#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 6.54 -1.18 1.61 0.15 -1.26 -2.24 113.70 117.32 2ys8 s SER 2 Ca 0.00 2.60 -0.06 0.00 0.70 0.00 0.00 55.95 59.18 2ys8 s SER 2 Cb 0.00 -2.57 0.01 0.00 -1.71 0.00 0.00 66.02 61.75 2ys8 s SER 2 CO 0.00 -0.92 1.02 -0.24 1.20 0.00 0.00 173.24 174.30 2ys8 n SER 3 N 5.47 -5.13 -4.88 5.45 2.88 -1.26 -4.99 113.62 111.16 2ys8 n SER 3 Ca 0.16 -0.49 -0.31 0.00 -1.33 0.00 0.00 58.87 56.90 2ys8 n SER 3 Cb 0.39 -4.54 -0.05 0.00 -0.75 0.00 0.00 64.21 59.27 2ys8 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ys8 s GLY 4 N -3.47 2.19 -0.35 0.46 0.00 -0.95 -5.04 107.32 100.15 2ys8 s GLY 4 Ca 0.42 -0.26 -0.24 0.00 0.00 0.00 0.00 44.72 44.63 2ys8 s GLY 4 CO 0.65 -0.12 0.82 -0.45 0.00 0.00 0.00 173.10 174.00 2ys8 s SER 5 N -2.55 6.61 0.00 1.64 0.15 -1.26 -5.02 113.70 113.26 2ys8 s SER 5 Ca 0.48 0.47 -0.08 0.00 0.70 0.00 0.00 55.95 57.53 2ys8 s SER 5 Cb -0.11 -2.42 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2ys8 s SER 5 CO 0.23 -0.74 0.15 -0.55 1.20 0.00 0.00 173.24 173.52 2ys8 s SER 6 N 1.81 0.02 0.48 5.45 0.15 -1.26 -5.03 113.70 115.32 2ys8 s SER 6 Ca 0.33 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.78 2ys8 s SER 6 Cb -0.13 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 2ys8 s SER 6 CO 0.16 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2ys8 n GLY 7 N 1.42 0.59 3.82 9.45 0.00 -1.26 -4.72 105.19 114.48 2ys8 n GLY 7 Ca -0.23 0.54 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 2ys8 n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ys8 s SER 8 N -4.00 3.52 0.00 1.61 1.04 -1.26 -5.01 113.70 109.60 2ys8 s SER 8 Ca 0.00 0.83 -0.28 0.00 0.48 0.00 0.00 55.95 56.98 2ys8 s SER 8 Cb 0.00 -1.30 -0.04 0.00 0.10 0.00 0.00 66.02 64.78 2ys8 s SER 8 CO 0.00 -2.53 0.88 -0.44 0.98 0.00 0.00 173.24 172.13 2ys8 s SER 9 N -4.23 7.27 -0.10 7.02 0.01 -1.26 -4.97 113.70 117.43 2ys8 s SER 9 Ca 0.65 1.53 -0.26 0.00 1.31 0.00 0.00 55.95 59.17 2ys8 s SER 9 Cb -0.12 -2.52 -0.27 0.00 0.21 0.00 0.00 66.02 63.32 2ys8 s SER 9 CO 0.52 -0.16 0.85 0.00 0.41 0.00 0.00 173.24 174.87 2ys8 h ALA 10 N 6.47 -0.02 -1.59 1.44 0.00 -1.95 -3.47 119.26 120.14 2ys8 h ALA 10 Ca -0.42 -0.54 -0.27 0.00 0.00 0.00 0.00 54.91 53.69 2ys8 h ALA 10 Cb 1.21 0.03 0.15 0.00 0.00 0.00 0.00 17.79 19.18 2ys8 h ALA 10 CO 0.74 0.10 -0.31 0.45 0.00 0.00 0.00 179.25 180.24 2ys8 n SER 11 N -4.48 -3.17 -4.90 0.00 2.88 -1.26 -4.49 113.62 98.21 2ys8 n SER 11 Ca -0.11 -0.46 -0.22 0.00 -1.33 0.00 0.00 58.87 56.76 2ys8 n SER 11 Cb 0.56 -0.84 -0.02 0.00 -0.75 0.00 0.00 64.21 63.17 2ys8 n SER 11 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2ys8 s PHE 12 N -2.10 2.41 0.58 0.66 -0.71 -1.26 -4.79 117.98 112.77 2ys8 s PHE 12 Ca 0.44 -0.57 0.06 0.00 -1.04 0.00 0.00 56.93 55.82 2ys8 s PHE 12 Cb -0.08 -2.14 0.08 0.00 -1.21 0.00 0.00 43.02 39.67 2ys8 s PHE 12 CO 0.41 -0.28 0.80 0.95 -1.34 0.00 0.00 175.22 175.76 2ys8 s THR 13 N -2.54 2.36 0.07 -4.49 -4.23 -1.26 -5.01 115.64 100.53 2ys8 s THR 13 Ca 0.47 -0.85 -0.31 0.00 -1.18 0.00 0.00 61.69 59.82 2ys8 s THR 13 Cb -0.03 -2.51 -0.18 0.00 1.34 0.00 0.00 72.50 71.11 2ys8 s THR 13 CO 0.28 0.00 1.59 0.07 -0.54 0.00 0.00 174.62 176.02 2ys8 h LYS 14 N 0.06 -0.78 -0.56 3.99 2.10 -2.00 -3.05 116.57 116.32 2ys8 h LYS 14 Ca -0.35 0.05 0.05 0.00 -2.00 0.00 0.00 60.65 58.41 2ys8 h LYS 14 Cb 1.28 0.18 -0.07 0.00 -0.90 0.00 0.00 32.23 32.72 2ys8 h LYS 14 CO 0.43 -0.51 -0.33 -1.91 -2.00 0.00 0.00 179.45 175.13 2ys8 n GLU 15 N -5.42 -0.25 -0.23 0.07 4.07 -1.26 -0.63 120.64 116.98 2ys8 n GLU 15 Ca -0.13 1.15 -0.12 0.00 -0.06 0.00 0.00 57.16 58.00 2ys8 n GLU 15 Cb 0.34 -1.70 -0.09 0.00 -0.06 0.00 0.00 31.44 29.92 2ys8 n GLU 15 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 2ys8 h GLN 16 N 0.00 -0.25 -0.67 5.31 4.20 -1.87 0.97 115.11 122.80 2ys8 h GLN 16 Ca 0.09 0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.96 2ys8 h GLN 16 Cb 0.23 0.06 -0.11 0.00 0.30 0.00 0.00 27.48 27.96 2ys8 h GLN 16 CO -0.53 -0.17 0.09 0.00 -0.67 0.00 0.00 178.83 177.55 2ys8 h ALA 17 N 0.20 0.77 0.00 3.87 0.00 -0.84 0.57 119.26 123.83 2ys8 h ALA 17 Ca 0.11 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2ys8 h ALA 17 Cb 0.54 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2ys8 h ALA 17 CO -0.72 -0.36 -0.03 -0.44 0.00 0.00 0.00 179.25 177.70 2ys8 h ASP 18 N 0.19 0.00 -0.03 0.00 3.32 0.14 -2.06 116.42 117.98 2ys8 h ASP 18 Ca 0.36 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.29 2ys8 h ASP 18 Cb 0.60 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.16 2ys8 h ASP 18 CO -0.51 0.03 -0.47 0.00 -1.72 0.00 0.00 179.24 176.57 2ys8 h ALA 19 N 1.97 0.10 0.24 3.45 0.00 0.20 -3.16 119.26 122.07 2ys8 h ALA 19 Ca -0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2ys8 h ALA 19 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ys8 h ALA 19 CO 0.00 0.28 -0.12 0.82 0.00 0.00 0.00 179.25 180.24 2ys8 h ILE 20 N -0.14 0.82 -1.13 0.00 5.03 -0.87 -2.13 117.51 119.10 2ys8 h ILE 20 Ca -0.05 -0.48 0.32 0.00 -0.12 0.00 0.00 64.86 64.52 2ys8 h ILE 20 Cb 1.16 1.10 -0.09 0.00 -3.03 0.00 0.00 36.82 35.95 2ys8 h ILE 20 CO 0.09 0.10 0.74 0.08 -0.68 0.00 0.00 178.15 178.49 2ys8 h ARG 21 N -0.58 0.26 -0.01 2.37 0.11 -1.52 0.54 114.38 115.56 2ys8 h ARG 21 Ca -0.03 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.02 2ys8 h ARG 21 Cb 0.42 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.44 2ys8 h ARG 21 CO 0.05 0.17 -0.02 0.00 0.10 0.00 0.00 179.97 180.27 2ys8 h ARG 22 N 0.26 0.03 -0.99 0.08 3.08 -1.47 -0.53 114.38 114.84 2ys8 h ARG 22 Ca 0.64 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.81 2ys8 h ARG 22 Cb 1.86 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.82 2ys8 h ARG 22 CO -0.27 0.68 0.61 0.82 -1.07 0.00 0.00 179.97 180.74 2ys8 h ILE 23 N -0.62 0.84 0.00 2.04 2.04 -0.27 1.85 117.51 123.38 2ys8 h ILE 23 Ca -0.00 -0.31 -0.19 0.00 1.00 0.00 0.00 64.86 65.36 2ys8 h ILE 23 Cb 0.68 -0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 2ys8 h ILE 23 CO 0.01 0.16 -0.92 0.08 0.00 0.00 0.00 178.15 177.48 2ys8 h ARG 24 N 0.90 0.00 -0.61 2.37 0.11 -1.22 -3.21 114.38 112.72 2ys8 h ARG 24 Ca 0.52 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.60 2ys8 h ARG 24 Cb 0.64 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.72 2ys8 h ARG 24 CO -0.31 0.92 0.00 0.09 0.10 0.00 0.00 179.97 180.77 2ys8 n ASN 25 N -3.34 4.73 -4.82 0.08 3.02 -0.15 -4.98 115.26 109.81 2ys8 n ASN 25 Ca 0.00 -2.50 -0.33 0.00 -0.03 0.00 0.00 54.58 51.72 2ys8 n ASN 25 Cb 0.90 -0.57 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 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 -0.97 6.78 0.00 6.41 0.01 0.61 -4.94 113.70 121.60 2ys8 s SER 26 Ca 0.50 1.72 0.16 0.00 1.31 0.00 0.00 55.95 59.64 2ys8 s SER 26 Cb 0.33 -2.54 -0.15 0.00 0.21 0.00 0.00 66.02 63.87 2ys8 s SER 26 CO 0.23 -0.47 0.70 0.29 0.41 0.00 0.00 173.24 174.40 2ys8 n LYS 27 N -0.81 1.74 -3.48 12.44 5.02 -1.26 -5.00 118.16 126.81 2ys8 n LYS 27 Ca 0.07 -0.11 -0.16 0.00 -2.02 0.00 0.00 58.31 56.10 2ys8 n LYS 27 Cb 0.54 -1.25 -0.05 0.00 -0.02 0.00 0.00 35.03 34.25 2ys8 n LYS 27 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2ys8 s ASP 28 N -2.43 -0.63 0.27 4.39 1.01 -1.26 -5.04 116.67 112.98 2ys8 s ASP 28 Ca 0.07 0.46 -0.01 0.00 0.71 0.00 0.00 52.55 53.79 2ys8 s ASP 28 Cb 0.12 0.56 0.57 0.00 1.01 0.00 0.00 42.92 45.18 2ys8 s ASP 28 CO 0.62 -0.74 1.73 -1.28 0.21 0.00 0.00 175.17 175.72 2ys8 h SER 29 N 2.64 0.39 -1.14 0.27 0.87 -1.94 0.15 113.55 114.80 2ys8 h SER 29 Ca -0.29 0.12 0.32 0.00 -1.23 0.00 0.00 61.79 60.70 2ys8 h SER 29 Cb 1.20 0.07 -0.08 0.00 -0.44 0.00 0.00 62.40 63.15 2ys8 h SER 29 CO 0.39 0.12 0.77 -0.50 -0.53 0.00 0.00 176.83 177.07 2ys8 h TRP 30 N 0.50 0.39 -0.13 2.24 -0.00 -1.94 0.24 115.95 117.27 2ys8 h TRP 30 Ca 0.48 0.01 -0.13 0.00 -0.00 0.00 0.00 58.89 59.25 2ys8 h TRP 30 Cb 0.76 -0.11 0.00 0.00 -0.00 0.00 0.00 29.16 29.82 2ys8 h TRP 30 CO -0.13 0.01 -0.41 0.22 -0.00 0.00 0.00 178.44 178.12 2ys8 h ASP 31 N 0.21 0.58 0.31 -3.49 1.82 -0.94 0.63 116.42 115.54 2ys8 h ASP 31 Ca 0.61 -0.61 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 2ys8 h ASP 31 Cb 1.93 -0.17 -0.00 0.00 0.68 0.00 0.00 39.33 41.77 2ys8 h ASP 31 CO -0.20 1.09 -0.19 0.24 -1.61 0.00 0.00 179.24 178.57 2ys8 h MET 32 N 0.11 -0.45 -0.33 0.28 2.86 -0.45 -3.02 114.93 113.92 2ys8 h MET 32 Ca -0.02 0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 2ys8 h MET 32 Cb 1.04 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.79 2ys8 h MET 32 CO 0.09 -0.30 0.12 -0.07 1.06 0.00 0.00 176.91 177.80 2ys8 h LEU 33 N -0.47 0.42 -0.39 1.22 3.38 -1.48 -3.47 115.31 114.52 2ys8 h LEU 33 Ca -0.04 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2ys8 h LEU 33 Cb 0.37 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2ys8 h LEU 33 CO 0.04 0.40 0.00 0.61 0.09 0.00 0.00 178.44 179.59 2ys8 n GLY 34 N -1.20 1.01 3.63 0.83 0.00 0.05 -4.66 105.19 104.85 2ys8 n GLY 34 Ca 0.02 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.39 1.19 0.11 1.61 -7.23 -0.26 -5.01 120.40 108.43 2ys8 s VAL 35 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 2ys8 s VAL 35 Cb 0.00 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 2ys8 s VAL 35 CO 0.00 0.00 0.27 -1.59 -0.31 0.00 0.00 175.10 173.47 2ys8 s LYS 36 N -3.80 3.47 -0.21 4.82 0.00 -1.26 -4.56 119.74 118.18 2ys8 s LYS 36 Ca 0.21 -0.44 -0.29 0.00 0.00 0.00 0.00 55.97 55.44 2ys8 s LYS 36 Cb 0.05 -2.97 -0.03 0.00 0.00 0.00 0.00 37.83 34.87 2ys8 s LYS 36 CO 0.11 0.54 1.61 -1.25 0.00 0.00 0.00 175.35 176.36 2ys8 s PRO 37 N -2.84 3.82 0.00 1.78 0.04 -1.26 -3.12 135.00 133.42 2ys8 s PRO 37 Ca 0.36 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.07 2ys8 s PRO 37 Cb -0.12 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.39 2ys8 s PRO 37 CO 0.28 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.46 2ys8 n GLY 38 N 4.62 1.19 3.34 0.56 0.00 -1.26 -5.13 105.19 108.51 2ys8 n GLY 38 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2ys8 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ys8 n ALA 39 N 0.00 -3.62 -2.27 4.61 0.00 -1.18 -5.04 120.51 113.01 2ys8 n ALA 39 Ca 0.00 -1.38 -0.23 0.00 0.00 0.00 0.00 53.44 51.83 2ys8 n ALA 39 Cb 0.00 -1.73 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 2ys8 n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ys8 s SER 40 N -2.35 4.89 0.25 0.00 0.01 -1.26 -4.93 113.70 110.32 2ys8 s SER 40 Ca 0.64 -0.92 -0.05 0.00 1.31 0.00 0.00 55.95 56.93 2ys8 s SER 40 Cb -0.19 -0.20 0.50 0.00 0.21 0.00 0.00 66.02 66.33 2ys8 s SER 40 CO 0.62 -0.84 1.65 -0.09 0.41 0.00 0.00 173.24 175.00 2ys8 h ARG 41 N 0.90 0.16 0.07 12.44 2.43 -1.90 -0.46 114.38 128.03 2ys8 h ARG 41 Ca -0.39 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.79 2ys8 h ARG 41 Cb 1.28 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.76 2ys8 h ARG 41 CO 0.57 0.11 -0.20 -0.44 -1.51 0.00 0.00 179.97 178.50 2ys8 h ASP 42 N 0.17 -0.56 0.18 -3.80 3.32 -1.98 -0.91 116.42 112.85 2ys8 h ASP 42 Ca 0.44 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.57 2ys8 h ASP 42 Cb 0.80 0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.52 2ys8 h ASP 42 CO -0.62 -0.27 -0.47 -0.33 -1.72 0.00 0.00 179.24 175.83 2ys8 h GLU 43 N -0.35 -0.72 -1.00 3.56 5.08 -1.51 0.28 114.58 119.92 2ys8 h GLU 43 Ca 0.04 0.05 0.21 0.00 -1.00 0.00 0.00 59.36 58.65 2ys8 h GLU 43 Cb 0.39 0.16 -0.10 0.00 0.50 0.00 0.00 28.75 29.70 2ys8 h GLU 43 CO -0.13 -0.48 0.61 0.28 -1.00 0.00 0.00 179.01 178.29 2ys8 h VAL 44 N -0.75 0.66 -0.24 3.13 2.07 -1.15 0.11 116.25 120.09 2ys8 h VAL 44 Ca -0.00 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 2ys8 h VAL 44 Cb 0.74 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2ys8 h VAL 44 CO -0.23 0.12 -0.19 0.78 0.02 0.00 0.00 177.57 178.07 2ys8 h ASN 45 N 0.67 0.58 -0.67 0.57 2.35 -0.12 0.94 115.58 119.90 2ys8 h ASN 45 Ca 0.58 -0.45 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 2ys8 h ASN 45 Cb 1.04 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.21 2ys8 h ASN 45 CO -0.37 0.91 0.35 0.11 -1.65 0.00 0.00 177.43 176.78 2ys8 h LYS 46 N 0.26 0.94 -0.16 0.81 6.56 0.13 -0.77 116.57 124.33 2ys8 h LYS 46 Ca 0.04 -0.12 -0.20 0.00 -1.06 0.00 0.00 60.65 59.32 2ys8 h LYS 46 Cb 0.72 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 32.20 2ys8 h LYS 46 CO 0.05 0.72 -0.70 0.00 -2.06 0.00 0.00 179.45 177.45 2ys8 h ALA 47 N 1.17 0.45 -0.59 3.86 0.00 -0.84 -2.99 119.26 120.32 2ys8 h ALA 47 Ca 0.23 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 2ys8 h ALA 47 Cb 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2ys8 h ALA 47 CO -0.04 0.70 0.18 -0.92 0.00 0.00 0.00 179.25 179.18 2ys8 h TYR 48 N 0.49 0.92 0.41 0.00 5.03 -0.55 -2.75 116.97 120.52 2ys8 h TYR 48 Ca -0.03 -0.08 -0.02 0.00 2.58 0.00 0.00 58.73 61.18 2ys8 h TYR 48 Cb 1.31 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 39.32 2ys8 h TYR 48 CO 0.07 0.75 -0.20 0.00 -1.32 0.00 0.00 178.16 177.46 2ys8 h ARG 49 N 0.87 -0.53 -1.46 1.82 3.08 -1.13 0.19 114.38 117.22 2ys8 h ARG 49 Ca 0.20 0.04 0.44 0.00 0.07 0.00 0.00 59.98 60.72 2ys8 h ARG 49 Cb 0.26 0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.34 2ys8 h ARG 49 CO -0.01 -0.35 1.00 1.57 -1.07 0.00 0.00 179.97 181.11 2ys8 h LYS 50 N -0.66 0.07 0.06 0.04 2.10 -1.55 -0.22 116.57 116.41 2ys8 h LYS 50 Ca -0.06 -0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2ys8 h LYS 50 Cb 0.42 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 2ys8 h LYS 50 CO 0.09 0.05 -0.03 1.25 -2.00 0.00 0.00 179.45 178.81 2ys8 h LEU 51 N 0.07 -0.07 -0.99 7.07 5.85 -1.33 -3.26 115.31 122.64 2ys8 h LEU 51 Ca 0.78 -0.19 0.36 0.00 0.84 0.00 0.00 57.88 59.66 2ys8 h LEU 51 Cb 2.76 0.02 -0.17 0.00 0.37 0.00 0.00 40.66 43.63 2ys8 h LEU 51 CO -0.19 0.51 0.39 0.00 -0.34 0.00 0.00 178.44 178.81 2ys8 h ALA 52 N -0.80 1.83 -0.94 1.25 0.00 0.11 1.18 119.26 121.89 2ys8 h ALA 52 Ca -0.01 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2ys8 h ALA 52 Cb 0.25 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2ys8 h ALA 52 CO 0.01 -0.77 0.55 0.28 0.00 0.00 0.00 179.25 179.31 2ys8 h VAL 53 N 0.06 1.26 -0.19 0.00 2.07 -1.42 1.81 116.25 119.85 2ys8 h VAL 53 Ca 0.75 -0.60 -0.20 0.00 0.82 0.00 0.00 66.70 67.47 2ys8 h VAL 53 Cb 1.84 -0.04 0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2ys8 h VAL 53 CO -0.78 0.28 -0.67 0.25 0.02 0.00 0.00 177.57 176.67 2ys8 h LEU 54 N 1.30 0.91 -1.31 2.57 5.85 0.13 -3.09 115.31 121.68 2ys8 h LEU 54 Ca 0.33 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2ys8 h LEU 54 Cb -0.03 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.74 2ys8 h LEU 54 CO -0.06 1.36 0.00 0.18 -0.34 0.00 0.00 178.44 179.58 2ys8 n LEU 55 N -4.00 1.98 -4.61 2.25 4.77 0.10 -4.51 117.00 112.97 2ys8 n LEU 55 Ca -0.07 -0.79 -0.43 0.00 -0.03 0.00 0.00 56.01 54.69 2ys8 n LEU 55 Cb 0.69 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2ys8 n LEU 55 CO 0.51 0.40 0.62 1.57 -1.33 0.00 0.00 177.39 179.16 2ys8 n HIS 56 N 0.53 1.38 0.17 -1.77 -0.00 0.61 -4.57 115.22 111.58 2ys8 n HIS 56 Ca 0.17 0.62 0.02 0.00 0.46 0.00 0.00 57.72 58.99 2ys8 n HIS 56 Cb 0.39 -2.27 0.31 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 1.89 0.00 -0.00 1.57 0.13 -1.85 0.89 132.00 134.63 2ys8 h PRO 57 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2ys8 h PRO 57 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2ys8 h PRO 57 CO 0.59 0.44 -0.17 -3.47 -0.23 0.00 0.00 178.00 175.16 2ys8 n ASP 58 N -3.88 0.46 -0.01 1.44 2.03 -1.26 -3.85 116.55 111.48 2ys8 n ASP 58 Ca -0.01 -0.39 -0.00 0.00 0.52 0.00 0.00 54.79 54.90 2ys8 n ASP 58 Cb 0.48 -0.06 -0.02 0.00 -0.72 0.00 0.00 41.12 40.80 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 -1.09 2.02 -3.92 -0.67 5.02 -0.98 -4.94 118.16 113.60 2ys8 n LYS 59 Ca 0.12 -0.01 -0.31 0.00 -2.02 0.00 0.00 58.31 56.09 2ys8 n LYS 59 Cb 0.30 -1.05 -0.15 0.00 -0.02 0.00 0.00 35.03 34.11 2ys8 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ys8 n VAL 61 N 4.52 0.10 -1.51 0.00 0.24 -1.26 -4.44 118.33 115.97 2ys8 n VAL 61 Ca -0.01 -0.11 -0.35 0.00 -2.04 0.00 0.00 64.34 61.82 2ys8 n VAL 61 Cb 0.42 0.00 0.09 0.00 -1.47 0.00 0.00 33.84 32.88 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 -1.90 2.18 0.22 2.33 0.00 -1.26 -4.91 121.76 118.41 2ys8 s ALA 62 Ca 0.14 1.02 0.24 0.00 0.00 0.00 0.00 51.96 53.36 2ys8 s ALA 62 Cb 0.07 -3.51 1.01 0.00 0.00 0.00 0.00 23.12 20.69 2ys8 s ALA 62 CO 0.10 -1.83 1.87 -1.00 0.00 0.00 0.00 175.76 174.91 2ys8 h PRO 63 N -0.03 0.00 0.00 0.00 0.13 -2.04 -3.16 132.00 126.90 2ys8 h PRO 63 Ca -0.49 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.31 2ys8 h PRO 63 Cb 1.31 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.39 2ys8 h PRO 63 CO 0.50 0.23 -2.01 0.41 -0.23 0.00 0.00 178.00 176.90 2ys8 n GLY 64 N -0.07 -0.98 0.33 1.56 0.00 -1.26 -4.36 105.19 100.42 2ys8 n GLY 64 Ca -0.00 -0.17 0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.62 0.34 1.61 4.64 -1.86 0.13 113.55 117.80 2ys8 h SER 65 Ca -0.40 0.27 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 2ys8 h SER 65 Cb 2.11 0.51 -0.03 0.00 -0.31 0.00 0.00 62.40 64.68 2ys8 h SER 65 CO 0.06 -0.31 -0.45 -0.08 -0.87 0.00 0.00 176.83 175.17 2ys8 h GLU 66 N 0.02 -0.78 -0.96 4.77 4.81 -1.76 -1.62 114.58 119.05 2ys8 h GLU 66 Ca 0.52 0.05 0.15 0.00 -0.13 0.00 0.00 59.36 59.95 2ys8 h GLU 66 Cb 0.95 0.18 -0.08 0.00 0.63 0.00 0.00 28.75 30.42 2ys8 h GLU 66 CO -0.91 -0.52 0.61 -0.44 -0.73 0.00 0.00 179.01 177.01 2ys8 h ASP 67 N -0.81 0.76 0.47 1.04 3.32 -1.29 -2.47 116.42 117.43 2ys8 h ASP 67 Ca -0.04 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2ys8 h ASP 67 Cb 0.73 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.17 2ys8 h ASP 67 CO -0.12 0.36 -0.46 0.00 -1.72 0.00 0.00 179.24 177.30 2ys8 h ALA 68 N 1.59 -1.13 -0.45 3.45 0.00 -0.14 -2.08 119.26 120.50 2ys8 h ALA 68 Ca 0.50 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.32 2ys8 h ALA 68 Cb 0.72 0.69 -0.10 0.00 0.00 0.00 0.00 17.79 19.10 2ys8 h ALA 68 CO -0.26 -1.15 -0.22 0.35 0.00 0.00 0.00 179.25 177.97 2ys8 h PHE 69 N -0.93 -0.56 -0.70 0.00 3.04 -0.89 -0.66 116.94 116.25 2ys8 h PHE 69 Ca -0.06 0.05 0.15 0.00 3.98 0.00 0.00 57.97 62.09 2ys8 h PHE 69 Cb 0.80 0.31 -0.13 0.00 2.56 0.00 0.00 35.95 39.50 2ys8 h PHE 69 CO -0.23 -0.30 -0.06 0.87 -2.02 0.00 0.00 178.31 176.57 2ys8 h LYS 70 N -0.12 0.06 0.21 1.11 1.57 -1.26 -1.08 116.57 117.06 2ys8 h LYS 70 Ca 0.21 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 2ys8 h LYS 70 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2ys8 h LYS 70 CO -0.53 0.04 -0.10 0.00 -0.57 0.00 0.00 179.45 178.29 2ys8 h ALA 71 N 1.67 -0.28 -1.00 3.86 0.00 -0.45 -2.66 119.26 120.41 2ys8 h ALA 71 Ca 0.36 -0.07 0.37 0.00 0.00 0.00 0.00 54.91 55.57 2ys8 h ALA 71 Cb 0.60 0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.33 2ys8 h ALA 71 CO -0.65 -0.64 0.51 0.28 0.00 0.00 0.00 179.25 178.75 2ys8 h VAL 72 N -0.31 0.11 0.32 0.00 2.07 -0.17 0.20 116.25 118.47 2ys8 h VAL 72 Ca -0.03 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2ys8 h VAL 72 Cb 0.24 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 2ys8 h VAL 72 CO 0.05 0.02 -0.15 0.58 0.02 0.00 0.00 177.57 178.09 2ys8 h VAL 73 N 0.11 0.69 -0.64 2.57 2.07 -1.11 0.46 116.25 120.40 2ys8 h VAL 73 Ca 0.79 -0.52 0.17 0.00 0.82 0.00 0.00 66.70 67.96 2ys8 h VAL 73 Cb 1.97 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 2ys8 h VAL 73 CO -0.72 0.10 0.45 -0.55 0.02 0.00 0.00 177.57 176.87 2ys8 h ASN 74 N -0.72 0.12 0.16 0.57 7.08 -0.51 0.23 115.58 122.51 2ys8 h ASN 74 Ca -0.04 0.01 -0.29 0.00 -3.08 0.00 0.00 56.30 52.89 2ys8 h ASN 74 Cb 0.49 -0.02 0.01 0.00 -2.08 0.00 0.00 38.32 36.73 2ys8 h ASN 74 CO 0.07 0.06 -1.43 0.00 -2.08 0.00 0.00 177.43 174.05 2ys8 h ALA 75 N 1.69 0.07 0.23 4.14 0.00 -0.89 -3.24 119.26 121.26 2ys8 h ALA 75 Ca 0.31 -1.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 2ys8 h ALA 75 Cb 1.05 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2ys8 h ALA 75 CO -0.04 0.79 -0.11 -0.09 0.00 0.00 0.00 179.25 179.80 2ys8 h ARG 76 N -0.12 -0.30 -0.92 0.00 2.43 0.98 -2.75 114.38 113.69 2ys8 h ARG 76 Ca -0.28 0.02 0.24 0.00 -0.81 0.00 0.00 59.98 59.15 2ys8 h ARG 76 Cb 1.91 0.07 -0.17 0.00 -0.42 0.00 0.00 29.97 31.36 2ys8 h ARG 76 CO 0.14 -0.20 0.04 1.15 -1.51 0.00 0.00 179.97 179.59 2ys8 h THR 77 N -0.44 0.14 0.33 0.20 2.02 -0.80 -0.13 112.91 114.23 2ys8 h THR 77 Ca -0.03 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 2ys8 h THR 77 Cb 0.24 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 2ys8 h THR 77 CO 0.05 0.01 -0.52 0.00 0.37 0.00 0.00 175.52 175.43 2ys8 h ALA 78 N 1.89 -1.09 -0.38 6.16 0.00 -1.60 -1.31 119.26 122.93 2ys8 h ALA 78 Ca 0.54 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.38 2ys8 h ALA 78 Cb 1.07 0.82 -0.08 0.00 0.00 0.00 0.00 17.79 19.60 2ys8 h ALA 78 CO -0.83 -1.16 -0.15 -0.07 0.00 0.00 0.00 179.25 177.04 2ys8 h LEU 79 N -0.90 -0.51 -0.63 0.00 3.38 -0.76 -1.47 115.31 114.42 2ys8 h LEU 79 Ca -0.04 0.13 0.13 0.00 0.09 0.00 0.00 57.88 58.20 2ys8 h LEU 79 Cb 0.83 0.30 -0.11 0.00 0.09 0.00 0.00 40.66 41.77 2ys8 h LEU 79 CO -0.17 -0.18 0.02 -0.07 0.09 0.00 0.00 178.44 178.13 2ys8 h LEU 80 N -0.07 -0.25 -0.94 1.67 3.38 -0.90 0.98 115.31 119.17 2ys8 h LEU 80 Ca 0.19 0.15 0.24 0.00 0.09 0.00 0.00 57.88 58.55 2ys8 h LEU 80 Cb 0.36 0.27 -0.13 0.00 0.09 0.00 0.00 40.66 41.25 2ys8 h LEU 80 CO -0.43 -0.11 0.47 0.11 0.09 0.00 0.00 178.44 178.57 2ys8 h LYS 81 N 0.13 0.43 -0.08 1.13 1.57 -0.13 0.28 116.57 119.89 2ys8 h LYS 81 Ca 0.33 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.90 2ys8 h LYS 81 Cb 0.55 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 2ys8 h LYS 81 CO -0.53 0.28 -0.74 -0.97 -0.57 0.00 0.00 179.45 176.92 2ys8 h ASN 82 N 0.44 0.53 -3.10 0.86 -0.00 -0.75 -3.44 115.58 110.12 2ys8 h ASN 82 Ca 0.61 -0.35 -0.54 0.00 -0.00 0.00 0.00 56.30 56.01 2ys8 h ASN 82 Cb 1.19 -0.16 -0.01 0.00 -0.00 0.00 0.00 38.32 39.34 2ys8 h ASN 82 CO -0.53 1.10 0.66 -0.63 -0.00 0.00 0.00 177.43 178.04 2ys8 s ILE 83 N -3.62 4.13 0.14 2.57 1.01 0.99 -4.99 121.20 121.43 2ys8 s ILE 83 Ca -0.06 1.49 -0.30 0.00 0.00 0.00 0.00 60.65 61.77 2ys8 s ILE 83 Cb 0.10 -3.96 -0.07 0.00 0.01 0.00 0.00 42.46 38.54 2ys8 s ILE 83 CO 0.85 0.04 1.20 -0.54 0.00 0.00 0.00 174.94 176.48 2ys8 s LYS 84 N 1.84 4.48 -0.21 2.79 1.02 -1.26 -4.88 119.74 123.52 2ys8 s LYS 84 Ca 0.58 1.83 -0.04 0.00 0.02 0.00 0.00 55.97 58.36 2ys8 s LYS 84 Cb -0.27 -3.28 0.09 0.00 -0.52 0.00 0.00 37.83 33.86 2ys8 s LYS 84 CO 0.25 -0.14 0.21 0.45 -0.92 0.00 0.00 175.35 175.20 2ys8 s SER 85 N 0.44 1.49 0.00 2.83 0.15 -1.26 -4.82 113.70 112.53 2ys8 s SER 85 Ca 0.55 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.91 2ys8 s SER 85 Cb -0.31 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2ys8 s SER 85 CO 0.34 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.05 2ys8 n GLY 86 N 5.31 0.78 3.64 9.45 0.00 -1.26 -5.08 105.19 118.03 2ys8 n GLY 86 Ca -0.05 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.35 -0.10 1.61 0.04 -1.26 -5.06 135.00 129.88 2ys8 s PRO 87 Ca 0.00 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.29 2ys8 s PRO 87 Cb 0.00 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.85 2ys8 s PRO 87 CO 0.00 -3.20 -0.09 -1.54 0.04 0.00 0.00 177.00 172.22 2ys8 s SER 88 N -3.63 4.46 -1.10 6.66 1.04 -1.26 -4.58 113.70 115.29 2ys8 s SER 88 Ca 0.68 -0.13 -0.06 0.00 0.48 0.00 0.00 55.95 56.92 2ys8 s SER 88 Cb -0.15 -1.34 0.01 0.00 0.10 0.00 0.00 66.02 64.63 2ys8 s SER 88 CO 0.57 0.28 0.95 -0.24 0.98 0.00 0.00 173.24 175.78 2ys8 n SER 89 N 2.78 -4.87 0.00 7.02 2.88 -1.26 -5.25 113.62 114.93 2ys8 n SER 89 Ca -0.18 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 56.90 2ys8 n SER 89 Cb 0.53 -4.28 0.00 0.00 -0.75 0.00 0.00 64.21 59.71 2ys8 n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42