#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 0.00 -4.09 1.61 7.64 -1.26 -5.19 113.62 112.33 1wvo n SER 2 Ca 0.00 -0.84 -0.08 0.00 1.01 0.00 0.00 58.87 58.96 1wvo n SER 2 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 1wvo n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wvo s SER 3 N -0.66 0.60 -0.57 6.43 0.15 -1.26 -4.91 113.70 113.48 1wvo s SER 3 Ca 0.00 -0.89 -0.01 0.00 0.70 0.00 0.00 55.95 55.75 1wvo s SER 3 Cb 0.00 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1wvo s SER 3 CO 0.00 -0.50 0.48 0.61 1.20 0.00 0.00 173.24 175.03 1wvo n GLY 4 N 0.40 0.11 3.69 9.45 0.00 -1.26 -5.01 105.19 112.57 1wvo n GLY 4 Ca -0.16 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.54 3.32 0.00 1.61 1.04 -1.26 -5.06 113.70 109.81 1wvo s SER 5 Ca 0.05 2.28 0.00 0.00 0.48 0.00 0.00 55.95 58.77 1wvo s SER 5 Cb -0.02 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.52 1wvo s SER 5 CO 0.34 -2.84 0.00 -0.24 0.98 0.00 0.00 173.24 171.48 1wvo n SER 6 N -3.69 0.00 -0.51 7.02 2.88 -1.26 -5.02 113.62 113.03 1wvo n SER 6 Ca 0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 1wvo n SER 6 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1wvo n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wvo n GLY 7 N 4.61 0.94 3.29 0.46 0.00 -1.26 -3.62 105.19 109.62 1wvo n GLY 7 Ca 0.00 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 1wvo n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wvo s SER 8 N 0.48 0.72 -0.21 1.61 0.15 -1.15 -3.94 113.70 111.36 1wvo s SER 8 Ca 0.00 -1.48 -0.29 0.00 0.70 0.00 0.00 55.95 54.88 1wvo s SER 8 Cb 0.00 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1wvo s SER 8 CO 0.00 -0.99 1.12 -0.69 1.20 0.00 0.00 173.24 173.88 1wvo s VAL 9 N -3.79 4.53 0.06 4.45 1.01 -1.14 -0.91 120.40 124.62 1wvo s VAL 9 Ca 0.37 1.84 0.06 0.00 0.00 0.00 0.00 61.98 64.25 1wvo s VAL 9 Cb 0.04 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1wvo s VAL 9 CO 0.18 -0.18 -0.16 0.68 0.00 0.00 0.00 175.10 175.62 1wvo s VAL 10 N 3.34 1.26 -0.12 2.92 -7.23 -0.80 -1.98 120.40 117.78 1wvo s VAL 10 Ca 0.48 -1.19 -0.31 0.00 -1.81 0.00 0.00 61.98 59.16 1wvo s VAL 10 Cb -0.17 -1.15 -0.08 0.00 0.56 0.00 0.00 36.38 35.53 1wvo s VAL 10 CO 0.10 -0.05 2.07 0.00 -0.31 0.00 0.00 175.10 176.91 1wvo n ALA 11 N 1.60 1.48 0.19 1.32 0.00 0.08 -2.73 120.51 122.44 1wvo n ALA 11 Ca -0.19 0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.32 1wvo n ALA 11 Cb 0.54 -2.73 0.44 0.00 0.00 0.00 0.00 19.45 17.71 1wvo n ALA 11 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1wvo h LYS 12 N 12.17 0.06 -3.95 0.00 3.64 -1.48 0.22 116.57 127.23 1wvo h LYS 12 Ca -0.44 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 58.81 1wvo h LYS 12 Cb 1.25 -0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.95 1wvo h LYS 12 CO 0.96 0.28 -0.30 0.14 -2.27 0.00 0.00 179.45 178.26 1wvo s VAL 13 N -4.56 0.02 0.18 2.00 -7.23 -1.26 -4.75 120.40 104.80 1wvo s VAL 13 Ca -0.04 -1.55 -0.31 0.00 -1.81 0.00 0.00 61.98 58.27 1wvo s VAL 13 Cb 0.15 -2.18 -0.10 0.00 0.56 0.00 0.00 36.38 34.81 1wvo s VAL 13 CO 0.71 -0.08 1.58 -0.75 -0.31 0.00 0.00 175.10 176.26 1wvo s LYS 14 N -4.04 4.20 -0.38 4.82 2.20 -1.26 -4.29 119.74 120.99 1wvo s LYS 14 Ca 0.25 2.40 -0.01 0.00 -0.36 0.00 0.00 55.97 58.25 1wvo s LYS 14 Cb 0.02 -3.14 0.10 0.00 -1.51 0.00 0.00 37.83 33.31 1wvo s LYS 14 CO 0.07 -0.62 0.15 0.42 -0.36 0.00 0.00 175.35 175.02 1wvo s ILE 15 N 1.04 3.06 0.50 5.43 1.01 0.40 -4.91 121.20 127.72 1wvo s ILE 15 Ca 0.70 -2.04 -0.21 0.00 0.00 0.00 0.00 60.65 59.10 1wvo s ILE 15 Cb -0.45 -3.09 -0.07 0.00 0.01 0.00 0.00 42.46 38.87 1wvo s ILE 15 CO 0.33 -0.61 1.13 -2.16 0.00 0.00 0.00 174.94 173.63 1wvo s PRO 16 N 1.11 3.61 0.48 2.79 0.04 -1.26 -0.97 135.00 140.80 1wvo s PRO 16 Ca 0.07 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 62.54 1wvo s PRO 16 Cb -0.22 -2.21 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 1wvo s PRO 16 CO -0.05 -0.65 0.87 -1.91 0.04 0.00 0.00 177.00 175.30 1wvo n GLU 17 N -0.87 1.02 -0.71 4.56 2.13 -1.25 -2.71 120.64 122.82 1wvo n GLU 17 Ca 0.09 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.29 1wvo n GLU 17 Cb 0.50 -1.95 0.00 0.00 0.27 0.00 0.00 31.44 30.26 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 1.37 1.55 3.84 8.31 0.00 -0.57 -4.94 105.19 114.76 1wvo n GLY 18 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.68 4.54 -0.13 2.61 2.01 -1.10 -4.73 115.64 115.16 1wvo s THR 19 Ca 0.00 1.18 -0.19 0.00 0.31 0.00 0.00 61.69 62.99 1wvo s THR 19 Cb 0.00 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1wvo s THR 19 CO 0.00 -0.40 0.51 -0.63 -0.69 0.00 0.00 174.62 173.41 1wvo s ILE 20 N -2.26 5.15 0.49 1.82 -1.09 -1.26 -1.63 121.20 122.42 1wvo s ILE 20 Ca 0.58 1.00 -0.22 0.00 -2.23 0.00 0.00 60.65 59.78 1wvo s ILE 20 Cb -0.10 -3.84 -0.06 0.00 -1.58 0.00 0.00 42.46 36.87 1wvo s ILE 20 CO 0.21 0.28 1.21 -0.76 -1.23 0.00 0.00 174.94 174.64 1wvo s LEU 21 N 0.90 3.94 0.06 2.97 1.43 0.57 -4.91 118.68 123.65 1wvo s LEU 21 Ca 0.27 2.40 -0.02 0.00 -1.03 0.00 0.00 54.13 55.74 1wvo s LEU 21 Cb -0.15 -4.30 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 1wvo s LEU 21 CO 0.11 -1.12 0.01 0.42 0.23 0.00 0.00 176.35 176.00 1wvo s THR 22 N -1.52 0.20 0.43 5.49 -4.23 -1.26 -0.67 115.64 114.09 1wvo s THR 22 Ca 0.67 -1.70 0.22 0.00 -1.18 0.00 0.00 61.69 59.70 1wvo s THR 22 Cb -0.31 -1.52 0.25 0.00 1.34 0.00 0.00 72.50 72.27 1wvo s THR 22 CO 0.37 -0.91 2.04 0.24 -0.54 0.00 0.00 174.62 175.82 1wvo h MET 23 N 3.06 0.00 0.00 3.99 2.86 -1.97 -1.59 114.93 121.28 1wvo h MET 23 Ca -0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 1wvo h MET 23 Cb 1.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1wvo h MET 23 CO 0.64 0.15 0.00 0.22 1.06 0.00 0.00 176.91 178.97 1wvo h ASP 24 N 0.00 0.00 0.00 1.22 3.58 -2.01 -2.54 116.42 116.67 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 0.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1wvo h ASP 24 CO 0.02 0.00 0.00 0.23 -2.88 0.00 0.00 179.24 176.61 1wvo n MET 25 N -2.45 0.99 -4.00 0.28 2.81 -0.63 -4.88 117.12 109.24 1wvo n MET 25 Ca -0.01 -1.00 -0.30 0.00 -1.81 0.00 0.00 57.70 54.59 1wvo n MET 25 Cb 0.12 -1.00 -0.16 0.00 -0.71 0.00 0.00 33.22 31.47 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 -0.50 1.76 0.39 4.03 1.43 -0.96 -1.19 118.68 123.65 1wvo s LEU 26 Ca 0.00 -0.56 0.05 0.00 -1.03 0.00 0.00 54.13 52.59 1wvo s LEU 26 Cb 0.00 -1.16 -0.06 0.00 0.03 0.00 0.00 46.19 45.00 1wvo s LEU 26 CO 0.00 -0.08 0.04 0.28 0.23 0.00 0.00 176.35 176.82 1wvo s THR 27 N 1.49 1.47 0.15 5.49 -1.32 -1.11 -4.82 115.64 117.00 1wvo s THR 27 Ca 0.04 -2.00 0.11 0.00 -1.21 0.00 0.00 61.69 58.63 1wvo s THR 27 Cb -0.13 -2.76 -0.04 0.00 -1.51 0.00 0.00 72.50 68.05 1wvo s THR 27 CO -0.10 0.00 -0.26 -0.69 -2.21 0.00 0.00 174.62 171.36 1wvo s VAL 28 N -2.99 2.32 0.13 5.08 1.01 -1.26 -1.91 120.40 122.78 1wvo s VAL 28 Ca 0.31 -1.84 0.01 0.00 0.00 0.00 0.00 61.98 60.46 1wvo s VAL 28 Cb 0.08 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.41 1wvo s VAL 28 CO 0.15 0.02 0.09 0.29 0.00 0.00 0.00 175.10 175.65 1wvo n LYS 29 N 0.69 1.31 -0.22 2.72 4.76 -0.09 -4.93 118.16 122.40 1wvo n LYS 29 Ca -0.16 -0.79 0.03 0.00 -2.87 0.00 0.00 58.31 54.52 1wvo n LYS 29 Cb 0.54 0.08 0.04 0.00 -1.84 0.00 0.00 35.03 33.85 1wvo n LYS 29 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1wvo n VAL 30 N -0.80 0.68 0.00 -0.18 0.24 -1.26 -4.00 118.33 113.00 1wvo n VAL 30 Ca -0.00 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.51 1wvo n VAL 30 Cb 0.14 0.38 0.00 0.00 -1.47 0.00 0.00 33.84 32.90 1wvo n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wvo n GLY 31 N -0.48 1.60 3.19 7.63 0.00 -1.24 -4.64 105.19 111.25 1wvo n GLY 31 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 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 0.88 0.00 1.61 -1.05 -1.26 -4.61 118.70 114.28 1wvo s GLU 32 Ca 0.00 -1.27 0.20 0.00 -0.15 0.00 0.00 54.97 53.76 1wvo s GLU 32 Cb 0.00 -0.46 1.16 0.00 -0.44 0.00 0.00 34.13 34.39 1wvo s GLU 32 CO 0.00 0.05 1.62 -0.35 0.95 0.00 0.00 175.26 177.54 1wvo n PRO 33 N 0.24 0.52 -1.65 -4.83 -0.04 -1.25 -2.91 135.00 125.07 1wvo n PRO 33 Ca -0.14 0.03 -0.49 0.00 -0.04 0.00 0.00 63.50 62.87 1wvo n PRO 33 Cb 0.59 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 1wvo n PRO 33 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1wvo n LYS 34 N -1.10 1.76 0.00 0.54 4.81 -1.26 -4.65 118.16 118.26 1wvo n LYS 34 Ca 0.13 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.21 1wvo n LYS 34 Cb 0.10 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 32.78 1wvo n LYS 34 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wvo n GLY 35 N 3.34 -0.38 3.71 3.14 0.00 -1.26 -4.67 105.19 109.06 1wvo n GLY 35 Ca 0.19 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.55 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 -0.07 2.87 0.25 1.61 6.14 -0.27 -4.91 117.35 122.97 1wvo s TYR 36 Ca 0.00 0.54 -0.30 0.00 0.64 0.00 0.00 57.07 57.95 1wvo s TYR 36 Cb 0.00 -3.93 -0.10 0.00 0.42 0.00 0.00 41.96 38.35 1wvo s TYR 36 CO 0.00 -3.53 1.48 -1.25 0.64 0.00 0.00 175.55 172.89 1wvo s PRO 37 N 1.61 4.23 0.44 4.97 0.04 -1.26 -2.88 135.00 142.15 1wvo s PRO 37 Ca 0.71 2.36 0.30 0.00 0.04 0.00 0.00 61.00 64.41 1wvo s PRO 37 Cb -0.42 -3.09 1.31 0.00 0.04 0.00 0.00 34.50 32.33 1wvo s PRO 37 CO 0.31 -0.47 1.90 -1.00 0.04 0.00 0.00 177.00 177.78 1wvo h PRO 38 N 5.06 0.00 0.00 0.56 0.13 -1.92 -2.74 132.00 133.10 1wvo h PRO 38 Ca -0.46 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.64 1wvo h PRO 38 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1wvo h PRO 38 CO 0.79 0.00 -0.12 1.49 -0.23 0.00 0.00 178.00 179.92 1wvo h GLU 39 N 0.00 0.00 -0.39 0.86 4.57 -1.97 -2.46 114.58 115.19 1wvo h GLU 39 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1wvo h GLU 39 Cb 0.38 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 1wvo h GLU 39 CO 0.00 0.12 0.00 -0.25 -1.18 0.00 0.00 179.01 177.70 1wvo n ASP 40 N -3.76 3.38 -0.32 1.04 8.00 -1.03 -4.67 116.55 119.19 1wvo n ASP 40 Ca -0.02 -2.25 0.25 0.00 0.71 0.00 0.00 54.79 53.48 1wvo n ASP 40 Cb 0.23 -0.35 0.55 0.00 -0.02 0.00 0.00 41.12 41.53 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 2.35 0.49 -0.82 0.53 2.10 -1.47 -0.59 117.51 120.10 1wvo h ILE 41 Ca 0.00 -0.11 0.24 0.00 1.08 0.00 0.00 64.86 66.07 1wvo h ILE 41 Cb 0.97 0.14 -0.03 0.00 -1.09 0.00 0.00 36.82 36.80 1wvo h ILE 41 CO 0.07 0.06 0.59 -0.26 -1.08 0.00 0.00 178.15 177.53 1wvo h PHE 42 N 0.32 0.02 0.00 2.19 0.04 -1.83 0.13 116.94 117.81 1wvo h PHE 42 Ca 0.60 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.34 1wvo h PHE 42 Cb 1.65 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.79 1wvo h PHE 42 CO -0.00 0.00 -0.33 -0.91 -0.60 0.00 0.00 178.31 176.48 1wvo h ASN 43 N 0.01 0.00 0.48 2.17 2.35 -1.48 -3.29 115.58 115.82 1wvo h ASN 43 Ca 0.39 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.89 1wvo h ASN 43 Cb 1.55 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.93 1wvo h ASN 43 CO -0.01 0.14 -1.11 -0.07 -1.65 0.00 0.00 177.43 174.73 1wvo h LEU 44 N 0.00 0.49 -9.51 1.61 3.38 -1.09 -3.42 115.31 106.76 1wvo h LEU 44 Ca -0.01 -0.46 -0.53 0.00 0.09 0.00 0.00 57.88 56.97 1wvo h LEU 44 Cb 1.11 -0.16 0.04 0.00 0.09 0.00 0.00 40.66 41.75 1wvo h LEU 44 CO 0.02 1.31 1.10 -0.69 0.09 0.00 0.00 178.44 180.26 1wvo s VAL 45 N -2.94 2.55 0.00 1.22 1.01 -1.13 -1.64 120.40 119.47 1wvo s VAL 45 Ca -0.05 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.02 1wvo s VAL 45 Cb 0.08 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1wvo s VAL 45 CO 0.88 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.59 1wvo n GLY 46 N 4.20 1.09 3.90 4.51 0.00 0.15 -4.97 105.19 114.07 1wvo n GLY 46 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.77 2.95 -0.01 1.61 1.02 -0.65 -4.69 119.74 119.21 1wvo s LYS 47 Ca 0.00 0.23 -0.02 0.00 0.02 0.00 0.00 55.97 56.21 1wvo s LYS 47 Cb 0.00 -2.16 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 1wvo s LYS 47 CO 0.00 -0.81 0.12 0.21 -0.92 0.00 0.00 175.35 173.95 1wvo s LYS 48 N -5.14 3.22 0.15 1.68 2.20 -1.25 -0.31 119.74 120.28 1wvo s LYS 48 Ca 0.55 -0.41 -0.24 0.00 -0.36 0.00 0.00 55.97 55.52 1wvo s LYS 48 Cb -0.11 -2.96 -0.08 0.00 -1.51 0.00 0.00 37.83 33.17 1wvo s LYS 48 CO 0.48 0.66 0.73 0.14 -0.36 0.00 0.00 175.35 177.00 1wvo s VAL 49 N -1.24 4.46 -0.43 4.02 -7.23 -0.65 -1.26 120.40 118.07 1wvo s VAL 49 Ca 0.24 1.57 0.23 0.00 -1.81 0.00 0.00 61.98 62.22 1wvo s VAL 49 Cb -0.12 -4.07 0.10 0.00 0.56 0.00 0.00 36.38 32.85 1wvo s VAL 49 CO 0.15 0.52 1.29 -0.07 -0.31 0.00 0.00 175.10 176.68 1wvo h LEU 50 N 4.32 0.00 -7.98 1.32 3.38 -1.39 -1.50 115.31 113.46 1wvo h LEU 50 Ca -0.48 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.35 1wvo h LEU 50 Cb 1.21 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.84 1wvo h LEU 50 CO 0.65 0.03 -0.21 0.68 0.09 0.00 0.00 178.44 179.68 1wvo s VAL 51 N -3.26 0.05 0.34 1.22 -7.23 -1.26 -4.81 120.40 105.46 1wvo s VAL 51 Ca 0.04 -1.22 -0.27 0.00 -1.81 0.00 0.00 61.98 58.72 1wvo s VAL 51 Cb 0.10 -1.79 -0.09 0.00 0.56 0.00 0.00 36.38 35.16 1wvo s VAL 51 CO 0.73 -0.23 1.07 -0.89 -0.31 0.00 0.00 175.10 175.47 1wvo s THR 52 N -3.94 3.60 -0.10 5.32 2.01 -1.26 -3.82 115.64 117.44 1wvo s THR 52 Ca 0.15 1.40 0.00 0.00 0.31 0.00 0.00 61.69 63.56 1wvo s THR 52 Cb 0.02 -3.81 0.02 0.00 0.01 0.00 0.00 72.50 68.74 1wvo s THR 52 CO -0.00 0.18 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.32 1wvo s VAL 53 N -1.42 1.08 0.75 3.82 1.01 -0.14 -4.88 120.40 120.62 1wvo s VAL 53 Ca 0.52 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.03 1wvo s VAL 53 Cb -0.27 -1.06 0.04 0.00 0.00 0.00 0.00 36.38 35.10 1wvo s VAL 53 CO 0.34 0.37 1.08 -1.61 0.00 0.00 0.00 175.10 175.27 1wvo s GLU 54 N 1.36 2.43 0.23 2.72 0.41 -1.26 -0.45 118.70 124.14 1wvo s GLU 54 Ca -0.01 0.99 -0.30 0.00 -0.41 0.00 0.00 54.97 55.23 1wvo s GLU 54 Cb -0.14 -1.93 -0.10 0.00 -1.78 0.00 0.00 34.13 30.19 1wvo s GLU 54 CO -0.05 -1.47 1.44 -2.00 -0.49 0.00 0.00 175.26 172.69 1wvo s GLU 55 N -4.99 4.27 0.00 1.61 2.12 -1.26 -2.49 118.70 117.96 1wvo s GLU 55 Ca 0.60 2.28 0.00 0.00 0.36 0.00 0.00 54.97 58.21 1wvo s GLU 55 Cb -0.16 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 31.11 1wvo s GLU 55 CO 0.55 -0.42 0.00 -3.47 -0.54 0.00 0.00 175.26 171.38 1wvo n ASP 56 N 2.57 -0.31 -4.79 -1.70 2.03 0.07 -4.92 116.55 109.50 1wvo n ASP 56 Ca 0.08 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 55.06 1wvo n ASP 56 Cb 0.40 -0.05 0.05 0.00 -0.72 0.00 0.00 41.12 40.80 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 -2.88 5.18 -0.31 1.67 2.15 -1.04 -4.64 116.67 116.80 1wvo s ASP 57 Ca 0.00 1.85 -0.28 0.00 0.43 0.00 0.00 52.55 54.54 1wvo s ASP 57 Cb 0.00 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.10 1wvo s ASP 57 CO 0.00 -1.58 1.04 -0.89 -0.17 0.00 0.00 175.17 173.57 1wvo s THR 58 N -2.62 4.56 0.36 1.71 2.01 -1.26 -0.74 115.64 119.65 1wvo s THR 58 Ca 0.63 1.72 -0.26 0.00 0.31 0.00 0.00 61.69 64.09 1wvo s THR 58 Cb -0.17 -4.38 -0.09 0.00 0.01 0.00 0.00 72.50 67.87 1wvo s THR 58 CO 0.46 -0.42 1.09 -0.63 -0.69 0.00 0.00 174.62 174.43 1wvo s ILE 59 N 3.53 3.52 0.07 1.82 -1.09 -0.84 -4.93 121.20 123.28 1wvo s ILE 59 Ca 0.44 1.31 0.02 0.00 -2.23 0.00 0.00 60.65 60.19 1wvo s ILE 59 Cb -0.13 -3.75 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 1wvo s ILE 59 CO 0.14 0.15 -0.08 -0.04 -1.23 0.00 0.00 174.94 173.88 1wvo s MET 60 N -2.09 0.67 0.52 2.79 -1.94 -1.26 -1.11 119.30 116.87 1wvo s MET 60 Ca 0.53 -0.99 0.18 0.00 -1.71 0.00 0.00 55.69 53.70 1wvo s MET 60 Cb -0.27 -0.31 1.29 0.00 2.01 0.00 0.00 34.83 37.56 1wvo s MET 60 CO 0.34 0.04 2.13 1.05 -0.01 0.00 0.00 175.02 178.57 1wvo h GLU 61 N 3.90 0.00 0.00 2.03 -0.00 -1.96 -1.82 114.58 116.73 1wvo h GLU 61 Ca -0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 58.98 1wvo h GLU 61 Cb 1.19 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1wvo h GLU 61 CO 0.50 0.03 -0.10 1.49 -0.00 0.00 0.00 179.01 180.93 1wvo h GLU 62 N 0.00 0.00 -0.11 1.06 4.57 -2.02 -2.52 114.58 115.56 1wvo h GLU 62 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1wvo h GLU 62 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1wvo h GLU 62 CO 0.00 0.10 0.00 1.28 -1.18 0.00 0.00 179.01 179.22 1wvo n LEU 63 N -3.36 1.11 -3.85 1.64 4.77 -0.68 -4.79 117.00 111.84 1wvo n LEU 63 Ca -0.01 -0.46 -0.26 0.00 -0.03 0.00 0.00 56.01 55.25 1wvo n LEU 63 Cb 0.29 -0.07 -0.17 0.00 -2.33 0.00 0.00 43.42 41.15 1wvo n LEU 63 CO 0.29 0.23 -0.41 0.68 -1.33 0.00 0.00 177.39 176.85 1wvo s VAL 64 N -1.87 0.84 -0.17 4.08 -7.23 -0.95 -1.01 120.40 114.09 1wvo s VAL 64 Ca 0.31 -0.33 -0.29 0.00 -1.81 0.00 0.00 61.98 59.86 1wvo s VAL 64 Cb 0.16 -1.00 -0.02 0.00 0.56 0.00 0.00 36.38 36.08 1wvo s VAL 64 CO 0.25 0.20 1.40 -0.62 -0.31 0.00 0.00 175.10 176.01 1wvo s ASP 65 N 1.76 6.77 0.00 4.85 2.15 -0.39 -4.91 116.67 126.90 1wvo s ASP 65 Ca 0.03 1.72 0.00 0.00 0.43 0.00 0.00 52.55 54.73 1wvo s ASP 65 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 1wvo s ASP 65 CO -0.07 -0.91 0.00 -3.20 -0.17 0.00 0.00 175.17 170.82 1wvo n ASN 66 N 7.12 0.00 -3.36 -0.34 2.85 -1.26 -3.92 115.26 116.35 1wvo n ASN 66 Ca 0.15 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.24 1wvo n ASN 66 Cb 0.45 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.44 1wvo n ASN 66 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1wvo n HIS 67 N 0.00 2.51 -1.56 1.20 8.25 -1.26 -4.93 115.22 119.42 1wvo n HIS 67 Ca 0.00 -3.01 0.00 0.00 -0.26 0.00 0.00 57.72 54.45 1wvo n HIS 67 Cb 0.00 -2.45 0.00 0.00 1.12 0.00 0.00 29.99 28.66 1wvo n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wvo n GLY 68 N 3.67 1.84 3.84 -1.41 0.00 -1.26 -4.50 105.19 107.37 1wvo n GLY 68 Ca 0.73 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 3.30 -0.23 1.61 2.20 -1.26 -5.10 119.74 120.26 1wvo s LYS 69 Ca 0.00 -0.29 -0.10 0.00 -0.36 0.00 0.00 55.97 55.22 1wvo s LYS 69 Cb 0.00 -3.04 0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1wvo s LYS 69 CO 0.00 0.72 0.53 0.21 -0.36 0.00 0.00 175.35 176.45 1wvo s LYS 70 N -1.39 0.49 0.75 4.03 2.20 -1.26 -5.15 119.74 119.40 1wvo s LYS 70 Ca 0.20 1.12 -0.15 0.00 -0.36 0.00 0.00 55.97 56.78 1wvo s LYS 70 Cb -0.12 0.34 0.05 0.00 -1.51 0.00 0.00 37.83 36.59 1wvo s LYS 70 CO 0.10 -0.19 1.23 0.42 -0.36 0.00 0.00 175.35 176.55 1wvo s ILE 71 N 2.18 2.06 -0.11 5.43 1.01 -1.26 -4.97 121.20 125.54 1wvo s ILE 71 Ca -0.06 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.63 1wvo s ILE 71 Cb -0.10 -2.63 -0.07 0.00 0.01 0.00 0.00 42.46 39.67 1wvo s ILE 71 CO -0.16 -0.02 -0.09 0.29 0.00 0.00 0.00 174.94 174.96 1wvo n LYS 72 N -2.82 0.31 0.00 2.79 4.76 -1.26 -5.05 118.16 116.89 1wvo n LYS 72 Ca 0.14 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.64 1wvo n LYS 72 Cb 0.50 -1.21 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 1wvo n LYS 72 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1wvo n SER 73 N -2.80 -0.38 -4.10 4.39 2.88 -1.26 -5.13 113.62 107.22 1wvo n SER 73 Ca -0.19 -0.65 -0.11 0.00 -1.33 0.00 0.00 58.87 56.60 1wvo n SER 73 Cb 0.70 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 64.08 1wvo n SER 73 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wvo s SER 74 N -1.23 0.09 0.00 -3.46 0.01 -1.26 -5.04 113.70 102.81 1wvo s SER 74 Ca 0.00 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 56.03 1wvo s SER 74 Cb 0.00 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.69 1wvo s SER 74 CO 0.00 -0.96 0.00 0.61 0.41 0.00 0.00 173.24 173.30 1wvo n GLY 75 N -0.32 2.09 3.81 3.44 0.00 -1.26 -5.11 105.19 107.84 1wvo n GLY 75 Ca 0.01 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 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 0.00 3.01 0.81 1.61 0.04 -1.26 -5.04 135.00 134.18 1wvo s PRO 76 Ca 0.00 1.02 -0.12 0.00 0.04 0.00 0.00 61.00 61.94 1wvo s PRO 76 Cb 0.00 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.63 1wvo s PRO 76 CO 0.00 -1.04 1.16 -1.12 0.04 0.00 0.00 177.00 176.03 1wvo s SER 77 N -3.54 3.77 0.35 6.66 0.01 -1.26 -4.92 113.70 114.77 1wvo s SER 77 Ca 0.59 2.17 0.11 0.00 1.31 0.00 0.00 55.95 60.14 1wvo s SER 77 Cb -0.15 -2.57 0.89 0.00 0.21 0.00 0.00 66.02 64.41 1wvo s SER 77 CO 0.51 -2.54 1.81 0.28 0.41 0.00 0.00 173.24 173.70 1wvo h SER 78 N -1.09 0.63 0.00 2.44 0.02 -2.05 -3.55 113.55 109.95 1wvo h SER 78 Ca -0.45 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1wvo h SER 78 Cb 1.27 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.77 1wvo h SER 78 CO 0.47 0.23 0.00 0.61 -1.14 0.00 0.00 176.83 177.00