#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 -7.17 -3.28 1.61 7.64 -1.26 -4.93 113.62 106.23 1wgv n SER 2 Ca 0.00 1.04 -0.22 0.00 1.01 0.00 0.00 58.87 60.70 1wgv n SER 2 Cb 0.00 -4.12 0.02 0.00 -1.01 0.00 0.00 64.21 59.10 1wgv n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1wgv n SER 3 N -4.04 -6.28 0.00 6.43 3.41 -1.26 -4.98 113.62 106.89 1wgv n SER 3 Ca -0.05 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1wgv n SER 3 Cb 0.58 -2.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.14 1wgv n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wgv n GLY 4 N 0.25 0.07 3.11 5.00 0.00 -1.26 -5.08 105.19 107.27 1wgv n GLY 4 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.38 -6.85 -3.61 1.61 7.64 -1.26 -5.01 113.62 104.75 1wgv n SER 5 Ca 0.00 0.54 -0.18 0.00 1.01 0.00 0.00 58.87 60.23 1wgv n SER 5 Cb 0.00 -2.99 -0.15 0.00 -1.01 0.00 0.00 64.21 60.06 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 -1.47 1.08 0.45 6.43 0.15 -1.26 -5.15 113.70 113.92 1wgv s SER 6 Ca 0.12 0.09 0.03 0.00 0.70 0.00 0.00 55.95 56.89 1wgv s SER 6 Cb -0.02 0.27 -0.02 0.00 -1.71 0.00 0.00 66.02 64.54 1wgv s SER 6 CO 0.49 -0.28 0.09 -0.83 1.20 0.00 0.00 173.24 173.91 1wgv s GLY 7 N 2.29 2.78 0.30 9.45 0.00 -1.26 -5.12 107.32 115.77 1wgv s GLY 7 Ca 0.04 -0.91 -0.29 0.00 0.00 0.00 0.00 44.72 43.56 1wgv s GLY 7 CO -0.08 -1.96 1.38 1.62 0.00 0.00 0.00 173.10 174.06 1wgv s GLN 8 N -3.76 4.29 0.00 2.90 0.74 -1.26 -5.02 119.66 117.56 1wgv s GLN 8 Ca 0.17 2.29 -0.01 0.00 0.05 0.00 0.00 55.36 57.86 1wgv s GLN 8 Cb 0.02 -3.08 -0.00 0.00 1.10 0.00 0.00 33.01 31.05 1wgv s GLN 8 CO 0.11 -0.33 0.01 0.15 -0.55 0.00 0.00 175.29 174.67 1wgv s LYS 9 N -1.21 0.10 0.13 1.67 -0.14 -1.26 -5.16 119.74 113.87 1wgv s LYS 9 Ca 0.54 -0.15 0.11 0.00 -1.36 0.00 0.00 55.97 55.10 1wgv s LYS 9 Cb -0.41 0.04 -0.04 0.00 -1.68 0.00 0.00 37.83 35.74 1wgv s LYS 9 CO 0.50 -0.02 -0.26 0.54 -0.76 0.00 0.00 175.35 175.35 1wgv s ASN 10 N -0.40 3.39 -0.04 2.83 2.20 -1.26 -5.05 114.94 116.61 1wgv s ASN 10 Ca -0.04 -0.72 -0.24 0.00 -0.94 0.00 0.00 52.86 50.92 1wgv s ASN 10 Cb -0.03 -0.26 -0.23 0.00 -2.00 0.00 0.00 41.25 38.73 1wgv s ASN 10 CO -0.00 0.18 1.07 1.55 -2.94 0.00 0.00 177.10 176.96 1wgv h PRO 11 N 3.89 0.20 0.00 3.55 0.13 -2.02 -3.47 132.00 134.29 1wgv h PRO 11 Ca -0.51 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1wgv h PRO 11 Cb 1.17 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1wgv h PRO 11 CO 0.40 0.90 0.00 -3.47 -0.23 0.00 0.00 178.00 175.60 1wgv n ASP 12 N -4.50 0.00 0.07 1.44 -0.08 -1.26 -3.44 116.55 108.77 1wgv n ASP 12 Ca -0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 1wgv n ASP 12 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 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 3.31 0.42 -3.65 1.67 2.88 -1.26 -5.11 113.62 111.87 1wgv n SER 13 Ca 0.00 0.22 -0.07 0.00 -1.33 0.00 0.00 58.87 57.70 1wgv n SER 13 Cb 0.00 -0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.38 1wgv n SER 13 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1wgv s TYR 14 N -1.74 -1.06 -0.68 0.66 2.02 -1.22 -5.08 117.35 110.25 1wgv s TYR 14 Ca 0.00 2.06 -0.25 0.00 -0.37 0.00 0.00 57.07 58.51 1wgv s TYR 14 Cb 0.00 0.62 -0.13 0.00 -0.40 0.00 0.00 41.96 42.05 1wgv s TYR 14 CO 0.00 -0.53 2.43 0.09 -1.57 0.00 0.00 175.55 175.97 1wgv n ASN 15 N 4.51 1.71 0.00 2.29 3.02 -1.26 -3.66 115.26 121.87 1wgv n ASN 15 Ca -0.19 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1wgv n ASN 15 Cb 0.57 -1.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.25 1wgv n ASN 15 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wgv n GLY 16 N 6.32 -2.51 2.87 7.41 0.00 -1.26 -5.10 105.19 112.92 1wgv n GLY 16 Ca 0.45 0.81 -0.29 0.00 0.00 0.00 0.00 46.02 47.00 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 -1.00 1.54 -0.10 4.61 0.00 -1.24 -5.09 121.76 120.47 1wgv s ALA 17 Ca 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 1wgv s ALA 17 Cb 0.00 -1.26 0.05 0.00 0.00 0.00 0.00 23.12 21.91 1wgv s ALA 17 CO 0.00 -1.06 0.12 0.08 0.00 0.00 0.00 175.76 174.90 1wgv s VAL 18 N 1.60 -0.19 0.46 0.00 1.01 -1.26 -4.16 120.40 117.86 1wgv s VAL 18 Ca -0.02 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.19 1wgv s VAL 18 Cb -0.17 -0.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 1wgv s VAL 18 CO -0.07 0.02 0.07 -0.13 0.00 0.00 0.00 175.10 174.99 1wgv s ARG 19 N 2.23 2.07 -1.16 2.72 3.00 -1.26 -5.06 118.95 121.48 1wgv s ARG 19 Ca 0.04 -2.29 -0.07 0.00 0.00 0.00 0.00 55.73 53.41 1wgv s ARG 19 Cb -0.13 -1.07 0.25 0.00 0.00 0.00 0.00 34.95 34.00 1wgv s ARG 19 CO -0.06 -0.42 1.59 -0.85 0.00 0.00 0.00 175.30 175.55 1wgv n GLU 20 N -1.09 4.07 0.09 3.54 0.28 -1.26 -4.26 120.64 122.01 1wgv n GLU 20 Ca -0.13 -4.16 0.00 0.00 -0.16 0.00 0.00 57.16 52.71 1wgv n GLU 20 Cb 0.66 -2.68 0.00 0.00 1.43 0.00 0.00 31.44 30.85 1wgv n GLU 20 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1wgv n ASN 21 N 2.51 -1.67 -3.64 -1.84 4.13 -1.26 -5.14 115.26 108.35 1wgv n ASN 21 Ca 0.31 0.65 -0.06 0.00 1.68 0.00 0.00 54.58 57.16 1wgv n ASN 21 Cb 0.35 1.84 -0.07 0.00 -1.54 0.00 0.00 39.78 40.36 1wgv n ASN 21 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 1wgv s TYR 22 N -1.96 -0.86 0.32 3.10 -0.85 -1.26 -4.70 117.35 111.14 1wgv s TYR 22 Ca 0.00 1.75 -0.11 0.00 -0.52 0.00 0.00 57.07 58.19 1wgv s TYR 22 Cb 0.00 0.50 -0.07 0.00 0.38 0.00 0.00 41.96 42.77 1wgv s TYR 22 CO 0.00 -0.42 0.67 0.99 -1.52 0.00 0.00 175.55 175.27 1wgv s THR 23 N 1.40 4.82 0.19 -3.49 2.01 -0.94 -4.55 115.64 115.09 1wgv s THR 23 Ca -0.08 0.61 -0.22 0.00 0.31 0.00 0.00 61.69 62.31 1wgv s THR 23 Cb -0.05 -3.66 0.05 0.00 0.01 0.00 0.00 72.50 68.86 1wgv s THR 23 CO -0.16 -0.27 0.61 -1.66 -0.69 0.00 0.00 174.62 172.45 1wgv s TRP 24 N -2.06 -0.42 0.08 4.92 1.48 -1.26 -0.53 118.94 121.15 1wgv s TRP 24 Ca 0.50 0.14 -0.10 0.00 -1.06 0.00 0.00 56.10 55.58 1wgv s TRP 24 Cb -0.11 0.57 0.00 0.00 -1.16 0.00 0.00 33.47 32.78 1wgv s TRP 24 CO 0.24 -0.94 0.21 -1.54 -4.06 0.00 0.00 176.95 170.86 1wgv s SER 25 N -2.80 0.07 -0.24 -2.66 1.04 -0.80 -4.57 113.70 103.74 1wgv s SER 25 Ca 0.04 -0.55 -0.06 0.00 0.48 0.00 0.00 55.95 55.87 1wgv s SER 25 Cb -0.02 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 1wgv s SER 25 CO -0.08 -0.69 0.02 0.00 0.98 0.00 0.00 173.24 173.47 1wgv s GLN 26 N -3.51 3.52 0.51 4.02 1.03 -1.26 -2.99 119.66 120.97 1wgv s GLN 26 Ca 0.02 -0.55 0.04 0.00 0.04 0.00 0.00 55.36 54.91 1wgv s GLN 26 Cb 0.03 -3.18 0.04 0.00 0.03 0.00 0.00 33.01 29.94 1wgv s GLN 26 CO -0.09 -0.20 0.36 -0.25 -2.54 0.00 0.00 175.29 172.57 1wgv n ASP 27 N 4.86 2.69 -0.17 12.60 9.92 -0.97 -5.03 116.55 140.45 1wgv n ASP 27 Ca -0.17 -2.78 -0.05 0.00 -0.53 0.00 0.00 54.79 51.26 1wgv n ASP 27 Cb 0.51 -0.01 -0.04 0.00 -0.64 0.00 0.00 41.12 40.94 1wgv n ASP 27 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1wgv n TYR 28 N -1.66 -0.18 -3.09 1.24 4.02 -1.26 -3.92 117.16 112.30 1wgv n TYR 28 Ca -0.03 0.52 -0.18 0.00 -0.01 0.00 0.00 57.90 58.19 1wgv n TYR 28 Cb 0.58 -0.50 -0.04 0.00 -0.02 0.00 0.00 39.34 39.36 1wgv n TYR 28 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1wgv n THR 29 N -3.93 -0.61 0.00 -0.72 5.66 -1.26 -5.09 114.28 108.33 1wgv n THR 29 Ca 0.01 -2.83 0.00 0.00 -3.05 0.00 0.00 64.05 58.18 1wgv n THR 29 Cb 0.11 -0.70 0.00 0.00 -1.55 0.00 0.00 70.33 68.19 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 2.17 0.00 -4.31 1.09 5.75 -1.25 -4.60 116.55 115.40 1wgv n ASP 30 Ca 0.21 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.65 1wgv n ASP 30 Cb 0.54 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.49 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 2.76 -0.30 -2.12 1.02 -1.12 -2.29 118.68 116.63 1wgv s LEU 31 Ca 0.00 -0.39 -0.05 0.00 0.02 0.00 0.00 54.13 53.71 1wgv s LEU 31 Cb 0.00 -1.67 0.03 0.00 0.02 0.00 0.00 46.19 44.57 1wgv s LEU 31 CO 0.00 0.05 0.05 -1.61 0.02 0.00 0.00 176.35 174.86 1wgv s GLU 32 N 1.05 2.78 -0.08 1.70 2.02 -1.16 -2.02 118.70 122.98 1wgv s GLU 32 Ca -0.00 -1.05 0.03 0.00 0.02 0.00 0.00 54.97 53.97 1wgv s GLU 32 Cb -0.15 -3.31 -0.01 0.00 0.10 0.00 0.00 34.13 30.76 1wgv s GLU 32 CO -0.01 -0.54 -0.18 0.54 0.02 0.00 0.00 175.26 175.08 1wgv s VAL 33 N 1.40 2.65 -0.08 2.63 0.11 -1.17 -1.91 120.40 124.02 1wgv s VAL 33 Ca -0.01 -0.84 0.05 0.00 -2.93 0.00 0.00 61.98 58.25 1wgv s VAL 33 Cb -0.18 -2.04 -0.01 0.00 -1.53 0.00 0.00 36.38 32.62 1wgv s VAL 33 CO 0.01 0.56 -0.23 -0.13 -3.33 0.00 0.00 175.10 171.98 1wgv s ARG 34 N -0.09 2.84 -0.14 1.54 0.52 0.31 -2.73 118.95 121.21 1wgv s ARG 34 Ca -0.04 -0.87 0.00 0.00 -0.52 0.00 0.00 55.73 54.31 1wgv s ARG 34 Cb -0.14 -2.27 -0.01 0.00 0.52 0.00 0.00 34.95 33.05 1wgv s ARG 34 CO 0.04 0.29 -0.15 0.08 0.02 0.00 0.00 175.30 175.58 1wgv s VAL 35 N 0.07 2.76 0.30 3.52 1.01 -0.44 -2.20 120.40 125.42 1wgv s VAL 35 Ca -0.10 -0.75 -0.28 0.00 0.00 0.00 0.00 61.98 60.84 1wgv s VAL 35 Cb -0.16 -2.15 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 1wgv s VAL 35 CO 0.06 0.52 1.07 -2.16 0.00 0.00 0.00 175.10 174.60 1wgv s PRO 36 N 0.60 4.55 0.21 2.72 0.04 -1.26 0.20 135.00 142.05 1wgv s PRO 36 Ca -0.09 1.71 0.09 0.00 0.04 0.00 0.00 61.00 62.75 1wgv s PRO 36 Cb -0.16 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 1wgv s PRO 36 CO 0.03 0.16 -0.16 0.14 0.04 0.00 0.00 177.00 177.21 1wgv s VAL 37 N -1.27 1.87 1.07 -0.36 -7.23 -1.01 -4.86 120.40 108.60 1wgv s VAL 37 Ca 0.47 -2.17 -0.17 0.00 -1.81 0.00 0.00 61.98 58.30 1wgv s VAL 37 Cb -0.29 -2.04 0.24 0.00 0.56 0.00 0.00 36.38 34.85 1wgv s VAL 37 CO 0.37 -0.50 1.22 -2.16 -0.31 0.00 0.00 175.10 173.72 1wgv s PRO 38 N -3.42 -0.18 -0.04 4.82 0.04 -1.26 -4.44 135.00 130.52 1wgv s PRO 38 Ca 0.22 -0.22 0.07 0.00 0.04 0.00 0.00 61.00 61.11 1wgv s PRO 38 Cb -0.03 -1.73 0.26 0.00 0.04 0.00 0.00 34.50 33.04 1wgv s PRO 38 CO 0.08 -3.00 1.07 1.63 0.04 0.00 0.00 177.00 176.83 1wgv n LYS 39 N -4.22 1.96 0.00 4.56 4.01 -1.26 -3.00 118.16 120.21 1wgv n LYS 39 Ca 0.14 -1.01 0.02 0.00 -0.51 0.00 0.00 58.31 56.95 1wgv n LYS 39 Cb 0.59 -1.46 0.00 0.00 -0.51 0.00 0.00 35.03 33.65 1wgv n LYS 39 CO 0.00 0.00 0.00 -2.39 -1.11 0.00 0.00 177.40 173.90 1wgv n HIS 40 N 0.24 0.00 -3.59 2.13 1.44 -1.26 -4.84 115.22 109.33 1wgv n HIS 40 Ca 0.09 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.40 1wgv n HIS 40 Cb 0.39 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.39 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 -0.81 4.66 0.00 0.61 1.01 -1.16 -4.83 120.40 119.88 1wgv s VAL 41 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.28 1wgv s VAL 41 Cb 0.04 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.87 1wgv s VAL 41 CO 0.11 -0.18 0.00 1.33 0.00 0.00 0.00 175.10 176.36 1wgv n VAL 42 N 5.01 0.00 -1.73 2.92 0.24 -1.26 -1.80 118.33 121.70 1wgv n VAL 42 Ca -0.12 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.87 1wgv n VAL 42 Cb 0.47 -0.38 0.05 0.00 -1.47 0.00 0.00 33.84 32.51 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 -1.62 2.93 0.16 7.34 1.02 -1.26 -4.27 119.74 124.05 1wgv s LYS 43 Ca 0.00 0.71 0.24 0.00 0.02 0.00 0.00 55.97 56.94 1wgv s LYS 43 Cb 0.00 -2.01 0.38 0.00 -0.52 0.00 0.00 37.83 35.68 1wgv s LYS 43 CO 0.00 -1.04 1.38 0.78 -0.92 0.00 0.00 175.35 175.55 1wgv h GLY 44 N -0.66 0.00 2.00 -3.33 0.00 -1.94 -3.22 103.07 95.91 1wgv h GLY 44 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1wgv h GLY 44 CO 0.61 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.73 1wgv n LYS 45 N -2.27 0.25 -0.02 4.80 2.85 -1.26 -2.60 118.16 119.92 1wgv n LYS 45 Ca 0.03 0.23 0.13 0.00 -1.05 0.00 0.00 58.31 57.65 1wgv n LYS 45 Cb 0.46 -1.81 0.61 0.00 -0.65 0.00 0.00 35.03 33.64 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 -2.26 1.33 -3.74 -1.58 6.02 -1.22 -4.71 117.38 111.23 1wgv n GLN 46 Ca 0.05 -0.48 -0.15 0.00 -0.01 0.00 0.00 57.00 56.41 1wgv n GLN 46 Cb 0.41 -1.42 -0.15 0.00 1.02 0.00 0.00 30.24 30.10 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 -1.95 -0.09 -0.21 5.09 -7.23 -1.07 0.19 120.40 115.13 1wgv s VAL 47 Ca 0.37 0.24 -0.10 0.00 -1.81 0.00 0.00 61.98 60.68 1wgv s VAL 47 Cb 0.18 -0.19 -0.05 0.00 0.56 0.00 0.00 36.38 36.89 1wgv s VAL 47 CO 0.30 0.10 0.13 -0.44 -0.31 0.00 0.00 175.10 174.88 1wgv s SER 48 N 1.40 6.10 -0.09 4.85 0.01 -0.12 -4.91 113.70 120.94 1wgv s SER 48 Ca -0.06 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.37 1wgv s SER 48 Cb -0.12 -2.08 0.02 0.00 0.21 0.00 0.00 66.02 64.05 1wgv s SER 48 CO -0.05 0.14 -0.07 -0.69 0.41 0.00 0.00 173.24 172.99 1wgv s VAL 49 N 0.58 0.90 -0.35 3.43 1.01 -1.26 -1.04 120.40 123.67 1wgv s VAL 49 Ca 0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 1wgv s VAL 49 Cb -0.12 -0.92 0.07 0.00 0.00 0.00 0.00 36.38 35.41 1wgv s VAL 49 CO 0.00 0.33 0.11 0.00 0.00 0.00 0.00 175.10 175.55 1wgv s ALA 50 N 1.47 3.02 -0.31 5.51 0.00 -1.05 -4.95 121.76 125.45 1wgv s ALA 50 Ca -0.00 -2.02 -0.22 0.00 0.00 0.00 0.00 51.96 49.72 1wgv s ALA 50 Cb -0.13 -2.23 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 1wgv s ALA 50 CO -0.05 -1.48 0.73 -0.51 0.00 0.00 0.00 175.76 174.45 1wgv s LEU 51 N 1.27 4.12 0.02 0.00 1.43 -1.26 -2.27 118.68 121.99 1wgv s LEU 51 Ca 0.00 0.54 0.06 0.00 -1.03 0.00 0.00 54.13 53.70 1wgv s LEU 51 Cb -0.21 -2.97 -0.02 0.00 0.03 0.00 0.00 46.19 43.02 1wgv s LEU 51 CO -0.01 -0.58 -0.17 -0.44 0.23 0.00 0.00 176.35 175.38 1wgv s SER 52 N 1.65 2.05 0.59 2.29 0.01 0.12 -5.00 113.70 115.41 1wgv s SER 52 Ca 0.29 -0.42 0.29 0.00 1.31 0.00 0.00 55.95 57.43 1wgv s SER 52 Cb -0.14 -0.18 1.45 0.00 0.21 0.00 0.00 66.02 67.36 1wgv s SER 52 CO 0.13 0.14 1.87 0.28 0.41 0.00 0.00 173.24 176.07 1wgv h SER 53 N 5.22 0.00 -0.76 2.44 0.02 -1.97 -2.61 113.55 115.90 1wgv h SER 53 Ca -0.39 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.24 1wgv h SER 53 Cb 1.16 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.41 1wgv h SER 53 CO 0.46 0.00 -0.84 -1.54 -1.14 0.00 0.00 176.83 173.77 1wgv n SER 54 N -3.71 -0.24 0.00 3.07 3.41 -1.26 0.19 113.62 115.07 1wgv n SER 54 Ca 0.10 -2.86 0.00 0.00 -0.26 0.00 0.00 58.87 55.85 1wgv n SER 54 Cb 0.73 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.96 1wgv n SER 54 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wgv n SER 55 N -0.08 0.00 -4.25 4.04 3.41 -0.98 -3.35 113.62 112.41 1wgv n SER 55 Ca 0.08 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.51 1wgv n SER 55 Cb 0.78 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.62 1wgv n SER 55 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1wgv s ILE 56 N -0.47 1.38 -0.05 -1.33 -1.16 -1.00 0.15 121.20 118.73 1wgv s ILE 56 Ca 0.00 -1.73 -0.04 0.00 -0.51 0.00 0.00 60.65 58.36 1wgv s ILE 56 Cb 0.00 -1.56 0.01 0.00 0.61 0.00 0.00 42.46 41.52 1wgv s ILE 56 CO 0.00 -0.40 0.13 -0.60 -2.81 0.00 0.00 174.94 171.25 1wgv s ARG 57 N -2.67 0.14 -0.07 3.50 3.52 -0.96 -2.32 118.95 120.09 1wgv s ARG 57 Ca 0.09 0.18 -0.03 0.00 -0.13 0.00 0.00 55.73 55.85 1wgv s ARG 57 Cb -0.05 0.06 0.04 0.00 -1.56 0.00 0.00 34.95 33.44 1wgv s ARG 57 CO 0.03 -0.02 0.12 0.08 -0.81 0.00 0.00 175.30 174.70 1wgv s VAL 58 N 0.11 -0.20 0.06 7.11 1.01 0.50 -2.52 120.40 126.46 1wgv s VAL 58 Ca -0.00 0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.34 1wgv s VAL 58 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 1wgv s VAL 58 CO -0.00 0.16 0.01 0.00 0.00 0.00 0.00 175.10 175.26 1wgv s ALA 59 N 2.24 0.38 -0.02 5.51 0.00 -0.21 0.05 121.76 129.71 1wgv s ALA 59 Ca 0.04 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 1wgv s ALA 59 Cb -0.12 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1wgv s ALA 59 CO -0.05 -0.39 0.07 0.00 0.00 0.00 0.00 175.76 175.40 1wgv s MET 60 N -3.84 0.16 0.12 0.00 0.23 0.74 -0.95 119.30 115.76 1wgv s MET 60 Ca 0.06 -0.03 -0.30 0.00 -1.03 0.00 0.00 55.69 54.39 1wgv s MET 60 Cb 0.07 0.07 -0.06 0.00 -1.53 0.00 0.00 34.83 33.37 1wgv s MET 60 CO -0.10 -0.03 1.11 -0.51 -2.03 0.00 0.00 175.02 173.46 1wgv s LEU 61 N -0.29 4.44 0.00 0.18 1.43 0.50 -0.42 118.68 124.53 1wgv s LEU 61 Ca -0.03 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1wgv s LEU 61 Cb -0.02 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.60 1wgv s LEU 61 CO 0.00 -0.29 0.00 -0.62 0.23 0.00 0.00 176.35 175.67 1wgv n GLU 62 N 3.00 0.00 0.00 1.70 -0.58 -1.25 -4.90 120.64 118.61 1wgv n GLU 62 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1wgv n GLU 62 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 1wgv n GLU 62 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1wgv n GLU 63 N -0.73 0.00 -0.22 3.49 2.13 -1.26 -4.92 120.64 119.13 1wgv n GLU 63 Ca 0.00 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.91 1wgv n GLU 63 Cb 0.00 0.00 0.18 0.00 0.27 0.00 0.00 31.44 31.89 1wgv n GLU 63 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1wgv n ASN 64 N -1.92 2.85 0.00 4.31 4.13 -1.26 -5.00 115.26 118.38 1wgv n ASN 64 Ca 0.00 -3.09 0.00 0.00 1.68 0.00 0.00 54.58 53.17 1wgv n ASN 64 Cb 0.00 -0.47 0.00 0.00 -1.54 0.00 0.00 39.78 37.77 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 -1.12 3.76 3.47 7.41 0.00 -1.26 -5.15 105.19 112.30 1wgv n GLY 65 Ca 0.18 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.59 -1.63 -0.02 1.61 1.03 -1.26 -3.94 118.70 111.91 1wgv s GLU 66 Ca 0.00 0.26 -0.02 0.00 0.03 0.00 0.00 54.97 55.24 1wgv s GLU 66 Cb 0.00 -1.52 0.00 0.00 -0.80 0.00 0.00 34.13 31.81 1wgv s GLU 66 CO 0.00 -4.05 0.05 0.50 -1.33 0.00 0.00 175.26 170.43 1wgv s ARG 67 N -5.03 0.11 -0.66 -4.83 3.52 0.44 -4.85 118.95 107.65 1wgv s ARG 67 Ca 0.69 -0.01 -0.22 0.00 -0.13 0.00 0.00 55.73 56.06 1wgv s ARG 67 Cb -0.15 0.05 0.08 0.00 -1.56 0.00 0.00 34.95 33.36 1wgv s ARG 67 CO 0.59 -0.02 0.92 0.08 -0.81 0.00 0.00 175.30 176.06 1wgv s VAL 68 N -0.18 4.45 0.07 7.11 1.01 -1.26 -0.19 120.40 131.41 1wgv s VAL 68 Ca -0.02 -0.58 -0.24 0.00 0.00 0.00 0.00 61.98 61.14 1wgv s VAL 68 Cb -0.02 -4.65 -0.16 0.00 0.00 0.00 0.00 36.38 31.55 1wgv s VAL 68 CO 0.00 -1.39 1.64 -0.07 0.00 0.00 0.00 175.10 175.28 1wgv h LEU 69 N 11.01 -0.04 -7.86 3.92 3.38 -0.72 -3.45 115.31 121.55 1wgv h LEU 69 Ca -0.26 -0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.46 1wgv h LEU 69 Cb 1.07 0.01 -0.22 0.00 0.09 0.00 0.00 40.66 41.61 1wgv h LEU 69 CO 1.16 0.06 -0.62 -0.32 0.09 0.00 0.00 178.44 178.81 1wgv s MET 70 N -5.82 0.34 -0.23 1.13 0.00 -0.78 -4.65 119.30 109.29 1wgv s MET 70 Ca -0.14 -0.45 -0.37 0.00 0.00 0.00 0.00 55.69 54.74 1wgv s MET 70 Cb 0.05 0.13 0.15 0.00 0.00 0.00 0.00 34.83 35.16 1wgv s MET 70 CO 0.66 -0.07 1.31 -2.00 0.00 0.00 0.00 175.02 174.92 1wgv s GLU 71 N -1.23 0.16 0.00 4.11 -6.30 -1.26 0.19 118.70 114.36 1wgv s GLU 71 Ca -0.13 -0.06 0.00 0.00 -2.50 0.00 0.00 54.97 52.27 1wgv s GLU 71 Cb -0.08 0.07 0.00 0.00 0.00 0.00 0.00 34.13 34.12 1wgv s GLU 71 CO 0.00 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.62 1wgv n GLY 72 N -0.08 4.13 3.71 -1.50 0.00 -0.98 -5.00 105.19 105.46 1wgv n GLY 72 Ca 0.02 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 1wgv n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wgv s LYS 73 N -2.78 4.52 0.65 1.61 -2.85 -1.26 -2.38 119.74 117.25 1wgv s LYS 73 Ca 0.00 1.27 -0.17 0.00 -1.00 0.00 0.00 55.97 56.07 1wgv s LYS 73 Cb 0.00 -3.46 -0.00 0.00 -2.06 0.00 0.00 37.83 32.30 1wgv s LYS 73 CO 0.00 -0.04 1.19 -0.51 0.10 0.00 0.00 175.35 176.09 1wgv s LEU 74 N 1.03 3.49 0.00 2.77 1.43 -1.21 -1.50 118.68 124.70 1wgv s LEU 74 Ca 0.48 2.31 0.26 0.00 -1.03 0.00 0.00 54.13 56.14 1wgv s LEU 74 Cb -0.20 -4.59 1.31 0.00 0.03 0.00 0.00 46.19 42.74 1wgv s LEU 74 CO 0.25 -1.84 1.87 0.35 0.23 0.00 0.00 176.35 177.21 1wgv n THR 75 N -2.14 0.17 -3.98 5.49 -2.24 -1.05 -4.63 114.28 105.91 1wgv n THR 75 Ca 0.13 0.04 -0.12 0.00 -2.27 0.00 0.00 64.05 61.84 1wgv n THR 75 Cb 0.50 -0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 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 -2.57 0.60 0.72 4.78 3.76 -1.26 -5.03 115.29 116.29 1wgv s HIS 76 Ca 0.24 -1.00 -0.07 0.00 -0.15 0.00 0.00 55.06 54.09 1wgv s HIS 76 Cb 0.17 0.28 0.07 0.00 1.11 0.00 0.00 32.58 34.21 1wgv s HIS 76 CO 0.39 -1.25 1.03 0.15 -0.85 0.00 0.00 174.74 174.21 1wgv s LYS 77 N -3.03 2.11 0.16 1.40 1.02 -1.26 -4.52 119.74 115.62 1wgv s LYS 77 Ca 0.24 -0.30 -0.18 0.00 0.02 0.00 0.00 55.97 55.75 1wgv s LYS 77 Cb -0.02 -2.16 0.04 0.00 -0.52 0.00 0.00 37.83 35.16 1wgv s LYS 77 CO 0.15 -1.30 0.48 0.96 -0.92 0.00 0.00 175.35 174.72 1wgv s ILE 78 N -3.27 0.04 -1.17 2.17 -5.25 0.49 -4.03 121.20 110.19 1wgv s ILE 78 Ca 0.61 -0.58 -0.09 0.00 -0.99 0.00 0.00 60.65 59.60 1wgv s ILE 78 Cb -0.10 -1.32 0.24 0.00 2.95 0.00 0.00 42.46 44.23 1wgv s ILE 78 CO 0.45 -0.19 1.49 -3.20 -1.79 0.00 0.00 174.94 171.71 1wgv n ASN 79 N -0.30 5.63 -0.31 4.36 2.85 -1.13 -4.50 115.26 121.87 1wgv n ASN 79 Ca -0.14 -3.16 0.09 0.00 -0.11 0.00 0.00 54.58 51.26 1wgv n ASN 79 Cb 0.63 -1.41 0.19 0.00 1.24 0.00 0.00 39.78 40.43 1wgv n ASN 79 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1wgv n THR 80 N 2.81 -0.37 -0.28 -0.44 -2.24 -1.26 0.87 114.28 113.37 1wgv n THR 80 Ca 0.31 1.98 -0.04 0.00 -2.27 0.00 0.00 64.05 64.03 1wgv n THR 80 Cb 0.37 -2.81 0.01 0.00 -2.10 0.00 0.00 70.33 65.80 1wgv n THR 80 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1wgv h GLU 81 N 0.00 -0.10 -0.08 -0.78 4.81 -1.98 0.52 114.58 116.97 1wgv h GLU 81 Ca 0.47 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.58 1wgv h GLU 81 Cb 0.85 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1wgv h GLU 81 CO -0.87 -0.07 -0.54 0.77 -0.73 0.00 0.00 179.01 177.57 1wgv h SER 82 N -0.11 0.26 -2.82 1.04 0.02 0.08 -3.43 113.55 108.58 1wgv h SER 82 Ca 0.26 -0.13 -0.53 0.00 -0.84 0.00 0.00 61.79 60.55 1wgv h SER 82 Cb 0.56 -0.07 0.04 0.00 0.14 0.00 0.00 62.40 63.07 1wgv h SER 82 CO -0.80 0.75 0.88 -0.44 -1.14 0.00 0.00 176.83 176.08 1wgv s SER 83 N -6.89 6.60 0.53 3.07 0.01 0.18 -4.85 113.70 112.36 1wgv s SER 83 Ca -0.04 2.58 0.03 0.00 1.31 0.00 0.00 55.95 59.83 1wgv s SER 83 Cb 0.12 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.77 1wgv s SER 83 CO 0.79 -0.82 0.15 -1.48 0.41 0.00 0.00 173.24 172.29 1wgv s LEU 84 N 1.30 2.42 -0.30 2.44 0.05 -1.07 -4.85 118.68 118.67 1wgv s LEU 84 Ca 0.70 -1.52 -0.13 0.00 0.05 0.00 0.00 54.13 53.24 1wgv s LEU 84 Cb -0.43 -0.89 0.15 0.00 -2.05 0.00 0.00 46.19 42.97 1wgv s LEU 84 CO 0.31 -0.97 0.82 -1.66 -0.55 0.00 0.00 176.35 174.31 1wgv s TRP 85 N -2.85 -1.00 0.00 3.48 1.48 -1.26 -1.94 118.94 116.86 1wgv s TRP 85 Ca 0.15 1.74 0.07 0.00 -1.06 0.00 0.00 56.10 57.00 1wgv s TRP 85 Cb -0.00 0.60 -0.02 0.00 -1.16 0.00 0.00 33.47 32.89 1wgv s TRP 85 CO 0.09 -0.50 -0.22 -1.12 -4.06 0.00 0.00 176.95 171.14 1wgv s SER 86 N 2.64 2.63 -0.10 -2.66 0.01 0.48 -5.00 113.70 111.71 1wgv s SER 86 Ca -0.04 -0.45 -0.04 0.00 1.31 0.00 0.00 55.95 56.72 1wgv s SER 86 Cb -0.09 -0.27 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 1wgv s SER 86 CO -0.18 0.25 0.08 -0.22 0.41 0.00 0.00 173.24 173.57 1wgv s LEU 87 N -0.74 4.03 -0.07 2.44 1.98 -1.26 -1.23 118.68 123.82 1wgv s LEU 87 Ca 0.09 0.32 0.05 0.00 -2.89 0.00 0.00 54.13 51.70 1wgv s LEU 87 Cb -0.09 -1.99 -0.01 0.00 0.66 0.00 0.00 46.19 44.77 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 -1.02 2.64 -0.08 1.98 2.02 -1.03 -5.00 118.70 118.20 1wgv s GLU 88 Ca 0.15 -0.88 -0.30 0.00 0.02 0.00 0.00 54.97 53.96 1wgv s GLU 88 Cb -0.12 -2.16 -0.03 0.00 0.10 0.00 0.00 34.13 31.92 1wgv s GLU 88 CO 0.04 0.32 1.23 -1.25 0.02 0.00 0.00 175.26 175.62 1wgv s PRO 89 N -0.01 4.32 -1.37 0.39 0.04 -1.26 -3.35 135.00 133.76 1wgv s PRO 89 Ca -0.08 1.69 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 1wgv s PRO 89 Cb -0.15 -3.61 0.03 0.00 0.04 0.00 0.00 34.50 30.81 1wgv s PRO 89 CO 0.05 -0.52 0.89 0.41 0.04 0.00 0.00 177.00 177.88 1wgv n GLY 90 N 3.45 -0.40 0.00 0.56 0.00 -0.75 -4.86 105.19 103.19 1wgv n GLY 90 Ca 0.12 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -4.48 0.00 -3.83 1.61 4.76 -1.21 -4.97 118.16 110.03 1wgv n LYS 91 Ca -0.15 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.23 1wgv n LYS 91 Cb 0.61 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.82 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 -2.47 4.58 -0.14 0.00 1.01 0.52 -2.46 120.40 121.44 1wgv s VAL 93 Ca 0.17 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 1wgv s VAL 93 Cb -0.04 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1wgv s VAL 93 CO 0.08 0.57 -0.12 -0.22 0.00 0.00 0.00 175.10 175.41 1wgv s LEU 94 N -0.59 2.76 -0.00 3.92 1.98 -0.37 -1.33 118.68 125.06 1wgv s LEU 94 Ca 0.10 -0.32 0.01 0.00 -2.89 0.00 0.00 54.13 51.04 1wgv s LEU 94 Cb -0.12 -1.63 -0.00 0.00 0.66 0.00 0.00 46.19 45.10 1wgv s LEU 94 CO 0.02 0.15 -0.04 -0.69 -1.89 0.00 0.00 176.35 173.90 1wgv s VAL 95 N 0.44 0.35 -0.21 1.68 1.01 -1.10 -0.39 120.40 122.18 1wgv s VAL 95 Ca -0.09 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1wgv s VAL 95 Cb -0.16 -0.30 0.03 0.00 0.00 0.00 0.00 36.38 35.96 1wgv s VAL 95 CO 0.05 0.10 -0.16 0.20 0.00 0.00 0.00 175.10 175.28 1wgv s ASN 96 N -0.08 3.64 -0.39 3.32 0.02 -0.82 -3.03 114.94 117.60 1wgv s ASN 96 Ca 0.01 -0.90 -0.16 0.00 -1.02 0.00 0.00 52.86 50.79 1wgv s ASN 96 Cb -0.02 -1.52 0.01 0.00 0.02 0.00 0.00 41.25 39.74 1wgv s ASN 96 CO -0.00 -0.07 0.40 -0.76 0.02 0.00 0.00 177.10 176.69 1wgv s LEU 97 N 1.23 4.69 0.30 0.60 1.43 -0.86 -2.59 118.68 123.49 1wgv s LEU 97 Ca 0.00 -0.49 -0.29 0.00 -1.03 0.00 0.00 54.13 52.32 1wgv s LEU 97 Cb -0.15 -2.36 -0.10 0.00 0.03 0.00 0.00 46.19 43.61 1wgv s LEU 97 CO -0.10 -0.47 1.21 -0.55 0.23 0.00 0.00 176.35 176.67 1wgv s SER 98 N 1.77 7.01 0.01 2.29 0.15 -1.26 -2.78 113.70 120.89 1wgv s SER 98 Ca 0.12 2.48 -0.27 0.00 0.70 0.00 0.00 55.95 58.98 1wgv s SER 98 Cb -0.17 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.46 1wgv s SER 98 CO 0.13 -0.35 0.86 -0.54 1.20 0.00 0.00 173.24 174.53 1wgv s LYS 99 N -1.58 4.53 -0.55 5.44 1.02 -1.26 -2.84 119.74 124.50 1wgv s LYS 99 Ca 0.47 1.20 -0.03 0.00 0.02 0.00 0.00 55.97 57.63 1wgv s LYS 99 Cb -0.36 -3.42 0.14 0.00 -0.52 0.00 0.00 37.83 33.67 1wgv s LYS 99 CO 0.47 0.09 0.36 0.08 -0.92 0.00 0.00 175.35 175.43 1wgv s VAL 100 N 0.59 3.58 0.08 3.17 1.01 -1.26 -4.71 120.40 122.86 1wgv s VAL 100 Ca 0.44 -2.65 0.00 0.00 0.00 0.00 0.00 61.98 59.77 1wgv s VAL 100 Cb -0.20 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.80 1wgv s VAL 100 CO 0.24 -0.82 0.00 0.61 0.00 0.00 0.00 175.10 175.14 1wgv n GLY 101 N 3.87 -2.99 3.56 4.51 0.00 -1.26 -4.68 105.19 108.19 1wgv n GLY 101 Ca 0.04 -1.22 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 1wgv n GLY 101 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wgv s GLU 102 N -4.38 2.36 0.11 1.61 -1.05 -1.26 -4.91 118.70 111.17 1wgv s GLU 102 Ca 0.00 0.25 0.06 0.00 -0.15 0.00 0.00 54.97 55.13 1wgv s GLU 102 Cb 0.00 -4.79 -0.04 0.00 -0.44 0.00 0.00 34.13 28.87 1wgv s GLU 102 CO 0.00 -3.39 -0.15 0.71 0.95 0.00 0.00 175.26 173.38 1wgv s TYR 103 N 10.87 1.39 -0.14 4.83 2.02 -1.26 -5.12 117.35 129.94 1wgv s TYR 103 Ca 0.76 -0.52 -0.28 0.00 -0.37 0.00 0.00 57.07 56.66 1wgv s TYR 103 Cb -0.10 -0.74 -0.01 0.00 -0.40 0.00 0.00 41.96 40.71 1wgv s TYR 103 CO 0.09 0.13 0.97 -0.46 -1.57 0.00 0.00 175.55 174.70 1wgv s TRP 104 N -1.83 3.46 0.00 2.71 -0.11 -1.26 -4.93 118.94 116.98 1wgv s TRP 104 Ca 0.06 1.49 0.00 0.00 1.22 0.00 0.00 56.10 58.87 1wgv s TRP 104 Cb -0.07 -3.16 0.00 0.00 -1.50 0.00 0.00 33.47 28.75 1wgv s TRP 104 CO 0.03 -0.27 0.00 0.91 -4.62 0.00 0.00 176.95 173.00 1wgv n TRP 105 N 5.26 0.00 0.00 5.86 7.02 -1.26 -4.94 117.44 129.38 1wgv n TRP 105 Ca 0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.56 1wgv n TRP 105 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1wgv n TRP 105 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1wgv n ASN 106 N -2.37 0.00 -4.35 -0.99 5.15 -1.26 -4.82 115.26 106.61 1wgv n ASN 106 Ca 0.00 0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.79 1wgv n ASN 106 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 1wgv n ASN 106 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wgv s ALA 107 N 0.00 2.02 -0.05 5.20 0.00 -1.26 -3.82 121.76 123.85 1wgv s ALA 107 Ca 0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.21 1wgv s ALA 107 Cb 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 1wgv s ALA 107 CO 0.00 -0.01 0.23 0.82 0.00 0.00 0.00 175.76 176.80 1wgv h ILE 108 N 2.51 0.00 -2.21 0.00 1.08 -1.87 -3.43 117.51 113.58 1wgv h ILE 108 Ca -0.38 -0.57 -0.45 0.00 -0.39 0.00 0.00 64.86 63.07 1wgv h ILE 108 Cb 1.22 0.00 0.01 0.00 -3.07 0.00 0.00 36.82 34.98 1wgv h ILE 108 CO 0.64 0.00 -0.27 -0.76 -0.69 0.00 0.00 178.15 177.06 1wgv s LEU 109 N -7.26 3.94 0.00 1.44 1.43 -1.26 -2.52 118.68 114.45 1wgv s LEU 109 Ca -0.02 0.04 0.15 0.00 -1.03 0.00 0.00 54.13 53.27 1wgv s LEU 109 Cb 0.00 -2.93 0.68 0.00 0.03 0.00 0.00 46.19 43.97 1wgv s LEU 109 CO 0.07 -0.44 1.46 -0.62 0.23 0.00 0.00 176.35 177.05 1wgv n GLU 110 N -1.74 0.07 -2.00 1.70 1.02 -0.56 -2.55 120.64 116.58 1wgv n GLU 110 Ca -0.02 0.21 -0.27 0.00 -0.02 0.00 0.00 57.16 57.06 1wgv n GLU 110 Cb 0.58 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.52 1wgv n GLU 110 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wgv n GLY 111 N 0.04 6.18 2.75 0.62 0.00 -1.26 -4.96 105.19 108.56 1wgv n GLY 111 Ca 0.05 -2.62 -0.21 0.00 0.00 0.00 0.00 46.02 43.24 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 -3.65 0.33 0.46 1.61 2.12 -1.06 -5.11 118.70 113.40 1wgv s GLU 112 Ca 0.53 0.18 -0.20 0.00 0.36 0.00 0.00 54.97 55.84 1wgv s GLU 112 Cb 0.43 -0.72 -0.14 0.00 0.26 0.00 0.00 34.13 33.96 1wgv s GLU 112 CO -0.04 -0.27 0.19 0.39 -0.54 0.00 0.00 175.26 174.99 1wgv n GLU 113 N 4.96 0.19 -0.37 4.30 1.02 -1.26 -4.65 120.64 124.84 1wgv n GLU 113 Ca -0.10 0.07 -0.07 0.00 -0.02 0.00 0.00 57.16 57.04 1wgv n GLU 113 Cb 0.50 -1.21 0.06 0.00 -0.02 0.00 0.00 31.44 30.77 1wgv n GLU 113 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1wgv n PRO 114 N 1.02 -0.94 -4.43 3.49 -0.04 -1.26 -4.58 135.00 128.27 1wgv n PRO 114 Ca 0.11 -0.48 -0.21 0.00 -0.04 0.00 0.00 63.50 62.88 1wgv n PRO 114 Cb 0.43 -0.38 -0.10 0.00 -0.04 0.00 0.00 33.50 33.41 1wgv n PRO 114 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1wgv s ILE 115 N -1.61 0.95 -0.15 0.52 -4.36 -1.25 -4.93 121.20 110.37 1wgv s ILE 115 Ca 0.18 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.49 1wgv s ILE 115 Cb -0.01 -2.69 -0.06 0.00 1.25 0.00 0.00 42.46 40.94 1wgv s ILE 115 CO 0.13 0.00 -0.21 -0.67 0.24 0.00 0.00 174.94 174.44 1wgv n ASP 116 N -0.73 1.20 -4.64 4.36 -0.08 -1.26 -4.99 116.55 110.41 1wgv n ASP 116 Ca -0.02 0.20 -0.46 0.00 -1.51 0.00 0.00 54.79 53.00 1wgv n ASP 116 Cb 0.66 -0.49 -0.03 0.00 2.34 0.00 0.00 41.12 43.60 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 -3.77 0.84 -3.71 5.18 2.08 -1.26 -4.98 119.36 113.74 1wgv n ILE 117 Ca -0.28 -0.21 -0.11 0.00 0.56 0.00 0.00 62.75 62.71 1wgv n ILE 117 Cb 0.66 -1.30 -0.11 0.00 -0.75 0.00 0.00 39.64 38.15 1wgv n ILE 117 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1wgv s ASP 118 N 0.26 -0.46 -1.08 4.38 -1.08 -1.26 -5.08 116.67 112.36 1wgv s ASP 118 Ca 0.71 0.82 -0.15 0.00 -0.52 0.00 0.00 52.55 53.40 1wgv s ASP 118 Cb -0.71 0.72 0.16 0.00 -1.46 0.00 0.00 42.92 41.63 1wgv s ASP 118 CO 0.49 -0.18 1.26 -0.55 0.52 0.00 0.00 175.17 176.72 1wgv s SER 119 N 1.18 6.90 0.00 -0.34 0.15 -1.26 -4.93 113.70 115.40 1wgv s SER 119 Ca -0.08 -2.65 0.00 0.00 0.70 0.00 0.00 55.95 53.92 1wgv s SER 119 Cb -0.08 -2.38 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1wgv s SER 119 CO -0.10 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.12 1wgv n GLY 120 N 4.55 4.30 2.84 9.45 0.00 -1.26 -4.97 105.19 120.10 1wgv n GLY 120 Ca 0.30 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 44.20 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 2.25 -3.65 1.61 -0.04 -1.26 -4.71 135.00 129.21 1wgv n PRO 121 Ca 0.00 -2.12 -0.01 0.00 -0.04 0.00 0.00 63.50 61.34 1wgv n PRO 121 Cb 0.00 -3.00 -0.06 0.00 -0.04 0.00 0.00 33.50 30.40 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 3.92 -0.22 -0.51 3.54 1.04 -1.26 -5.10 113.70 115.11 1wgv s SER 122 Ca 0.53 0.36 -0.27 0.00 0.48 0.00 0.00 55.95 57.04 1wgv s SER 122 Cb 0.14 0.94 -0.02 0.00 0.10 0.00 0.00 66.02 67.18 1wgv s SER 122 CO 0.01 -0.06 1.86 -0.94 0.98 0.00 0.00 173.24 175.09 1wgv s SER 123 N 0.93 5.44 0.00 7.02 1.04 -1.26 -4.96 113.70 121.91 1wgv s SER 123 Ca -0.05 0.70 0.00 0.00 0.48 0.00 0.00 55.95 57.07 1wgv s SER 123 Cb -0.03 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1wgv s SER 123 CO -0.12 -2.17 0.17 0.61 0.98 0.00 0.00 173.24 172.71