#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 6.94 1.13 1.61 1.04 -1.26 -5.07 113.70 118.09 1wvo s SER 2 Ca 0.00 1.15 -0.18 0.00 0.48 0.00 0.00 55.95 57.40 1wvo s SER 2 Cb 0.00 -2.44 0.26 0.00 0.10 0.00 0.00 66.02 63.94 1wvo s SER 2 CO 0.00 -0.33 1.14 -0.94 0.98 0.00 0.00 173.24 174.08 1wvo s SER 3 N 1.10 1.55 0.00 7.02 1.04 -1.26 -5.02 113.70 118.14 1wvo s SER 3 Ca 0.37 0.67 0.00 0.00 0.48 0.00 0.00 55.95 57.47 1wvo s SER 3 Cb -0.17 -0.96 0.00 0.00 0.10 0.00 0.00 66.02 65.00 1wvo s SER 3 CO 0.14 -3.74 0.00 0.61 0.98 0.00 0.00 173.24 171.23 1wvo n GLY 4 N -1.41 0.86 3.41 7.32 0.00 -1.26 -5.19 105.19 108.93 1wvo n GLY 4 Ca 0.12 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1wvo n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wvo s SER 5 N 0.00 2.78 0.00 1.61 0.15 -1.26 -5.07 113.70 111.91 1wvo s SER 5 Ca 0.00 -1.14 0.00 0.00 0.70 0.00 0.00 55.95 55.51 1wvo s SER 5 Cb 0.00 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.14 1wvo s SER 5 CO 0.00 -0.27 0.53 -1.54 1.20 0.00 0.00 173.24 173.16 1wvo n SER 6 N -0.54 0.26 -0.40 5.45 3.41 -1.26 -5.05 113.62 115.49 1wvo n SER 6 Ca -0.06 -1.13 0.00 0.00 -0.26 0.00 0.00 58.87 57.42 1wvo n SER 6 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1wvo n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wvo n GLY 7 N -0.06 1.48 3.11 5.00 0.00 -1.26 -0.14 105.19 113.32 1wvo n GLY 7 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 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 0.80 0.47 0.00 1.61 1.04 -0.90 -4.04 113.70 112.67 1wvo s SER 8 Ca 0.00 -1.06 -0.24 0.00 0.48 0.00 0.00 55.95 55.13 1wvo s SER 8 Cb 0.00 0.22 -0.05 0.00 0.10 0.00 0.00 66.02 66.29 1wvo s SER 8 CO 0.00 -0.63 0.72 -0.69 0.98 0.00 0.00 173.24 173.62 1wvo s VAL 9 N -3.94 4.86 0.18 5.02 1.01 -0.30 -1.15 120.40 126.08 1wvo s VAL 9 Ca 0.12 1.52 0.06 0.00 0.00 0.00 0.00 61.98 63.67 1wvo s VAL 9 Cb 0.08 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1wvo s VAL 9 CO -0.07 0.34 -0.11 0.68 0.00 0.00 0.00 175.10 175.94 1wvo s VAL 10 N 0.20 1.40 -0.12 2.92 -7.23 -0.37 -1.57 120.40 115.63 1wvo s VAL 10 Ca 0.37 -2.12 -0.29 0.00 -1.81 0.00 0.00 61.98 58.13 1wvo s VAL 10 Cb -0.19 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1wvo s VAL 10 CO 0.21 -0.64 1.56 0.00 -0.31 0.00 0.00 175.10 175.92 1wvo s ALA 11 N -3.18 3.54 0.34 1.32 0.00 0.44 -1.26 121.76 122.96 1wvo s ALA 11 Ca 0.20 0.72 0.16 0.00 0.00 0.00 0.00 51.96 53.05 1wvo s ALA 11 Cb 0.02 -3.74 0.82 0.00 0.00 0.00 0.00 23.12 20.22 1wvo s ALA 11 CO 0.04 -1.48 1.84 -0.22 0.00 0.00 0.00 175.76 175.94 1wvo h LYS 12 N 9.54 0.00 -4.09 0.00 3.64 -1.24 0.44 116.57 124.86 1wvo h LYS 12 Ca -0.35 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 58.89 1wvo h LYS 12 Cb 1.16 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.85 1wvo h LYS 12 CO 0.97 0.34 -0.38 0.14 -2.27 0.00 0.00 179.45 178.24 1wvo s VAL 13 N -4.07 0.03 0.09 2.00 -7.23 -1.26 -4.67 120.40 105.29 1wvo s VAL 13 Ca -0.02 -1.63 -0.31 0.00 -1.81 0.00 0.00 61.98 58.21 1wvo s VAL 13 Cb 0.13 -2.17 -0.08 0.00 0.56 0.00 0.00 36.38 34.83 1wvo s VAL 13 CO 0.70 -0.13 1.42 -0.75 -0.31 0.00 0.00 175.10 176.02 1wvo s LYS 14 N -4.05 4.30 -0.38 4.82 2.20 -1.26 -4.32 119.74 121.04 1wvo s LYS 14 Ca 0.26 2.09 -0.04 0.00 -0.36 0.00 0.00 55.97 57.92 1wvo s LYS 14 Cb 0.04 -3.33 0.09 0.00 -1.51 0.00 0.00 37.83 33.12 1wvo s LYS 14 CO 0.07 -0.49 0.17 0.42 -0.36 0.00 0.00 175.35 175.15 1wvo s ILE 15 N 1.45 3.49 0.49 5.43 1.01 0.61 -4.89 121.20 128.79 1wvo s ILE 15 Ca 0.65 -1.70 -0.22 0.00 0.00 0.00 0.00 60.65 59.39 1wvo s ILE 15 Cb -0.36 -3.22 -0.07 0.00 0.01 0.00 0.00 42.46 38.81 1wvo s ILE 15 CO 0.30 -0.49 1.15 -2.16 0.00 0.00 0.00 174.94 173.73 1wvo s PRO 16 N 1.25 3.63 0.28 2.79 0.04 -1.26 -0.65 135.00 141.08 1wvo s PRO 16 Ca 0.03 1.70 -0.28 0.00 0.04 0.00 0.00 61.00 62.49 1wvo s PRO 16 Cb -0.22 -2.26 -0.14 0.00 0.04 0.00 0.00 34.50 31.92 1wvo s PRO 16 CO -0.02 -0.65 0.99 -1.91 0.04 0.00 0.00 177.00 175.45 1wvo n GLU 17 N -0.78 1.25 -0.35 4.56 0.00 -1.24 -2.11 120.64 121.97 1wvo n GLU 17 Ca 0.09 0.44 0.00 0.00 0.00 0.00 0.00 57.16 57.69 1wvo n GLU 17 Cb 0.49 -1.79 0.00 0.00 0.00 0.00 0.00 31.44 30.14 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 1.32 1.08 3.77 8.31 0.00 -0.33 -4.94 105.19 114.40 1wvo n GLY 18 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.90 4.26 0.14 2.61 2.01 -0.89 -4.80 115.64 116.07 1wvo s THR 19 Ca 0.00 1.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.53 1wvo s THR 19 Cb 0.00 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 68.25 1wvo s THR 19 CO 0.00 0.49 1.00 -0.63 -0.69 0.00 0.00 174.62 174.79 1wvo s ILE 20 N -1.20 4.29 0.08 1.82 -1.09 -1.26 -1.86 121.20 121.98 1wvo s ILE 20 Ca 0.38 1.94 -0.30 0.00 -2.23 0.00 0.00 60.65 60.45 1wvo s ILE 20 Cb -0.24 -4.24 -0.06 0.00 -1.58 0.00 0.00 42.46 36.34 1wvo s ILE 20 CO 0.28 0.32 1.14 -0.76 -1.23 0.00 0.00 174.94 174.69 1wvo s LEU 21 N -0.19 4.40 0.21 2.97 1.43 0.75 -4.92 118.68 123.33 1wvo s LEU 21 Ca 0.47 1.98 0.06 0.00 -1.03 0.00 0.00 54.13 55.62 1wvo s LEU 21 Cb -0.25 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.33 1wvo s LEU 21 CO 0.31 -0.38 -0.11 0.42 0.23 0.00 0.00 176.35 176.83 1wvo s THR 22 N 0.71 1.54 0.51 5.49 -4.23 -1.26 -1.03 115.64 117.37 1wvo s THR 22 Ca 0.55 -2.15 0.22 0.00 -1.18 0.00 0.00 61.69 59.13 1wvo s THR 22 Cb -0.28 -2.10 0.28 0.00 1.34 0.00 0.00 72.50 71.73 1wvo s THR 22 CO 0.31 -0.55 2.13 0.24 -0.54 0.00 0.00 174.62 176.21 1wvo h MET 23 N 2.55 0.00 0.00 3.99 2.86 -1.96 -1.91 114.93 120.45 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 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1wvo h MET 23 CO 0.63 0.07 0.00 -0.25 1.06 0.00 0.00 176.91 178.42 1wvo n ASP 24 N -4.10 0.00 -0.39 1.22 8.00 -1.26 -2.99 116.55 117.03 1wvo n ASP 24 Ca -0.03 0.24 0.04 0.00 0.71 0.00 0.00 54.79 55.75 1wvo n ASP 24 Cb 0.15 -0.40 0.08 0.00 -0.02 0.00 0.00 41.12 40.94 1wvo n ASP 24 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1wvo n MET 25 N -1.40 2.25 -4.34 -1.24 2.81 -0.72 -4.81 117.12 109.68 1wvo n MET 25 Ca 0.08 -1.65 -0.24 0.00 -1.81 0.00 0.00 57.70 54.08 1wvo n MET 25 Cb 0.21 -1.17 -0.12 0.00 -0.71 0.00 0.00 33.22 31.44 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 -0.91 2.38 0.13 4.03 1.43 -1.16 -0.87 118.68 123.71 1wvo s LEU 26 Ca 0.14 -0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 1wvo s LEU 26 Cb 0.07 -0.95 0.01 0.00 0.03 0.00 0.00 46.19 45.36 1wvo s LEU 26 CO 0.10 0.05 0.32 0.28 0.23 0.00 0.00 176.35 177.33 1wvo s THR 27 N -1.57 0.09 -0.39 5.49 -1.32 -0.39 -4.55 115.64 113.00 1wvo s THR 27 Ca 0.13 -0.98 -0.04 0.00 -1.21 0.00 0.00 61.69 59.58 1wvo s THR 27 Cb -0.08 -1.42 0.09 0.00 -1.51 0.00 0.00 72.50 69.57 1wvo s THR 27 CO 0.06 -0.40 0.17 -0.69 -2.21 0.00 0.00 174.62 171.55 1wvo s VAL 28 N -3.87 3.48 -0.64 5.08 1.01 -1.26 -1.23 120.40 122.97 1wvo s VAL 28 Ca 0.07 -1.71 -0.27 0.00 0.00 0.00 0.00 61.98 60.07 1wvo s VAL 28 Cb 0.03 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.21 1wvo s VAL 28 CO -0.08 -0.50 1.34 -0.75 0.00 0.00 0.00 175.10 175.11 1wvo s LYS 29 N 1.25 3.25 0.00 2.72 2.47 -0.30 -4.91 119.74 124.22 1wvo s LYS 29 Ca 0.04 0.14 -0.30 0.00 -1.56 0.00 0.00 55.97 54.28 1wvo s LYS 29 Cb -0.22 -4.14 -0.06 0.00 -1.46 0.00 0.00 37.83 31.94 1wvo s LYS 29 CO -0.02 -2.03 1.59 0.08 0.16 0.00 0.00 175.35 175.14 1wvo s VAL 30 N 5.92 3.42 0.00 4.02 1.01 -1.26 -2.43 120.40 131.08 1wvo s VAL 30 Ca 0.44 0.72 0.00 0.00 0.00 0.00 0.00 61.98 63.15 1wvo s VAL 30 Cb -0.09 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1wvo s VAL 30 CO 0.21 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.89 1wvo n GLY 31 N 3.97 -1.10 3.21 4.51 0.00 0.80 -4.93 105.19 111.66 1wvo n GLY 31 Ca 0.16 0.46 -0.10 0.00 0.00 0.00 0.00 46.02 46.54 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 0.79 0.00 1.61 -1.05 -1.26 -4.78 118.70 114.02 1wvo s GLU 32 Ca 0.00 -0.72 0.29 0.00 -0.15 0.00 0.00 54.97 54.39 1wvo s GLU 32 Cb 0.00 0.33 1.71 0.00 -0.44 0.00 0.00 34.13 35.73 1wvo s GLU 32 CO 0.00 -0.25 2.08 -0.35 0.95 0.00 0.00 175.26 177.69 1wvo n PRO 33 N 0.35 0.97 -1.61 -4.83 -0.04 -1.26 -2.13 135.00 126.45 1wvo n PRO 33 Ca -0.17 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.88 1wvo n PRO 33 Cb 0.60 -1.46 -0.03 0.00 -0.04 0.00 0.00 33.50 32.57 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 2.82 0.00 0.54 2.20 -1.26 -4.16 119.74 117.87 1wvo s LYS 34 Ca 0.43 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 57.85 1wvo s LYS 34 Cb 0.20 -4.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.08 1wvo s LYS 34 CO 0.33 -2.46 0.00 0.41 -0.36 0.00 0.00 175.35 173.27 1wvo n GLY 35 N 5.83 0.60 3.07 5.54 0.00 -1.26 -4.77 105.19 114.19 1wvo n GLY 35 Ca 0.32 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.11 0.15 1.61 6.14 -1.10 -4.56 117.35 119.48 1wvo s TYR 36 Ca 0.00 0.27 -0.31 0.00 0.64 0.00 0.00 57.07 57.67 1wvo s TYR 36 Cb 0.00 0.03 -0.08 0.00 0.42 0.00 0.00 41.96 42.33 1wvo s TYR 36 CO 0.00 -0.15 1.35 -1.25 0.64 0.00 0.00 175.55 176.14 1wvo s PRO 37 N -0.36 4.35 0.51 4.97 0.04 -1.26 -1.15 135.00 142.10 1wvo s PRO 37 Ca -0.05 2.06 0.32 0.00 0.04 0.00 0.00 61.00 63.37 1wvo s PRO 37 Cb -0.03 -3.22 1.24 0.00 0.04 0.00 0.00 34.50 32.53 1wvo s PRO 37 CO 0.01 -0.35 1.93 -1.00 0.04 0.00 0.00 177.00 177.63 1wvo h PRO 38 N 6.11 0.00 -0.13 0.56 0.13 -1.88 -2.87 132.00 133.91 1wvo h PRO 38 Ca -0.43 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.64 1wvo h PRO 38 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1wvo h PRO 38 CO 0.82 0.00 -0.18 0.93 -0.23 0.00 0.00 178.00 179.34 1wvo h GLU 39 N 0.00 0.22 -0.43 0.86 3.07 -1.94 -2.77 114.58 113.59 1wvo h GLU 39 Ca 0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1wvo h GLU 39 Cb 0.54 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1wvo h GLU 39 CO 0.00 0.40 0.00 -0.25 -1.40 0.00 0.00 179.01 177.76 1wvo n ASP 40 N -4.24 4.38 -0.25 1.42 8.00 -1.09 -4.69 116.55 120.09 1wvo n ASP 40 Ca -0.01 -2.75 0.26 0.00 0.71 0.00 0.00 54.79 53.00 1wvo n ASP 40 Cb 0.30 -0.54 0.62 0.00 -0.02 0.00 0.00 41.12 41.48 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 2.82 0.55 -0.16 0.53 2.10 -1.43 -0.68 117.51 121.24 1wvo h ILE 41 Ca 0.00 -0.07 0.05 0.00 1.08 0.00 0.00 64.86 65.92 1wvo h ILE 41 Cb 1.48 0.34 -0.01 0.00 -1.09 0.00 0.00 36.82 37.54 1wvo h ILE 41 CO 0.26 0.04 0.20 -0.26 -1.08 0.00 0.00 178.15 177.31 1wvo h PHE 42 N 0.20 0.00 0.00 2.19 0.04 -1.85 -0.20 116.94 117.32 1wvo h PHE 42 Ca 0.50 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.27 1wvo h PHE 42 Cb 1.61 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.76 1wvo h PHE 42 CO -0.00 0.00 -0.12 -0.91 -0.60 0.00 0.00 178.31 176.68 1wvo h ASN 43 N 0.00 0.00 0.48 2.17 2.35 -1.51 -3.25 115.58 115.82 1wvo h ASN 43 Ca 0.08 -0.02 -0.22 0.00 -0.55 0.00 0.00 56.30 55.59 1wvo h ASN 43 Cb 0.48 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.84 1wvo h ASN 43 CO -0.00 0.01 -0.97 -0.07 -1.65 0.00 0.00 177.43 174.75 1wvo h LEU 44 N 0.00 0.41 -9.60 1.61 3.38 -1.17 -3.43 115.31 106.52 1wvo h LEU 44 Ca 0.00 -0.35 -0.52 0.00 0.09 0.00 0.00 57.88 57.10 1wvo h LEU 44 Cb 0.87 -0.13 0.05 0.00 0.09 0.00 0.00 40.66 41.53 1wvo h LEU 44 CO 0.00 1.17 0.96 -0.69 0.09 0.00 0.00 178.44 179.97 1wvo s VAL 45 N -3.14 2.47 0.00 1.22 1.01 -1.22 -1.54 120.40 119.20 1wvo s VAL 45 Ca -0.04 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1wvo s VAL 45 Cb 0.09 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1wvo s VAL 45 CO 0.86 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1wvo n GLY 46 N 3.90 2.43 3.80 4.51 0.00 -0.20 -4.98 105.19 114.65 1wvo n GLY 46 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.91 1.43 -0.05 1.61 1.02 -0.59 -4.69 119.74 117.58 1wvo s LYS 47 Ca 0.00 0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.39 1wvo s LYS 47 Cb 0.00 -1.87 -0.00 0.00 -0.52 0.00 0.00 37.83 35.44 1wvo s LYS 47 CO 0.00 -2.01 -0.17 0.21 -0.92 0.00 0.00 175.35 172.46 1wvo s LYS 48 N -5.27 1.84 0.35 1.68 2.20 -1.26 -0.18 119.74 119.10 1wvo s LYS 48 Ca 0.63 -0.62 -0.28 0.00 -0.36 0.00 0.00 55.97 55.34 1wvo s LYS 48 Cb -0.14 -1.59 -0.10 0.00 -1.51 0.00 0.00 37.83 34.49 1wvo s LYS 48 CO 0.53 0.24 1.27 0.14 -0.36 0.00 0.00 175.35 177.17 1wvo s VAL 49 N 0.06 2.81 -0.63 4.02 -7.23 -0.78 -1.35 120.40 117.30 1wvo s VAL 49 Ca -0.04 0.78 0.23 0.00 -1.81 0.00 0.00 61.98 61.13 1wvo s VAL 49 Cb -0.12 -3.48 -0.10 0.00 0.56 0.00 0.00 36.38 33.24 1wvo s VAL 49 CO 0.02 0.16 1.05 0.18 -0.31 0.00 0.00 175.10 176.20 1wvo n LEU 50 N 0.58 0.62 -3.86 1.32 4.77 -0.01 -1.19 117.00 119.23 1wvo n LEU 50 Ca 0.01 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1wvo n LEU 50 Cb 0.43 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.34 1wvo n LEU 50 CO 0.57 0.04 -0.11 0.68 -1.33 0.00 0.00 177.39 177.24 1wvo s VAL 51 N -3.19 0.14 -0.59 4.08 -7.23 -1.26 -4.85 120.40 107.50 1wvo s VAL 51 Ca 0.04 -1.14 -0.27 0.00 -1.81 0.00 0.00 61.98 58.80 1wvo s VAL 51 Cb 0.14 -1.25 -0.01 0.00 0.56 0.00 0.00 36.38 35.82 1wvo s VAL 51 CO 0.80 -0.63 1.78 -0.89 -0.31 0.00 0.00 175.10 175.84 1wvo s THR 52 N -3.58 3.43 -0.23 5.32 2.01 -1.26 -3.71 115.64 117.62 1wvo s THR 52 Ca 0.03 0.28 -0.29 0.00 0.31 0.00 0.00 61.69 62.02 1wvo s THR 52 Cb 0.04 -4.02 0.01 0.00 0.01 0.00 0.00 72.50 68.54 1wvo s THR 52 CO -0.09 -0.95 1.05 -0.69 -0.69 0.00 0.00 174.62 173.25 1wvo s VAL 53 N 8.41 4.65 0.89 3.82 1.01 0.18 -4.89 120.40 134.47 1wvo s VAL 53 Ca 0.65 1.99 -0.12 0.00 0.00 0.00 0.00 61.98 64.50 1wvo s VAL 53 Cb -0.13 -4.30 0.13 0.00 0.00 0.00 0.00 36.38 32.08 1wvo s VAL 53 CO 0.22 -0.19 1.10 -1.61 0.00 0.00 0.00 175.10 174.62 1wvo s GLU 54 N 3.24 1.30 0.47 2.72 2.02 -1.26 -0.28 118.70 126.91 1wvo s GLU 54 Ca 0.45 0.60 -0.24 0.00 0.02 0.00 0.00 54.97 55.79 1wvo s GLU 54 Cb -0.15 -1.83 -0.07 0.00 0.10 0.00 0.00 34.13 32.17 1wvo s GLU 54 CO 0.07 -2.16 1.40 -2.00 0.02 0.00 0.00 175.26 172.59 1wvo s GLU 55 N -5.08 3.56 0.00 1.61 2.12 -1.26 -2.43 118.70 117.22 1wvo s GLU 55 Ca 0.63 2.35 0.00 0.00 0.36 0.00 0.00 54.97 58.31 1wvo s GLU 55 Cb -0.16 -2.55 0.00 0.00 0.26 0.00 0.00 34.13 31.67 1wvo s GLU 55 CO 0.56 -0.89 0.00 -3.47 -0.54 0.00 0.00 175.26 170.91 1wvo n ASP 56 N -0.40 -1.99 -4.78 -1.70 2.03 0.15 -4.92 116.55 104.93 1wvo n ASP 56 Ca 0.06 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.05 1wvo n ASP 56 Cb 0.43 -2.31 0.03 0.00 -0.72 0.00 0.00 41.12 38.55 1wvo n ASP 56 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wvo s ASP 57 N -2.13 5.38 0.02 1.67 2.15 -1.02 -4.54 116.67 118.20 1wvo s ASP 57 Ca 0.00 1.91 -0.30 0.00 0.43 0.00 0.00 52.55 54.59 1wvo s ASP 57 Cb 0.00 -2.54 -0.06 0.00 -0.30 0.00 0.00 42.92 40.02 1wvo s ASP 57 CO 0.00 -1.45 1.33 -0.89 -0.17 0.00 0.00 175.17 173.99 1wvo s THR 58 N -2.42 3.79 0.01 1.71 2.01 -1.26 -0.42 115.64 119.06 1wvo s THR 58 Ca 0.65 1.21 -0.18 0.00 0.31 0.00 0.00 61.69 63.68 1wvo s THR 58 Cb -0.18 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.49 1wvo s THR 58 CO 0.40 0.03 0.52 -0.63 -0.69 0.00 0.00 174.62 174.25 1wvo s ILE 59 N 1.87 4.92 0.03 1.82 -1.09 -0.61 -4.88 121.20 123.27 1wvo s ILE 59 Ca 0.62 1.08 0.01 0.00 -2.23 0.00 0.00 60.65 60.12 1wvo s ILE 59 Cb -0.31 -3.84 -0.00 0.00 -1.58 0.00 0.00 42.46 36.73 1wvo s ILE 59 CO 0.27 0.50 0.03 0.23 -1.23 0.00 0.00 174.94 174.74 1wvo n MET 60 N 2.22 0.04 0.05 2.79 2.81 -1.26 -2.70 117.12 121.07 1wvo n MET 60 Ca -0.10 -0.30 -0.19 0.00 -1.81 0.00 0.00 57.70 55.30 1wvo n MET 60 Cb 0.51 0.25 -0.14 0.00 -0.71 0.00 0.00 33.22 33.13 1wvo n MET 60 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1wvo h GLU 61 N 0.00 0.29 0.00 0.03 4.22 -1.94 -3.34 114.58 113.83 1wvo h GLU 61 Ca -0.02 -0.49 0.00 0.00 0.08 0.00 0.00 59.36 58.93 1wvo h GLU 61 Cb 0.11 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1wvo h GLU 61 CO 0.03 1.16 0.00 -0.85 -2.18 0.00 0.00 179.01 177.17 1wvo n GLU 62 N -3.48 0.06 -0.09 1.92 0.00 -1.26 -1.72 120.64 116.08 1wvo n GLU 62 Ca -0.22 0.45 0.11 0.00 0.00 0.00 0.00 57.16 57.50 1wvo n GLU 62 Cb 1.06 -1.66 0.15 0.00 0.00 0.00 0.00 31.44 30.99 1wvo n GLU 62 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1wvo n LEU 63 N -1.78 3.12 -4.13 -1.84 4.77 -1.25 -4.93 117.00 110.96 1wvo n LEU 63 Ca 0.01 -1.24 -0.12 0.00 -0.03 0.00 0.00 56.01 54.63 1wvo n LEU 63 Cb 0.09 -0.11 -0.11 0.00 -2.33 0.00 0.00 43.42 40.96 1wvo n LEU 63 CO 0.09 0.60 -0.40 0.68 -1.33 0.00 0.00 177.39 177.03 1wvo s VAL 64 N -1.67 0.68 0.76 4.08 -7.23 -0.70 -0.83 120.40 115.49 1wvo s VAL 64 Ca 0.31 -1.54 -0.11 0.00 -1.81 0.00 0.00 61.98 58.83 1wvo s VAL 64 Cb 0.20 -1.20 0.05 0.00 0.56 0.00 0.00 36.38 35.99 1wvo s VAL 64 CO 0.29 -0.62 1.10 1.51 -0.31 0.00 0.00 175.10 177.07 1wvo s ASP 65 N -2.35 4.88 -0.07 4.85 1.47 -0.46 -4.89 116.67 120.10 1wvo s ASP 65 Ca 0.02 1.25 -0.30 0.00 1.18 0.00 0.00 52.55 54.70 1wvo s ASP 65 Cb -0.02 -2.01 -0.04 0.00 -0.34 0.00 0.00 42.92 40.50 1wvo s ASP 65 CO -0.02 -1.71 1.44 0.20 0.68 0.00 0.00 175.17 175.76 1wvo s ASN 66 N -4.07 6.82 0.49 2.11 -0.87 -1.26 -4.56 114.94 113.59 1wvo s ASN 66 Ca 0.60 2.02 0.27 0.00 -1.57 0.00 0.00 52.86 54.17 1wvo s ASN 66 Cb -0.13 -2.54 1.34 0.00 -0.02 0.00 0.00 41.25 39.90 1wvo s ASN 66 CO 0.53 -0.81 1.86 1.12 -2.57 0.00 0.00 177.10 177.24 1wvo h HIS 67 N 8.56 0.22 -0.14 2.20 2.07 -1.93 -2.17 115.15 123.96 1wvo h HIS 67 Ca -0.35 0.01 -0.03 0.00 -2.85 0.00 0.00 60.37 57.15 1wvo h HIS 67 Cb 1.15 -0.06 -0.01 0.00 2.57 0.00 0.00 27.41 31.06 1wvo h HIS 67 CO 0.82 0.04 -0.06 0.78 -3.07 0.00 0.00 177.93 176.44 1wvo h GLY 68 N 0.15 0.21 -4.41 6.13 0.00 -1.98 -3.46 103.07 99.71 1wvo h GLY 68 Ca 0.47 -0.11 0.22 0.00 0.00 0.00 0.00 47.33 47.91 1wvo h GLY 68 CO -0.08 0.10 0.84 -1.59 0.00 0.00 0.00 176.54 175.81 1wvo s LYS 69 N -4.88 0.23 -0.20 4.80 0.00 -0.82 -5.15 119.74 113.72 1wvo s LYS 69 Ca -0.06 -0.00 -0.12 0.00 0.00 0.00 0.00 55.97 55.79 1wvo s LYS 69 Cb 0.16 0.11 -0.05 0.00 0.00 0.00 0.00 37.83 38.05 1wvo s LYS 69 CO 0.72 -0.08 0.22 -1.59 0.00 0.00 0.00 175.35 174.61 1wvo s LYS 70 N -1.55 4.19 -0.38 1.78 -2.85 -1.26 -4.25 119.74 115.42 1wvo s LYS 70 Ca 0.07 -0.08 0.11 0.00 -1.00 0.00 0.00 55.97 55.08 1wvo s LYS 70 Cb -0.01 -3.46 0.33 0.00 -2.06 0.00 0.00 37.83 32.63 1wvo s LYS 70 CO -0.05 0.19 0.70 0.44 0.10 0.00 0.00 175.35 176.73 1wvo n ILE 71 N 3.79 -0.12 -2.12 3.79 -5.35 -1.26 -5.06 119.36 113.02 1wvo n ILE 71 Ca -0.14 -4.52 -0.34 0.00 -0.27 0.00 0.00 62.75 57.49 1wvo n ILE 71 Cb 0.52 -0.66 -0.04 0.00 -1.74 0.00 0.00 39.64 37.71 1wvo n ILE 71 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1wvo s LYS 72 N -2.22 2.71 0.31 6.28 -0.14 -1.26 -4.89 119.74 120.53 1wvo s LYS 72 Ca 0.39 0.04 0.04 0.00 -1.36 0.00 0.00 55.97 55.08 1wvo s LYS 72 Cb 0.31 -4.73 -0.02 0.00 -1.68 0.00 0.00 37.83 31.70 1wvo s LYS 72 CO -0.09 -2.92 0.30 -1.12 -0.76 0.00 0.00 175.35 170.76 1wvo s SER 73 N 7.52 1.26 -1.04 2.83 0.01 -1.26 -5.09 113.70 117.92 1wvo s SER 73 Ca 0.64 -1.63 -0.23 0.00 1.31 0.00 0.00 55.95 56.04 1wvo s SER 73 Cb -0.09 0.55 -0.01 0.00 0.21 0.00 0.00 66.02 66.69 1wvo s SER 73 CO 0.09 -1.08 1.77 -0.94 0.41 0.00 0.00 173.24 173.49 1wvo s SER 74 N -3.31 5.76 0.00 2.44 1.04 -1.26 -4.87 113.70 113.50 1wvo s SER 74 Ca 0.38 -1.34 0.00 0.00 0.48 0.00 0.00 55.95 55.47 1wvo s SER 74 Cb 0.02 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1wvo s SER 74 CO 0.24 -2.22 0.00 0.61 0.98 0.00 0.00 173.24 172.84 1wvo n GLY 75 N 6.47 0.71 3.70 7.32 0.00 -1.26 -5.18 105.19 116.95 1wvo n GLY 75 Ca 0.40 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.00 0.51 0.00 1.61 0.04 -1.26 -5.09 135.00 128.81 1wvo s PRO 76 Ca 0.00 0.40 0.00 0.00 0.04 0.00 0.00 61.00 61.44 1wvo s PRO 76 Cb 0.00 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.78 1wvo s PRO 76 CO 0.00 -2.65 0.00 -1.13 0.04 0.00 0.00 177.00 173.26 1wvo n SER 77 N -4.10 0.00 -3.68 6.66 3.41 -1.26 -5.10 113.62 109.55 1wvo n SER 77 Ca 0.06 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.66 1wvo n SER 77 Cb 0.58 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.52 1wvo n SER 77 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wvo s SER 78 N -0.57 -0.11 0.00 4.04 0.15 -1.26 -5.25 113.70 110.70 1wvo s SER 78 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1wvo s SER 78 Cb 0.00 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1wvo s SER 78 CO 0.00 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.44