#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 6.47 0.06 1.61 0.15 -1.26 -4.95 113.70 115.78 1wgv s SER 2 Ca 0.00 2.72 -0.34 0.00 0.70 0.00 0.00 55.95 59.03 1wgv s SER 2 Cb 0.00 -2.65 -0.19 0.00 -1.71 0.00 0.00 66.02 61.47 1wgv s SER 2 CO 0.00 -0.75 1.53 -1.28 1.20 0.00 0.00 173.24 173.94 1wgv h SER 3 N 2.96 -0.92 0.00 5.45 0.87 -2.06 -3.49 113.55 116.36 1wgv h SER 3 Ca -0.50 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1wgv h SER 3 Cb 1.24 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 1wgv h SER 3 CO 0.64 -0.63 0.00 0.61 -0.53 0.00 0.00 176.83 176.92 1wgv n GLY 4 N -1.42 0.76 3.17 5.77 0.00 -1.26 -4.91 105.19 107.30 1wgv n GLY 4 Ca -0.15 -0.66 -0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 -6.65 -3.66 1.61 7.64 -1.26 -5.00 113.62 106.30 1wgv n SER 5 Ca 0.00 0.46 -0.05 0.00 1.01 0.00 0.00 58.87 60.29 1wgv n SER 5 Cb 0.00 -1.67 -0.07 0.00 -1.01 0.00 0.00 64.21 61.46 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 -0.96 -0.80 0.42 6.43 0.15 -1.26 -5.13 113.70 112.55 1wgv s SER 6 Ca -0.00 1.33 0.00 0.00 0.70 0.00 0.00 55.95 57.98 1wgv s SER 6 Cb 0.00 1.68 0.00 0.00 -1.71 0.00 0.00 66.02 65.99 1wgv s SER 6 CO 0.02 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1wgv n GLY 7 N 5.05 -2.69 1.54 9.45 0.00 -1.26 -4.99 105.19 112.28 1wgv n GLY 7 Ca -0.14 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1wgv n GLY 7 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wgv n GLN 8 N -3.95 0.00 0.10 1.61 3.00 -1.26 -5.09 117.38 111.79 1wgv n GLN 8 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 1wgv n GLN 8 Cb 0.55 -0.24 0.00 0.00 0.00 0.00 0.00 30.24 30.55 1wgv n GLN 8 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1wgv n LYS 9 N -3.37 0.00 -3.78 -1.09 4.81 -1.26 -5.13 118.16 108.34 1wgv n LYS 9 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.30 1wgv n LYS 9 Cb 0.04 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 34.94 1wgv n LYS 9 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1wgv s ASN 10 N -1.85 0.02 -0.04 3.14 2.20 -1.26 -5.05 114.94 112.11 1wgv s ASN 10 Ca 0.00 0.09 -0.24 0.00 -0.94 0.00 0.00 52.86 51.77 1wgv s ASN 10 Cb 0.00 -0.01 -0.22 0.00 -2.00 0.00 0.00 41.25 39.02 1wgv s ASN 10 CO 0.00 -0.12 1.07 1.55 -2.94 0.00 0.00 177.10 176.66 1wgv h PRO 11 N 7.16 0.18 0.00 3.55 0.13 -2.04 -3.49 132.00 137.50 1wgv h PRO 11 Ca -0.43 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1wgv h PRO 11 Cb 1.13 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wgv h PRO 11 CO 0.47 0.88 0.00 -0.40 -0.23 0.00 0.00 178.00 178.72 1wgv n ASP 12 N -4.52 0.00 -3.08 1.44 5.68 -1.26 -5.08 116.55 109.73 1wgv n ASP 12 Ca -0.09 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 54.10 1wgv n ASP 12 Cb 0.48 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.47 1wgv n ASP 12 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1wgv n SER 13 N 0.00 -6.97 0.00 -1.12 2.88 -1.26 -4.97 113.62 102.18 1wgv n SER 13 Ca 0.00 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 1wgv n SER 13 Cb 0.00 -3.26 0.00 0.00 -0.75 0.00 0.00 64.21 60.20 1wgv n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wgv n TYR 14 N 0.54 0.00 -3.61 0.66 9.36 -1.26 -5.01 117.16 117.84 1wgv n TYR 14 Ca 0.00 0.00 -0.04 0.00 3.32 0.00 0.00 57.90 61.18 1wgv n TYR 14 Cb 0.40 0.18 -0.03 0.00 -0.63 0.00 0.00 39.34 39.26 1wgv n TYR 14 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1wgv s ASN 15 N -4.19 -0.13 1.17 2.98 3.84 -1.26 -5.09 114.94 112.25 1wgv s ASN 15 Ca 0.00 0.09 0.00 0.00 0.21 0.00 0.00 52.86 53.16 1wgv s ASN 15 Cb 0.00 0.12 0.00 0.00 -0.55 0.00 0.00 41.25 40.82 1wgv s ASN 15 CO 0.00 -0.16 0.00 0.61 -2.79 0.00 0.00 177.10 174.76 1wgv n GLY 16 N 0.33 1.54 3.18 1.21 0.00 -1.26 -4.84 105.19 105.34 1wgv n GLY 16 Ca -0.01 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1wgv n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgv n ALA 17 N 7.57 -4.71 0.00 4.61 0.00 -1.26 -4.61 120.51 122.11 1wgv n ALA 17 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 53.44 52.16 1wgv n ALA 17 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1wgv n ALA 17 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1wgv n VAL 18 N -4.02 0.00 0.00 0.00 0.24 -1.26 -4.75 118.33 108.54 1wgv n VAL 18 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1wgv n VAL 18 Cb 0.66 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.03 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 1.60 0.00 0.00 7.34 5.12 -1.26 -4.96 116.66 124.49 1wgv n ARG 19 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1wgv n ARG 19 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1wgv n ARG 19 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 1wgv n GLU 20 N 0.00 0.00 0.21 5.56 -0.00 -1.26 -4.88 120.64 120.27 1wgv n GLU 20 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.16 57.03 1wgv n GLU 20 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.44 31.37 1wgv n GLU 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 1wgv h ASN 21 N 0.00 -0.48 -3.13 -1.84 4.21 -1.93 -3.46 115.58 108.96 1wgv h ASN 21 Ca 0.00 -0.11 -0.19 0.00 1.21 0.00 0.00 56.30 57.21 1wgv h ASN 21 Cb 0.00 0.12 -0.30 0.00 -1.12 0.00 0.00 38.32 37.02 1wgv h ASN 21 CO 0.00 -0.08 -0.48 -0.72 -1.29 0.00 0.00 177.43 174.87 1wgv s TYR 22 N -4.31 -0.41 0.28 1.19 -0.85 -1.26 -4.42 117.35 107.57 1wgv s TYR 22 Ca -0.13 0.93 -0.01 0.00 -0.52 0.00 0.00 57.07 57.34 1wgv s TYR 22 Cb 0.02 0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.37 1wgv s TYR 22 CO 0.46 -0.30 0.50 0.95 -1.52 0.00 0.00 175.55 175.63 1wgv s THR 23 N 1.74 5.12 0.16 -3.49 -4.23 -1.14 -4.40 115.64 109.40 1wgv s THR 23 Ca -0.05 -0.32 -0.15 0.00 -1.18 0.00 0.00 61.69 59.99 1wgv s THR 23 Cb -0.11 -3.79 0.02 0.00 1.34 0.00 0.00 72.50 69.96 1wgv s THR 23 CO -0.09 -0.38 0.43 -1.66 -0.54 0.00 0.00 174.62 172.38 1wgv s TRP 24 N -2.11 -0.04 0.12 3.99 1.48 -1.26 -1.99 118.94 119.13 1wgv s TRP 24 Ca 0.40 -0.31 -0.12 0.00 -1.06 0.00 0.00 56.10 55.02 1wgv s TRP 24 Cb -0.10 0.25 0.01 0.00 -1.16 0.00 0.00 33.47 32.47 1wgv s TRP 24 CO 0.32 -0.80 0.31 -1.12 -4.06 0.00 0.00 176.95 171.60 1wgv s SER 25 N -2.87 -0.05 -0.13 -2.66 0.01 -0.87 -4.70 113.70 102.44 1wgv s SER 25 Ca 0.09 -0.55 -0.00 0.00 1.31 0.00 0.00 55.95 56.79 1wgv s SER 25 Cb 0.01 0.42 -0.02 0.00 0.21 0.00 0.00 66.02 66.64 1wgv s SER 25 CO -0.06 -0.82 -0.12 0.00 0.41 0.00 0.00 173.24 172.66 1wgv s GLN 26 N -3.86 3.36 0.51 12.44 -2.07 -1.26 -2.83 119.66 125.96 1wgv s GLN 26 Ca 0.06 -0.66 0.02 0.00 -1.82 0.00 0.00 55.36 52.96 1wgv s GLN 26 Cb 0.03 -2.65 -0.01 0.00 -1.09 0.00 0.00 33.01 29.29 1wgv s GLN 26 CO -0.09 0.25 0.06 -0.51 -1.32 0.00 0.00 175.29 173.69 1wgv s ASP 27 N 0.26 4.21 0.20 12.60 1.11 -0.89 -5.02 116.67 129.14 1wgv s ASP 27 Ca -0.08 -1.59 -0.18 0.00 0.18 0.00 0.00 52.55 50.88 1wgv s ASP 27 Cb -0.15 0.50 0.18 0.00 1.07 0.00 0.00 42.92 44.51 1wgv s ASP 27 CO 0.05 -0.89 1.41 0.00 1.18 0.00 0.00 175.17 176.92 1wgv n TYR 28 N -1.34 -0.04 -2.86 4.23 4.19 -1.26 -3.86 117.16 116.23 1wgv n TYR 28 Ca -0.16 1.12 -0.09 0.00 3.31 0.00 0.00 57.90 62.08 1wgv n TYR 28 Cb 0.67 -0.80 0.01 0.00 0.49 0.00 0.00 39.34 39.70 1wgv n TYR 28 CO 0.00 0.00 0.00 -2.37 0.91 0.00 0.00 176.86 175.40 1wgv n THR 29 N -5.31 -0.19 0.00 2.97 5.66 -1.26 -5.12 114.28 111.03 1wgv n THR 29 Ca 0.08 -1.67 0.00 0.00 -3.05 0.00 0.00 64.05 59.41 1wgv n THR 29 Cb 0.35 0.65 0.00 0.00 -1.55 0.00 0.00 70.33 69.78 1wgv n THR 29 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1wgv n ASP 30 N 2.37 0.00 -4.48 1.09 -0.08 -1.25 -4.71 116.55 109.50 1wgv n ASP 30 Ca 0.16 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 53.11 1wgv n ASP 30 Cb 0.57 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.91 1wgv n ASP 30 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1wgv s LEU 31 N 0.00 2.95 -0.29 -2.67 1.02 -0.93 -2.09 118.68 116.67 1wgv s LEU 31 Ca 0.00 -0.17 0.02 0.00 0.02 0.00 0.00 54.13 54.00 1wgv s LEU 31 Cb 0.00 -1.65 0.08 0.00 0.02 0.00 0.00 46.19 44.64 1wgv s LEU 31 CO 0.00 0.26 -0.00 -1.61 0.02 0.00 0.00 176.35 175.02 1wgv s GLU 32 N -0.20 1.57 -0.18 1.70 2.02 -1.13 -2.19 118.70 120.30 1wgv s GLU 32 Ca 0.02 -1.44 -0.01 0.00 0.02 0.00 0.00 54.97 53.55 1wgv s GLU 32 Cb -0.13 -2.83 0.00 0.00 0.10 0.00 0.00 34.13 31.27 1wgv s GLU 32 CO 0.03 -0.78 -0.13 0.54 0.02 0.00 0.00 175.26 174.94 1wgv s VAL 33 N 1.16 2.77 -0.11 2.63 0.11 -1.19 -2.04 120.40 123.72 1wgv s VAL 33 Ca 0.02 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.37 1wgv s VAL 33 Cb -0.19 -2.20 -0.01 0.00 -1.53 0.00 0.00 36.38 32.45 1wgv s VAL 33 CO -0.09 0.49 -0.15 -0.13 -3.33 0.00 0.00 175.10 171.89 1wgv s ARG 34 N 1.09 3.16 -0.11 1.54 1.81 -0.84 -2.73 118.95 122.87 1wgv s ARG 34 Ca 0.00 -0.72 -0.01 0.00 -1.72 0.00 0.00 55.73 53.28 1wgv s ARG 34 Cb -0.14 -2.52 -0.03 0.00 -0.45 0.00 0.00 34.95 31.81 1wgv s ARG 34 CO -0.04 0.29 -0.08 0.08 -0.68 0.00 0.00 175.30 174.87 1wgv s VAL 35 N 0.14 3.59 0.29 3.52 1.01 -0.47 -2.87 120.40 125.62 1wgv s VAL 35 Ca -0.08 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 1wgv s VAL 35 Cb -0.15 -2.51 -0.09 0.00 0.00 0.00 0.00 36.38 33.63 1wgv s VAL 35 CO 0.05 0.55 1.07 -2.16 0.00 0.00 0.00 175.10 174.61 1wgv s PRO 36 N -0.19 4.59 0.17 2.72 0.04 -1.26 0.20 135.00 141.27 1wgv s PRO 36 Ca 0.02 1.73 0.07 0.00 0.04 0.00 0.00 61.00 62.85 1wgv s PRO 36 Cb -0.13 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1wgv s PRO 36 CO 0.03 0.19 -0.14 0.14 0.04 0.00 0.00 177.00 177.26 1wgv s VAL 37 N -1.24 1.53 1.08 -0.36 -7.23 -1.07 -4.84 120.40 108.28 1wgv s VAL 37 Ca 0.46 -2.03 -0.18 0.00 -1.81 0.00 0.00 61.98 58.43 1wgv s VAL 37 Cb -0.30 -1.86 0.24 0.00 0.56 0.00 0.00 36.38 35.03 1wgv s VAL 37 CO 0.38 -0.55 1.22 -2.16 -0.31 0.00 0.00 175.10 173.68 1wgv s PRO 38 N -3.34 -0.29 -0.01 4.82 0.04 -1.26 -4.35 135.00 130.62 1wgv s PRO 38 Ca 0.17 -0.25 0.06 0.00 0.04 0.00 0.00 61.00 61.03 1wgv s PRO 38 Cb -0.02 -1.72 0.19 0.00 0.04 0.00 0.00 34.50 32.99 1wgv s PRO 38 CO 0.05 -3.06 1.12 1.63 0.04 0.00 0.00 177.00 176.77 1wgv n LYS 39 N -4.26 1.55 0.00 4.56 4.76 -1.26 -2.88 118.16 120.63 1wgv n LYS 39 Ca 0.14 -0.76 0.05 0.00 -2.87 0.00 0.00 58.31 54.87 1wgv n LYS 39 Cb 0.59 -1.22 -0.00 0.00 -1.84 0.00 0.00 35.03 32.56 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 0.12 0.00 -3.44 2.13 1.44 -1.26 -4.79 115.22 109.41 1wgv n HIS 40 Ca 0.07 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.35 1wgv n HIS 40 Cb 0.21 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.23 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 -1.36 5.24 0.00 0.61 1.01 -1.14 -4.79 120.40 119.98 1wgv s VAL 41 Ca 0.08 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1wgv s VAL 41 Cb 0.08 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1wgv s VAL 41 CO 0.25 -0.38 0.00 1.33 0.00 0.00 0.00 175.10 176.30 1wgv n VAL 42 N 5.17 0.00 -3.01 2.92 0.24 -1.26 -1.69 118.33 120.70 1wgv n VAL 42 Ca -0.11 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.79 1wgv n VAL 42 Cb 0.46 -0.30 -0.05 0.00 -1.47 0.00 0.00 33.84 32.49 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 4.45 0.46 7.34 1.02 -1.26 -4.32 119.74 125.90 1wgv s LYS 43 Ca 0.00 0.95 0.31 0.00 0.02 0.00 0.00 55.97 57.25 1wgv s LYS 43 Cb 0.00 -3.44 1.62 0.00 -0.52 0.00 0.00 37.83 35.49 1wgv s LYS 43 CO 0.00 0.08 1.95 0.78 -0.92 0.00 0.00 175.35 177.24 1wgv h GLY 44 N 6.63 0.00 1.67 -3.33 0.00 -1.92 0.16 103.07 106.28 1wgv h GLY 44 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1wgv h GLY 44 CO 0.75 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.87 1wgv n LYS 45 N -2.61 0.23 0.04 4.80 2.85 -1.26 -1.94 118.16 120.27 1wgv n LYS 45 Ca -0.01 0.10 0.11 0.00 -1.05 0.00 0.00 58.31 57.46 1wgv n LYS 45 Cb 0.09 -1.50 0.05 0.00 -0.65 0.00 0.00 35.03 33.02 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 -1.34 0.34 -5.15 -1.58 6.02 0.57 -4.85 117.38 111.40 1wgv n GLN 46 Ca 0.09 0.03 -0.32 0.00 -0.01 0.00 0.00 57.00 56.79 1wgv n GLN 46 Cb 0.19 -1.64 -0.16 0.00 1.02 0.00 0.00 30.24 29.65 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 -3.22 2.33 -0.05 5.09 -7.23 -0.82 0.20 120.40 116.71 1wgv s VAL 47 Ca 0.03 -0.97 -0.11 0.00 -1.81 0.00 0.00 61.98 59.13 1wgv s VAL 47 Cb 0.14 -1.88 -0.05 0.00 0.56 0.00 0.00 36.38 35.15 1wgv s VAL 47 CO 0.78 0.57 0.29 -0.44 -0.31 0.00 0.00 175.10 175.99 1wgv s SER 48 N -0.20 6.62 -0.03 4.85 0.01 0.22 -4.92 113.70 120.26 1wgv s SER 48 Ca -0.02 0.74 -0.01 0.00 1.31 0.00 0.00 55.95 57.98 1wgv s SER 48 Cb -0.13 -2.17 0.03 0.00 0.21 0.00 0.00 66.02 63.96 1wgv s SER 48 CO 0.03 0.36 0.04 -0.69 0.41 0.00 0.00 173.24 173.39 1wgv s VAL 49 N -1.06 -0.05 -0.21 3.43 1.01 -1.25 -2.76 120.40 119.50 1wgv s VAL 49 Ca 0.20 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1wgv s VAL 49 Cb -0.15 -0.12 0.05 0.00 0.00 0.00 0.00 36.38 36.17 1wgv s VAL 49 CO 0.09 0.12 -0.05 0.00 0.00 0.00 0.00 175.10 175.26 1wgv s ALA 50 N 1.39 1.74 -0.16 5.51 0.00 -1.20 -4.95 121.76 124.09 1wgv s ALA 50 Ca -0.05 -1.13 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 1wgv s ALA 50 Cb -0.13 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.67 1wgv s ALA 50 CO -0.03 -1.04 -0.09 -0.51 0.00 0.00 0.00 175.76 174.09 1wgv s LEU 51 N 1.51 2.84 0.13 0.00 1.43 -1.26 -3.07 118.68 120.25 1wgv s LEU 51 Ca -0.03 -0.32 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1wgv s LEU 51 Cb -0.17 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.38 1wgv s LEU 51 CO -0.07 0.11 0.00 -1.20 0.23 0.00 0.00 176.35 175.42 1wgv n SER 52 N 3.89 0.37 0.00 2.29 7.64 -1.25 -5.03 113.62 121.53 1wgv n SER 52 Ca -0.18 0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1wgv n SER 52 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 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 -3.20 0.00 -1.14 6.43 3.41 -1.26 -4.62 113.62 113.25 1wgv n SER 53 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.57 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 -1.54 -0.16 0.00 0.00 175.04 173.34 1wgv n SER 54 N 0.00 2.74 -3.59 4.04 3.41 -1.26 -0.60 113.62 118.37 1wgv n SER 54 Ca 0.00 -3.76 -0.15 0.00 -0.26 0.00 0.00 58.87 54.70 1wgv n SER 54 Cb 0.00 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.43 1wgv n SER 54 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1wgv s SER 55 N -3.33 -0.47 -0.01 4.04 1.04 -1.26 -0.92 113.70 112.80 1wgv s SER 55 Ca 0.42 0.32 -0.14 0.00 0.48 0.00 0.00 55.95 57.02 1wgv s SER 55 Cb 0.38 0.48 0.02 0.00 0.10 0.00 0.00 66.02 67.00 1wgv s SER 55 CO -0.04 -0.65 0.30 -0.51 0.98 0.00 0.00 173.24 173.33 1wgv s ILE 56 N -1.92 0.06 -0.02 -1.02 -1.16 -0.95 -3.81 121.20 112.38 1wgv s ILE 56 Ca -0.08 -0.50 0.00 0.00 -0.51 0.00 0.00 60.65 59.56 1wgv s ILE 56 Cb -0.01 -0.62 0.03 0.00 0.61 0.00 0.00 42.46 42.46 1wgv s ILE 56 CO 0.03 -0.27 0.01 -0.60 -2.81 0.00 0.00 174.94 171.30 1wgv s ARG 57 N -1.40 0.12 -0.31 3.50 3.52 -1.18 -0.72 118.95 122.48 1wgv s ARG 57 Ca -0.13 0.12 -0.03 0.00 -0.13 0.00 0.00 55.73 55.56 1wgv s ARG 57 Cb -0.05 -0.34 0.11 0.00 -1.56 0.00 0.00 34.95 33.11 1wgv s ARG 57 CO 0.04 -0.14 0.15 0.08 -0.81 0.00 0.00 175.30 174.62 1wgv s VAL 58 N 0.97 -0.01 0.02 7.11 1.01 -1.25 -3.25 120.40 125.00 1wgv s VAL 58 Ca -0.09 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 60.92 1wgv s VAL 58 Cb -0.12 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 1wgv s VAL 58 CO -0.02 -0.80 -0.16 0.00 0.00 0.00 0.00 175.10 174.11 1wgv s ALA 59 N 1.82 1.37 -0.07 5.51 0.00 -1.11 0.16 121.76 129.43 1wgv s ALA 59 Ca 0.11 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1wgv s ALA 59 Cb -0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1wgv s ALA 59 CO -0.27 0.31 -0.14 0.00 0.00 0.00 0.00 175.76 175.66 1wgv s MET 60 N -0.80 2.70 0.33 0.00 0.23 0.34 0.70 119.30 122.81 1wgv s MET 60 Ca 0.05 -0.70 -0.29 0.00 -1.03 0.00 0.00 55.69 53.72 1wgv s MET 60 Cb -0.07 -2.43 -0.10 0.00 -1.53 0.00 0.00 34.83 30.70 1wgv s MET 60 CO 0.01 0.52 1.29 -0.51 -2.03 0.00 0.00 175.02 174.30 1wgv s LEU 61 N -0.47 4.43 0.00 0.18 1.43 0.54 0.11 118.68 124.90 1wgv s LEU 61 Ca 0.06 2.66 0.04 0.00 -1.03 0.00 0.00 54.13 55.86 1wgv s LEU 61 Cb -0.12 -3.66 0.04 0.00 0.03 0.00 0.00 46.19 42.48 1wgv s LEU 61 CO 0.02 -0.52 0.29 -0.62 0.23 0.00 0.00 176.35 175.75 1wgv n GLU 62 N 0.79 0.95 0.24 1.70 -0.58 0.45 -4.85 120.64 119.35 1wgv n GLU 62 Ca 0.00 -1.56 0.13 0.00 -0.42 0.00 0.00 57.16 55.31 1wgv n GLU 62 Cb 0.42 0.03 0.50 0.00 -0.57 0.00 0.00 31.44 31.82 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 0.00 -0.69 3.49 5.08 -1.97 -3.31 114.58 117.18 1wgv h GLU 63 Ca -0.15 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.90 1wgv h GLU 63 Cb 0.60 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.55 1wgv h GLU 63 CO 0.22 0.11 -0.88 -1.71 -1.00 0.00 0.00 179.01 175.75 1wgv n ASN 64 N -3.21 0.10 0.00 1.42 2.85 -1.26 -5.10 115.26 110.06 1wgv n ASN 64 Ca 0.01 -2.69 0.00 0.00 -0.11 0.00 0.00 54.58 51.79 1wgv n ASN 64 Cb 0.40 0.09 0.00 0.00 1.24 0.00 0.00 39.78 41.52 1wgv n ASN 64 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1wgv n GLY 65 N -0.20 0.41 3.43 8.20 0.00 -1.25 -5.13 105.19 110.66 1wgv n GLY 65 Ca 0.06 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.64 1.61 0.00 -1.26 0.17 120.64 118.48 1wgv n GLU 66 Ca 0.00 -2.23 -0.15 0.00 0.00 0.00 0.00 57.16 54.78 1wgv n GLU 66 Cb 0.00 2.59 -0.07 0.00 0.00 0.00 0.00 31.44 33.95 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 -2.25 0.84 -0.38 3.44 3.52 0.12 -4.70 118.95 119.53 1wgv s ARG 67 Ca 0.18 0.23 -0.19 0.00 -0.13 0.00 0.00 55.73 55.82 1wgv s ARG 67 Cb -0.04 0.39 0.01 0.00 -1.56 0.00 0.00 34.95 33.75 1wgv s ARG 67 CO 0.13 -0.22 0.57 0.08 -0.81 0.00 0.00 175.30 175.05 1wgv s VAL 68 N -0.89 4.94 -0.06 7.11 1.01 -1.26 0.13 120.40 131.37 1wgv s VAL 68 Ca -0.09 0.28 -0.25 0.00 0.00 0.00 0.00 61.98 61.92 1wgv s VAL 68 Cb -0.03 -4.06 -0.20 0.00 0.00 0.00 0.00 36.38 32.09 1wgv s VAL 68 CO 0.06 -0.36 1.01 -0.07 0.00 0.00 0.00 175.10 175.75 1wgv h LEU 69 N 9.32 -0.05 0.00 3.92 3.38 0.11 -3.47 115.31 128.52 1wgv h LEU 69 Ca -0.27 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1wgv h LEU 69 Cb 1.11 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1wgv h LEU 69 CO 0.82 0.58 0.00 0.80 0.09 0.00 0.00 178.44 180.73 1wgv n MET 70 N -4.81 0.00 -1.66 1.13 0.00 -0.73 -4.51 117.12 106.54 1wgv n MET 70 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.61 1wgv n MET 70 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.53 1wgv n MET 70 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1wgv n GLU 71 N 0.00 -4.46 0.00 2.12 2.13 -1.26 -4.78 120.64 114.39 1wgv n GLU 71 Ca 0.00 3.41 0.00 0.00 0.66 0.00 0.00 57.16 61.23 1wgv n GLU 71 Cb 0.00 -4.09 0.00 0.00 0.27 0.00 0.00 31.44 27.62 1wgv n GLU 71 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wgv n GLY 72 N -1.94 4.17 3.68 8.31 0.00 0.10 -4.92 105.19 114.58 1wgv n GLY 72 Ca 0.00 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.99 4.24 0.76 1.61 -2.85 -1.26 -2.23 119.74 117.02 1wgv s LYS 73 Ca 0.00 2.10 -0.13 0.00 -1.00 0.00 0.00 55.97 56.94 1wgv s LYS 73 Cb 0.00 -3.64 0.05 0.00 -2.06 0.00 0.00 37.83 32.19 1wgv s LYS 73 CO 0.00 -0.66 1.14 -0.51 0.10 0.00 0.00 175.35 175.41 1wgv s LEU 74 N 2.70 3.17 0.12 2.77 1.43 -0.10 -1.07 118.68 127.71 1wgv s LEU 74 Ca 0.68 2.08 -0.10 0.00 -1.03 0.00 0.00 54.13 55.76 1wgv s LEU 74 Cb -0.34 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.22 1wgv s LEU 74 CO 0.28 -2.19 1.33 0.71 0.23 0.00 0.00 176.35 176.72 1wgv h THR 75 N -0.73 1.30 -4.51 5.49 1.35 -1.38 -3.41 112.91 111.01 1wgv h THR 75 Ca -0.45 -2.04 -0.43 0.00 -0.55 0.00 0.00 66.41 62.94 1wgv h THR 75 Cb 1.26 2.04 -0.09 0.00 -1.73 0.00 0.00 68.15 69.63 1wgv h THR 75 CO 0.50 0.64 -0.34 1.41 -0.25 0.00 0.00 175.52 177.48 1wgv n HIS 76 N -3.90 0.39 -2.51 4.73 8.25 -1.26 -4.99 115.22 115.92 1wgv n HIS 76 Ca -0.07 -1.85 -0.23 0.00 -0.26 0.00 0.00 57.72 55.31 1wgv n HIS 76 Cb 0.75 -0.09 0.04 0.00 1.12 0.00 0.00 29.99 31.81 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 -3.19 2.52 0.15 -0.41 1.02 -1.26 -4.21 119.74 114.36 1wgv s LYS 77 Ca 0.09 -0.52 -0.09 0.00 0.02 0.00 0.00 55.97 55.47 1wgv s LYS 77 Cb 0.00 -2.38 -0.00 0.00 -0.52 0.00 0.00 37.83 34.93 1wgv s LYS 77 CO 0.06 -0.83 0.28 0.96 -0.92 0.00 0.00 175.35 174.90 1wgv s ILE 78 N -2.91 0.08 -1.16 2.17 -5.25 0.24 -3.95 121.20 110.41 1wgv s ILE 78 Ca 0.57 -1.30 -0.11 0.00 -0.99 0.00 0.00 60.65 58.82 1wgv s ILE 78 Cb -0.10 -1.72 0.23 0.00 2.95 0.00 0.00 42.46 43.81 1wgv s ILE 78 CO 0.41 -0.35 1.28 -3.20 -1.79 0.00 0.00 174.94 171.29 1wgv n ASN 79 N -0.19 5.40 -0.32 4.36 2.85 -1.22 -4.61 115.26 121.52 1wgv n ASN 79 Ca -0.09 -3.02 0.06 0.00 -0.11 0.00 0.00 54.58 51.42 1wgv n ASN 79 Cb 0.63 -1.47 0.13 0.00 1.24 0.00 0.00 39.78 40.31 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 3.54 -0.38 -0.16 -0.44 -2.24 -1.26 0.11 114.28 113.45 1wgv n THR 80 Ca 0.30 2.04 -0.06 0.00 -2.27 0.00 0.00 64.05 64.07 1wgv n THR 80 Cb 0.41 -2.83 0.00 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 -0.18 -0.05 -0.78 4.81 -1.94 0.17 114.58 116.61 1wgv h GLU 81 Ca 0.43 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.54 1wgv h GLU 81 Cb 0.67 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1wgv h GLU 81 CO -0.92 -0.12 -0.58 1.03 -0.73 0.00 0.00 179.01 177.69 1wgv h SER 82 N -0.19 0.16 -4.28 1.04 0.87 0.22 -3.44 113.55 107.94 1wgv h SER 82 Ca 0.21 -0.09 -0.50 0.00 -1.23 0.00 0.00 61.79 60.18 1wgv h SER 82 Cb 0.53 -0.05 0.07 0.00 -0.44 0.00 0.00 62.40 62.51 1wgv h SER 82 CO -0.60 0.70 0.38 -0.44 -0.53 0.00 0.00 176.83 176.34 1wgv s SER 83 N -6.88 5.85 0.38 6.23 0.01 0.30 -4.80 113.70 114.79 1wgv s SER 83 Ca -0.03 1.63 -0.10 0.00 1.31 0.00 0.00 55.95 58.76 1wgv s SER 83 Cb 0.12 -2.50 0.04 0.00 0.21 0.00 0.00 66.02 63.89 1wgv s SER 83 CO 0.78 -1.12 0.67 -1.48 0.41 0.00 0.00 173.24 172.49 1wgv s LEU 84 N -4.94 0.45 -0.18 2.44 0.05 -0.07 -4.80 118.68 111.62 1wgv s LEU 84 Ca 0.59 -1.32 -0.07 0.00 0.05 0.00 0.00 54.13 53.39 1wgv s LEU 84 Cb -0.13 2.29 0.08 0.00 -2.05 0.00 0.00 46.19 46.37 1wgv s LEU 84 CO 0.46 -1.55 0.39 -1.66 -0.55 0.00 0.00 176.35 173.43 1wgv s TRP 85 N -2.53 -0.69 -0.14 3.48 1.48 -1.26 -0.81 118.94 118.47 1wgv s TRP 85 Ca 0.22 1.37 0.02 0.00 -1.06 0.00 0.00 56.10 56.65 1wgv s TRP 85 Cb -0.03 0.23 0.00 0.00 -1.16 0.00 0.00 33.47 32.51 1wgv s TRP 85 CO 0.16 -0.43 -0.19 -1.12 -4.06 0.00 0.00 176.95 171.31 1wgv s SER 86 N 2.35 3.43 0.10 -2.66 0.01 0.13 -4.97 113.70 112.08 1wgv s SER 86 Ca -0.03 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 56.58 1wgv s SER 86 Cb -0.11 -1.50 -0.06 0.00 0.21 0.00 0.00 66.02 64.55 1wgv s SER 86 CO -0.12 0.10 0.49 -0.22 0.41 0.00 0.00 173.24 173.91 1wgv s LEU 87 N 0.69 4.39 -0.05 2.44 1.98 -1.26 0.02 118.68 126.88 1wgv s LEU 87 Ca -0.09 1.01 0.05 0.00 -2.89 0.00 0.00 54.13 52.21 1wgv s LEU 87 Cb -0.16 -3.04 -0.00 0.00 0.66 0.00 0.00 46.19 43.65 1wgv s LEU 87 CO 0.01 0.18 -0.19 -1.61 -1.89 0.00 0.00 176.35 172.85 1wgv s GLU 88 N -1.70 1.95 -0.10 1.98 0.41 -1.05 -4.95 118.70 115.24 1wgv s GLU 88 Ca 0.33 -0.67 -0.30 0.00 -0.41 0.00 0.00 54.97 53.92 1wgv s GLU 88 Cb -0.16 -1.68 -0.03 0.00 -1.78 0.00 0.00 34.13 30.49 1wgv s GLU 88 CO 0.18 0.28 1.24 -1.25 -0.49 0.00 0.00 175.26 175.22 1wgv s PRO 89 N -0.01 4.30 -1.10 0.39 0.04 -1.26 -3.68 135.00 133.67 1wgv s PRO 89 Ca -0.04 1.69 -0.14 0.00 0.04 0.00 0.00 61.00 62.56 1wgv s PRO 89 Cb -0.12 -3.65 -0.04 0.00 0.04 0.00 0.00 34.50 30.74 1wgv s PRO 89 CO 0.02 -0.57 0.85 0.41 0.04 0.00 0.00 177.00 177.76 1wgv n GLY 90 N 3.49 -1.06 0.00 0.56 0.00 -0.68 -4.87 105.19 102.63 1wgv n GLY 90 Ca 0.12 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.65 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 -3.75 0.00 -3.84 1.61 5.02 -1.24 -4.99 118.16 110.96 1wgv n LYS 91 Ca -0.09 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.15 1wgv n LYS 91 Cb 0.61 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.63 1wgv n LYS 91 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wgv s VAL 93 N -2.41 4.57 -0.16 0.00 1.01 0.53 -2.53 120.40 121.41 1wgv s VAL 93 Ca 0.18 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 1wgv s VAL 93 Cb -0.04 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1wgv s VAL 93 CO 0.08 0.50 0.11 -0.22 0.00 0.00 0.00 175.10 175.57 1wgv s LEU 94 N 0.06 4.14 -0.19 3.92 1.98 0.10 -1.36 118.68 127.33 1wgv s LEU 94 Ca 0.04 0.29 -0.05 0.00 -2.89 0.00 0.00 54.13 51.52 1wgv s LEU 94 Cb -0.12 -2.03 0.07 0.00 0.66 0.00 0.00 46.19 44.76 1wgv s LEU 94 CO 0.01 0.29 0.10 -0.69 -1.89 0.00 0.00 176.35 174.16 1wgv s VAL 95 N -0.29 -0.08 -0.47 1.68 1.01 -1.11 0.19 120.40 121.35 1wgv s VAL 95 Ca 0.10 -0.27 -0.18 0.00 0.00 0.00 0.00 61.98 61.62 1wgv s VAL 95 Cb -0.12 -0.65 0.04 0.00 0.00 0.00 0.00 36.38 35.66 1wgv s VAL 95 CO 0.01 -0.36 0.54 0.20 0.00 0.00 0.00 175.10 175.49 1wgv s ASN 96 N 2.13 6.22 -0.15 3.32 0.02 0.01 -3.17 114.94 123.33 1wgv s ASN 96 Ca 0.03 -0.80 -0.13 0.00 -1.02 0.00 0.00 52.86 50.94 1wgv s ASN 96 Cb -0.16 -2.26 -0.05 0.00 0.02 0.00 0.00 41.25 38.80 1wgv s ASN 96 CO -0.14 -0.75 0.28 -0.76 0.02 0.00 0.00 177.10 175.74 1wgv s LEU 97 N 2.39 4.27 0.41 0.60 1.43 -0.93 -0.90 118.68 125.97 1wgv s LEU 97 Ca 0.14 0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 53.69 1wgv s LEU 97 Cb -0.18 -2.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 1wgv s LEU 97 CO 0.13 0.15 0.73 -0.55 0.23 0.00 0.00 176.35 177.04 1wgv s SER 98 N 0.19 6.39 0.01 2.29 0.15 -1.26 -2.18 113.70 119.29 1wgv s SER 98 Ca 0.16 0.94 -0.18 0.00 0.70 0.00 0.00 55.95 57.57 1wgv s SER 98 Cb -0.13 -2.24 -0.06 0.00 -1.71 0.00 0.00 66.02 61.88 1wgv s SER 98 CO 0.04 -0.43 0.52 -0.54 1.20 0.00 0.00 173.24 174.03 1wgv s LYS 99 N -4.20 4.16 -0.46 5.44 1.02 -1.26 -3.46 119.74 120.98 1wgv s LYS 99 Ca 0.48 0.61 0.03 0.00 0.02 0.00 0.00 55.97 57.10 1wgv s LYS 99 Cb -0.10 -3.28 0.13 0.00 -0.52 0.00 0.00 37.83 34.06 1wgv s LYS 99 CO 0.37 0.54 0.23 0.08 -0.92 0.00 0.00 175.35 175.65 1wgv s VAL 100 N -0.69 1.88 0.00 3.17 1.01 -1.25 -4.58 120.40 119.93 1wgv s VAL 100 Ca 0.28 -2.78 0.00 0.00 0.00 0.00 0.00 61.98 59.47 1wgv s VAL 100 Cb -0.18 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.88 1wgv s VAL 100 CO 0.16 -0.83 0.00 0.61 0.00 0.00 0.00 175.10 175.04 1wgv n GLY 101 N 3.48 -0.88 3.56 4.51 0.00 -1.26 -4.75 105.19 109.84 1wgv n GLY 101 Ca 0.06 -1.50 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 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 -3.75 2.39 0.14 1.61 -1.05 -1.26 -4.91 118.70 111.86 1wgv s GLU 102 Ca 0.00 0.27 0.06 0.00 -0.15 0.00 0.00 54.97 55.15 1wgv s GLU 102 Cb 0.00 -4.77 -0.04 0.00 -0.44 0.00 0.00 34.13 28.88 1wgv s GLU 102 CO 0.00 -3.34 -0.14 0.71 0.95 0.00 0.00 175.26 173.44 1wgv s TYR 103 N 10.71 1.46 -0.50 4.83 2.02 -1.26 -5.11 117.35 129.49 1wgv s TYR 103 Ca 0.75 -0.57 -0.17 0.00 -0.37 0.00 0.00 57.07 56.71 1wgv s TYR 103 Cb -0.10 -0.74 0.08 0.00 -0.40 0.00 0.00 41.96 40.80 1wgv s TYR 103 CO 0.10 0.18 0.49 -0.46 -1.57 0.00 0.00 175.55 174.28 1wgv s TRP 104 N -2.37 3.18 -0.90 2.71 -0.11 -1.26 -5.00 118.94 115.20 1wgv s TRP 104 Ca 0.12 -0.92 -0.25 0.00 1.22 0.00 0.00 56.10 56.27 1wgv s TRP 104 Cb -0.04 -3.44 0.04 0.00 -1.50 0.00 0.00 33.47 28.54 1wgv s TRP 104 CO 0.03 -0.93 1.37 -1.58 -4.62 0.00 0.00 176.95 171.22 1wgv s TRP 105 N 1.92 2.44 -1.28 5.86 0.52 -1.26 -4.76 118.94 122.39 1wgv s TRP 105 Ca 0.07 -0.53 0.28 0.00 0.02 0.00 0.00 56.10 55.94 1wgv s TRP 105 Cb -0.24 -4.66 1.15 0.00 -1.15 0.00 0.00 33.47 28.57 1wgv s TRP 105 CO 0.07 -1.98 1.84 0.27 0.02 0.00 0.00 176.95 177.16 1wgv n ASN 106 N 9.03 0.24 -3.67 2.95 0.23 -1.26 -4.92 115.26 117.86 1wgv n ASN 106 Ca 0.20 -0.09 0.01 0.00 -0.53 0.00 0.00 54.58 54.18 1wgv n ASN 106 Cb 0.50 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 1wgv n ASN 106 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wgv s ALA 107 N -2.76 -2.19 -0.14 -2.53 0.00 -1.26 -0.96 121.76 111.91 1wgv s ALA 107 Ca 0.21 0.26 -0.10 0.00 0.00 0.00 0.00 51.96 52.33 1wgv s ALA 107 Cb 0.19 0.64 -0.06 0.00 0.00 0.00 0.00 23.12 23.89 1wgv s ALA 107 CO 0.53 -1.09 -0.04 0.82 0.00 0.00 0.00 175.76 175.98 1wgv h ILE 108 N 2.00 0.21 -1.88 0.00 1.08 -1.91 -3.42 117.51 113.58 1wgv h ILE 108 Ca -0.27 -1.22 -0.44 0.00 -0.39 0.00 0.00 64.86 62.54 1wgv h ILE 108 Cb 1.20 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.41 1wgv h ILE 108 CO 0.30 0.07 -0.36 -0.76 -0.69 0.00 0.00 178.15 176.71 1wgv s LEU 109 N -8.25 4.04 0.46 1.44 1.43 -1.26 -1.18 118.68 115.34 1wgv s LEU 109 Ca -0.13 -0.14 0.29 0.00 -1.03 0.00 0.00 54.13 53.12 1wgv s LEU 109 Cb 0.02 -2.77 1.05 0.00 0.03 0.00 0.00 46.19 44.52 1wgv s LEU 109 CO 0.24 -0.36 1.85 -0.33 0.23 0.00 0.00 176.35 177.98 1wgv h GLU 110 N 0.95 0.00 -0.84 1.70 5.08 -1.32 -2.70 114.58 117.45 1wgv h GLU 110 Ca -0.47 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 57.60 1wgv h GLU 110 Cb 1.25 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.33 1wgv h GLU 110 CO 0.54 0.00 0.37 0.41 -1.00 0.00 0.00 179.01 179.33 1wgv n GLY 111 N 0.34 3.75 3.50 -3.84 0.00 -1.26 -4.91 105.19 102.77 1wgv n GLY 111 Ca 0.02 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.90 2.56 0.52 1.61 -6.30 -1.02 -5.10 118.70 108.07 1wgv s GLU 112 Ca 0.52 -0.66 -0.23 0.00 -2.50 0.00 0.00 54.97 52.10 1wgv s GLU 112 Cb 0.42 -2.43 -0.06 0.00 0.00 0.00 0.00 34.13 32.06 1wgv s GLU 112 CO 0.12 0.63 1.37 0.39 0.02 0.00 0.00 175.26 177.79 1wgv n GLU 113 N 2.26 1.84 -2.40 4.30 1.02 -1.26 -4.86 120.64 121.54 1wgv n GLU 113 Ca -0.17 0.67 -0.43 0.00 -0.02 0.00 0.00 57.16 57.21 1wgv n GLU 113 Cb 0.52 -2.58 -0.02 0.00 -0.02 0.00 0.00 31.44 29.34 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 -2.74 4.08 0.90 3.49 0.04 -1.26 -4.59 135.00 134.92 1wgv s PRO 114 Ca 0.68 1.50 -0.15 0.00 0.04 0.00 0.00 61.00 63.08 1wgv s PRO 114 Cb -0.43 -3.83 -0.03 0.00 0.04 0.00 0.00 34.50 30.25 1wgv s PRO 114 CO 0.52 -0.91 0.12 0.44 0.04 0.00 0.00 177.00 177.21 1wgv n ILE 115 N 5.77 0.36 -2.80 0.56 -5.35 -0.14 -4.83 119.36 112.93 1wgv n ILE 115 Ca 0.15 -0.32 -0.44 0.00 -0.27 0.00 0.00 62.75 61.87 1wgv n ILE 115 Cb 0.46 -0.47 0.00 0.00 -1.74 0.00 0.00 39.64 37.88 1wgv n ILE 115 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1wgv n ASP 116 N 0.18 5.32 -0.25 7.28 9.92 -1.26 -4.97 116.55 132.76 1wgv n ASP 116 Ca 0.05 -3.06 0.00 0.00 -0.53 0.00 0.00 54.79 51.25 1wgv n ASP 116 Cb 0.53 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 1wgv n ASP 116 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1wgv n ILE 117 N 3.70 0.00 0.00 0.53 2.08 -1.26 -4.98 119.36 119.44 1wgv n ILE 117 Ca 0.35 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.66 1wgv n ILE 117 Cb 0.39 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.28 1wgv n ILE 117 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1wgv n ASP 118 N -3.73 0.00 -2.67 4.38 9.92 -1.26 -5.12 116.55 118.06 1wgv n ASP 118 Ca 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.23 1wgv n ASP 118 Cb 0.00 0.00 0.04 0.00 -0.64 0.00 0.00 41.12 40.52 1wgv n ASP 118 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1wgv n SER 119 N 0.00 -1.55 0.00 -2.24 7.64 -1.26 -5.16 113.62 111.05 1wgv n SER 119 Ca 0.00 -1.14 0.00 0.00 1.01 0.00 0.00 58.87 58.74 1wgv n SER 119 Cb 0.00 0.79 0.00 0.00 -1.01 0.00 0.00 64.21 63.99 1wgv n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgv n GLY 120 N 2.49 0.93 3.79 0.23 0.00 -1.26 -5.06 105.19 106.31 1wgv n GLY 120 Ca 0.11 -2.21 -0.29 0.00 0.00 0.00 0.00 46.02 43.62 1wgv n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wgv s PRO 121 N -1.18 1.35 0.14 1.61 0.04 -1.26 -4.96 135.00 130.74 1wgv s PRO 121 Ca 0.00 0.36 -0.30 0.00 0.04 0.00 0.00 61.00 61.10 1wgv s PRO 121 Cb 0.00 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 1wgv s PRO 121 CO 0.00 -2.07 1.56 1.03 0.04 0.00 0.00 177.00 177.57 1wgv h SER 122 N -1.41 -1.62 -2.07 6.66 0.87 -2.00 -3.44 113.55 110.54 1wgv h SER 122 Ca -0.50 0.22 0.20 0.00 -1.23 0.00 0.00 61.79 60.49 1wgv h SER 122 Cb 1.32 0.67 -0.33 0.00 -0.44 0.00 0.00 62.40 63.62 1wgv h SER 122 CO 0.62 -0.40 0.85 -0.55 -0.53 0.00 0.00 176.83 176.81 1wgv s SER 123 N -5.01 -0.04 0.00 6.23 0.15 -1.26 -5.15 113.70 108.62 1wgv s SER 123 Ca -0.15 0.07 0.29 0.00 0.70 0.00 0.00 55.95 56.86 1wgv s SER 123 Cb 0.10 0.45 1.17 0.00 -1.71 0.00 0.00 66.02 66.02 1wgv s SER 123 CO 0.63 -0.01 1.81 0.61 1.20 0.00 0.00 173.24 177.48