#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 0.41 -0.55 1.61 1.04 -1.26 -5.00 113.70 109.94 1wvo s SER 2 Ca 0.00 0.70 -0.11 0.00 0.48 0.00 0.00 55.95 57.03 1wvo s SER 2 Cb 0.00 -0.99 0.14 0.00 0.10 0.00 0.00 66.02 65.27 1wvo s SER 2 CO 0.00 -4.44 0.45 -0.44 0.98 0.00 0.00 173.24 169.78 1wvo s SER 3 N -3.68 5.91 0.00 7.02 0.01 -1.26 -4.81 113.70 116.89 1wvo s SER 3 Ca 0.70 -2.10 0.00 0.00 1.31 0.00 0.00 55.95 55.86 1wvo s SER 3 Cb -0.11 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.06 1wvo s SER 3 CO 0.57 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 174.15 1wvo n GLY 4 N 4.70 -2.85 3.56 3.44 0.00 -1.26 -5.12 105.19 107.65 1wvo n GLY 4 Ca -0.04 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.03 3.04 0.51 1.61 1.04 -1.26 -5.18 113.70 113.43 1wvo s SER 5 Ca 0.00 -1.56 0.01 0.00 0.48 0.00 0.00 55.95 54.88 1wvo s SER 5 Cb 0.00 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 1wvo s SER 5 CO 0.00 -0.79 0.02 -0.44 0.98 0.00 0.00 173.24 173.02 1wvo s SER 6 N -3.64 4.16 0.00 7.02 0.01 -1.26 -4.95 113.70 115.03 1wvo s SER 6 Ca 0.24 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 55.87 1wvo s SER 6 Cb 0.05 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.78 1wvo s SER 6 CO 0.13 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1wvo n GLY 7 N -1.29 5.14 3.11 3.44 0.00 -1.26 -2.10 105.19 112.23 1wvo n GLY 7 Ca -0.18 -1.35 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 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 1.04 0.84 0.06 1.61 1.04 -1.07 -4.19 113.70 113.03 1wvo s SER 8 Ca 0.00 -0.87 -0.30 0.00 0.48 0.00 0.00 55.95 55.25 1wvo s SER 8 Cb 0.00 0.11 -0.05 0.00 0.10 0.00 0.00 66.02 66.18 1wvo s SER 8 CO 0.00 -0.43 1.14 -0.69 0.98 0.00 0.00 173.24 174.24 1wvo s VAL 9 N -3.07 4.19 0.16 5.02 1.01 -0.42 -1.64 120.40 125.63 1wvo s VAL 9 Ca 0.04 1.61 0.06 0.00 0.00 0.00 0.00 61.98 63.69 1wvo s VAL 9 Cb 0.02 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1wvo s VAL 9 CO -0.05 0.14 -0.13 0.68 0.00 0.00 0.00 175.10 175.75 1wvo s VAL 10 N 0.88 1.43 0.11 2.92 -7.23 0.15 -1.42 120.40 117.24 1wvo s VAL 10 Ca 0.56 -1.98 -0.31 0.00 -1.81 0.00 0.00 61.98 58.45 1wvo s VAL 10 Cb -0.28 -1.79 -0.07 0.00 0.56 0.00 0.00 36.38 34.80 1wvo s VAL 10 CO 0.30 -0.56 1.29 0.00 -0.31 0.00 0.00 175.10 175.82 1wvo s ALA 11 N -2.73 3.50 0.17 1.32 0.00 0.38 -1.92 121.76 122.48 1wvo s ALA 11 Ca 0.16 1.01 0.02 0.00 0.00 0.00 0.00 51.96 53.14 1wvo s ALA 11 Cb -0.01 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.64 1wvo s ALA 11 CO 0.04 -0.52 1.39 -0.22 0.00 0.00 0.00 175.76 176.45 1wvo h LYS 12 N 6.49 0.21 -4.24 0.00 3.64 -1.84 -0.41 116.57 120.42 1wvo h LYS 12 Ca -0.42 -0.22 -0.18 0.00 -1.27 0.00 0.00 60.65 58.55 1wvo h LYS 12 Cb 1.21 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 32.97 1wvo h LYS 12 CO 0.82 0.94 -0.42 0.14 -2.27 0.00 0.00 179.45 178.66 1wvo s VAL 13 N -3.27 0.00 -0.17 2.00 -7.23 -1.26 -4.50 120.40 105.97 1wvo s VAL 13 Ca -0.03 -1.77 -0.29 0.00 -1.81 0.00 0.00 61.98 58.08 1wvo s VAL 13 Cb 0.10 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1wvo s VAL 13 CO 0.83 0.00 1.63 -0.75 -0.31 0.00 0.00 175.10 176.50 1wvo s LYS 14 N -4.03 3.91 -0.48 4.82 2.20 -1.26 -4.04 119.74 120.86 1wvo s LYS 14 Ca 0.33 1.84 -0.16 0.00 -0.36 0.00 0.00 55.97 57.61 1wvo s LYS 14 Cb 0.04 -4.02 0.07 0.00 -1.51 0.00 0.00 37.83 32.41 1wvo s LYS 14 CO 0.12 -1.15 0.44 0.42 -0.36 0.00 0.00 175.35 174.82 1wvo s ILE 15 N 4.86 5.17 0.45 5.43 1.01 0.11 -4.88 121.20 133.34 1wvo s ILE 15 Ca 0.72 -0.96 -0.24 0.00 0.00 0.00 0.00 60.65 60.18 1wvo s ILE 15 Cb -0.28 -4.16 -0.07 0.00 0.01 0.00 0.00 42.46 37.96 1wvo s ILE 15 CO 0.29 -0.63 1.21 -2.16 0.00 0.00 0.00 174.94 173.66 1wvo s PRO 16 N 1.83 3.76 0.70 2.79 0.04 -1.26 -0.89 135.00 141.97 1wvo s PRO 16 Ca 0.06 1.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.85 1wvo s PRO 16 Cb -0.23 -2.49 -0.02 0.00 0.04 0.00 0.00 34.50 31.80 1wvo s PRO 16 CO 0.08 -0.59 0.76 -1.91 0.04 0.00 0.00 177.00 175.37 1wvo n GLU 17 N -0.37 0.45 -1.75 4.56 0.00 -1.26 -3.23 120.64 119.05 1wvo n GLU 17 Ca 0.07 0.20 -0.11 0.00 0.00 0.00 0.00 57.16 57.32 1wvo n GLU 17 Cb 0.47 -2.02 -0.03 0.00 0.00 0.00 0.00 31.44 29.86 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 1.38 0.58 3.38 8.31 0.00 -0.95 -4.96 105.19 112.93 1wvo n GLY 18 Ca 0.12 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.46 2.36 0.20 2.61 2.01 -1.20 -4.96 115.64 114.20 1wvo s THR 19 Ca 0.00 -1.27 -0.30 0.00 0.31 0.00 0.00 61.69 60.44 1wvo s THR 19 Cb 0.00 -1.93 -0.08 0.00 0.01 0.00 0.00 72.50 70.50 1wvo s THR 19 CO 0.00 0.40 1.13 -0.63 -0.69 0.00 0.00 174.62 174.83 1wvo s ILE 20 N -0.81 3.70 0.26 1.82 -1.09 -1.26 -2.82 121.20 121.00 1wvo s ILE 20 Ca 0.12 1.50 -0.28 0.00 -2.23 0.00 0.00 60.65 59.76 1wvo s ILE 20 Cb -0.10 -3.95 -0.09 0.00 -1.58 0.00 0.00 42.46 36.73 1wvo s ILE 20 CO 0.02 0.27 0.92 -0.76 -1.23 0.00 0.00 174.94 174.16 1wvo s LEU 21 N -0.51 4.54 0.17 2.97 1.43 0.73 -4.95 118.68 123.07 1wvo s LEU 21 Ca 0.50 1.87 0.01 0.00 -1.03 0.00 0.00 54.13 55.48 1wvo s LEU 21 Cb -0.31 -3.71 -0.05 0.00 0.03 0.00 0.00 46.19 42.16 1wvo s LEU 21 CO 0.37 0.09 0.03 0.42 0.23 0.00 0.00 176.35 177.48 1wvo s THR 22 N -1.32 0.54 0.54 5.49 -4.23 -1.26 -0.62 115.64 114.77 1wvo s THR 22 Ca 0.43 -1.97 0.27 0.00 -1.18 0.00 0.00 61.69 59.25 1wvo s THR 22 Cb -0.23 -2.17 0.32 0.00 1.34 0.00 0.00 72.50 71.76 1wvo s THR 22 CO 0.29 -0.41 2.19 0.24 -0.54 0.00 0.00 174.62 176.39 1wvo h MET 23 N 2.69 0.00 0.00 3.99 2.86 -1.97 -1.19 114.93 121.31 1wvo h MET 23 Ca -0.37 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1wvo h MET 23 Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 1wvo h MET 23 CO 0.62 0.04 0.00 -3.47 1.06 0.00 0.00 176.91 175.15 1wvo n ASP 24 N -3.89 0.07 -0.04 1.22 2.03 -1.26 -3.20 116.55 111.47 1wvo n ASP 24 Ca -0.03 0.51 0.06 0.00 0.52 0.00 0.00 54.79 55.85 1wvo n ASP 24 Cb 0.13 -0.53 0.09 0.00 -0.72 0.00 0.00 41.12 40.09 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 -1.56 1.96 -3.83 -0.67 2.81 -0.47 -4.82 117.12 110.53 1wvo n MET 25 Ca 0.06 -2.16 -0.13 0.00 -1.81 0.00 0.00 57.70 53.67 1wvo n MET 25 Cb 0.32 -1.30 -0.14 0.00 -0.71 0.00 0.00 33.22 31.38 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 -2.14 1.60 0.04 4.03 1.43 -1.08 -2.87 118.68 119.70 1wvo s LEU 26 Ca 0.19 0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.30 1wvo s LEU 26 Cb 0.17 0.18 0.01 0.00 0.03 0.00 0.00 46.19 46.58 1wvo s LEU 26 CO 0.02 -0.04 0.25 0.28 0.23 0.00 0.00 176.35 177.08 1wvo s THR 27 N 0.26 0.10 -0.41 5.49 -1.32 -0.81 -4.81 115.64 114.14 1wvo s THR 27 Ca -0.02 -0.80 -0.05 0.00 -1.21 0.00 0.00 61.69 59.61 1wvo s THR 27 Cb -0.03 -0.94 0.10 0.00 -1.51 0.00 0.00 72.50 70.12 1wvo s THR 27 CO -0.01 -0.44 0.21 -0.69 -2.21 0.00 0.00 174.62 171.48 1wvo s VAL 28 N -2.62 3.55 -0.35 5.08 1.01 -1.26 -0.67 120.40 125.15 1wvo s VAL 28 Ca -0.05 -1.82 -0.29 0.00 0.00 0.00 0.00 61.98 59.82 1wvo s VAL 28 Cb -0.01 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1wvo s VAL 28 CO -0.04 -0.60 1.37 -0.75 0.00 0.00 0.00 175.10 175.08 1wvo s LYS 29 N 1.24 3.75 0.05 2.72 2.20 -0.65 -4.81 119.74 124.23 1wvo s LYS 29 Ca 0.05 1.14 -0.30 0.00 -0.36 0.00 0.00 55.97 56.50 1wvo s LYS 29 Cb -0.23 -3.96 -0.09 0.00 -1.51 0.00 0.00 37.83 32.05 1wvo s LYS 29 CO -0.02 -1.34 1.85 0.08 -0.36 0.00 0.00 175.35 175.56 1wvo s VAL 30 N 4.91 2.98 0.00 4.02 1.01 -1.26 -2.72 120.40 129.34 1wvo s VAL 30 Ca 0.60 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1wvo s VAL 30 Cb -0.16 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1wvo s VAL 30 CO 0.28 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1wvo n GLY 31 N 4.34 -2.27 3.10 4.51 0.00 -0.89 -4.91 105.19 109.07 1wvo n GLY 31 Ca 0.18 0.76 -0.09 0.00 0.00 0.00 0.00 46.02 46.88 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 0.65 0.00 1.61 -1.05 -1.24 -4.72 118.70 113.94 1wvo s GLU 32 Ca 0.00 -1.18 0.00 0.00 -0.15 0.00 0.00 54.97 53.64 1wvo s GLU 32 Cb 0.00 0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.74 1wvo s GLU 32 CO 0.00 -0.07 0.67 -0.35 0.95 0.00 0.00 175.26 176.46 1wvo n PRO 33 N 0.25 0.73 -1.93 -4.83 -0.04 -1.26 -2.61 135.00 125.32 1wvo n PRO 33 Ca -0.15 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.00 1wvo n PRO 33 Cb 0.60 -1.06 -0.04 0.00 -0.04 0.00 0.00 33.50 32.96 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 -1.84 2.41 0.00 0.54 2.20 -1.26 -4.64 119.74 117.16 1wvo s LYS 34 Ca 0.00 0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.99 1wvo s LYS 34 Cb 0.00 -4.70 0.00 0.00 -1.51 0.00 0.00 37.83 31.62 1wvo s LYS 34 CO 0.00 -3.23 0.00 0.41 -0.36 0.00 0.00 175.35 172.17 1wvo n GLY 35 N 6.28 0.81 3.77 5.54 0.00 -1.26 -4.71 105.19 115.60 1wvo n GLY 35 Ca 0.32 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.62 2.86 0.61 1.61 5.04 -0.37 -4.80 117.35 120.68 1wvo s TYR 36 Ca 0.00 1.48 -0.16 0.00 -2.44 0.00 0.00 57.07 55.96 1wvo s TYR 36 Cb 0.00 -3.52 -0.03 0.00 0.35 0.00 0.00 41.96 38.76 1wvo s TYR 36 CO 0.00 -1.77 1.08 -1.25 -1.34 0.00 0.00 175.55 172.27 1wvo s PRO 37 N -2.43 3.15 0.45 4.97 0.04 -1.26 -1.31 135.00 138.61 1wvo s PRO 37 Ca 0.60 1.30 0.20 0.00 0.04 0.00 0.00 61.00 63.14 1wvo s PRO 37 Cb -0.34 -2.00 1.07 0.00 0.04 0.00 0.00 34.50 33.27 1wvo s PRO 37 CO 0.42 -0.96 1.95 -1.00 0.04 0.00 0.00 177.00 177.45 1wvo h PRO 38 N 0.38 0.00 0.00 0.56 0.13 -1.94 -3.01 132.00 128.12 1wvo h PRO 38 Ca -0.47 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 1wvo h PRO 38 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1wvo h PRO 38 CO 0.56 0.23 -0.40 0.93 -0.23 0.00 0.00 178.00 179.09 1wvo h GLU 39 N 0.00 0.00 -0.01 0.86 5.08 -1.98 -3.20 114.58 115.34 1wvo h GLU 39 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wvo h GLU 39 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1wvo h GLU 39 CO 0.03 0.40 -0.11 -0.25 -1.00 0.00 0.00 179.01 178.08 1wvo n ASP 40 N -3.35 1.10 -0.25 1.42 8.00 -1.14 -4.29 116.55 118.05 1wvo n ASP 40 Ca 0.01 -1.12 0.22 0.00 0.71 0.00 0.00 54.79 54.61 1wvo n ASP 40 Cb 0.61 0.04 0.55 0.00 -0.02 0.00 0.00 41.12 42.30 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 1.55 0.62 -0.02 0.53 2.10 -1.61 -0.52 117.51 120.17 1wvo h ILE 41 Ca 0.00 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.83 1wvo h ILE 41 Cb 0.46 0.26 -0.00 0.00 -1.09 0.00 0.00 36.82 36.44 1wvo h ILE 41 CO 0.00 0.06 0.03 -0.26 -1.08 0.00 0.00 178.15 176.90 1wvo h PHE 42 N 0.33 0.00 0.00 2.19 0.04 -1.85 -1.10 116.94 116.56 1wvo h PHE 42 Ca 0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.26 1wvo h PHE 42 Cb 1.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.50 1wvo h PHE 42 CO -0.00 0.00 -1.46 0.27 -0.60 0.00 0.00 178.31 176.52 1wvo n ASN 43 N -3.49 0.44 0.06 2.17 0.23 -0.21 -4.00 115.26 110.45 1wvo n ASN 43 Ca -0.03 0.08 -0.08 0.00 -0.53 0.00 0.00 54.58 54.03 1wvo n ASN 43 Cb 0.11 1.21 0.06 0.00 -2.08 0.00 0.00 39.78 39.08 1wvo n ASN 43 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1wvo h LEU 44 N 0.00 0.42 -9.62 -4.53 3.38 -1.19 -3.41 115.31 100.36 1wvo h LEU 44 Ca 0.00 -0.26 -0.53 0.00 0.09 0.00 0.00 57.88 57.19 1wvo h LEU 44 Cb 0.95 -0.12 0.04 0.00 0.09 0.00 0.00 40.66 41.63 1wvo h LEU 44 CO 0.00 0.96 0.85 -0.69 0.09 0.00 0.00 178.44 179.66 1wvo s VAL 45 N -3.71 2.68 0.00 1.22 1.01 -0.97 -1.84 120.40 118.78 1wvo s VAL 45 Ca -0.05 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.43 1wvo s VAL 45 Cb 0.11 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1wvo s VAL 45 CO 0.82 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1wvo n GLY 46 N 3.53 1.57 3.79 4.51 0.00 0.20 -4.99 105.19 113.81 1wvo n GLY 46 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.69 0.67 -0.31 1.61 1.02 -0.77 -4.67 119.74 116.60 1wvo s LYS 47 Ca 0.00 0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.06 1wvo s LYS 47 Cb 0.00 -1.80 0.09 0.00 -0.52 0.00 0.00 37.83 35.60 1wvo s LYS 47 CO 0.00 -2.47 0.06 0.21 -0.92 0.00 0.00 175.35 172.23 1wvo s LYS 48 N -5.46 1.09 0.25 1.68 2.47 -1.26 -0.19 119.74 118.33 1wvo s LYS 48 Ca 0.67 -1.32 -0.27 0.00 -1.56 0.00 0.00 55.97 53.49 1wvo s LYS 48 Cb -0.11 -2.49 -0.16 0.00 -1.46 0.00 0.00 37.83 33.61 1wvo s LYS 48 CO 0.53 -0.91 0.62 1.33 0.16 0.00 0.00 175.35 177.08 1wvo n VAL 49 N 4.62 1.90 0.19 4.02 0.24 -1.13 -4.35 118.33 123.82 1wvo n VAL 49 Ca -0.01 -0.50 0.12 0.00 -2.04 0.00 0.00 64.34 61.90 1wvo n VAL 49 Cb 0.42 -0.30 0.07 0.00 -1.47 0.00 0.00 33.84 32.56 1wvo n VAL 49 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1wvo h LEU 50 N 1.20 0.00 -8.27 1.34 3.38 -1.55 -2.53 115.31 108.89 1wvo h LEU 50 Ca -0.32 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.48 1wvo h LEU 50 Cb 1.41 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 42.03 1wvo h LEU 50 CO 0.57 0.01 -0.48 0.68 0.09 0.00 0.00 178.44 179.31 1wvo s VAL 51 N -3.30 0.08 0.23 1.22 -7.23 -1.26 -4.82 120.40 105.32 1wvo s VAL 51 Ca 0.02 -1.66 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 1wvo s VAL 51 Cb 0.09 -1.98 -0.09 0.00 0.56 0.00 0.00 36.38 34.96 1wvo s VAL 51 CO 0.75 -0.35 1.06 -0.89 -0.31 0.00 0.00 175.10 175.36 1wvo s THR 52 N -4.02 3.78 -0.11 5.32 2.01 -1.26 -3.99 115.64 117.37 1wvo s THR 52 Ca 0.22 1.70 0.03 0.00 0.31 0.00 0.00 61.69 63.95 1wvo s THR 52 Cb 0.05 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.48 1wvo s THR 52 CO 0.02 0.37 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.39 1wvo s VAL 53 N -0.85 2.09 0.99 3.82 1.01 -0.07 -4.90 120.40 122.49 1wvo s VAL 53 Ca 0.45 -1.00 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 1wvo s VAL 53 Cb -0.29 -1.81 0.19 0.00 0.00 0.00 0.00 36.38 34.47 1wvo s VAL 53 CO 0.37 0.56 1.18 -1.61 0.00 0.00 0.00 175.10 175.60 1wvo s GLU 54 N 0.49 0.51 0.44 2.72 2.02 -1.26 0.05 118.70 123.67 1wvo s GLU 54 Ca -0.15 0.01 -0.24 0.00 0.02 0.00 0.00 54.97 54.62 1wvo s GLU 54 Cb -0.17 -1.79 -0.08 0.00 0.10 0.00 0.00 34.13 32.19 1wvo s GLU 54 CO 0.06 -2.57 1.17 -2.00 0.02 0.00 0.00 175.26 171.94 1wvo s GLU 55 N -5.49 3.86 0.00 1.61 2.12 -1.26 -3.00 118.70 116.54 1wvo s GLU 55 Ca 0.68 1.81 0.00 0.00 0.36 0.00 0.00 54.97 57.82 1wvo s GLU 55 Cb -0.11 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.78 1wvo s GLU 55 CO 0.54 -0.48 0.00 -0.40 -0.54 0.00 0.00 175.26 174.38 1wvo n ASP 56 N -0.29 -4.63 -4.81 -1.70 5.68 -0.16 -4.90 116.55 105.74 1wvo n ASP 56 Ca 0.06 0.00 -0.31 0.00 -0.50 0.00 0.00 54.79 54.04 1wvo n ASP 56 Cb 0.47 -3.13 0.04 0.00 -1.14 0.00 0.00 41.12 37.37 1wvo n ASP 56 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1wvo s ASP 57 N -1.86 5.40 -0.11 -1.12 2.15 -1.16 -4.64 116.67 115.32 1wvo s ASP 57 Ca 0.00 1.68 -0.25 0.00 0.43 0.00 0.00 52.55 54.41 1wvo s ASP 57 Cb 0.00 -2.51 -0.03 0.00 -0.30 0.00 0.00 42.92 40.09 1wvo s ASP 57 CO 0.00 -1.43 0.80 -0.89 -0.17 0.00 0.00 175.17 173.48 1wvo s THR 58 N -2.90 4.95 0.06 1.71 2.01 -1.26 -0.47 115.64 119.74 1wvo s THR 58 Ca 0.60 1.61 -0.26 0.00 0.31 0.00 0.00 61.69 63.94 1wvo s THR 58 Cb -0.15 -4.12 -0.06 0.00 0.01 0.00 0.00 72.50 68.19 1wvo s THR 58 CO 0.51 0.13 0.79 -0.63 -0.69 0.00 0.00 174.62 174.73 1wvo s ILE 59 N 1.49 4.68 0.06 1.82 -1.09 -0.51 -4.88 121.20 122.76 1wvo s ILE 59 Ca 0.39 1.70 -0.03 0.00 -2.23 0.00 0.00 60.65 60.49 1wvo s ILE 59 Cb -0.18 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.53 1wvo s ILE 59 CO 0.17 0.37 0.02 -0.04 -1.23 0.00 0.00 174.94 174.22 1wvo s MET 60 N -0.11 0.65 0.64 2.79 -1.94 -1.26 -1.23 119.30 118.84 1wvo s MET 60 Ca 0.40 -1.15 0.41 0.00 -1.71 0.00 0.00 55.69 53.64 1wvo s MET 60 Cb -0.21 0.24 2.21 0.00 2.01 0.00 0.00 34.83 39.08 1wvo s MET 60 CO 0.24 -0.14 2.30 1.05 -0.01 0.00 0.00 175.02 178.46 1wvo h GLU 61 N 3.09 0.00 0.00 2.03 4.11 -1.94 -1.58 114.58 120.28 1wvo h GLU 61 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 1wvo h GLU 61 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1wvo h GLU 61 CO 0.64 0.01 -0.11 -0.85 0.07 0.00 0.00 179.01 178.76 1wvo n GLU 62 N -3.17 0.15 -0.01 1.06 0.28 -1.26 -3.54 120.64 114.15 1wvo n GLU 62 Ca -0.02 0.11 0.10 0.00 -0.16 0.00 0.00 57.16 57.18 1wvo n GLU 62 Cb 0.11 -1.66 0.09 0.00 1.43 0.00 0.00 31.44 31.41 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 -1.91 2.69 -4.11 -1.84 4.77 -0.60 -4.97 117.00 111.03 1wvo n LEU 63 Ca 0.06 -1.02 -0.17 0.00 -0.03 0.00 0.00 56.01 54.84 1wvo n LEU 63 Cb 0.39 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.35 1wvo n LEU 63 CO 0.30 0.47 -0.44 0.68 -1.33 0.00 0.00 177.39 177.07 1wvo s VAL 64 N -1.65 0.90 0.65 4.08 -7.23 -1.23 -1.25 120.40 114.67 1wvo s VAL 64 Ca 0.24 -1.02 -0.10 0.00 -1.81 0.00 0.00 61.98 59.29 1wvo s VAL 64 Cb 0.17 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 36.24 1wvo s VAL 64 CO 0.25 -0.13 1.02 -0.62 -0.31 0.00 0.00 175.10 175.31 1wvo s ASP 65 N -1.29 5.73 0.55 4.85 2.15 -1.26 -4.92 116.67 122.48 1wvo s ASP 65 Ca -0.02 1.11 -0.20 0.00 0.43 0.00 0.00 52.55 53.88 1wvo s ASP 65 Cb -0.08 -2.05 -0.05 0.00 -0.30 0.00 0.00 42.92 40.44 1wvo s ASP 65 CO 0.01 -1.11 1.18 0.21 -0.17 0.00 0.00 175.17 175.29 1wvo s ASN 66 N -4.29 5.56 -0.13 -0.34 3.84 -1.26 -4.87 114.94 113.46 1wvo s ASN 66 Ca 0.56 2.31 -0.09 0.00 0.21 0.00 0.00 52.86 55.85 1wvo s ASN 66 Cb -0.11 -2.59 0.04 0.00 -0.55 0.00 0.00 41.25 38.04 1wvo s ASN 66 CO 0.51 -1.33 0.32 -2.28 -2.79 0.00 0.00 177.10 171.52 1wvo s HIS 67 N -1.64 -0.40 -0.38 0.43 2.46 -1.26 -5.00 115.29 109.50 1wvo s HIS 67 Ca 0.73 0.93 -0.06 0.00 0.47 0.00 0.00 55.06 57.13 1wvo s HIS 67 Cb -0.28 0.13 0.01 0.00 -0.13 0.00 0.00 32.58 32.31 1wvo s HIS 67 CO 0.32 -0.22 0.44 0.41 -2.47 0.00 0.00 174.74 173.21 1wvo n GLY 68 N 3.54 -1.04 3.23 1.59 0.00 -1.26 -5.09 105.19 106.15 1wvo n GLY 68 Ca -0.18 0.58 -0.10 0.00 0.00 0.00 0.00 46.02 46.32 1wvo n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wvo s LYS 69 N -2.49 1.05 -0.16 1.61 2.47 -1.26 -5.17 119.74 115.78 1wvo s LYS 69 Ca 0.10 -1.37 -0.06 0.00 -1.56 0.00 0.00 55.97 53.07 1wvo s LYS 69 Cb -0.03 0.29 0.07 0.00 -1.46 0.00 0.00 37.83 36.71 1wvo s LYS 69 CO 0.52 -0.34 0.34 -1.59 0.16 0.00 0.00 175.35 174.45 1wvo s LYS 70 N -4.04 0.25 0.75 4.03 -2.85 -1.26 -5.16 119.74 111.47 1wvo s LYS 70 Ca 0.24 0.86 -0.12 0.00 -1.00 0.00 0.00 55.97 55.95 1wvo s LYS 70 Cb 0.06 0.12 0.05 0.00 -2.06 0.00 0.00 37.83 35.99 1wvo s LYS 70 CO 0.03 -0.25 1.10 0.42 0.10 0.00 0.00 175.35 176.75 1wvo s ILE 71 N 2.33 3.23 -0.29 3.79 1.01 -1.26 -5.06 121.20 124.96 1wvo s ILE 71 Ca -0.02 0.45 0.03 0.00 0.00 0.00 0.00 60.65 61.11 1wvo s ILE 71 Cb -0.12 -2.92 0.17 0.00 0.01 0.00 0.00 42.46 39.61 1wvo s ILE 71 CO -0.11 -0.48 0.48 -0.75 0.00 0.00 0.00 174.94 174.09 1wvo s LYS 72 N -4.67 0.47 0.38 2.79 2.20 -1.26 -5.04 119.74 114.62 1wvo s LYS 72 Ca 0.63 0.36 0.10 0.00 -0.36 0.00 0.00 55.97 56.71 1wvo s LYS 72 Cb -0.18 -0.06 0.74 0.00 -1.51 0.00 0.00 37.83 36.82 1wvo s LYS 72 CO 0.52 -0.99 1.87 0.66 -0.36 0.00 0.00 175.35 177.06 1wvo h SER 73 N 8.09 0.16 -2.32 1.43 4.64 -1.98 -3.44 113.55 120.13 1wvo h SER 73 Ca -0.07 -0.04 -0.56 0.00 -0.47 0.00 0.00 61.79 60.65 1wvo h SER 73 Cb 1.15 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1wvo h SER 73 CO 0.22 0.40 1.30 -0.44 -0.87 0.00 0.00 176.83 177.44 1wvo s SER 74 N -6.90 6.11 0.00 4.97 0.01 -1.26 -4.77 113.70 111.86 1wvo s SER 74 Ca -0.05 2.21 0.00 0.00 1.31 0.00 0.00 55.95 59.43 1wvo s SER 74 Cb 0.15 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.86 1wvo s SER 74 CO 0.73 -1.39 0.00 0.61 0.41 0.00 0.00 173.24 173.61 1wvo n GLY 75 N 4.95 -0.60 3.74 3.44 0.00 -1.26 -4.98 105.19 110.48 1wvo n GLY 75 Ca 0.23 -1.74 -0.37 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 -1.51 2.87 0.83 1.61 0.04 -1.26 -5.03 135.00 132.54 1wvo s PRO 76 Ca 0.00 2.06 -0.14 0.00 0.04 0.00 0.00 61.00 62.96 1wvo s PRO 76 Cb 0.00 -2.02 0.19 0.00 0.04 0.00 0.00 34.50 32.72 1wvo s PRO 76 CO 0.00 -1.35 1.11 0.43 0.04 0.00 0.00 177.00 177.23 1wvo n SER 77 N -1.51 0.01 0.37 6.66 7.64 -1.26 -5.01 113.62 120.53 1wvo n SER 77 Ca 0.13 -1.39 -0.18 0.00 1.01 0.00 0.00 58.87 58.44 1wvo n SER 77 Cb 0.47 -0.85 -0.09 0.00 -1.01 0.00 0.00 64.21 62.73 1wvo n SER 77 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1wvo h SER 78 N -1.51 -1.11 0.00 6.43 4.64 -1.98 -3.55 113.55 116.47 1wvo h SER 78 Ca -0.36 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1wvo h SER 78 Cb 1.00 0.33 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1wvo h SER 78 CO 0.25 -0.66 0.00 0.61 -0.87 0.00 0.00 176.83 176.16