#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 -0.08 -0.19 1.61 0.15 -1.26 -5.09 113.70 108.84 1wgv s SER 2 Ca 0.00 0.13 -0.09 0.00 0.70 0.00 0.00 55.95 56.68 1wgv s SER 2 Cb 0.00 0.86 0.04 0.00 -1.71 0.00 0.00 66.02 65.20 1wgv s SER 2 CO 0.00 -0.02 0.18 -1.20 1.20 0.00 0.00 173.24 173.40 1wgv n SER 3 N 2.82 -1.78 -3.25 5.45 7.64 -1.26 -5.00 113.62 118.25 1wgv n SER 3 Ca -0.16 1.23 -0.25 0.00 1.01 0.00 0.00 58.87 60.70 1wgv n SER 3 Cb 0.56 -4.85 -0.07 0.00 -1.01 0.00 0.00 64.21 58.85 1wgv n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgv n GLY 4 N 1.36 3.81 5.00 0.23 0.00 -1.26 -4.97 105.19 109.35 1wgv n GLY 4 Ca -0.31 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.63 1wgv n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wgv n SER 5 N 0.97 0.00 -2.42 1.61 2.88 -1.26 -4.67 113.62 110.73 1wgv n SER 5 Ca 0.25 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.76 1wgv n SER 5 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1wgv n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wgv n SER 6 N 2.56 -6.26 0.00 -3.46 7.64 -1.26 -5.06 113.62 107.78 1wgv n SER 6 Ca 0.00 0.62 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1wgv n SER 6 Cb 0.00 -4.12 0.00 0.00 -1.01 0.00 0.00 64.21 59.08 1wgv n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgv n GLY 7 N -0.04 -1.03 0.04 0.23 0.00 -1.26 -5.07 105.19 98.04 1wgv n GLY 7 Ca 0.05 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.86 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 0.00 0.00 -1.72 1.61 6.02 -1.26 -5.14 117.38 116.89 1wgv n GLN 8 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.62 1wgv n GLN 8 Cb 0.00 0.00 0.07 0.00 1.02 0.00 0.00 30.24 31.33 1wgv n GLN 8 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1wgv n LYS 9 N -2.87 1.12 -3.15 -1.09 4.01 -1.26 -4.99 118.16 109.93 1wgv n LYS 9 Ca 0.00 0.44 -0.29 0.00 -0.51 0.00 0.00 58.31 57.95 1wgv n LYS 9 Cb 0.00 -2.51 -0.03 0.00 -0.51 0.00 0.00 35.03 31.98 1wgv n LYS 9 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1wgv s ASN 10 N -1.35 6.44 1.05 4.39 2.47 -1.26 -5.09 114.94 121.59 1wgv s ASN 10 Ca 0.82 0.83 -0.17 0.00 0.42 0.00 0.00 52.86 54.76 1wgv s ASN 10 Cb -0.38 -2.19 0.22 0.00 -1.45 0.00 0.00 41.25 37.45 1wgv s ASN 10 CO 0.41 -0.29 1.20 -2.16 -3.72 0.00 0.00 177.10 172.54 1wgv s PRO 11 N -3.78 0.00 0.06 0.43 0.04 -1.26 -5.10 135.00 125.40 1wgv s PRO 11 Ca 0.46 -0.14 -0.22 0.00 0.04 0.00 0.00 61.00 61.15 1wgv s PRO 11 Cb -0.10 -1.75 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1wgv s PRO 11 CO 0.32 -2.89 0.51 0.16 0.04 0.00 0.00 177.00 175.14 1wgv s ASP 12 N -4.33 -0.42 0.20 6.66 1.47 -1.26 -5.05 116.67 113.94 1wgv s ASP 12 Ca 0.71 0.10 -0.16 0.00 1.18 0.00 0.00 52.55 54.38 1wgv s ASP 12 Cb -0.08 0.50 0.20 0.00 -0.34 0.00 0.00 42.92 43.19 1wgv s ASP 12 CO 0.54 -0.75 1.61 -1.28 0.68 0.00 0.00 175.17 175.97 1wgv h SER 13 N 2.68 -0.75 -5.95 2.11 0.87 -1.99 -3.47 113.55 107.06 1wgv h SER 13 Ca -0.31 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1wgv h SER 13 Cb 1.23 0.44 -0.01 0.00 -0.44 0.00 0.00 62.40 63.61 1wgv h SER 13 CO 0.42 -0.24 -0.82 0.00 -0.53 0.00 0.00 176.83 175.66 1wgv n TYR 14 N -5.43 -1.21 0.05 2.24 9.36 -1.26 -4.90 117.16 116.00 1wgv n TYR 14 Ca 0.06 0.60 0.00 0.00 3.32 0.00 0.00 57.90 61.88 1wgv n TYR 14 Cb 0.34 -1.87 0.00 0.00 -0.63 0.00 0.00 39.34 37.18 1wgv n TYR 14 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1wgv n ASN 15 N 1.53 -0.90 0.00 2.98 5.15 -1.26 -5.08 115.26 117.69 1wgv n ASN 15 Ca -0.04 0.41 0.00 0.00 -0.60 0.00 0.00 54.58 54.35 1wgv n ASN 15 Cb 0.30 1.10 0.00 0.00 -0.53 0.00 0.00 39.78 40.65 1wgv n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wgv n GLY 16 N -1.16 0.35 3.03 8.20 0.00 -1.26 -5.01 105.19 109.33 1wgv n GLY 16 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1wgv n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgv s ALA 17 N -2.00 -0.57 0.00 4.61 0.00 -1.21 -5.02 121.76 117.57 1wgv s ALA 17 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1wgv s ALA 17 Cb 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.20 1wgv s ALA 17 CO 0.00 -0.52 0.00 1.33 0.00 0.00 0.00 175.76 176.57 1wgv n VAL 18 N 5.05 0.00 -3.05 0.00 0.24 -1.26 -3.41 118.33 115.90 1wgv n VAL 18 Ca -0.11 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1wgv n VAL 18 Cb 0.51 -0.68 0.00 0.00 -1.47 0.00 0.00 33.84 32.20 1wgv n VAL 18 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1wgv n ARG 19 N -0.68 -0.96 -2.91 7.34 3.00 -1.26 -4.99 116.66 116.20 1wgv n ARG 19 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.51 1wgv n ARG 19 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 1wgv n ARG 19 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1wgv n GLU 20 N 0.00 4.12 0.10 -0.14 0.28 -1.26 -4.58 120.64 119.15 1wgv n GLU 20 Ca 0.00 -4.73 0.00 0.00 -0.16 0.00 0.00 57.16 52.27 1wgv n GLU 20 Cb 0.00 -2.36 0.00 0.00 1.43 0.00 0.00 31.44 30.51 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 0.20 -1.76 -3.65 -1.84 5.15 -1.26 -5.13 115.26 106.96 1wgv n ASN 21 Ca 0.36 0.67 -0.07 0.00 -0.60 0.00 0.00 54.58 54.94 1wgv n ASN 21 Cb 0.34 1.92 -0.07 0.00 -0.53 0.00 0.00 39.78 41.43 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 -1.98 -1.03 0.40 1.20 -0.85 -1.26 -4.75 117.35 109.08 1wgv s TYR 22 Ca 0.00 2.01 -0.10 0.00 -0.52 0.00 0.00 57.07 58.47 1wgv s TYR 22 Cb 0.00 0.60 -0.06 0.00 0.38 0.00 0.00 41.96 42.87 1wgv s TYR 22 CO 0.00 -0.52 0.75 0.95 -1.52 0.00 0.00 175.55 175.21 1wgv s THR 23 N 1.85 4.81 0.14 -3.49 -4.23 -1.10 -4.54 115.64 109.08 1wgv s THR 23 Ca -0.09 0.56 -0.25 0.00 -1.18 0.00 0.00 61.69 60.73 1wgv s THR 23 Cb -0.07 -3.74 0.07 0.00 1.34 0.00 0.00 72.50 70.10 1wgv s THR 23 CO -0.18 -0.52 0.81 -1.66 -0.54 0.00 0.00 174.62 172.52 1wgv s TRP 24 N -2.37 -0.29 0.31 3.99 1.48 -1.22 -1.34 118.94 119.50 1wgv s TRP 24 Ca 0.50 0.02 -0.12 0.00 -1.06 0.00 0.00 56.10 55.45 1wgv s TRP 24 Cb -0.10 0.61 0.01 0.00 -1.16 0.00 0.00 33.47 32.83 1wgv s TRP 24 CO 0.32 -0.84 0.58 -1.54 -4.06 0.00 0.00 176.95 171.41 1wgv s SER 25 N -2.77 0.16 -0.13 -2.66 1.04 -0.84 -3.33 113.70 105.18 1wgv s SER 25 Ca 0.07 -1.08 -0.00 0.00 0.48 0.00 0.00 55.95 55.43 1wgv s SER 25 Cb -0.02 0.69 -0.02 0.00 0.10 0.00 0.00 66.02 66.77 1wgv s SER 25 CO -0.03 -1.33 -0.12 0.00 0.98 0.00 0.00 173.24 172.73 1wgv s GLN 26 N -3.37 3.36 0.55 4.02 -2.07 -1.26 -3.02 119.66 117.86 1wgv s GLN 26 Ca 0.21 -0.67 0.04 0.00 -1.82 0.00 0.00 55.36 53.12 1wgv s GLN 26 Cb -0.02 -2.64 0.03 0.00 -1.09 0.00 0.00 33.01 29.29 1wgv s GLN 26 CO 0.12 0.24 0.29 -0.51 -1.32 0.00 0.00 175.29 174.12 1wgv s ASP 27 N 0.28 4.47 0.22 12.60 1.11 -0.53 -5.01 116.67 129.81 1wgv s ASP 27 Ca -0.09 -1.42 -0.13 0.00 0.18 0.00 0.00 52.55 51.09 1wgv s ASP 27 Cb -0.15 0.60 0.28 0.00 1.07 0.00 0.00 42.92 44.71 1wgv s ASP 27 CO 0.05 -1.10 1.39 0.00 1.18 0.00 0.00 175.17 176.69 1wgv n TYR 28 N -1.66 0.13 -2.78 4.23 9.36 -1.26 -3.74 117.16 121.44 1wgv n TYR 28 Ca -0.08 1.10 -0.09 0.00 3.32 0.00 0.00 57.90 62.15 1wgv n TYR 28 Cb 0.65 -0.90 0.05 0.00 -0.63 0.00 0.00 39.34 38.51 1wgv n TYR 28 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 1wgv n THR 29 N -5.37 -0.05 0.00 2.97 5.66 -1.26 -5.13 114.28 111.10 1wgv n THR 29 Ca 0.11 -1.69 0.00 0.00 -3.05 0.00 0.00 64.05 59.42 1wgv n THR 29 Cb 0.39 1.26 0.00 0.00 -1.55 0.00 0.00 70.33 70.43 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 1.46 0.00 -4.23 1.09 8.00 -1.25 -4.62 116.55 117.01 1wgv n ASP 30 Ca 0.10 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.27 1wgv n ASP 30 Cb 0.63 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.57 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 2.33 -0.28 0.64 1.02 -1.03 -1.46 118.68 119.89 1wgv s LEU 31 Ca 0.00 -0.52 -0.02 0.00 0.02 0.00 0.00 54.13 53.61 1wgv s LEU 31 Cb 0.00 -1.51 0.04 0.00 0.02 0.00 0.00 46.19 44.74 1wgv s LEU 31 CO 0.00 0.09 -0.01 -1.61 0.02 0.00 0.00 176.35 174.84 1wgv s GLU 32 N 0.75 2.62 -0.17 1.70 2.02 -1.17 -1.85 118.70 122.60 1wgv s GLU 32 Ca -0.07 -1.14 -0.00 0.00 0.02 0.00 0.00 54.97 53.78 1wgv s GLU 32 Cb -0.16 -3.13 0.00 0.00 0.10 0.00 0.00 34.13 30.95 1wgv s GLU 32 CO 0.00 -0.53 -0.15 0.54 0.02 0.00 0.00 175.26 175.14 1wgv s VAL 33 N 1.30 2.58 -0.14 2.63 0.11 -1.22 -1.99 120.40 123.66 1wgv s VAL 33 Ca -0.03 -0.78 -0.03 0.00 -2.93 0.00 0.00 61.98 58.20 1wgv s VAL 33 Cb -0.18 -2.10 -0.03 0.00 -1.53 0.00 0.00 36.38 32.53 1wgv s VAL 33 CO -0.02 0.51 -0.03 -0.13 -3.33 0.00 0.00 175.10 172.10 1wgv s ARG 34 N 1.09 3.55 -0.12 1.54 0.52 -0.45 -3.12 118.95 121.96 1wgv s ARG 34 Ca -0.00 -0.49 -0.01 0.00 -0.52 0.00 0.00 55.73 54.71 1wgv s ARG 34 Cb -0.14 -2.91 -0.02 0.00 0.52 0.00 0.00 34.95 32.40 1wgv s ARG 34 CO -0.05 0.33 -0.10 0.08 0.02 0.00 0.00 175.30 175.59 1wgv s VAL 35 N 0.12 3.37 0.31 3.52 1.01 -0.37 -2.71 120.40 125.65 1wgv s VAL 35 Ca -0.00 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 1wgv s VAL 35 Cb -0.13 -2.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.73 1wgv s VAL 35 CO 0.02 0.53 1.07 -2.16 0.00 0.00 0.00 175.10 174.57 1wgv s PRO 36 N 0.13 4.52 0.17 2.72 0.04 -1.26 0.20 135.00 141.51 1wgv s PRO 36 Ca -0.05 1.70 0.07 0.00 0.04 0.00 0.00 61.00 62.76 1wgv s PRO 36 Cb -0.14 -3.01 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 1wgv s PRO 36 CO 0.04 0.13 -0.14 0.14 0.04 0.00 0.00 177.00 177.22 1wgv s VAL 37 N -1.31 1.51 1.12 -0.36 -7.23 -1.08 -4.84 120.40 108.21 1wgv s VAL 37 Ca 0.48 -2.04 -0.19 0.00 -1.81 0.00 0.00 61.98 58.42 1wgv s VAL 37 Cb -0.29 -1.86 0.26 0.00 0.56 0.00 0.00 36.38 35.05 1wgv s VAL 37 CO 0.36 -0.57 1.23 -2.16 -0.31 0.00 0.00 175.10 173.66 1wgv s PRO 38 N -3.38 -0.57 -0.03 4.82 0.04 -1.26 -4.42 135.00 130.20 1wgv s PRO 38 Ca 0.17 -0.35 0.07 0.00 0.04 0.00 0.00 61.00 60.93 1wgv s PRO 38 Cb -0.01 -1.70 0.25 0.00 0.04 0.00 0.00 34.50 33.08 1wgv s PRO 38 CO 0.04 -3.23 1.12 1.63 0.04 0.00 0.00 177.00 176.60 1wgv n LYS 39 N -4.36 1.84 0.00 4.56 4.01 -1.26 -2.98 118.16 119.97 1wgv n LYS 39 Ca 0.16 -0.99 0.02 0.00 -0.51 0.00 0.00 58.31 56.99 1wgv n LYS 39 Cb 0.59 -1.37 0.01 0.00 -0.51 0.00 0.00 35.03 33.75 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 0.25 0.00 -3.40 2.13 1.44 -1.26 -4.81 115.22 109.57 1wgv n HIS 40 Ca 0.09 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.37 1wgv n HIS 40 Cb 0.33 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.35 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 -0.77 5.20 0.00 0.61 1.01 -1.16 -4.78 120.40 120.50 1wgv s VAL 41 Ca 0.05 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1wgv s VAL 41 Cb 0.04 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1wgv s VAL 41 CO 0.11 -0.41 0.00 1.33 0.00 0.00 0.00 175.10 176.13 1wgv n VAL 42 N 5.25 0.00 -2.85 2.92 0.24 -1.26 -1.73 118.33 120.91 1wgv n VAL 42 Ca -0.10 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.79 1wgv n VAL 42 Cb 0.46 -0.31 -0.04 0.00 -1.47 0.00 0.00 33.84 32.48 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 -1.51 4.58 0.42 7.34 1.02 -1.26 -4.35 119.74 125.98 1wgv s LYS 43 Ca 0.00 1.26 0.17 0.00 0.02 0.00 0.00 55.97 57.42 1wgv s LYS 43 Cb 0.00 -3.39 1.06 0.00 -0.52 0.00 0.00 37.83 34.99 1wgv s LYS 43 CO 0.00 0.20 1.87 0.78 -0.92 0.00 0.00 175.35 177.28 1wgv h GLY 44 N 5.84 0.85 2.00 -3.33 0.00 -1.93 0.92 103.07 107.41 1wgv h GLY 44 Ca -0.43 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1wgv h GLY 44 CO 0.72 0.01 0.00 0.07 0.00 0.00 0.00 176.54 177.34 1wgv h LYS 45 N 0.42 0.00 0.00 4.80 2.10 -2.01 0.45 116.57 122.33 1wgv h LYS 45 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 1wgv h LYS 45 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1wgv h LYS 45 CO -0.16 0.00 0.00 1.04 -2.00 0.00 0.00 179.45 178.33 1wgv n GLN 46 N -2.36 0.25 -3.78 0.07 6.02 0.32 -4.68 117.38 113.22 1wgv n GLN 46 Ca -0.02 0.03 -0.15 0.00 -0.01 0.00 0.00 57.00 56.86 1wgv n GLN 46 Cb 0.04 -1.50 -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 -2.73 -0.05 0.01 5.09 -7.23 0.16 0.19 120.40 115.83 1wgv s VAL 47 Ca 0.21 0.19 -0.07 0.00 -1.81 0.00 0.00 61.98 60.50 1wgv s VAL 47 Cb 0.18 -0.08 -0.05 0.00 0.56 0.00 0.00 36.38 36.99 1wgv s VAL 47 CO 0.45 0.08 0.28 -0.44 -0.31 0.00 0.00 175.10 175.15 1wgv s SER 48 N 0.95 6.51 -0.11 4.85 0.01 0.37 -4.89 113.70 121.38 1wgv s SER 48 Ca -0.08 0.58 -0.03 0.00 1.31 0.00 0.00 55.95 57.73 1wgv s SER 48 Cb -0.11 -2.10 0.04 0.00 0.21 0.00 0.00 66.02 64.07 1wgv s SER 48 CO -0.03 0.25 0.06 -0.69 0.41 0.00 0.00 173.24 173.24 1wgv s VAL 49 N -1.31 0.06 -0.32 3.43 1.01 -1.25 -2.77 120.40 119.25 1wgv s VAL 49 Ca 0.28 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 1wgv s VAL 49 Cb -0.13 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.83 1wgv s VAL 49 CO 0.16 -0.02 0.05 0.00 0.00 0.00 0.00 175.10 175.30 1wgv s ALA 50 N 2.09 2.92 -0.17 5.51 0.00 -1.13 -4.96 121.76 126.03 1wgv s ALA 50 Ca 0.03 -1.82 -0.04 0.00 0.00 0.00 0.00 51.96 50.13 1wgv s ALA 50 Cb -0.14 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 1wgv s ALA 50 CO -0.06 -1.34 -0.03 -0.51 0.00 0.00 0.00 175.76 173.82 1wgv s LEU 51 N 1.29 3.24 0.05 0.00 1.43 -1.26 -2.80 118.68 120.64 1wgv s LEU 51 Ca -0.03 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1wgv s LEU 51 Cb -0.20 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1wgv s LEU 51 CO -0.00 0.14 0.00 -1.20 0.23 0.00 0.00 176.35 175.52 1wgv n SER 52 N 3.73 0.29 0.00 2.29 7.64 -1.26 -5.04 113.62 121.27 1wgv n SER 52 Ca -0.17 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1wgv n SER 52 Cb 0.52 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 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 -2.86 0.00 -0.99 6.43 2.88 -1.26 -4.64 113.62 113.17 1wgv n SER 53 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 1wgv n SER 53 Cb 0.00 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 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 2.16 -3.60 -3.46 3.41 -1.26 -0.11 113.62 110.76 1wgv n SER 54 Ca 0.00 -3.62 -0.08 0.00 -0.26 0.00 0.00 58.87 54.91 1wgv n SER 54 Cb 0.00 -0.47 -0.01 0.00 -0.26 0.00 0.00 64.21 63.47 1wgv n SER 54 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wgv s SER 55 N -3.18 -0.14 -0.04 4.04 0.15 -1.26 0.17 113.70 113.44 1wgv s SER 55 Ca 0.39 -0.81 -0.29 0.00 0.70 0.00 0.00 55.95 55.94 1wgv s SER 55 Cb 0.38 0.75 0.10 0.00 -1.71 0.00 0.00 66.02 65.54 1wgv s SER 55 CO -0.06 -1.42 0.86 -0.51 1.20 0.00 0.00 173.24 173.30 1wgv s ILE 56 N -3.46 0.00 -0.06 6.45 -1.16 -1.07 -4.07 121.20 117.82 1wgv s ILE 56 Ca 0.14 0.00 -0.04 0.00 -0.51 0.00 0.00 60.65 60.24 1wgv s ILE 56 Cb -0.05 -1.00 0.03 0.00 0.61 0.00 0.00 42.46 42.05 1wgv s ILE 56 CO 0.09 0.00 0.15 -0.60 -2.81 0.00 0.00 174.94 171.77 1wgv s ARG 57 N -2.23 0.13 -0.31 3.50 3.52 -1.12 -2.26 118.95 120.18 1wgv s ARG 57 Ca -0.00 0.31 -0.02 0.00 -0.13 0.00 0.00 55.73 55.88 1wgv s ARG 57 Cb -0.01 -0.06 0.11 0.00 -1.56 0.00 0.00 34.95 33.43 1wgv s ARG 57 CO -0.03 -0.10 0.15 0.08 -0.81 0.00 0.00 175.30 174.58 1wgv s VAL 58 N 0.70 0.19 -0.08 7.11 1.01 0.50 -2.83 120.40 127.00 1wgv s VAL 58 Ca -0.05 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 60.83 1wgv s VAL 58 Cb -0.07 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 35.15 1wgv s VAL 58 CO -0.03 -0.78 -0.21 0.00 0.00 0.00 0.00 175.10 174.08 1wgv s ALA 59 N 1.74 1.89 -0.11 5.51 0.00 -1.11 0.19 121.76 129.86 1wgv s ALA 59 Ca 0.11 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 1wgv s ALA 59 Cb -0.18 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 1wgv s ALA 59 CO -0.26 0.26 -0.02 0.00 0.00 0.00 0.00 175.76 175.74 1wgv s MET 60 N 0.35 3.24 0.31 0.00 0.23 0.11 0.14 119.30 123.67 1wgv s MET 60 Ca -0.15 -0.47 -0.29 0.00 -1.03 0.00 0.00 55.69 53.75 1wgv s MET 60 Cb -0.17 -2.82 -0.10 0.00 -1.53 0.00 0.00 34.83 30.21 1wgv s MET 60 CO 0.07 0.51 1.37 -0.51 -2.03 0.00 0.00 175.02 174.43 1wgv s LEU 61 N -0.37 4.40 0.00 0.18 1.43 0.50 -0.68 118.68 124.13 1wgv s LEU 61 Ca 0.07 2.72 0.04 0.00 -1.03 0.00 0.00 54.13 55.92 1wgv s LEU 61 Cb -0.12 -3.64 0.04 0.00 0.03 0.00 0.00 46.19 42.49 1wgv s LEU 61 CO 0.02 -0.62 0.32 -0.62 0.23 0.00 0.00 176.35 175.67 1wgv n GLU 62 N 1.29 0.89 0.22 1.70 -0.58 0.51 -4.86 120.64 119.81 1wgv n GLU 62 Ca 0.02 -1.38 0.15 0.00 -0.42 0.00 0.00 57.16 55.53 1wgv n GLU 62 Cb 0.41 -0.05 0.47 0.00 -0.57 0.00 0.00 31.44 31.70 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 -0.41 3.49 5.08 -1.99 -3.32 114.58 117.44 1wgv h GLU 63 Ca -0.12 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.96 1wgv h GLU 63 Cb 0.54 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.53 1wgv h GLU 63 CO 0.18 0.00 -0.71 -1.71 -1.00 0.00 0.00 179.01 175.77 1wgv n ASN 64 N -2.90 -0.43 0.00 1.42 2.85 -1.26 -5.11 115.26 109.84 1wgv n ASN 64 Ca 0.02 -2.52 0.00 0.00 -0.11 0.00 0.00 54.58 51.97 1wgv n ASN 64 Cb 0.38 0.33 0.00 0.00 1.24 0.00 0.00 39.78 41.73 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 -0.45 0.24 3.69 8.20 0.00 -1.25 -5.14 105.19 110.48 1wgv n GLY 65 Ca 0.01 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.45 1.51 -0.01 1.61 1.03 -1.26 0.19 118.70 120.31 1wgv s GLU 66 Ca 0.00 -0.75 -0.01 0.00 0.03 0.00 0.00 54.97 54.24 1wgv s GLU 66 Cb 0.00 0.57 0.00 0.00 -0.80 0.00 0.00 34.13 33.90 1wgv s GLU 66 CO 0.00 -0.68 0.04 0.50 -1.33 0.00 0.00 175.26 173.79 1wgv s ARG 67 N -3.74 0.05 -0.67 -4.83 3.52 0.14 -4.79 118.95 108.63 1wgv s ARG 67 Ca 0.08 0.04 -0.22 0.00 -0.13 0.00 0.00 55.73 55.50 1wgv s ARG 67 Cb -0.04 0.02 0.07 0.00 -1.56 0.00 0.00 34.95 33.45 1wgv s ARG 67 CO -0.01 -0.01 0.97 0.08 -0.81 0.00 0.00 175.30 175.53 1wgv s VAL 68 N 0.00 4.34 0.04 7.11 1.01 -1.26 0.05 120.40 131.69 1wgv s VAL 68 Ca -0.00 -0.41 -0.33 0.00 0.00 0.00 0.00 61.98 61.24 1wgv s VAL 68 Cb -0.00 -4.69 -0.18 0.00 0.00 0.00 0.00 36.38 31.51 1wgv s VAL 68 CO 0.00 -1.46 1.36 -0.07 0.00 0.00 0.00 175.10 174.93 1wgv h LEU 69 N 11.31 -1.00 -8.30 3.92 3.38 0.17 -3.45 115.31 121.35 1wgv h LEU 69 Ca -0.27 0.03 -0.39 0.00 0.09 0.00 0.00 57.88 57.34 1wgv h LEU 69 Cb 1.07 0.26 -0.23 0.00 0.09 0.00 0.00 40.66 41.85 1wgv h LEU 69 CO 1.18 -0.65 -0.77 -0.32 0.09 0.00 0.00 178.44 177.97 1wgv s MET 70 N -5.38 0.77 -0.26 1.13 0.00 -0.43 -4.75 119.30 110.38 1wgv s MET 70 Ca -0.17 -0.79 -0.34 0.00 0.00 0.00 0.00 55.69 54.39 1wgv s MET 70 Cb 0.02 -0.73 0.16 0.00 0.00 0.00 0.00 34.83 34.28 1wgv s MET 70 CO 0.51 0.17 1.32 -2.00 0.00 0.00 0.00 175.02 175.02 1wgv s GLU 71 N -1.38 0.13 0.00 4.11 2.12 -1.26 0.19 118.70 122.61 1wgv s GLU 71 Ca -0.02 -0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.29 1wgv s GLU 71 Cb -0.09 0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.36 1wgv s GLU 71 CO 0.01 -0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 1wgv n GLY 72 N 0.19 4.45 3.70 -1.50 0.00 -0.96 -5.00 105.19 106.08 1wgv n GLY 72 Ca 0.02 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 1wgv n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgv s LYS 73 N -3.20 4.39 1.17 1.61 1.02 -1.26 -2.60 119.74 120.87 1wgv s LYS 73 Ca 0.00 1.71 -0.16 0.00 0.02 0.00 0.00 55.97 57.54 1wgv s LYS 73 Cb 0.00 -3.47 0.27 0.00 -0.52 0.00 0.00 37.83 34.11 1wgv s LYS 73 CO 0.00 -0.36 1.06 -0.51 -0.92 0.00 0.00 175.35 174.62 1wgv s LEU 74 N 1.72 0.70 0.01 3.17 1.43 0.45 -2.37 118.68 123.79 1wgv s LEU 74 Ca 0.57 1.00 -0.03 0.00 -1.03 0.00 0.00 54.13 54.64 1wgv s LEU 74 Cb -0.27 -2.85 -0.27 0.00 0.03 0.00 0.00 46.19 42.83 1wgv s LEU 74 CO 0.25 -4.04 0.89 0.71 0.23 0.00 0.00 176.35 174.39 1wgv h THR 75 N -2.52 1.19 -3.10 5.49 1.35 -1.66 -3.40 112.91 110.27 1wgv h THR 75 Ca -0.51 -2.83 -0.45 0.00 -0.55 0.00 0.00 66.41 62.06 1wgv h THR 75 Cb 1.32 2.77 -0.14 0.00 -1.73 0.00 0.00 68.15 70.38 1wgv h THR 75 CO 0.44 0.82 -0.59 -1.00 -0.25 0.00 0.00 175.52 174.95 1wgv s HIS 76 N -2.62 1.80 0.85 4.73 3.76 -1.26 -5.03 115.29 117.51 1wgv s HIS 76 Ca -0.08 -1.10 -0.13 0.00 -0.15 0.00 0.00 55.06 53.60 1wgv s HIS 76 Cb 0.07 -1.14 0.12 0.00 1.11 0.00 0.00 32.58 32.75 1wgv s HIS 76 CO 0.85 -0.17 1.21 0.15 -0.85 0.00 0.00 174.74 175.93 1wgv s LYS 77 N -3.89 1.49 0.20 1.40 1.02 -1.26 -4.32 119.74 114.39 1wgv s LYS 77 Ca 0.34 -0.15 -0.13 0.00 0.02 0.00 0.00 55.97 56.05 1wgv s LYS 77 Cb 0.07 -1.94 0.01 0.00 -0.52 0.00 0.00 37.83 35.44 1wgv s LYS 77 CO 0.15 -1.86 0.43 0.96 -0.92 0.00 0.00 175.35 174.11 1wgv s ILE 78 N -3.65 0.03 -1.16 2.17 -5.25 0.85 -3.87 121.20 110.32 1wgv s ILE 78 Ca 0.66 -1.18 -0.11 0.00 -0.99 0.00 0.00 60.65 59.03 1wgv s ILE 78 Cb -0.08 -1.87 0.23 0.00 2.95 0.00 0.00 42.46 43.69 1wgv s ILE 78 CO 0.50 -0.14 1.26 0.21 -1.79 0.00 0.00 174.94 174.98 1wgv s ASN 79 N -2.95 7.21 0.44 4.36 3.84 -1.11 -4.66 114.94 122.07 1wgv s ASN 79 Ca 0.16 -3.32 0.30 0.00 0.21 0.00 0.00 52.86 50.21 1wgv s ASN 79 Cb 0.00 -2.30 1.41 0.00 -0.55 0.00 0.00 41.25 39.82 1wgv s ASN 79 CO 0.02 -0.50 1.63 0.71 -2.79 0.00 0.00 177.10 176.17 1wgv h THR 80 N 4.13 0.14 0.07 -5.21 1.35 -1.88 0.92 112.91 112.43 1wgv h THR 80 Ca 0.24 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 66.07 1wgv h THR 80 Cb 0.87 0.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.32 1wgv h THR 80 CO 1.12 0.02 -0.07 -0.33 -0.25 0.00 0.00 175.52 176.01 1wgv h GLU 81 N 0.10 -0.15 0.00 4.72 4.39 -1.94 -1.80 114.58 119.90 1wgv h GLU 81 Ca 0.81 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.52 1wgv h GLU 81 Cb 2.52 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 31.20 1wgv h GLU 81 CO -0.41 -0.10 0.00 0.77 -1.16 0.00 0.00 179.01 178.11 1wgv h SER 82 N -0.15 0.00 -3.70 1.42 0.02 0.17 -3.44 113.55 107.87 1wgv h SER 82 Ca 0.00 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.45 1wgv h SER 82 Cb 0.14 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1wgv h SER 82 CO -0.01 0.00 0.23 -0.44 -1.14 0.00 0.00 176.83 175.47 1wgv s SER 83 N -5.34 7.28 0.35 3.07 0.01 0.17 -4.75 113.70 114.48 1wgv s SER 83 Ca 0.06 1.67 0.07 0.00 1.31 0.00 0.00 55.95 59.06 1wgv s SER 83 Cb 0.08 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 1wgv s SER 83 CO 0.57 0.04 0.25 -1.48 0.41 0.00 0.00 173.24 173.04 1wgv s LEU 84 N -1.77 1.80 -0.28 2.44 0.05 -0.96 -4.84 118.68 115.11 1wgv s LEU 84 Ca 0.44 -1.75 -0.10 0.00 0.05 0.00 0.00 54.13 52.77 1wgv s LEU 84 Cb -0.20 0.44 0.12 0.00 -2.05 0.00 0.00 46.19 44.51 1wgv s LEU 84 CO 0.24 -1.05 0.62 -1.66 -0.55 0.00 0.00 176.35 173.96 1wgv s TRP 85 N -3.40 -1.25 -0.12 3.48 1.48 -1.26 -1.08 118.94 116.80 1wgv s TRP 85 Ca 0.37 2.21 0.03 0.00 -1.06 0.00 0.00 56.10 57.65 1wgv s TRP 85 Cb 0.02 0.73 0.00 0.00 -1.16 0.00 0.00 33.47 33.06 1wgv s TRP 85 CO 0.25 -0.63 -0.22 -1.12 -4.06 0.00 0.00 176.95 171.17 1wgv s SER 86 N 2.74 3.21 0.07 -2.66 0.01 0.20 -4.98 113.70 112.29 1wgv s SER 86 Ca -0.06 -0.55 -0.11 0.00 1.31 0.00 0.00 55.95 56.55 1wgv s SER 86 Cb -0.11 -1.45 -0.06 0.00 0.21 0.00 0.00 66.02 64.61 1wgv s SER 86 CO -0.18 0.14 0.41 -0.22 0.41 0.00 0.00 173.24 173.80 1wgv s LEU 87 N 0.49 4.37 -0.05 2.44 1.98 -1.26 -0.54 118.68 126.11 1wgv s LEU 87 Ca -0.14 0.84 0.05 0.00 -2.89 0.00 0.00 54.13 51.98 1wgv s LEU 87 Cb -0.17 -2.94 -0.01 0.00 0.66 0.00 0.00 46.19 43.73 1wgv s LEU 87 CO 0.05 0.19 -0.20 -1.61 -1.89 0.00 0.00 176.35 172.89 1wgv s GLU 88 N -1.79 2.07 -0.13 1.98 2.02 -1.04 -4.96 118.70 116.84 1wgv s GLU 88 Ca 0.32 -0.73 -0.29 0.00 0.02 0.00 0.00 54.97 54.28 1wgv s GLU 88 Cb -0.14 -1.79 -0.02 0.00 0.10 0.00 0.00 34.13 32.28 1wgv s GLU 88 CO 0.17 0.31 1.26 -1.25 0.02 0.00 0.00 175.26 175.77 1wgv s PRO 89 N -0.07 4.26 -1.14 0.39 0.04 -1.26 -3.55 135.00 133.67 1wgv s PRO 89 Ca -0.03 1.68 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 1wgv s PRO 89 Cb -0.12 -3.71 -0.03 0.00 0.04 0.00 0.00 34.50 30.67 1wgv s PRO 89 CO 0.03 -0.64 0.90 0.41 0.04 0.00 0.00 177.00 177.73 1wgv n GLY 90 N 3.56 -0.78 0.00 0.56 0.00 -0.71 -4.89 105.19 102.94 1wgv n GLY 90 Ca 0.13 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 -3.76 0.00 -3.84 1.61 5.02 -1.23 -5.00 118.16 110.96 1wgv n LYS 91 Ca -0.17 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.06 1wgv n LYS 91 Cb 0.64 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.67 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 4.69 -0.13 0.00 1.01 0.52 -2.49 120.40 121.60 1wgv s VAL 93 Ca 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1wgv s VAL 93 Cb -0.04 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1wgv s VAL 93 CO 0.08 0.55 -0.08 -0.22 0.00 0.00 0.00 175.10 175.43 1wgv s LEU 94 N -0.42 3.05 0.00 3.92 1.98 0.30 -1.24 118.68 126.27 1wgv s LEU 94 Ca 0.09 -0.17 0.01 0.00 -2.89 0.00 0.00 54.13 51.17 1wgv s LEU 94 Cb -0.12 -1.70 -0.01 0.00 0.66 0.00 0.00 46.19 45.02 1wgv s LEU 94 CO 0.02 0.22 -0.04 -0.69 -1.89 0.00 0.00 176.35 173.96 1wgv s VAL 95 N 0.07 0.32 -0.24 1.68 1.01 -1.18 0.59 120.40 122.65 1wgv s VAL 95 Ca -0.02 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1wgv s VAL 95 Cb -0.14 -0.30 0.04 0.00 0.00 0.00 0.00 36.38 35.98 1wgv s VAL 95 CO 0.03 0.03 -0.11 0.20 0.00 0.00 0.00 175.10 175.25 1wgv s ASN 96 N -0.27 4.11 -0.30 3.32 0.01 -0.24 -3.38 114.94 118.19 1wgv s ASN 96 Ca -0.00 -1.07 -0.13 0.00 -0.71 0.00 0.00 52.86 50.94 1wgv s ASN 96 Cb -0.03 -1.57 -0.03 0.00 0.41 0.00 0.00 41.25 40.03 1wgv s ASN 96 CO -0.00 -0.13 0.29 -0.76 -1.51 0.00 0.00 177.10 174.99 1wgv s LEU 97 N 1.21 4.21 0.28 0.60 1.43 -0.77 -2.26 118.68 123.39 1wgv s LEU 97 Ca -0.03 -0.05 -0.27 0.00 -1.03 0.00 0.00 54.13 52.75 1wgv s LEU 97 Cb -0.17 -2.26 -0.09 0.00 0.03 0.00 0.00 46.19 43.69 1wgv s LEU 97 CO -0.07 -0.19 0.92 -0.55 0.23 0.00 0.00 176.35 176.69 1wgv s SER 98 N 1.72 7.42 0.14 2.29 0.15 -1.26 -2.48 113.70 121.67 1wgv s SER 98 Ca 0.10 1.83 -0.28 0.00 0.70 0.00 0.00 55.95 58.30 1wgv s SER 98 Cb -0.16 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.51 1wgv s SER 98 CO 0.11 0.03 0.87 -0.54 1.20 0.00 0.00 173.24 174.91 1wgv s LYS 99 N -1.73 4.66 -0.43 5.44 1.02 -1.26 -2.73 119.74 124.71 1wgv s LYS 99 Ca 0.46 1.31 0.04 0.00 0.02 0.00 0.00 55.97 57.79 1wgv s LYS 99 Cb -0.21 -3.33 0.12 0.00 -0.52 0.00 0.00 37.83 33.89 1wgv s LYS 99 CO 0.26 0.38 0.17 0.08 -0.92 0.00 0.00 175.35 175.32 1wgv s VAL 100 N -0.54 2.51 0.00 3.17 1.01 -1.25 -4.62 120.40 120.68 1wgv s VAL 100 Ca 0.41 -2.81 0.00 0.00 0.00 0.00 0.00 61.98 59.58 1wgv s VAL 100 Cb -0.23 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1wgv s VAL 100 CO 0.28 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.28 1wgv n GLY 101 N 3.71 -2.83 3.50 4.51 0.00 -1.26 -4.70 105.19 108.12 1wgv n GLY 101 Ca 0.04 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.00 3.39 0.14 1.61 2.02 -1.26 -4.98 118.70 118.62 1wgv s GLU 102 Ca 0.00 -1.08 0.06 0.00 0.02 0.00 0.00 54.97 53.97 1wgv s GLU 102 Cb 0.00 -4.72 -0.04 0.00 0.10 0.00 0.00 34.13 29.47 1wgv s GLU 102 CO 0.00 -1.96 -0.14 0.71 0.02 0.00 0.00 175.26 173.89 1wgv s TYR 103 N 4.17 1.46 -0.46 1.61 1.51 -1.26 -5.11 117.35 119.27 1wgv s TYR 103 Ca 0.34 -0.57 -0.12 0.00 -1.01 0.00 0.00 57.07 55.71 1wgv s TYR 103 Cb -0.07 -0.75 0.09 0.00 -0.11 0.00 0.00 41.96 41.12 1wgv s TYR 103 CO -0.00 0.18 0.35 1.67 -1.11 0.00 0.00 175.55 176.64 1wgv s TRP 104 N -2.33 3.31 -1.11 2.71 -2.14 -1.26 -5.00 118.94 113.11 1wgv s TRP 104 Ca 0.12 -1.37 -0.21 0.00 2.66 0.00 0.00 56.10 57.29 1wgv s TRP 104 Cb -0.04 -3.24 0.06 0.00 -3.10 0.00 0.00 33.47 27.15 1wgv s TRP 104 CO 0.03 -0.88 1.53 -1.58 -2.66 0.00 0.00 176.95 173.39 1wgv s TRP 105 N 1.50 2.66 -2.26 1.66 0.52 -1.26 -4.70 118.94 117.07 1wgv s TRP 105 Ca 0.04 -1.16 0.20 0.00 0.02 0.00 0.00 56.10 55.20 1wgv s TRP 105 Cb -0.25 -4.69 0.64 0.00 -1.15 0.00 0.00 33.47 28.02 1wgv s TRP 105 CO 0.03 -1.86 1.49 0.27 0.02 0.00 0.00 176.95 176.89 1wgv n ASN 106 N 8.55 1.96 0.00 2.95 0.23 -1.26 -4.85 115.26 122.84 1wgv n ASN 106 Ca 0.38 -1.79 0.00 0.00 -0.53 0.00 0.00 54.58 52.64 1wgv n ASN 106 Cb 0.49 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 1wgv n ASN 106 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wgv n ALA 107 N 0.53 0.00 0.06 -2.53 0.00 -1.26 -2.25 120.51 115.06 1wgv n ALA 107 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.49 1wgv n ALA 107 Cb 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.76 1wgv n ALA 107 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1wgv h ILE 108 N 0.00 0.68 -1.72 0.00 1.08 -1.93 -3.38 117.51 112.25 1wgv h ILE 108 Ca 0.00 0.00 -0.49 0.00 -0.39 0.00 0.00 64.86 63.98 1wgv h ILE 108 Cb 0.00 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 1wgv h ILE 108 CO 0.00 0.00 -0.41 -0.76 -0.69 0.00 0.00 178.15 176.29 1wgv s LEU 109 N -10.30 3.55 0.55 1.44 1.43 -1.26 -2.42 118.68 111.67 1wgv s LEU 109 Ca -0.14 -0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 52.25 1wgv s LEU 109 Cb 0.08 -2.21 -0.06 0.00 0.03 0.00 0.00 46.19 44.03 1wgv s LEU 109 CO 0.66 -0.48 1.00 -1.61 0.23 0.00 0.00 176.35 176.16 1wgv s GLU 110 N -4.07 3.80 0.00 1.70 2.02 -1.00 -3.91 118.70 117.25 1wgv s GLU 110 Ca 0.44 0.90 0.00 0.00 0.02 0.00 0.00 54.97 56.33 1wgv s GLU 110 Cb -0.05 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.07 1wgv s GLU 110 CO 0.28 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.57 1wgv n GLY 111 N -1.92 1.97 3.55 -1.39 0.00 -1.26 -4.96 105.19 101.18 1wgv n GLY 111 Ca 0.06 -0.29 -0.55 0.00 0.00 0.00 0.00 46.02 45.24 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 1.01 -1.12 1.61 4.07 -1.25 -4.81 120.64 120.14 1wgv n GLU 112 Ca 0.00 0.33 -0.36 0.00 -0.06 0.00 0.00 57.16 57.07 1wgv n GLU 112 Cb 0.00 -2.18 0.01 0.00 -0.06 0.00 0.00 31.44 29.21 1wgv n GLU 112 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1wgv n GLU 113 N 6.75 0.00 -2.45 5.31 1.02 -1.26 -4.74 120.64 125.27 1wgv n GLU 113 Ca 0.35 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 57.07 1wgv n GLU 113 Cb 0.15 -0.93 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 1wgv n GLU 113 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wgv s PRO 114 N -1.07 4.39 1.00 3.49 0.04 -1.26 -4.76 135.00 136.83 1wgv s PRO 114 Ca 0.50 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 63.09 1wgv s PRO 114 Cb -0.42 -3.48 -0.02 0.00 0.04 0.00 0.00 34.50 30.63 1wgv s PRO 114 CO 0.64 -0.36 -0.14 0.44 0.04 0.00 0.00 177.00 177.61 1wgv n ILE 115 N 4.33 0.00 -2.74 0.56 -5.35 -0.95 -4.93 119.36 110.27 1wgv n ILE 115 Ca 0.10 -0.27 -0.22 0.00 -0.27 0.00 0.00 62.75 62.09 1wgv n ILE 115 Cb 0.46 -0.41 -0.01 0.00 -1.74 0.00 0.00 39.64 37.95 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 0.23 3.45 -3.62 7.28 8.00 -1.26 -5.08 116.55 125.55 1wgv n ASP 116 Ca 0.03 -3.41 -0.20 0.00 0.71 0.00 0.00 54.79 51.92 1wgv n ASP 116 Cb 0.58 -0.52 0.16 0.00 -0.02 0.00 0.00 41.12 41.32 1wgv n ASP 116 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1wgv n ILE 117 N -0.23 0.00 -3.62 0.53 -6.64 -1.26 -5.05 119.36 103.10 1wgv n ILE 117 Ca 0.29 -0.05 -0.06 0.00 -1.77 0.00 0.00 62.75 61.15 1wgv n ILE 117 Cb 0.62 -0.55 -0.05 0.00 -1.44 0.00 0.00 39.64 38.22 1wgv n ILE 117 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1wgv s ASP 118 N -2.08 -0.20 0.08 7.28 2.15 -1.26 -5.11 116.67 117.53 1wgv s ASP 118 Ca 0.41 0.25 0.04 0.00 0.43 0.00 0.00 52.55 53.67 1wgv s ASP 118 Cb -0.07 0.21 -0.03 0.00 -0.30 0.00 0.00 42.92 42.72 1wgv s ASP 118 CO 0.38 -0.16 -0.10 -0.44 -0.17 0.00 0.00 175.17 174.68 1wgv s SER 119 N -0.85 1.37 0.28 -0.34 0.01 -1.26 -5.06 113.70 107.85 1wgv s SER 119 Ca 0.04 -0.71 0.00 0.00 1.31 0.00 0.00 55.95 56.59 1wgv s SER 119 Cb -0.01 0.00 0.00 0.00 0.21 0.00 0.00 66.02 66.22 1wgv s SER 119 CO -0.05 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1wgv n GLY 120 N 0.91 -2.02 0.10 3.44 0.00 -1.26 -3.46 105.19 102.90 1wgv n GLY 120 Ca -0.19 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.48 1wgv n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgv h PRO 121 N -0.96 -0.11 -4.92 1.61 0.13 -2.05 -3.44 132.00 122.27 1wgv h PRO 121 Ca -0.01 0.01 -0.67 0.00 -0.87 0.00 0.00 66.00 64.45 1wgv h PRO 121 Cb 0.94 0.02 -0.33 0.00 0.13 0.00 0.00 31.00 31.77 1wgv h PRO 121 CO 0.02 0.43 -0.77 -1.54 -0.23 0.00 0.00 178.00 175.91 1wgv s SER 122 N -5.70 4.16 0.61 1.44 1.04 -1.26 -5.02 113.70 108.96 1wgv s SER 122 Ca -0.13 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.38 1wgv s SER 122 Cb -0.00 -1.62 0.00 0.00 0.10 0.00 0.00 66.02 64.50 1wgv s SER 122 CO 0.51 -0.12 0.00 -0.24 0.98 0.00 0.00 173.24 174.37 1wgv n SER 123 N 4.63 -7.66 0.00 7.02 2.88 -1.26 -5.09 113.62 114.14 1wgv n SER 123 Ca -0.17 1.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 1wgv n SER 123 Cb 0.47 -4.93 0.00 0.00 -0.75 0.00 0.00 64.21 58.99 1wgv n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42