#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 6.87 0.40 1.61 1.04 -1.26 -4.99 113.70 117.36 1wvo s SER 2 Ca 0.00 2.27 -0.25 0.00 0.48 0.00 0.00 55.95 58.45 1wvo s SER 2 Cb 0.00 -2.59 -0.08 0.00 0.10 0.00 0.00 66.02 63.45 1wvo s SER 2 CO 0.00 -0.62 1.20 -0.55 0.98 0.00 0.00 173.24 174.25 1wvo s SER 3 N 1.08 6.47 -0.75 7.02 0.15 -1.26 -3.35 113.70 123.06 1wvo s SER 3 Ca 0.63 2.43 -0.05 0.00 0.70 0.00 0.00 55.95 59.66 1wvo s SER 3 Cb -0.36 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.34 1wvo s SER 3 CO 0.30 -0.72 0.66 0.61 1.20 0.00 0.00 173.24 175.29 1wvo n GLY 4 N 0.66 0.12 3.53 9.45 0.00 -1.26 -4.96 105.19 112.72 1wvo n GLY 4 Ca 0.04 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.19 6.53 0.03 1.61 0.01 -1.21 -4.92 113.70 112.56 1wvo s SER 5 Ca 0.32 -1.60 -0.10 0.00 1.31 0.00 0.00 55.95 55.88 1wvo s SER 5 Cb -0.14 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.52 1wvo s SER 5 CO 0.41 -1.39 1.16 0.28 0.41 0.00 0.00 173.24 174.11 1wvo h SER 6 N 9.53 -0.42 -3.92 2.44 0.02 -1.92 -3.45 113.55 115.83 1wvo h SER 6 Ca 0.17 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.21 1wvo h SER 6 Cb 1.02 0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1wvo h SER 6 CO 1.33 -0.18 -0.07 0.61 -1.14 0.00 0.00 176.83 177.39 1wvo n GLY 7 N -1.15 -1.44 3.15 -3.77 0.00 -1.23 -4.80 105.19 95.96 1wvo n GLY 7 Ca -0.03 -1.49 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.97 0.24 0.16 1.61 1.04 -0.96 -4.12 113.70 108.70 1wvo s SER 8 Ca 0.00 -0.73 -0.30 0.00 0.48 0.00 0.00 55.95 55.40 1wvo s SER 8 Cb 0.00 0.28 -0.08 0.00 0.10 0.00 0.00 66.02 66.32 1wvo s SER 8 CO 0.00 -0.65 1.25 -0.69 0.98 0.00 0.00 173.24 174.13 1wvo s VAL 9 N -3.64 3.53 0.08 5.02 1.01 -0.72 -1.34 120.40 124.33 1wvo s VAL 9 Ca 0.04 1.21 0.02 0.00 0.00 0.00 0.00 61.98 63.25 1wvo s VAL 9 Cb 0.05 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1wvo s VAL 9 CO -0.09 0.16 -0.07 0.68 0.00 0.00 0.00 175.10 175.78 1wvo s VAL 10 N 0.34 0.64 -0.02 2.92 -7.23 -0.29 -1.59 120.40 115.18 1wvo s VAL 10 Ca 0.56 -1.75 -0.30 0.00 -1.81 0.00 0.00 61.98 58.68 1wvo s VAL 10 Cb -0.34 -1.45 -0.05 0.00 0.56 0.00 0.00 36.38 35.10 1wvo s VAL 10 CO 0.35 -0.77 1.40 0.00 -0.31 0.00 0.00 175.10 175.77 1wvo s ALA 11 N -3.16 3.59 0.04 1.32 0.00 0.04 -1.82 121.76 121.77 1wvo s ALA 11 Ca 0.07 0.85 0.13 0.00 0.00 0.00 0.00 51.96 53.01 1wvo s ALA 11 Cb 0.02 -3.61 0.19 0.00 0.00 0.00 0.00 23.12 19.72 1wvo s ALA 11 CO -0.04 -0.96 1.50 -0.22 0.00 0.00 0.00 175.76 176.04 1wvo h LYS 12 N 7.97 0.00 -4.20 0.00 3.64 -1.31 0.29 116.57 122.96 1wvo h LYS 12 Ca -0.37 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 58.85 1wvo h LYS 12 Cb 1.17 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.86 1wvo h LYS 12 CO 0.91 0.61 -0.45 0.14 -2.27 0.00 0.00 179.45 178.39 1wvo s VAL 13 N -3.13 0.03 -0.14 2.00 -7.23 -1.26 -4.64 120.40 106.03 1wvo s VAL 13 Ca 0.02 -1.72 -0.29 0.00 -1.81 0.00 0.00 61.98 58.17 1wvo s VAL 13 Cb 0.10 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.79 1wvo s VAL 13 CO 0.75 -0.15 1.59 -0.75 -0.31 0.00 0.00 175.10 176.24 1wvo s LYS 14 N -4.07 4.02 -0.36 4.82 2.20 -1.26 -4.26 119.74 120.83 1wvo s LYS 14 Ca 0.28 1.90 -0.12 0.00 -0.36 0.00 0.00 55.97 57.67 1wvo s LYS 14 Cb 0.05 -3.98 0.01 0.00 -1.51 0.00 0.00 37.83 32.39 1wvo s LYS 14 CO 0.07 -1.03 0.22 0.42 -0.36 0.00 0.00 175.35 174.67 1wvo s ILE 15 N 4.50 4.84 0.45 5.43 1.01 -0.47 -4.93 121.20 132.03 1wvo s ILE 15 Ca 0.70 -0.61 -0.21 0.00 0.00 0.00 0.00 60.65 60.53 1wvo s ILE 15 Cb -0.28 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.48 1wvo s ILE 15 CO 0.27 -0.14 1.02 -2.16 0.00 0.00 0.00 174.94 173.93 1wvo s PRO 16 N 1.62 3.97 0.46 2.79 0.04 -1.26 -1.09 135.00 141.54 1wvo s PRO 16 Ca 0.04 1.36 -0.22 0.00 0.04 0.00 0.00 61.00 62.21 1wvo s PRO 16 Cb -0.18 -2.23 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 1wvo s PRO 16 CO 0.08 -0.28 0.88 -1.91 0.04 0.00 0.00 177.00 175.80 1wvo n GLU 17 N -0.67 1.06 -0.40 4.56 0.00 -1.24 -2.81 120.64 121.13 1wvo n GLU 17 Ca 0.08 0.39 0.00 0.00 0.00 0.00 0.00 57.16 57.63 1wvo n GLU 17 Cb 0.52 -1.94 0.00 0.00 0.00 0.00 0.00 31.44 30.02 1wvo n GLU 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1wvo n GLY 18 N 1.36 1.20 3.88 8.31 0.00 -0.40 -4.95 105.19 114.60 1wvo n GLY 18 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.04 4.90 0.09 2.61 2.01 -1.12 -4.79 115.64 116.31 1wvo s THR 19 Ca 0.00 0.43 -0.17 0.00 0.31 0.00 0.00 61.69 62.25 1wvo s THR 19 Cb 0.00 -3.67 -0.07 0.00 0.01 0.00 0.00 72.50 68.77 1wvo s THR 19 CO 0.00 -0.25 0.55 -0.63 -0.69 0.00 0.00 174.62 173.59 1wvo s ILE 20 N -2.03 4.81 0.25 1.82 -1.09 -1.26 -1.84 121.20 121.86 1wvo s ILE 20 Ca 0.48 1.06 -0.30 0.00 -2.23 0.00 0.00 60.65 59.66 1wvo s ILE 20 Cb -0.11 -3.83 -0.09 0.00 -1.58 0.00 0.00 42.46 36.86 1wvo s ILE 20 CO 0.25 0.46 1.06 -0.76 -1.23 0.00 0.00 174.94 174.73 1wvo s LEU 21 N -1.37 4.57 0.09 2.97 1.43 -0.43 -4.94 118.68 121.00 1wvo s LEU 21 Ca 0.31 2.16 0.03 0.00 -1.03 0.00 0.00 54.13 55.60 1wvo s LEU 21 Cb -0.18 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 1wvo s LEU 21 CO 0.18 -0.08 -0.09 0.42 0.23 0.00 0.00 176.35 177.01 1wvo s THR 22 N -1.01 0.80 -0.69 5.49 -4.23 -1.26 -2.19 115.64 112.55 1wvo s THR 22 Ca 0.44 -1.62 0.17 0.00 -1.18 0.00 0.00 61.69 59.51 1wvo s THR 22 Cb -0.30 -1.31 0.17 0.00 1.34 0.00 0.00 72.50 72.40 1wvo s THR 22 CO 0.38 -0.61 1.53 0.23 -0.54 0.00 0.00 174.62 175.61 1wvo n MET 23 N 0.56 0.09 0.26 3.99 0.00 -1.26 -2.08 117.12 118.69 1wvo n MET 23 Ca -0.16 0.40 0.16 0.00 0.00 0.00 0.00 57.70 58.10 1wvo n MET 23 Cb 0.58 -1.71 0.55 0.00 0.00 0.00 0.00 33.22 32.64 1wvo n MET 23 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1wvo h ASP 24 N 0.00 0.00 -0.18 7.83 3.32 -2.01 -3.15 116.42 122.23 1wvo h ASP 24 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wvo h ASP 24 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1wvo h ASP 24 CO 0.00 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.75 1wvo n MET 25 N -3.08 2.91 -4.21 3.56 2.81 -0.88 -4.86 117.12 113.36 1wvo n MET 25 Ca 0.02 -1.83 -0.18 0.00 -1.81 0.00 0.00 57.70 53.89 1wvo n MET 25 Cb 0.36 -1.16 -0.12 0.00 -0.71 0.00 0.00 33.22 31.59 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 -1.07 2.24 0.38 4.03 1.43 -1.19 -0.90 118.68 123.61 1wvo s LEU 26 Ca 0.13 -0.56 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 1wvo s LEU 26 Cb 0.07 -0.52 0.04 0.00 0.03 0.00 0.00 46.19 45.82 1wvo s LEU 26 CO 0.08 -0.05 0.72 0.28 0.23 0.00 0.00 176.35 177.61 1wvo s THR 27 N -1.15 0.00 -0.21 5.49 -1.32 -0.76 -4.74 115.64 112.96 1wvo s THR 27 Ca -0.01 -1.14 0.01 0.00 -1.21 0.00 0.00 61.69 59.33 1wvo s THR 27 Cb -0.09 -2.86 0.05 0.00 -1.51 0.00 0.00 72.50 68.09 1wvo s THR 27 CO 0.02 0.00 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.65 1wvo s VAL 28 N -2.42 1.62 -0.92 5.08 1.01 -1.26 -1.14 120.40 122.38 1wvo s VAL 28 Ca 0.19 -1.06 -0.24 0.00 0.00 0.00 0.00 61.98 60.86 1wvo s VAL 28 Cb -0.04 -1.74 0.04 0.00 0.00 0.00 0.00 36.38 34.64 1wvo s VAL 28 CO 0.14 0.10 1.42 -0.75 0.00 0.00 0.00 175.10 176.02 1wvo s LYS 29 N 1.39 3.40 -0.54 2.72 2.20 -0.45 -4.87 119.74 123.59 1wvo s LYS 29 Ca -0.02 -0.77 -0.26 0.00 -0.36 0.00 0.00 55.97 54.56 1wvo s LYS 29 Cb -0.17 -4.95 -0.08 0.00 -1.51 0.00 0.00 37.83 31.12 1wvo s LYS 29 CO -0.08 -2.25 2.42 0.28 -0.36 0.00 0.00 175.35 175.37 1wvo n VAL 30 N 6.77 -0.08 0.00 4.02 0.31 -1.26 -3.03 118.33 125.06 1wvo n VAL 30 Ca 0.23 -0.75 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 1wvo n VAL 30 Cb 0.50 -2.66 0.00 0.00 -0.91 0.00 0.00 33.84 30.77 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 6.13 -0.13 3.28 2.92 0.00 -1.26 -4.92 105.19 111.20 1wvo n GLY 31 Ca 0.39 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.61 0.85 0.00 1.61 -1.05 -1.26 -4.73 118.70 112.51 1wvo s GLU 32 Ca 0.00 -0.41 0.25 0.00 -0.15 0.00 0.00 54.97 54.67 1wvo s GLU 32 Cb 0.00 0.37 1.36 0.00 -0.44 0.00 0.00 34.13 35.42 1wvo s GLU 32 CO 0.00 -0.28 1.86 -0.35 0.95 0.00 0.00 175.26 177.45 1wvo n PRO 33 N 0.61 0.50 -1.77 -4.83 -0.04 -1.26 -2.26 135.00 125.96 1wvo n PRO 33 Ca -0.19 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 62.89 1wvo n PRO 33 Cb 0.59 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.52 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 -2.39 2.95 0.00 0.54 2.36 -1.26 -4.69 119.74 117.25 1wvo s LYS 34 Ca 0.29 1.57 0.00 0.00 -2.55 0.00 0.00 55.97 55.27 1wvo s LYS 34 Cb 0.17 -4.36 0.00 0.00 -1.05 0.00 0.00 37.83 32.59 1wvo s LYS 34 CO 0.36 -2.31 0.00 0.41 1.55 0.00 0.00 175.35 175.35 1wvo n GLY 35 N 5.69 1.26 3.70 5.54 0.00 -1.26 -4.70 105.19 115.43 1wvo n GLY 35 Ca 0.28 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 1wvo n GLY 35 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wvo n TYR 36 N -1.57 2.48 -1.82 1.61 4.19 -0.21 -4.76 117.16 117.08 1wvo n TYR 36 Ca 0.00 0.32 -0.42 0.00 3.31 0.00 0.00 57.90 61.11 1wvo n TYR 36 Cb 0.00 -2.54 -0.03 0.00 0.49 0.00 0.00 39.34 37.26 1wvo n TYR 36 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1wvo s PRO 37 N -0.18 4.16 0.53 2.98 0.04 -1.26 -1.76 135.00 139.50 1wvo s PRO 37 Ca 0.68 2.50 0.34 0.00 0.04 0.00 0.00 61.00 64.56 1wvo s PRO 37 Cb -0.58 -3.10 1.53 0.00 0.04 0.00 0.00 34.50 32.40 1wvo s PRO 37 CO 0.47 -0.67 2.02 -1.00 0.04 0.00 0.00 177.00 177.86 1wvo h PRO 38 N 6.41 0.00 0.00 0.56 0.13 -1.89 -2.76 132.00 134.44 1wvo h PRO 38 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1wvo h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1wvo h PRO 38 CO 0.91 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.83 1wvo n GLU 39 N -2.94 0.04 -0.01 0.86 0.28 -1.26 -2.63 120.64 114.97 1wvo n GLU 39 Ca -0.00 0.26 0.01 0.00 -0.16 0.00 0.00 57.16 57.27 1wvo n GLU 39 Cb 0.23 -1.57 0.01 0.00 1.43 0.00 0.00 31.44 31.55 1wvo n GLU 39 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1wvo n ASP 40 N -1.63 1.90 -0.41 -1.84 8.00 -1.04 -4.85 116.55 116.67 1wvo n ASP 40 Ca 0.03 -2.03 0.35 0.00 0.71 0.00 0.00 54.79 53.85 1wvo n ASP 40 Cb 0.19 -0.04 0.62 0.00 -0.02 0.00 0.00 41.12 41.88 1wvo n ASP 40 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1wvo h ILE 41 N 0.22 0.08 -0.49 0.53 2.10 -1.55 -1.31 117.51 117.10 1wvo h ILE 41 Ca 0.00 -0.02 -0.00 0.00 1.08 0.00 0.00 64.86 65.92 1wvo h ILE 41 Cb 0.58 0.01 -0.02 0.00 -1.09 0.00 0.00 36.82 36.29 1wvo h ILE 41 CO 0.00 0.01 0.30 -0.26 -1.08 0.00 0.00 178.15 177.13 1wvo h PHE 42 N 0.07 0.63 -0.91 2.19 -1.00 -1.88 -2.89 116.94 113.14 1wvo h PHE 42 Ca 0.84 0.01 0.02 0.00 2.81 0.00 0.00 57.97 61.64 1wvo h PHE 42 Cb 2.47 -0.21 -0.05 0.00 3.61 0.00 0.00 35.95 41.77 1wvo h PHE 42 CO -0.01 0.42 0.60 -0.91 -1.61 0.00 0.00 178.31 176.80 1wvo h ASN 43 N 0.67 1.02 0.30 2.17 2.35 -1.65 -2.51 115.58 117.93 1wvo h ASN 43 Ca 0.18 -0.02 -0.16 0.00 -0.55 0.00 0.00 56.30 55.75 1wvo h ASN 43 Cb -0.04 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 1wvo h ASN 43 CO -0.04 0.72 -0.65 -0.07 -1.65 0.00 0.00 177.43 175.75 1wvo h LEU 44 N 1.19 0.38 -8.29 1.61 3.38 -1.68 -3.42 115.31 108.49 1wvo h LEU 44 Ca 0.35 -0.23 -0.26 0.00 0.09 0.00 0.00 57.88 57.82 1wvo h LEU 44 Cb -0.07 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1wvo h LEU 44 CO -0.09 0.93 0.68 -0.69 0.09 0.00 0.00 178.44 179.36 1wvo s VAL 45 N -3.72 3.34 0.00 1.22 1.01 -0.95 -1.25 120.40 120.06 1wvo s VAL 45 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1wvo s VAL 45 Cb 0.11 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1wvo s VAL 45 CO 0.82 -0.74 0.00 0.61 0.00 0.00 0.00 175.10 175.79 1wvo n GLY 46 N 6.71 0.45 3.92 4.51 0.00 -0.93 -4.95 105.19 114.90 1wvo n GLY 46 Ca 0.39 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.14 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 1.89 -0.09 1.61 1.02 -0.38 -4.73 119.74 119.05 1wvo s LYS 47 Ca 0.00 -0.12 -0.00 0.00 0.02 0.00 0.00 55.97 55.86 1wvo s LYS 47 Cb 0.00 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.25 1wvo s LYS 47 CO 0.00 -1.55 -0.06 0.21 -0.92 0.00 0.00 175.35 173.03 1wvo s LYS 48 N -5.48 3.02 0.35 1.68 2.20 -1.26 -1.31 119.74 118.94 1wvo s LYS 48 Ca 0.63 -0.54 -0.24 0.00 -0.36 0.00 0.00 55.97 55.46 1wvo s LYS 48 Cb -0.10 -2.68 -0.10 0.00 -1.51 0.00 0.00 37.83 33.44 1wvo s LYS 48 CO 0.48 0.54 0.92 0.14 -0.36 0.00 0.00 175.35 177.06 1wvo s VAL 49 N -0.46 4.31 -0.62 4.02 -7.23 -0.77 -1.77 120.40 117.89 1wvo s VAL 49 Ca 0.07 1.64 0.22 0.00 -1.81 0.00 0.00 61.98 62.10 1wvo s VAL 49 Cb -0.12 -3.86 -0.20 0.00 0.56 0.00 0.00 36.38 32.76 1wvo s VAL 49 CO 0.02 -0.00 0.87 0.18 -0.31 0.00 0.00 175.10 175.86 1wvo n LEU 50 N 0.18 0.60 -3.87 1.32 4.77 0.21 -1.28 117.00 118.94 1wvo n LEU 50 Ca 0.03 -0.17 -0.09 0.00 -0.03 0.00 0.00 56.01 55.75 1wvo n LEU 50 Cb 0.51 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.48 1wvo n LEU 50 CO 0.42 0.10 -0.12 0.68 -1.33 0.00 0.00 177.39 177.14 1wvo s VAL 51 N -3.20 0.14 -0.66 4.08 -7.23 -1.26 -4.86 120.40 107.40 1wvo s VAL 51 Ca 0.03 -1.12 -0.27 0.00 -1.81 0.00 0.00 61.98 58.81 1wvo s VAL 51 Cb 0.15 -1.18 0.02 0.00 0.56 0.00 0.00 36.38 35.92 1wvo s VAL 51 CO 0.85 -0.62 1.41 -0.89 -0.31 0.00 0.00 175.10 175.54 1wvo s THR 52 N -3.37 3.69 0.21 5.32 2.01 -1.26 -3.70 115.64 118.54 1wvo s THR 52 Ca 0.01 0.46 -0.30 0.00 0.31 0.00 0.00 61.69 62.18 1wvo s THR 52 Cb 0.03 -4.61 -0.08 0.00 0.01 0.00 0.00 72.50 67.84 1wvo s THR 52 CO -0.08 -1.49 0.94 -0.69 -0.69 0.00 0.00 174.62 172.61 1wvo s VAL 53 N 6.39 4.17 0.71 3.82 1.01 -0.25 -4.90 120.40 131.36 1wvo s VAL 53 Ca 0.46 2.07 -0.07 0.00 0.00 0.00 0.00 61.98 64.43 1wvo s VAL 53 Cb -0.09 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 32.03 1wvo s VAL 53 CO 0.19 0.46 1.02 -1.61 0.00 0.00 0.00 175.10 175.17 1wvo s GLU 54 N -0.94 2.18 0.28 2.72 2.02 -1.26 -1.37 118.70 122.33 1wvo s GLU 54 Ca 0.42 -0.24 -0.29 0.00 0.02 0.00 0.00 54.97 54.88 1wvo s GLU 54 Cb -0.25 -2.16 -0.10 0.00 0.10 0.00 0.00 34.13 31.72 1wvo s GLU 54 CO 0.31 -1.26 1.20 -2.00 0.02 0.00 0.00 175.26 173.53 1wvo s GLU 55 N -5.27 4.51 0.00 1.61 2.12 -1.26 -2.90 118.70 117.51 1wvo s GLU 55 Ca 0.60 1.97 0.00 0.00 0.36 0.00 0.00 54.97 57.91 1wvo s GLU 55 Cb -0.11 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.13 1wvo s GLU 55 CO 0.45 0.00 0.00 -3.47 -0.54 0.00 0.00 175.26 171.70 1wvo n ASP 56 N 1.32 -1.74 -4.77 -1.70 2.03 0.09 -4.95 116.55 106.84 1wvo n ASP 56 Ca 0.00 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.94 1wvo n ASP 56 Cb 0.44 -1.25 -0.00 0.00 -0.72 0.00 0.00 41.12 39.58 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 -2.36 6.07 0.05 1.67 1.11 -1.14 -4.62 116.67 117.45 1wvo s ASP 57 Ca 0.00 2.46 -0.31 0.00 0.18 0.00 0.00 52.55 54.88 1wvo s ASP 57 Cb 0.00 -2.62 -0.06 0.00 1.07 0.00 0.00 42.92 41.32 1wvo s ASP 57 CO 0.00 -1.00 1.25 -0.89 1.18 0.00 0.00 175.17 175.71 1wvo s THR 58 N -1.43 3.92 -0.05 -1.27 2.01 -1.26 -0.78 115.64 116.77 1wvo s THR 58 Ca 0.63 1.36 -0.23 0.00 0.31 0.00 0.00 61.69 63.76 1wvo s THR 58 Cb -0.33 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 1wvo s THR 58 CO 0.40 0.08 0.68 -0.63 -0.69 0.00 0.00 174.62 174.46 1wvo s ILE 59 N 1.32 5.01 0.24 1.82 -1.09 -0.62 -4.89 121.20 122.99 1wvo s ILE 59 Ca 0.60 1.40 0.09 0.00 -2.23 0.00 0.00 60.65 60.50 1wvo s ILE 59 Cb -0.30 -4.02 -0.05 0.00 -1.58 0.00 0.00 42.46 36.51 1wvo s ILE 59 CO 0.28 0.29 -0.14 -0.04 -1.23 0.00 0.00 174.94 174.10 1wvo s MET 60 N 0.58 1.47 0.34 2.79 -1.94 -1.26 -1.04 119.30 120.24 1wvo s MET 60 Ca 0.36 -1.68 0.16 0.00 -1.71 0.00 0.00 55.69 52.82 1wvo s MET 60 Cb -0.18 -1.31 0.58 0.00 2.01 0.00 0.00 34.83 35.93 1wvo s MET 60 CO 0.18 0.19 1.69 1.05 -0.01 0.00 0.00 175.02 178.13 1wvo h GLU 61 N 2.42 0.00 0.00 2.03 9.09 -1.97 -3.12 114.58 123.03 1wvo h GLU 61 Ca -0.39 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.02 1wvo h GLU 61 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1wvo h GLU 61 CO 0.63 0.45 0.00 -0.85 0.05 0.00 0.00 179.01 179.28 1wvo n GLU 62 N -3.61 0.17 0.00 1.06 0.28 -1.26 -2.20 120.64 115.08 1wvo n GLU 62 Ca -0.00 0.47 0.13 0.00 -0.16 0.00 0.00 57.16 57.60 1wvo n GLU 62 Cb 0.54 -1.87 0.36 0.00 1.43 0.00 0.00 31.44 31.90 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 -2.20 1.85 -4.35 -1.84 4.77 -1.18 -4.95 117.00 109.10 1wvo n LEU 63 Ca 0.01 -0.61 -0.19 0.00 -0.03 0.00 0.00 56.01 55.20 1wvo n LEU 63 Cb 0.18 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 1wvo n LEU 63 CO 0.17 0.31 -0.43 0.68 -1.33 0.00 0.00 177.39 176.79 1wvo s VAL 64 N -2.11 1.71 0.20 4.08 -7.23 -0.93 -0.62 120.40 115.50 1wvo s VAL 64 Ca 0.32 -2.20 -0.03 0.00 -1.81 0.00 0.00 61.98 58.26 1wvo s VAL 64 Cb 0.20 -2.08 0.05 0.00 0.56 0.00 0.00 36.38 35.11 1wvo s VAL 64 CO 0.37 -0.57 0.27 -0.90 -0.31 0.00 0.00 175.10 173.96 1wvo n ASP 65 N -0.39 -0.01 -4.03 4.85 5.75 -0.73 -4.86 116.55 117.14 1wvo n ASP 65 Ca -0.08 -1.09 -0.25 0.00 -0.01 0.00 0.00 54.79 53.36 1wvo n ASP 65 Cb 0.61 -0.21 -0.17 0.00 -1.03 0.00 0.00 41.12 40.32 1wvo n ASP 65 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1wvo s ASN 66 N -2.00 1.85 -0.44 -1.12 3.84 -1.26 -4.85 114.94 110.95 1wvo s ASN 66 Ca 0.15 -0.31 -0.41 0.00 0.21 0.00 0.00 52.86 52.50 1wvo s ASN 66 Cb -0.00 -0.85 -0.17 0.00 -0.55 0.00 0.00 41.25 39.68 1wvo s ASN 66 CO 0.11 0.03 2.11 0.00 -2.79 0.00 0.00 177.10 176.57 1wvo n HIS 67 N 3.85 1.36 -0.06 0.43 1.44 -1.26 -4.67 115.22 116.31 1wvo n HIS 67 Ca -0.22 0.63 0.00 0.00 -2.01 0.00 0.00 57.72 56.11 1wvo n HIS 67 Cb 0.52 -2.37 0.00 0.00 0.12 0.00 0.00 29.99 28.26 1wvo n HIS 67 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1wvo n GLY 68 N 6.92 -0.60 3.84 -1.39 0.00 -1.26 -5.15 105.19 107.54 1wvo n GLY 68 Ca 0.49 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1wvo n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wvo s LYS 69 N -1.34 2.62 0.15 1.61 0.00 -1.26 -5.15 119.74 116.36 1wvo s LYS 69 Ca 0.00 -1.40 -0.15 0.00 0.00 0.00 0.00 55.97 54.42 1wvo s LYS 69 Cb 0.00 -2.40 0.02 0.00 0.00 0.00 0.00 37.83 35.46 1wvo s LYS 69 CO 0.00 0.03 0.40 -1.59 0.00 0.00 0.00 175.35 174.19 1wvo s LYS 70 N -4.00 1.15 0.64 1.78 -2.85 -1.26 -5.07 119.74 110.14 1wvo s LYS 70 Ca 0.42 -0.85 -0.03 0.00 -1.00 0.00 0.00 55.97 54.51 1wvo s LYS 70 Cb -0.04 0.46 0.05 0.00 -2.06 0.00 0.00 37.83 36.24 1wvo s LYS 70 CO 0.26 -0.45 0.92 0.96 0.10 0.00 0.00 175.35 177.14 1wvo s ILE 71 N -3.85 2.43 -0.07 3.79 -4.36 -1.26 -5.05 121.20 112.83 1wvo s ILE 71 Ca 0.07 -0.44 -0.28 0.00 -0.26 0.00 0.00 60.65 59.74 1wvo s ILE 71 Cb 0.02 -2.99 -0.02 0.00 1.25 0.00 0.00 42.46 40.71 1wvo s ILE 71 CO -0.07 0.00 0.94 -1.59 0.24 0.00 0.00 174.94 174.46 1wvo s LYS 72 N -5.05 4.46 -0.18 0.37 0.00 -1.26 -5.00 119.74 113.09 1wvo s LYS 72 Ca 0.59 1.30 -0.31 0.00 0.00 0.00 0.00 55.97 57.55 1wvo s LYS 72 Cb -0.10 -3.50 0.14 0.00 0.00 0.00 0.00 37.83 34.36 1wvo s LYS 72 CO 0.42 -0.17 1.13 -1.12 0.00 0.00 0.00 175.35 175.61 1wvo s SER 73 N 1.04 -0.22 0.02 0.03 0.01 -1.26 -5.20 113.70 108.11 1wvo s SER 73 Ca 0.47 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.88 1wvo s SER 73 Cb -0.19 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1wvo s SER 73 CO 0.21 -0.28 0.01 -0.24 0.41 0.00 0.00 173.24 173.35 1wvo n SER 74 N 0.31 1.48 -3.59 2.44 2.88 -1.26 -5.15 113.62 110.73 1wvo n SER 74 Ca -0.05 -1.08 -0.27 0.00 -1.33 0.00 0.00 58.87 56.14 1wvo n SER 74 Cb 0.59 0.01 0.21 0.00 -0.75 0.00 0.00 64.21 64.27 1wvo n SER 74 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wvo n GLY 75 N 4.75 -2.21 3.68 0.46 0.00 -1.26 -5.04 105.19 105.56 1wvo n GLY 75 Ca -0.00 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 1wvo n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wvo s PRO 76 N -5.46 0.84 -0.03 1.61 0.04 -1.26 -4.99 135.00 125.75 1wvo s PRO 76 Ca 0.67 0.88 0.04 0.00 0.04 0.00 0.00 61.00 62.63 1wvo s PRO 76 Cb -0.04 -1.76 0.06 0.00 0.04 0.00 0.00 34.50 32.79 1wvo s PRO 76 CO 0.50 -2.54 0.87 0.43 0.04 0.00 0.00 177.00 176.30 1wvo n SER 77 N -4.10 0.93 -3.89 6.66 7.64 -1.26 -5.07 113.62 114.53 1wvo n SER 77 Ca 0.07 -1.90 -0.10 0.00 1.01 0.00 0.00 58.87 57.95 1wvo n SER 77 Cb 0.55 -0.13 -0.09 0.00 -1.01 0.00 0.00 64.21 63.52 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 -1.05 0.09 0.00 6.43 0.15 -1.26 -5.34 113.70 112.72 1wvo s SER 78 Ca 0.06 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.33 1wvo s SER 78 Cb 0.05 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 1wvo s SER 78 CO 0.01 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 174.59