#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgv s SER 2 N 0.00 5.30 -0.25 1.61 0.15 -1.26 -4.89 113.70 114.37 1wgv s SER 2 Ca 0.00 -0.90 0.02 0.00 0.70 0.00 0.00 55.95 55.77 1wgv s SER 2 Cb 0.00 -2.56 0.06 0.00 -1.71 0.00 0.00 66.02 61.81 1wgv s SER 2 CO 0.00 -2.62 -0.08 -0.94 1.20 0.00 0.00 173.24 170.80 1wgv s SER 3 N 7.47 4.15 0.00 5.45 1.04 -1.26 -5.04 113.70 125.51 1wgv s SER 3 Ca 0.67 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1wgv s SER 3 Cb -0.05 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 64.71 1wgv s SER 3 CO -0.00 -0.21 0.02 0.61 0.98 0.00 0.00 173.24 174.64 1wgv n GLY 4 N 4.55 1.47 3.90 7.32 0.00 -1.26 -4.94 105.19 116.24 1wgv n GLY 4 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1wgv n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgv s SER 5 N -1.08 6.46 -0.58 1.61 0.01 -1.26 -5.01 113.70 113.86 1wgv s SER 5 Ca 0.00 0.51 -0.27 0.00 1.31 0.00 0.00 55.95 57.51 1wgv s SER 5 Cb 0.00 -2.06 -0.03 0.00 0.21 0.00 0.00 66.02 64.14 1wgv s SER 5 CO 0.00 0.09 1.94 -0.44 0.41 0.00 0.00 173.24 175.24 1wgv s SER 6 N -2.43 5.17 1.17 2.44 0.01 -1.26 -4.77 113.70 114.03 1wgv s SER 6 Ca 0.39 0.50 0.00 0.00 1.31 0.00 0.00 55.95 58.15 1wgv s SER 6 Cb -0.12 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1wgv s SER 6 CO 0.25 -2.43 0.00 0.61 0.41 0.00 0.00 173.24 172.08 1wgv n GLY 7 N 5.73 2.94 3.33 3.44 0.00 -1.26 -4.73 105.19 114.65 1wgv n GLY 7 Ca 0.23 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1wgv n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wgv s GLN 8 N 0.00 1.26 -0.45 1.61 0.74 -1.26 -5.06 119.66 116.50 1wgv s GLN 8 Ca 0.00 -1.29 -0.26 0.00 0.05 0.00 0.00 55.36 53.85 1wgv s GLN 8 Cb 0.00 -1.54 -0.06 0.00 1.10 0.00 0.00 33.01 32.50 1wgv s GLN 8 CO 0.00 0.35 2.37 0.15 -0.55 0.00 0.00 175.29 177.61 1wgv s LYS 9 N -2.20 2.27 0.64 1.67 -0.14 -1.26 -4.58 119.74 116.14 1wgv s LYS 9 Ca 0.12 1.49 0.00 0.00 -1.36 0.00 0.00 55.97 56.22 1wgv s LYS 9 Cb -0.09 -4.55 0.00 0.00 -1.68 0.00 0.00 37.83 31.51 1wgv s LYS 9 CO 0.06 -3.08 0.00 0.09 -0.76 0.00 0.00 175.35 171.65 1wgv n ASN 10 N 15.18 -8.20 -0.00 2.83 3.02 -1.26 -4.70 115.26 122.12 1wgv n ASN 10 Ca 0.35 1.62 -0.17 0.00 -0.03 0.00 0.00 54.58 56.34 1wgv n ASN 10 Cb 0.53 -5.15 -0.10 0.00 -0.61 0.00 0.00 39.78 34.46 1wgv n ASN 10 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1wgv h PRO 11 N -1.06 0.50 -6.87 3.52 0.13 -2.03 -3.45 132.00 122.73 1wgv h PRO 11 Ca -0.16 -0.48 -0.56 0.00 -0.87 0.00 0.00 66.00 63.93 1wgv h PRO 11 Cb 1.32 0.12 0.13 0.00 0.13 0.00 0.00 31.00 32.71 1wgv h PRO 11 CO 0.06 1.12 0.46 -3.47 -0.23 0.00 0.00 178.00 175.95 1wgv n ASP 12 N -4.17 2.33 -2.70 1.44 -0.08 -1.26 -4.12 116.55 108.00 1wgv n ASP 12 Ca -0.10 1.04 -0.01 0.00 -1.51 0.00 0.00 54.79 54.21 1wgv n ASP 12 Cb 0.68 -1.50 -0.01 0.00 2.34 0.00 0.00 41.12 42.63 1wgv n ASP 12 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1wgv n SER 13 N -0.18 -6.39 -0.05 1.67 2.88 -1.26 -4.96 113.62 105.32 1wgv n SER 13 Ca 0.08 1.43 -0.13 0.00 -1.33 0.00 0.00 58.87 58.92 1wgv n SER 13 Cb 0.42 -5.34 -0.11 0.00 -0.75 0.00 0.00 64.21 58.42 1wgv n SER 13 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1wgv h TYR 14 N 3.30 -0.01 -1.56 0.66 5.03 -1.91 -3.48 116.97 119.00 1wgv h TYR 14 Ca -0.12 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.26 1wgv h TYR 14 Cb 0.29 0.00 -0.25 0.00 1.55 0.00 0.00 36.73 38.32 1wgv h TYR 14 CO 0.01 0.78 0.51 1.21 -1.32 0.00 0.00 178.16 179.35 1wgv s ASN 15 N -6.00 -0.40 0.00 -2.11 2.47 -1.26 -5.05 114.94 102.59 1wgv s ASN 15 Ca -0.17 0.64 0.00 0.00 0.42 0.00 0.00 52.86 53.75 1wgv s ASN 15 Cb -0.01 0.60 0.00 0.00 -1.45 0.00 0.00 41.25 40.39 1wgv s ASN 15 CO 0.65 -0.22 0.00 0.61 -3.72 0.00 0.00 177.10 174.42 1wgv n GLY 16 N 1.56 0.53 3.62 1.21 0.00 -1.26 -4.99 105.19 105.87 1wgv n GLY 16 Ca -0.11 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.30 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 -1.58 3.33 0.03 4.61 0.00 -0.36 -4.97 121.76 122.83 1wgv s ALA 17 Ca 0.00 -0.20 0.05 0.00 0.00 0.00 0.00 51.96 51.81 1wgv s ALA 17 Cb 0.00 -3.78 -0.02 0.00 0.00 0.00 0.00 23.12 19.32 1wgv s ALA 17 CO 0.00 -1.85 -0.14 0.08 0.00 0.00 0.00 175.76 173.85 1wgv s VAL 18 N 4.13 1.11 0.00 0.00 1.01 -1.26 -0.93 120.40 124.45 1wgv s VAL 18 Ca 0.48 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1wgv s VAL 18 Cb -0.11 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1wgv s VAL 18 CO 0.23 0.03 0.00 -1.14 0.00 0.00 0.00 175.10 174.23 1wgv n ARG 19 N 1.98 0.00 0.00 2.72 3.00 -1.25 -5.03 116.66 118.08 1wgv n ARG 19 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.67 1wgv n ARG 19 Cb 0.55 -0.09 0.00 0.00 0.00 0.00 0.00 32.46 32.92 1wgv n ARG 19 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1wgv n GLU 20 N -1.63 0.00 0.00 -0.14 0.28 -1.26 -5.00 120.64 112.89 1wgv n GLU 20 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1wgv n GLU 20 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1wgv n GLU 20 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1wgv n ASN 21 N 0.00 0.00 -3.79 -1.84 0.23 -1.26 -5.12 115.26 103.47 1wgv n ASN 21 Ca 0.00 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 53.89 1wgv n ASN 21 Cb 0.00 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.54 1wgv n ASN 21 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1wgv s TYR 22 N -1.02 0.17 0.26 -2.53 -0.85 -1.26 -4.72 117.35 107.39 1wgv s TYR 22 Ca 0.00 0.07 -0.12 0.00 -0.52 0.00 0.00 57.07 56.50 1wgv s TYR 22 Cb 0.00 -0.32 -0.08 0.00 0.38 0.00 0.00 41.96 41.94 1wgv s TYR 22 CO 0.00 -0.11 0.62 0.95 -1.52 0.00 0.00 175.55 175.49 1wgv s THR 23 N 1.06 4.84 0.18 -3.49 -4.23 -1.23 -3.83 115.64 108.93 1wgv s THR 23 Ca -0.09 0.65 -0.17 0.00 -1.18 0.00 0.00 61.69 60.90 1wgv s THR 23 Cb -0.13 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.12 1wgv s THR 23 CO -0.02 -0.10 0.49 -1.66 -0.54 0.00 0.00 174.62 172.78 1wgv s TRP 24 N -1.86 -0.10 0.13 3.99 1.48 -0.11 -1.83 118.94 120.64 1wgv s TRP 24 Ca 0.49 -0.23 -0.16 0.00 -1.06 0.00 0.00 56.10 55.14 1wgv s TRP 24 Cb -0.11 0.34 0.04 0.00 -1.16 0.00 0.00 33.47 32.57 1wgv s TRP 24 CO 0.20 -0.86 0.41 -1.54 -4.06 0.00 0.00 176.95 171.10 1wgv s SER 25 N -2.87 -0.25 -0.19 -2.66 1.04 -0.43 -1.22 113.70 107.12 1wgv s SER 25 Ca 0.08 -0.31 -0.05 0.00 0.48 0.00 0.00 55.95 56.15 1wgv s SER 25 Cb -0.00 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.57 1wgv s SER 25 CO -0.04 -0.86 -0.00 0.00 0.98 0.00 0.00 173.24 173.31 1wgv s GLN 26 N -3.80 3.65 0.50 4.02 0.00 -1.26 -2.00 119.66 120.76 1wgv s GLN 26 Ca 0.03 -0.51 0.06 0.00 -0.00 0.00 0.00 55.36 54.94 1wgv s GLN 26 Cb 0.02 -3.07 0.06 0.00 0.00 0.00 0.00 33.01 30.02 1wgv s GLN 26 CO -0.12 0.06 0.52 -0.25 0.00 0.00 0.00 175.29 175.50 1wgv n ASP 27 N 4.12 2.25 -0.38 12.60 9.92 -0.32 -5.01 116.55 139.74 1wgv n ASP 27 Ca -0.17 -2.54 -0.07 0.00 -0.53 0.00 0.00 54.79 51.48 1wgv n ASP 27 Cb 0.52 -0.19 -0.05 0.00 -0.64 0.00 0.00 41.12 40.76 1wgv n ASP 27 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wgv n TYR 28 N -1.86 -0.26 -2.94 1.24 9.36 -1.26 -3.78 117.16 117.65 1wgv n TYR 28 Ca 0.06 1.14 -0.15 0.00 3.32 0.00 0.00 57.90 62.27 1wgv n TYR 28 Cb 0.55 -0.66 -0.00 0.00 -0.63 0.00 0.00 39.34 38.59 1wgv n TYR 28 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 1wgv n THR 29 N -5.22 -0.31 0.00 2.97 5.66 -1.26 -5.11 114.28 111.02 1wgv n THR 29 Ca 0.04 -2.53 0.00 0.00 -3.05 0.00 0.00 64.05 58.51 1wgv n THR 29 Cb 0.28 0.04 0.00 0.00 -1.55 0.00 0.00 70.33 69.10 1wgv n THR 29 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1wgv n ASP 30 N 1.62 0.00 -4.89 1.09 5.75 -1.25 -4.60 116.55 114.27 1wgv n ASP 30 Ca 0.14 0.00 -0.26 0.00 -0.01 0.00 0.00 54.79 54.67 1wgv n ASP 30 Cb 0.58 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.64 1wgv n ASP 30 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1wgv s LEU 31 N 0.00 4.14 -0.21 -2.12 1.02 -1.03 -1.17 118.68 119.30 1wgv s LEU 31 Ca 0.00 0.05 -0.04 0.00 0.02 0.00 0.00 54.13 54.16 1wgv s LEU 31 Cb 0.00 -2.72 0.09 0.00 0.02 0.00 0.00 46.19 43.57 1wgv s LEU 31 CO 0.00 0.05 0.16 -0.70 0.02 0.00 0.00 176.35 175.88 1wgv s GLU 32 N -3.24 0.15 -0.17 1.70 2.12 -0.85 -3.06 118.70 115.35 1wgv s GLU 32 Ca 0.33 -0.05 0.01 0.00 0.36 0.00 0.00 54.97 55.62 1wgv s GLU 32 Cb -0.10 -1.40 0.02 0.00 0.26 0.00 0.00 34.13 32.91 1wgv s GLU 32 CO 0.27 -0.75 -0.18 0.54 -0.54 0.00 0.00 175.26 174.59 1wgv s VAL 33 N 2.22 1.91 -0.21 3.70 0.11 -1.16 -1.31 120.40 125.67 1wgv s VAL 33 Ca 0.06 -0.85 -0.05 0.00 -2.93 0.00 0.00 61.98 58.20 1wgv s VAL 33 Cb -0.16 -1.74 -0.02 0.00 -1.53 0.00 0.00 36.38 32.93 1wgv s VAL 33 CO -0.17 0.52 0.01 -0.13 -3.33 0.00 0.00 175.10 172.00 1wgv s ARG 34 N 1.34 3.60 -0.20 1.54 0.52 -0.76 -3.05 118.95 121.94 1wgv s ARG 34 Ca 0.05 -0.52 -0.09 0.00 -0.52 0.00 0.00 55.73 54.64 1wgv s ARG 34 Cb -0.13 -3.12 -0.05 0.00 0.52 0.00 0.00 34.95 32.18 1wgv s ARG 34 CO -0.12 -0.05 0.11 0.08 0.02 0.00 0.00 175.30 175.34 1wgv s VAL 35 N 1.17 5.17 0.20 3.52 1.01 -0.72 -3.56 120.40 127.20 1wgv s VAL 35 Ca 0.03 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1wgv s VAL 35 Cb -0.14 -3.36 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 1wgv s VAL 35 CO 0.01 0.44 1.11 -2.16 0.00 0.00 0.00 175.10 174.50 1wgv s PRO 36 N 0.42 4.59 0.25 2.72 0.04 -1.26 0.16 135.00 141.93 1wgv s PRO 36 Ca 0.06 1.75 0.11 0.00 0.04 0.00 0.00 61.00 62.97 1wgv s PRO 36 Cb -0.12 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 31.12 1wgv s PRO 36 CO -0.01 0.09 -0.19 0.14 0.04 0.00 0.00 177.00 177.07 1wgv s VAL 37 N -0.44 2.29 1.04 -0.36 -7.23 -0.87 -4.88 120.40 109.95 1wgv s VAL 37 Ca 0.49 -2.30 -0.16 0.00 -1.81 0.00 0.00 61.98 58.20 1wgv s VAL 37 Cb -0.30 -2.21 0.22 0.00 0.56 0.00 0.00 36.38 34.65 1wgv s VAL 37 CO 0.36 -0.39 1.20 -2.16 -0.31 0.00 0.00 175.10 173.80 1wgv s PRO 38 N -3.38 0.07 0.00 4.82 0.04 -1.26 -4.28 135.00 131.00 1wgv s PRO 38 Ca 0.27 -0.11 0.10 0.00 0.04 0.00 0.00 61.00 61.30 1wgv s PRO 38 Cb -0.05 -1.75 0.45 0.00 0.04 0.00 0.00 34.50 33.19 1wgv s PRO 38 CO 0.12 -2.84 1.31 1.63 0.04 0.00 0.00 177.00 177.26 1wgv n LYS 39 N -4.14 1.29 0.00 4.56 4.76 -1.26 -2.71 118.16 120.66 1wgv n LYS 39 Ca 0.12 -0.45 0.08 0.00 -2.87 0.00 0.00 58.31 55.19 1wgv n LYS 39 Cb 0.59 -1.19 -0.00 0.00 -1.84 0.00 0.00 35.03 32.59 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 -0.22 0.00 -3.52 2.13 1.44 -1.26 -4.78 115.22 109.01 1wgv n HIS 40 Ca 0.08 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.38 1wgv n HIS 40 Cb 0.13 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.14 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 -1.83 4.88 -0.02 0.61 1.01 -1.10 -4.84 120.40 119.11 1wgv s VAL 41 Ca 0.13 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1wgv s VAL 41 Cb 0.12 -3.76 0.04 0.00 0.00 0.00 0.00 36.38 32.78 1wgv s VAL 41 CO 0.39 -0.32 1.00 1.33 0.00 0.00 0.00 175.10 177.50 1wgv n VAL 42 N 5.07 0.25 -3.89 2.92 0.24 -1.26 -1.59 118.33 120.08 1wgv n VAL 42 Ca -0.11 -0.30 -0.11 0.00 -2.04 0.00 0.00 64.34 61.77 1wgv n VAL 42 Cb 0.46 0.42 -0.11 0.00 -1.47 0.00 0.00 33.84 33.14 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 -0.38 0.32 0.41 7.34 1.02 -1.26 -4.73 119.74 122.46 1wgv s LYS 43 Ca 0.04 -0.27 0.21 0.00 0.02 0.00 0.00 55.97 55.96 1wgv s LYS 43 Cb 0.04 0.13 0.85 0.00 -0.52 0.00 0.00 37.83 38.33 1wgv s LYS 43 CO 0.00 -0.06 1.81 0.78 -0.92 0.00 0.00 175.35 176.96 1wgv h GLY 44 N 4.94 0.00 2.00 -3.33 0.00 -1.93 -2.02 103.07 102.73 1wgv h GLY 44 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1wgv h GLY 44 CO 0.42 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.54 1wgv n LYS 45 N -3.57 0.22 -0.02 4.80 2.85 -1.26 -2.00 118.16 119.18 1wgv n LYS 45 Ca -0.01 0.36 0.08 0.00 -1.05 0.00 0.00 58.31 57.70 1wgv n LYS 45 Cb 0.44 -1.85 0.45 0.00 -0.65 0.00 0.00 35.03 33.42 1wgv n LYS 45 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1wgv n GLN 46 N -2.25 1.13 -4.19 -1.58 6.02 -0.76 -4.81 117.38 110.93 1wgv n GLN 46 Ca 0.03 -0.20 -0.12 0.00 -0.01 0.00 0.00 57.00 56.70 1wgv n GLN 46 Cb 0.29 -1.27 -0.10 0.00 1.02 0.00 0.00 30.24 30.18 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 -1.96 0.03 -0.08 5.09 -7.23 -0.85 0.20 120.40 115.60 1wgv s VAL 47 Ca 0.25 -1.98 0.01 0.00 -1.81 0.00 0.00 61.98 58.45 1wgv s VAL 47 Cb 0.12 -2.41 0.02 0.00 0.56 0.00 0.00 36.38 34.66 1wgv s VAL 47 CO 0.20 -0.09 -0.10 -0.94 -0.31 0.00 0.00 175.10 173.85 1wgv s SER 48 N -3.14 1.90 -0.07 4.85 1.04 0.23 -4.93 113.70 113.58 1wgv s SER 48 Ca 0.36 -0.30 0.03 0.00 0.48 0.00 0.00 55.95 56.53 1wgv s SER 48 Cb 0.07 -0.82 0.01 0.00 0.10 0.00 0.00 66.02 65.37 1wgv s SER 48 CO 0.10 -0.03 -0.16 -0.69 0.98 0.00 0.00 173.24 173.44 1wgv s VAL 49 N 1.06 1.41 -0.21 5.02 1.01 -1.25 -2.63 120.40 124.81 1wgv s VAL 49 Ca -0.07 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1wgv s VAL 49 Cb -0.15 -1.25 0.06 0.00 0.00 0.00 0.00 36.38 35.04 1wgv s VAL 49 CO -0.01 0.41 -0.02 0.00 0.00 0.00 0.00 175.10 175.48 1wgv s ALA 50 N 0.41 1.57 -0.16 5.51 0.00 -1.21 -4.97 121.76 122.91 1wgv s ALA 50 Ca -0.12 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 1wgv s ALA 50 Cb -0.15 -1.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.65 1wgv s ALA 50 CO 0.04 -1.12 -0.08 -0.51 0.00 0.00 0.00 175.76 174.10 1wgv s LEU 51 N 1.59 2.96 0.22 0.00 1.43 -1.26 -3.73 118.68 119.89 1wgv s LEU 51 Ca -0.03 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 1wgv s LEU 51 Cb -0.18 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1wgv s LEU 51 CO -0.07 0.13 0.00 -1.20 0.23 0.00 0.00 176.35 175.44 1wgv n SER 52 N 3.76 0.27 0.00 2.29 7.64 -1.26 -5.04 113.62 121.28 1wgv n SER 52 Ca -0.18 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.07 1wgv n SER 52 Cb 0.52 0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.88 1wgv n SER 52 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wgv n SER 53 N -3.48 0.00 -2.23 6.43 2.88 -1.26 -4.61 113.62 111.34 1wgv n SER 53 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 1wgv n SER 53 Cb 0.00 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.51 1wgv n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1wgv n SER 54 N 0.00 2.90 -3.67 -3.46 2.88 -1.26 0.94 113.62 111.94 1wgv n SER 54 Ca 0.00 -2.86 -0.13 0.00 -1.33 0.00 0.00 58.87 54.54 1wgv n SER 54 Cb 0.00 -0.41 -0.07 0.00 -0.75 0.00 0.00 64.21 62.98 1wgv n SER 54 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wgv s SER 55 N -3.54 -0.30 -0.10 -3.46 1.04 -1.26 0.22 113.70 106.31 1wgv s SER 55 Ca 0.38 0.09 -0.13 0.00 0.48 0.00 0.00 55.95 56.77 1wgv s SER 55 Cb 0.37 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.93 1wgv s SER 55 CO -0.02 -0.60 0.34 -0.51 0.98 0.00 0.00 173.24 173.43 1wgv s ILE 56 N -2.06 0.02 -0.09 -1.02 -1.16 -1.11 -4.21 121.20 111.57 1wgv s ILE 56 Ca -0.08 -0.13 -0.03 0.00 -0.51 0.00 0.00 60.65 59.90 1wgv s ILE 56 Cb -0.02 -0.53 0.05 0.00 0.61 0.00 0.00 42.46 42.57 1wgv s ILE 56 CO 0.01 -0.07 0.17 -0.60 -2.81 0.00 0.00 174.94 171.64 1wgv s ARG 57 N -0.24 0.07 -0.34 3.50 3.52 -1.24 -1.86 118.95 122.34 1wgv s ARG 57 Ca -0.04 0.54 -0.00 0.00 -0.13 0.00 0.00 55.73 56.09 1wgv s ARG 57 Cb -0.03 -0.22 0.11 0.00 -1.56 0.00 0.00 34.95 33.25 1wgv s ARG 57 CO 0.02 -0.26 0.14 0.08 -0.81 0.00 0.00 175.30 174.46 1wgv s VAL 58 N 1.99 0.90 -0.08 7.11 1.01 0.51 -3.28 120.40 128.55 1wgv s VAL 58 Ca -0.01 -1.66 0.03 0.00 0.00 0.00 0.00 61.98 60.35 1wgv s VAL 58 Cb -0.12 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.60 1wgv s VAL 58 CO -0.06 -0.75 -0.18 0.00 0.00 0.00 0.00 175.10 174.10 1wgv s ALA 59 N 1.31 1.73 -0.04 5.51 0.00 -1.08 0.42 121.76 129.61 1wgv s ALA 59 Ca 0.12 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 1wgv s ALA 59 Cb -0.19 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 1wgv s ALA 59 CO -0.18 0.19 0.09 0.00 0.00 0.00 0.00 175.76 175.87 1wgv s MET 60 N 0.52 3.18 0.29 0.00 0.23 0.23 0.77 119.30 124.52 1wgv s MET 60 Ca -0.16 -0.37 -0.29 0.00 -1.03 0.00 0.00 55.69 53.83 1wgv s MET 60 Cb -0.17 -2.95 -0.10 0.00 -1.53 0.00 0.00 34.83 30.08 1wgv s MET 60 CO 0.06 0.69 1.18 -0.51 -2.03 0.00 0.00 175.02 174.41 1wgv s LEU 61 N -1.47 4.50 0.00 0.18 1.43 0.52 0.59 118.68 124.42 1wgv s LEU 61 Ca 0.20 2.41 0.02 0.00 -1.03 0.00 0.00 54.13 55.73 1wgv s LEU 61 Cb -0.12 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.49 1wgv s LEU 61 CO 0.11 -0.29 0.19 -0.62 0.23 0.00 0.00 176.35 175.96 1wgv n GLU 62 N 1.18 1.07 -0.09 1.70 -0.58 0.55 -4.83 120.64 119.64 1wgv n GLU 62 Ca -0.00 -1.08 -0.10 0.00 -0.42 0.00 0.00 57.16 55.56 1wgv n GLU 62 Cb 0.44 0.04 0.05 0.00 -0.57 0.00 0.00 31.44 31.39 1wgv n GLU 62 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1wgv h GLU 63 N 0.00 0.81 -1.58 3.49 5.08 -1.98 -3.32 114.58 117.08 1wgv h GLU 63 Ca -0.10 -0.38 -0.46 0.00 -1.00 0.00 0.00 59.36 57.42 1wgv h GLU 63 Cb 0.41 -0.01 -0.41 0.00 0.50 0.00 0.00 28.75 29.24 1wgv h GLU 63 CO 0.16 1.01 -1.06 -1.71 -1.00 0.00 0.00 179.01 176.40 1wgv n ASN 64 N -4.08 2.08 0.00 1.42 5.15 -1.26 -5.07 115.26 113.50 1wgv n ASN 64 Ca -0.01 -3.08 0.00 0.00 -0.60 0.00 0.00 54.58 50.89 1wgv n ASN 64 Cb 0.49 -0.55 0.00 0.00 -0.53 0.00 0.00 39.78 39.18 1wgv n ASN 64 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wgv n GLY 65 N -0.03 0.40 3.62 8.20 0.00 -1.25 -5.13 105.19 111.00 1wgv n GLY 65 Ca 0.22 -1.24 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 1wgv n GLY 65 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wgv s GLU 66 N -2.00 1.56 0.00 1.61 1.03 -1.26 0.21 118.70 119.85 1wgv s GLU 66 Ca 0.00 -1.19 0.00 0.00 0.03 0.00 0.00 54.97 53.82 1wgv s GLU 66 Cb 0.00 0.49 -0.00 0.00 -0.80 0.00 0.00 34.13 33.82 1wgv s GLU 66 CO 0.00 -0.66 -0.02 0.50 -1.33 0.00 0.00 175.26 173.75 1wgv s ARG 67 N -3.99 0.13 -0.68 -4.83 3.52 0.20 -4.75 118.95 108.54 1wgv s ARG 67 Ca 0.20 -0.11 -0.18 0.00 -0.13 0.00 0.00 55.73 55.50 1wgv s ARG 67 Cb -0.01 -0.08 0.12 0.00 -1.56 0.00 0.00 34.95 33.42 1wgv s ARG 67 CO 0.08 0.02 0.79 0.08 -0.81 0.00 0.00 175.30 175.45 1wgv s VAL 68 N -0.20 4.90 0.04 7.11 1.01 -1.26 0.78 120.40 132.78 1wgv s VAL 68 Ca -0.01 -1.27 -0.25 0.00 0.00 0.00 0.00 61.98 60.45 1wgv s VAL 68 Cb -0.02 -4.54 -0.17 0.00 0.00 0.00 0.00 36.38 31.65 1wgv s VAL 68 CO -0.00 -1.19 1.52 -0.07 0.00 0.00 0.00 175.10 175.37 1wgv h LEU 69 N 9.79 -0.07 -7.81 3.92 3.38 -0.39 -3.45 115.31 120.68 1wgv h LEU 69 Ca -0.17 -0.19 -0.19 0.00 0.09 0.00 0.00 57.88 57.43 1wgv h LEU 69 Cb 1.07 0.02 -0.24 0.00 0.09 0.00 0.00 40.66 41.60 1wgv h LEU 69 CO 1.06 0.15 -0.65 -0.32 0.09 0.00 0.00 178.44 178.77 1wgv s MET 70 N -5.37 0.23 -0.27 1.13 0.00 -0.14 -4.72 119.30 110.16 1wgv s MET 70 Ca -0.14 -0.28 -0.30 0.00 0.00 0.00 0.00 55.69 54.96 1wgv s MET 70 Cb 0.04 0.09 0.18 0.00 0.00 0.00 0.00 34.83 35.14 1wgv s MET 70 CO 0.65 -0.04 1.31 -2.00 0.00 0.00 0.00 175.02 174.94 1wgv s GLU 71 N -0.79 0.13 0.00 4.11 -6.30 -1.26 0.19 118.70 114.78 1wgv s GLU 71 Ca -0.09 0.02 0.00 0.00 -2.50 0.00 0.00 54.97 52.40 1wgv s GLU 71 Cb -0.05 0.06 0.00 0.00 0.00 0.00 0.00 34.13 34.14 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 0.47 4.31 3.63 -1.50 0.00 -0.78 -5.00 105.19 106.32 1wgv n GLY 72 Ca -0.01 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 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 -3.26 3.80 1.13 1.61 3.01 -1.26 -2.76 119.74 122.00 1wgv s LYS 73 Ca 0.00 1.74 -0.17 0.00 -1.01 0.00 0.00 55.97 56.53 1wgv s LYS 73 Cb 0.00 -4.05 0.17 0.00 -1.01 0.00 0.00 37.83 32.94 1wgv s LYS 73 CO 0.00 -1.29 0.25 1.28 0.51 0.00 0.00 175.35 176.10 1wgv n LEU 74 N 8.48 -1.76 -0.04 3.17 4.77 0.13 -3.70 117.00 128.07 1wgv n LEU 74 Ca 0.19 -0.31 -0.18 0.00 -0.03 0.00 0.00 56.01 55.68 1wgv n LEU 74 Cb 0.45 -0.90 -0.14 0.00 -2.33 0.00 0.00 43.42 40.50 1wgv n LEU 74 CO 0.65 -3.32 -0.91 0.35 -1.33 0.00 0.00 177.39 172.83 1wgv n THR 75 N -4.62 1.67 -4.66 -5.08 -2.24 -1.18 -4.72 114.28 93.45 1wgv n THR 75 Ca 0.04 -0.67 -0.30 0.00 -2.27 0.00 0.00 64.05 60.84 1wgv n THR 75 Cb 0.52 -1.47 -0.09 0.00 -2.10 0.00 0.00 70.33 67.20 1wgv n THR 75 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1wgv s HIS 76 N -2.55 2.17 0.38 4.78 3.76 -1.26 -5.10 115.29 117.47 1wgv s HIS 76 Ca -0.21 -0.82 -0.02 0.00 -0.15 0.00 0.00 55.06 53.86 1wgv s HIS 76 Cb 0.07 -1.70 -0.04 0.00 1.11 0.00 0.00 32.58 32.02 1wgv s HIS 76 CO 0.75 0.31 0.62 0.15 -0.85 0.00 0.00 174.74 175.72 1wgv s LYS 77 N -3.81 3.53 0.04 1.40 1.02 -1.26 -4.21 119.74 116.46 1wgv s LYS 77 Ca 0.20 -0.12 -0.01 0.00 0.02 0.00 0.00 55.97 56.07 1wgv s LYS 77 Cb 0.05 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 1wgv s LYS 77 CO 0.11 0.05 -0.03 0.96 -0.92 0.00 0.00 175.35 175.51 1wgv s ILE 78 N -2.41 0.21 -1.18 2.17 -5.25 0.27 -4.20 121.20 110.81 1wgv s ILE 78 Ca 0.43 -1.57 -0.15 0.00 -0.99 0.00 0.00 60.65 58.37 1wgv s ILE 78 Cb -0.10 -1.18 0.15 0.00 2.95 0.00 0.00 42.46 44.28 1wgv s ILE 78 CO 0.38 -0.85 1.43 0.21 -1.79 0.00 0.00 174.94 174.32 1wgv s ASN 79 N -2.52 6.99 0.38 4.36 3.84 -1.00 -4.46 114.94 122.53 1wgv s ASN 79 Ca 0.01 -2.81 0.23 0.00 0.21 0.00 0.00 52.86 50.50 1wgv s ASN 79 Cb 0.03 -2.42 1.36 0.00 -0.55 0.00 0.00 41.25 39.67 1wgv s ASN 79 CO -0.07 -0.84 1.59 0.71 -2.79 0.00 0.00 177.10 175.69 1wgv h THR 80 N 4.93 0.02 0.07 -5.21 1.35 -1.89 0.57 112.91 112.75 1wgv h THR 80 Ca 0.31 -0.01 0.02 0.00 -0.55 0.00 0.00 66.41 66.19 1wgv h THR 80 Cb 0.89 -0.00 -0.05 0.00 -1.73 0.00 0.00 68.15 67.26 1wgv h THR 80 CO 1.26 0.00 -0.44 -0.08 -0.25 0.00 0.00 175.52 176.01 1wgv h GLU 81 N 0.02 -0.62 0.00 4.72 4.81 -1.94 -1.25 114.58 120.32 1wgv h GLU 81 Ca 0.85 0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 60.03 1wgv h GLU 81 Cb 2.32 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.83 1wgv h GLU 81 CO -0.70 -0.41 -0.45 0.77 -0.73 0.00 0.00 179.01 177.49 1wgv h SER 82 N -0.64 0.00 -4.13 1.04 0.02 -0.46 -3.44 113.55 105.94 1wgv h SER 82 Ca 0.03 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.48 1wgv h SER 82 Cb 0.68 0.00 0.16 0.00 0.14 0.00 0.00 62.40 63.38 1wgv h SER 82 CO -0.28 0.45 0.24 -0.44 -1.14 0.00 0.00 176.83 175.66 1wgv s SER 83 N -6.89 3.45 0.36 3.07 0.01 0.95 -4.81 113.70 109.83 1wgv s SER 83 Ca -0.02 1.78 -0.06 0.00 1.31 0.00 0.00 55.95 58.95 1wgv s SER 83 Cb 0.14 -2.40 0.02 0.00 0.21 0.00 0.00 66.02 63.99 1wgv s SER 83 CO 0.74 -2.69 0.57 -1.48 0.41 0.00 0.00 173.24 170.78 1wgv s LEU 84 N -6.31 0.71 -0.29 2.44 0.05 -0.89 -4.89 118.68 109.50 1wgv s LEU 84 Ca 0.64 -1.39 -0.14 0.00 0.05 0.00 0.00 54.13 53.29 1wgv s LEU 84 Cb -0.19 1.89 0.13 0.00 -2.05 0.00 0.00 46.19 45.96 1wgv s LEU 84 CO 0.58 -1.42 0.83 -1.66 -0.55 0.00 0.00 176.35 174.13 1wgv s TRP 85 N -2.82 -0.90 0.22 3.48 1.48 -1.26 -2.39 118.94 116.76 1wgv s TRP 85 Ca 0.26 1.68 0.06 0.00 -1.06 0.00 0.00 56.10 57.03 1wgv s TRP 85 Cb -0.02 0.54 -0.05 0.00 -1.16 0.00 0.00 33.47 32.78 1wgv s TRP 85 CO 0.18 -0.45 -0.08 -1.12 -4.06 0.00 0.00 176.95 171.42 1wgv s SER 86 N 2.01 2.35 0.05 -2.66 0.01 0.39 -5.00 113.70 110.85 1wgv s SER 86 Ca -0.07 -1.12 0.09 0.00 1.31 0.00 0.00 55.95 56.16 1wgv s SER 86 Cb -0.06 -0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.04 1wgv s SER 86 CO -0.18 -0.32 -0.25 -0.22 0.41 0.00 0.00 173.24 172.68 1wgv s LEU 87 N -3.33 2.25 -0.04 2.44 1.98 -1.26 -1.91 118.68 118.82 1wgv s LEU 87 Ca 0.25 -0.58 0.04 0.00 -2.89 0.00 0.00 54.13 50.95 1wgv s LEU 87 Cb 0.03 -1.32 -0.00 0.00 0.66 0.00 0.00 46.19 45.55 1wgv s LEU 87 CO 0.08 0.25 -0.15 -1.61 -1.89 0.00 0.00 176.35 173.03 1wgv s GLU 88 N -1.34 1.58 -0.19 1.98 0.41 -1.12 -4.93 118.70 115.09 1wgv s GLU 88 Ca 0.12 -0.55 -0.29 0.00 -0.41 0.00 0.00 54.97 53.85 1wgv s GLU 88 Cb -0.10 -1.40 -0.01 0.00 -1.78 0.00 0.00 34.13 30.84 1wgv s GLU 88 CO 0.03 0.23 1.29 -1.25 -0.49 0.00 0.00 175.26 175.07 1wgv s PRO 89 N 0.03 4.15 -1.24 0.39 0.04 -1.26 -3.48 135.00 133.64 1wgv s PRO 89 Ca -0.03 1.58 -0.02 0.00 0.04 0.00 0.00 61.00 62.57 1wgv s PRO 89 Cb -0.10 -3.81 -0.01 0.00 0.04 0.00 0.00 34.50 30.62 1wgv s PRO 89 CO 0.02 -0.82 0.82 0.41 0.04 0.00 0.00 177.00 177.46 1wgv n GLY 90 N 3.82 -0.45 0.00 0.56 0.00 -0.62 -4.89 105.19 103.61 1wgv n GLY 90 Ca 0.14 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1wgv n GLY 90 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wgv n LYS 91 N -4.11 0.00 -3.83 1.61 4.81 -1.23 -4.96 118.16 110.45 1wgv n LYS 91 Ca -0.26 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.12 1wgv n LYS 91 Cb 0.66 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.72 1wgv n LYS 91 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1wgv s VAL 93 N -2.74 4.99 -0.18 0.00 1.01 0.43 -2.78 120.40 121.14 1wgv s VAL 93 Ca 0.16 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 62.04 1wgv s VAL 93 Cb -0.04 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 1wgv s VAL 93 CO 0.07 0.47 0.27 -0.22 0.00 0.00 0.00 175.10 175.68 1wgv s LEU 94 N 0.27 4.22 -0.01 3.92 1.98 -0.80 -1.75 118.68 126.51 1wgv s LEU 94 Ca 0.05 0.43 0.01 0.00 -2.89 0.00 0.00 54.13 51.73 1wgv s LEU 94 Cb -0.12 -2.32 0.01 0.00 0.66 0.00 0.00 46.19 44.42 1wgv s LEU 94 CO -0.00 0.09 -0.02 -0.69 -1.89 0.00 0.00 176.35 173.84 1wgv s VAL 95 N 0.56 0.20 -0.21 1.68 1.01 -1.17 -0.47 120.40 122.01 1wgv s VAL 95 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.08 1wgv s VAL 95 Cb -0.13 -0.21 0.05 0.00 0.00 0.00 0.00 36.38 36.09 1wgv s VAL 95 CO 0.03 0.09 -0.06 0.20 0.00 0.00 0.00 175.10 175.36 1wgv s ASN 96 N 0.30 3.45 -0.29 3.32 0.01 -1.00 -2.97 114.94 117.76 1wgv s ASN 96 Ca -0.03 -0.97 -0.18 0.00 -0.71 0.00 0.00 52.86 50.97 1wgv s ASN 96 Cb -0.05 -1.09 -0.02 0.00 0.41 0.00 0.00 41.25 40.50 1wgv s ASN 96 CO -0.01 -0.21 0.53 -0.76 -1.51 0.00 0.00 177.10 175.14 1wgv s LEU 97 N 1.48 4.13 0.28 0.60 1.43 -1.17 -2.09 118.68 123.34 1wgv s LEU 97 Ca -0.03 0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 53.14 1wgv s LEU 97 Cb -0.17 -2.66 -0.10 0.00 0.03 0.00 0.00 46.19 43.29 1wgv s LEU 97 CO -0.07 -0.36 1.22 -0.55 0.23 0.00 0.00 176.35 176.82 1wgv s SER 98 N 1.62 7.00 0.27 2.29 0.15 -1.26 -2.46 113.70 121.31 1wgv s SER 98 Ca 0.21 2.46 -0.20 0.00 0.70 0.00 0.00 55.95 59.11 1wgv s SER 98 Cb -0.15 -2.63 -0.09 0.00 -1.71 0.00 0.00 66.02 61.44 1wgv s SER 98 CO 0.11 -0.37 0.78 -0.54 1.20 0.00 0.00 173.24 174.42 1wgv s LYS 99 N -1.31 4.29 0.02 5.44 -0.14 -1.26 -2.37 119.74 124.41 1wgv s LYS 99 Ca 0.49 0.95 0.04 0.00 -1.36 0.00 0.00 55.97 56.09 1wgv s LYS 99 Cb -0.36 -2.77 -0.02 0.00 -1.68 0.00 0.00 37.83 33.01 1wgv s LYS 99 CO 0.45 0.32 -0.11 0.14 -0.76 0.00 0.00 175.35 175.39 1wgv s VAL 100 N -1.64 0.85 0.00 3.17 -7.23 -1.26 -4.62 120.40 109.67 1wgv s VAL 100 Ca 0.47 -0.76 0.00 0.00 -1.81 0.00 0.00 61.98 59.88 1wgv s VAL 100 Cb -0.16 -0.77 0.00 0.00 0.56 0.00 0.00 36.38 36.01 1wgv s VAL 100 CO 0.21 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.63 1wgv n GLY 101 N 2.22 1.23 3.56 2.32 0.00 -1.26 -3.63 105.19 109.64 1wgv n GLY 101 Ca -0.17 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 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 0.00 2.75 -0.77 1.61 2.02 -1.26 -4.89 118.70 118.17 1wgv s GLU 102 Ca 0.00 0.87 -0.25 0.00 0.02 0.00 0.00 54.97 55.60 1wgv s GLU 102 Cb 0.00 -4.36 -0.06 0.00 0.10 0.00 0.00 34.13 29.81 1wgv s GLU 102 CO 0.00 -2.57 2.06 0.71 0.02 0.00 0.00 175.26 175.48 1wgv s TYR 103 N 8.80 1.57 -0.51 1.61 2.02 -1.24 -4.87 117.35 124.73 1wgv s TYR 103 Ca 0.72 1.02 0.01 0.00 -0.37 0.00 0.00 57.07 58.46 1wgv s TYR 103 Cb -0.15 -3.89 0.13 0.00 -0.40 0.00 0.00 41.96 37.65 1wgv s TYR 103 CO 0.24 -1.92 0.28 -0.46 -1.57 0.00 0.00 175.55 172.12 1wgv s TRP 104 N 10.96 3.38 -0.16 2.71 -0.11 -1.26 -5.05 118.94 129.41 1wgv s TRP 104 Ca 0.76 -2.94 0.01 0.00 1.22 0.00 0.00 56.10 55.15 1wgv s TRP 104 Cb -0.10 -2.99 0.02 0.00 -1.50 0.00 0.00 33.47 28.90 1wgv s TRP 104 CO 0.09 -0.83 -0.15 -1.58 -4.62 0.00 0.00 176.95 169.86 1wgv s TRP 105 N 0.10 2.32 0.00 5.86 0.52 -1.26 -4.64 118.94 121.84 1wgv s TRP 105 Ca 0.15 -1.34 0.00 0.00 0.02 0.00 0.00 56.10 54.93 1wgv s TRP 105 Cb -0.23 -1.67 0.00 0.00 -1.15 0.00 0.00 33.47 30.42 1wgv s TRP 105 CO -0.03 -0.71 0.62 0.09 0.02 0.00 0.00 176.95 176.94 1wgv n ASN 106 N 4.73 1.00 0.00 2.95 3.02 -1.26 -4.96 115.26 120.74 1wgv n ASN 106 Ca -0.18 -1.38 0.00 0.00 -0.03 0.00 0.00 54.58 52.99 1wgv n ASN 106 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 1wgv n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wgv n ALA 107 N -0.19 0.00 -0.31 5.41 0.00 -1.26 -1.34 120.51 122.82 1wgv n ALA 107 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1wgv n ALA 107 Cb 0.25 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.81 1wgv n ALA 107 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1wgv n ILE 108 N 0.00 -0.36 -4.31 0.00 2.08 -1.26 -4.27 119.36 111.23 1wgv n ILE 108 Ca 0.00 1.96 -0.28 0.00 0.56 0.00 0.00 62.75 64.99 1wgv n ILE 108 Cb 0.00 -2.70 -0.10 0.00 -0.75 0.00 0.00 39.64 36.08 1wgv n ILE 108 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1wgv s LEU 109 N -10.77 2.79 0.35 1.39 1.43 -1.26 -3.08 118.68 109.53 1wgv s LEU 109 Ca -0.13 -0.60 0.24 0.00 -1.03 0.00 0.00 54.13 52.60 1wgv s LEU 109 Cb 0.23 -1.55 1.28 0.00 0.03 0.00 0.00 46.19 46.18 1wgv s LEU 109 CO 0.66 0.14 1.72 -0.33 0.23 0.00 0.00 176.35 178.78 1wgv h GLU 110 N 3.30 0.00 -1.91 1.70 5.08 -1.74 -2.28 114.58 118.73 1wgv h GLU 110 Ca -0.48 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.15 1wgv h GLU 110 Cb 1.19 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.14 1wgv h GLU 110 CO 0.50 0.00 0.67 0.41 -1.00 0.00 0.00 179.01 179.59 1wgv n GLY 111 N -1.25 5.64 3.04 -3.84 0.00 -1.26 -4.92 105.19 102.61 1wgv n GLY 111 Ca -0.02 -2.55 -0.13 0.00 0.00 0.00 0.00 46.02 43.33 1wgv n GLY 111 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wgv s GLU 112 N -3.97 0.19 0.45 1.61 2.12 -0.86 -5.10 118.70 113.15 1wgv s GLU 112 Ca 0.51 0.56 -0.20 0.00 0.36 0.00 0.00 54.97 56.19 1wgv s GLU 112 Cb 0.42 -0.11 -0.14 0.00 0.26 0.00 0.00 34.13 34.56 1wgv s GLU 112 CO -0.36 -0.18 0.19 0.39 -0.54 0.00 0.00 175.26 174.75 1wgv n GLU 113 N 4.40 0.18 -2.33 4.30 1.02 -1.26 -4.70 120.64 122.25 1wgv n GLU 113 Ca -0.23 0.07 -0.42 0.00 -0.02 0.00 0.00 57.16 56.57 1wgv n GLU 113 Cb 0.52 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 30.72 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 -1.26 3.30 1.01 3.49 0.04 -1.26 -4.60 135.00 135.72 1wgv s PRO 114 Ca 0.61 0.62 -0.16 0.00 0.04 0.00 0.00 61.00 62.12 1wgv s PRO 114 Cb -0.57 -4.13 0.10 0.00 0.04 0.00 0.00 34.50 29.94 1wgv s PRO 114 CO 0.61 -1.92 0.02 0.44 0.04 0.00 0.00 177.00 176.19 1wgv n ILE 115 N 6.97 0.00 -0.04 0.56 -5.35 -0.45 -4.98 119.36 116.06 1wgv n ILE 115 Ca 0.14 -0.10 -0.08 0.00 -0.27 0.00 0.00 62.75 62.44 1wgv n ILE 115 Cb 0.49 -0.44 -0.03 0.00 -1.74 0.00 0.00 39.64 37.92 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 -0.61 1.15 -4.65 7.28 -0.08 -1.26 -5.02 116.55 113.36 1wgv n ASP 116 Ca 0.03 0.08 -0.44 0.00 -1.51 0.00 0.00 54.79 52.95 1wgv n ASP 116 Cb 0.44 -0.23 -0.02 0.00 2.34 0.00 0.00 41.12 43.66 1wgv n ASP 116 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1wgv n ILE 117 N -3.25 1.63 -2.76 5.18 2.08 -1.26 -3.79 119.36 117.18 1wgv n ILE 117 Ca -0.16 -0.41 -0.00 0.00 0.56 0.00 0.00 62.75 62.74 1wgv n ILE 117 Cb 0.63 -1.34 0.00 0.00 -0.75 0.00 0.00 39.64 38.18 1wgv n ILE 117 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1wgv n ASP 118 N 1.36 -7.94 -3.66 4.38 2.03 -1.26 -5.02 116.55 106.45 1wgv n ASP 118 Ca 0.09 1.33 -0.06 0.00 0.52 0.00 0.00 54.79 56.67 1wgv n ASP 118 Cb 0.33 -5.05 -0.08 0.00 -0.72 0.00 0.00 41.12 35.60 1wgv n ASP 118 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1wgv s SER 119 N -1.62 -0.67 0.65 1.67 0.15 -1.25 -4.93 113.70 107.71 1wgv s SER 119 Ca 0.01 1.23 -0.08 0.00 0.70 0.00 0.00 55.95 57.81 1wgv s SER 119 Cb -0.00 1.57 0.02 0.00 -1.71 0.00 0.00 66.02 65.90 1wgv s SER 119 CO 0.72 -0.22 0.99 -0.83 1.20 0.00 0.00 173.24 175.10 1wgv s GLY 120 N 2.39 1.62 -1.14 9.45 0.00 -1.26 -4.94 107.32 113.44 1wgv s GLY 120 Ca -0.05 -0.63 -0.19 0.00 0.00 0.00 0.00 44.72 43.85 1wgv s GLY 120 CO -0.16 -0.29 2.01 -1.55 0.00 0.00 0.00 173.10 173.11 1wgv n PRO 121 N -2.79 2.22 -3.61 2.90 -0.04 -1.26 -4.76 135.00 127.66 1wgv n PRO 121 Ca 0.06 -2.38 -0.05 0.00 -0.04 0.00 0.00 63.50 61.09 1wgv n PRO 121 Cb 0.58 -3.23 -0.04 0.00 -0.04 0.00 0.00 33.50 30.77 1wgv n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wgv s SER 122 N 4.44 -0.17 -0.18 3.54 0.15 -1.26 -5.08 113.70 115.13 1wgv s SER 122 Ca 0.55 0.15 -0.15 0.00 0.70 0.00 0.00 55.95 57.20 1wgv s SER 122 Cb 0.11 0.15 -0.07 0.00 -1.71 0.00 0.00 66.02 64.51 1wgv s SER 122 CO 0.04 -0.19 -0.25 -1.20 1.20 0.00 0.00 173.24 172.84 1wgv n SER 123 N 0.43 1.89 0.00 5.45 7.64 -1.26 -5.14 113.62 122.63 1wgv n SER 123 Ca -0.03 0.45 0.00 0.00 1.01 0.00 0.00 58.87 60.29 1wgv n SER 123 Cb 0.58 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 1wgv n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64