#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 -4.73 1.61 2.88 -1.26 -5.13 113.62 107.00 1wvo n SER 2 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 1wvo n SER 2 Cb 0.00 0.18 0.09 0.00 -0.75 0.00 0.00 64.21 63.73 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 -3.54 4.33 0.00 -3.46 0.15 -1.26 -4.85 113.70 105.07 1wvo s SER 3 Ca 0.00 2.26 0.00 0.00 0.70 0.00 0.00 55.95 58.91 1wvo s SER 3 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 1wvo s SER 3 CO 0.00 -2.17 0.00 0.61 1.20 0.00 0.00 173.24 172.88 1wvo n GLY 4 N 0.17 1.94 3.40 9.45 0.00 -1.26 -5.16 105.19 113.73 1wvo n GLY 4 Ca 0.13 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.20 0.00 1.61 0.01 -1.26 -5.06 113.70 108.79 1wvo s SER 5 Ca 0.00 -0.46 0.01 0.00 1.31 0.00 0.00 55.95 56.81 1wvo s SER 5 Cb 0.00 0.51 0.01 0.00 0.21 0.00 0.00 66.02 66.75 1wvo s SER 5 CO 0.00 -0.94 0.75 -1.20 0.41 0.00 0.00 173.24 172.26 1wvo n SER 6 N -0.27 1.51 0.00 2.44 7.64 -1.26 -4.91 113.62 118.77 1wvo n SER 6 Ca -0.12 -1.47 0.00 0.00 1.01 0.00 0.00 58.87 58.28 1wvo n SER 6 Cb 0.63 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1wvo n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wvo n GLY 7 N -0.18 -0.83 3.17 0.23 0.00 -1.26 -4.58 105.19 101.74 1wvo n GLY 7 Ca 0.01 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 1wvo n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wvo s SER 8 N -4.00 0.19 0.25 1.61 1.04 -1.09 -4.11 113.70 107.59 1wvo s SER 8 Ca 0.00 -0.67 -0.30 0.00 0.48 0.00 0.00 55.95 55.46 1wvo s SER 8 Cb 0.00 0.29 -0.09 0.00 0.10 0.00 0.00 66.02 66.32 1wvo s SER 8 CO 0.00 -0.66 1.25 -0.69 0.98 0.00 0.00 173.24 174.13 1wvo s VAL 9 N -3.58 3.16 0.10 5.02 1.01 -0.48 -1.65 120.40 123.98 1wvo s VAL 9 Ca 0.03 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.07 1wvo s VAL 9 Cb 0.04 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1wvo s VAL 9 CO -0.09 0.20 -0.05 0.68 0.00 0.00 0.00 175.10 175.84 1wvo s VAL 10 N -0.52 0.60 -0.22 2.92 -7.23 0.02 -1.96 120.40 114.02 1wvo s VAL 10 Ca 0.52 -1.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 1wvo s VAL 10 Cb -0.36 -1.71 -0.01 0.00 0.56 0.00 0.00 36.38 34.86 1wvo s VAL 10 CO 0.43 -0.84 1.26 0.00 -0.31 0.00 0.00 175.10 175.64 1wvo s ALA 11 N -3.69 3.56 0.43 1.32 0.00 0.20 -1.70 121.76 121.88 1wvo s ALA 11 Ca 0.13 0.32 0.11 0.00 0.00 0.00 0.00 51.96 52.51 1wvo s ALA 11 Cb 0.06 -3.67 0.93 0.00 0.00 0.00 0.00 23.12 20.43 1wvo s ALA 11 CO -0.04 -1.37 2.00 -0.22 0.00 0.00 0.00 175.76 176.12 1wvo h LYS 12 N 8.54 0.22 -4.73 0.00 3.64 -1.20 0.55 116.57 123.58 1wvo h LYS 12 Ca -0.26 -0.03 -0.32 0.00 -1.27 0.00 0.00 60.65 58.77 1wvo h LYS 12 Cb 1.10 -0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 32.73 1wvo h LYS 12 CO 0.99 0.27 -0.59 0.14 -2.27 0.00 0.00 179.45 177.99 1wvo s VAL 13 N -4.94 0.15 0.18 2.00 -7.23 -1.26 -4.47 120.40 104.84 1wvo s VAL 13 Ca -0.06 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.81 1wvo s VAL 13 Cb 0.16 -2.53 -0.08 0.00 0.56 0.00 0.00 36.38 34.49 1wvo s VAL 13 CO 0.71 0.00 1.28 -0.75 -0.31 0.00 0.00 175.10 176.04 1wvo s LYS 14 N -3.98 4.41 -0.26 4.82 2.20 -1.26 -4.18 119.74 121.49 1wvo s LYS 14 Ca 0.38 2.00 0.03 0.00 -0.36 0.00 0.00 55.97 58.02 1wvo s LYS 14 Cb 0.06 -3.22 0.06 0.00 -1.51 0.00 0.00 37.83 33.23 1wvo s LYS 14 CO 0.15 -0.22 -0.10 0.42 -0.36 0.00 0.00 175.35 175.24 1wvo s ILE 15 N 0.17 2.08 0.52 5.43 1.01 0.52 -4.90 121.20 126.03 1wvo s ILE 15 Ca 0.56 -1.57 -0.20 0.00 0.00 0.00 0.00 60.65 59.44 1wvo s ILE 15 Cb -0.35 -2.21 -0.06 0.00 0.01 0.00 0.00 42.46 39.85 1wvo s ILE 15 CO 0.37 -0.03 1.14 -2.16 0.00 0.00 0.00 174.94 174.26 1wvo s PRO 16 N 1.14 3.46 0.65 2.79 0.04 -1.26 -0.75 135.00 141.07 1wvo s PRO 16 Ca -0.08 1.67 -0.17 0.00 0.04 0.00 0.00 61.00 62.45 1wvo s PRO 16 Cb -0.20 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.20 1wvo s PRO 16 CO -0.05 -0.78 0.93 -1.91 0.04 0.00 0.00 177.00 175.23 1wvo n GLU 17 N -1.08 0.72 -2.26 4.56 2.13 -1.24 -3.25 120.64 120.21 1wvo n GLU 17 Ca 0.10 0.29 -0.12 0.00 0.66 0.00 0.00 57.16 58.10 1wvo n GLU 17 Cb 0.50 -2.16 -0.00 0.00 0.27 0.00 0.00 31.44 30.04 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 1.26 -0.10 3.45 8.31 0.00 -0.62 -4.94 105.19 112.56 1wvo n GLY 18 Ca 0.14 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.61 2.58 -0.21 2.61 2.01 -1.20 -4.91 115.64 113.92 1wvo s THR 19 Ca 0.02 -1.68 -0.18 0.00 0.31 0.00 0.00 61.69 60.16 1wvo s THR 19 Cb -0.01 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.29 1wvo s THR 19 CO 0.02 0.05 0.49 -0.63 -0.69 0.00 0.00 174.62 173.86 1wvo s ILE 20 N -1.22 5.12 0.54 1.82 -1.09 -1.26 -1.74 121.20 123.37 1wvo s ILE 20 Ca 0.17 0.89 -0.21 0.00 -2.23 0.00 0.00 60.65 59.27 1wvo s ILE 20 Cb -0.10 -3.81 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 1wvo s ILE 20 CO 0.09 0.18 1.28 -0.76 -1.23 0.00 0.00 174.94 174.50 1wvo s LEU 21 N 1.64 3.85 0.11 2.97 1.43 -0.14 -4.85 118.68 123.68 1wvo s LEU 21 Ca 0.23 2.58 -0.02 0.00 -1.03 0.00 0.00 54.13 55.89 1wvo s LEU 21 Cb -0.15 -4.33 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 1wvo s LEU 21 CO 0.09 -1.43 0.05 0.42 0.23 0.00 0.00 176.35 175.71 1wvo s THR 22 N -1.41 0.13 0.41 5.49 -4.23 -1.26 -0.54 115.64 114.22 1wvo s THR 22 Ca 0.71 -1.85 0.10 0.00 -1.18 0.00 0.00 61.69 59.47 1wvo s THR 22 Cb -0.36 -1.90 0.20 0.00 1.34 0.00 0.00 72.50 71.78 1wvo s THR 22 CO 0.42 -0.58 1.97 0.24 -0.54 0.00 0.00 174.62 176.13 1wvo h MET 23 N 2.91 0.29 -0.06 3.99 2.86 -1.97 -2.43 114.93 120.52 1wvo h MET 23 Ca -0.35 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.26 1wvo h MET 23 Cb 1.19 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.80 1wvo h MET 23 CO 0.60 0.33 0.05 0.22 1.06 0.00 0.00 176.91 179.17 1wvo h ASP 24 N 0.28 0.00 -0.52 1.22 3.58 -2.01 -2.15 116.42 116.82 1wvo h ASP 24 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1wvo h ASP 24 Cb 0.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.28 1wvo h ASP 24 CO 0.01 0.00 0.00 0.23 -2.88 0.00 0.00 179.24 176.60 1wvo n MET 25 N -4.21 2.69 -4.43 0.28 2.81 -0.92 -4.84 117.12 108.51 1wvo n MET 25 Ca -0.02 -2.32 -0.22 0.00 -1.81 0.00 0.00 57.70 53.33 1wvo n MET 25 Cb 0.15 -1.43 -0.13 0.00 -0.71 0.00 0.00 33.22 31.10 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 -1.04 2.19 0.35 4.03 1.43 -0.81 -0.71 118.68 124.12 1wvo s LEU 26 Ca 0.36 -0.52 -0.09 0.00 -1.03 0.00 0.00 54.13 52.85 1wvo s LEU 26 Cb 0.19 -0.76 0.02 0.00 0.03 0.00 0.00 46.19 45.68 1wvo s LEU 26 CO 0.25 0.07 0.61 0.28 0.23 0.00 0.00 176.35 177.79 1wvo s THR 27 N -0.90 0.00 -0.10 5.49 -1.32 -0.69 -4.71 115.64 113.42 1wvo s THR 27 Ca 0.04 -1.33 -0.01 0.00 -1.21 0.00 0.00 61.69 59.18 1wvo s THR 27 Cb -0.09 -2.70 0.03 0.00 -1.51 0.00 0.00 72.50 68.24 1wvo s THR 27 CO 0.02 0.00 -0.03 0.54 -2.21 0.00 0.00 174.62 172.94 1wvo s VAL 28 N -2.82 0.69 -0.46 5.08 0.11 -1.26 -0.80 120.40 120.94 1wvo s VAL 28 Ca 0.23 -0.10 -0.21 0.00 -2.93 0.00 0.00 61.98 58.97 1wvo s VAL 28 Cb -0.03 -0.80 0.03 0.00 -1.53 0.00 0.00 36.38 34.06 1wvo s VAL 28 CO 0.16 0.29 0.67 -0.54 -3.33 0.00 0.00 175.10 172.35 1wvo s LYS 29 N 1.84 3.26 0.26 1.54 1.02 -0.66 -4.89 119.74 122.12 1wvo s LYS 29 Ca 0.05 -0.45 -0.31 0.00 0.02 0.00 0.00 55.97 55.28 1wvo s LYS 29 Cb -0.13 -3.99 -0.12 0.00 -0.52 0.00 0.00 37.83 33.08 1wvo s LYS 29 CO -0.07 -1.10 1.59 0.28 -0.92 0.00 0.00 175.35 175.13 1wvo n VAL 30 N 5.85 0.77 0.00 3.17 0.31 -1.26 -2.85 118.33 124.32 1wvo n VAL 30 Ca -0.02 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1wvo n VAL 30 Cb 0.47 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1wvo n VAL 30 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wvo n GLY 31 N 2.55 -1.36 3.31 2.92 0.00 -1.26 -4.89 105.19 106.46 1wvo n GLY 31 Ca 0.11 0.46 -0.24 0.00 0.00 0.00 0.00 46.02 46.34 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 1.19 0.30 1.61 -1.05 -1.26 -4.62 118.70 114.87 1wvo s GLU 32 Ca 0.00 -1.22 0.25 0.00 -0.15 0.00 0.00 54.97 53.85 1wvo s GLU 32 Cb 0.00 -1.46 1.02 0.00 -0.44 0.00 0.00 34.13 33.24 1wvo s GLU 32 CO 0.00 0.34 1.76 -1.00 0.95 0.00 0.00 175.26 177.31 1wvo h PRO 33 N 3.95 0.00 -5.71 -4.83 0.13 -1.95 -2.88 132.00 120.71 1wvo h PRO 33 Ca -0.46 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.05 1wvo h PRO 33 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1wvo h PRO 33 CO 0.41 0.00 1.52 1.17 -0.23 0.00 0.00 178.00 180.86 1wvo n LYS 34 N -2.39 0.69 0.00 0.86 4.81 -1.26 -4.56 118.16 116.31 1wvo n LYS 34 Ca 0.02 0.14 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1wvo n LYS 34 Cb 0.27 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.03 1wvo n LYS 34 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wvo n GLY 35 N 6.58 0.81 3.77 3.14 0.00 -1.26 -4.69 105.19 113.53 1wvo n GLY 35 Ca 0.48 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.18 2.96 0.23 1.61 5.04 0.11 -4.81 117.35 121.31 1wvo s TYR 36 Ca 0.00 1.38 -0.30 0.00 -2.44 0.00 0.00 57.07 55.70 1wvo s TYR 36 Cb 0.00 -3.74 -0.10 0.00 0.35 0.00 0.00 41.96 38.48 1wvo s TYR 36 CO 0.00 -2.06 1.42 -1.25 -1.34 0.00 0.00 175.55 172.33 1wvo s PRO 37 N -1.88 4.29 0.35 4.97 0.04 -1.26 -1.39 135.00 140.12 1wvo s PRO 37 Ca 0.50 2.25 0.27 0.00 0.04 0.00 0.00 61.00 64.06 1wvo s PRO 37 Cb -0.41 -3.13 1.05 0.00 0.04 0.00 0.00 34.50 32.05 1wvo s PRO 37 CO 0.54 -0.41 1.79 -1.00 0.04 0.00 0.00 177.00 177.97 1wvo h PRO 38 N 5.31 0.00 0.00 0.56 0.13 -1.91 -3.09 132.00 133.01 1wvo h PRO 38 Ca -0.45 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1wvo h PRO 38 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1wvo h PRO 38 CO 0.79 0.00 -0.14 1.49 -0.23 0.00 0.00 178.00 179.91 1wvo h GLU 39 N 0.00 0.00 -0.18 0.86 4.81 -1.97 -3.13 114.58 114.97 1wvo h GLU 39 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1wvo h GLU 39 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1wvo h GLU 39 CO 0.00 0.14 0.00 -3.47 -0.73 0.00 0.00 179.01 174.95 1wvo n ASP 40 N -3.29 2.75 -0.38 1.04 -0.08 -1.17 -4.78 116.55 110.64 1wvo n ASP 40 Ca 0.00 -2.34 0.30 0.00 -1.51 0.00 0.00 54.79 51.23 1wvo n ASP 40 Cb 0.38 -0.25 0.57 0.00 2.34 0.00 0.00 41.12 44.17 1wvo n ASP 40 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1wvo h ILE 41 N 1.09 0.32 -0.05 5.18 2.10 -1.58 -1.14 117.51 123.43 1wvo h ILE 41 Ca 0.00 -0.08 0.01 0.00 1.08 0.00 0.00 64.86 65.87 1wvo h ILE 41 Cb 0.83 0.06 -0.00 0.00 -1.09 0.00 0.00 36.82 36.62 1wvo h ILE 41 CO 0.04 0.04 0.07 -0.26 -1.08 0.00 0.00 178.15 176.97 1wvo h PHE 42 N 0.24 0.00 0.05 2.19 0.04 -1.87 -2.13 116.94 115.46 1wvo h PHE 42 Ca 0.71 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 61.25 1wvo h PHE 42 Cb 2.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 40.16 1wvo h PHE 42 CO -0.00 0.00 -1.04 -2.95 -0.60 0.00 0.00 178.31 173.72 1wvo h ASN 43 N 0.00 0.26 -0.38 2.17 7.08 -1.61 -3.21 115.58 119.89 1wvo h ASN 43 Ca 0.02 -0.25 -0.04 0.00 -3.08 0.00 0.00 56.30 52.96 1wvo h ASN 43 Cb 0.17 -0.08 -0.02 0.00 -2.08 0.00 0.00 38.32 36.30 1wvo h ASN 43 CO -0.00 1.14 0.13 -0.07 -2.08 0.00 0.00 177.43 176.54 1wvo h LEU 44 N 0.07 0.60 -9.24 6.14 3.38 -1.54 -3.41 115.31 111.31 1wvo h LEU 44 Ca -0.07 -0.08 -0.55 0.00 0.09 0.00 0.00 57.88 57.27 1wvo h LEU 44 Cb 1.74 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 42.35 1wvo h LEU 44 CO 0.16 0.59 1.31 -0.69 0.09 0.00 0.00 178.44 179.89 1wvo s VAL 45 N -5.21 3.02 0.00 1.22 1.01 -1.19 -1.49 120.40 117.77 1wvo s VAL 45 Ca -0.09 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1wvo s VAL 45 Cb 0.16 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1wvo s VAL 45 CO 0.77 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.47 1wvo n GLY 46 N 4.90 0.35 3.90 4.51 0.00 0.30 -4.97 105.19 114.18 1wvo n GLY 46 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.85 3.61 -0.10 1.61 1.02 -0.55 -4.72 119.74 119.76 1wvo s LYS 47 Ca 0.00 0.31 -0.13 0.00 0.02 0.00 0.00 55.97 56.17 1wvo s LYS 47 Cb 0.00 -2.36 -0.05 0.00 -0.52 0.00 0.00 37.83 34.90 1wvo s LYS 47 CO 0.00 -0.19 0.31 0.21 -0.92 0.00 0.00 175.35 174.76 1wvo s LYS 48 N -4.54 3.99 0.25 1.68 2.20 -1.26 -0.97 119.74 121.09 1wvo s LYS 48 Ca 0.49 0.17 -0.30 0.00 -0.36 0.00 0.00 55.97 55.97 1wvo s LYS 48 Cb -0.10 -3.31 -0.09 0.00 -1.51 0.00 0.00 37.83 32.81 1wvo s LYS 48 CO 0.42 0.49 1.01 0.14 -0.36 0.00 0.00 175.35 177.05 1wvo s VAL 49 N -0.32 3.83 -0.52 4.02 -7.23 -0.71 -1.04 120.40 118.44 1wvo s VAL 49 Ca 0.19 1.83 0.24 0.00 -1.81 0.00 0.00 61.98 62.43 1wvo s VAL 49 Cb -0.14 -4.16 0.15 0.00 0.56 0.00 0.00 36.38 32.79 1wvo s VAL 49 CO 0.07 0.43 1.42 -0.07 -0.31 0.00 0.00 175.10 176.64 1wvo h LEU 50 N 4.08 0.00 -8.00 1.32 3.38 -1.31 -1.66 115.31 113.12 1wvo h LEU 50 Ca -0.46 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.34 1wvo h LEU 50 Cb 1.21 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1wvo h LEU 50 CO 0.68 0.04 -0.34 0.68 0.09 0.00 0.00 178.44 179.58 1wvo s VAL 51 N -3.21 0.09 -0.16 1.22 -7.23 -1.26 -4.83 120.40 105.02 1wvo s VAL 51 Ca 0.06 -1.33 -0.29 0.00 -1.81 0.00 0.00 61.98 58.61 1wvo s VAL 51 Cb 0.10 -1.68 -0.01 0.00 0.56 0.00 0.00 36.38 35.36 1wvo s VAL 51 CO 0.70 -0.42 1.09 -0.89 -0.31 0.00 0.00 175.10 175.28 1wvo s THR 52 N -3.93 4.58 -0.09 5.32 2.01 -1.26 -3.72 115.64 118.54 1wvo s THR 52 Ca 0.13 1.89 -0.02 0.00 0.31 0.00 0.00 61.69 64.00 1wvo s THR 52 Cb 0.04 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 1wvo s THR 52 CO -0.04 -0.09 0.01 -0.69 -0.69 0.00 0.00 174.62 173.12 1wvo s VAL 53 N 2.75 4.37 0.81 3.82 1.01 0.07 -4.88 120.40 128.35 1wvo s VAL 53 Ca 0.49 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 62.17 1wvo s VAL 53 Cb -0.19 -2.85 0.14 0.00 0.00 0.00 0.00 36.38 33.49 1wvo s VAL 53 CO 0.13 0.60 1.12 -1.61 0.00 0.00 0.00 175.10 175.34 1wvo s GLU 54 N -0.80 1.40 0.14 2.72 2.02 -1.26 -0.36 118.70 122.56 1wvo s GLU 54 Ca 0.12 -0.67 -0.30 0.00 0.02 0.00 0.00 54.97 54.14 1wvo s GLU 54 Cb -0.11 -2.12 -0.08 0.00 0.10 0.00 0.00 34.13 31.92 1wvo s GLU 54 CO 0.02 -1.76 1.28 -2.00 0.02 0.00 0.00 175.26 172.81 1wvo s GLU 55 N -5.44 4.41 0.00 1.61 2.12 -1.26 -2.66 118.70 117.47 1wvo s GLU 55 Ca 0.68 1.95 0.00 0.00 0.36 0.00 0.00 54.97 57.96 1wvo s GLU 55 Cb -0.06 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 31.08 1wvo s GLU 55 CO 0.48 -0.26 0.00 -0.25 -0.54 0.00 0.00 175.26 174.68 1wvo n ASP 56 N 3.25 -4.68 -4.80 -1.70 9.92 0.18 -4.92 116.55 113.81 1wvo n ASP 56 Ca 0.08 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 54.01 1wvo n ASP 56 Cb 0.44 -2.28 0.00 0.00 -0.64 0.00 0.00 41.12 38.65 1wvo n ASP 56 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1wvo s ASP 57 N -2.01 5.82 0.01 -2.24 2.15 -1.09 -4.68 116.67 114.63 1wvo s ASP 57 Ca 0.00 1.89 -0.30 0.00 0.43 0.00 0.00 52.55 54.57 1wvo s ASP 57 Cb 0.00 -2.54 -0.04 0.00 -0.30 0.00 0.00 42.92 40.04 1wvo s ASP 57 CO 0.00 -1.14 1.04 -0.89 -0.17 0.00 0.00 175.17 174.01 1wvo s THR 58 N -2.29 4.65 0.20 1.71 2.01 -1.26 -0.63 115.64 120.03 1wvo s THR 58 Ca 0.65 1.91 -0.12 0.00 0.31 0.00 0.00 61.69 64.44 1wvo s THR 58 Cb -0.17 -4.22 -0.07 0.00 0.01 0.00 0.00 72.50 68.05 1wvo s THR 58 CO 0.33 0.14 0.56 -0.63 -0.69 0.00 0.00 174.62 174.32 1wvo s ILE 59 N 1.12 4.89 0.11 1.82 -1.09 -0.83 -4.89 121.20 122.33 1wvo s ILE 59 Ca 0.53 0.63 -0.03 0.00 -2.23 0.00 0.00 60.65 59.55 1wvo s ILE 59 Cb -0.23 -3.66 -0.03 0.00 -1.58 0.00 0.00 42.46 36.96 1wvo s ILE 59 CO 0.28 0.05 0.09 -0.04 -1.23 0.00 0.00 174.94 174.09 1wvo s MET 60 N -2.49 0.89 0.49 2.79 -1.94 -1.26 -0.71 119.30 117.07 1wvo s MET 60 Ca 0.44 -1.29 0.23 0.00 -1.71 0.00 0.00 55.69 53.36 1wvo s MET 60 Cb -0.13 0.27 1.27 0.00 2.01 0.00 0.00 34.83 38.26 1wvo s MET 60 CO 0.20 -0.26 2.02 1.05 -0.01 0.00 0.00 175.02 178.03 1wvo h GLU 61 N 2.86 0.00 0.00 2.03 9.09 -1.96 -2.46 114.58 124.14 1wvo h GLU 61 Ca -0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.07 1wvo h GLU 61 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.29 1wvo h GLU 61 CO 0.58 0.16 0.00 0.39 0.05 0.00 0.00 179.01 180.19 1wvo n GLU 62 N -3.82 0.22 -0.18 1.06 1.02 -1.26 -3.16 120.64 114.53 1wvo n GLU 62 Ca -0.02 0.36 0.10 0.00 -0.02 0.00 0.00 57.16 57.59 1wvo n GLU 62 Cb 0.26 -1.86 0.27 0.00 -0.02 0.00 0.00 31.44 30.09 1wvo n GLU 62 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1wvo n LEU 63 N -2.27 2.58 -4.00 -4.62 4.77 -0.93 -4.87 117.00 107.67 1wvo n LEU 63 Ca 0.03 -1.17 -0.27 0.00 -0.03 0.00 0.00 56.01 54.58 1wvo n LEU 63 Cb 0.29 -0.23 -0.17 0.00 -2.33 0.00 0.00 43.42 40.98 1wvo n LEU 63 CO 0.23 0.59 -0.47 0.68 -1.33 0.00 0.00 177.39 177.09 1wvo s VAL 64 N -1.54 1.22 -0.62 4.08 -7.23 -1.19 -0.82 120.40 114.30 1wvo s VAL 64 Ca 0.35 -0.47 -0.27 0.00 -1.81 0.00 0.00 61.98 59.78 1wvo s VAL 64 Cb 0.19 -1.15 0.01 0.00 0.56 0.00 0.00 36.38 35.99 1wvo s VAL 64 CO 0.27 0.39 1.51 -0.62 -0.31 0.00 0.00 175.10 176.34 1wvo s ASP 65 N 1.10 5.89 -0.07 4.85 -1.08 -0.20 -4.89 116.67 122.27 1wvo s ASP 65 Ca -0.06 0.13 -0.30 0.00 -0.52 0.00 0.00 52.55 51.80 1wvo s ASP 65 Cb -0.14 -2.54 0.11 0.00 -1.46 0.00 0.00 42.92 38.89 1wvo s ASP 65 CO -0.02 -1.93 0.98 0.54 0.52 0.00 0.00 175.17 175.26 1wvo s ASN 66 N 5.32 -0.31 0.21 -0.34 6.03 -1.26 -4.23 114.94 120.35 1wvo s ASN 66 Ca 0.52 0.05 0.00 0.00 -1.03 0.00 0.00 52.86 52.40 1wvo s ASN 66 Cb -0.11 0.32 0.00 0.00 -3.03 0.00 0.00 41.25 38.43 1wvo s ASN 66 CO 0.21 -0.49 0.00 1.57 -2.03 0.00 0.00 177.10 176.36 1wvo n HIS 67 N -0.09 -2.36 0.00 1.54 -0.00 -1.26 -5.14 115.22 107.90 1wvo n HIS 67 Ca -0.07 0.53 0.00 0.00 0.46 0.00 0.00 57.72 58.64 1wvo n HIS 67 Cb 0.60 1.31 0.00 0.00 -0.12 0.00 0.00 29.99 31.78 1wvo n HIS 67 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1wvo n GLY 68 N 0.42 0.73 1.79 1.57 0.00 -1.26 -5.09 105.19 103.34 1wvo n GLY 68 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1wvo n GLY 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wvo n LYS 69 N 0.00 0.00 0.26 1.61 3.00 -1.26 -4.86 118.16 116.92 1wvo n LYS 69 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 58.31 58.46 1wvo n LYS 69 Cb 0.00 -0.11 0.63 0.00 0.00 0.00 0.00 35.03 35.55 1wvo n LYS 69 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1wvo h LYS 70 N 0.00 0.00 -4.57 1.64 1.57 -2.07 -3.43 116.57 109.70 1wvo h LYS 70 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 1wvo h LYS 70 Cb 0.06 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.17 1wvo h LYS 70 CO 0.00 0.06 -0.72 0.42 -0.57 0.00 0.00 179.45 178.63 1wvo s ILE 71 N -3.68 0.57 0.40 1.86 1.09 -1.26 -5.18 121.20 115.00 1wvo s ILE 71 Ca 0.01 -1.29 0.04 0.00 -1.10 0.00 0.00 60.65 58.31 1wvo s ILE 71 Cb 0.09 -0.87 -0.05 0.00 -1.06 0.00 0.00 42.46 40.57 1wvo s ILE 71 CO 0.57 -0.51 0.04 -1.59 -0.10 0.00 0.00 174.94 173.35 1wvo s LYS 72 N -2.14 1.90 -0.71 2.79 -2.85 -1.26 -4.71 119.74 112.75 1wvo s LYS 72 Ca -0.05 -2.11 -0.26 0.00 -1.00 0.00 0.00 55.97 52.55 1wvo s LYS 72 Cb -0.06 -1.21 -0.03 0.00 -2.06 0.00 0.00 37.83 34.47 1wvo s LYS 72 CO -0.01 -0.22 1.85 -1.54 0.10 0.00 0.00 175.35 175.54 1wvo s SER 73 N -3.65 5.30 0.64 0.03 1.04 -1.26 -4.99 113.70 110.80 1wvo s SER 73 Ca 0.28 -0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.65 1wvo s SER 73 Cb 0.07 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.70 1wvo s SER 73 CO 0.14 -2.45 0.91 -0.94 0.98 0.00 0.00 173.24 171.89 1wvo s SER 74 N 7.83 5.04 0.26 7.02 1.04 -1.26 -4.83 113.70 128.80 1wvo s SER 74 Ca 0.66 0.29 0.00 0.00 0.48 0.00 0.00 55.95 57.38 1wvo s SER 74 Cb -0.10 -1.06 0.00 0.00 0.10 0.00 0.00 66.02 64.96 1wvo s SER 74 CO 0.13 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.58 1wvo n GLY 75 N -2.67 -1.79 0.27 7.32 0.00 -1.26 -4.04 105.19 103.01 1wvo n GLY 75 Ca 0.08 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1wvo n GLY 75 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wvo n PRO 76 N -0.50 0.39 -0.89 1.61 -0.04 -1.26 -4.79 135.00 129.52 1wvo n PRO 76 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1wvo n PRO 76 Cb 0.00 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1wvo n PRO 76 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1wvo n SER 77 N -0.07 -1.36 -4.59 3.54 7.64 -1.26 -5.00 113.62 112.53 1wvo n SER 77 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 1wvo n SER 77 Cb 0.05 -1.08 -0.08 0.00 -1.01 0.00 0.00 64.21 62.09 1wvo n SER 77 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wvo s SER 78 N -2.44 4.32 0.00 6.43 0.15 -1.26 -5.11 113.70 115.80 1wvo s SER 78 Ca 0.00 -0.65 0.00 0.00 0.70 0.00 0.00 55.95 56.00 1wvo s SER 78 Cb 0.00 -0.74 0.00 0.00 -1.71 0.00 0.00 66.02 63.57 1wvo s SER 78 CO 0.00 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.10