#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxb s SER 2 N 0.00 -1.43 -0.31 1.61 0.15 -1.26 -5.11 113.70 107.35 1wxb s SER 2 Ca 0.00 0.54 -0.01 0.00 0.70 0.00 0.00 55.95 57.18 1wxb s SER 2 Cb 0.00 2.06 0.13 0.00 -1.71 0.00 0.00 66.02 66.50 1wxb s SER 2 CO 0.00 -0.26 0.26 -0.94 1.20 0.00 0.00 173.24 173.49 1wxb s SER 3 N 2.85 2.23 0.00 5.45 1.04 -1.26 -5.10 113.70 118.91 1wxb s SER 3 Ca 0.16 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1wxb s SER 3 Cb -0.12 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1wxb s SER 3 CO -0.23 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1wxb n GLY 4 N 4.96 1.19 3.60 7.32 0.00 -1.26 -4.98 105.19 116.02 1wxb n GLY 4 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1wxb n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wxb n SER 5 N 0.00 -0.17 -2.77 1.61 2.88 -1.26 -5.01 113.62 108.90 1wxb n SER 5 Ca 0.00 0.44 -0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1wxb n SER 5 Cb 0.00 -1.41 0.01 0.00 -0.75 0.00 0.00 64.21 62.07 1wxb n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wxb s SER 6 N -2.32 -0.48 -0.43 -3.46 0.15 -1.26 -5.09 113.70 100.80 1wxb s SER 6 Ca 0.66 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.93 1wxb s SER 6 Cb -0.24 0.62 0.21 0.00 -1.71 0.00 0.00 66.02 64.89 1wxb s SER 6 CO 0.59 -0.04 0.93 0.61 1.20 0.00 0.00 173.24 176.53 1wxb n GLY 7 N 3.31 -1.08 3.93 9.45 0.00 -1.26 -5.16 105.19 114.37 1wxb n GLY 7 Ca 0.09 0.83 -0.26 0.00 0.00 0.00 0.00 46.02 46.68 1wxb n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wxb s LYS 8 N 0.86 2.47 0.10 1.61 3.01 -1.26 -5.04 119.74 121.49 1wxb s LYS 8 Ca 0.27 -0.20 -0.06 0.00 -1.01 0.00 0.00 55.97 54.98 1wxb s LYS 8 Cb 0.08 -2.22 -0.02 0.00 -1.01 0.00 0.00 37.83 34.66 1wxb s LYS 8 CO -0.09 -1.02 0.13 0.71 0.51 0.00 0.00 175.35 175.60 1wxb s TYR 9 N -3.13 0.39 0.04 3.18 2.02 -1.26 -3.08 117.35 115.51 1wxb s TYR 9 Ca 0.58 -0.83 0.03 0.00 -0.37 0.00 0.00 57.07 56.48 1wxb s TYR 9 Cb -0.11 -0.20 -0.02 0.00 -0.40 0.00 0.00 41.96 41.23 1wxb s TYR 9 CO 0.44 -0.53 -0.10 0.54 -1.57 0.00 0.00 175.55 174.33 1wxb s VAL 10 N -3.92 0.74 -0.18 0.71 0.11 -0.20 -4.20 120.40 113.46 1wxb s VAL 10 Ca 0.10 -0.97 -0.05 0.00 -2.93 0.00 0.00 61.98 58.13 1wxb s VAL 10 Cb 0.06 -0.73 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1wxb s VAL 10 CO -0.07 -0.19 0.01 -0.75 -3.33 0.00 0.00 175.10 170.77 1wxb s LYS 11 N -1.29 3.73 0.02 1.54 2.20 -0.98 -0.44 119.74 124.53 1wxb s LYS 11 Ca -0.04 -0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 54.79 1wxb s LYS 11 Cb -0.08 -3.08 -0.05 0.00 -1.51 0.00 0.00 37.83 33.10 1wxb s LYS 11 CO 0.01 0.14 1.29 0.42 -0.36 0.00 0.00 175.35 176.85 1wxb s ILE 12 N 0.68 3.88 -0.14 5.43 -1.09 0.18 -2.68 121.20 127.47 1wxb s ILE 12 Ca 0.00 1.30 0.21 0.00 -2.23 0.00 0.00 60.65 59.93 1wxb s ILE 12 Cb -0.14 -3.83 -0.17 0.00 -1.58 0.00 0.00 42.46 36.74 1wxb s ILE 12 CO 0.02 0.04 0.71 0.18 -1.23 0.00 0.00 174.94 174.67 1wxb n LEU 13 N 4.69 0.46 -3.87 2.97 4.77 -0.19 0.51 117.00 126.34 1wxb n LEU 13 Ca 0.11 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.16 1wxb n LEU 13 Cb 0.45 0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.45 1wxb n LEU 13 CO 0.57 -0.00 -0.26 -0.31 -1.33 0.00 0.00 177.39 176.05 1wxb s TYR 14 N -3.28 -0.01 -0.36 -1.77 2.02 -1.26 -4.69 117.35 108.01 1wxb s TYR 14 Ca -0.05 0.04 -0.29 0.00 -0.37 0.00 0.00 57.07 56.40 1wxb s TYR 14 Cb 0.11 -0.02 -0.00 0.00 -0.40 0.00 0.00 41.96 41.65 1wxb s TYR 14 CO 0.84 -0.12 1.53 -0.51 -1.57 0.00 0.00 175.55 175.72 1wxb s ASP 15 N -0.48 6.25 -0.05 2.29 1.11 -1.26 -4.28 116.67 120.26 1wxb s ASP 15 Ca -0.05 1.07 0.01 0.00 0.18 0.00 0.00 52.55 53.75 1wxb s ASP 15 Cb -0.04 -2.54 -0.03 0.00 1.07 0.00 0.00 42.92 41.39 1wxb s ASP 15 CO 0.00 -1.46 -0.05 0.12 1.18 0.00 0.00 175.17 174.97 1wxb s PHE 16 N 5.71 2.98 -0.19 4.23 5.36 0.16 -4.89 117.98 131.35 1wxb s PHE 16 Ca 0.67 0.05 0.01 0.00 -0.96 0.00 0.00 56.93 56.70 1wxb s PHE 16 Cb -0.17 -1.70 0.02 0.00 -0.34 0.00 0.00 43.02 40.83 1wxb s PHE 16 CO 0.32 0.38 -0.18 0.99 -1.46 0.00 0.00 175.22 175.26 1wxb s THR 17 N -0.89 2.03 -0.49 0.12 2.01 -1.26 0.47 115.64 117.62 1wxb s THR 17 Ca 0.14 -0.99 -0.45 0.00 0.31 0.00 0.00 61.69 60.70 1wxb s THR 17 Cb -0.11 -1.87 -0.19 0.00 0.01 0.00 0.00 72.50 70.34 1wxb s THR 17 CO 0.04 0.47 1.84 0.00 -0.69 0.00 0.00 174.62 176.28 1wxb n ALA 18 N 4.61 -0.62 0.88 7.40 0.00 -1.19 -4.77 120.51 126.83 1wxb n ALA 18 Ca -0.20 0.36 0.11 0.00 0.00 0.00 0.00 53.44 53.71 1wxb n ALA 18 Cb 0.49 -2.01 0.05 0.00 0.00 0.00 0.00 19.45 17.99 1wxb n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wxb n ARG 19 N 5.58 0.08 -2.50 0.00 1.74 -1.26 -4.95 116.66 115.36 1wxb n ARG 19 Ca 0.41 -0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.44 1wxb n ARG 19 Cb -0.04 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 29.86 1wxb n ARG 19 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1wxb n ASN 20 N -1.62 -0.17 0.09 0.55 3.02 -1.26 -5.04 115.26 110.83 1wxb n ASN 20 Ca 0.04 -1.50 -0.04 0.00 -0.03 0.00 0.00 54.58 53.06 1wxb n ASN 20 Cb 0.36 0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 39.86 1wxb n ASN 20 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wxb h ALA 21 N 1.25 0.49 -0.84 5.41 0.00 -2.02 -3.22 119.26 120.34 1wxb h ALA 21 Ca -0.05 -0.75 -0.60 0.00 0.00 0.00 0.00 54.91 53.51 1wxb h ALA 21 Cb 0.27 -0.13 -0.24 0.00 0.00 0.00 0.00 17.79 17.69 1wxb h ALA 21 CO 0.08 1.03 0.76 0.09 0.00 0.00 0.00 179.25 181.21 1wxb n ASN 22 N -3.34 7.28 -4.13 0.00 4.13 -1.26 -4.90 115.26 113.03 1wxb n ASN 22 Ca 0.00 -3.58 -0.09 0.00 1.68 0.00 0.00 54.58 52.59 1wxb n ASN 22 Cb 0.85 -1.04 -0.10 0.00 -1.54 0.00 0.00 39.78 37.95 1wxb n ASN 22 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1wxb s GLU 23 N -3.21 0.73 0.02 3.52 2.02 -1.22 -3.10 118.70 117.46 1wxb s GLU 23 Ca 0.54 -1.27 0.08 0.00 0.02 0.00 0.00 54.97 54.34 1wxb s GLU 23 Cb 0.42 -0.02 -0.02 0.00 0.10 0.00 0.00 34.13 34.61 1wxb s GLU 23 CO -0.11 -0.06 -0.23 -1.17 0.02 0.00 0.00 175.26 173.71 1wxb s LEU 24 N -2.95 2.12 -0.34 1.80 2.96 -1.20 -4.57 118.68 116.50 1wxb s LEU 24 Ca 0.09 -0.50 -0.13 0.00 -0.22 0.00 0.00 54.13 53.37 1wxb s LEU 24 Cb 0.06 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.60 1wxb s LEU 24 CO -0.07 0.23 0.26 -0.94 -1.32 0.00 0.00 176.35 174.51 1wxb s SER 25 N -0.96 6.08 0.10 3.68 1.04 -1.26 -3.15 113.70 119.23 1wxb s SER 25 Ca 0.09 -0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.13 1wxb s SER 25 Cb -0.09 -2.15 -0.04 0.00 0.10 0.00 0.00 66.02 63.84 1wxb s SER 25 CO 0.01 -0.26 -0.08 0.68 0.98 0.00 0.00 173.24 174.57 1wxb s VAL 26 N 1.76 0.80 0.58 5.02 -7.23 0.18 -4.91 120.40 116.60 1wxb s VAL 26 Ca 0.07 -1.85 0.09 0.00 -1.81 0.00 0.00 61.98 58.48 1wxb s VAL 26 Cb -0.17 -1.58 0.08 0.00 0.56 0.00 0.00 36.38 35.27 1wxb s VAL 26 CO 0.11 -0.77 0.75 -0.76 -0.31 0.00 0.00 175.10 174.12 1wxb s LEU 27 N -2.87 3.02 0.14 1.32 2.01 -1.26 0.40 118.68 121.44 1wxb s LEU 27 Ca 0.10 -0.92 -0.20 0.00 0.01 0.00 0.00 54.13 53.11 1wxb s LEU 27 Cb 0.02 -1.53 -0.07 0.00 0.01 0.00 0.00 46.19 44.62 1wxb s LEU 27 CO -0.03 -1.34 0.65 -0.75 1.01 0.00 0.00 176.35 175.90 1wxb s LYS 28 N -4.63 4.28 0.00 1.70 2.36 -1.26 -3.48 119.74 118.72 1wxb s LYS 28 Ca 0.58 0.85 0.00 0.00 -2.55 0.00 0.00 55.97 54.85 1wxb s LYS 28 Cb -0.05 -3.14 0.00 0.00 -1.05 0.00 0.00 37.83 33.59 1wxb s LYS 28 CO 0.37 0.55 0.00 -3.47 1.55 0.00 0.00 175.35 174.35 1wxb n ASP 29 N 1.38 0.00 -4.67 1.43 2.03 0.18 -4.92 116.55 111.98 1wxb n ASP 29 Ca -0.07 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 54.95 1wxb n ASP 29 Cb 0.50 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 41.07 1wxb n ASP 29 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1wxb s GLU 30 N -0.24 0.63 -0.07 -0.67 8.01 -1.23 -4.67 118.70 120.46 1wxb s GLU 30 Ca 0.00 0.69 -0.01 0.00 0.01 0.00 0.00 54.97 55.66 1wxb s GLU 30 Cb 0.00 -1.75 0.03 0.00 -4.31 0.00 0.00 34.13 28.10 1wxb s GLU 30 CO 0.00 -2.64 -0.02 0.08 0.01 0.00 0.00 175.26 172.69 1wxb s VAL 31 N -2.90 0.50 0.50 2.63 1.01 -1.26 0.50 120.40 121.38 1wxb s VAL 31 Ca 0.65 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.70 1wxb s VAL 31 Cb -0.19 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1wxb s VAL 31 CO 0.58 0.27 0.25 -0.76 0.00 0.00 0.00 175.10 175.44 1wxb s LEU 32 N 1.75 2.71 -0.25 3.92 2.01 0.42 -4.90 118.68 124.33 1wxb s LEU 32 Ca 0.02 -1.30 -0.06 0.00 0.01 0.00 0.00 54.13 52.80 1wxb s LEU 32 Cb -0.13 -1.15 -0.02 0.00 0.01 0.00 0.00 46.19 44.91 1wxb s LEU 32 CO -0.05 -0.90 0.05 -0.70 1.01 0.00 0.00 176.35 175.76 1wxb s GLU 33 N -4.09 3.46 0.05 1.70 2.12 -1.19 -1.03 118.70 119.72 1wxb s GLU 33 Ca 0.29 -0.60 -0.30 0.00 0.36 0.00 0.00 54.97 54.72 1wxb s GLU 33 Cb 0.00 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 1wxb s GLU 33 CO 0.17 -0.25 0.96 0.54 -0.54 0.00 0.00 175.26 176.14 1wxb s VAL 34 N 1.56 4.70 -0.03 3.70 0.11 -1.18 -1.66 120.40 127.60 1wxb s VAL 34 Ca 0.05 2.05 -0.02 0.00 -2.93 0.00 0.00 61.98 61.13 1wxb s VAL 34 Cb -0.15 -4.32 -0.02 0.00 -1.53 0.00 0.00 36.38 30.36 1wxb s VAL 34 CO 0.02 0.24 -0.05 0.18 -3.33 0.00 0.00 175.10 172.15 1wxb n LEU 35 N 3.37 0.40 -4.24 2.54 4.77 -0.68 -4.45 117.00 118.71 1wxb n LEU 35 Ca 0.04 0.06 -0.33 0.00 -0.03 0.00 0.00 56.01 55.75 1wxb n LEU 35 Cb 0.50 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 41.28 1wxb n LEU 35 CO 0.51 0.00 -0.48 -1.61 -1.33 0.00 0.00 177.39 174.48 1wxb s GLU 36 N -2.08 3.19 0.32 3.23 0.41 -1.21 -5.01 118.70 117.54 1wxb s GLU 36 Ca -0.06 -0.76 0.03 0.00 -0.41 0.00 0.00 54.97 53.78 1wxb s GLU 36 Cb 0.02 -2.64 -0.04 0.00 -1.78 0.00 0.00 34.13 29.69 1wxb s GLU 36 CO 0.07 -0.04 0.13 0.16 -0.49 0.00 0.00 175.26 175.10 1wxb s ASP 37 N 0.94 1.78 0.00 -0.19 -4.77 -1.26 -2.17 116.67 111.01 1wxb s ASP 37 Ca -0.03 -1.52 0.00 0.00 -3.30 0.00 0.00 52.55 47.70 1wxb s ASP 37 Cb -0.15 0.31 0.00 0.00 -1.09 0.00 0.00 42.92 41.99 1wxb s ASP 37 CO -0.02 -0.83 0.00 0.61 0.70 0.00 0.00 175.17 175.63 1wxb n GLY 38 N -0.63 1.44 3.83 2.12 0.00 -1.26 -5.05 105.19 105.64 1wxb n GLY 38 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1wxb n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wxb s ARG 39 N -0.97 2.64 0.03 1.61 0.52 -1.26 -5.05 118.95 116.47 1wxb s ARG 39 Ca 0.00 -1.35 -0.07 0.00 -0.52 0.00 0.00 55.73 53.78 1wxb s ARG 39 Cb 0.00 -2.41 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 1wxb s ARG 39 CO 0.00 0.09 1.12 1.96 0.02 0.00 0.00 175.30 178.49 1wxb h GLN 40 N 1.31 -0.08 -5.80 3.54 4.20 -1.97 -3.38 115.11 112.93 1wxb h GLN 40 Ca -0.44 0.01 -0.59 0.00 0.06 0.00 0.00 58.65 57.68 1wxb h GLN 40 Cb 1.25 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.98 1wxb h GLN 40 CO 0.59 -0.05 -0.19 -1.58 -0.67 0.00 0.00 178.83 176.93 1wxb s TRP 41 N -3.58 3.58 0.48 2.96 0.52 -1.26 -3.86 118.94 117.78 1wxb s TRP 41 Ca -0.03 0.88 -0.03 0.00 0.02 0.00 0.00 56.10 56.94 1wxb s TRP 41 Cb 0.02 -2.42 -0.01 0.00 -1.15 0.00 0.00 33.47 29.91 1wxb s TRP 41 CO 0.14 0.35 0.74 -1.58 0.02 0.00 0.00 176.95 176.62 1wxb s TRP 42 N -0.03 3.35 -0.40 -1.98 0.51 -0.74 -4.83 118.94 114.82 1wxb s TRP 42 Ca 0.24 0.50 -0.01 0.00 -2.12 0.00 0.00 56.10 54.70 1wxb s TRP 42 Cb -0.15 -2.37 0.11 0.00 -0.81 0.00 0.00 33.47 30.24 1wxb s TRP 42 CO 0.10 -0.40 0.17 0.21 -0.51 0.00 0.00 176.95 176.52 1wxb s LYS 43 N -4.69 1.87 0.26 4.98 2.20 -0.92 -2.22 119.74 121.22 1wxb s LYS 43 Ca 0.49 -1.86 0.06 0.00 -0.36 0.00 0.00 55.97 54.30 1wxb s LYS 43 Cb -0.10 -3.49 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 1wxb s LYS 43 CO 0.41 -1.04 0.31 -0.51 -0.36 0.00 0.00 175.35 174.16 1wxb s LEU 44 N 1.04 4.05 -0.08 5.43 2.01 -0.99 -1.68 118.68 128.46 1wxb s LEU 44 Ca 0.09 -0.11 -0.00 0.00 0.01 0.00 0.00 54.13 54.12 1wxb s LEU 44 Cb -0.22 -2.62 0.02 0.00 0.01 0.00 0.00 46.19 43.39 1wxb s LEU 44 CO -0.05 -0.11 -0.04 -0.60 1.01 0.00 0.00 176.35 176.55 1wxb s ARG 45 N -3.95 1.05 0.88 1.70 3.52 -0.67 -2.02 118.95 119.47 1wxb s ARG 45 Ca 0.35 -0.10 -0.11 0.00 -0.13 0.00 0.00 55.73 55.74 1wxb s ARG 45 Cb -0.08 -1.19 0.12 0.00 -1.56 0.00 0.00 34.95 32.24 1wxb s ARG 45 CO 0.28 -0.22 1.09 0.45 -0.81 0.00 0.00 175.30 176.09 1wxb s SER 46 N 1.57 3.50 0.62 -2.12 0.15 0.09 -3.18 113.70 114.33 1wxb s SER 46 Ca 0.00 1.67 0.36 0.00 0.70 0.00 0.00 55.95 58.69 1wxb s SER 46 Cb -0.13 -2.33 2.08 0.00 -1.71 0.00 0.00 66.02 63.93 1wxb s SER 46 CO -0.05 -2.65 2.30 0.08 1.20 0.00 0.00 173.24 174.12 1wxb h ARG 47 N -1.56 0.00 0.00 5.44 -0.00 -1.90 0.18 114.38 116.54 1wxb h ARG 47 Ca -0.48 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.50 1wxb h ARG 47 Cb 1.27 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.24 1wxb h ARG 47 CO 0.52 0.00 -0.01 1.03 -0.00 0.00 0.00 179.97 181.52 1wxb h SER 48 N 0.00 0.00 0.00 0.08 0.87 -2.03 -3.45 113.55 109.02 1wxb h SER 48 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1wxb h SER 48 Cb 0.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1wxb h SER 48 CO 0.00 0.01 0.00 0.61 -0.53 0.00 0.00 176.83 176.92 1wxb n GLY 49 N -0.21 1.03 3.74 5.77 0.00 0.62 -5.08 105.19 111.06 1wxb n GLY 49 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1wxb n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wxb s GLN 50 N -0.59 2.57 -0.03 1.61 -1.52 -1.25 -4.76 119.66 115.70 1wxb s GLN 50 Ca 0.00 1.73 0.00 0.00 -1.95 0.00 0.00 55.36 55.15 1wxb s GLN 50 Cb 0.00 -1.89 0.03 0.00 -0.22 0.00 0.00 33.01 30.93 1wxb s GLN 50 CO 0.00 -1.50 0.01 0.00 -0.25 0.00 0.00 175.29 173.55 1wxb s ALA 51 N -1.88 0.24 0.31 6.09 0.00 -1.26 -0.73 121.76 124.52 1wxb s ALA 51 Ca 0.75 0.20 -0.07 0.00 0.00 0.00 0.00 51.96 52.83 1wxb s ALA 51 Cb -0.28 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1wxb s ALA 51 CO 0.40 -0.07 0.48 0.20 0.00 0.00 0.00 175.76 176.77 1wxb s GLY 52 N 0.98 1.05 -0.03 0.00 0.00 -0.86 -4.92 107.32 103.55 1wxb s GLY 52 Ca -0.09 -1.24 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 1wxb s GLY 52 CO -0.02 -0.83 0.04 -0.19 0.00 0.00 0.00 173.10 172.10 1wxb s TYR 53 N -3.39 3.21 0.16 1.90 2.02 -1.18 -2.35 117.35 117.72 1wxb s TYR 53 Ca 0.27 0.18 -0.06 0.00 -0.37 0.00 0.00 57.07 57.09 1wxb s TYR 53 Cb -0.00 -1.74 -0.02 0.00 -0.40 0.00 0.00 41.96 39.79 1wxb s TYR 53 CO 0.15 0.51 0.21 0.14 -1.57 0.00 0.00 175.55 174.99 1wxb s VAL 54 N -1.07 0.08 0.42 0.71 -7.23 -0.94 -3.21 120.40 109.15 1wxb s VAL 54 Ca 0.19 -1.57 -0.23 0.00 -1.81 0.00 0.00 61.98 58.55 1wxb s VAL 54 Cb -0.12 -1.93 -0.09 0.00 0.56 0.00 0.00 36.38 34.81 1wxb s VAL 54 CO 0.09 -0.34 1.05 -2.16 -0.31 0.00 0.00 175.10 173.43 1wxb s PRO 55 N -4.00 4.09 0.00 4.82 0.04 -1.26 -1.79 135.00 136.90 1wxb s PRO 55 Ca 0.20 1.50 0.29 0.00 0.04 0.00 0.00 61.00 63.03 1wxb s PRO 55 Cb 0.05 -2.46 1.49 0.00 0.04 0.00 0.00 34.50 33.62 1wxb s PRO 55 CO 0.01 -0.20 1.99 0.00 0.04 0.00 0.00 177.00 178.83 1wxb h ASN 57 N 0.90 0.00 0.09 0.00 4.21 -1.91 -3.11 115.58 115.76 1wxb h ASN 57 Ca 0.00 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.32 1wxb h ASN 57 Cb 0.19 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.36 1wxb h ASN 57 CO 0.00 0.44 -2.10 2.30 -1.29 0.00 0.00 177.43 176.78 1wxb n ILE 58 N -3.46 0.77 -1.74 2.81 -5.35 -1.19 -4.95 119.36 106.23 1wxb n ILE 58 Ca 0.00 -0.68 -0.33 0.00 -0.27 0.00 0.00 62.75 61.46 1wxb n ILE 58 Cb 0.58 -0.29 0.05 0.00 -1.74 0.00 0.00 39.64 38.24 1wxb n ILE 58 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1wxb s LEU 59 N -5.11 3.41 -0.01 7.28 1.43 -1.18 -1.02 118.68 123.49 1wxb s LEU 59 Ca -0.08 2.10 -0.24 0.00 -1.03 0.00 0.00 54.13 54.87 1wxb s LEU 59 Cb 0.10 -4.56 0.05 0.00 0.03 0.00 0.00 46.19 41.81 1wxb s LEU 59 CO 0.86 -1.72 0.54 -0.83 0.23 0.00 0.00 176.35 175.43 1wxb s GLY 60 N -2.38 -0.43 0.35 -3.19 0.00 -1.09 -4.86 107.32 95.72 1wxb s GLY 60 Ca 0.69 0.85 -0.29 0.00 0.00 0.00 0.00 44.72 45.97 1wxb s GLY 60 CO 0.41 0.54 1.51 -1.83 0.00 0.00 0.00 173.10 173.73 1wxb s GLU 61 N -1.66 4.12 0.20 2.90 1.03 -1.26 -2.33 118.70 121.71 1wxb s GLU 61 Ca -0.10 2.56 0.08 0.00 0.03 0.00 0.00 54.97 57.55 1wxb s GLU 61 Cb -0.01 -2.99 -0.04 0.00 -0.80 0.00 0.00 34.13 30.29 1wxb s GLU 61 CO 0.05 -0.55 -0.03 0.00 -1.33 0.00 0.00 175.26 173.40 1wxb s ALA 62 N -0.80 3.12 -0.85 -0.84 0.00 -1.26 -4.70 121.76 116.43 1wxb s ALA 62 Ca 0.56 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1wxb s ALA 62 Cb -0.47 -0.86 0.26 0.00 0.00 0.00 0.00 23.12 22.05 1wxb s ALA 62 CO 0.58 0.41 0.96 0.45 0.00 0.00 0.00 175.76 178.17 1wxb n SER 63 N -0.33 4.65 -4.87 0.00 2.88 -1.26 -5.00 113.62 109.70 1wxb n SER 63 Ca -0.09 -3.33 -0.30 0.00 -1.33 0.00 0.00 58.87 53.82 1wxb n SER 63 Cb 0.56 -0.97 0.06 0.00 -0.75 0.00 0.00 64.21 63.12 1wxb n SER 63 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wxb s GLY 64 N -1.52 1.62 0.42 0.46 0.00 -1.26 -5.03 107.32 102.01 1wxb s GLY 64 Ca 0.33 -0.34 -0.23 0.00 0.00 0.00 0.00 44.72 44.48 1wxb s GLY 64 CO -0.02 0.05 1.05 2.56 0.00 0.00 0.00 173.10 176.74 1wxb s PRO 65 N -5.34 4.07 -0.01 2.90 0.04 -1.26 -4.98 135.00 130.42 1wxb s PRO 65 Ca 0.59 1.48 -0.05 0.00 0.04 0.00 0.00 61.00 63.07 1wxb s PRO 65 Cb -0.12 -2.43 -0.02 0.00 0.04 0.00 0.00 34.50 31.97 1wxb s PRO 65 CO 0.52 -0.22 -0.10 0.43 0.04 0.00 0.00 177.00 177.67 1wxb n SER 66 N -0.29 1.08 -4.83 6.66 7.64 -1.26 -5.05 113.62 117.56 1wxb n SER 66 Ca 0.06 0.16 -0.30 0.00 1.01 0.00 0.00 58.87 59.80 1wxb n SER 66 Cb 0.50 -0.38 0.08 0.00 -1.01 0.00 0.00 64.21 63.40 1wxb n SER 66 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wxb s SER 67 N -5.88 4.75 0.00 6.43 0.15 -1.26 -5.23 113.70 112.66 1wxb s SER 67 Ca -0.09 1.22 0.00 0.00 0.70 0.00 0.00 55.95 57.78 1wxb s SER 67 Cb 0.02 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.37 1wxb s SER 67 CO 0.12 -1.79 0.00 0.61 1.20 0.00 0.00 173.24 173.38