#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 -7.81 0.00 1.61 2.88 -1.26 -5.10 113.62 103.95 1wgv n SER 2 Ca 0.00 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 1wgv n SER 2 Cb 0.00 -4.25 0.00 0.00 -0.75 0.00 0.00 64.21 59.21 1wgv n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wgv n SER 3 N 1.43 0.00 -3.24 -3.46 7.64 -1.26 -5.16 113.62 109.57 1wgv n SER 3 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.92 1wgv n SER 3 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1wgv n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wgv s GLY 4 N 0.00 -0.05 -0.22 0.23 0.00 -1.26 -5.06 107.32 100.96 1wgv s GLY 4 Ca 0.00 3.21 -0.03 0.00 0.00 0.00 0.00 44.72 47.91 1wgv s GLY 4 CO 0.00 3.50 0.07 -1.26 0.00 0.00 0.00 173.10 175.41 1wgv n SER 5 N 4.99 -7.45 0.17 1.64 2.88 -1.26 -4.98 113.62 109.61 1wgv n SER 5 Ca -0.08 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 1wgv n SER 5 Cb 0.54 -3.94 0.00 0.00 -0.75 0.00 0.00 64.21 60.06 1wgv n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1wgv n SER 6 N 0.80 -2.07 -3.88 -3.46 2.88 -1.26 -5.07 113.62 101.56 1wgv n SER 6 Ca 0.00 0.62 -0.33 0.00 -1.33 0.00 0.00 58.87 57.83 1wgv n SER 6 Cb 0.23 2.06 0.01 0.00 -0.75 0.00 0.00 64.21 65.75 1wgv n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgv n GLY 7 N -0.14 -1.03 3.21 0.46 0.00 -1.26 -4.95 105.19 101.49 1wgv n GLY 7 Ca 0.00 0.46 0.04 0.00 0.00 0.00 0.00 46.02 46.51 1wgv n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wgv s GLN 8 N -5.92 0.50 0.36 1.61 1.11 -1.26 -5.03 119.66 111.03 1wgv s GLN 8 Ca 0.21 0.93 0.00 0.00 0.01 0.00 0.00 55.36 56.51 1wgv s GLN 8 Cb -0.11 0.53 0.00 0.00 -1.01 0.00 0.00 33.01 32.41 1wgv s GLN 8 CO 0.87 -0.48 0.00 1.17 0.01 0.00 0.00 175.29 176.86 1wgv n LYS 9 N 5.42 0.00 0.00 2.91 0.00 -1.26 -5.17 118.16 120.07 1wgv n LYS 9 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.27 1wgv n LYS 9 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.54 1wgv n LYS 9 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1wgv n ASN 10 N -3.32 0.00 -0.02 3.14 4.13 -1.26 -5.05 115.26 112.88 1wgv n ASN 10 Ca 0.00 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 56.10 1wgv n ASN 10 Cb 0.00 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.13 1wgv n ASN 10 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1wgv h PRO 11 N 0.00 0.32 0.00 3.52 0.13 -2.03 -3.47 132.00 130.47 1wgv h PRO 11 Ca 0.00 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1wgv h PRO 11 Cb 0.00 0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.21 1wgv h PRO 11 CO 0.00 0.99 0.00 -0.25 -0.23 0.00 0.00 178.00 178.51 1wgv n ASP 12 N -4.37 -0.79 -3.23 1.44 9.92 -1.26 -5.13 116.55 113.14 1wgv n ASP 12 Ca -0.09 0.21 0.03 0.00 -0.53 0.00 0.00 54.79 54.41 1wgv n ASP 12 Cb 0.57 1.02 -0.04 0.00 -0.64 0.00 0.00 41.12 42.03 1wgv n ASP 12 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1wgv s SER 13 N -2.00 -0.14 -0.85 -2.24 0.15 -1.26 -5.09 113.70 102.27 1wgv s SER 13 Ca 0.00 0.20 -0.06 0.00 0.70 0.00 0.00 55.95 56.78 1wgv s SER 13 Cb 0.00 1.16 0.21 0.00 -1.71 0.00 0.00 66.02 65.68 1wgv s SER 13 CO 0.00 -0.03 0.75 -0.47 1.20 0.00 0.00 173.24 174.69 1wgv s TYR 14 N 2.08 3.80 0.14 3.44 5.04 -1.26 -4.55 117.35 126.04 1wgv s TYR 14 Ca -0.00 -2.65 0.00 0.00 -2.44 0.00 0.00 57.07 51.98 1wgv s TYR 14 Cb -0.02 -3.47 0.00 0.00 0.35 0.00 0.00 41.96 38.82 1wgv s TYR 14 CO -0.16 -0.86 0.00 0.09 -1.34 0.00 0.00 175.55 173.28 1wgv n ASN 15 N 3.08 -1.28 0.00 4.32 4.13 -1.26 -5.17 115.26 119.08 1wgv n ASN 15 Ca 0.17 0.63 0.00 0.00 1.68 0.00 0.00 54.58 57.05 1wgv n ASN 15 Cb 0.40 1.53 0.00 0.00 -1.54 0.00 0.00 39.78 40.17 1wgv n ASN 15 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wgv n GLY 16 N -1.14 2.91 2.05 7.41 0.00 -1.26 -5.04 105.19 110.11 1wgv n GLY 16 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.53 -2.14 -3.54 4.61 0.00 -1.26 -4.87 120.51 111.78 1wgv n ALA 17 Ca 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 53.44 53.75 1wgv n ALA 17 Cb 0.00 -1.32 -0.09 0.00 0.00 0.00 0.00 19.45 18.05 1wgv n ALA 17 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wgv s VAL 18 N -0.49 -0.00 0.15 0.00 1.01 -1.26 -4.62 120.40 115.18 1wgv s VAL 18 Ca 0.00 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1wgv s VAL 18 Cb 0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1wgv s VAL 18 CO 0.00 0.01 -0.02 -0.13 0.00 0.00 0.00 175.10 174.96 1wgv s ARG 19 N 0.72 1.03 -1.03 2.72 1.81 -1.26 -5.05 118.95 117.89 1wgv s ARG 19 Ca -0.03 -1.48 -0.05 0.00 -1.72 0.00 0.00 55.73 52.45 1wgv s ARG 19 Cb -0.05 -0.25 0.12 0.00 -0.45 0.00 0.00 34.95 34.33 1wgv s ARG 19 CO -0.05 -0.10 2.46 -0.85 -0.68 0.00 0.00 175.30 176.08 1wgv n GLU 20 N -0.18 3.96 0.09 3.54 0.28 -1.26 -3.99 120.64 123.08 1wgv n GLU 20 Ca -0.08 -3.21 0.00 0.00 -0.16 0.00 0.00 57.16 53.71 1wgv n GLU 20 Cb 0.62 -2.47 0.00 0.00 1.43 0.00 0.00 31.44 31.03 1wgv n GLU 20 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1wgv n ASN 21 N 1.30 -1.43 -3.64 -1.84 5.15 -1.26 -5.13 115.26 108.41 1wgv n ASN 21 Ca 0.57 0.33 -0.07 0.00 -0.60 0.00 0.00 54.58 54.81 1wgv n ASN 21 Cb 0.34 1.61 -0.07 0.00 -0.53 0.00 0.00 39.78 41.13 1wgv n ASN 21 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1wgv s TYR 22 N -2.00 -1.00 0.42 1.20 -0.85 -1.26 -4.74 117.35 109.12 1wgv s TYR 22 Ca 0.00 2.03 -0.09 0.00 -0.52 0.00 0.00 57.07 58.49 1wgv s TYR 22 Cb 0.00 0.59 -0.06 0.00 0.38 0.00 0.00 41.96 42.87 1wgv s TYR 22 CO 0.00 -0.50 0.76 0.99 -1.52 0.00 0.00 175.55 175.28 1wgv s THR 23 N 1.53 4.84 0.13 -3.49 2.01 -1.15 -4.41 115.64 115.10 1wgv s THR 23 Ca -0.09 0.46 -0.25 0.00 0.31 0.00 0.00 61.69 62.12 1wgv s THR 23 Cb -0.05 -3.77 0.07 0.00 0.01 0.00 0.00 72.50 68.76 1wgv s THR 23 CO -0.18 -0.60 0.78 -1.66 -0.69 0.00 0.00 174.62 172.27 1wgv s TRP 24 N -2.46 -0.34 0.11 4.92 1.48 -1.26 -1.63 118.94 119.77 1wgv s TRP 24 Ca 0.50 0.08 -0.14 0.00 -1.06 0.00 0.00 56.10 55.48 1wgv s TRP 24 Cb -0.10 0.60 0.02 0.00 -1.16 0.00 0.00 33.47 32.83 1wgv s TRP 24 CO 0.35 -0.83 0.33 -1.12 -4.06 0.00 0.00 176.95 171.62 1wgv s SER 25 N -2.74 -0.12 -0.12 -2.66 0.01 -1.00 -4.87 113.70 102.21 1wgv s SER 25 Ca 0.06 -0.42 -0.00 0.00 1.31 0.00 0.00 55.95 56.90 1wgv s SER 25 Cb -0.02 0.43 -0.02 0.00 0.21 0.00 0.00 66.02 66.62 1wgv s SER 25 CO -0.05 -0.80 -0.11 -1.58 0.41 0.00 0.00 173.24 171.10 1wgv s GLN 26 N -3.77 3.27 0.52 12.44 0.74 -1.26 -2.71 119.66 128.88 1wgv s GLN 26 Ca 0.03 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 54.84 1wgv s GLN 26 Cb 0.03 -2.64 0.01 0.00 1.10 0.00 0.00 33.01 31.51 1wgv s GLN 26 CO -0.11 0.31 0.24 -0.51 -0.55 0.00 0.00 175.29 174.66 1wgv s ASP 27 N 0.11 4.43 0.33 6.67 1.01 0.12 -5.00 116.67 124.33 1wgv s ASP 27 Ca -0.05 -1.39 0.11 0.00 0.71 0.00 0.00 52.55 51.94 1wgv s ASP 27 Cb -0.14 0.39 1.01 0.00 1.01 0.00 0.00 42.92 45.18 1wgv s ASP 27 CO 0.04 -0.97 1.64 0.22 0.21 0.00 0.00 175.17 176.31 1wgv h TYR 28 N 1.02 0.68 0.00 4.23 5.03 -2.00 -3.30 116.97 122.64 1wgv h TYR 28 Ca -0.40 0.04 -0.19 0.00 2.58 0.00 0.00 58.73 60.76 1wgv h TYR 28 Cb 1.30 -0.14 -0.14 0.00 1.55 0.00 0.00 36.73 39.31 1wgv h TYR 28 CO 1.16 -0.26 -0.41 -2.37 -1.32 0.00 0.00 178.16 174.96 1wgv n THR 29 N -5.17 0.00 0.00 1.81 5.66 -1.26 -4.96 114.28 110.35 1wgv n THR 29 Ca 0.29 -1.36 0.00 0.00 -3.05 0.00 0.00 64.05 59.94 1wgv n THR 29 Cb 0.94 1.43 0.00 0.00 -1.55 0.00 0.00 70.33 71.15 1wgv n THR 29 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1wgv n ASP 30 N 1.60 0.00 -4.36 1.09 8.00 -1.24 -4.68 116.55 116.96 1wgv n ASP 30 Ca 0.08 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.38 1wgv n ASP 30 Cb 0.64 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.64 1wgv n ASP 30 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1wgv s LEU 31 N 0.00 2.54 -0.25 0.64 1.02 -1.16 -0.71 118.68 120.76 1wgv s LEU 31 Ca 0.00 -1.00 -0.02 0.00 0.02 0.00 0.00 54.13 53.13 1wgv s LEU 31 Cb 0.00 -0.75 0.12 0.00 0.02 0.00 0.00 46.19 45.57 1wgv s LEU 31 CO 0.00 -0.12 0.27 -1.61 0.02 0.00 0.00 176.35 174.91 1wgv s GLU 32 N -3.49 0.28 -0.27 1.70 2.02 -1.10 -3.31 118.70 114.53 1wgv s GLU 32 Ca 0.22 0.05 -0.06 0.00 0.02 0.00 0.00 54.97 55.21 1wgv s GLU 32 Cb -0.02 -0.85 0.00 0.00 0.10 0.00 0.00 34.13 33.36 1wgv s GLU 32 CO 0.08 -0.85 0.04 0.54 0.02 0.00 0.00 175.26 175.08 1wgv s VAL 33 N 2.36 3.75 -0.22 2.63 0.11 -1.23 -2.36 120.40 125.45 1wgv s VAL 33 Ca 0.09 -0.63 -0.06 0.00 -2.93 0.00 0.00 61.98 58.45 1wgv s VAL 33 Cb -0.15 -2.87 -0.03 0.00 -1.53 0.00 0.00 36.38 31.81 1wgv s VAL 33 CO -0.24 0.20 0.04 -0.13 -3.33 0.00 0.00 175.10 171.64 1wgv s ARG 34 N 1.49 3.70 -0.15 1.54 0.52 -0.65 -3.03 118.95 122.37 1wgv s ARG 34 Ca 0.03 -0.47 -0.06 0.00 -0.52 0.00 0.00 55.73 54.72 1wgv s ARG 34 Cb -0.16 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.06 1wgv s ARG 34 CO 0.01 -0.03 0.05 0.08 0.02 0.00 0.00 175.30 175.43 1wgv s VAL 35 N 1.15 4.70 0.21 3.52 1.01 -0.45 -2.94 120.40 127.60 1wgv s VAL 35 Ca 0.04 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 1wgv s VAL 35 Cb -0.14 -3.08 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 1wgv s VAL 35 CO 0.03 0.51 1.11 -2.16 0.00 0.00 0.00 175.10 174.58 1wgv s PRO 36 N -0.05 4.60 0.23 2.72 0.04 -1.26 0.19 135.00 141.47 1wgv s PRO 36 Ca 0.06 1.76 0.10 0.00 0.04 0.00 0.00 61.00 62.96 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 0.11 -0.18 0.14 0.04 0.00 0.00 177.00 177.12 1wgv s VAL 37 N -0.53 2.14 1.11 -0.36 -7.23 -1.00 -4.85 120.40 109.68 1wgv s VAL 37 Ca 0.48 -2.24 -0.18 0.00 -1.81 0.00 0.00 61.98 58.22 1wgv s VAL 37 Cb -0.30 -2.14 0.26 0.00 0.56 0.00 0.00 36.38 34.76 1wgv s VAL 37 CO 0.37 -0.42 1.23 -2.16 -0.31 0.00 0.00 175.10 173.81 1wgv s PRO 38 N -3.37 -0.50 -0.02 4.82 0.04 -1.26 -4.43 135.00 130.27 1wgv s PRO 38 Ca 0.25 -0.32 0.07 0.00 0.04 0.00 0.00 61.00 61.03 1wgv s PRO 38 Cb -0.04 -1.70 0.24 0.00 0.04 0.00 0.00 34.50 33.04 1wgv s PRO 38 CO 0.11 -3.19 1.12 1.63 0.04 0.00 0.00 177.00 176.71 1wgv n LYS 39 N -4.33 1.82 0.00 4.56 4.76 -1.26 -2.98 118.16 120.72 1wgv n LYS 39 Ca 0.15 -0.98 0.03 0.00 -2.87 0.00 0.00 58.31 54.65 1wgv n LYS 39 Cb 0.59 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 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 0.25 0.00 -3.52 2.13 1.44 -1.26 -4.83 115.22 109.42 1wgv n HIS 40 Ca 0.09 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.38 1wgv n HIS 40 Cb 0.32 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.33 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 -0.90 4.94 0.00 0.61 1.01 -1.16 -4.81 120.40 120.10 1wgv s VAL 41 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1wgv s VAL 41 Cb 0.05 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.66 1wgv s VAL 41 CO 0.13 -0.29 0.00 1.33 0.00 0.00 0.00 175.10 176.27 1wgv n VAL 42 N 5.09 0.00 -2.65 2.92 0.24 -1.26 -1.71 118.33 120.95 1wgv n VAL 42 Ca -0.11 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.82 1wgv n VAL 42 Cb 0.46 -0.36 -0.05 0.00 -1.47 0.00 0.00 33.84 32.42 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 -1.57 4.40 0.00 7.34 1.02 -1.26 -4.32 119.74 125.35 1wgv s LYS 43 Ca 0.00 1.44 0.29 0.00 0.02 0.00 0.00 55.97 57.72 1wgv s LYS 43 Cb 0.00 -2.71 1.59 0.00 -0.52 0.00 0.00 37.83 36.19 1wgv s LYS 43 CO 0.00 0.09 2.03 0.41 -0.92 0.00 0.00 175.35 176.95 1wgv n GLY 44 N 0.48 -1.06 0.06 -3.33 0.00 -1.26 -2.46 105.19 97.62 1wgv n GLY 44 Ca 0.03 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1wgv n GLY 44 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wgv n LYS 45 N -1.14 0.36 -0.05 1.61 2.85 -1.26 -3.64 118.16 116.90 1wgv n LYS 45 Ca 0.18 0.05 0.05 0.00 -1.05 0.00 0.00 58.31 57.54 1wgv n LYS 45 Cb 0.16 -1.67 0.21 0.00 -0.65 0.00 0.00 35.03 33.08 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 -2.17 1.26 -3.87 -1.58 6.02 -1.03 -4.75 117.38 111.27 1wgv n GLN 46 Ca 0.02 -0.40 -0.12 0.00 -0.01 0.00 0.00 57.00 56.49 1wgv n GLN 46 Cb 0.46 -1.18 -0.14 0.00 1.02 0.00 0.00 30.24 30.41 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 -1.87 0.00 -0.09 5.09 -7.23 -1.24 0.18 120.40 115.24 1wgv s VAL 47 Ca 0.16 -0.03 -0.02 0.00 -1.81 0.00 0.00 61.98 60.27 1wgv s VAL 47 Cb 0.08 -0.05 -0.03 0.00 0.56 0.00 0.00 36.38 36.93 1wgv s VAL 47 CO 0.12 -0.02 0.01 -0.44 -0.31 0.00 0.00 175.10 174.46 1wgv s SER 48 N -0.03 5.31 -0.05 4.85 0.01 0.61 -4.96 113.70 119.44 1wgv s SER 48 Ca -0.00 0.15 -0.02 0.00 1.31 0.00 0.00 55.95 57.39 1wgv s SER 48 Cb -0.00 -1.54 0.03 0.00 0.21 0.00 0.00 66.02 64.72 1wgv s SER 48 CO 0.00 0.37 0.05 -0.69 0.41 0.00 0.00 173.24 173.37 1wgv s VAL 49 N -0.81 0.00 -0.21 3.43 1.01 -1.26 -2.27 120.40 120.29 1wgv s VAL 49 Ca 0.12 0.36 -0.03 0.00 0.00 0.00 0.00 61.98 62.43 1wgv s VAL 49 Cb -0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 36.38 36.02 1wgv s VAL 49 CO 0.02 0.20 -0.07 0.00 0.00 0.00 0.00 175.10 175.25 1wgv s ALA 50 N 2.12 2.73 -0.15 5.51 0.00 -1.20 -4.95 121.76 125.82 1wgv s ALA 50 Ca 0.05 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 50.85 1wgv s ALA 50 Cb -0.12 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.40 1wgv s ALA 50 CO -0.04 -0.41 -0.20 -0.51 0.00 0.00 0.00 175.76 174.61 1wgv s LEU 51 N 1.43 2.21 0.16 0.00 1.43 -1.26 -3.00 118.68 119.64 1wgv s LEU 51 Ca 0.05 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1wgv s LEU 51 Cb -0.14 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1wgv s LEU 51 CO -0.05 0.07 0.00 -1.20 0.23 0.00 0.00 176.35 175.40 1wgv n SER 52 N 4.17 0.50 0.00 2.29 7.64 -1.24 -5.02 113.62 121.96 1wgv n SER 52 Ca -0.20 0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1wgv n SER 52 Cb 0.51 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 -3.42 0.00 -1.19 6.43 2.88 -1.26 -4.66 113.62 112.40 1wgv n SER 53 Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 1wgv n SER 53 Cb 0.03 0.00 0.18 0.00 -0.75 0.00 0.00 64.21 63.67 1wgv n SER 53 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1wgv n SER 54 N 0.00 2.74 -3.68 -3.46 3.41 -1.26 -2.47 113.62 108.90 1wgv n SER 54 Ca 0.00 -3.82 -0.14 0.00 -0.26 0.00 0.00 58.87 54.65 1wgv n SER 54 Cb 0.00 -0.60 -0.08 0.00 -0.26 0.00 0.00 64.21 63.27 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 -2.78 -0.47 0.02 4.04 1.04 -1.26 0.45 113.70 114.73 1wgv s SER 55 Ca 0.45 0.70 -0.04 0.00 0.48 0.00 0.00 55.95 57.54 1wgv s SER 55 Cb 0.40 0.73 -0.01 0.00 0.10 0.00 0.00 66.02 67.24 1wgv s SER 55 CO -0.02 -0.35 0.07 -0.51 0.98 0.00 0.00 173.24 173.41 1wgv s ILE 56 N -0.50 0.11 -0.01 -1.02 -1.16 -1.00 -3.67 121.20 113.95 1wgv s ILE 56 Ca -0.06 -0.90 -0.00 0.00 -0.51 0.00 0.00 60.65 59.17 1wgv s ILE 56 Cb -0.03 -0.54 0.02 0.00 0.61 0.00 0.00 42.46 42.52 1wgv s ILE 56 CO 0.04 -0.50 0.02 -0.60 -2.81 0.00 0.00 174.94 171.09 1wgv s ARG 57 N -1.82 -0.02 -0.30 3.50 3.52 -1.16 -2.46 118.95 120.20 1wgv s ARG 57 Ca -0.12 0.11 -0.03 0.00 -0.13 0.00 0.00 55.73 55.56 1wgv s ARG 57 Cb -0.06 -0.14 0.11 0.00 -1.56 0.00 0.00 34.95 33.29 1wgv s ARG 57 CO -0.01 -0.10 0.14 0.08 -0.81 0.00 0.00 175.30 174.60 1wgv s VAL 58 N 0.61 0.08 0.13 7.11 1.01 0.48 -3.23 120.40 126.59 1wgv s VAL 58 Ca -0.05 -1.01 0.09 0.00 0.00 0.00 0.00 61.98 61.01 1wgv s VAL 58 Cb -0.07 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1wgv s VAL 58 CO -0.02 -0.77 -0.23 0.00 0.00 0.00 0.00 175.10 174.09 1wgv s ALA 59 N 1.85 2.10 0.04 5.51 0.00 -0.96 0.12 121.76 130.42 1wgv s ALA 59 Ca 0.11 -1.40 0.05 0.00 0.00 0.00 0.00 51.96 50.72 1wgv s ALA 59 Cb -0.17 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 1wgv s ALA 59 CO -0.29 0.40 -0.16 0.00 0.00 0.00 0.00 175.76 175.72 1wgv s MET 60 N -2.20 1.05 -0.01 0.00 0.23 0.10 -0.28 119.30 118.19 1wgv s MET 60 Ca 0.12 -0.78 -0.30 0.00 -1.03 0.00 0.00 55.69 53.70 1wgv s MET 60 Cb -0.09 -1.08 -0.03 0.00 -1.53 0.00 0.00 34.83 32.10 1wgv s MET 60 CO 0.06 0.27 1.06 -0.51 -2.03 0.00 0.00 175.02 173.87 1wgv s LEU 61 N -1.09 4.34 -0.51 0.18 1.43 0.48 -0.07 118.68 123.45 1wgv s LEU 61 Ca 0.03 1.73 0.02 0.00 -1.03 0.00 0.00 54.13 54.88 1wgv s LEU 61 Cb -0.08 -3.57 0.48 0.00 0.03 0.00 0.00 46.19 43.05 1wgv s LEU 61 CO 0.01 -0.37 1.73 -0.62 0.23 0.00 0.00 176.35 177.33 1wgv n GLU 62 N 4.25 2.84 0.00 1.70 -0.58 0.50 -4.88 120.64 124.47 1wgv n GLU 62 Ca 0.08 -3.51 0.00 0.00 -0.42 0.00 0.00 57.16 53.31 1wgv n GLU 62 Cb 0.49 -2.23 0.00 0.00 -0.57 0.00 0.00 31.44 29.13 1wgv n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1wgv n GLU 63 N -0.90 0.00 0.12 3.49 1.02 -1.26 -3.36 120.64 119.75 1wgv n GLU 63 Ca 0.54 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.71 1wgv n GLU 63 Cb 0.87 0.00 0.40 0.00 -0.02 0.00 0.00 31.44 32.69 1wgv n GLU 63 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1wgv h ASN 64 N 0.00 0.22 0.00 1.62 4.21 -2.01 -3.47 115.58 116.15 1wgv h ASN 64 Ca 0.00 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.47 1wgv h ASN 64 Cb 0.00 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.14 1wgv h ASN 64 CO 0.00 0.37 0.00 0.61 -1.29 0.00 0.00 177.43 177.12 1wgv n GLY 65 N -0.91 2.99 3.79 2.83 0.00 -1.21 -5.19 105.19 107.48 1wgv n GLY 65 Ca -0.01 0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 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 4.14 1.89 -0.09 1.61 1.03 -1.26 0.19 118.70 126.20 1wgv s GLU 66 Ca 0.00 -1.19 -0.12 0.00 0.03 0.00 0.00 54.97 53.69 1wgv s GLU 66 Cb 0.00 0.59 0.03 0.00 -0.80 0.00 0.00 34.13 33.95 1wgv s GLU 66 CO 0.00 -0.86 0.32 0.50 -1.33 0.00 0.00 175.26 173.89 1wgv s ARG 67 N -3.44 0.45 -0.70 -4.83 3.52 0.90 -4.78 118.95 110.08 1wgv s ARG 67 Ca 0.15 0.27 -0.22 0.00 -0.13 0.00 0.00 55.73 55.79 1wgv s ARG 67 Cb -0.05 0.21 0.07 0.00 -1.56 0.00 0.00 34.95 33.63 1wgv s ARG 67 CO 0.09 -0.08 1.01 0.08 -0.81 0.00 0.00 175.30 175.59 1wgv s VAL 68 N -0.25 4.31 0.05 7.11 1.01 -1.26 0.02 120.40 131.40 1wgv s VAL 68 Ca -0.04 -0.44 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 1wgv s VAL 68 Cb -0.03 -4.72 -0.17 0.00 0.00 0.00 0.00 36.38 31.46 1wgv s VAL 68 CO 0.01 -1.50 1.51 -0.07 0.00 0.00 0.00 175.10 175.05 1wgv h LEU 69 N 11.40 -0.47 -7.63 3.92 3.38 0.61 -3.44 115.31 123.08 1wgv h LEU 69 Ca -0.23 -0.05 -0.29 0.00 0.09 0.00 0.00 57.88 57.39 1wgv h LEU 69 Cb 1.06 0.12 -0.32 0.00 0.09 0.00 0.00 40.66 41.62 1wgv h LEU 69 CO 1.19 -0.24 -0.73 -0.32 0.09 0.00 0.00 178.44 178.42 1wgv s MET 70 N -5.58 0.09 -0.05 1.13 0.00 -0.29 -4.77 119.30 109.84 1wgv s MET 70 Ca -0.15 0.08 -0.30 0.00 0.00 0.00 0.00 55.69 55.32 1wgv s MET 70 Cb 0.03 -0.25 0.09 0.00 0.00 0.00 0.00 34.83 34.70 1wgv s MET 70 CO 0.60 -0.09 0.76 -2.00 0.00 0.00 0.00 175.02 174.29 1wgv s GLU 71 N 0.66 0.95 0.00 4.11 -6.30 -1.26 0.18 118.70 117.05 1wgv s GLU 71 Ca -0.06 0.09 0.00 0.00 -2.50 0.00 0.00 54.97 52.50 1wgv s GLU 71 Cb -0.09 0.45 0.00 0.00 0.00 0.00 0.00 34.13 34.49 1wgv s GLU 71 CO -0.02 -0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.35 1wgv n GLY 72 N 0.61 3.72 3.62 -1.50 0.00 -1.03 -5.03 105.19 105.58 1wgv n GLY 72 Ca -0.16 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.46 3.80 1.05 1.61 -2.85 -1.26 -2.36 119.74 117.28 1wgv s LYS 73 Ca 0.00 0.98 -0.19 0.00 -1.00 0.00 0.00 55.97 55.75 1wgv s LYS 73 Cb 0.00 -3.90 0.05 0.00 -2.06 0.00 0.00 37.83 31.91 1wgv s LYS 73 CO 0.00 -1.27 -0.30 1.28 0.10 0.00 0.00 175.35 175.16 1wgv n LEU 74 N 7.87 -2.29 0.03 2.77 4.77 0.17 -3.35 117.00 126.98 1wgv n LEU 74 Ca 0.14 -0.16 -0.21 0.00 -0.03 0.00 0.00 56.01 55.76 1wgv n LEU 74 Cb 0.48 -0.79 -0.14 0.00 -2.33 0.00 0.00 43.42 40.63 1wgv n LEU 74 CO 0.66 -2.94 -0.66 0.71 -1.33 0.00 0.00 177.39 173.84 1wgv h THR 75 N -1.96 0.79 -1.93 -5.08 1.35 -1.38 -3.42 112.91 101.27 1wgv h THR 75 Ca -0.43 -2.46 -0.59 0.00 -0.55 0.00 0.00 66.41 62.38 1wgv h THR 75 Cb 1.20 2.61 -0.13 0.00 -1.73 0.00 0.00 68.15 70.11 1wgv h THR 75 CO 0.28 0.86 -0.53 -1.00 -0.25 0.00 0.00 175.52 174.87 1wgv s HIS 76 N -2.57 1.88 0.54 4.73 3.76 -1.26 -5.07 115.29 117.30 1wgv s HIS 76 Ca -0.18 -1.10 -0.02 0.00 -0.15 0.00 0.00 55.06 53.61 1wgv s HIS 76 Cb 0.06 -1.35 0.01 0.00 1.11 0.00 0.00 32.58 32.41 1wgv s HIS 76 CO 0.81 -0.05 0.79 0.15 -0.85 0.00 0.00 174.74 175.59 1wgv s LYS 77 N -3.79 2.83 0.09 1.40 1.02 -1.26 -4.23 119.74 115.80 1wgv s LYS 77 Ca 0.21 -0.39 0.02 0.00 0.02 0.00 0.00 55.97 55.83 1wgv s LYS 77 Cb 0.04 -2.42 -0.01 0.00 -0.52 0.00 0.00 37.83 34.91 1wgv s LYS 77 CO 0.11 -0.58 0.08 0.44 -0.92 0.00 0.00 175.35 174.49 1wgv n ILE 78 N -2.36 0.00 -3.63 2.17 -6.64 -1.03 -4.30 119.36 103.57 1wgv n ILE 78 Ca 0.04 -0.66 -0.35 0.00 -1.77 0.00 0.00 62.75 60.01 1wgv n ILE 78 Cb 0.58 0.33 -0.07 0.00 -1.44 0.00 0.00 39.64 39.05 1wgv n ILE 78 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 1wgv n ASN 79 N -2.60 4.14 0.11 7.28 2.85 0.09 -4.75 115.26 122.37 1wgv n ASN 79 Ca 0.02 -3.17 0.18 0.00 -0.11 0.00 0.00 54.58 51.50 1wgv n ASN 79 Cb 0.17 -1.01 0.56 0.00 1.24 0.00 0.00 39.78 40.74 1wgv n ASN 79 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1wgv h THR 80 N 4.00 0.13 -0.15 -0.44 1.35 -1.86 1.77 112.91 117.70 1wgv h THR 80 Ca 0.17 0.00 -0.18 0.00 -0.55 0.00 0.00 66.41 65.85 1wgv h THR 80 Cb 0.78 0.38 0.01 0.00 -1.73 0.00 0.00 68.15 67.59 1wgv h THR 80 CO 0.86 0.00 -0.59 -0.08 -0.25 0.00 0.00 175.52 175.46 1wgv h GLU 81 N 0.00 0.67 -0.00 4.72 4.57 -1.95 -3.18 114.58 119.41 1wgv h GLU 81 Ca 0.20 -0.52 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 1wgv h GLU 81 Cb 1.62 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 30.31 1wgv h GLU 81 CO -0.00 1.14 -0.68 0.45 -1.18 0.00 0.00 179.01 178.73 1wgv n SER 82 N -4.11 0.78 -4.83 1.04 2.88 0.35 -4.91 113.62 104.81 1wgv n SER 82 Ca -0.07 -0.62 -0.33 0.00 -1.33 0.00 0.00 58.87 56.52 1wgv n SER 82 Cb 0.65 0.54 -0.07 0.00 -0.75 0.00 0.00 64.21 64.58 1wgv n SER 82 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wgv s SER 83 N -2.95 6.89 0.35 -3.46 0.01 0.52 -4.63 113.70 110.43 1wgv s SER 83 Ca 0.11 1.54 0.01 0.00 1.31 0.00 0.00 55.95 58.92 1wgv s SER 83 Cb 0.17 -2.48 -0.00 0.00 0.21 0.00 0.00 66.02 63.92 1wgv s SER 83 CO 0.75 -0.29 0.43 -1.48 0.41 0.00 0.00 173.24 173.07 1wgv s LEU 84 N -3.06 1.28 -0.29 2.44 0.05 -0.63 -4.86 118.68 113.62 1wgv s LEU 84 Ca 0.58 -1.62 -0.16 0.00 0.05 0.00 0.00 54.13 52.99 1wgv s LEU 84 Cb -0.10 1.22 0.12 0.00 -2.05 0.00 0.00 46.19 45.38 1wgv s LEU 84 CO 0.15 -1.26 0.83 -1.66 -0.55 0.00 0.00 176.35 173.86 1wgv s TRP 85 N -3.04 -0.83 0.18 3.48 1.48 -1.26 0.06 118.94 119.01 1wgv s TRP 85 Ca 0.34 1.64 0.10 0.00 -1.06 0.00 0.00 56.10 57.12 1wgv s TRP 85 Cb 0.00 0.50 -0.04 0.00 -1.16 0.00 0.00 33.47 32.76 1wgv s TRP 85 CO 0.24 -0.41 -0.20 0.45 -4.06 0.00 0.00 176.95 172.97 1wgv s SER 86 N 1.58 3.71 -0.06 -2.66 0.15 0.33 -4.95 113.70 111.80 1wgv s SER 86 Ca -0.09 -0.74 0.03 0.00 0.70 0.00 0.00 55.95 55.85 1wgv s SER 86 Cb -0.05 -0.42 -0.02 0.00 -1.71 0.00 0.00 66.02 63.82 1wgv s SER 86 CO -0.17 0.13 -0.14 -0.22 1.20 0.00 0.00 173.24 174.03 1wgv s LEU 87 N -2.60 2.75 -0.08 3.45 1.98 -1.26 0.94 118.68 123.86 1wgv s LEU 87 Ca 0.21 -0.20 0.05 0.00 -2.89 0.00 0.00 54.13 51.30 1wgv s LEU 87 Cb -0.09 -1.56 -0.01 0.00 0.66 0.00 0.00 46.19 45.19 1wgv s LEU 87 CO 0.11 0.33 -0.23 -1.61 -1.89 0.00 0.00 176.35 173.05 1wgv s GLU 88 N -0.63 2.83 -0.07 1.98 0.41 -1.07 -4.97 118.70 117.19 1wgv s GLU 88 Ca 0.09 -0.87 -0.30 0.00 -0.41 0.00 0.00 54.97 53.48 1wgv s GLU 88 Cb -0.11 -2.26 -0.03 0.00 -1.78 0.00 0.00 34.13 29.95 1wgv s GLU 88 CO 0.01 0.29 1.23 -1.25 -0.49 0.00 0.00 175.26 175.05 1wgv s PRO 89 N 0.08 4.33 -1.37 0.39 0.04 -1.26 -3.32 135.00 133.89 1wgv s PRO 89 Ca -0.11 1.70 -0.06 0.00 0.04 0.00 0.00 61.00 62.57 1wgv s PRO 89 Cb -0.16 -3.59 0.03 0.00 0.04 0.00 0.00 34.50 30.82 1wgv s PRO 89 CO 0.06 -0.50 0.95 0.41 0.04 0.00 0.00 177.00 177.96 1wgv n GLY 90 N 3.43 -0.42 0.00 0.56 0.00 -0.70 -4.85 105.19 103.21 1wgv n GLY 90 Ca 0.12 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.54 0.00 -3.69 1.61 4.76 -1.21 -4.97 118.16 110.12 1wgv n LYS 91 Ca -0.12 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.24 1wgv n LYS 91 Cb 0.60 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.78 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 -3.59 4.97 -0.11 0.00 1.01 0.50 -2.59 120.40 120.59 1wgv s VAL 93 Ca 0.08 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.84 1wgv s VAL 93 Cb -0.03 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1wgv s VAL 93 CO -0.01 0.42 -0.13 -0.22 0.00 0.00 0.00 175.10 175.16 1wgv s LEU 94 N -1.52 2.74 -0.23 3.92 1.98 0.27 -1.34 118.68 124.50 1wgv s LEU 94 Ca 0.30 -0.29 -0.03 0.00 -2.89 0.00 0.00 54.13 51.22 1wgv s LEU 94 Cb -0.16 -1.61 0.07 0.00 0.66 0.00 0.00 46.19 45.16 1wgv s LEU 94 CO 0.17 0.20 0.07 -0.69 -1.89 0.00 0.00 176.35 174.21 1wgv s VAL 95 N 0.14 0.45 -0.15 1.68 1.01 -1.17 0.12 120.40 122.48 1wgv s VAL 95 Ca -0.06 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 60.97 1wgv s VAL 95 Cb -0.15 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1wgv s VAL 95 CO 0.05 -0.39 0.64 0.20 0.00 0.00 0.00 175.10 175.60 1wgv s ASN 96 N 1.87 6.78 -0.25 3.32 -0.87 0.11 -3.46 114.94 122.43 1wgv s ASN 96 Ca 0.03 0.94 -0.03 0.00 -1.57 0.00 0.00 52.86 52.23 1wgv s ASN 96 Cb -0.17 -2.36 0.01 0.00 -0.02 0.00 0.00 41.25 38.71 1wgv s ASN 96 CO -0.16 -0.21 -0.02 -0.76 -2.57 0.00 0.00 177.10 173.38 1wgv s LEU 97 N 1.48 3.24 -0.45 0.60 1.43 -1.21 -1.61 118.68 122.16 1wgv s LEU 97 Ca 0.31 -0.69 -0.20 0.00 -1.03 0.00 0.00 54.13 52.51 1wgv s LEU 97 Cb -0.16 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.35 1wgv s LEU 97 CO 0.12 -0.11 0.64 -0.44 0.23 0.00 0.00 176.35 176.80 1wgv s SER 98 N 1.41 6.30 0.49 2.29 0.01 -1.26 -2.98 113.70 119.96 1wgv s SER 98 Ca 0.02 -0.44 -0.23 0.00 1.31 0.00 0.00 55.95 56.62 1wgv s SER 98 Cb -0.16 -2.31 -0.08 0.00 0.21 0.00 0.00 66.02 63.67 1wgv s SER 98 CO -0.03 -0.80 1.10 0.29 0.41 0.00 0.00 173.24 174.21 1wgv n LYS 99 N 6.26 1.41 -1.10 12.44 5.02 -1.26 -0.73 118.16 140.20 1wgv n LYS 99 Ca -0.02 0.51 -0.22 0.00 -2.02 0.00 0.00 58.31 56.56 1wgv n LYS 99 Cb 0.47 -2.22 0.02 0.00 -0.02 0.00 0.00 35.03 33.28 1wgv n LYS 99 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1wgv n VAL 100 N -0.82 3.02 0.00 -0.18 0.24 -1.26 -4.69 118.33 114.65 1wgv n VAL 100 Ca 0.10 -2.16 0.00 0.00 -2.04 0.00 0.00 64.34 60.24 1wgv n VAL 100 Cb 0.42 -1.37 0.00 0.00 -1.47 0.00 0.00 33.84 31.42 1wgv n VAL 100 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wgv n GLY 101 N 0.30 0.90 3.56 7.63 0.00 -1.26 -4.97 105.19 111.34 1wgv n GLY 101 Ca 0.39 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.98 2.64 0.14 1.61 2.02 -1.26 -4.93 118.70 117.94 1wgv s GLU 102 Ca 0.00 0.09 0.07 0.00 0.02 0.00 0.00 54.97 55.15 1wgv s GLU 102 Cb 0.00 -4.74 -0.04 0.00 0.10 0.00 0.00 34.13 29.45 1wgv s GLU 102 CO 0.00 -3.01 -0.15 0.71 0.02 0.00 0.00 175.26 172.84 1wgv s TYR 103 N 9.32 1.51 -0.32 1.61 2.02 -1.26 -5.12 117.35 125.11 1wgv s TYR 103 Ca 0.67 -0.55 -0.08 0.00 -0.37 0.00 0.00 57.07 56.74 1wgv s TYR 103 Cb -0.09 -0.77 0.02 0.00 -0.40 0.00 0.00 41.96 40.72 1wgv s TYR 103 CO 0.09 0.20 0.11 -0.46 -1.57 0.00 0.00 175.55 173.93 1wgv s TRP 104 N -2.29 3.20 -0.19 2.71 -0.11 -1.26 -4.98 118.94 116.02 1wgv s TRP 104 Ca 0.12 -1.06 -0.15 0.00 1.22 0.00 0.00 56.10 56.23 1wgv s TRP 104 Cb -0.04 -2.30 -0.04 0.00 -1.50 0.00 0.00 33.47 29.59 1wgv s TRP 104 CO 0.04 -0.62 0.33 -1.58 -4.62 0.00 0.00 176.95 170.50 1wgv s TRP 105 N 1.49 3.40 -0.64 5.86 0.52 -1.26 -4.92 118.94 123.39 1wgv s TRP 105 Ca 0.01 0.57 0.13 0.00 0.02 0.00 0.00 56.10 56.83 1wgv s TRP 105 Cb -0.18 -2.43 -0.14 0.00 -1.15 0.00 0.00 33.47 29.56 1wgv s TRP 105 CO 0.04 0.09 0.57 0.27 0.02 0.00 0.00 176.95 177.94 1wgv n ASN 106 N 4.13 0.64 -3.60 2.95 0.23 -1.26 -4.95 115.26 113.40 1wgv n ASN 106 Ca -0.10 -0.82 -0.04 0.00 -0.53 0.00 0.00 54.58 53.08 1wgv n ASN 106 Cb 0.51 1.00 -0.02 0.00 -2.08 0.00 0.00 39.78 39.19 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 -2.26 -1.94 -0.14 -2.53 0.00 -1.26 -2.79 121.76 110.84 1wgv s ALA 107 Ca 0.05 0.96 -0.09 0.00 0.00 0.00 0.00 51.96 52.88 1wgv s ALA 107 Cb 0.10 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.48 1wgv s ALA 107 CO 0.55 -0.80 -0.12 0.82 0.00 0.00 0.00 175.76 176.21 1wgv h ILE 108 N 2.00 0.06 -1.67 0.00 1.08 -1.94 -3.42 117.51 113.62 1wgv h ILE 108 Ca -0.20 -1.07 -0.44 0.00 -0.39 0.00 0.00 64.86 62.75 1wgv h ILE 108 Cb 1.21 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1wgv h ILE 108 CO 0.27 0.02 -0.33 -0.76 -0.69 0.00 0.00 178.15 176.66 1wgv s LEU 109 N -8.26 3.78 0.60 1.44 1.43 -1.26 -1.14 118.68 115.27 1wgv s LEU 109 Ca -0.13 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.47 1wgv s LEU 109 Cb 0.02 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 1wgv s LEU 109 CO 0.21 -0.55 1.07 -1.61 0.23 0.00 0.00 176.35 175.70 1wgv s GLU 110 N -4.21 3.25 0.00 1.70 2.02 -1.21 -3.63 118.70 116.62 1wgv s GLU 110 Ca 0.48 1.24 0.00 0.00 0.02 0.00 0.00 54.97 56.71 1wgv s GLU 110 Cb -0.09 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.12 1wgv s GLU 110 CO 0.31 -0.87 0.00 0.41 0.02 0.00 0.00 175.26 175.13 1wgv n GLY 111 N -0.88 1.82 3.44 -1.39 0.00 -1.26 -4.95 105.19 101.98 1wgv n GLY 111 Ca 0.09 -0.20 -0.63 0.00 0.00 0.00 0.00 46.02 45.28 1wgv n GLY 111 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wgv n GLU 112 N 0.00 0.00 -1.22 1.61 0.00 -1.24 -4.74 120.64 115.05 1wgv n GLU 112 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 57.16 56.77 1wgv n GLU 112 Cb 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 29.95 1wgv n GLU 112 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1wgv n GLU 113 N 5.94 0.00 -1.57 5.31 1.02 -1.26 -4.82 120.64 125.26 1wgv n GLU 113 Ca 0.44 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 57.27 1wgv n GLU 113 Cb -0.05 -0.95 0.05 0.00 -0.02 0.00 0.00 31.44 30.47 1wgv n GLU 113 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wgv s PRO 114 N -0.95 2.91 0.46 3.49 0.04 -1.26 -4.80 135.00 134.89 1wgv s PRO 114 Ca 0.56 0.94 0.05 0.00 0.04 0.00 0.00 61.00 62.59 1wgv s PRO 114 Cb -0.56 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.01 1wgv s PRO 114 CO 0.61 -1.12 0.65 0.96 0.04 0.00 0.00 177.00 178.14 1wgv s ILE 115 N -3.05 3.04 -0.30 0.56 -4.36 -1.12 -5.06 121.20 110.92 1wgv s ILE 115 Ca 0.58 -0.84 -0.08 0.00 -0.26 0.00 0.00 60.65 60.06 1wgv s ILE 115 Cb -0.14 -3.07 0.16 0.00 1.25 0.00 0.00 42.46 40.66 1wgv s ILE 115 CO 0.55 -0.04 0.73 -0.62 0.24 0.00 0.00 174.94 175.80 1wgv s ASP 116 N -4.35 -1.07 -0.22 4.36 2.15 -1.26 -5.04 116.67 111.24 1wgv s ASP 116 Ca 0.54 1.04 -0.23 0.00 0.43 0.00 0.00 52.55 54.33 1wgv s ASP 116 Cb -0.10 2.04 -0.01 0.00 -0.30 0.00 0.00 42.92 44.55 1wgv s ASP 116 CO 0.35 -0.20 0.77 -0.63 -0.17 0.00 0.00 175.17 175.29 1wgv s ILE 117 N 2.82 4.90 0.19 4.11 1.09 -1.26 -5.05 121.20 128.00 1wgv s ILE 117 Ca 0.05 1.46 0.04 0.00 -1.10 0.00 0.00 60.65 61.10 1wgv s ILE 117 Cb -0.12 -4.07 -0.03 0.00 -1.06 0.00 0.00 42.46 37.18 1wgv s ILE 117 CO -0.19 0.00 0.29 -1.81 -0.10 0.00 0.00 174.94 173.14 1wgv s ASP 118 N 1.28 6.20 -0.13 3.58 1.01 -1.26 -5.06 116.67 122.31 1wgv s ASP 118 Ca 0.33 0.08 -0.08 0.00 0.71 0.00 0.00 52.55 53.59 1wgv s ASP 118 Cb -0.16 -1.82 -0.03 0.00 1.01 0.00 0.00 42.92 41.93 1wgv s ASP 118 CO 0.09 0.00 -0.16 -0.24 0.21 0.00 0.00 175.17 175.08 1wgv n SER 119 N -0.87 1.60 -4.88 0.27 2.88 -1.26 -4.97 113.62 106.39 1wgv n SER 119 Ca -0.08 0.58 -0.29 0.00 -1.33 0.00 0.00 58.87 57.75 1wgv n SER 119 Cb 0.55 -0.82 -0.01 0.00 -0.75 0.00 0.00 64.21 63.17 1wgv n SER 119 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wgv s GLY 120 N -4.06 1.75 -0.29 0.46 0.00 -1.26 -5.01 107.32 98.90 1wgv s GLY 120 Ca -0.13 -0.27 -0.29 0.00 0.00 0.00 0.00 44.72 44.02 1wgv s GLY 120 CO 0.20 -0.08 1.35 2.56 0.00 0.00 0.00 173.10 177.13 1wgv s PRO 121 N -4.37 3.89 0.19 2.90 0.04 -1.26 -5.00 135.00 131.39 1wgv s PRO 121 Ca 0.51 1.30 0.10 0.00 0.04 0.00 0.00 61.00 62.94 1wgv s PRO 121 Cb -0.10 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.49 1wgv s PRO 121 CO 0.39 -1.15 -0.20 0.45 0.04 0.00 0.00 177.00 176.54 1wgv s SER 122 N 3.00 2.97 0.00 6.66 0.15 -1.26 -5.11 113.70 120.11 1wgv s SER 122 Ca 0.58 -0.89 0.00 0.00 0.70 0.00 0.00 55.95 56.34 1wgv s SER 122 Cb -0.18 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 1wgv s SER 122 CO 0.24 0.00 0.00 -1.20 1.20 0.00 0.00 173.24 173.48 1wgv n SER 123 N 0.13 0.00 0.00 5.45 7.64 -1.26 -5.20 113.62 120.38 1wgv n SER 123 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1wgv n SER 123 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 1wgv n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64