#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 2.31 -4.75 1.61 7.64 -1.26 -5.07 113.62 114.11 1wvo n SER 2 Ca 0.00 -2.97 -0.39 0.00 1.01 0.00 0.00 58.87 56.52 1wvo n SER 2 Cb 0.00 -0.38 0.04 0.00 -1.01 0.00 0.00 64.21 62.85 1wvo n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wvo n SER 3 N -1.33 2.85 0.00 6.43 7.64 -1.26 -4.95 113.62 123.00 1wvo n SER 3 Ca 0.14 1.02 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1wvo n SER 3 Cb 0.60 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.21 1wvo n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wvo n GLY 4 N 0.71 0.11 3.65 0.23 0.00 -1.26 -5.16 105.19 103.47 1wvo n GLY 4 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 1wvo n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wvo s SER 5 N -3.28 0.47 0.13 1.61 1.04 -1.26 -5.19 113.70 107.22 1wvo s SER 5 Ca 0.00 -1.32 -0.26 0.00 0.48 0.00 0.00 55.95 54.85 1wvo s SER 5 Cb 0.00 0.76 0.07 0.00 0.10 0.00 0.00 66.02 66.95 1wvo s SER 5 CO 0.00 -1.50 0.98 -0.55 0.98 0.00 0.00 173.24 173.15 1wvo s SER 6 N -3.16 -0.18 0.00 7.02 0.15 -1.26 -5.10 113.70 111.18 1wvo s SER 6 Ca 0.23 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.52 1wvo s SER 6 Cb -0.03 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 1wvo s SER 6 CO 0.16 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.37 1wvo n GLY 7 N -0.46 -0.88 3.51 9.45 0.00 -1.26 -3.30 105.19 112.26 1wvo n GLY 7 Ca -0.06 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 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 4.64 0.06 1.61 1.04 -0.33 -4.12 113.70 112.61 1wvo s SER 8 Ca 0.00 -0.11 -0.31 0.00 0.48 0.00 0.00 55.95 56.01 1wvo s SER 8 Cb 0.00 -1.54 -0.07 0.00 0.10 0.00 0.00 66.02 64.51 1wvo s SER 8 CO 0.00 0.24 1.44 -0.69 0.98 0.00 0.00 173.24 175.21 1wvo s VAL 9 N -0.08 3.40 0.11 5.02 1.01 -1.23 -0.85 120.40 127.78 1wvo s VAL 9 Ca 0.01 0.91 0.09 0.00 0.00 0.00 0.00 61.98 63.00 1wvo s VAL 9 Cb -0.13 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1wvo s VAL 9 CO 0.03 0.03 -0.24 0.68 0.00 0.00 0.00 175.10 175.60 1wvo s VAL 10 N 1.85 1.95 -0.11 2.92 -7.23 -0.30 -1.33 120.40 118.15 1wvo s VAL 10 Ca 0.66 -1.63 -0.29 0.00 -1.81 0.00 0.00 61.98 58.91 1wvo s VAL 10 Cb -0.35 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 1wvo s VAL 10 CO 0.29 0.01 1.57 0.00 -0.31 0.00 0.00 175.10 176.66 1wvo s ALA 11 N -1.11 3.56 0.13 1.32 0.00 -0.15 -2.27 121.76 123.24 1wvo s ALA 11 Ca 0.10 0.75 0.30 0.00 0.00 0.00 0.00 51.96 53.11 1wvo s ALA 11 Cb -0.10 -3.74 1.23 0.00 0.00 0.00 0.00 23.12 20.51 1wvo s ALA 11 CO 0.05 -1.45 1.94 -0.22 0.00 0.00 0.00 175.76 176.08 1wvo h LYS 12 N 9.49 0.00 -3.89 0.00 3.64 -1.28 0.14 116.57 124.67 1wvo h LYS 12 Ca -0.36 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.92 1wvo h LYS 12 Cb 1.16 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.86 1wvo h LYS 12 CO 0.97 0.08 -0.28 0.14 -2.27 0.00 0.00 179.45 178.08 1wvo s VAL 13 N -3.70 0.03 -0.70 2.00 -7.23 -1.26 -4.77 120.40 104.77 1wvo s VAL 13 Ca 0.01 -1.47 -0.27 0.00 -1.81 0.00 0.00 61.98 58.44 1wvo s VAL 13 Cb 0.10 -2.07 0.01 0.00 0.56 0.00 0.00 36.38 34.98 1wvo s VAL 13 CO 0.57 -0.14 1.49 -0.75 -0.31 0.00 0.00 175.10 175.97 1wvo s LYS 14 N -4.01 3.00 -0.46 4.82 2.20 -1.26 -4.09 119.74 119.93 1wvo s LYS 14 Ca 0.22 0.04 -0.24 0.00 -0.36 0.00 0.00 55.97 55.63 1wvo s LYS 14 Cb 0.02 -4.27 0.03 0.00 -1.51 0.00 0.00 37.83 32.10 1wvo s LYS 14 CO 0.05 -2.36 0.84 0.42 -0.36 0.00 0.00 175.35 173.94 1wvo s ILE 15 N 6.91 4.58 0.66 5.43 1.01 -0.01 -4.91 121.20 134.87 1wvo s ILE 15 Ca 0.46 0.53 -0.15 0.00 0.00 0.00 0.00 60.65 61.50 1wvo s ILE 15 Cb -0.09 -4.37 0.00 0.00 0.01 0.00 0.00 42.46 38.01 1wvo s ILE 15 CO 0.16 -0.77 1.11 -2.16 0.00 0.00 0.00 174.94 173.29 1wvo s PRO 16 N 3.46 2.79 0.34 2.79 0.04 -1.26 -0.74 135.00 142.43 1wvo s PRO 16 Ca 0.32 1.38 -0.27 0.00 0.04 0.00 0.00 61.00 62.48 1wvo s PRO 16 Cb -0.11 -1.95 -0.13 0.00 0.04 0.00 0.00 34.50 32.35 1wvo s PRO 16 CO 0.24 -1.26 1.05 -1.91 0.04 0.00 0.00 177.00 175.16 1wvo n GLU 17 N -2.44 1.48 -0.92 4.56 2.13 -1.23 -2.18 120.64 122.05 1wvo n GLU 17 Ca 0.10 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.44 1wvo n GLU 17 Cb 0.52 -1.98 0.00 0.00 0.27 0.00 0.00 31.44 30.25 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 1.14 1.03 3.83 8.31 0.00 -0.33 -4.92 105.19 114.24 1wvo n GLY 18 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.86 4.55 -0.04 2.61 2.01 -0.93 -4.79 115.64 115.20 1wvo s THR 19 Ca 0.00 1.22 -0.23 0.00 0.31 0.00 0.00 61.69 62.99 1wvo s THR 19 Cb 0.00 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 1wvo s THR 19 CO 0.00 -0.05 0.70 -0.63 -0.69 0.00 0.00 174.62 173.95 1wvo s ILE 20 N -1.84 4.98 0.51 1.82 -1.09 -1.26 -2.35 121.20 121.97 1wvo s ILE 20 Ca 0.52 1.46 -0.21 0.00 -2.23 0.00 0.00 60.65 60.18 1wvo s ILE 20 Cb -0.13 -4.04 -0.06 0.00 -1.58 0.00 0.00 42.46 36.65 1wvo s ILE 20 CO 0.18 0.29 1.16 -0.76 -1.23 0.00 0.00 174.94 174.58 1wvo s LEU 21 N 0.56 3.87 0.05 2.97 1.43 -0.19 -4.87 118.68 122.50 1wvo s LEU 21 Ca 0.37 2.28 -0.05 0.00 -1.03 0.00 0.00 54.13 55.70 1wvo s LEU 21 Cb -0.18 -4.41 -0.02 0.00 0.03 0.00 0.00 46.19 41.61 1wvo s LEU 21 CO 0.19 -1.12 0.08 0.42 0.23 0.00 0.00 176.35 176.14 1wvo s THR 22 N -1.63 0.16 0.41 5.49 -4.23 -1.26 -1.15 115.64 113.42 1wvo s THR 22 Ca 0.69 -1.32 0.27 0.00 -1.18 0.00 0.00 61.69 60.15 1wvo s THR 22 Cb -0.27 -1.17 0.29 0.00 1.34 0.00 0.00 72.50 72.69 1wvo s THR 22 CO 0.32 -0.73 2.06 0.24 -0.54 0.00 0.00 174.62 175.98 1wvo h MET 23 N 3.32 0.00 0.00 3.99 2.86 -1.96 -2.01 114.93 121.12 1wvo h MET 23 Ca -0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 1wvo h MET 23 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1wvo h MET 23 CO 0.56 0.12 0.00 -3.47 1.06 0.00 0.00 176.91 175.18 1wvo n ASP 24 N -3.65 0.62 -0.00 1.22 2.03 -1.26 -2.50 116.55 113.00 1wvo n ASP 24 Ca -0.02 0.71 0.00 0.00 0.52 0.00 0.00 54.79 56.01 1wvo n ASP 24 Cb 0.24 -0.82 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 1wvo n ASP 24 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1wvo n MET 25 N -2.25 2.35 -4.24 -0.67 2.81 -0.77 -4.90 117.12 109.45 1wvo n MET 25 Ca 0.00 -1.31 -0.19 0.00 -1.81 0.00 0.00 57.70 54.39 1wvo n MET 25 Cb 0.14 -0.90 -0.12 0.00 -0.71 0.00 0.00 33.22 31.63 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 -0.82 2.36 0.00 4.03 1.43 -1.04 -0.86 118.68 123.78 1wvo s LEU 26 Ca 0.00 -0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 52.21 1wvo s LEU 26 Cb 0.00 -0.62 0.06 0.00 0.03 0.00 0.00 46.19 45.66 1wvo s LEU 26 CO 0.00 -0.09 0.75 1.07 0.23 0.00 0.00 176.35 178.31 1wvo n THR 27 N 0.78 0.00 -3.89 5.49 5.66 -0.96 -4.72 114.28 116.63 1wvo n THR 27 Ca -0.17 -0.89 -0.16 0.00 -3.05 0.00 0.00 64.05 59.78 1wvo n THR 27 Cb 0.56 0.90 -0.16 0.00 -1.55 0.00 0.00 70.33 70.08 1wvo n THR 27 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1wvo s VAL 28 N -2.16 0.11 -0.57 1.08 0.11 -1.26 -1.15 120.40 116.55 1wvo s VAL 28 Ca 0.15 0.10 -0.25 0.00 -2.93 0.00 0.00 61.98 59.05 1wvo s VAL 28 Cb -0.04 -0.20 0.04 0.00 -1.53 0.00 0.00 36.38 34.64 1wvo s VAL 28 CO 0.11 0.12 1.03 -0.75 -3.33 0.00 0.00 175.10 172.27 1wvo s LYS 29 N 0.90 3.37 -0.87 1.54 2.47 -0.03 -4.89 119.74 122.23 1wvo s LYS 29 Ca -0.09 -0.13 -0.25 0.00 -1.56 0.00 0.00 55.97 53.94 1wvo s LYS 29 Cb -0.12 -4.05 -0.07 0.00 -1.46 0.00 0.00 37.83 32.12 1wvo s LYS 29 CO -0.02 -1.58 2.08 0.14 0.16 0.00 0.00 175.35 176.13 1wvo s VAL 30 N 4.32 3.32 0.00 4.02 -7.23 -1.26 -1.97 120.40 121.60 1wvo s VAL 30 Ca 0.34 -0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.24 1wvo s VAL 30 Cb -0.11 -3.72 0.00 0.00 0.56 0.00 0.00 36.38 33.11 1wvo s VAL 30 CO 0.21 -0.68 0.00 0.61 -0.31 0.00 0.00 175.10 174.93 1wvo n GLY 31 N 6.84 -0.12 3.54 2.32 0.00 -1.21 -4.91 105.19 111.65 1wvo n GLY 31 Ca 0.42 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 46.27 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 2.10 -1.39 1.61 4.04 -1.26 -4.63 118.70 119.16 1wvo s GLU 32 Ca 0.00 -1.01 -0.13 0.00 0.04 0.00 0.00 54.97 53.86 1wvo s GLU 32 Cb 0.00 -2.27 0.08 0.00 0.02 0.00 0.00 34.13 31.96 1wvo s GLU 32 CO 0.00 0.52 2.06 -0.35 -1.84 0.00 0.00 175.26 175.65 1wvo n PRO 33 N 0.97 3.09 -4.22 -4.83 -0.04 -1.26 -1.18 135.00 127.52 1wvo n PRO 33 Ca -0.15 -2.94 -0.24 0.00 -0.04 0.00 0.00 63.50 60.13 1wvo n PRO 33 Cb 0.52 -3.22 -0.08 0.00 -0.04 0.00 0.00 33.50 30.68 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 2.62 2.20 1.53 0.54 2.20 -1.26 -4.89 119.74 122.69 1wvo s LYS 34 Ca 0.46 -1.71 0.00 0.00 -0.36 0.00 0.00 55.97 54.35 1wvo s LYS 34 Cb 0.11 -2.01 0.00 0.00 -1.51 0.00 0.00 37.83 34.42 1wvo s LYS 34 CO -0.04 0.07 0.00 0.41 -0.36 0.00 0.00 175.35 175.42 1wvo n GLY 35 N -1.08 1.72 2.92 5.54 0.00 -1.26 -4.01 105.19 109.02 1wvo n GLY 35 Ca -0.03 0.18 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 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 0.14 0.54 1.61 5.04 -1.20 -4.54 117.35 118.93 1wvo s TYR 36 Ca 0.00 -0.24 -0.21 0.00 -2.44 0.00 0.00 57.07 54.18 1wvo s TYR 36 Cb 0.00 -0.10 -0.05 0.00 0.35 0.00 0.00 41.96 42.16 1wvo s TYR 36 CO 0.00 -0.09 1.22 -1.25 -1.34 0.00 0.00 175.55 174.10 1wvo s PRO 37 N -0.67 3.28 0.42 4.97 0.04 -1.26 -3.55 135.00 138.22 1wvo s PRO 37 Ca -0.07 1.89 0.26 0.00 0.04 0.00 0.00 61.00 63.12 1wvo s PRO 37 Cb -0.05 -2.16 0.70 0.00 0.04 0.00 0.00 34.50 33.04 1wvo s PRO 37 CO -0.00 -0.97 1.73 -1.00 0.04 0.00 0.00 177.00 176.79 1wvo h PRO 38 N 1.40 0.00 -0.19 0.56 0.13 -1.95 -3.17 132.00 128.78 1wvo h PRO 38 Ca -0.50 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.55 1wvo h PRO 38 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1wvo h PRO 38 CO 0.57 0.00 -0.21 0.93 -0.23 0.00 0.00 178.00 179.06 1wvo h GLU 39 N 0.00 0.34 -0.48 0.86 5.08 -1.96 -2.65 114.58 115.77 1wvo h GLU 39 Ca 0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1wvo h GLU 39 Cb 0.80 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1wvo h GLU 39 CO 0.00 0.54 0.00 -0.25 -1.00 0.00 0.00 179.01 178.30 1wvo n ASP 40 N -4.17 2.56 -0.19 1.42 9.92 -1.20 -4.42 116.55 120.47 1wvo n ASP 40 Ca -0.00 -2.04 0.16 0.00 -0.53 0.00 0.00 54.79 52.37 1wvo n ASP 40 Cb 0.35 -0.33 0.49 0.00 -0.64 0.00 0.00 41.12 40.99 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 2.66 0.78 0.00 0.53 2.10 -1.57 -1.24 117.51 120.77 1wvo h ILE 41 Ca 0.00 -0.15 -0.00 0.00 1.08 0.00 0.00 64.86 65.79 1wvo h ILE 41 Cb 0.67 0.30 -0.00 0.00 -1.09 0.00 0.00 36.82 36.70 1wvo h ILE 41 CO 0.02 0.08 -0.00 -0.26 -1.08 0.00 0.00 178.15 176.91 1wvo h PHE 42 N 0.45 0.00 0.00 2.19 0.04 -1.84 -2.00 116.94 115.78 1wvo h PHE 42 Ca 0.39 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.16 1wvo h PHE 42 Cb 0.88 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.03 1wvo h PHE 42 CO -0.00 0.00 -1.73 0.27 -0.60 0.00 0.00 178.31 176.25 1wvo n ASN 43 N -3.21 0.25 0.08 2.17 6.94 -0.47 -4.11 115.26 116.90 1wvo n ASN 43 Ca -0.03 -0.17 -0.02 0.00 -0.02 0.00 0.00 54.58 54.34 1wvo n ASN 43 Cb 0.09 1.69 0.24 0.00 -2.36 0.00 0.00 39.78 39.44 1wvo n ASN 43 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1wvo h LEU 44 N 0.00 0.28 -9.87 -4.53 3.38 -1.30 -3.41 115.31 99.86 1wvo h LEU 44 Ca 0.00 -0.11 -0.53 0.00 0.09 0.00 0.00 57.88 57.33 1wvo h LEU 44 Cb 0.90 -0.08 0.08 0.00 0.09 0.00 0.00 40.66 41.65 1wvo h LEU 44 CO 0.00 0.63 0.72 -0.69 0.09 0.00 0.00 178.44 179.19 1wvo s VAL 45 N -4.25 2.46 0.00 1.22 1.01 -1.18 -2.21 120.40 117.45 1wvo s VAL 45 Ca -0.05 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1wvo s VAL 45 Cb 0.14 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1wvo s VAL 45 CO 0.77 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1wvo n GLY 46 N 1.03 2.52 3.82 4.51 0.00 -0.30 -4.95 105.19 111.82 1wvo n GLY 46 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.58 1.07 -0.06 1.61 1.02 -0.94 -4.69 119.74 117.16 1wvo s LYS 47 Ca 0.00 0.10 0.05 0.00 0.02 0.00 0.00 55.97 56.13 1wvo s LYS 47 Cb 0.00 -1.85 -0.00 0.00 -0.52 0.00 0.00 37.83 35.46 1wvo s LYS 47 CO 0.00 -2.21 -0.21 0.21 -0.92 0.00 0.00 175.35 172.22 1wvo s LYS 48 N -5.47 2.34 0.46 1.68 2.20 -1.26 -1.02 119.74 118.66 1wvo s LYS 48 Ca 0.66 -0.75 -0.22 0.00 -0.36 0.00 0.00 55.97 55.30 1wvo s LYS 48 Cb -0.12 -1.92 -0.08 0.00 -1.51 0.00 0.00 37.83 34.20 1wvo s LYS 48 CO 0.52 0.25 1.05 0.14 -0.36 0.00 0.00 175.35 176.96 1wvo s VAL 49 N 0.11 3.71 -0.62 4.02 -7.23 -0.99 -1.69 120.40 117.71 1wvo s VAL 49 Ca -0.09 1.15 0.22 0.00 -1.81 0.00 0.00 61.98 61.46 1wvo s VAL 49 Cb -0.14 -3.52 -0.22 0.00 0.56 0.00 0.00 36.38 33.06 1wvo s VAL 49 CO 0.04 -0.14 0.84 0.18 -0.31 0.00 0.00 175.10 175.71 1wvo n LEU 50 N -0.65 0.60 -3.98 1.32 4.77 -0.58 -1.19 117.00 117.29 1wvo n LEU 50 Ca 0.08 -0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 55.77 1wvo n LEU 50 Cb 0.51 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.48 1wvo n LEU 50 CO 0.42 0.11 -0.17 0.68 -1.33 0.00 0.00 177.39 177.10 1wvo s VAL 51 N -3.20 0.14 -0.79 4.08 -7.23 -1.26 -4.80 120.40 107.33 1wvo s VAL 51 Ca 0.02 -1.48 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 1wvo s VAL 51 Cb 0.15 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.51 1wvo s VAL 51 CO 0.86 -0.64 1.62 -0.89 -0.31 0.00 0.00 175.10 175.73 1wvo s THR 52 N -3.92 3.60 0.04 5.32 2.01 -1.26 -3.47 115.64 117.95 1wvo s THR 52 Ca 0.11 -0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.76 1wvo s THR 52 Cb 0.06 -4.48 -0.06 0.00 0.01 0.00 0.00 72.50 68.03 1wvo s THR 52 CO -0.07 -1.42 1.37 -0.69 -0.69 0.00 0.00 174.62 173.12 1wvo s VAL 53 N 7.42 3.65 0.93 3.82 1.01 0.08 -4.87 120.40 132.45 1wvo s VAL 53 Ca 0.54 1.11 -0.12 0.00 0.00 0.00 0.00 61.98 63.50 1wvo s VAL 53 Cb -0.07 -3.71 0.15 0.00 0.00 0.00 0.00 36.38 32.74 1wvo s VAL 53 CO 0.08 0.03 1.13 -1.61 0.00 0.00 0.00 175.10 174.74 1wvo s GLU 54 N 1.86 0.98 0.24 2.72 2.02 -1.26 -0.83 118.70 124.43 1wvo s GLU 54 Ca 0.63 0.30 -0.30 0.00 0.02 0.00 0.00 54.97 55.62 1wvo s GLU 54 Cb -0.32 -1.82 -0.09 0.00 0.10 0.00 0.00 34.13 32.00 1wvo s GLU 54 CO 0.28 -2.31 1.10 -2.00 0.02 0.00 0.00 175.26 172.35 1wvo s GLU 55 N -5.25 4.62 -0.08 1.61 2.12 -1.26 -2.96 118.70 117.50 1wvo s GLU 55 Ca 0.64 1.77 0.00 0.00 0.36 0.00 0.00 54.97 57.74 1wvo s GLU 55 Cb -0.15 -3.23 0.00 0.00 0.26 0.00 0.00 34.13 31.01 1wvo s GLU 55 CO 0.54 0.16 0.00 -3.47 -0.54 0.00 0.00 175.26 171.95 1wvo n ASP 56 N 1.69 -4.13 -4.79 -1.70 2.03 0.49 -4.93 116.55 105.21 1wvo n ASP 56 Ca 0.00 0.02 -0.35 0.00 0.52 0.00 0.00 54.79 54.99 1wvo n ASP 56 Cb 0.45 -1.70 -0.02 0.00 -0.72 0.00 0.00 41.12 39.13 1wvo n ASP 56 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1wvo s ASP 57 N -2.09 6.15 -0.16 1.67 1.11 -1.16 -4.66 116.67 117.54 1wvo s ASP 57 Ca 0.00 2.04 -0.29 0.00 0.18 0.00 0.00 52.55 54.47 1wvo s ASP 57 Cb 0.00 -2.57 -0.01 0.00 1.07 0.00 0.00 42.92 41.41 1wvo s ASP 57 CO 0.00 -0.92 1.06 -0.89 1.18 0.00 0.00 175.17 175.60 1wvo s THR 58 N -1.87 4.64 -0.04 -1.27 2.01 -1.26 -0.98 115.64 116.88 1wvo s THR 58 Ca 0.68 1.95 -0.30 0.00 0.31 0.00 0.00 61.69 64.33 1wvo s THR 58 Cb -0.20 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.02 1wvo s THR 58 CO 0.23 -0.08 1.14 -0.63 -0.69 0.00 0.00 174.62 174.59 1wvo s ILE 59 N 2.65 4.38 0.14 1.82 -1.09 -0.44 -4.94 121.20 123.71 1wvo s ILE 59 Ca 0.48 1.69 0.07 0.00 -2.23 0.00 0.00 60.65 60.66 1wvo s ILE 59 Cb -0.18 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.57 1wvo s ILE 59 CO 0.13 0.03 -0.15 -0.04 -1.23 0.00 0.00 174.94 173.69 1wvo s MET 60 N 1.87 1.12 0.64 2.79 -1.94 -1.26 -3.25 119.30 119.27 1wvo s MET 60 Ca 0.55 -1.32 0.42 0.00 -1.71 0.00 0.00 55.69 53.63 1wvo s MET 60 Cb -0.24 -1.02 2.19 0.00 2.01 0.00 0.00 34.83 37.77 1wvo s MET 60 CO 0.23 0.20 2.29 1.05 -0.01 0.00 0.00 175.02 178.77 1wvo h GLU 61 N 3.34 0.00 0.00 2.03 4.11 -1.96 -2.04 114.58 120.06 1wvo h GLU 61 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.03 1wvo h GLU 61 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1wvo h GLU 61 CO 0.52 0.00 -0.48 -0.85 0.07 0.00 0.00 179.01 178.28 1wvo n GLU 62 N -3.11 0.02 -0.23 1.06 0.28 -1.26 -3.89 120.64 113.52 1wvo n GLU 62 Ca -0.02 0.01 0.06 0.00 -0.16 0.00 0.00 57.16 57.04 1wvo n GLU 62 Cb 0.12 -1.51 0.18 0.00 1.43 0.00 0.00 31.44 31.66 1wvo n GLU 62 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1wvo n LEU 63 N -1.54 2.22 -4.13 -1.84 4.77 -0.77 -4.92 117.00 110.79 1wvo n LEU 63 Ca 0.05 -1.11 -0.15 0.00 -0.03 0.00 0.00 56.01 54.77 1wvo n LEU 63 Cb 0.34 -0.29 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 1wvo n LEU 63 CO 0.35 0.51 -0.43 0.68 -1.33 0.00 0.00 177.39 177.17 1wvo s VAL 64 N -1.52 0.84 0.60 4.08 -7.23 -1.25 -1.53 120.40 114.39 1wvo s VAL 64 Ca 0.26 -1.29 -0.01 0.00 -1.81 0.00 0.00 61.98 59.13 1wvo s VAL 64 Cb 0.14 -0.95 0.04 0.00 0.56 0.00 0.00 36.38 36.17 1wvo s VAL 64 CO 0.17 -0.36 0.85 -0.62 -0.31 0.00 0.00 175.10 174.82 1wvo s ASP 65 N -1.83 5.13 0.23 4.85 2.15 -0.68 -4.89 116.67 121.62 1wvo s ASP 65 Ca -0.04 0.13 -0.30 0.00 0.43 0.00 0.00 52.55 52.78 1wvo s ASP 65 Cb -0.08 -0.94 -0.09 0.00 -0.30 0.00 0.00 42.92 41.51 1wvo s ASP 65 CO 0.01 -1.29 1.20 0.21 -0.17 0.00 0.00 175.17 175.13 1wvo s ASN 66 N -4.46 7.07 0.29 -0.34 2.47 -1.26 -4.54 114.94 114.18 1wvo s ASN 66 Ca 0.58 2.32 -0.30 0.00 0.42 0.00 0.00 52.86 55.88 1wvo s ASN 66 Cb -0.10 -2.62 -0.11 0.00 -1.45 0.00 0.00 41.25 36.96 1wvo s ASN 66 CO 0.40 -0.35 1.61 -2.28 -3.72 0.00 0.00 177.10 172.77 1wvo s HIS 67 N -0.45 2.73 0.19 0.43 5.65 -1.26 -4.76 115.29 117.82 1wvo s HIS 67 Ca 0.51 0.74 0.00 0.00 0.25 0.00 0.00 55.06 56.56 1wvo s HIS 67 Cb -0.34 -4.09 0.00 0.00 -1.18 0.00 0.00 32.58 26.97 1wvo s HIS 67 CO 0.40 -3.70 0.00 0.41 -0.65 0.00 0.00 174.74 171.20 1wvo n GLY 68 N 2.22 -1.88 0.00 1.59 0.00 -1.26 -4.89 105.19 100.96 1wvo n GLY 68 Ca 0.09 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1wvo n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wvo n LYS 69 N -2.88 0.25 -1.13 1.61 -0.00 -1.26 -5.12 118.16 109.63 1wvo n LYS 69 Ca 0.01 -0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 57.97 1wvo n LYS 69 Cb 0.37 -0.09 0.10 0.00 -0.00 0.00 0.00 35.03 35.41 1wvo n LYS 69 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1wvo n LYS 70 N -0.04 0.16 -0.80 -1.58 2.85 -1.26 -4.96 118.16 112.54 1wvo n LYS 70 Ca 0.00 0.11 -0.04 0.00 -1.05 0.00 0.00 58.31 57.33 1wvo n LYS 70 Cb 0.03 -2.05 0.20 0.00 -0.65 0.00 0.00 35.03 32.56 1wvo n LYS 70 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1wvo n ILE 71 N -2.92 2.57 0.01 0.58 -5.35 -1.26 -4.69 119.36 108.30 1wvo n ILE 71 Ca 0.11 -2.62 -0.03 0.00 -0.27 0.00 0.00 62.75 59.94 1wvo n ILE 71 Cb 0.51 -0.32 0.22 0.00 -1.74 0.00 0.00 39.64 38.30 1wvo n ILE 71 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1wvo h LYS 72 N 1.07 0.49 -7.08 6.28 3.64 -2.05 -3.44 116.57 115.48 1wvo h LYS 72 Ca 0.23 -0.17 -0.46 0.00 -1.27 0.00 0.00 60.65 58.98 1wvo h LYS 72 Cb 1.71 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 33.50 1wvo h LYS 72 CO 0.42 0.67 0.37 0.45 -2.27 0.00 0.00 179.45 179.08 1wvo s SER 73 N -6.80 6.58 -0.01 4.20 0.15 -1.26 -5.02 113.70 111.55 1wvo s SER 73 Ca -0.07 1.79 -0.04 0.00 0.70 0.00 0.00 55.95 58.34 1wvo s SER 73 Cb 0.14 -2.55 -0.02 0.00 -1.71 0.00 0.00 66.02 61.88 1wvo s SER 73 CO 0.78 -0.61 0.50 -1.28 1.20 0.00 0.00 173.24 173.83 1wvo h SER 74 N 1.59 -0.11 -3.49 5.45 0.87 -2.00 -3.49 113.55 112.36 1wvo h SER 74 Ca -0.49 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.22 1wvo h SER 74 Cb 1.20 0.03 -0.26 0.00 -0.44 0.00 0.00 62.40 62.93 1wvo h SER 74 CO 0.60 -0.02 0.70 -0.83 -0.53 0.00 0.00 176.83 176.75 1wvo s GLY 75 N -1.84 -0.08 0.38 5.77 0.00 -1.26 -5.06 107.32 105.24 1wvo s GLY 75 Ca -0.02 2.51 0.28 0.00 0.00 0.00 0.00 44.72 47.49 1wvo s GLY 75 CO 0.06 1.24 1.82 -0.56 0.00 0.00 0.00 173.10 175.66 1wvo h PRO 76 N 2.63 0.00 0.00 2.90 0.13 -2.05 -3.47 132.00 132.14 1wvo h PRO 76 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1wvo h PRO 76 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wvo h PRO 76 CO 0.25 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.45 1wvo n SER 77 N -2.64 -4.36 -2.29 1.44 7.64 -1.26 -5.00 113.62 107.15 1wvo n SER 77 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1wvo n SER 77 Cb 0.30 -2.40 0.00 0.00 -1.01 0.00 0.00 64.21 61.10 1wvo n SER 77 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1wvo n SER 78 N -0.58 -0.07 -0.82 6.43 3.41 -1.26 -5.34 113.62 115.40 1wvo n SER 78 Ca 0.00 -0.72 0.13 0.00 -0.26 0.00 0.00 58.87 58.01 1wvo n SER 78 Cb 0.29 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.47 1wvo n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49