#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 -3.38 -3.82 1.61 7.64 -1.26 -4.96 113.62 109.45 1wgv n SER 2 Ca 0.00 1.31 -0.29 0.00 1.01 0.00 0.00 58.87 60.90 1wgv n SER 2 Cb 0.00 -4.09 -0.13 0.00 -1.01 0.00 0.00 64.21 58.98 1wgv n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wgv s SER 3 N -0.45 4.05 0.08 6.43 0.15 -1.26 -5.00 113.70 117.72 1wgv s SER 3 Ca -0.16 -3.24 0.00 0.00 0.70 0.00 0.00 55.95 53.25 1wgv s SER 3 Cb 0.01 -1.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.95 1wgv s SER 3 CO 0.44 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.31 1wgv n GLY 4 N 2.77 1.33 3.61 9.45 0.00 -1.26 -4.86 105.19 116.22 1wgv n GLY 4 Ca 0.14 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 1wgv n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wgv s SER 5 N -4.00 6.58 0.26 1.61 0.15 -1.26 -5.01 113.70 112.03 1wgv s SER 5 Ca 0.00 0.66 0.06 0.00 0.70 0.00 0.00 55.95 57.37 1wgv s SER 5 Cb 0.00 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.74 1wgv s SER 5 CO 0.00 -1.26 0.34 -0.94 1.20 0.00 0.00 173.24 172.58 1wgv s SER 6 N 2.82 6.09 -0.49 5.45 1.04 -1.26 -4.98 113.70 122.37 1wgv s SER 6 Ca 0.52 -0.04 -0.44 0.00 0.48 0.00 0.00 55.95 56.47 1wgv s SER 6 Cb -0.10 -1.67 -0.19 0.00 0.10 0.00 0.00 66.02 64.16 1wgv s SER 6 CO 0.30 -0.12 2.04 0.61 0.98 0.00 0.00 173.24 177.06 1wgv n GLY 7 N -1.39 -0.11 3.45 7.32 0.00 -1.26 -4.90 105.19 108.30 1wgv n GLY 7 Ca -0.07 1.09 -0.26 0.00 0.00 0.00 0.00 46.02 46.78 1wgv n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wgv s GLN 8 N 5.55 1.63 0.55 1.61 -0.44 -1.26 -5.00 119.66 122.30 1wgv s GLN 8 Ca 1.17 -1.59 0.00 0.00 -2.50 0.00 0.00 55.36 52.43 1wgv s GLN 8 Cb -1.48 -1.85 0.00 0.00 -1.64 0.00 0.00 33.01 28.04 1wgv s GLN 8 CO 0.67 0.38 0.00 1.63 0.50 0.00 0.00 175.29 178.47 1wgv n LYS 9 N -0.09 -3.80 -1.28 1.67 5.02 -1.26 -4.95 118.16 113.48 1wgv n LYS 9 Ca -0.10 2.96 0.02 0.00 -2.02 0.00 0.00 58.31 59.17 1wgv n LYS 9 Cb 0.57 -3.73 -0.01 0.00 -0.02 0.00 0.00 35.03 31.84 1wgv n LYS 9 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1wgv n ASN 10 N -2.64 -6.88 -1.31 4.39 4.13 -1.26 -4.23 115.26 107.46 1wgv n ASN 10 Ca -0.01 1.50 0.00 0.00 1.68 0.00 0.00 54.58 57.76 1wgv n ASN 10 Cb 0.46 -4.00 0.00 0.00 -1.54 0.00 0.00 39.78 34.71 1wgv n ASN 10 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1wgv n PRO 11 N -2.60 0.75 0.00 3.52 -0.04 -1.26 -4.79 135.00 130.58 1wgv n PRO 11 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1wgv n PRO 11 Cb 0.42 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 1wgv n PRO 11 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wgv n ASP 12 N 1.12 0.00 -4.57 3.54 9.92 -1.26 -4.78 116.55 120.53 1wgv n ASP 12 Ca 0.00 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.07 1wgv n ASP 12 Cb 0.37 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.78 1wgv n ASP 12 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1wgv s SER 13 N 0.00 4.29 0.61 -2.24 1.04 -1.26 -4.91 113.70 111.23 1wgv s SER 13 Ca 0.00 -0.53 -0.17 0.00 0.48 0.00 0.00 55.95 55.73 1wgv s SER 13 Cb 0.00 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.53 1wgv s SER 13 CO 0.00 -3.62 1.15 -0.47 0.98 0.00 0.00 173.24 171.27 1wgv s TYR 14 N 13.42 2.53 -0.05 5.02 6.14 -1.26 -4.94 117.35 138.21 1wgv s TYR 14 Ca 0.81 1.55 -0.30 0.00 0.64 0.00 0.00 57.07 59.77 1wgv s TYR 14 Cb -0.08 -3.31 -0.05 0.00 0.42 0.00 0.00 41.96 38.94 1wgv s TYR 14 CO 0.08 -1.85 1.53 -0.80 0.64 0.00 0.00 175.55 175.15 1wgv s ASN 15 N -2.01 6.75 0.00 4.32 -0.87 -1.26 -4.41 114.94 117.46 1wgv s ASN 15 Ca 0.72 2.13 0.00 0.00 -1.57 0.00 0.00 52.86 54.14 1wgv s ASN 15 Cb -0.25 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.44 1wgv s ASN 15 CO 0.35 -0.85 0.00 0.61 -2.57 0.00 0.00 177.10 174.64 1wgv n GLY 16 N 3.93 0.00 1.93 0.66 0.00 -1.26 -5.04 105.19 105.41 1wgv n GLY 16 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 -2.19 -3.90 4.61 0.00 -1.26 -4.85 120.51 112.92 1wgv n ALA 17 Ca 0.00 0.40 -0.07 0.00 0.00 0.00 0.00 53.44 53.77 1wgv n ALA 17 Cb 0.00 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 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 1.57 0.00 0.00 0.00 0.24 -1.26 -4.80 118.33 114.08 1wgv n VAL 18 Ca 0.00 -0.58 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1wgv n VAL 18 Cb 0.00 0.17 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 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 -0.26 0.00 -2.11 7.34 3.00 -1.23 -4.88 116.66 118.53 1wgv n ARG 19 Ca -0.03 0.00 -0.02 0.00 -0.01 0.00 0.00 57.85 57.79 1wgv n ARG 19 Cb 0.15 0.00 0.01 0.00 0.00 0.00 0.00 32.46 32.62 1wgv n ARG 19 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1wgv n GLU 20 N 12.44 -0.83 -0.37 5.56 4.07 -1.26 -3.50 120.64 136.75 1wgv n GLU 20 Ca 0.00 0.13 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 1wgv n GLU 20 Cb 0.00 -2.80 0.00 0.00 -0.06 0.00 0.00 31.44 28.58 1wgv n GLU 20 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1wgv n ASN 21 N -1.42 0.00 0.00 4.31 5.15 -1.26 -4.92 115.26 117.11 1wgv n ASN 21 Ca -0.04 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.94 1wgv n ASN 21 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 1wgv n ASN 21 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wgv n TYR 22 N -2.00 0.00 -3.11 1.20 0.18 -1.23 -4.58 117.16 107.63 1wgv n TYR 22 Ca 0.00 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 1wgv n TYR 22 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1wgv n TYR 22 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1wgv s THR 23 N -0.11 4.55 0.08 -3.48 2.01 -1.21 -3.49 115.64 114.00 1wgv s THR 23 Ca 0.00 1.38 -0.07 0.00 0.31 0.00 0.00 61.69 63.31 1wgv s THR 23 Cb 0.00 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.55 1wgv s THR 23 CO 0.00 0.37 0.14 -1.66 -0.69 0.00 0.00 174.62 172.78 1wgv s TRP 24 N -1.33 0.25 0.35 4.92 1.48 -1.26 -1.54 118.94 121.82 1wgv s TRP 24 Ca 0.38 -0.71 -0.10 0.00 -1.06 0.00 0.00 56.10 54.61 1wgv s TRP 24 Cb -0.19 -0.14 0.03 0.00 -1.16 0.00 0.00 33.47 32.00 1wgv s TRP 24 CO 0.22 -0.51 0.62 -1.54 -4.06 0.00 0.00 176.95 171.68 1wgv s SER 25 N -2.88 0.42 -0.16 -2.66 1.04 -0.71 -4.72 113.70 104.02 1wgv s SER 25 Ca 0.06 -1.27 -0.05 0.00 0.48 0.00 0.00 55.95 55.17 1wgv s SER 25 Cb 0.06 0.74 0.08 0.00 0.10 0.00 0.00 66.02 67.00 1wgv s SER 25 CO -0.10 -1.46 0.29 0.00 0.98 0.00 0.00 173.24 172.94 1wgv s GLN 26 N -2.82 0.20 -0.04 4.02 -2.07 -1.26 -2.37 119.66 115.32 1wgv s GLN 26 Ca 0.23 0.66 0.02 0.00 -1.82 0.00 0.00 55.36 54.44 1wgv s GLN 26 Cb -0.03 -0.26 0.01 0.00 -1.09 0.00 0.00 33.01 31.65 1wgv s GLN 26 CO 0.15 -0.39 -0.07 -0.51 -1.32 0.00 0.00 175.29 173.15 1wgv s ASP 27 N 2.44 1.14 0.00 12.60 1.01 -1.25 -4.91 116.67 127.70 1wgv s ASP 27 Ca 0.03 -0.17 0.00 0.00 0.71 0.00 0.00 52.55 53.12 1wgv s ASP 27 Cb -0.13 -0.45 0.00 0.00 1.01 0.00 0.00 42.92 43.35 1wgv s ASP 27 CO -0.11 0.01 0.00 0.00 0.21 0.00 0.00 175.17 175.28 1wgv n TYR 28 N 3.69 0.00 0.00 4.23 9.36 -1.26 -2.94 117.16 130.23 1wgv n TYR 28 Ca -0.22 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.00 1wgv n TYR 28 Cb 0.52 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.23 1wgv n TYR 28 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 1wgv n THR 29 N 0.00 0.00 -3.79 2.97 5.66 -1.26 -5.17 114.28 112.68 1wgv n THR 29 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 1wgv n THR 29 Cb 0.00 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 68.80 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 0.00 -2.00 -3.63 1.09 5.68 -1.15 -4.56 116.55 111.97 1wgv n ASP 30 Ca 0.00 -2.55 -0.29 0.00 -0.50 0.00 0.00 54.79 51.45 1wgv n ASP 30 Cb 0.00 3.38 -0.15 0.00 -1.14 0.00 0.00 41.12 43.21 1wgv n ASP 30 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1wgv s LEU 31 N 0.00 1.19 -0.50 -2.12 1.02 -1.18 -3.77 118.68 113.33 1wgv s LEU 31 Ca 0.17 -1.35 -0.18 0.00 0.02 0.00 0.00 54.13 52.79 1wgv s LEU 31 Cb -0.04 -0.55 0.07 0.00 0.02 0.00 0.00 46.19 45.69 1wgv s LEU 31 CO 0.13 -0.42 0.54 -1.61 0.02 0.00 0.00 176.35 175.00 1wgv s GLU 32 N 1.91 3.06 -0.17 1.70 2.02 -1.00 -3.14 118.70 123.08 1wgv s GLU 32 Ca 0.08 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 53.94 1wgv s GLU 32 Cb -0.17 -4.13 0.01 0.00 0.10 0.00 0.00 34.13 29.94 1wgv s GLU 32 CO -0.30 -1.17 -0.16 0.54 0.02 0.00 0.00 175.26 174.19 1wgv s VAL 33 N 2.20 2.47 -0.14 2.63 0.11 -1.22 -1.74 120.40 124.72 1wgv s VAL 33 Ca 0.10 -0.82 0.00 0.00 -2.93 0.00 0.00 61.98 58.33 1wgv s VAL 33 Cb -0.22 -2.05 -0.01 0.00 -1.53 0.00 0.00 36.38 32.57 1wgv s VAL 33 CO 0.09 0.52 -0.14 -0.13 -3.33 0.00 0.00 175.10 172.11 1wgv s ARG 34 N 1.04 3.33 -0.18 1.54 0.52 -0.59 -3.19 118.95 121.42 1wgv s ARG 34 Ca -0.01 -0.71 -0.08 0.00 -0.52 0.00 0.00 55.73 54.41 1wgv s ARG 34 Cb -0.15 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 1wgv s ARG 34 CO -0.05 0.16 0.08 0.08 0.02 0.00 0.00 175.30 175.59 1wgv s VAL 35 N 0.48 4.94 0.20 3.52 1.01 -0.52 -3.30 120.40 126.73 1wgv s VAL 35 Ca -0.10 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 1wgv s VAL 35 Cb -0.16 -3.22 -0.08 0.00 0.00 0.00 0.00 36.38 32.92 1wgv s VAL 35 CO 0.05 0.47 1.11 -2.16 0.00 0.00 0.00 175.10 174.57 1wgv s PRO 36 N 0.24 4.60 0.26 2.72 0.04 -1.26 0.19 135.00 141.78 1wgv s PRO 36 Ca 0.05 1.75 0.11 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 -0.00 0.09 -0.20 0.14 0.04 0.00 0.00 177.00 177.07 1wgv s VAL 37 N -0.43 2.36 1.07 -0.36 -7.23 -0.99 -4.87 120.40 109.95 1wgv s VAL 37 Ca 0.49 -2.32 -0.17 0.00 -1.81 0.00 0.00 61.98 58.16 1wgv s VAL 37 Cb -0.30 -2.23 0.23 0.00 0.56 0.00 0.00 36.38 34.64 1wgv s VAL 37 CO 0.36 -0.38 1.21 -2.16 -0.31 0.00 0.00 175.10 173.82 1wgv s PRO 38 N -3.39 -0.17 -0.01 4.82 0.04 -1.26 -4.42 135.00 130.61 1wgv s PRO 38 Ca 0.27 -0.20 0.06 0.00 0.04 0.00 0.00 61.00 61.17 1wgv s PRO 38 Cb -0.05 -1.73 0.19 0.00 0.04 0.00 0.00 34.50 32.94 1wgv s PRO 38 CO 0.13 -2.99 1.10 1.63 0.04 0.00 0.00 177.00 176.91 1wgv n LYS 39 N -4.22 1.56 0.00 4.56 4.01 -1.26 -2.86 118.16 119.96 1wgv n LYS 39 Ca 0.14 -0.75 0.04 0.00 -0.51 0.00 0.00 58.31 57.23 1wgv n LYS 39 Cb 0.59 -1.24 0.01 0.00 -0.51 0.00 0.00 35.03 33.88 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 0.10 0.00 -3.50 2.13 1.44 -1.26 -4.81 115.22 109.32 1wgv n HIS 40 Ca 0.07 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.36 1wgv n HIS 40 Cb 0.22 0.00 -0.10 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 -1.12 4.96 0.00 0.61 1.01 -1.13 -4.79 120.40 119.94 1wgv s VAL 41 Ca 0.08 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1wgv s VAL 41 Cb 0.07 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.64 1wgv s VAL 41 CO 0.19 -0.34 0.00 1.33 0.00 0.00 0.00 175.10 176.28 1wgv n VAL 42 N 5.10 0.00 -2.59 2.92 0.24 -1.26 -1.66 118.33 121.07 1wgv n VAL 42 Ca -0.11 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.80 1wgv n VAL 42 Cb 0.46 -0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.52 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 -1.45 4.47 0.00 7.34 -0.14 -1.26 -4.36 119.74 124.35 1wgv s LYS 43 Ca 0.00 1.57 0.21 0.00 -1.36 0.00 0.00 55.97 56.38 1wgv s LYS 43 Cb 0.00 -2.88 1.23 0.00 -1.68 0.00 0.00 37.83 34.50 1wgv s LYS 43 CO 0.00 0.13 1.71 0.41 -0.76 0.00 0.00 175.35 176.84 1wgv n GLY 44 N 0.78 -0.87 0.02 -3.33 0.00 -1.26 -2.28 105.19 98.25 1wgv n GLY 44 Ca 0.02 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.87 0.16 -0.75 1.61 2.85 -1.26 -3.90 118.16 115.99 1wgv n LYS 45 Ca 0.15 -0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.36 1wgv n LYS 45 Cb 0.07 -1.55 0.21 0.00 -0.65 0.00 0.00 35.03 33.11 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 -1.75 2.89 -3.73 -1.58 6.02 -0.97 -4.82 117.38 113.45 1wgv n GLN 46 Ca 0.03 -2.20 -0.13 0.00 -0.01 0.00 0.00 57.00 54.69 1wgv n GLN 46 Cb 0.39 -1.95 -0.10 0.00 1.02 0.00 0.00 30.24 29.60 1wgv n GLN 46 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1wgv s VAL 47 N -2.30 -0.00 -0.10 5.09 -7.23 -1.25 0.62 120.40 115.22 1wgv s VAL 47 Ca 0.40 0.01 0.03 0.00 -1.81 0.00 0.00 61.98 60.61 1wgv s VAL 47 Cb 0.32 -0.56 -0.01 0.00 0.56 0.00 0.00 36.38 36.69 1wgv s VAL 47 CO 0.10 0.00 -0.20 -0.44 -0.31 0.00 0.00 175.10 174.25 1wgv s SER 48 N 0.33 3.46 -0.03 4.85 0.01 -0.35 -4.96 113.70 117.01 1wgv s SER 48 Ca -0.01 -0.45 0.05 0.00 1.31 0.00 0.00 55.95 56.84 1wgv s SER 48 Cb -0.03 -1.38 -0.01 0.00 0.21 0.00 0.00 66.02 64.81 1wgv s SER 48 CO -0.01 0.18 -0.17 -0.69 0.41 0.00 0.00 173.24 172.96 1wgv s VAL 49 N 0.23 1.40 -0.17 3.43 1.01 -1.26 -1.88 120.40 123.15 1wgv s VAL 49 Ca -0.13 -0.73 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 1wgv s VAL 49 Cb -0.16 -1.18 0.04 0.00 0.00 0.00 0.00 36.38 35.08 1wgv s VAL 49 CO 0.07 0.40 -0.06 0.00 0.00 0.00 0.00 175.10 175.51 1wgv s ALA 50 N -0.22 1.59 -0.18 5.51 0.00 -1.14 -4.93 121.76 122.38 1wgv s ALA 50 Ca 0.02 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.07 1wgv s ALA 50 Cb -0.09 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.88 1wgv s ALA 50 CO 0.00 -0.81 -0.15 -0.51 0.00 0.00 0.00 175.76 174.30 1wgv s LEU 51 N 1.58 2.42 0.11 0.00 1.43 -1.26 -2.73 118.68 120.23 1wgv s LEU 51 Ca 0.00 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1wgv s LEU 51 Cb -0.16 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.50 1wgv s LEU 51 CO -0.08 0.03 0.00 -1.20 0.23 0.00 0.00 176.35 175.33 1wgv n SER 52 N 4.42 0.51 0.00 2.29 7.64 -1.24 -5.02 113.62 122.21 1wgv n SER 52 Ca -0.20 0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1wgv n SER 52 Cb 0.51 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 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 -3.20 0.00 -0.49 6.43 2.88 -1.26 -4.65 113.62 113.33 1wgv n SER 53 Ca 0.00 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.61 1wgv n SER 53 Cb 0.00 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 63.65 1wgv n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1wgv n SER 54 N 0.00 1.88 -3.67 -3.46 2.88 -1.26 -0.84 113.62 109.15 1wgv n SER 54 Ca 0.00 -3.72 -0.13 0.00 -1.33 0.00 0.00 58.87 53.69 1wgv n SER 54 Cb 0.00 -0.51 -0.07 0.00 -0.75 0.00 0.00 64.21 62.88 1wgv n SER 54 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wgv s SER 55 N -3.14 -0.30 0.01 -3.46 1.04 -1.26 0.17 113.70 106.75 1wgv s SER 55 Ca 0.37 0.09 -0.12 0.00 0.48 0.00 0.00 55.95 56.77 1wgv s SER 55 Cb 0.35 0.41 0.01 0.00 0.10 0.00 0.00 66.02 66.90 1wgv s SER 55 CO -0.05 -0.61 0.25 -0.51 0.98 0.00 0.00 173.24 173.30 1wgv s ILE 56 N -2.10 0.08 -0.01 -1.02 -1.16 -1.14 -3.69 121.20 112.15 1wgv s ILE 56 Ca -0.08 -0.64 0.00 0.00 -0.51 0.00 0.00 60.65 59.43 1wgv s ILE 56 Cb -0.02 -0.70 0.02 0.00 0.61 0.00 0.00 42.46 42.37 1wgv s ILE 56 CO 0.00 -0.35 0.00 -0.60 -2.81 0.00 0.00 174.94 171.19 1wgv s ARG 57 N -1.80 0.10 -0.25 3.50 3.52 -1.11 -2.61 118.95 120.30 1wgv s ARG 57 Ca -0.11 0.06 -0.04 0.00 -0.13 0.00 0.00 55.73 55.51 1wgv s ARG 57 Cb -0.04 -0.23 0.09 0.00 -1.56 0.00 0.00 34.95 33.21 1wgv s ARG 57 CO 0.01 -0.07 0.11 0.08 -0.81 0.00 0.00 175.30 174.62 1wgv s VAL 58 N 0.55 0.00 0.25 7.11 1.01 0.48 -2.90 120.40 126.90 1wgv s VAL 58 Ca -0.05 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.38 1wgv s VAL 58 Cb -0.07 -0.90 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1wgv s VAL 58 CO -0.01 -0.58 -0.07 0.00 0.00 0.00 0.00 175.10 174.44 1wgv s ALA 59 N 2.07 2.12 -0.04 5.51 0.00 -0.79 0.14 121.76 130.78 1wgv s ALA 59 Ca 0.07 -1.80 -0.03 0.00 0.00 0.00 0.00 51.96 50.20 1wgv s ALA 59 Cb -0.16 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.15 1wgv s ALA 59 CO -0.27 -0.07 0.09 0.00 0.00 0.00 0.00 175.76 175.51 1wgv s MET 60 N -3.73 0.08 0.08 0.00 0.23 0.14 -1.22 119.30 114.88 1wgv s MET 60 Ca 0.27 0.18 -0.31 0.00 -1.03 0.00 0.00 55.69 54.81 1wgv s MET 60 Cb 0.03 -0.04 -0.06 0.00 -1.53 0.00 0.00 34.83 33.22 1wgv s MET 60 CO 0.09 -0.07 1.25 -0.51 -2.03 0.00 0.00 175.02 173.76 1wgv s LEU 61 N 0.43 4.37 -0.02 0.18 1.43 0.20 -0.61 118.68 124.68 1wgv s LEU 61 Ca -0.03 2.12 -0.01 0.00 -1.03 0.00 0.00 54.13 55.17 1wgv s LEU 61 Cb -0.05 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.59 1wgv s LEU 61 CO -0.02 -0.52 -0.03 -0.62 0.23 0.00 0.00 176.35 175.40 1wgv n GLU 62 N 3.85 0.05 0.06 1.70 -0.58 -0.67 -4.94 120.64 120.11 1wgv n GLU 62 Ca 0.09 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 1wgv n GLU 62 Cb 0.45 -0.71 0.00 0.00 -0.57 0.00 0.00 31.44 30.61 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 -2.59 0.00 0.02 3.49 2.13 -1.26 -4.92 120.64 117.51 1wgv n GLU 63 Ca -0.01 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.93 1wgv n GLU 63 Cb 0.04 0.00 0.23 0.00 0.27 0.00 0.00 31.44 31.98 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 -2.60 0.55 0.00 4.31 4.13 -1.26 -4.97 115.26 115.41 1wgv n ASN 64 Ca 0.00 -0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.18 1wgv n ASN 64 Cb 0.00 0.21 0.00 0.00 -1.54 0.00 0.00 39.78 38.45 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 1.44 3.27 3.75 7.41 0.00 -1.26 -5.20 105.19 114.60 1wgv n GLY 65 Ca 0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 4.40 2.17 -0.03 1.61 1.03 -1.26 -1.68 118.70 124.93 1wgv s GLU 66 Ca 0.00 -1.49 -0.03 0.00 0.03 0.00 0.00 54.97 53.48 1wgv s GLU 66 Cb 0.00 0.59 0.01 0.00 -0.80 0.00 0.00 34.13 33.93 1wgv s GLU 66 CO 0.00 -1.00 0.09 0.50 -1.33 0.00 0.00 175.26 173.53 1wgv s ARG 67 N -2.49 0.14 -0.64 -4.83 3.52 0.22 -4.83 118.95 110.05 1wgv s ARG 67 Ca 0.18 0.06 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 1wgv s ARG 67 Cb -0.04 0.07 0.09 0.00 -1.56 0.00 0.00 34.95 33.50 1wgv s ARG 67 CO 0.13 -0.02 0.85 0.08 -0.81 0.00 0.00 175.30 175.53 1wgv s VAL 68 N -0.11 4.59 0.06 7.11 1.01 -1.26 0.25 120.40 132.05 1wgv s VAL 68 Ca -0.02 -0.75 -0.27 0.00 0.00 0.00 0.00 61.98 60.95 1wgv s VAL 68 Cb -0.02 -4.60 -0.17 0.00 0.00 0.00 0.00 36.38 31.60 1wgv s VAL 68 CO 0.00 -1.30 1.58 -0.07 0.00 0.00 0.00 175.10 175.31 1wgv h LEU 69 N 10.62 -0.32 -7.69 3.92 3.38 0.91 -3.45 115.31 122.69 1wgv h LEU 69 Ca -0.26 -0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.44 1wgv h LEU 69 Cb 1.08 0.08 -0.27 0.00 0.09 0.00 0.00 40.66 41.64 1wgv h LEU 69 CO 1.14 -0.15 -0.64 -0.32 0.09 0.00 0.00 178.44 178.56 1wgv s MET 70 N -5.74 0.10 -0.18 1.13 0.00 -0.04 -4.85 119.30 109.72 1wgv s MET 70 Ca -0.15 0.03 -0.30 0.00 0.00 0.00 0.00 55.69 55.27 1wgv s MET 70 Cb 0.04 0.05 0.14 0.00 0.00 0.00 0.00 34.83 35.06 1wgv s MET 70 CO 0.63 -0.02 1.06 -2.00 0.00 0.00 0.00 175.02 174.70 1wgv s GLU 71 N -0.11 0.50 0.00 4.11 -6.30 -1.26 0.18 118.70 115.82 1wgv s GLU 71 Ca -0.01 0.12 0.00 0.00 -2.50 0.00 0.00 54.97 52.57 1wgv s GLU 71 Cb -0.01 0.23 0.00 0.00 0.00 0.00 0.00 34.13 34.35 1wgv s GLU 71 CO 0.00 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.54 1wgv n GLY 72 N 0.68 3.86 3.68 -1.50 0.00 -1.07 -5.03 105.19 105.80 1wgv n GLY 72 Ca -0.08 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 1wgv n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgv s LYS 73 N -2.62 4.24 1.10 1.61 -0.14 -1.26 -2.89 119.74 119.77 1wgv s LYS 73 Ca 0.00 2.03 -0.12 0.00 -1.36 0.00 0.00 55.97 56.52 1wgv s LYS 73 Cb 0.00 -3.71 0.25 0.00 -1.68 0.00 0.00 37.83 32.68 1wgv s LYS 73 CO 0.00 -0.69 1.06 -0.51 -0.76 0.00 0.00 175.35 174.45 1wgv s LEU 74 N 3.02 1.36 0.01 3.17 1.43 0.45 -2.63 118.68 125.49 1wgv s LEU 74 Ca 0.66 1.67 -0.18 0.00 -1.03 0.00 0.00 54.13 55.26 1wgv s LEU 74 Cb -0.32 -3.71 -0.29 0.00 0.03 0.00 0.00 46.19 41.91 1wgv s LEU 74 CO 0.26 -3.90 1.04 0.71 0.23 0.00 0.00 176.35 174.69 1wgv h THR 75 N -2.41 1.38 -3.15 5.49 1.35 -1.37 -3.42 112.91 110.78 1wgv h THR 75 Ca -0.57 -2.40 -0.43 0.00 -0.55 0.00 0.00 66.41 62.47 1wgv h THR 75 Cb 1.32 2.83 -0.14 0.00 -1.73 0.00 0.00 68.15 70.43 1wgv h THR 75 CO 0.48 0.71 -0.61 -1.00 -0.25 0.00 0.00 175.52 174.85 1wgv s HIS 76 N -2.86 1.81 0.79 4.73 3.76 -1.26 -5.05 115.29 117.21 1wgv s HIS 76 Ca -0.12 -1.02 -0.12 0.00 -0.15 0.00 0.00 55.06 53.66 1wgv s HIS 76 Cb 0.04 -1.14 0.06 0.00 1.11 0.00 0.00 32.58 32.65 1wgv s HIS 76 CO 0.88 -0.09 1.12 0.15 -0.85 0.00 0.00 174.74 175.95 1wgv s LYS 77 N -3.93 2.16 0.20 1.40 1.02 -1.26 -4.38 119.74 114.95 1wgv s LYS 77 Ca 0.36 0.41 0.03 0.00 0.02 0.00 0.00 55.97 56.79 1wgv s LYS 77 Cb 0.08 -1.95 -0.01 0.00 -0.52 0.00 0.00 37.83 35.43 1wgv s LYS 77 CO 0.14 -1.52 0.20 0.44 -0.92 0.00 0.00 175.35 173.70 1wgv n ILE 78 N -3.32 0.00 -3.52 2.17 -6.64 -0.02 -4.25 119.36 103.78 1wgv n ILE 78 Ca 0.07 -1.32 -0.36 0.00 -1.77 0.00 0.00 62.75 59.37 1wgv n ILE 78 Cb 0.58 0.69 -0.05 0.00 -1.44 0.00 0.00 39.64 39.42 1wgv n ILE 78 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 1wgv n ASN 79 N -2.12 4.48 -0.33 7.28 3.02 -0.05 -4.72 115.26 122.82 1wgv n ASN 79 Ca 0.03 -3.20 0.32 0.00 -0.03 0.00 0.00 54.58 51.70 1wgv n ASN 79 Cb 0.35 -1.05 0.57 0.00 -0.61 0.00 0.00 39.78 39.04 1wgv n ASN 79 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1wgv n THR 80 N 2.02 -0.35 0.17 3.41 -2.24 -1.26 0.13 114.28 116.15 1wgv n THR 80 Ca 0.23 1.84 -0.14 0.00 -2.27 0.00 0.00 64.05 63.72 1wgv n THR 80 Cb 0.37 -3.00 -0.07 0.00 -2.10 0.00 0.00 70.33 65.53 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 -0.46 0.00 -0.78 4.81 -1.95 -1.62 114.58 114.58 1wgv h GLU 81 Ca 0.80 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 60.06 1wgv h GLU 81 Cb 2.22 0.10 0.00 0.00 0.63 0.00 0.00 28.75 31.71 1wgv h GLU 81 CO -0.65 -0.31 0.00 0.77 -0.73 0.00 0.00 179.01 178.09 1wgv h SER 82 N -0.48 0.00 -3.53 1.04 0.02 0.74 -3.43 113.55 107.91 1wgv h SER 82 Ca -0.01 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1wgv h SER 82 Cb 0.43 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1wgv h SER 82 CO -0.03 0.00 0.19 -0.44 -1.14 0.00 0.00 176.83 175.41 1wgv s SER 83 N -5.69 7.40 0.45 3.07 0.01 0.22 -4.67 113.70 114.50 1wgv s SER 83 Ca 0.03 1.66 0.03 0.00 1.31 0.00 0.00 55.95 58.98 1wgv s SER 83 Cb 0.08 -2.51 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 1wgv s SER 83 CO 0.56 0.20 0.10 -1.48 0.41 0.00 0.00 173.24 173.04 1wgv s LEU 84 N -1.10 2.05 -0.29 2.44 0.05 -1.05 -4.81 118.68 115.97 1wgv s LEU 84 Ca 0.36 -1.72 -0.14 0.00 0.05 0.00 0.00 54.13 52.69 1wgv s LEU 84 Cb -0.23 -0.24 0.10 0.00 -2.05 0.00 0.00 46.19 43.77 1wgv s LEU 84 CO 0.27 -0.96 0.70 -1.66 -0.55 0.00 0.00 176.35 174.14 1wgv s TRP 85 N -3.10 -1.14 0.13 3.48 1.48 -1.26 -2.62 118.94 115.92 1wgv s TRP 85 Ca 0.17 2.13 0.04 0.00 -1.06 0.00 0.00 56.10 57.38 1wgv s TRP 85 Cb 0.01 0.68 -0.04 0.00 -1.16 0.00 0.00 33.47 32.96 1wgv s TRP 85 CO 0.11 -0.56 -0.10 -1.12 -4.06 0.00 0.00 176.95 171.22 1wgv s SER 86 N 2.11 1.71 -0.01 -2.66 0.01 -0.60 -5.02 113.70 109.24 1wgv s SER 86 Ca -0.08 -0.97 0.06 0.00 1.31 0.00 0.00 55.95 56.27 1wgv s SER 86 Cb -0.07 -0.00 -0.03 0.00 0.21 0.00 0.00 66.02 66.12 1wgv s SER 86 CO -0.19 -0.32 -0.17 -0.22 0.41 0.00 0.00 173.24 172.75 1wgv s LEU 87 N -2.99 2.58 -0.05 2.44 1.98 -1.26 -2.05 118.68 119.32 1wgv s LEU 87 Ca 0.14 -0.32 0.05 0.00 -2.89 0.00 0.00 54.13 51.10 1wgv s LEU 87 Cb 0.01 -1.51 -0.01 0.00 0.66 0.00 0.00 46.19 45.35 1wgv s LEU 87 CO 0.00 0.31 -0.21 -1.61 -1.89 0.00 0.00 176.35 172.95 1wgv s GLU 88 N -0.98 2.18 -0.12 1.98 2.02 -1.13 -4.97 118.70 117.69 1wgv s GLU 88 Ca 0.12 -0.74 -0.30 0.00 0.02 0.00 0.00 54.97 54.08 1wgv s GLU 88 Cb -0.10 -1.85 -0.02 0.00 0.10 0.00 0.00 34.13 32.25 1wgv s GLU 88 CO 0.02 0.29 1.25 -1.25 0.02 0.00 0.00 175.26 175.59 1wgv s PRO 89 N -0.01 4.28 -1.38 0.39 0.04 -1.26 -3.38 135.00 133.69 1wgv s PRO 89 Ca -0.05 1.69 -0.05 0.00 0.04 0.00 0.00 61.00 62.63 1wgv s PRO 89 Cb -0.13 -3.69 0.03 0.00 0.04 0.00 0.00 34.50 30.75 1wgv s PRO 89 CO 0.03 -0.61 0.83 0.41 0.04 0.00 0.00 177.00 177.70 1wgv n GLY 90 N 3.54 -0.37 0.00 0.56 0.00 -0.67 -4.87 105.19 103.38 1wgv n GLY 90 Ca 0.13 0.15 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 -4.44 0.00 -3.82 1.61 4.76 -1.22 -4.97 118.16 110.08 1wgv n LYS 91 Ca -0.18 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.21 1wgv n LYS 91 Cb 0.62 0.00 0.00 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 -2.86 5.39 -0.09 0.00 1.01 0.50 -2.83 120.40 121.52 1wgv s VAL 93 Ca 0.15 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 1wgv s VAL 93 Cb -0.04 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 1wgv s VAL 93 CO 0.07 0.42 0.23 -0.22 0.00 0.00 0.00 175.10 175.60 1wgv s LEU 94 N 0.52 4.39 -0.11 3.92 1.98 -0.87 -1.44 118.68 127.07 1wgv s LEU 94 Ca 0.08 0.61 -0.05 0.00 -2.89 0.00 0.00 54.13 51.88 1wgv s LEU 94 Cb -0.12 -2.26 0.05 0.00 0.66 0.00 0.00 46.19 44.53 1wgv s LEU 94 CO -0.00 0.34 0.25 -0.69 -1.89 0.00 0.00 176.35 174.36 1wgv s VAL 95 N -0.81 -0.14 -0.18 1.68 1.01 -1.19 -1.56 120.40 119.20 1wgv s VAL 95 Ca 0.17 0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.31 1wgv s VAL 95 Cb -0.13 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 1wgv s VAL 95 CO 0.06 0.08 -0.05 0.20 0.00 0.00 0.00 175.10 175.39 1wgv s ASN 96 N 1.58 4.46 -0.30 3.32 0.01 -1.08 -3.43 114.94 119.50 1wgv s ASN 96 Ca -0.06 -0.28 -0.03 0.00 -0.71 0.00 0.00 52.86 51.77 1wgv s ASN 96 Cb -0.11 -1.74 0.04 0.00 0.41 0.00 0.00 41.25 39.85 1wgv s ASN 96 CO -0.09 0.07 0.02 -0.76 -1.51 0.00 0.00 177.10 174.84 1wgv s LEU 97 N 0.92 3.82 -0.54 0.60 1.43 -1.19 -2.54 118.68 121.18 1wgv s LEU 97 Ca -0.01 -1.08 -0.18 0.00 -1.03 0.00 0.00 54.13 51.83 1wgv s LEU 97 Cb -0.15 -1.76 0.09 0.00 0.03 0.00 0.00 46.19 44.40 1wgv s LEU 97 CO 0.01 -0.24 0.62 -0.55 0.23 0.00 0.00 176.35 176.43 1wgv s SER 98 N 1.33 6.19 0.48 2.29 0.15 -1.26 -3.07 113.70 119.81 1wgv s SER 98 Ca -0.02 -1.27 -0.21 0.00 0.70 0.00 0.00 55.95 55.14 1wgv s SER 98 Cb -0.19 -2.28 -0.10 0.00 -1.71 0.00 0.00 66.02 61.75 1wgv s SER 98 CO -0.01 -0.96 0.73 0.29 1.20 0.00 0.00 173.24 174.49 1wgv n LYS 99 N 6.06 0.83 -1.14 5.44 5.02 -1.26 -0.87 118.16 132.23 1wgv n LYS 99 Ca -0.09 0.31 -0.21 0.00 -2.02 0.00 0.00 58.31 56.29 1wgv n LYS 99 Cb 0.43 -1.79 -0.00 0.00 -0.02 0.00 0.00 35.03 33.65 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 -1.06 3.02 0.00 -0.18 0.24 -1.26 -4.69 118.33 114.40 1wgv n VAL 100 Ca 0.11 -2.21 0.00 0.00 -2.04 0.00 0.00 64.34 60.20 1wgv n VAL 100 Cb 0.42 -1.45 0.00 0.00 -1.47 0.00 0.00 33.84 31.35 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 0.56 0.18 2.81 7.63 0.00 -1.26 -5.02 105.19 110.08 1wgv n GLY 101 Ca 0.39 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.57 1.26 0.14 1.61 -1.05 -1.26 -5.10 118.70 112.74 1wgv s GLU 102 Ca 0.00 -1.81 0.06 0.00 -0.15 0.00 0.00 54.97 53.07 1wgv s GLU 102 Cb 0.00 -2.53 -0.04 0.00 -0.44 0.00 0.00 34.13 31.12 1wgv s GLU 102 CO 0.00 -1.07 -0.15 0.71 0.95 0.00 0.00 175.26 175.71 1wgv s TYR 103 N 0.71 1.51 -0.50 4.83 2.02 -1.26 -5.11 117.35 119.55 1wgv s TYR 103 Ca 0.14 -0.56 -0.17 0.00 -0.37 0.00 0.00 57.07 56.12 1wgv s TYR 103 Cb -0.22 -0.77 0.08 0.00 -0.40 0.00 0.00 41.96 40.66 1wgv s TYR 103 CO -0.08 0.20 0.48 -0.46 -1.57 0.00 0.00 175.55 174.12 1wgv s TRP 104 N -2.30 3.19 -0.76 2.71 -0.11 -1.26 -5.01 118.94 115.40 1wgv s TRP 104 Ca 0.12 -0.91 -0.25 0.00 1.22 0.00 0.00 56.10 56.29 1wgv s TRP 104 Cb -0.04 -3.41 0.05 0.00 -1.50 0.00 0.00 33.47 28.57 1wgv s TRP 104 CO 0.04 -0.92 1.22 -1.58 -4.62 0.00 0.00 176.95 171.09 1wgv s TRP 105 N 1.92 2.44 -0.31 5.86 0.52 -1.26 -4.81 118.94 123.29 1wgv s TRP 105 Ca 0.07 -0.32 0.26 0.00 0.02 0.00 0.00 56.10 56.14 1wgv s TRP 105 Cb -0.24 -4.55 1.10 0.00 -1.15 0.00 0.00 33.47 28.63 1wgv s TRP 105 CO 0.07 -1.94 1.79 -2.95 0.02 0.00 0.00 176.95 173.94 1wgv h ASN 106 N 9.85 0.00 -5.42 2.95 7.08 -1.94 -3.46 115.58 124.64 1wgv h ASN 106 Ca -0.21 0.00 0.20 0.00 -3.08 0.00 0.00 56.30 53.21 1wgv h ASN 106 Cb 1.05 0.00 -0.08 0.00 -2.08 0.00 0.00 38.32 37.21 1wgv h ASN 106 CO 1.27 0.00 0.56 0.00 -2.08 0.00 0.00 177.43 177.18 1wgv s ALA 107 N -3.42 -1.73 -0.12 4.14 0.00 -1.26 -1.85 121.76 117.53 1wgv s ALA 107 Ca 0.03 0.11 -0.05 0.00 0.00 0.00 0.00 51.96 52.06 1wgv s ALA 107 Cb 0.09 0.62 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1wgv s ALA 107 CO 0.43 -1.05 -0.09 0.82 0.00 0.00 0.00 175.76 175.87 1wgv h ILE 108 N 2.00 0.00 -1.04 0.00 1.08 -1.92 -3.42 117.51 114.21 1wgv h ILE 108 Ca -0.26 -0.97 -0.47 0.00 -0.39 0.00 0.00 64.86 62.77 1wgv h ILE 108 Cb 1.22 0.00 0.02 0.00 -3.07 0.00 0.00 36.82 34.99 1wgv h ILE 108 CO 0.28 0.00 -0.18 -0.76 -0.69 0.00 0.00 178.15 176.80 1wgv s LEU 109 N -8.27 3.30 0.05 1.44 1.43 -1.26 -1.11 118.68 114.24 1wgv s LEU 109 Ca -0.08 -0.71 0.25 0.00 -1.03 0.00 0.00 54.13 52.56 1wgv s LEU 109 Cb 0.01 -2.00 0.42 0.00 0.03 0.00 0.00 46.19 44.66 1wgv s LEU 109 CO 0.11 -1.10 1.36 -0.62 0.23 0.00 0.00 176.35 176.33 1wgv n GLU 110 N -2.05 0.13 0.12 1.70 1.02 -1.08 -3.77 120.64 116.71 1wgv n GLU 110 Ca 0.12 0.03 -0.02 0.00 -0.02 0.00 0.00 57.16 57.27 1wgv n GLU 110 Cb 0.61 -1.57 0.10 0.00 -0.02 0.00 0.00 31.44 30.55 1wgv n GLU 110 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1wgv h GLY 111 N 4.78 0.00 0.00 0.62 0.00 -1.95 -3.45 103.07 103.07 1wgv h GLY 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wgv h GLY 111 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 176.54 174.33 1wgv n GLU 112 N -3.62 0.40 -4.38 4.80 4.07 -1.25 -5.08 120.64 115.58 1wgv n GLU 112 Ca -0.01 0.00 -0.25 0.00 -0.06 0.00 0.00 57.16 56.85 1wgv n GLU 112 Cb 0.70 0.00 -0.12 0.00 -0.06 0.00 0.00 31.44 31.97 1wgv n GLU 112 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1wgv s GLU 113 N -1.02 1.41 -0.35 5.31 2.02 -1.26 -5.05 118.70 119.76 1wgv s GLU 113 Ca 0.00 -1.46 -0.29 0.00 0.02 0.00 0.00 54.97 53.24 1wgv s GLU 113 Cb 0.00 -1.64 0.00 0.00 0.10 0.00 0.00 34.13 32.60 1wgv s GLU 113 CO 0.00 0.35 1.38 -1.25 0.02 0.00 0.00 175.26 175.76 1wgv s PRO 114 N -2.67 3.73 1.13 0.39 0.04 -1.26 -4.57 135.00 131.79 1wgv s PRO 114 Ca 0.18 1.11 -0.17 0.00 0.04 0.00 0.00 61.00 62.16 1wgv s PRO 114 Cb -0.07 -3.97 0.21 0.00 0.04 0.00 0.00 34.50 30.72 1wgv s PRO 114 CO 0.08 -1.37 0.43 0.44 0.04 0.00 0.00 177.00 176.63 1wgv n ILE 115 N 6.68 0.00 -1.03 0.56 -5.35 -0.77 -4.61 119.36 114.84 1wgv n ILE 115 Ca 0.16 -0.08 -0.43 0.00 -0.27 0.00 0.00 62.75 62.12 1wgv n ILE 115 Cb 0.47 -0.63 -0.07 0.00 -1.74 0.00 0.00 39.64 37.67 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 -2.46 2.19 -4.27 7.28 8.00 -1.26 -4.89 116.55 121.13 1wgv n ASP 116 Ca 0.07 -2.64 -0.41 0.00 0.71 0.00 0.00 54.79 52.52 1wgv n ASP 116 Cb 0.45 -0.99 0.00 0.00 -0.02 0.00 0.00 41.12 40.56 1wgv n ASP 116 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1wgv n ILE 117 N 6.27 0.34 -0.20 0.53 5.41 -1.26 -4.79 119.36 125.67 1wgv n ILE 117 Ca 0.49 -0.50 -0.10 0.00 1.00 0.00 0.00 62.75 63.64 1wgv n ILE 117 Cb 0.41 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.29 1wgv n ILE 117 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1wgv h ASP 118 N 0.17 -1.60 -3.75 4.38 3.58 -1.93 -3.08 116.42 114.19 1wgv h ASP 118 Ca -0.39 0.25 -0.73 0.00 0.42 0.00 0.00 57.03 56.58 1wgv h ASP 118 Cb 1.45 0.71 -0.33 0.00 1.72 0.00 0.00 39.33 42.88 1wgv h ASP 118 CO 0.45 -0.35 -0.09 -0.55 -2.88 0.00 0.00 179.24 175.82 1wgv s SER 119 N -5.15 6.03 0.00 2.28 0.15 -1.26 -4.98 113.70 110.77 1wgv s SER 119 Ca -0.14 -3.22 0.00 0.00 0.70 0.00 0.00 55.95 53.28 1wgv s SER 119 Cb 0.12 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 1wgv s SER 119 CO 0.65 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.37 1wgv n GLY 120 N 3.07 1.34 3.78 9.45 0.00 -1.16 -5.17 105.19 116.49 1wgv n GLY 120 Ca 0.16 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 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 1.15 0.78 0.26 1.61 0.04 -1.26 -4.90 135.00 132.68 1wgv s PRO 121 Ca 0.00 0.15 0.01 0.00 0.04 0.00 0.00 61.00 61.20 1wgv s PRO 121 Cb 0.00 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.68 1wgv s PRO 121 CO 0.00 -2.42 0.09 -1.12 0.04 0.00 0.00 177.00 173.59 1wgv s SER 122 N -4.13 1.24 0.11 6.66 0.01 -1.26 -4.27 113.70 112.06 1wgv s SER 122 Ca 0.66 -1.38 -0.31 0.00 1.31 0.00 0.00 55.95 56.24 1wgv s SER 122 Cb -0.13 0.15 -0.10 0.00 0.21 0.00 0.00 66.02 66.15 1wgv s SER 122 CO 0.54 -0.72 1.87 -0.44 0.41 0.00 0.00 173.24 174.89 1wgv s SER 123 N -3.32 6.42 0.00 2.44 0.01 -1.26 -5.06 113.70 112.93 1wgv s SER 123 Ca 0.37 2.76 0.00 0.00 1.31 0.00 0.00 55.95 60.39 1wgv s SER 123 Cb 0.08 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.75 1wgv s SER 123 CO 0.13 -1.02 0.00 0.61 0.41 0.00 0.00 173.24 173.37