#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 -0.42 0.18 1.61 0.15 -1.26 -5.20 113.70 108.78 1wvo s SER 2 Ca 0.00 0.28 -0.24 0.00 0.70 0.00 0.00 55.95 56.69 1wvo s SER 2 Cb 0.00 0.45 0.05 0.00 -1.71 0.00 0.00 66.02 64.81 1wvo s SER 2 CO 0.00 -0.61 0.84 -0.94 1.20 0.00 0.00 173.24 173.72 1wvo s SER 3 N -1.60 -0.26 0.00 5.45 1.04 -1.26 -5.18 113.70 111.89 1wvo s SER 3 Ca -0.09 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1wvo s SER 3 Cb -0.02 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1wvo s SER 3 CO 0.03 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.82 1wvo n GLY 4 N -0.44 4.58 3.17 7.32 0.00 -1.26 -5.18 105.19 113.38 1wvo n GLY 4 Ca -0.06 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.69 -0.10 -0.16 1.61 0.01 -1.26 -5.15 113.70 107.97 1wvo s SER 5 Ca 0.00 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1wvo s SER 5 Cb 0.00 0.28 0.03 0.00 0.21 0.00 0.00 66.02 66.54 1wvo s SER 5 CO 0.00 -0.38 -0.12 -0.44 0.41 0.00 0.00 173.24 172.71 1wvo s SER 6 N -1.22 2.80 0.09 2.44 0.01 -1.26 -5.09 113.70 111.48 1wvo s SER 6 Ca -0.13 -0.57 -0.10 0.00 1.31 0.00 0.00 55.95 56.47 1wvo s SER 6 Cb -0.06 -1.14 0.03 0.00 0.21 0.00 0.00 66.02 65.06 1wvo s SER 6 CO 0.03 -0.09 0.46 0.61 0.41 0.00 0.00 173.24 174.66 1wvo n GLY 7 N 4.78 1.02 3.12 3.44 0.00 -1.23 -0.79 105.19 115.53 1wvo n GLY 7 Ca -0.16 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.09 0.33 -0.15 1.61 1.04 -1.08 -4.14 113.70 109.22 1wvo s SER 8 Ca 0.10 -0.82 -0.26 0.00 0.48 0.00 0.00 55.95 55.46 1wvo s SER 8 Cb -0.01 0.24 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 1wvo s SER 8 CO 0.03 -0.62 0.84 -0.69 0.98 0.00 0.00 173.24 173.78 1wvo s VAL 9 N -3.66 4.89 0.10 5.02 1.01 -0.36 -0.70 120.40 126.70 1wvo s VAL 9 Ca 0.04 1.66 0.09 0.00 0.00 0.00 0.00 61.98 63.77 1wvo s VAL 9 Cb 0.05 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1wvo s VAL 9 CO -0.09 0.05 -0.23 0.68 0.00 0.00 0.00 175.10 175.50 1wvo s VAL 10 N 1.98 1.90 -0.27 2.92 -7.23 -0.32 -1.83 120.40 117.55 1wvo s VAL 10 Ca 0.39 -1.54 -0.29 0.00 -1.81 0.00 0.00 61.98 58.74 1wvo s VAL 10 Cb -0.17 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.05 1wvo s VAL 10 CO 0.14 0.06 1.79 0.00 -0.31 0.00 0.00 175.10 176.78 1wvo s ALA 11 N -1.04 3.00 0.41 1.32 0.00 0.08 -1.85 121.76 123.68 1wvo s ALA 11 Ca 0.09 0.41 0.27 0.00 0.00 0.00 0.00 51.96 52.74 1wvo s ALA 11 Cb -0.10 -3.96 1.44 0.00 0.00 0.00 0.00 23.12 20.49 1wvo s ALA 11 CO 0.04 -2.40 2.07 -0.22 0.00 0.00 0.00 175.76 175.25 1wvo h LYS 12 N 12.34 0.00 -3.80 0.00 3.64 -1.30 0.27 116.57 127.72 1wvo h LYS 12 Ca -0.35 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 58.94 1wvo h LYS 12 Cb 1.17 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.87 1wvo h LYS 12 CO 1.01 0.12 -0.26 0.14 -2.27 0.00 0.00 179.45 178.19 1wvo s VAL 13 N -4.19 0.05 0.17 2.00 -7.23 -1.26 -4.66 120.40 105.28 1wvo s VAL 13 Ca -0.03 -1.32 -0.31 0.00 -1.81 0.00 0.00 61.98 58.51 1wvo s VAL 13 Cb 0.13 -1.86 -0.10 0.00 0.56 0.00 0.00 36.38 35.11 1wvo s VAL 13 CO 0.59 -0.23 1.54 -0.75 -0.31 0.00 0.00 175.10 175.94 1wvo s LYS 14 N -3.97 4.23 -0.34 4.82 2.20 -1.26 -4.32 119.74 121.10 1wvo s LYS 14 Ca 0.17 2.34 0.03 0.00 -0.36 0.00 0.00 55.97 58.15 1wvo s LYS 14 Cb 0.02 -3.15 0.10 0.00 -1.51 0.00 0.00 37.83 33.29 1wvo s LYS 14 CO 0.01 -0.58 0.06 0.42 -0.36 0.00 0.00 175.35 174.90 1wvo s ILE 15 N 1.01 2.45 0.65 5.43 1.01 0.38 -4.92 121.20 127.20 1wvo s ILE 15 Ca 0.68 -2.21 -0.16 0.00 0.00 0.00 0.00 60.65 58.96 1wvo s ILE 15 Cb -0.43 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.29 1wvo s ILE 15 CO 0.33 -0.54 1.15 -2.16 0.00 0.00 0.00 174.94 173.71 1wvo s PRO 16 N 0.97 2.77 0.53 2.79 0.04 -1.26 -0.60 135.00 140.24 1wvo s PRO 16 Ca 0.08 1.58 -0.22 0.00 0.04 0.00 0.00 61.00 62.48 1wvo s PRO 16 Cb -0.20 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 1wvo s PRO 16 CO -0.07 -1.31 1.27 -1.91 0.04 0.00 0.00 177.00 175.02 1wvo n GLU 17 N -2.16 1.59 -0.70 4.56 0.00 -1.25 -2.82 120.64 119.86 1wvo n GLU 17 Ca 0.12 0.58 0.00 0.00 0.00 0.00 0.00 57.16 57.86 1wvo n GLU 17 Cb 0.51 -2.45 0.00 0.00 0.00 0.00 0.00 31.44 29.50 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 0.87 0.56 3.51 8.31 0.00 -1.26 -4.93 105.19 112.25 1wvo n GLY 18 Ca 0.10 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.00 2.77 -0.05 2.61 2.01 -1.13 -5.02 115.64 114.83 1wvo s THR 19 Ca 0.00 -1.99 -0.04 0.00 0.31 0.00 0.00 61.69 59.98 1wvo s THR 19 Cb 0.00 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1wvo s THR 19 CO 0.00 -0.21 0.13 -0.63 -0.69 0.00 0.00 174.62 173.22 1wvo s ILE 20 N -1.95 5.22 0.17 1.82 -1.09 -1.26 -2.15 121.20 121.97 1wvo s ILE 20 Ca 0.25 -0.09 -0.30 0.00 -2.23 0.00 0.00 60.65 58.29 1wvo s ILE 20 Cb -0.07 -3.35 -0.07 0.00 -1.58 0.00 0.00 42.46 37.38 1wvo s ILE 20 CO 0.14 0.46 1.08 -0.76 -1.23 0.00 0.00 174.94 174.63 1wvo s LEU 21 N -1.48 4.49 0.14 2.97 1.43 0.27 -4.93 118.68 121.58 1wvo s LEU 21 Ca 0.21 2.06 0.05 0.00 -1.03 0.00 0.00 54.13 55.42 1wvo s LEU 21 Cb -0.12 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 1wvo s LEU 21 CO 0.11 -0.20 -0.12 0.42 0.23 0.00 0.00 176.35 176.80 1wvo s THR 22 N -0.26 1.26 0.49 5.49 -4.23 -1.26 -0.76 115.64 116.37 1wvo s THR 22 Ca 0.49 -1.95 0.40 0.00 -1.18 0.00 0.00 61.69 59.45 1wvo s THR 22 Cb -0.29 -1.74 0.42 0.00 1.34 0.00 0.00 72.50 72.23 1wvo s THR 22 CO 0.34 -0.63 2.24 0.24 -0.54 0.00 0.00 174.62 176.28 1wvo h MET 23 N 3.02 0.00 0.00 3.99 2.86 -1.97 -2.37 114.93 120.46 1wvo h MET 23 Ca -0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 1wvo h MET 23 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1wvo h MET 23 CO 0.59 0.01 0.00 0.22 1.06 0.00 0.00 176.91 178.79 1wvo h ASP 24 N 0.00 0.00 -0.24 1.22 3.58 -2.01 -3.30 116.42 115.67 1wvo h ASP 24 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1wvo h ASP 24 Cb 0.17 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1wvo h ASP 24 CO 0.00 0.00 0.00 0.23 -2.88 0.00 0.00 179.24 176.59 1wvo n MET 25 N -2.84 2.75 -4.16 0.28 2.81 -0.90 -4.94 117.12 110.13 1wvo n MET 25 Ca 0.04 -2.48 -0.16 0.00 -1.81 0.00 0.00 57.70 53.30 1wvo n MET 25 Cb 0.50 -1.57 -0.12 0.00 -0.71 0.00 0.00 33.22 31.31 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 -2.13 2.21 -0.06 4.03 1.43 -1.22 -0.87 118.68 122.07 1wvo s LEU 26 Ca 0.32 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 1wvo s LEU 26 Cb 0.24 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 46.14 1wvo s LEU 26 CO 0.10 -0.10 0.26 0.28 0.23 0.00 0.00 176.35 177.12 1wvo s THR 27 N -1.10 0.03 -0.30 5.49 -1.32 -0.77 -4.77 115.64 112.90 1wvo s THR 27 Ca -0.04 -0.26 -0.21 0.00 -1.21 0.00 0.00 61.69 59.96 1wvo s THR 27 Cb -0.09 -0.46 -0.01 0.00 -1.51 0.00 0.00 72.50 70.44 1wvo s THR 27 CO 0.01 -0.14 0.68 -0.69 -2.21 0.00 0.00 174.62 172.27 1wvo s VAL 28 N -0.55 4.89 0.53 5.08 1.01 -1.26 -1.18 120.40 128.93 1wvo s VAL 28 Ca -0.06 0.98 0.17 0.00 0.00 0.00 0.00 61.98 63.07 1wvo s VAL 28 Cb -0.04 -4.04 0.28 0.00 0.00 0.00 0.00 36.38 32.58 1wvo s VAL 28 CO 0.02 -0.16 2.15 0.50 0.00 0.00 0.00 175.10 177.61 1wvo h LYS 29 N 8.14 0.00 -6.30 2.72 3.64 -1.28 -3.47 116.57 120.02 1wvo h LYS 29 Ca -0.26 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.75 1wvo h LYS 29 Cb 1.11 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1wvo h LYS 29 CO 0.83 0.00 -0.79 0.28 -2.27 0.00 0.00 179.45 177.50 1wvo n VAL 30 N -4.48 -5.61 0.07 2.00 0.31 -1.26 -4.89 118.33 104.47 1wvo n VAL 30 Ca -0.03 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1wvo n VAL 30 Cb 0.10 -4.22 0.00 0.00 -0.91 0.00 0.00 33.84 28.81 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 -1.73 -0.96 3.13 2.92 0.00 0.03 -4.89 105.19 103.70 1wvo n GLY 31 Ca -0.16 0.19 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.38 0.72 0.00 1.61 -1.05 -1.22 -4.60 118.70 112.78 1wvo s GLU 32 Ca 0.00 -0.99 0.12 0.00 -0.15 0.00 0.00 54.97 53.95 1wvo s GLU 32 Cb 0.00 -0.47 0.71 0.00 -0.44 0.00 0.00 34.13 33.93 1wvo s GLU 32 CO 0.00 0.08 1.31 -0.35 0.95 0.00 0.00 175.26 177.25 1wvo n PRO 33 N 0.97 0.81 -2.24 -4.83 -0.04 -1.26 -2.63 135.00 125.78 1wvo n PRO 33 Ca -0.19 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.84 1wvo n PRO 33 Cb 0.56 -1.23 -0.02 0.00 -0.04 0.00 0.00 33.50 32.77 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 -2.00 3.86 0.00 0.54 2.20 -1.26 -4.76 119.74 118.31 1wvo s LYS 34 Ca 0.18 1.50 0.00 0.00 -0.36 0.00 0.00 55.97 57.29 1wvo s LYS 34 Cb 0.08 -3.97 0.00 0.00 -1.51 0.00 0.00 37.83 32.44 1wvo s LYS 34 CO 0.14 -1.21 0.00 0.41 -0.36 0.00 0.00 175.35 174.33 1wvo n GLY 35 N 4.49 2.13 3.68 5.54 0.00 -1.26 -4.60 105.19 115.16 1wvo n GLY 35 Ca 0.17 -2.16 -0.44 0.00 0.00 0.00 0.00 46.02 43.59 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 -0.65 2.18 -2.09 1.61 9.36 -0.28 -4.74 117.16 122.56 1wvo n TYR 36 Ca 0.00 0.45 -0.35 0.00 3.32 0.00 0.00 57.90 61.32 1wvo n TYR 36 Cb 0.00 -2.45 0.02 0.00 -0.63 0.00 0.00 39.34 36.28 1wvo n TYR 36 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1wvo s PRO 37 N -0.67 3.12 0.00 2.98 0.04 -1.26 -1.22 135.00 137.98 1wvo s PRO 37 Ca 0.66 1.67 0.30 0.00 0.04 0.00 0.00 61.00 63.66 1wvo s PRO 37 Cb -0.63 -1.97 1.57 0.00 0.04 0.00 0.00 34.50 33.51 1wvo s PRO 37 CO 0.52 -1.05 2.06 -0.35 0.04 0.00 0.00 177.00 178.22 1wvo n PRO 38 N -1.58 0.55 -0.00 0.56 -0.04 -1.26 -3.57 135.00 129.66 1wvo n PRO 38 Ca 0.12 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.40 1wvo n PRO 38 Cb 0.51 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.33 1wvo n PRO 38 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1wvo h GLU 39 N 0.00 0.19 0.00 0.54 4.57 -1.97 -3.32 114.58 114.59 1wvo h GLU 39 Ca 0.00 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 1wvo h GLU 39 Cb 0.21 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1wvo h GLU 39 CO 0.00 1.15 0.00 -0.25 -1.18 0.00 0.00 179.01 178.73 1wvo n ASP 40 N -4.22 0.00 -0.30 1.04 9.92 -1.24 -4.33 116.55 117.43 1wvo n ASP 40 Ca -0.17 -1.71 0.14 0.00 -0.53 0.00 0.00 54.79 52.51 1wvo n ASP 40 Cb 0.75 0.00 0.31 0.00 -0.64 0.00 0.00 41.12 41.54 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 0.40 -0.09 0.53 2.10 -1.66 0.85 117.51 119.64 1wvo h ILE 41 Ca 0.00 -0.11 0.03 0.00 1.08 0.00 0.00 64.86 65.85 1wvo h ILE 41 Cb 0.00 0.05 -0.00 0.00 -1.09 0.00 0.00 36.82 35.78 1wvo h ILE 41 CO 0.00 0.06 0.07 -0.26 -1.08 0.00 0.00 178.15 176.94 1wvo h PHE 42 N 0.32 0.00 -0.11 2.19 -1.00 -1.88 -0.87 116.94 115.59 1wvo h PHE 42 Ca 0.57 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 61.15 1wvo h PHE 42 Cb 1.13 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.69 1wvo h PHE 42 CO -0.17 0.00 -0.74 -0.91 -1.61 0.00 0.00 178.31 174.88 1wvo h ASN 43 N 0.00 0.65 -0.49 2.17 2.35 -1.17 -3.19 115.58 115.91 1wvo h ASN 43 Ca 0.04 -0.43 -0.10 0.00 -0.55 0.00 0.00 56.30 55.26 1wvo h ASN 43 Cb 0.19 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1wvo h ASN 43 CO -0.00 1.19 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.82 1wvo h LEU 44 N 0.38 0.95 -9.68 1.61 3.38 -1.15 -3.41 115.31 107.38 1wvo h LEU 44 Ca -0.04 -0.29 -0.52 0.00 0.09 0.00 0.00 57.88 57.12 1wvo h LEU 44 Cb 1.33 -0.26 0.06 0.00 0.09 0.00 0.00 40.66 41.88 1wvo h LEU 44 CO 0.14 1.05 0.94 -0.69 0.09 0.00 0.00 178.44 179.96 1wvo s VAL 45 N -4.88 2.22 0.00 1.22 1.01 -0.92 -1.45 120.40 117.60 1wvo s VAL 45 Ca -0.11 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1wvo s VAL 45 Cb 0.13 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.41 1wvo s VAL 45 CO 0.85 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1wvo n GLY 46 N 3.41 1.02 3.86 4.51 0.00 0.06 -4.96 105.19 113.10 1wvo n GLY 46 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.75 3.85 -0.14 1.61 1.02 -0.53 -4.74 119.74 120.06 1wvo s LYS 47 Ca 0.00 0.65 -0.15 0.00 0.02 0.00 0.00 55.97 56.49 1wvo s LYS 47 Cb 0.00 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.96 1wvo s LYS 47 CO 0.00 -0.10 0.34 0.21 -0.92 0.00 0.00 175.35 174.88 1wvo s LYS 48 N -3.87 4.23 1.04 1.68 2.20 -1.26 -0.57 119.74 123.19 1wvo s LYS 48 Ca 0.54 0.20 -0.12 0.00 -0.36 0.00 0.00 55.97 56.22 1wvo s LYS 48 Cb -0.10 -3.41 0.21 0.00 -1.51 0.00 0.00 37.83 33.02 1wvo s LYS 48 CO 0.30 0.27 1.07 0.14 -0.36 0.00 0.00 175.35 176.77 1wvo s VAL 49 N 0.35 2.12 -0.45 4.02 -7.23 -0.91 -0.73 120.40 117.57 1wvo s VAL 49 Ca 0.19 0.04 0.06 0.00 -1.81 0.00 0.00 61.98 60.46 1wvo s VAL 49 Cb -0.14 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 1wvo s VAL 49 CO 0.06 -0.05 0.39 0.18 -0.31 0.00 0.00 175.10 175.37 1wvo n LEU 50 N -4.39 0.66 -3.62 1.32 4.77 -1.02 -4.36 117.00 110.37 1wvo n LEU 50 Ca 0.05 -0.65 -0.10 0.00 -0.03 0.00 0.00 56.01 55.28 1wvo n LEU 50 Cb 0.56 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 1wvo n LEU 50 CO 0.57 0.14 0.30 0.68 -1.33 0.00 0.00 177.39 177.75 1wvo s VAL 51 N -1.28 0.03 -0.40 4.08 -7.23 -1.26 -4.96 120.40 109.38 1wvo s VAL 51 Ca 0.04 -0.49 -0.29 0.00 -1.81 0.00 0.00 61.98 59.44 1wvo s VAL 51 Cb 0.05 -1.31 0.00 0.00 0.56 0.00 0.00 36.38 35.68 1wvo s VAL 51 CO 0.20 -0.12 1.53 -0.89 -0.31 0.00 0.00 175.10 175.51 1wvo s THR 52 N -3.82 3.77 -0.04 5.32 2.01 -1.26 -3.76 115.64 117.86 1wvo s THR 52 Ca 0.05 0.77 -0.24 0.00 0.31 0.00 0.00 61.69 62.58 1wvo s THR 52 Cb -0.01 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 1wvo s THR 52 CO -0.08 -0.68 0.72 -0.69 -0.69 0.00 0.00 174.62 173.21 1wvo s VAL 53 N 5.93 4.98 0.80 3.82 1.01 0.24 -4.88 120.40 132.29 1wvo s VAL 53 Ca 0.66 1.51 -0.12 0.00 0.00 0.00 0.00 61.98 64.03 1wvo s VAL 53 Cb -0.16 -4.07 0.07 0.00 0.00 0.00 0.00 36.38 32.23 1wvo s VAL 53 CO 0.33 0.27 1.13 -1.61 0.00 0.00 0.00 175.10 175.22 1wvo s GLU 54 N 0.61 2.07 0.54 2.72 2.02 -1.26 -0.47 118.70 124.93 1wvo s GLU 54 Ca 0.38 0.34 -0.20 0.00 0.02 0.00 0.00 54.97 55.52 1wvo s GLU 54 Cb -0.18 -1.94 -0.06 0.00 0.10 0.00 0.00 34.13 32.04 1wvo s GLU 54 CO 0.20 -1.57 1.13 -2.00 0.02 0.00 0.00 175.26 173.04 1wvo s GLU 55 N -5.38 3.39 -0.00 1.61 2.12 -1.26 -2.81 118.70 116.37 1wvo s GLU 55 Ca 0.61 1.61 0.00 0.00 0.36 0.00 0.00 54.97 57.55 1wvo s GLU 55 Cb -0.12 -2.02 0.00 0.00 0.26 0.00 0.00 34.13 32.24 1wvo s GLU 55 CO 0.52 -0.82 0.00 -0.25 -0.54 0.00 0.00 175.26 174.17 1wvo n ASP 56 N -1.25 -5.86 -4.81 -1.70 9.92 0.94 -4.93 116.55 108.86 1wvo n ASP 56 Ca 0.11 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 54.05 1wvo n ASP 56 Cb 0.51 -3.36 -0.01 0.00 -0.64 0.00 0.00 41.12 37.62 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 -2.00 6.13 -0.22 -2.24 2.15 -1.12 -4.73 116.67 114.63 1wvo s ASP 57 Ca 0.00 1.79 -0.21 0.00 0.43 0.00 0.00 52.55 54.56 1wvo s ASP 57 Cb 0.00 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 40.07 1wvo s ASP 57 CO 0.00 -0.93 0.67 -0.89 -0.17 0.00 0.00 175.17 173.85 1wvo s THR 58 N -2.36 4.98 0.25 1.71 2.01 -1.26 -0.74 115.64 120.22 1wvo s THR 58 Ca 0.64 1.25 -0.30 0.00 0.31 0.00 0.00 61.69 63.59 1wvo s THR 58 Cb -0.15 -3.98 -0.09 0.00 0.01 0.00 0.00 72.50 68.30 1wvo s THR 58 CO 0.31 0.05 1.12 -0.63 -0.69 0.00 0.00 174.62 174.78 1wvo s ILE 59 N 2.24 3.55 0.13 1.82 -1.09 -0.76 -4.94 121.20 122.15 1wvo s ILE 59 Ca 0.29 1.48 0.05 0.00 -2.23 0.00 0.00 60.65 60.24 1wvo s ILE 59 Cb -0.16 -3.94 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 1wvo s ILE 59 CO 0.09 0.32 -0.11 -0.04 -1.23 0.00 0.00 174.94 173.97 1wvo s MET 60 N -1.08 1.01 0.55 2.79 -1.94 -1.26 -1.12 119.30 118.25 1wvo s MET 60 Ca 0.47 -1.35 0.23 0.00 -1.71 0.00 0.00 55.69 53.33 1wvo s MET 60 Cb -0.32 -0.67 1.52 0.00 2.01 0.00 0.00 34.83 37.38 1wvo s MET 60 CO 0.40 0.10 2.18 1.05 -0.01 0.00 0.00 175.02 178.73 1wvo h GLU 61 N 3.09 0.00 -0.01 2.03 4.11 -1.96 -1.39 114.58 120.45 1wvo h GLU 61 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 1wvo h GLU 61 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1wvo h GLU 61 CO 0.59 0.00 -0.19 -0.85 0.07 0.00 0.00 179.01 178.62 1wvo n GLU 62 N -4.20 0.94 -0.57 1.06 0.28 -1.26 -3.75 120.64 113.14 1wvo n GLU 62 Ca -0.02 -0.52 0.08 0.00 -0.16 0.00 0.00 57.16 56.54 1wvo n GLU 62 Cb 0.14 -1.49 0.31 0.00 1.43 0.00 0.00 31.44 31.83 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 -0.57 4.27 -3.90 -1.84 4.77 -0.52 -4.87 117.00 114.34 1wvo n LEU 63 Ca 0.14 -2.16 -0.12 0.00 -0.03 0.00 0.00 56.01 53.83 1wvo n LEU 63 Cb 0.34 -0.56 -0.14 0.00 -2.33 0.00 0.00 43.42 40.73 1wvo n LEU 63 CO 0.24 0.68 -0.37 0.68 -1.33 0.00 0.00 177.39 177.29 1wvo s VAL 64 N -1.93 0.09 -1.17 4.08 -7.23 -1.25 -2.43 120.40 110.56 1wvo s VAL 64 Ca 0.44 -0.12 -0.15 0.00 -1.81 0.00 0.00 61.98 60.34 1wvo s VAL 64 Cb 0.29 -0.10 -0.06 0.00 0.56 0.00 0.00 36.38 37.08 1wvo s VAL 64 CO 0.20 -0.02 2.22 -0.67 -0.31 0.00 0.00 175.10 176.52 1wvo n ASP 65 N 2.93 4.36 -3.78 4.85 2.03 0.09 -4.79 116.55 122.24 1wvo n ASP 65 Ca -0.13 -2.66 -0.13 0.00 0.52 0.00 0.00 54.79 52.39 1wvo n ASP 65 Cb 0.59 -1.37 -0.11 0.00 -0.72 0.00 0.00 41.12 39.51 1wvo n ASP 65 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1wvo s ASN 66 N 3.66 -0.26 0.00 1.67 3.84 -1.26 -4.73 114.94 117.86 1wvo s ASN 66 Ca 0.53 0.47 0.00 0.00 0.21 0.00 0.00 52.86 54.07 1wvo s ASN 66 Cb 0.14 0.52 0.00 0.00 -0.55 0.00 0.00 41.25 41.36 1wvo s ASN 66 CO -0.01 -0.14 0.00 1.41 -2.79 0.00 0.00 177.10 175.57 1wvo n HIS 67 N 2.71 0.00 -1.65 0.43 8.25 -1.26 -4.77 115.22 118.93 1wvo n HIS 67 Ca -0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.03 1wvo n HIS 67 Cb 0.58 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.80 1wvo n HIS 67 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1wvo s GLY 68 N 0.00 1.59 0.00 -1.41 0.00 -1.26 -4.87 107.32 101.37 1wvo s GLY 68 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 44.72 44.24 1wvo s GLY 68 CO 0.00 0.02 0.00 0.58 0.00 0.00 0.00 173.10 173.70 1wvo n LYS 69 N -3.54 0.00 -2.57 2.90 0.00 -1.26 -4.86 118.16 108.83 1wvo n LYS 69 Ca 0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.96 1wvo n LYS 69 Cb 0.59 0.00 -0.02 0.00 -0.00 0.00 0.00 35.03 35.60 1wvo n LYS 69 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1wvo s LYS 70 N 0.00 3.52 0.00 -1.58 1.02 -1.26 -4.89 119.74 116.56 1wvo s LYS 70 Ca 0.00 0.29 0.10 0.00 0.02 0.00 0.00 55.97 56.39 1wvo s LYS 70 Cb 0.00 -4.01 0.62 0.00 -0.52 0.00 0.00 37.83 33.92 1wvo s LYS 70 CO 0.00 -1.67 1.15 0.44 -0.92 0.00 0.00 175.35 174.36 1wvo n ILE 71 N 6.70 0.00 -2.85 2.17 -5.35 -1.26 -4.60 119.36 114.18 1wvo n ILE 71 Ca 0.09 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 62.14 1wvo n ILE 71 Cb 0.49 -0.40 -0.03 0.00 -1.74 0.00 0.00 39.64 37.95 1wvo n ILE 71 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1wvo s LYS 72 N -2.00 3.24 -0.73 6.28 2.20 -1.26 -4.98 119.74 122.49 1wvo s LYS 72 Ca 0.16 -1.03 -0.26 0.00 -0.36 0.00 0.00 55.97 54.47 1wvo s LYS 72 Cb 0.07 -4.43 -0.10 0.00 -1.51 0.00 0.00 37.83 31.86 1wvo s LYS 72 CO 0.12 -1.84 2.30 -1.54 -0.36 0.00 0.00 175.35 174.03 1wvo s SER 73 N 3.74 4.30 -0.28 1.43 1.04 -1.26 -4.88 113.70 117.78 1wvo s SER 73 Ca 0.26 0.17 -0.18 0.00 0.48 0.00 0.00 55.95 56.68 1wvo s SER 73 Cb -0.13 -2.54 0.09 0.00 0.10 0.00 0.00 66.02 63.54 1wvo s SER 73 CO 0.05 -3.38 0.77 -0.55 0.98 0.00 0.00 173.24 171.10 1wvo s SER 74 N 10.52 -0.80 0.23 7.02 0.15 -1.26 -5.15 113.70 124.41 1wvo s SER 74 Ca 0.88 1.34 -0.30 0.00 0.70 0.00 0.00 55.95 58.58 1wvo s SER 74 Cb -0.13 1.34 -0.09 0.00 -1.71 0.00 0.00 66.02 65.44 1wvo s SER 74 CO 0.11 -0.22 1.15 -0.83 1.20 0.00 0.00 173.24 174.66 1wvo s GLY 75 N 1.23 2.88 0.91 9.45 0.00 -1.26 -5.03 107.32 115.49 1wvo s GLY 75 Ca -0.07 0.93 -0.12 0.00 0.00 0.00 0.00 44.72 45.46 1wvo s GLY 75 CO -0.14 1.69 1.11 2.56 0.00 0.00 0.00 173.10 178.32 1wvo s PRO 76 N -0.84 1.18 -0.31 2.90 0.04 -1.26 -4.93 135.00 131.78 1wvo s PRO 76 Ca 0.49 0.49 -0.28 0.00 0.04 0.00 0.00 61.00 61.74 1wvo s PRO 76 Cb -0.32 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 1wvo s PRO 76 CO 0.39 -2.21 1.97 -1.12 0.04 0.00 0.00 177.00 176.08 1wvo s SER 77 N -3.78 5.66 -0.49 6.66 0.01 -1.26 -4.85 113.70 115.65 1wvo s SER 77 Ca 0.63 1.47 0.06 0.00 1.31 0.00 0.00 55.95 59.43 1wvo s SER 77 Cb -0.16 -2.52 0.18 0.00 0.21 0.00 0.00 66.02 63.73 1wvo s SER 77 CO 0.55 -1.87 0.62 -0.44 0.41 0.00 0.00 173.24 172.51 1wvo s SER 78 N 7.19 -0.67 0.00 2.44 0.01 -1.26 -5.35 113.70 116.05 1wvo s SER 78 Ca 0.87 -2.07 0.00 0.00 1.31 0.00 0.00 55.95 56.07 1wvo s SER 78 Cb -0.26 1.28 0.00 0.00 0.21 0.00 0.00 66.02 67.25 1wvo s SER 78 CO 0.33 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.51