.15 -1.51 0.00 0.00 179.97 179.13 2ys8 h THR 77 N -0.13 0.04 0.26 0.20 2.02 -1.32 0.18 112.91 114.16 2ys8 h THR 77 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 2ys8 h THR 77 Cb 0.13 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 66.55 2ys8 h THR 77 CO -0.06 0.00 -0.42 0.00 0.37 0.00 0.00 175.52 175.41 2ys8 h ALA 78 N 1.14 -0.83 -0.84 6.16 0.00 -1.42 -1.36 119.26 122.10 2ys8 h ALA 78 Ca 0.29 -0.11 0.17 0.00 0.00 0.00 0.00 54.91 55.26 2ys8 h ALA 78 Cb 0.57 0.66 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 2ys8 h ALA 78 CO -0.89 -1.02 0.37 -0.07 0.00 0.00 0.00 179.25 177.64 2ys8 h LEU 79 N -0.75 0.36 0.13 0.00 3.38 0.95 -1.40 115.31 117.99 2ys8 h LEU 79 Ca -0.01 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2ys8 h LEU 79 Cb 0.72 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2ys8 h LEU 79 CO -0.16 0.09 -0.15 -0.07 0.09 0.00 0.00 178.44 178.24 2ys8 h LEU 80 N 0.48 -0.39 -0.96 1.67 3.38 -0.06 -1.43 115.31 118.00 2ys8 h LEU 80 Ca 0.49 0.04 0.28 0.00 0.09 0.00 0.00 57.88 58.77 2ys8 h LEU 80 Cb 0.81 0.14 -0.17 0.00 0.09 0.00 0.00 40.66 41.52 2ys8 h LEU 80 CO -0.45 -0.22 0.12 0.11 0.09 0.00 0.00 178.44 178.09 2ys8 h LYS 81 N -0.31 0.05 -0.12 1.13 6.56 -0.16 0.90 116.57 124.61 2ys8 h LYS 81 Ca 0.01 -0.00 -0.18 0.00 -1.06 0.00 0.00 60.65 59.42 2ys8 h LYS 81 Cb 0.31 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 31.95 2ys8 h LYS 81 CO -0.05 0.03 -0.66 -0.97 -2.06 0.00 0.00 179.45 175.74 2ys8 h ASN 82 N 0.05 0.54 -3.15 0.86 -0.73 -1.33 -3.42 115.58 108.40 2ys8 h ASN 82 Ca 0.61 -0.33 -0.57 0.00 1.87 0.00 0.00 56.30 57.88 2ys8 h ASN 82 Cb 1.29 -0.16 -0.05 0.00 0.27 0.00 0.00 38.32 39.68 2ys8 h ASN 82 CO -0.85 1.05 1.11 -0.63 -0.37 0.00 0.00 177.43 177.75 2ys8 s ILE 83 N -3.77 3.83 0.05 2.57 1.01 0.31 -4.97 121.20 120.23 2ys8 s ILE 83 Ca -0.06 0.85 -0.12 0.00 0.00 0.00 0.00 60.65 61.32 2ys8 s ILE 83 Cb 0.11 -4.09 0.01 0.00 0.01 0.00 0.00 42.46 38.50 2ys8 s ILE 83 CO 0.84 -0.67 0.26 -0.75 0.00 0.00 0.00 174.94 174.61 2ys8 s LYS 84 N 5.03 0.78 0.03 2.79 2.20 -1.26 -4.86 119.74 124.45 2ys8 s LYS 84 Ca 0.65 -0.60 0.01 0.00 -0.36 0.00 0.00 55.97 55.66 2ys8 s LYS 84 Cb -0.16 0.33 -0.02 0.00 -1.51 0.00 0.00 37.83 36.47 2ys8 s LYS 84 CO 0.32 -0.24 -0.05 0.45 -0.36 0.00 0.00 175.35 175.47 2ys8 s SER 85 N -2.18 0.46 0.00 1.43 0.15 -1.26 -5.13 113.70 107.18 2ys8 s SER 85 Ca -0.04 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.08 2ys8 s SER 85 Cb -0.00 0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 2ys8 s SER 85 CO -0.05 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2ys8 n GLY 86 N 1.51 -1.43 3.67 9.45 0.00 -1.26 -4.61 105.19 112.53 2ys8 n GLY 86 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 2ys8 n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ys8 s PRO 87 N 0.00 4.23 0.23 1.61 0.04 -1.26 -5.00 135.00 134.85 2ys8 s PRO 87 Ca 0.00 2.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 2ys8 s PRO 87 Cb 0.00 -3.77 -0.09 0.00 0.04 0.00 0.00 34.50 30.68 2ys8 s PRO 87 CO 0.00 -0.71 0.97 0.45 0.04 0.00 0.00 177.00 177.74 2ys8 s SER 88 N 2.49 7.58 0.16 6.66 0.15 -1.26 -4.95 113.70 124.53 2ys8 s SER 88 Ca 0.66 1.98 -0.19 0.00 0.70 0.00 0.00 55.95 59.09 2ys8 s SER 88 Cb -0.31 -2.61 0.08 0.00 -1.71 0.00 0.00 66.02 61.48 2ys8 s SER 88 CO 0.26 0.09 1.27 -1.20 1.20 0.00 0.00 173.24 174.86 2ys8 n SER 89 N 1.62 -0.69 0.00 5.45 7.64 -1.26 -5.24 113.62 121.14 2ys8 n SER 89 Ca -0.01 1.45 0.00 0.00 1.01 0.00 0.00 58.87 61.32 2ys8 n SER 89 Cb 0.47 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2ys8 n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64