#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvo n SER 2 N 0.00 0.00 -4.81 1.61 2.88 -1.26 -4.72 113.62 107.32 1wvo n SER 2 Ca 0.00 0.94 -0.30 0.00 -1.33 0.00 0.00 58.87 58.18 1wvo n SER 2 Cb 0.00 -0.44 0.08 0.00 -0.75 0.00 0.00 64.21 63.10 1wvo n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wvo s SER 3 N -2.30 4.65 0.00 -3.46 0.15 -1.26 -4.94 113.70 106.54 1wvo s SER 3 Ca 0.00 1.36 0.00 0.00 0.70 0.00 0.00 55.95 58.01 1wvo s SER 3 Cb 0.00 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 1wvo s SER 3 CO 0.00 -1.88 0.00 0.61 1.20 0.00 0.00 173.24 173.17 1wvo n GLY 4 N -2.07 2.12 3.64 9.45 0.00 -1.26 -5.07 105.19 112.00 1wvo n GLY 4 Ca 0.07 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.26 1wvo n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wvo s SER 5 N 0.00 2.64 0.99 1.61 0.01 -1.26 -5.04 113.70 112.66 1wvo s SER 5 Ca 0.00 1.84 -0.10 0.00 1.31 0.00 0.00 55.95 59.00 1wvo s SER 5 Cb 0.00 -2.42 0.13 0.00 0.21 0.00 0.00 66.02 63.94 1wvo s SER 5 CO 0.00 -3.22 0.77 -0.24 0.41 0.00 0.00 173.24 170.97 1wvo n SER 6 N -4.29 0.07 -1.49 2.44 2.88 -1.26 -4.80 113.62 107.16 1wvo n SER 6 Ca 0.08 -1.28 -0.03 0.00 -1.33 0.00 0.00 58.87 56.31 1wvo n SER 6 Cb 0.53 -0.59 -0.00 0.00 -0.75 0.00 0.00 64.21 63.40 1wvo n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wvo n GLY 7 N -0.06 2.35 3.25 0.46 0.00 -1.26 -1.87 105.19 108.05 1wvo n GLY 7 Ca 0.10 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.75 1wvo n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wvo s SER 8 N -1.55 0.16 0.08 1.61 0.15 -1.02 -4.02 113.70 109.12 1wvo s SER 8 Ca 0.06 -1.01 -0.29 0.00 0.70 0.00 0.00 55.95 55.42 1wvo s SER 8 Cb -0.01 0.37 -0.05 0.00 -1.71 0.00 0.00 66.02 64.62 1wvo s SER 8 CO 0.04 -0.81 0.91 -0.69 1.20 0.00 0.00 173.24 173.89 1wvo s VAL 9 N -4.00 4.61 0.12 4.45 1.01 -0.87 -1.21 120.40 124.52 1wvo s VAL 9 Ca 0.19 1.94 0.03 0.00 0.00 0.00 0.00 61.98 64.15 1wvo s VAL 9 Cb 0.05 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 1wvo s VAL 9 CO 0.00 0.31 -0.09 0.68 0.00 0.00 0.00 175.10 176.01 1wvo s VAL 10 N 0.10 0.98 -0.11 2.92 -7.23 -0.27 -1.61 120.40 115.17 1wvo s VAL 10 Ca 0.45 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.36 1wvo s VAL 10 Cb -0.22 -1.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.96 1wvo s VAL 10 CO 0.28 -0.77 1.42 0.00 -0.31 0.00 0.00 175.10 175.72 1wvo s ALA 11 N -3.31 3.64 0.33 1.32 0.00 0.36 -1.71 121.76 122.38 1wvo s ALA 11 Ca 0.14 0.67 0.13 0.00 0.00 0.00 0.00 51.96 52.89 1wvo s ALA 11 Cb 0.03 -3.67 0.65 0.00 0.00 0.00 0.00 23.12 20.13 1wvo s ALA 11 CO -0.01 -1.24 1.77 -0.22 0.00 0.00 0.00 175.76 176.05 1wvo h LYS 12 N 8.70 0.00 -3.61 0.00 3.64 -1.17 -0.55 116.57 123.58 1wvo h LYS 12 Ca -0.32 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.99 1wvo h LYS 12 Cb 1.14 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.84 1wvo h LYS 12 CO 0.96 0.43 -0.18 0.14 -2.27 0.00 0.00 179.45 178.53 1wvo s VAL 13 N -3.99 0.07 0.38 2.00 -7.23 -1.26 -4.59 120.40 105.77 1wvo s VAL 13 Ca -0.02 -1.01 -0.27 0.00 -1.81 0.00 0.00 61.98 58.87 1wvo s VAL 13 Cb 0.14 -1.54 -0.11 0.00 0.56 0.00 0.00 36.38 35.42 1wvo s VAL 13 CO 0.73 -0.31 1.28 1.17 -0.31 0.00 0.00 175.10 177.66 1wvo n LYS 14 N -0.23 2.06 -3.82 4.82 4.81 -1.26 -4.50 118.16 120.05 1wvo n LYS 14 Ca -0.11 0.73 -0.30 0.00 -0.87 0.00 0.00 58.31 57.76 1wvo n LYS 14 Cb 0.63 -2.36 -0.16 0.00 0.02 0.00 0.00 35.03 33.17 1wvo n LYS 14 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1wvo s ILE 15 N -1.14 1.11 0.49 3.15 1.01 -0.45 -4.90 121.20 120.47 1wvo s ILE 15 Ca 0.58 -1.23 -0.23 0.00 0.00 0.00 0.00 60.65 59.77 1wvo s ILE 15 Cb -0.54 -1.64 -0.06 0.00 0.01 0.00 0.00 42.46 40.22 1wvo s ILE 15 CO 0.61 -0.39 1.25 -2.16 0.00 0.00 0.00 174.94 174.25 1wvo s PRO 16 N 1.55 3.53 0.40 2.79 0.04 -1.26 -0.49 135.00 141.56 1wvo s PRO 16 Ca 0.03 1.99 -0.26 0.00 0.04 0.00 0.00 61.00 62.80 1wvo s PRO 16 Cb -0.18 -2.38 -0.10 0.00 0.04 0.00 0.00 34.50 31.88 1wvo s PRO 16 CO -0.14 -0.80 1.28 -1.91 0.04 0.00 0.00 177.00 175.48 1wvo n GLU 17 N -0.65 2.00 -0.45 4.56 2.13 -1.25 -2.75 120.64 124.22 1wvo n GLU 17 Ca 0.08 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.61 1wvo n GLU 17 Cb 0.46 -2.39 0.00 0.00 0.27 0.00 0.00 31.44 29.79 1wvo n GLU 17 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wvo n GLY 18 N 0.79 0.74 3.91 8.31 0.00 -0.94 -4.94 105.19 113.05 1wvo n GLY 18 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1wvo n GLY 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wvo s THR 19 N -2.66 5.25 0.05 2.61 2.01 -1.11 -4.87 115.64 116.91 1wvo s THR 19 Ca 0.00 -0.22 -0.15 0.00 0.31 0.00 0.00 61.69 61.63 1wvo s THR 19 Cb 0.00 -3.66 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 1wvo s THR 19 CO 0.00 0.01 0.47 -0.63 -0.69 0.00 0.00 174.62 173.78 1wvo s ILE 20 N -1.67 4.94 0.49 1.82 -1.09 -1.26 -1.39 121.20 123.04 1wvo s ILE 20 Ca 0.38 0.89 -0.20 0.00 -2.23 0.00 0.00 60.65 59.49 1wvo s ILE 20 Cb -0.12 -3.76 -0.08 0.00 -1.58 0.00 0.00 42.46 36.93 1wvo s ILE 20 CO 0.27 0.50 1.07 -0.76 -1.23 0.00 0.00 174.94 174.79 1wvo s LEU 21 N -1.28 3.85 0.06 2.97 1.43 0.11 -4.96 118.68 120.85 1wvo s LEU 21 Ca 0.28 2.01 -0.06 0.00 -1.03 0.00 0.00 54.13 55.33 1wvo s LEU 21 Cb -0.17 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.51 1wvo s LEU 21 CO 0.16 -0.87 0.12 0.42 0.23 0.00 0.00 176.35 176.40 1wvo s THR 22 N -1.89 0.15 0.40 5.49 -4.23 -1.26 -3.13 115.64 111.19 1wvo s THR 22 Ca 0.68 -1.27 0.11 0.00 -1.18 0.00 0.00 61.69 60.02 1wvo s THR 22 Cb -0.19 -1.22 0.17 0.00 1.34 0.00 0.00 72.50 72.61 1wvo s THR 22 CO 0.23 -0.70 1.95 0.24 -0.54 0.00 0.00 174.62 175.79 1wvo h MET 23 N 3.15 0.20 0.00 3.99 2.86 -1.96 -2.00 114.93 121.17 1wvo h MET 23 Ca -0.33 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 1wvo h MET 23 Cb 1.18 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1wvo h MET 23 CO 0.56 0.32 0.02 -0.44 1.06 0.00 0.00 176.91 178.44 1wvo h ASP 24 N 0.19 0.00 -0.00 1.22 3.32 -2.02 -1.16 116.42 117.98 1wvo h ASP 24 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1wvo h ASP 24 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1wvo h ASP 24 CO 0.02 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.77 1wvo n MET 25 N -2.66 2.82 -4.30 3.56 2.81 -0.77 -4.80 117.12 113.77 1wvo n MET 25 Ca -0.02 -1.62 -0.19 0.00 -1.81 0.00 0.00 57.70 54.05 1wvo n MET 25 Cb 0.08 -1.06 -0.13 0.00 -0.71 0.00 0.00 33.22 31.40 1wvo n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1wvo s LEU 26 N -1.20 2.20 0.17 4.03 1.43 -0.44 -0.66 118.68 124.21 1wvo s LEU 26 Ca 0.04 -0.50 -0.15 0.00 -1.03 0.00 0.00 54.13 52.49 1wvo s LEU 26 Cb 0.03 -0.57 0.02 0.00 0.03 0.00 0.00 46.19 45.70 1wvo s LEU 26 CO 0.01 0.00 0.43 0.28 0.23 0.00 0.00 176.35 177.30 1wvo s THR 27 N -0.96 0.05 -0.45 5.49 -1.32 -0.70 -4.69 115.64 113.06 1wvo s THR 27 Ca 0.00 -0.91 -0.08 0.00 -1.21 0.00 0.00 61.69 59.49 1wvo s THR 27 Cb -0.08 -1.56 0.11 0.00 -1.51 0.00 0.00 72.50 69.45 1wvo s THR 27 CO 0.01 -0.22 0.30 -0.69 -2.21 0.00 0.00 174.62 171.82 1wvo s VAL 28 N -3.88 4.07 0.07 5.08 1.01 -1.26 -1.11 120.40 124.38 1wvo s VAL 28 Ca 0.10 -1.71 -0.31 0.00 0.00 0.00 0.00 61.98 60.06 1wvo s VAL 28 Cb 0.01 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.69 1wvo s VAL 28 CO -0.04 -0.68 1.26 -0.54 0.00 0.00 0.00 175.10 175.10 1wvo s LYS 29 N 1.35 4.39 -0.08 2.72 -0.14 -0.35 -4.87 119.74 122.77 1wvo s LYS 29 Ca 0.05 1.86 -0.30 0.00 -1.36 0.00 0.00 55.97 56.22 1wvo s LYS 29 Cb -0.25 -3.33 -0.03 0.00 -1.68 0.00 0.00 37.83 32.53 1wvo s LYS 29 CO -0.00 -0.32 1.32 0.14 -0.76 0.00 0.00 175.35 175.72 1wvo s VAL 30 N 1.15 4.05 0.00 3.17 -7.23 -1.26 -2.44 120.40 117.83 1wvo s VAL 30 Ca 0.60 1.35 0.00 0.00 -1.81 0.00 0.00 61.98 62.12 1wvo s VAL 30 Cb -0.31 -3.87 0.00 0.00 0.56 0.00 0.00 36.38 32.76 1wvo s VAL 30 CO 0.29 -0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.64 1wvo n GLY 31 N 3.60 -1.58 3.06 2.32 0.00 -0.78 -4.97 105.19 106.83 1wvo n GLY 31 Ca 0.13 0.61 -0.10 0.00 0.00 0.00 0.00 46.02 46.66 1wvo n GLY 31 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wvo s GLU 32 N 0.00 0.53 0.00 1.61 1.03 -1.25 -4.48 118.70 116.13 1wvo s GLU 32 Ca 0.00 -0.91 0.00 0.00 0.03 0.00 0.00 54.97 54.09 1wvo s GLU 32 Cb 0.00 -0.04 0.00 0.00 -0.80 0.00 0.00 34.13 33.29 1wvo s GLU 32 CO 0.00 -0.03 0.40 -0.35 -1.33 0.00 0.00 175.26 173.95 1wvo n PRO 33 N 0.96 0.52 -2.05 -4.83 -0.04 -1.26 -3.41 135.00 124.90 1wvo n PRO 33 Ca -0.19 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.84 1wvo n PRO 33 Cb 0.57 -1.12 -0.03 0.00 -0.04 0.00 0.00 33.50 32.88 1wvo n PRO 33 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1wvo s LYS 34 N -1.53 3.71 0.00 0.54 0.00 -1.26 -4.70 119.74 116.50 1wvo s LYS 34 Ca 0.00 1.70 0.00 0.00 0.00 0.00 0.00 55.97 57.67 1wvo s LYS 34 Cb 0.00 -4.08 0.00 0.00 0.00 0.00 0.00 37.83 33.75 1wvo s LYS 34 CO 0.00 -1.40 0.00 0.41 0.00 0.00 0.00 175.35 174.36 1wvo n GLY 35 N 4.82 0.31 3.76 0.59 0.00 -1.26 -4.77 105.19 108.64 1wvo n GLY 35 Ca 0.20 -2.30 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 1wvo n GLY 35 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wvo s TYR 36 N 0.00 3.26 0.29 1.61 5.04 -0.19 -4.89 117.35 122.48 1wvo s TYR 36 Ca 0.00 1.46 -0.30 0.00 -2.44 0.00 0.00 57.07 55.79 1wvo s TYR 36 Cb 0.00 -3.54 -0.11 0.00 0.35 0.00 0.00 41.96 38.66 1wvo s TYR 36 CO 0.00 -1.46 1.58 -1.25 -1.34 0.00 0.00 175.55 173.09 1wvo s PRO 37 N -1.29 4.13 0.22 4.97 0.04 -1.26 -2.05 135.00 139.76 1wvo s PRO 37 Ca 0.49 2.56 0.22 0.00 0.04 0.00 0.00 61.00 64.31 1wvo s PRO 37 Cb -0.37 -3.03 0.92 0.00 0.04 0.00 0.00 34.50 32.07 1wvo s PRO 37 CO 0.46 -0.62 1.66 -0.35 0.04 0.00 0.00 177.00 178.19 1wvo n PRO 38 N 2.16 0.16 0.08 0.56 -0.04 -1.26 -2.42 135.00 134.24 1wvo n PRO 38 Ca 0.08 0.40 -0.08 0.00 -0.04 0.00 0.00 63.50 63.87 1wvo n PRO 38 Cb 0.38 -1.81 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 1wvo n PRO 38 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1wvo h GLU 39 N 0.00 0.07 -0.02 0.54 5.08 -1.97 -3.15 114.58 115.13 1wvo h GLU 39 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1wvo h GLU 39 Cb 0.33 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1wvo h GLU 39 CO 0.00 0.97 0.00 -0.25 -1.00 0.00 0.00 179.01 178.73 1wvo n ASP 40 N -3.49 0.24 -0.14 1.42 9.92 -1.02 -4.13 116.55 119.35 1wvo n ASP 40 Ca -0.02 -1.44 0.20 0.00 -0.53 0.00 0.00 54.79 53.01 1wvo n ASP 40 Cb 0.88 -0.01 0.61 0.00 -0.64 0.00 0.00 41.12 41.96 1wvo n ASP 40 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 1wvo h ILE 41 N 0.32 0.70 -0.68 0.53 2.10 -1.62 -0.94 117.51 117.93 1wvo h ILE 41 Ca 0.00 -0.07 0.05 0.00 1.08 0.00 0.00 64.86 65.92 1wvo h ILE 41 Cb 0.07 0.48 -0.05 0.00 -1.09 0.00 0.00 36.82 36.22 1wvo h ILE 41 CO 0.00 0.04 0.39 -0.26 -1.08 0.00 0.00 178.15 177.24 1wvo h PHE 42 N 0.20 0.72 -0.48 2.19 0.04 -1.86 -1.63 116.94 116.13 1wvo h PHE 42 Ca 0.37 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 61.10 1wvo h PHE 42 Cb 1.15 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 39.06 1wvo h PHE 42 CO -0.00 0.37 0.03 -0.91 -0.60 0.00 0.00 178.31 177.19 1wvo h ASN 43 N 0.73 0.74 -0.17 2.17 2.35 -1.49 -2.57 115.58 117.34 1wvo h ASN 43 Ca 0.30 -0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1wvo h ASN 43 Cb 0.14 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1wvo h ASN 43 CO -0.16 0.79 -0.05 -0.07 -1.65 0.00 0.00 177.43 176.28 1wvo h LEU 44 N 0.73 0.44 -8.00 1.61 3.38 -1.21 -3.38 115.31 108.88 1wvo h LEU 44 Ca 0.15 -0.09 -0.40 0.00 0.09 0.00 0.00 57.88 57.63 1wvo h LEU 44 Cb 0.41 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1wvo h LEU 44 CO 0.01 0.55 1.23 -0.69 0.09 0.00 0.00 178.44 179.64 1wvo s VAL 45 N -4.87 3.65 0.00 1.22 1.01 -0.96 -1.29 120.40 119.15 1wvo s VAL 45 Ca -0.07 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1wvo s VAL 45 Cb 0.15 -4.62 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1wvo s VAL 45 CO 0.76 -1.20 0.00 0.61 0.00 0.00 0.00 175.10 175.27 1wvo n GLY 46 N 5.94 -0.16 3.91 4.51 0.00 -1.18 -4.96 105.19 113.24 1wvo n GLY 46 Ca 0.44 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.19 1wvo n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wvo s LYS 47 N 0.00 3.60 -0.12 1.61 1.02 -0.41 -4.82 119.74 120.62 1wvo s LYS 47 Ca 0.00 -0.02 -0.08 0.00 0.02 0.00 0.00 55.97 55.88 1wvo s LYS 47 Cb 0.00 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.66 1wvo s LYS 47 CO 0.00 0.15 0.16 0.21 -0.92 0.00 0.00 175.35 174.95 1wvo s LYS 48 N -3.85 3.58 0.21 1.68 2.20 -1.26 -0.72 119.74 121.59 1wvo s LYS 48 Ca 0.44 -0.09 -0.30 0.00 -0.36 0.00 0.00 55.97 55.65 1wvo s LYS 48 Cb -0.10 -3.22 -0.08 0.00 -1.51 0.00 0.00 37.83 32.91 1wvo s LYS 48 CO 0.33 0.71 1.09 0.14 -0.36 0.00 0.00 175.35 177.26 1wvo s VAL 49 N -0.85 3.75 -0.79 4.02 -7.23 -0.48 -1.17 120.40 117.64 1wvo s VAL 49 Ca 0.15 1.60 0.25 0.00 -1.81 0.00 0.00 61.98 62.16 1wvo s VAL 49 Cb -0.12 -4.02 0.04 0.00 0.56 0.00 0.00 36.38 32.83 1wvo s VAL 49 CO 0.04 0.31 1.37 0.18 -0.31 0.00 0.00 175.10 176.70 1wvo n LEU 50 N 1.95 0.59 -3.97 1.32 4.77 -0.06 -2.22 117.00 119.36 1wvo n LEU 50 Ca 0.01 0.15 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1wvo n LEU 50 Cb 0.46 -0.22 -0.09 0.00 -2.33 0.00 0.00 43.42 41.24 1wvo n LEU 50 CO 0.54 0.02 -0.22 0.68 -1.33 0.00 0.00 177.39 177.07 1wvo s VAL 51 N -3.10 0.18 -0.52 4.08 -7.23 -1.26 -4.89 120.40 107.66 1wvo s VAL 51 Ca 0.08 -1.50 -0.28 0.00 -1.81 0.00 0.00 61.98 58.48 1wvo s VAL 51 Cb 0.15 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1wvo s VAL 51 CO 0.71 -0.81 1.52 -0.89 -0.31 0.00 0.00 175.10 175.32 1wvo s THR 52 N -3.89 3.70 0.30 5.32 2.01 -1.26 -3.88 115.64 117.94 1wvo s THR 52 Ca 0.06 0.61 -0.27 0.00 0.31 0.00 0.00 61.69 62.41 1wvo s THR 52 Cb 0.06 -4.24 -0.10 0.00 0.01 0.00 0.00 72.50 68.23 1wvo s THR 52 CO -0.10 -0.99 0.93 -0.69 -0.69 0.00 0.00 174.62 173.08 1wvo s VAL 53 N 6.50 4.20 0.60 3.82 1.01 0.35 -4.88 120.40 132.00 1wvo s VAL 53 Ca 0.59 1.86 -0.01 0.00 0.00 0.00 0.00 61.98 64.41 1wvo s VAL 53 Cb -0.13 -4.07 0.04 0.00 0.00 0.00 0.00 36.38 32.22 1wvo s VAL 53 CO 0.26 0.22 0.85 -1.61 0.00 0.00 0.00 175.10 174.82 1wvo s GLU 54 N -1.87 2.45 0.25 2.72 2.02 -1.26 -1.35 118.70 121.67 1wvo s GLU 54 Ca 0.48 -0.59 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 1wvo s GLU 54 Cb -0.20 -2.38 -0.09 0.00 0.10 0.00 0.00 34.13 31.55 1wvo s GLU 54 CO 0.25 -0.87 1.28 -2.00 0.02 0.00 0.00 175.26 173.94 1wvo s GLU 55 N -4.92 4.41 -0.63 1.61 2.12 -1.26 -2.64 118.70 117.39 1wvo s GLU 55 Ca 0.58 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.98 1wvo s GLU 55 Cb -0.10 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.13 1wvo s GLU 55 CO 0.41 -0.17 0.00 -3.47 -0.54 0.00 0.00 175.26 171.48 1wvo n ASP 56 N 1.86 -5.11 -4.83 -1.70 2.03 -0.22 -4.88 116.55 103.70 1wvo n ASP 56 Ca 0.03 0.15 -0.32 0.00 0.52 0.00 0.00 54.79 55.17 1wvo n ASP 56 Cb 0.43 -3.13 0.01 0.00 -0.72 0.00 0.00 41.12 37.70 1wvo n ASP 56 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wvo s ASP 57 N -2.32 5.97 -0.01 1.67 2.15 -1.08 -4.70 116.67 118.35 1wvo s ASP 57 Ca 0.00 1.62 -0.30 0.00 0.43 0.00 0.00 52.55 54.30 1wvo s ASP 57 Cb 0.00 -2.50 -0.03 0.00 -0.30 0.00 0.00 42.92 40.08 1wvo s ASP 57 CO 0.00 -1.04 1.05 -0.89 -0.17 0.00 0.00 175.17 174.12 1wvo s THR 58 N -2.80 4.64 -0.09 1.71 2.01 -1.26 -0.49 115.64 119.35 1wvo s THR 58 Ca 0.59 1.90 -0.22 0.00 0.31 0.00 0.00 61.69 64.27 1wvo s THR 58 Cb -0.13 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 1wvo s THR 58 CO 0.44 0.11 0.65 -0.63 -0.69 0.00 0.00 174.62 174.50 1wvo s ILE 59 N 1.31 5.07 0.13 1.82 -1.09 -0.64 -4.86 121.20 122.94 1wvo s ILE 59 Ca 0.53 1.32 0.03 0.00 -2.23 0.00 0.00 60.65 60.30 1wvo s ILE 59 Cb -0.22 -3.98 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 1wvo s ILE 59 CO 0.26 0.25 -0.09 -0.04 -1.23 0.00 0.00 174.94 174.09 1wvo s MET 60 N 0.92 0.97 0.35 2.79 -1.94 -1.26 -1.02 119.30 120.12 1wvo s MET 60 Ca 0.34 -1.40 0.05 0.00 -1.71 0.00 0.00 55.69 52.97 1wvo s MET 60 Cb -0.17 -0.46 0.66 0.00 2.01 0.00 0.00 34.83 36.87 1wvo s MET 60 CO 0.15 0.04 1.91 1.49 -0.01 0.00 0.00 175.02 178.60 1wvo h GLU 61 N 2.87 0.49 0.00 2.03 4.22 -1.94 -2.00 114.58 120.26 1wvo h GLU 61 Ca -0.36 -0.09 0.00 0.00 0.08 0.00 0.00 59.36 58.99 1wvo h GLU 61 Cb 1.18 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1wvo h GLU 61 CO 0.64 0.50 0.00 0.93 -2.18 0.00 0.00 179.01 178.90 1wvo h GLU 62 N 0.48 0.00 -0.50 1.92 5.08 -2.00 -1.17 114.58 118.38 1wvo h GLU 62 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1wvo h GLU 62 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1wvo h GLU 62 CO 0.01 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.30 1wvo n LEU 63 N -3.00 3.60 -4.11 1.33 4.77 -0.75 -4.89 117.00 113.96 1wvo n LEU 63 Ca -0.03 -1.69 -0.17 0.00 -0.03 0.00 0.00 56.01 54.09 1wvo n LEU 63 Cb 0.08 -0.33 -0.13 0.00 -2.33 0.00 0.00 43.42 40.72 1wvo n LEU 63 CO 0.20 0.83 -0.44 0.68 -1.33 0.00 0.00 177.39 177.32 1wvo s VAL 64 N -1.28 0.87 0.44 4.08 -7.23 -0.44 -0.89 120.40 115.95 1wvo s VAL 64 Ca 0.41 -1.00 -0.25 0.00 -1.81 0.00 0.00 61.98 59.34 1wvo s VAL 64 Cb 0.23 -0.83 -0.09 0.00 0.56 0.00 0.00 36.38 36.25 1wvo s VAL 64 CO 0.31 -0.14 1.30 0.47 -0.31 0.00 0.00 175.10 176.73 1wvo n ASP 65 N 1.76 2.64 -0.06 4.85 8.00 -0.32 -4.84 116.55 128.58 1wvo n ASP 65 Ca -0.19 1.09 0.01 0.00 0.71 0.00 0.00 54.79 56.41 1wvo n ASP 65 Cb 0.55 -1.52 0.32 0.00 -0.02 0.00 0.00 41.12 40.45 1wvo n ASP 65 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1wvo h ASN 66 N 2.02 0.60 -5.45 -2.24 -1.24 -1.92 -3.44 115.58 103.90 1wvo h ASN 66 Ca -0.49 -0.05 -0.21 0.00 0.71 0.00 0.00 56.30 56.27 1wvo h ASN 66 Cb 1.29 -0.15 -0.10 0.00 0.73 0.00 0.00 38.32 40.10 1wvo h ASN 66 CO 0.60 0.51 -0.24 -1.38 -1.29 0.00 0.00 177.43 175.62 1wvo s HIS 67 N -5.41 0.88 -0.25 0.67 -3.43 -1.26 -5.16 115.29 101.32 1wvo s HIS 67 Ca -0.09 -1.14 -0.02 0.00 -0.80 0.00 0.00 55.06 53.01 1wvo s HIS 67 Cb 0.17 -0.09 0.14 0.00 -1.43 0.00 0.00 32.58 31.37 1wvo s HIS 67 CO 0.76 -1.01 0.38 0.20 -2.00 0.00 0.00 174.74 173.07 1wvo s GLY 68 N -3.16 -0.44 0.05 -1.38 0.00 -1.26 -4.84 107.32 96.29 1wvo s GLY 68 Ca 0.30 0.80 0.01 0.00 0.00 0.00 0.00 44.72 45.82 1wvo s GLY 68 CO 0.16 2.73 -0.05 -1.59 0.00 0.00 0.00 173.10 174.35 1wvo s LYS 69 N 2.55 0.58 -0.30 2.90 -2.85 -1.26 -5.09 119.74 116.26 1wvo s LYS 69 Ca 0.12 -1.00 0.00 0.00 -1.00 0.00 0.00 55.97 54.10 1wvo s LYS 69 Cb -0.15 -0.03 0.19 0.00 -2.06 0.00 0.00 37.83 35.78 1wvo s LYS 69 CO -0.18 -0.04 0.65 0.21 0.10 0.00 0.00 175.35 176.09 1wvo s LYS 70 N -2.78 0.52 0.00 1.78 2.20 -1.26 -5.03 119.74 115.17 1wvo s LYS 70 Ca -0.01 0.76 0.26 0.00 -0.36 0.00 0.00 55.97 56.62 1wvo s LYS 70 Cb -0.01 0.40 1.47 0.00 -1.51 0.00 0.00 37.83 38.18 1wvo s LYS 70 CO -0.04 -0.73 1.91 0.44 -0.36 0.00 0.00 175.35 176.57 1wvo n ILE 71 N 5.42 0.08 -2.09 5.43 -6.64 -1.26 -4.76 119.36 115.53 1wvo n ILE 71 Ca 0.01 0.02 -0.37 0.00 -1.77 0.00 0.00 62.75 60.65 1wvo n ILE 71 Cb 0.53 -0.60 -0.03 0.00 -1.44 0.00 0.00 39.64 38.09 1wvo n ILE 71 CO 0.00 0.00 0.00 -0.75 -1.77 0.00 0.00 176.55 174.03 1wvo s LYS 72 N -2.24 2.68 0.03 6.28 2.20 -1.26 -4.61 119.74 122.82 1wvo s LYS 72 Ca 0.34 0.34 0.00 0.00 -0.36 0.00 0.00 55.97 56.29 1wvo s LYS 72 Cb 0.18 -4.52 0.00 0.00 -1.51 0.00 0.00 37.83 31.98 1wvo s LYS 72 CO 0.34 -2.80 0.00 0.45 -0.36 0.00 0.00 175.35 172.99 1wvo n SER 73 N 12.63 0.21 -4.66 1.43 2.88 -1.26 -5.09 113.62 119.76 1wvo n SER 73 Ca 0.23 0.05 -0.29 0.00 -1.33 0.00 0.00 58.87 57.53 1wvo n SER 73 Cb 0.51 -0.05 0.17 0.00 -0.75 0.00 0.00 64.21 64.09 1wvo n SER 73 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wvo s SER 74 N -5.07 2.69 0.11 -3.46 0.01 -1.26 -5.08 113.70 101.64 1wvo s SER 74 Ca 0.00 1.37 -0.26 0.00 1.31 0.00 0.00 55.95 58.38 1wvo s SER 74 Cb 0.00 -2.05 0.08 0.00 0.21 0.00 0.00 66.02 64.26 1wvo s SER 74 CO 0.00 -3.11 1.09 -0.83 0.41 0.00 0.00 173.24 170.79 1wvo s GLY 75 N -3.29 -0.18 0.01 3.44 0.00 -1.26 -5.03 107.32 101.02 1wvo s GLY 75 Ca 0.65 0.14 0.21 0.00 0.00 0.00 0.00 44.72 45.72 1wvo s GLY 75 CO 0.58 1.03 1.67 -1.55 0.00 0.00 0.00 173.10 174.83 1wvo n PRO 76 N -0.57 0.01 -0.65 2.90 -0.04 -1.26 -4.17 135.00 131.22 1wvo n PRO 76 Ca -0.05 0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.49 1wvo n PRO 76 Cb 0.61 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1wvo n PRO 76 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1wvo n SER 77 N -1.54 3.62 -3.28 3.54 3.41 -1.26 -4.52 113.62 113.59 1wvo n SER 77 Ca 0.05 -2.15 -0.20 0.00 -0.26 0.00 0.00 58.87 56.30 1wvo n SER 77 Cb 0.25 -0.96 -0.08 0.00 -0.26 0.00 0.00 64.21 63.16 1wvo n SER 77 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1wvo s SER 78 N 2.28 1.03 0.00 4.04 0.01 -1.26 -5.20 113.70 114.59 1wvo s SER 78 Ca 0.41 -2.32 0.00 0.00 1.31 0.00 0.00 55.95 55.34 1wvo s SER 78 Cb 0.20 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.68 1wvo s SER 78 CO 0.00 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.07