#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvo s SER 2 N 0.00 3.60 -0.08 1.61 1.04 -1.26 -5.10 113.70 113.51 1wvo s SER 2 Ca 0.00 0.80 -0.10 0.00 0.48 0.00 0.00 55.95 57.13 1wvo s SER 2 Cb 0.00 -1.26 0.02 0.00 0.10 0.00 0.00 66.02 64.88 1wvo s SER 2 CO 0.00 -2.48 0.25 -0.94 0.98 0.00 0.00 173.24 171.06 1wvo s SER 3 N -4.30 -0.23 -0.22 7.02 1.04 -1.26 -5.14 113.70 110.62 1wvo s SER 3 Ca 0.65 0.39 -0.05 0.00 0.48 0.00 0.00 55.95 57.43 1wvo s SER 3 Cb -0.12 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.46 1wvo s SER 3 CO 0.52 -0.17 -0.01 -0.83 0.98 0.00 0.00 173.24 173.73 1wvo s GLY 4 N -0.21 1.66 -0.20 7.32 0.00 -1.26 -5.08 107.32 109.55 1wvo s GLY 4 Ca -0.03 -1.13 -0.05 0.00 0.00 0.00 0.00 44.72 43.51 1wvo s GLY 4 CO 0.01 0.41 0.12 -0.56 0.00 0.00 0.00 173.10 173.08 1wvo s SER 5 N 1.42 2.43 0.03 1.64 0.01 -1.26 -5.14 113.70 112.83 1wvo s SER 5 Ca 0.05 -0.69 -0.00 0.00 1.31 0.00 0.00 55.95 56.62 1wvo s SER 5 Cb -0.14 -0.18 -0.03 0.00 0.21 0.00 0.00 66.02 65.88 1wvo s SER 5 CO -0.01 -0.36 -0.03 -0.94 0.41 0.00 0.00 173.24 172.31 1wvo s SER 6 N 2.16 0.37 0.00 2.44 1.04 -1.26 -5.04 113.70 113.41 1wvo s SER 6 Ca 0.04 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1wvo s SER 6 Cb -0.16 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.10 1wvo s SER 6 CO -0.15 -0.43 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1wvo n GLY 7 N 0.94 -0.62 3.02 7.32 0.00 -1.26 -0.84 105.19 113.76 1wvo n GLY 7 Ca -0.20 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 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 0.49 -0.06 1.61 1.04 -0.79 -3.96 113.70 108.03 1wvo s SER 8 Ca 0.00 -0.58 -0.30 0.00 0.48 0.00 0.00 55.95 55.56 1wvo s SER 8 Cb 0.00 0.09 -0.03 0.00 0.10 0.00 0.00 66.02 66.18 1wvo s SER 8 CO 0.00 -0.30 1.15 -0.69 0.98 0.00 0.00 173.24 174.38 1wvo s VAL 9 N -1.71 4.38 0.17 5.02 1.01 -0.91 -0.48 120.40 127.88 1wvo s VAL 9 Ca -0.11 1.70 0.09 0.00 0.00 0.00 0.00 61.98 63.65 1wvo s VAL 9 Cb -0.08 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1wvo s VAL 9 CO -0.01 0.02 -0.18 0.68 0.00 0.00 0.00 175.10 175.60 1wvo s VAL 10 N 2.03 1.85 -0.08 2.92 -7.23 -0.09 -2.98 120.40 116.81 1wvo s VAL 10 Ca 0.54 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 1wvo s VAL 10 Cb -0.23 -1.88 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 1wvo s VAL 10 CO 0.22 -0.34 1.69 0.00 -0.31 0.00 0.00 175.10 176.36 1wvo s ALA 11 N -2.14 3.52 0.27 1.32 0.00 0.20 -1.57 121.76 123.36 1wvo s ALA 11 Ca 0.17 0.87 0.18 0.00 0.00 0.00 0.00 51.96 53.18 1wvo s ALA 11 Cb -0.05 -3.78 0.78 0.00 0.00 0.00 0.00 23.12 20.06 1wvo s ALA 11 CO 0.07 -1.56 1.80 -0.22 0.00 0.00 0.00 175.76 175.84 1wvo h LYS 12 N 10.04 0.00 -3.65 0.00 3.64 -1.33 0.35 116.57 125.62 1wvo h LYS 12 Ca -0.39 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 58.93 1wvo h LYS 12 Cb 1.18 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.91 1wvo h LYS 12 CO 0.96 0.36 -0.12 0.14 -2.27 0.00 0.00 179.45 178.52 1wvo s VAL 13 N -3.85 0.00 0.29 2.00 -7.23 -1.26 -4.66 120.40 105.69 1wvo s VAL 13 Ca -0.01 -1.40 -0.30 0.00 -1.81 0.00 0.00 61.98 58.46 1wvo s VAL 13 Cb 0.12 -2.18 -0.11 0.00 0.56 0.00 0.00 36.38 34.77 1wvo s VAL 13 CO 0.69 -0.01 1.57 -0.75 -0.31 0.00 0.00 175.10 176.29 1wvo s LYS 14 N -4.01 4.14 -0.20 4.82 2.20 -1.26 -4.02 119.74 121.40 1wvo s LYS 14 Ca 0.22 2.54 0.01 0.00 -0.36 0.00 0.00 55.97 58.38 1wvo s LYS 14 Cb -0.01 -3.03 0.04 0.00 -1.51 0.00 0.00 37.83 33.32 1wvo s LYS 14 CO 0.09 -0.60 -0.12 0.42 -0.36 0.00 0.00 175.35 174.78 1wvo s ILE 15 N -0.04 1.77 0.45 5.43 1.01 -0.35 -4.91 121.20 124.57 1wvo s ILE 15 Ca 0.62 -1.08 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1wvo s ILE 15 Cb -0.47 -1.81 -0.07 0.00 0.01 0.00 0.00 42.46 40.12 1wvo s ILE 15 CO 0.48 0.20 1.20 -2.16 0.00 0.00 0.00 174.94 174.67 1wvo s PRO 16 N 1.34 3.77 0.52 2.79 0.04 -1.26 -1.27 135.00 140.93 1wvo s PRO 16 Ca -0.01 1.89 -0.22 0.00 0.04 0.00 0.00 61.00 62.69 1wvo s PRO 16 Cb -0.16 -2.49 -0.06 0.00 0.04 0.00 0.00 34.50 31.83 1wvo s PRO 16 CO -0.08 -0.57 1.21 -1.91 0.04 0.00 0.00 177.00 175.68 1wvo n GLU 17 N -0.36 1.51 -0.73 4.56 2.13 -1.26 -2.73 120.64 123.76 1wvo n GLU 17 Ca 0.07 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.44 1wvo n GLU 17 Cb 0.47 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.80 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 0.94 0.87 3.91 8.31 0.00 -1.26 -4.96 105.19 113.00 1wvo n GLY 18 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.46 5.01 -0.10 2.61 2.01 -1.11 -4.84 115.64 115.76 1wvo s THR 19 Ca 0.00 0.07 -0.20 0.00 0.31 0.00 0.00 61.69 61.87 1wvo s THR 19 Cb 0.00 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.72 1wvo s THR 19 CO 0.00 -0.38 0.56 -0.63 -0.69 0.00 0.00 174.62 173.48 1wvo s ILE 20 N -2.16 5.13 0.58 1.82 -1.09 -1.26 -2.05 121.20 122.17 1wvo s ILE 20 Ca 0.44 1.15 -0.18 0.00 -2.23 0.00 0.00 60.65 59.83 1wvo s ILE 20 Cb -0.11 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 1wvo s ILE 20 CO 0.31 0.30 1.11 -0.76 -1.23 0.00 0.00 174.94 174.68 1wvo s LEU 21 N 0.67 3.62 0.10 2.97 1.43 0.32 -4.90 118.68 122.89 1wvo s LEU 21 Ca 0.30 2.08 -0.02 0.00 -1.03 0.00 0.00 54.13 55.47 1wvo s LEU 21 Cb -0.16 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.45 1wvo s LEU 21 CO 0.13 -1.34 0.04 0.42 0.23 0.00 0.00 176.35 175.84 1wvo s THR 22 N -2.01 0.14 0.20 5.49 -4.23 -1.26 -1.05 115.64 112.92 1wvo s THR 22 Ca 0.70 -1.82 -0.09 0.00 -1.18 0.00 0.00 61.69 59.30 1wvo s THR 22 Cb -0.22 -1.82 0.13 0.00 1.34 0.00 0.00 72.50 71.94 1wvo s THR 22 CO 0.32 -0.66 1.75 0.24 -0.54 0.00 0.00 174.62 175.74 1wvo h MET 23 N 2.95 1.14 -0.29 3.99 2.86 -1.95 -2.86 114.93 120.77 1wvo h MET 23 Ca -0.34 -0.22 0.07 0.00 -2.06 0.00 0.00 59.70 57.14 1wvo h MET 23 Cb 1.18 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 1wvo h MET 23 CO 0.61 0.95 0.20 0.22 1.06 0.00 0.00 176.91 179.95 1wvo h ASP 24 N 1.09 0.08 -0.64 1.22 3.58 -2.02 -2.10 116.42 117.62 1wvo h ASP 24 Ca 0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.70 1wvo h ASP 24 Cb 0.26 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.29 1wvo h ASP 24 CO -0.01 0.05 0.00 0.23 -2.88 0.00 0.00 179.24 176.63 1wvo n MET 25 N -4.47 3.54 -4.79 0.28 2.81 -1.09 -4.90 117.12 108.50 1wvo n MET 25 Ca 0.03 -2.83 -0.25 0.00 -1.81 0.00 0.00 57.70 52.84 1wvo n MET 25 Cb 0.30 -1.82 -0.16 0.00 -0.71 0.00 0.00 33.22 30.83 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 -1.71 1.94 -0.02 4.03 1.43 -0.79 -0.92 118.68 122.63 1wvo s LEU 26 Ca 0.50 -0.33 -0.00 0.00 -1.03 0.00 0.00 54.13 53.27 1wvo s LEU 26 Cb 0.31 -0.91 0.03 0.00 0.03 0.00 0.00 46.19 45.65 1wvo s LEU 26 CO 0.25 0.16 0.04 0.28 0.23 0.00 0.00 176.35 177.32 1wvo s THR 27 N -0.07 -0.05 -0.16 5.49 -1.32 -0.61 -4.76 115.64 114.15 1wvo s THR 27 Ca -0.01 0.19 -0.20 0.00 -1.21 0.00 0.00 61.69 60.46 1wvo s THR 27 Cb -0.10 -0.09 -0.03 0.00 -1.51 0.00 0.00 72.50 70.77 1wvo s THR 27 CO 0.01 0.08 0.58 0.68 -2.21 0.00 0.00 174.62 173.76 1wvo s VAL 28 N 0.96 5.08 -0.57 5.08 -7.23 -1.26 -0.91 120.40 121.55 1wvo s VAL 28 Ca -0.08 1.11 -0.25 0.00 -1.81 0.00 0.00 61.98 60.95 1wvo s VAL 28 Cb -0.11 -3.90 0.04 0.00 0.56 0.00 0.00 36.38 32.96 1wvo s VAL 28 CO -0.03 0.19 1.02 -0.54 -0.31 0.00 0.00 175.10 175.43 1wvo s LYS 29 N 1.43 3.36 0.46 4.82 1.02 0.37 -4.86 119.74 126.33 1wvo s LYS 29 Ca 0.28 -0.17 -0.25 0.00 0.02 0.00 0.00 55.97 55.85 1wvo s LYS 29 Cb -0.16 -4.06 -0.08 0.00 -0.52 0.00 0.00 37.83 33.01 1wvo s LYS 29 CO 0.11 -1.58 1.41 1.55 -0.92 0.00 0.00 175.35 175.92 1wvo n VAL 30 N 6.30 2.87 0.00 3.17 3.14 -1.26 -1.89 118.33 130.67 1wvo n VAL 30 Ca 0.03 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.91 1wvo n VAL 30 Cb 0.48 -1.80 0.00 0.00 -1.06 0.00 0.00 33.84 31.46 1wvo n VAL 30 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wvo n GLY 31 N 0.62 0.77 3.28 7.55 0.00 -0.02 -4.88 105.19 112.51 1wvo n GLY 31 Ca 0.06 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 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 1.12 0.00 1.61 -1.05 -1.26 -4.61 118.70 114.51 1wvo s GLU 32 Ca 0.00 -1.19 0.00 0.00 -0.15 0.00 0.00 54.97 53.63 1wvo s GLU 32 Cb 0.00 -1.32 0.00 0.00 -0.44 0.00 0.00 34.13 32.37 1wvo s GLU 32 CO 0.00 0.30 0.84 -0.35 0.95 0.00 0.00 175.26 177.00 1wvo n PRO 33 N 0.95 0.89 -2.58 -4.83 -0.04 -1.25 -2.80 135.00 125.34 1wvo n PRO 33 Ca -0.18 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.86 1wvo n PRO 33 Cb 0.54 -1.10 -0.03 0.00 -0.04 0.00 0.00 33.50 32.87 1wvo n PRO 33 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1wvo s LYS 34 N -0.02 3.47 0.00 0.54 2.20 -1.26 -4.72 119.74 119.94 1wvo s LYS 34 Ca 0.00 -0.89 0.00 0.00 -0.36 0.00 0.00 55.97 54.72 1wvo s LYS 34 Cb 0.00 -4.99 0.00 0.00 -1.51 0.00 0.00 37.83 31.33 1wvo s LYS 34 CO 0.00 -2.17 0.00 0.41 -0.36 0.00 0.00 175.35 173.23 1wvo n GLY 35 N 6.38 0.55 3.78 5.54 0.00 -1.26 -4.73 105.19 115.46 1wvo n GLY 35 Ca 0.24 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 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 -4.00 3.87 0.27 1.61 6.14 -1.26 -4.94 117.35 119.05 1wvo s TYR 36 Ca 0.00 1.58 -0.30 0.00 0.64 0.00 0.00 57.07 58.99 1wvo s TYR 36 Cb 0.00 -2.73 -0.13 0.00 0.42 0.00 0.00 41.96 39.52 1wvo s TYR 36 CO 0.00 0.50 1.40 -0.35 0.64 0.00 0.00 175.55 177.74 1wvo n PRO 37 N 1.50 2.14 0.03 4.97 -0.04 -1.26 -2.15 135.00 140.18 1wvo n PRO 37 Ca -0.06 0.76 0.11 0.00 -0.04 0.00 0.00 63.50 64.27 1wvo n PRO 37 Cb 0.49 -2.41 0.47 0.00 -0.04 0.00 0.00 33.50 32.01 1wvo n PRO 37 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1wvo n PRO 38 N 1.70 0.05 0.04 0.54 -0.04 -1.26 -3.34 135.00 132.69 1wvo n PRO 38 Ca 0.10 0.15 -0.22 0.00 -0.04 0.00 0.00 63.50 63.49 1wvo n PRO 38 Cb 0.33 -1.57 -0.14 0.00 -0.04 0.00 0.00 33.50 32.08 1wvo n PRO 38 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1wvo h GLU 39 N 0.00 0.33 0.00 0.54 4.11 -1.94 -3.34 114.58 114.28 1wvo h GLU 39 Ca 0.00 -0.56 0.00 0.00 0.07 0.00 0.00 59.36 58.87 1wvo h GLU 39 Cb 0.43 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1wvo h GLU 39 CO 0.00 1.27 0.00 -0.25 0.07 0.00 0.00 179.01 180.10 1wvo n ASP 40 N -3.54 0.00 -0.34 3.06 9.92 -1.21 -4.12 116.55 120.32 1wvo n ASP 40 Ca -0.29 -1.04 0.25 0.00 -0.53 0.00 0.00 54.79 53.18 1wvo n ASP 40 Cb 1.06 0.00 0.50 0.00 -0.64 0.00 0.00 41.12 42.04 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 0.00 0.28 -0.66 0.53 2.10 -1.69 -0.49 117.51 117.58 1wvo h ILE 41 Ca 0.00 -0.10 0.18 0.00 1.08 0.00 0.00 64.86 66.02 1wvo h ILE 41 Cb 0.00 -0.04 -0.03 0.00 -1.09 0.00 0.00 36.82 35.66 1wvo h ILE 41 CO 0.00 0.05 0.47 -0.26 -1.08 0.00 0.00 178.15 177.33 1wvo h PHE 42 N 0.29 0.07 -0.02 2.19 -1.00 -1.90 -1.07 116.94 115.50 1wvo h PHE 42 Ca 0.74 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 61.39 1wvo h PHE 42 Cb 1.77 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 41.32 1wvo h PHE 42 CO -0.01 0.02 -0.50 -0.91 -1.61 0.00 0.00 178.31 175.31 1wvo h ASN 43 N 0.06 0.47 -0.79 2.17 2.35 -1.43 -3.27 115.58 115.14 1wvo h ASN 43 Ca 0.32 -0.74 0.07 0.00 -0.55 0.00 0.00 56.30 55.39 1wvo h ASN 43 Cb 1.18 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 39.35 1wvo h ASN 43 CO -0.02 1.14 0.47 -0.07 -1.65 0.00 0.00 177.43 177.30 1wvo h LEU 44 N -0.17 0.71 -8.88 1.61 3.38 -1.30 -3.37 115.31 107.29 1wvo h LEU 44 Ca -0.06 0.03 -0.56 0.00 0.09 0.00 0.00 57.88 57.38 1wvo h LEU 44 Cb 1.21 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1wvo h LEU 44 CO 0.10 0.44 1.52 -0.69 0.09 0.00 0.00 178.44 179.90 1wvo s VAL 45 N -6.07 3.03 0.00 1.22 1.01 -0.81 -0.81 120.40 117.97 1wvo s VAL 45 Ca -0.13 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1wvo s VAL 45 Cb 0.18 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.51 1wvo s VAL 45 CO 0.78 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.45 1wvo n GLY 46 N 5.81 1.84 3.83 4.51 0.00 -0.22 -4.95 105.19 116.02 1wvo n GLY 46 Ca 0.31 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.41 3.37 -0.11 1.61 1.02 0.01 -4.61 119.74 120.62 1wvo s LYS 47 Ca 0.00 0.98 -0.09 0.00 0.02 0.00 0.00 55.97 56.88 1wvo s LYS 47 Cb 0.00 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 1wvo s LYS 47 CO 0.00 -0.75 0.19 0.21 -0.92 0.00 0.00 175.35 174.08 1wvo s LYS 48 N -4.61 3.67 1.09 1.68 2.20 -1.26 -0.52 119.74 122.00 1wvo s LYS 48 Ca 0.59 -0.04 -0.14 0.00 -0.36 0.00 0.00 55.97 56.02 1wvo s LYS 48 Cb -0.13 -3.24 0.24 0.00 -1.51 0.00 0.00 37.83 33.18 1wvo s LYS 48 CO 0.45 0.66 1.08 0.14 -0.36 0.00 0.00 175.35 177.32 1wvo s VAL 49 N -0.75 1.90 -0.15 4.02 -7.23 -0.87 -0.51 120.40 116.80 1wvo s VAL 49 Ca 0.16 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.36 1wvo s VAL 49 Cb -0.13 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1wvo s VAL 49 CO 0.05 0.00 0.15 0.18 -0.31 0.00 0.00 175.10 175.17 1wvo n LEU 50 N -4.49 0.15 -3.86 1.32 4.77 0.11 -4.18 117.00 110.81 1wvo n LEU 50 Ca 0.06 -0.43 -0.09 0.00 -0.03 0.00 0.00 56.01 55.52 1wvo n LEU 50 Cb 0.57 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.62 1wvo n LEU 50 CO 0.55 0.04 0.20 0.68 -1.33 0.00 0.00 177.39 177.53 1wvo s VAL 51 N -1.48 0.02 0.19 4.08 -7.23 -1.26 -4.91 120.40 109.82 1wvo s VAL 51 Ca 0.01 -1.09 -0.30 0.00 -1.81 0.00 0.00 61.98 58.79 1wvo s VAL 51 Cb 0.03 -1.84 -0.08 0.00 0.56 0.00 0.00 36.38 35.05 1wvo s VAL 51 CO 0.16 -0.11 1.14 -0.89 -0.31 0.00 0.00 175.10 175.09 1wvo s THR 52 N -3.94 3.69 0.14 5.32 2.01 -1.26 -4.14 115.64 117.46 1wvo s THR 52 Ca 0.15 1.47 0.10 0.00 0.31 0.00 0.00 61.69 63.72 1wvo s THR 52 Cb -0.00 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 1wvo s THR 52 CO 0.02 0.26 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.26 1wvo s VAL 53 N -0.26 2.16 0.39 3.82 1.01 -0.40 -4.91 120.40 122.20 1wvo s VAL 53 Ca 0.50 -1.77 0.08 0.00 0.00 0.00 0.00 61.98 60.79 1wvo s VAL 53 Cb -0.31 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1wvo s VAL 53 CO 0.36 0.02 0.34 -1.61 0.00 0.00 0.00 175.10 174.21 1wvo s GLU 54 N -2.15 2.58 0.54 2.72 2.02 -1.26 -1.21 118.70 121.93 1wvo s GLU 54 Ca 0.14 -1.46 -0.21 0.00 0.02 0.00 0.00 54.97 53.45 1wvo s GLU 54 Cb -0.10 -2.39 -0.05 0.00 0.10 0.00 0.00 34.13 31.69 1wvo s GLU 54 CO 0.06 -0.09 1.23 -2.00 0.02 0.00 0.00 175.26 174.49 1wvo s GLU 55 N -4.07 3.28 0.00 1.61 2.12 -1.26 -2.71 118.70 117.67 1wvo s GLU 55 Ca 0.45 1.91 0.00 0.00 0.36 0.00 0.00 54.97 57.69 1wvo s GLU 55 Cb -0.04 -2.17 0.00 0.00 0.26 0.00 0.00 34.13 32.19 1wvo s GLU 55 CO 0.27 -0.98 0.00 -0.25 -0.54 0.00 0.00 175.26 173.76 1wvo n ASP 56 N -1.09 0.00 -4.74 -1.70 8.00 0.11 -4.93 116.55 112.21 1wvo n ASP 56 Ca 0.11 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.26 1wvo n ASP 56 Cb 0.48 -0.71 0.06 0.00 -0.02 0.00 0.00 41.12 40.93 1wvo n ASP 56 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1wvo s ASP 57 N -3.01 4.74 -0.72 -2.24 2.15 -1.10 -4.61 116.67 111.88 1wvo s ASP 57 Ca 0.00 2.32 -0.24 0.00 0.43 0.00 0.00 52.55 55.06 1wvo s ASP 57 Cb 0.00 -2.59 0.05 0.00 -0.30 0.00 0.00 42.92 40.09 1wvo s ASP 57 CO 0.00 -1.89 1.14 -0.89 -0.17 0.00 0.00 175.17 173.36 1wvo s THR 58 N -1.87 4.04 -0.76 1.71 2.01 -1.26 -0.63 115.64 118.88 1wvo s THR 58 Ca 0.75 -0.07 -0.25 0.00 0.31 0.00 0.00 61.69 62.42 1wvo s THR 58 Cb -0.29 -4.82 -0.06 0.00 0.01 0.00 0.00 72.50 67.35 1wvo s THR 58 CO 0.40 -1.67 2.04 -0.63 -0.69 0.00 0.00 174.62 174.07 1wvo s ILE 59 N 4.84 3.31 0.33 1.82 -1.09 -1.16 -4.95 121.20 124.29 1wvo s ILE 59 Ca 0.30 -0.12 0.02 0.00 -2.23 0.00 0.00 60.65 58.62 1wvo s ILE 59 Cb -0.12 -3.73 -0.03 0.00 -1.58 0.00 0.00 42.46 37.01 1wvo s ILE 59 CO 0.11 -0.69 0.51 -0.04 -1.23 0.00 0.00 174.94 173.60 1wvo s MET 60 N 7.45 3.39 0.63 2.79 -1.94 -1.26 -3.99 119.30 126.37 1wvo s MET 60 Ca 0.76 -0.51 0.38 0.00 -1.71 0.00 0.00 55.69 54.60 1wvo s MET 60 Cb -0.10 -2.72 2.13 0.00 2.01 0.00 0.00 34.83 36.15 1wvo s MET 60 CO 0.09 0.16 2.31 1.05 -0.01 0.00 0.00 175.02 178.62 1wvo h GLU 61 N 0.82 0.00 0.00 2.03 4.11 -1.94 -1.26 114.58 118.35 1wvo h GLU 61 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 1wvo h GLU 61 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1wvo h GLU 61 CO 0.60 0.00 0.00 1.05 0.07 0.00 0.00 179.01 180.73 1wvo h GLU 62 N 0.00 0.00 -0.65 1.06 4.11 -1.97 -3.21 114.58 113.91 1wvo h GLU 62 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1wvo h GLU 62 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1wvo h GLU 62 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.36 1wvo n LEU 63 N -2.46 3.74 -4.14 3.06 4.77 -0.47 -4.93 117.00 116.57 1wvo n LEU 63 Ca 0.03 -1.83 -0.17 0.00 -0.03 0.00 0.00 56.01 54.02 1wvo n LEU 63 Cb 0.35 -0.43 -0.12 0.00 -2.33 0.00 0.00 43.42 40.89 1wvo n LEU 63 CO 0.26 0.91 -0.44 0.68 -1.33 0.00 0.00 177.39 177.47 1wvo s VAL 64 N -1.13 0.98 0.31 4.08 -7.23 -1.22 -0.71 120.40 115.48 1wvo s VAL 64 Ca 0.46 -1.24 0.06 0.00 -1.81 0.00 0.00 61.98 59.46 1wvo s VAL 64 Cb 0.24 -0.96 -0.01 0.00 0.56 0.00 0.00 36.38 36.21 1wvo s VAL 64 CO 0.32 -0.25 0.44 -0.62 -0.31 0.00 0.00 175.10 174.68 1wvo s ASP 65 N -1.67 6.02 0.30 4.85 -1.08 0.33 -4.84 116.67 120.57 1wvo s ASP 65 Ca -0.04 -0.15 -0.29 0.00 -0.52 0.00 0.00 52.55 51.56 1wvo s ASP 65 Cb -0.10 -1.36 -0.10 0.00 -1.46 0.00 0.00 42.92 39.91 1wvo s ASP 65 CO 0.02 -0.35 1.18 0.21 0.52 0.00 0.00 175.17 176.75 1wvo s ASN 66 N -4.12 7.08 0.00 -0.34 3.84 -1.26 -4.00 114.94 116.13 1wvo s ASN 66 Ca 0.42 2.43 0.16 0.00 0.21 0.00 0.00 52.86 56.08 1wvo s ASN 66 Cb -0.09 -2.64 0.94 0.00 -0.55 0.00 0.00 41.25 38.91 1wvo s ASN 66 CO 0.30 -0.29 1.35 1.57 -2.79 0.00 0.00 177.10 177.24 1wvo n HIS 67 N 1.04 0.00 -0.86 0.43 -0.00 -1.26 -4.73 115.22 109.84 1wvo n HIS 67 Ca -0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.42 1wvo n HIS 67 Cb 0.44 -0.00 0.18 0.00 -0.00 0.00 0.00 29.99 30.61 1wvo n HIS 67 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 1wvo s GLY 68 N -2.00 1.61 0.00 1.57 0.00 -1.26 -4.95 107.32 102.28 1wvo s GLY 68 Ca 0.23 0.07 0.21 0.00 0.00 0.00 0.00 44.72 45.23 1wvo s GLY 68 CO 0.18 0.62 1.46 0.58 0.00 0.00 0.00 173.10 175.94 1wvo n LYS 69 N -4.33 2.10 -0.78 2.90 2.85 -1.26 -4.98 118.16 114.66 1wvo n LYS 69 Ca 0.07 -1.67 -0.32 0.00 -1.05 0.00 0.00 58.31 55.35 1wvo n LYS 69 Cb 0.54 -1.44 0.16 0.00 -0.65 0.00 0.00 35.03 33.64 1wvo n LYS 69 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1wvo n LYS 70 N 0.88 -0.31 -2.06 -1.58 3.00 -1.26 -5.02 118.16 111.81 1wvo n LYS 70 Ca 0.17 -0.02 -0.28 0.00 -0.00 0.00 0.00 58.31 58.18 1wvo n LYS 70 Cb 0.45 -2.38 0.06 0.00 0.00 0.00 0.00 35.03 33.16 1wvo n LYS 70 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1wvo s ILE 71 N -2.51 2.83 0.69 3.15 -4.36 -1.26 -5.04 121.20 114.70 1wvo s ILE 71 Ca 0.68 0.08 -0.17 0.00 -0.26 0.00 0.00 60.65 60.99 1wvo s ILE 71 Cb -0.24 -3.23 0.01 0.00 1.25 0.00 0.00 42.46 40.24 1wvo s ILE 71 CO 0.56 -0.28 1.27 -0.75 0.24 0.00 0.00 174.94 175.99 1wvo s LYS 72 N -5.32 2.32 0.26 0.37 2.20 -1.26 -5.03 119.74 113.29 1wvo s LYS 72 Ca 0.59 1.99 -0.14 0.00 -0.36 0.00 0.00 55.97 58.05 1wvo s LYS 72 Cb -0.11 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.39 1wvo s LYS 72 CO 0.48 -1.75 0.53 0.45 -0.36 0.00 0.00 175.35 174.70 1wvo s SER 73 N -1.58 -0.09 -1.01 1.43 0.15 -1.26 -5.05 113.70 106.29 1wvo s SER 73 Ca 0.80 -0.89 -0.08 0.00 0.70 0.00 0.00 55.95 56.48 1wvo s SER 73 Cb -0.35 0.62 -0.13 0.00 -1.71 0.00 0.00 66.02 64.45 1wvo s SER 73 CO 0.42 -1.20 2.97 -1.54 1.20 0.00 0.00 173.24 175.09 1wvo n SER 74 N -0.46 6.98 -1.93 5.45 3.41 -1.26 -4.50 113.62 121.31 1wvo n SER 74 Ca -0.02 -2.48 -0.03 0.00 -0.26 0.00 0.00 58.87 56.08 1wvo n SER 74 Cb 0.61 -1.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 1wvo n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wvo n GLY 75 N 3.28 -0.91 0.17 5.00 0.00 -1.26 -4.93 105.19 106.55 1wvo n GLY 75 Ca 0.62 0.33 0.13 0.00 0.00 0.00 0.00 46.02 47.09 1wvo n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wvo h PRO 76 N 0.64 0.00 -2.93 1.61 0.13 -1.98 -3.45 132.00 126.01 1wvo h PRO 76 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.18 1wvo h PRO 76 Cb 0.31 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.41 1wvo h PRO 76 CO 0.06 0.00 0.28 -1.12 -0.23 0.00 0.00 178.00 176.99 1wvo s SER 77 N -4.53 -0.14 -0.24 1.44 0.01 -1.26 -5.14 113.70 103.83 1wvo s SER 77 Ca 0.02 -0.80 0.01 0.00 1.31 0.00 0.00 55.95 56.49 1wvo s SER 77 Cb 0.09 0.75 0.04 0.00 0.21 0.00 0.00 66.02 67.11 1wvo s SER 77 CO 0.40 -1.43 -0.11 -0.44 0.41 0.00 0.00 173.24 172.07 1wvo s SER 78 N -3.00 4.14 0.00 2.44 0.01 -1.26 -5.16 113.70 110.87 1wvo s SER 78 Ca 0.13 -1.05 0.25 0.00 1.31 0.00 0.00 55.95 56.59 1wvo s SER 78 Cb -0.05 -1.58 0.49 0.00 0.21 0.00 0.00 66.02 65.09 1wvo s SER 78 CO 0.08 -0.13 1.43 0.61 0.41 0.00 0.00 173.24 175.64