#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgv n SER 2 N 0.00 -2.54 -3.77 1.61 2.88 -1.26 -5.14 113.62 105.40 1wgv n SER 2 Ca 0.00 0.68 -0.13 0.00 -1.33 0.00 0.00 58.87 58.10 1wgv n SER 2 Cb 0.00 2.53 -0.11 0.00 -0.75 0.00 0.00 64.21 65.88 1wgv n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wgv s SER 3 N -2.00 -0.30 0.00 -3.46 0.15 -1.26 -4.95 113.70 101.89 1wgv s SER 3 Ca 0.00 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.23 1wgv s SER 3 Cb 0.00 0.59 -0.00 0.00 -1.71 0.00 0.00 66.02 64.90 1wgv s SER 3 CO 0.00 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1wgv n GLY 4 N 2.92 3.67 2.53 9.45 0.00 -1.26 -5.07 105.19 117.43 1wgv n GLY 4 Ca -0.13 -1.55 -0.03 0.00 0.00 0.00 0.00 46.02 44.32 1wgv n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wgv n SER 5 N -2.65 -4.23 -4.86 1.61 7.64 -1.26 -4.96 113.62 104.91 1wgv n SER 5 Ca 0.00 1.47 -0.31 0.00 1.01 0.00 0.00 58.87 61.04 1wgv n SER 5 Cb 0.00 -4.57 -0.02 0.00 -1.01 0.00 0.00 64.21 58.62 1wgv n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wgv s SER 6 N -0.52 6.44 0.00 6.43 0.15 -1.26 -4.88 113.70 120.06 1wgv s SER 6 Ca -0.14 1.39 0.00 0.00 0.70 0.00 0.00 55.95 57.90 1wgv s SER 6 Cb 0.01 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 1wgv s SER 6 CO 0.38 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.78 1wgv n GLY 7 N -1.99 -1.90 3.64 9.45 0.00 -1.26 -4.99 105.19 108.15 1wgv n GLY 7 Ca 0.05 -0.93 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 1wgv n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wgv s GLN 8 N -3.02 0.65 0.02 1.61 -2.07 -1.26 -4.63 119.66 110.96 1wgv s GLN 8 Ca 0.00 1.01 -0.28 0.00 -1.82 0.00 0.00 55.36 54.27 1wgv s GLN 8 Cb 0.00 0.19 0.10 0.00 -1.09 0.00 0.00 33.01 32.21 1wgv s GLN 8 CO 0.00 -0.12 0.92 -1.59 -1.32 0.00 0.00 175.29 173.18 1wgv s LYS 9 N 1.19 0.88 -0.28 9.60 0.00 -1.26 -5.15 119.74 124.72 1wgv s LYS 9 Ca -0.06 -0.37 -0.29 0.00 0.00 0.00 0.00 55.97 55.25 1wgv s LYS 9 Cb -0.05 0.37 0.19 0.00 0.00 0.00 0.00 37.83 38.34 1wgv s LYS 9 CO -0.13 -0.39 1.34 0.54 0.00 0.00 0.00 175.35 176.70 1wgv s ASN 10 N -2.58 -0.07 0.03 0.03 2.20 -1.26 -4.97 114.94 108.33 1wgv s ASN 10 Ca 0.07 0.08 -0.18 0.00 -0.94 0.00 0.00 52.86 51.88 1wgv s ASN 10 Cb -0.01 0.06 -0.22 0.00 -2.00 0.00 0.00 41.25 39.09 1wgv s ASN 10 CO -0.07 -0.06 1.16 1.55 -2.94 0.00 0.00 177.10 176.74 1wgv h PRO 11 N 2.22 0.49 0.00 3.55 0.13 -2.03 -3.47 132.00 132.89 1wgv h PRO 11 Ca -0.11 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1wgv h PRO 11 Cb 1.19 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1wgv h PRO 11 CO 0.22 1.12 0.00 -0.25 -0.23 0.00 0.00 178.00 178.86 1wgv n ASP 12 N -4.17 -1.03 -3.37 1.44 8.00 -1.26 -5.09 116.55 111.07 1wgv n ASP 12 Ca -0.10 0.22 -0.11 0.00 0.71 0.00 0.00 54.79 55.51 1wgv n ASP 12 Cb 0.68 1.32 -0.08 0.00 -0.02 0.00 0.00 41.12 43.02 1wgv n ASP 12 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1wgv s SER 13 N -2.10 0.63 -0.29 -2.24 1.04 -1.26 -5.06 113.70 104.41 1wgv s SER 13 Ca 0.00 -0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.36 1wgv s SER 13 Cb 0.00 0.93 0.18 0.00 0.10 0.00 0.00 66.02 67.23 1wgv s SER 13 CO 0.00 -0.33 0.48 -0.47 0.98 0.00 0.00 173.24 173.90 1wgv s TYR 14 N 2.49 -1.34 0.13 5.02 5.04 -1.26 -4.97 117.35 122.45 1wgv s TYR 14 Ca 0.11 0.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.36 1wgv s TYR 14 Cb -0.15 0.03 0.00 0.00 0.35 0.00 0.00 41.96 42.19 1wgv s TYR 14 CO -0.21 -1.03 0.00 -1.71 -1.34 0.00 0.00 175.55 171.27 1wgv n ASN 15 N 5.38 -1.13 0.00 4.32 5.15 -1.26 -4.86 115.26 122.86 1wgv n ASN 15 Ca 0.02 0.51 0.00 0.00 -0.60 0.00 0.00 54.58 54.51 1wgv n ASN 15 Cb 0.51 1.34 0.00 0.00 -0.53 0.00 0.00 39.78 41.10 1wgv n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wgv n GLY 16 N -1.16 5.39 3.64 8.20 0.00 -1.26 -2.82 105.19 117.19 1wgv n GLY 16 Ca 0.00 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.29 1wgv n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgv s ALA 17 N -2.00 3.45 0.40 4.61 0.00 -1.26 -5.00 121.76 121.95 1wgv s ALA 17 Ca 0.00 0.32 0.02 0.00 0.00 0.00 0.00 51.96 52.29 1wgv s ALA 17 Cb 0.00 -3.74 0.05 0.00 0.00 0.00 0.00 23.12 19.43 1wgv s ALA 17 CO 0.00 -1.62 0.37 1.33 0.00 0.00 0.00 175.76 175.84 1wgv n VAL 18 N 5.97 0.00 0.00 0.00 0.24 -1.26 -4.27 118.33 119.01 1wgv n VAL 18 Ca 0.15 -0.70 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 1wgv n VAL 18 Cb 0.46 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.81 1wgv n VAL 18 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1wgv n ARG 19 N -1.64 0.00 -0.06 7.34 5.12 -1.26 -4.97 116.66 121.19 1wgv n ARG 19 Ca 0.07 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.91 1wgv n ARG 19 Cb 0.24 0.00 0.09 0.00 -1.16 0.00 0.00 32.46 31.63 1wgv n ARG 19 CO 0.00 0.00 0.00 1.05 -1.93 0.00 0.00 177.63 176.75 1wgv h GLU 20 N 0.00 0.71 0.40 5.56 4.11 -2.01 -3.23 114.58 120.12 1wgv h GLU 20 Ca 0.00 -0.31 -0.01 0.00 0.07 0.00 0.00 59.36 59.11 1wgv h GLU 20 Cb 0.00 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1wgv h GLU 20 CO 0.00 0.91 -0.39 -0.97 0.07 0.00 0.00 179.01 178.64 1wgv h ASN 21 N 0.61 -1.06 -2.63 3.06 -1.24 -1.95 -3.45 115.58 108.92 1wgv h ASN 21 Ca 0.07 0.08 0.05 0.00 0.71 0.00 0.00 56.30 57.22 1wgv h ASN 21 Cb 0.79 0.35 -0.22 0.00 0.73 0.00 0.00 38.32 39.97 1wgv h ASN 21 CO 0.07 -0.51 0.05 -0.72 -1.29 0.00 0.00 177.43 175.02 1wgv s TYR 22 N -5.15 -1.03 0.34 0.67 -0.85 -1.22 -4.65 117.35 105.46 1wgv s TYR 22 Ca -0.14 1.99 -0.13 0.00 -0.52 0.00 0.00 57.07 58.27 1wgv s TYR 22 Cb 0.03 0.62 -0.08 0.00 0.38 0.00 0.00 41.96 42.91 1wgv s TYR 22 CO 0.45 -0.51 0.73 0.95 -1.52 0.00 0.00 175.55 175.65 1wgv s THR 23 N 1.89 4.75 0.26 -3.49 -4.23 -0.95 -4.34 115.64 109.53 1wgv s THR 23 Ca -0.09 0.77 -0.20 0.00 -1.18 0.00 0.00 61.69 61.00 1wgv s THR 23 Cb -0.06 -3.66 0.02 0.00 1.34 0.00 0.00 72.50 70.14 1wgv s THR 23 CO -0.19 -0.30 0.66 -1.66 -0.54 0.00 0.00 174.62 172.59 1wgv s TRP 24 N -2.11 -0.12 0.02 3.99 1.48 -1.26 -0.93 118.94 120.01 1wgv s TRP 24 Ca 0.52 -0.30 -0.20 0.00 -1.06 0.00 0.00 56.10 55.07 1wgv s TRP 24 Cb -0.10 0.59 0.04 0.00 -1.16 0.00 0.00 33.47 32.84 1wgv s TRP 24 CO 0.23 -1.15 0.44 -1.12 -4.06 0.00 0.00 176.95 171.29 1wgv s SER 25 N -2.92 -0.34 -0.16 -2.66 0.01 -0.48 -4.37 113.70 102.77 1wgv s SER 25 Ca 0.12 0.14 -0.04 0.00 1.31 0.00 0.00 55.95 57.47 1wgv s SER 25 Cb -0.04 0.43 -0.03 0.00 0.21 0.00 0.00 66.02 66.58 1wgv s SER 25 CO 0.05 -0.62 -0.02 -1.58 0.41 0.00 0.00 173.24 171.48 1wgv s GLN 26 N -2.07 3.71 0.39 12.44 0.74 -1.26 -2.96 119.66 130.65 1wgv s GLN 26 Ca -0.08 -0.50 0.05 0.00 0.05 0.00 0.00 55.36 54.88 1wgv s GLN 26 Cb -0.02 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.10 1wgv s GLN 26 CO 0.01 0.22 0.17 -0.51 -0.55 0.00 0.00 175.29 174.63 1wgv s ASP 27 N 0.43 2.51 -0.57 6.67 1.01 -1.24 -4.80 116.67 120.68 1wgv s ASP 27 Ca -0.03 -1.71 -0.02 0.00 0.71 0.00 0.00 52.55 51.50 1wgv s ASP 27 Cb -0.14 0.55 0.27 0.00 1.01 0.00 0.00 42.92 44.61 1wgv s ASP 27 CO 0.02 -0.98 2.22 0.00 0.21 0.00 0.00 175.17 176.64 1wgv n TYR 28 N -0.84 2.36 0.13 4.23 9.36 -1.26 -4.26 117.16 126.88 1wgv n TYR 28 Ca -0.03 -2.34 0.00 0.00 3.32 0.00 0.00 57.90 58.86 1wgv n TYR 28 Cb 0.64 -1.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.09 1wgv n TYR 28 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1wgv n THR 29 N -0.07 0.00 -3.80 2.97 -2.24 -1.26 -4.99 114.28 104.89 1wgv n THR 29 Ca 0.49 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 62.23 1wgv n THR 29 Cb 0.51 -0.15 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 1wgv n THR 29 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1wgv s ASP 30 N -2.87 -0.18 -0.15 3.42 1.01 -1.26 -4.46 116.67 112.17 1wgv s ASP 30 Ca 0.00 -0.53 -0.14 0.00 0.71 0.00 0.00 52.55 52.59 1wgv s ASP 30 Cb 0.00 0.59 -0.05 0.00 1.01 0.00 0.00 42.92 44.47 1wgv s ASP 30 CO 0.00 -1.10 0.29 -0.76 0.21 0.00 0.00 175.17 173.82 1wgv s LEU 31 N -2.97 4.26 -0.22 1.23 1.02 -0.51 -3.71 118.68 117.77 1wgv s LEU 31 Ca 0.13 0.53 -0.02 0.00 0.02 0.00 0.00 54.13 54.79 1wgv s LEU 31 Cb -0.03 -2.37 0.02 0.00 0.02 0.00 0.00 46.19 43.82 1wgv s LEU 31 CO 0.05 0.12 -0.09 -1.61 0.02 0.00 0.00 176.35 174.84 1wgv s GLU 32 N 0.34 3.02 -0.05 1.70 2.02 -1.15 -1.72 118.70 122.85 1wgv s GLU 32 Ca 0.17 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.34 1wgv s GLU 32 Cb -0.13 -2.89 0.01 0.00 0.10 0.00 0.00 34.13 31.22 1wgv s GLU 32 CO 0.04 -0.30 -0.14 0.54 0.02 0.00 0.00 175.26 175.43 1wgv s VAL 33 N 1.36 1.21 -0.05 2.63 0.11 -1.10 -1.39 120.40 123.18 1wgv s VAL 33 Ca 0.03 -0.56 0.04 0.00 -2.93 0.00 0.00 61.98 58.55 1wgv s VAL 33 Cb -0.15 -1.08 -0.00 0.00 -1.53 0.00 0.00 36.38 33.62 1wgv s VAL 33 CO -0.06 0.36 -0.17 -0.13 -3.33 0.00 0.00 175.10 171.77 1wgv s ARG 34 N 0.35 1.87 -0.10 1.54 0.52 -0.11 -2.01 118.95 121.01 1wgv s ARG 34 Ca -0.09 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.53 1wgv s ARG 34 Cb -0.13 -1.59 -0.02 0.00 0.52 0.00 0.00 34.95 33.73 1wgv s ARG 34 CO 0.03 0.20 -0.10 0.08 0.02 0.00 0.00 175.30 175.54 1wgv s VAL 35 N 0.16 3.42 0.28 3.52 1.01 -0.43 -2.24 120.40 126.13 1wgv s VAL 35 Ca -0.07 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 1wgv s VAL 35 Cb -0.13 -2.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 1wgv s VAL 35 CO 0.03 0.56 1.08 -2.16 0.00 0.00 0.00 175.10 174.60 1wgv s PRO 36 N -0.27 4.63 0.19 2.72 0.04 -1.26 0.19 135.00 141.24 1wgv s PRO 36 Ca 0.03 1.75 0.07 0.00 0.04 0.00 0.00 61.00 62.89 1wgv s PRO 36 Cb -0.13 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 1wgv s PRO 36 CO 0.03 0.22 -0.15 0.14 0.04 0.00 0.00 177.00 177.28 1wgv s VAL 37 N -1.20 1.67 1.07 -0.36 -7.23 -1.08 -4.84 120.40 108.43 1wgv s VAL 37 Ca 0.45 -2.10 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 1wgv s VAL 37 Cb -0.31 -1.95 0.23 0.00 0.56 0.00 0.00 36.38 34.92 1wgv s VAL 37 CO 0.39 -0.54 1.21 -2.16 -0.31 0.00 0.00 175.10 173.69 1wgv s PRO 38 N -3.41 -0.17 -0.02 4.82 0.04 -1.26 -4.42 135.00 130.57 1wgv s PRO 38 Ca 0.20 -0.20 0.06 0.00 0.04 0.00 0.00 61.00 61.10 1wgv s PRO 38 Cb -0.02 -1.73 0.22 0.00 0.04 0.00 0.00 34.50 33.01 1wgv s PRO 38 CO 0.06 -2.99 1.09 1.63 0.04 0.00 0.00 177.00 176.83 1wgv n LYS 39 N -4.22 1.75 0.00 4.56 4.76 -1.26 -2.93 118.16 120.81 1wgv n LYS 39 Ca 0.14 -0.89 0.03 0.00 -2.87 0.00 0.00 58.31 54.72 1wgv n LYS 39 Cb 0.59 -1.35 0.01 0.00 -1.84 0.00 0.00 35.03 32.44 1wgv n LYS 39 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 1wgv n HIS 40 N 0.19 0.00 -3.59 2.13 1.44 -1.26 -4.82 115.22 109.31 1wgv n HIS 40 Ca 0.08 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.39 1wgv n HIS 40 Cb 0.30 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.30 1wgv n HIS 40 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1wgv s VAL 41 N -0.86 4.76 0.00 0.61 1.01 -1.15 -4.82 120.40 119.95 1wgv s VAL 41 Ca 0.06 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1wgv s VAL 41 Cb 0.05 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.87 1wgv s VAL 41 CO 0.13 -0.13 0.00 1.33 0.00 0.00 0.00 175.10 176.43 1wgv n VAL 42 N 5.03 0.00 -2.27 2.92 0.24 -1.26 -1.79 118.33 121.20 1wgv n VAL 42 Ca -0.12 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.85 1wgv n VAL 42 Cb 0.47 -0.33 -0.02 0.00 -1.47 0.00 0.00 33.84 32.50 1wgv n VAL 42 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1wgv s LYS 43 N -1.52 3.68 0.30 7.34 -0.14 -1.26 -4.32 119.74 123.81 1wgv s LYS 43 Ca 0.00 1.10 0.25 0.00 -1.36 0.00 0.00 55.97 55.96 1wgv s LYS 43 Cb 0.00 -2.09 0.64 0.00 -1.68 0.00 0.00 37.83 34.70 1wgv s LYS 43 CO 0.00 -0.51 1.72 0.78 -0.76 0.00 0.00 175.35 176.58 1wgv h GLY 44 N 0.79 0.00 2.00 -3.33 0.00 -1.94 -2.97 103.07 97.61 1wgv h GLY 44 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1wgv h GLY 44 CO 0.60 0.00 0.00 0.07 0.00 0.00 0.00 176.54 177.21 1wgv h LYS 45 N 0.00 0.00 0.00 4.80 5.09 -2.01 -2.75 116.57 121.70 1wgv h LYS 45 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1wgv h LYS 45 Cb 0.83 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.16 1wgv h LYS 45 CO 0.00 0.00 0.00 1.04 -2.09 0.00 0.00 179.45 178.40 1wgv n GLN 46 N -2.36 0.65 -4.02 0.07 6.02 -1.12 -4.76 117.38 111.86 1wgv n GLN 46 Ca 0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.92 1wgv n GLN 46 Cb 0.39 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.04 1wgv n GLN 46 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1wgv s VAL 47 N -2.33 0.31 -0.05 5.09 -7.23 -1.04 0.19 120.40 115.34 1wgv s VAL 47 Ca 0.36 -0.82 0.02 0.00 -1.81 0.00 0.00 61.98 59.72 1wgv s VAL 47 Cb 0.20 -0.39 -0.03 0.00 0.56 0.00 0.00 36.38 36.72 1wgv s VAL 47 CO 0.41 -0.34 -0.09 -0.44 -0.31 0.00 0.00 175.10 174.33 1wgv s SER 48 N -1.23 4.48 -0.04 4.85 0.01 0.37 -4.92 113.70 117.22 1wgv s SER 48 Ca -0.10 -0.09 -0.00 0.00 1.31 0.00 0.00 55.95 57.07 1wgv s SER 48 Cb -0.08 -1.06 0.03 0.00 0.21 0.00 0.00 66.02 65.11 1wgv s SER 48 CO -0.00 0.34 0.01 -0.69 0.41 0.00 0.00 173.24 173.31 1wgv s VAL 49 N -0.83 0.17 -0.08 3.43 1.01 -1.25 -2.57 120.40 120.28 1wgv s VAL 49 Ca 0.13 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1wgv s VAL 49 Cb -0.11 -0.29 0.02 0.00 0.00 0.00 0.00 36.38 36.00 1wgv s VAL 49 CO 0.02 0.16 -0.05 0.00 0.00 0.00 0.00 175.10 175.23 1wgv s ALA 50 N 1.26 0.99 -0.05 5.51 0.00 -0.88 -4.95 121.76 123.64 1wgv s ALA 50 Ca -0.06 -0.30 0.05 0.00 0.00 0.00 0.00 51.96 51.65 1wgv s ALA 50 Cb -0.13 -0.70 -0.01 0.00 0.00 0.00 0.00 23.12 22.28 1wgv s ALA 50 CO -0.02 -0.26 -0.21 -0.51 0.00 0.00 0.00 175.76 174.76 1wgv s LEU 51 N 1.45 1.98 0.08 0.00 1.43 -1.26 -1.64 118.68 120.72 1wgv s LEU 51 Ca -0.02 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1wgv s LEU 51 Cb -0.13 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.92 1wgv s LEU 51 CO -0.04 0.19 0.00 -1.20 0.23 0.00 0.00 176.35 175.53 1wgv n SER 52 N 3.11 0.35 0.00 2.29 7.64 -1.25 -5.02 113.62 120.73 1wgv n SER 52 Ca -0.18 0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1wgv n SER 52 Cb 0.52 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1wgv n SER 52 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1wgv n SER 53 N -3.01 0.00 -1.20 6.43 3.41 -1.26 -4.63 113.62 113.35 1wgv n SER 53 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.54 1wgv n SER 53 Cb 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.09 1wgv n SER 53 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1wgv n SER 54 N 0.00 3.07 -3.48 4.04 2.88 -1.25 -0.71 113.62 118.16 1wgv n SER 54 Ca 0.00 -3.84 -0.06 0.00 -1.33 0.00 0.00 58.87 53.64 1wgv n SER 54 Cb 0.00 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 1wgv n SER 54 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wgv s SER 55 N -3.30 -0.11 -0.00 -3.46 0.15 -1.26 0.11 113.70 105.83 1wgv s SER 55 Ca 0.44 -0.71 -0.28 0.00 0.70 0.00 0.00 55.95 56.10 1wgv s SER 55 Cb 0.39 0.65 0.10 0.00 -1.71 0.00 0.00 66.02 65.45 1wgv s SER 55 CO -0.02 -1.25 0.82 -0.51 1.20 0.00 0.00 173.24 173.48 1wgv s ILE 56 N -2.96 0.00 -0.03 6.45 -1.16 -1.14 -3.93 121.20 118.43 1wgv s ILE 56 Ca 0.15 0.00 -0.00 0.00 -0.51 0.00 0.00 60.65 60.29 1wgv s ILE 56 Cb -0.04 -1.00 0.03 0.00 0.61 0.00 0.00 42.46 42.06 1wgv s ILE 56 CO 0.07 0.00 0.02 -0.60 -2.81 0.00 0.00 174.94 171.61 1wgv s ARG 57 N -2.69 0.19 -0.03 3.50 3.52 -0.65 -2.75 118.95 120.05 1wgv s ARG 57 Ca 0.01 0.15 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 1wgv s ARG 57 Cb -0.01 -0.47 0.01 0.00 -1.56 0.00 0.00 34.95 32.92 1wgv s ARG 57 CO -0.06 -0.19 -0.05 0.08 -0.81 0.00 0.00 175.30 174.27 1wgv s VAL 58 N 1.29 0.52 0.13 7.11 1.01 0.25 -2.07 120.40 128.63 1wgv s VAL 58 Ca -0.06 -0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.51 1wgv s VAL 58 Cb -0.13 -0.51 0.06 0.00 0.00 0.00 0.00 36.38 35.81 1wgv s VAL 58 CO -0.02 0.19 0.57 0.00 0.00 0.00 0.00 175.10 175.84 1wgv s ALA 59 N 0.49 -1.50 0.00 5.51 0.00 -1.06 -2.24 121.76 122.95 1wgv s ALA 59 Ca -0.06 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1wgv s ALA 59 Cb -0.10 0.73 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 1wgv s ALA 59 CO 0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 175.76 175.06 1wgv s MET 60 N -3.40 0.08 0.03 0.00 0.23 0.13 -0.48 119.30 115.89 1wgv s MET 60 Ca -0.00 -0.14 -0.30 0.00 -1.03 0.00 0.00 55.69 54.21 1wgv s MET 60 Cb -0.00 0.01 -0.05 0.00 -1.53 0.00 0.00 34.83 33.25 1wgv s MET 60 CO -0.10 -0.01 1.19 -0.51 -2.03 0.00 0.00 175.02 173.57 1wgv s LEU 61 N -0.32 4.35 0.00 0.18 1.43 0.51 -0.53 118.68 124.30 1wgv s LEU 61 Ca -0.03 1.95 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 1wgv s LEU 61 Cb -0.02 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.63 1wgv s LEU 61 CO -0.00 -0.50 0.00 -0.62 0.23 0.00 0.00 176.35 175.46 1wgv n GLU 62 N 4.30 0.00 0.05 1.70 -0.58 -0.47 -4.93 120.64 120.71 1wgv n GLU 62 Ca 0.09 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1wgv n GLU 62 Cb 0.46 -0.39 0.00 0.00 -0.57 0.00 0.00 31.44 30.95 1wgv n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1wgv n GLU 63 N -1.65 0.00 0.00 3.49 1.02 -1.26 -4.91 120.64 117.33 1wgv n GLU 63 Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 1wgv n GLU 63 Cb 0.00 0.00 0.36 0.00 -0.02 0.00 0.00 31.44 31.78 1wgv n GLU 63 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1wgv n ASN 64 N -2.69 0.70 0.00 1.62 4.13 -1.26 -4.96 115.26 112.80 1wgv n ASN 64 Ca 0.00 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.73 1wgv n ASN 64 Cb 0.00 0.13 0.00 0.00 -1.54 0.00 0.00 39.78 38.37 1wgv n ASN 64 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wgv n GLY 65 N 1.41 2.76 3.64 7.41 0.00 -1.26 -5.19 105.19 113.96 1wgv n GLY 65 Ca 0.09 0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1wgv n GLY 65 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1wgv n GLU 66 N 0.00 0.96 -3.81 1.61 0.00 -1.26 -1.36 120.64 116.78 1wgv n GLU 66 Ca 0.00 -2.53 -0.12 0.00 0.00 0.00 0.00 57.16 54.51 1wgv n GLU 66 Cb 0.00 2.79 -0.11 0.00 0.00 0.00 0.00 31.44 34.12 1wgv n GLU 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 1wgv s ARG 67 N -2.42 0.34 -0.68 3.44 3.52 0.31 -4.81 118.95 118.66 1wgv s ARG 67 Ca 0.22 0.14 -0.20 0.00 -0.13 0.00 0.00 55.73 55.77 1wgv s ARG 67 Cb -0.03 0.15 0.11 0.00 -1.56 0.00 0.00 34.95 33.62 1wgv s ARG 67 CO 0.16 -0.06 0.85 0.08 -0.81 0.00 0.00 175.30 175.52 1wgv s VAL 68 N -0.28 4.72 0.08 7.11 1.01 -1.26 0.18 120.40 131.96 1wgv s VAL 68 Ca -0.04 -1.02 -0.27 0.00 0.00 0.00 0.00 61.98 60.66 1wgv s VAL 68 Cb -0.03 -4.59 -0.17 0.00 0.00 0.00 0.00 36.38 31.59 1wgv s VAL 68 CO 0.01 -1.27 1.68 -0.07 0.00 0.00 0.00 175.10 175.44 1wgv h LEU 69 N 10.28 -0.30 -7.94 3.92 3.38 -1.79 -3.45 115.31 119.42 1wgv h LEU 69 Ca -0.19 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.53 1wgv h LEU 69 Cb 1.07 0.08 -0.24 0.00 0.09 0.00 0.00 40.66 41.65 1wgv h LEU 69 CO 1.10 -0.20 -0.72 -0.32 0.09 0.00 0.00 178.44 178.39 1wgv s MET 70 N -6.06 0.30 -0.27 1.13 0.00 -1.18 -4.67 119.30 108.56 1wgv s MET 70 Ca -0.15 -0.39 -0.33 0.00 0.00 0.00 0.00 55.69 54.82 1wgv s MET 70 Cb 0.05 -0.12 0.17 0.00 0.00 0.00 0.00 34.83 34.93 1wgv s MET 70 CO 0.64 0.02 1.32 -2.00 0.00 0.00 0.00 175.02 175.01 1wgv s GLU 71 N -0.82 0.12 0.00 4.11 -6.30 -1.26 0.85 118.70 115.39 1wgv s GLU 71 Ca -0.07 -0.01 0.00 0.00 -2.50 0.00 0.00 54.97 52.40 1wgv s GLU 71 Cb -0.06 0.05 0.00 0.00 0.00 0.00 0.00 34.13 34.13 1wgv s GLU 71 CO -0.00 -0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.64 1wgv n GLY 72 N 0.28 4.28 3.74 -1.50 0.00 -1.11 -5.03 105.19 105.86 1wgv n GLY 72 Ca 0.01 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 1wgv n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgv s LYS 73 N -2.92 4.47 1.07 1.61 1.02 -1.26 -2.89 119.74 120.85 1wgv s LYS 73 Ca 0.00 1.95 -0.17 0.00 0.02 0.00 0.00 55.97 57.77 1wgv s LYS 73 Cb 0.00 -3.20 0.23 0.00 -0.52 0.00 0.00 37.83 34.34 1wgv s LYS 73 CO 0.00 -0.10 1.19 -0.51 -0.92 0.00 0.00 175.35 175.01 1wgv s LEU 74 N -0.56 1.62 0.02 3.17 1.43 0.31 -2.54 118.68 122.13 1wgv s LEU 74 Ca 0.52 0.56 0.08 0.00 -1.03 0.00 0.00 54.13 54.26 1wgv s LEU 74 Cb -0.34 -2.49 -0.23 0.00 0.03 0.00 0.00 46.19 43.16 1wgv s LEU 74 CO 0.40 -3.39 0.90 0.71 0.23 0.00 0.00 176.35 175.20 1wgv h THR 75 N -2.08 1.19 -2.18 5.49 1.35 -1.38 -3.40 112.91 111.90 1wgv h THR 75 Ca -0.46 -2.97 -0.02 0.00 -0.55 0.00 0.00 66.41 62.41 1wgv h THR 75 Cb 1.28 2.62 -0.01 0.00 -1.73 0.00 0.00 68.15 70.31 1wgv h THR 75 CO 0.40 0.71 -0.02 1.41 -0.25 0.00 0.00 175.52 177.77 1wgv n HIS 76 N -3.21 -0.04 -2.66 4.73 8.25 -1.26 -5.04 115.22 115.99 1wgv n HIS 76 Ca -0.11 -0.13 -0.22 0.00 -0.26 0.00 0.00 57.72 57.00 1wgv n HIS 76 Cb 1.01 0.01 0.06 0.00 1.12 0.00 0.00 29.99 32.19 1wgv n HIS 76 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1wgv s LYS 77 N -2.07 2.27 0.37 -0.41 1.02 -1.25 -3.95 119.74 115.73 1wgv s LYS 77 Ca 0.02 -0.96 -0.05 0.00 0.02 0.00 0.00 55.97 54.99 1wgv s LYS 77 Cb 0.00 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.87 1wgv s LYS 77 CO 0.01 -0.93 0.58 0.96 -0.92 0.00 0.00 175.35 175.06 1wgv s ILE 78 N -2.86 0.00 -0.92 2.17 -5.25 0.11 -3.96 121.20 110.49 1wgv s ILE 78 Ca 0.60 -1.42 -0.03 0.00 -0.99 0.00 0.00 60.65 58.81 1wgv s ILE 78 Cb -0.08 -2.78 0.23 0.00 2.95 0.00 0.00 42.46 42.77 1wgv s ILE 78 CO 0.40 0.00 0.82 0.21 -1.79 0.00 0.00 174.94 174.58 1wgv s ASN 79 N -3.21 6.22 0.30 4.36 3.84 -1.23 -4.75 114.94 120.46 1wgv s ASN 79 Ca 0.26 -3.63 0.04 0.00 0.21 0.00 0.00 52.86 49.75 1wgv s ASN 79 Cb -0.02 -1.97 0.77 0.00 -0.55 0.00 0.00 41.25 39.48 1wgv s ASN 79 CO 0.19 -0.22 1.66 0.71 -2.79 0.00 0.00 177.10 176.65 1wgv h THR 80 N 4.08 0.36 -0.08 -5.21 1.35 -1.90 1.60 112.91 113.10 1wgv h THR 80 Ca 0.15 -0.10 0.03 0.00 -0.55 0.00 0.00 66.41 65.95 1wgv h THR 80 Cb 0.84 0.05 -0.04 0.00 -1.73 0.00 0.00 68.15 67.27 1wgv h THR 80 CO 0.87 0.05 -0.13 -0.33 -0.25 0.00 0.00 175.52 175.73 1wgv h GLU 81 N 0.28 -0.18 0.00 4.72 5.08 -1.94 -1.08 114.58 121.46 1wgv h GLU 81 Ca 0.58 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.92 1wgv h GLU 81 Cb 1.18 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1wgv h GLU 81 CO -0.61 -0.12 -0.17 1.03 -1.00 0.00 0.00 179.01 178.14 1wgv h SER 82 N -0.18 0.00 -4.29 1.42 0.87 -1.01 -3.44 113.55 106.91 1wgv h SER 82 Ca 0.07 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.13 1wgv h SER 82 Cb 0.28 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 62.36 1wgv h SER 82 CO -0.19 0.17 0.34 -0.44 -0.53 0.00 0.00 176.83 176.18 1wgv s SER 83 N -6.12 4.75 0.37 6.23 0.01 0.51 -4.81 113.70 114.64 1wgv s SER 83 Ca 0.03 1.54 -0.07 0.00 1.31 0.00 0.00 55.95 58.75 1wgv s SER 83 Cb 0.08 -2.32 0.03 0.00 0.21 0.00 0.00 66.02 64.02 1wgv s SER 83 CO 0.64 -1.84 0.61 -1.48 0.41 0.00 0.00 173.24 171.59 1wgv s LEU 84 N -5.75 0.63 -0.29 2.44 0.05 -0.48 -4.89 118.68 110.38 1wgv s LEU 84 Ca 0.60 -1.38 -0.16 0.00 0.05 0.00 0.00 54.13 53.24 1wgv s LEU 84 Cb -0.15 2.05 0.11 0.00 -2.05 0.00 0.00 46.19 46.16 1wgv s LEU 84 CO 0.55 -1.49 0.83 -1.66 -0.55 0.00 0.00 176.35 174.03 1wgv s TRP 85 N -2.64 -0.84 -0.02 3.48 1.48 -1.26 -0.22 118.94 118.93 1wgv s TRP 85 Ca 0.25 1.66 0.06 0.00 -1.06 0.00 0.00 56.10 57.00 1wgv s TRP 85 Cb -0.02 0.50 -0.01 0.00 -1.16 0.00 0.00 33.47 32.77 1wgv s TRP 85 CO 0.17 -0.42 -0.19 -1.12 -4.06 0.00 0.00 176.95 171.34 1wgv s SER 86 N 1.57 2.27 -0.10 -2.66 0.01 0.36 -4.96 113.70 110.19 1wgv s SER 86 Ca -0.09 -0.35 -0.05 0.00 1.31 0.00 0.00 55.95 56.77 1wgv s SER 86 Cb -0.05 -0.30 -0.04 0.00 0.21 0.00 0.00 66.02 65.84 1wgv s SER 86 CO -0.18 0.23 0.08 -0.22 0.41 0.00 0.00 173.24 173.56 1wgv s LEU 87 N -0.39 4.03 -0.07 2.44 1.98 -1.26 0.18 118.68 125.59 1wgv s LEU 87 Ca 0.06 0.32 0.05 0.00 -2.89 0.00 0.00 54.13 51.68 1wgv s LEU 87 Cb -0.08 -1.96 -0.01 0.00 0.66 0.00 0.00 46.19 44.80 1wgv s LEU 87 CO -0.00 0.39 -0.24 -1.61 -1.89 0.00 0.00 176.35 173.00 1wgv s GLU 88 N -0.98 2.71 -0.12 1.98 2.02 -0.83 -4.95 118.70 118.53 1wgv s GLU 88 Ca 0.14 -0.89 -0.29 0.00 0.02 0.00 0.00 54.97 53.95 1wgv s GLU 88 Cb -0.12 -2.22 -0.02 0.00 0.10 0.00 0.00 34.13 31.87 1wgv s GLU 88 CO 0.03 0.33 1.25 -1.25 0.02 0.00 0.00 175.26 175.65 1wgv s PRO 89 N -0.03 4.27 -1.23 0.39 0.04 -1.26 -3.40 135.00 133.79 1wgv s PRO 89 Ca -0.07 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.65 1wgv s PRO 89 Cb -0.15 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.70 1wgv s PRO 89 CO 0.05 -0.62 0.96 0.41 0.04 0.00 0.00 177.00 177.85 1wgv n GLY 90 N 3.54 -0.36 0.00 0.56 0.00 -0.74 -4.88 105.19 103.31 1wgv n GLY 90 Ca 0.13 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1wgv n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wgv n LYS 91 N -4.20 0.00 -3.83 1.61 4.76 -1.22 -4.97 118.16 110.31 1wgv n LYS 91 Ca -0.28 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.10 1wgv n LYS 91 Cb 0.67 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.87 1wgv n LYS 91 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wgv s VAL 93 N -2.55 4.82 -0.21 0.00 1.01 0.52 -1.96 120.40 122.03 1wgv s VAL 93 Ca 0.17 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.01 1wgv s VAL 93 Cb -0.04 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 1wgv s VAL 93 CO 0.08 0.48 0.15 -0.22 0.00 0.00 0.00 175.10 175.59 1wgv s LEU 94 N 0.16 4.19 -0.15 3.92 1.98 0.48 -1.31 118.68 127.96 1wgv s LEU 94 Ca 0.05 0.22 -0.03 0.00 -2.89 0.00 0.00 54.13 51.48 1wgv s LEU 94 Cb -0.12 -2.11 0.05 0.00 0.66 0.00 0.00 46.19 44.67 1wgv s LEU 94 CO 0.00 0.15 0.04 -0.69 -1.89 0.00 0.00 176.35 173.97 1wgv s VAL 95 N 0.51 0.31 -0.27 1.68 1.01 -0.85 0.14 120.40 122.92 1wgv s VAL 95 Ca 0.08 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1wgv s VAL 95 Cb -0.12 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 1wgv s VAL 95 CO -0.00 -0.08 0.19 0.20 0.00 0.00 0.00 175.10 175.40 1wgv s ASN 96 N 1.97 6.04 -0.19 3.32 0.02 0.70 -2.70 114.94 124.10 1wgv s ASN 96 Ca 0.02 0.01 -0.04 0.00 -1.02 0.00 0.00 52.86 51.82 1wgv s ASN 96 Cb -0.15 -2.12 -0.02 0.00 0.02 0.00 0.00 41.25 38.98 1wgv s ASN 96 CO -0.07 -0.03 -0.02 -0.76 0.02 0.00 0.00 177.10 176.24 1wgv s LEU 97 N 1.63 3.19 0.56 0.60 1.43 -0.70 -1.39 118.68 124.00 1wgv s LEU 97 Ca 0.07 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 1wgv s LEU 97 Cb -0.16 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 1wgv s LEU 97 CO 0.10 0.07 0.97 -0.55 0.23 0.00 0.00 176.35 177.17 1wgv s SER 98 N 0.94 6.37 -0.18 2.29 0.15 -1.26 -1.42 113.70 120.60 1wgv s SER 98 Ca 0.01 1.40 -0.12 0.00 0.70 0.00 0.00 55.95 57.94 1wgv s SER 98 Cb -0.14 -2.45 -0.05 0.00 -1.71 0.00 0.00 66.02 61.67 1wgv s SER 98 CO 0.02 -0.72 0.21 -0.54 1.20 0.00 0.00 173.24 173.40 1wgv s LYS 99 N -4.71 4.19 -0.44 5.44 1.02 -1.26 -3.52 119.74 120.47 1wgv s LYS 99 Ca 0.55 -0.06 -0.06 0.00 0.02 0.00 0.00 55.97 56.43 1wgv s LYS 99 Cb -0.11 -3.41 0.12 0.00 -0.52 0.00 0.00 37.83 33.91 1wgv s LYS 99 CO 0.45 0.29 0.27 0.08 -0.92 0.00 0.00 175.35 175.52 1wgv s VAL 100 N 0.34 3.68 0.31 3.17 1.01 -1.25 -4.71 120.40 122.95 1wgv s VAL 100 Ca 0.13 -1.96 0.00 0.00 0.00 0.00 0.00 61.98 60.14 1wgv s VAL 100 Cb -0.12 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1wgv s VAL 100 CO 0.01 -0.73 0.00 0.61 0.00 0.00 0.00 175.10 174.99 1wgv n GLY 101 N 4.70 -3.28 3.56 4.51 0.00 -1.26 -4.58 105.19 108.84 1wgv n GLY 101 Ca -0.04 -1.14 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 1wgv n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wgv s GLU 102 N -4.29 2.41 0.13 1.61 2.02 -1.26 -4.91 118.70 114.40 1wgv s GLU 102 Ca 0.00 0.22 0.06 0.00 0.02 0.00 0.00 54.97 55.27 1wgv s GLU 102 Cb 0.00 -4.79 -0.04 0.00 0.10 0.00 0.00 34.13 29.40 1wgv s GLU 102 CO 0.00 -3.33 -0.13 0.71 0.02 0.00 0.00 175.26 172.53 1wgv s TYR 103 N 10.60 1.38 0.52 1.61 2.02 -1.26 -5.14 117.35 127.08 1wgv s TYR 103 Ca 0.74 -0.59 -0.17 0.00 -0.37 0.00 0.00 57.07 56.69 1wgv s TYR 103 Cb -0.10 -0.71 -0.07 0.00 -0.40 0.00 0.00 41.96 40.67 1wgv s TYR 103 CO 0.09 0.14 0.99 -0.46 -1.57 0.00 0.00 175.55 174.74 1wgv s TRP 104 N -2.40 3.39 0.00 2.71 -0.00 -1.26 -4.98 118.94 116.39 1wgv s TRP 104 Ca 0.11 1.48 0.00 0.00 -0.00 0.00 0.00 56.10 57.68 1wgv s TRP 104 Cb -0.03 -2.82 0.00 0.00 -0.00 0.00 0.00 33.47 30.61 1wgv s TRP 104 CO 0.03 -0.46 0.00 0.91 -0.00 0.00 0.00 176.95 177.42 1wgv n TRP 105 N -1.62 0.00 -1.63 5.86 7.02 -1.26 -4.77 117.44 121.04 1wgv n TRP 105 Ca 0.07 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.44 1wgv n TRP 105 Cb 0.54 0.26 -0.04 0.00 -2.42 0.00 0.00 31.31 29.65 1wgv n TRP 105 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1wgv n ASN 106 N -2.03 -3.11 0.00 -0.99 5.03 -1.26 -4.74 115.26 108.16 1wgv n ASN 106 Ca 0.00 0.26 0.00 0.00 0.87 0.00 0.00 54.58 55.71 1wgv n ASN 106 Cb 0.00 -2.89 0.00 0.00 -1.02 0.00 0.00 39.78 35.87 1wgv n ASN 106 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1wgv n ALA 107 N -0.43 0.00 0.03 5.41 0.00 -1.26 -2.35 120.51 121.90 1wgv n ALA 107 Ca -0.12 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 1wgv n ALA 107 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.86 1wgv n ALA 107 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1wgv h ILE 108 N 1.06 0.12 -2.33 0.00 1.08 -1.92 -3.41 117.51 112.12 1wgv h ILE 108 Ca 0.00 -0.94 -0.45 0.00 -0.39 0.00 0.00 64.86 63.07 1wgv h ILE 108 Cb 0.00 0.23 0.02 0.00 -3.07 0.00 0.00 36.82 33.99 1wgv h ILE 108 CO 0.00 0.04 -0.22 -0.76 -0.69 0.00 0.00 178.15 176.52 1wgv s LEU 109 N -8.73 3.84 0.62 1.44 1.43 -1.26 -1.18 118.68 114.84 1wgv s LEU 109 Ca -0.04 0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 53.01 1wgv s LEU 109 Cb 0.00 -2.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.21 1wgv s LEU 109 CO 0.13 -0.53 1.07 -1.61 0.23 0.00 0.00 176.35 175.64 1wgv s GLU 110 N -4.35 3.14 0.00 1.70 0.41 -1.05 -3.65 118.70 114.90 1wgv s GLU 110 Ca 0.46 1.19 0.00 0.00 -0.41 0.00 0.00 54.97 56.21 1wgv s GLU 110 Cb -0.10 -2.01 0.00 0.00 -1.78 0.00 0.00 34.13 30.24 1wgv s GLU 110 CO 0.34 -0.95 0.00 0.41 -0.49 0.00 0.00 175.26 174.57 1wgv n GLY 111 N -1.07 1.93 3.45 -1.39 0.00 -1.26 -4.95 105.19 101.89 1wgv n GLY 111 Ca 0.09 -0.26 -0.60 0.00 0.00 0.00 0.00 46.02 45.25 1wgv n GLY 111 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wgv n GLU 112 N 0.00 0.31 -1.21 1.61 4.07 -1.24 -4.77 120.64 119.41 1wgv n GLU 112 Ca 0.00 0.10 -0.38 0.00 -0.06 0.00 0.00 57.16 56.82 1wgv n GLU 112 Cb 0.00 -1.73 0.01 0.00 -0.06 0.00 0.00 31.44 29.66 1wgv n GLU 112 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1wgv n GLU 113 N 6.57 0.00 -2.47 5.31 1.02 -1.26 -4.78 120.64 125.03 1wgv n GLU 113 Ca 0.44 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 57.16 1wgv n GLU 113 Cb 0.02 -0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 1wgv n GLU 113 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wgv s PRO 114 N -0.96 4.48 0.01 3.49 0.04 -1.26 -4.75 135.00 136.05 1wgv s PRO 114 Ca 0.55 1.72 -0.00 0.00 0.04 0.00 0.00 61.00 63.32 1wgv s PRO 114 Cb -0.52 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 30.68 1wgv s PRO 114 CO 0.62 -0.17 0.01 0.44 0.04 0.00 0.00 177.00 177.94 1wgv n ILE 115 N 3.59 0.00 0.00 0.56 -5.35 -0.99 -5.06 119.36 112.11 1wgv n ILE 115 Ca 0.07 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 1wgv n ILE 115 Cb 0.47 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 1wgv n ILE 115 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1wgv n ASP 116 N -2.29 0.00 -0.69 7.28 2.03 -1.26 -5.08 116.55 116.54 1wgv n ASP 116 Ca 0.00 0.00 0.09 0.00 0.52 0.00 0.00 54.79 55.40 1wgv n ASP 116 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1wgv n ASP 116 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1wgv n ILE 117 N 0.00 0.00 -2.57 5.18 -0.00 -1.26 -4.96 119.36 115.75 1wgv n ILE 117 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 62.75 62.70 1wgv n ILE 117 Cb 0.00 -0.22 -0.04 0.00 -0.00 0.00 0.00 39.64 39.38 1wgv n ILE 117 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 1wgv n ASP 118 N -4.31 -2.01 -3.15 4.38 8.00 -1.26 -4.90 116.55 113.30 1wgv n ASP 118 Ca 0.00 1.44 0.05 0.00 0.71 0.00 0.00 54.79 57.00 1wgv n ASP 118 Cb 0.29 -5.21 -0.01 0.00 -0.02 0.00 0.00 41.12 36.17 1wgv n ASP 118 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1wgv s SER 119 N -0.64 -0.40 0.00 -2.24 0.15 -1.13 -4.20 113.70 105.24 1wgv s SER 119 Ca -0.24 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.51 1wgv s SER 119 Cb 0.02 1.27 0.00 0.00 -1.71 0.00 0.00 66.02 65.60 1wgv s SER 119 CO 0.65 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.62 1wgv n GLY 120 N 5.22 -0.16 2.92 9.45 0.00 -1.26 -4.82 105.19 116.54 1wgv n GLY 120 Ca 0.04 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.38 1wgv n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wgv n PRO 121 N 0.00 2.15 -3.52 1.61 -0.04 -1.26 -4.87 135.00 129.07 1wgv n PRO 121 Ca 0.00 -2.20 -0.38 0.00 -0.04 0.00 0.00 63.50 60.88 1wgv n PRO 121 Cb 0.00 -3.09 -0.06 0.00 -0.04 0.00 0.00 33.50 30.31 1wgv n PRO 121 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wgv s SER 122 N 4.13 6.74 0.39 3.54 1.04 -1.26 -5.07 113.70 123.20 1wgv s SER 122 Ca 0.52 0.87 -0.21 0.00 0.48 0.00 0.00 55.95 57.62 1wgv s SER 122 Cb 0.14 -2.23 -0.10 0.00 0.10 0.00 0.00 66.02 63.93 1wgv s SER 122 CO 0.02 0.29 0.91 -0.55 0.98 0.00 0.00 173.24 174.88 1wgv s SER 123 N -0.80 6.99 0.00 7.02 0.15 -1.26 -5.10 113.70 120.70 1wgv s SER 123 Ca 0.23 1.64 0.00 0.00 0.70 0.00 0.00 55.95 58.52 1wgv s SER 123 Cb -0.16 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 1wgv s SER 123 CO 0.12 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.90