#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxb n SER 2 N 0.00 -3.52 -2.78 1.61 7.64 -1.26 -5.06 113.62 110.25 1wxb n SER 2 Ca 0.00 0.77 -0.04 0.00 1.01 0.00 0.00 58.87 60.61 1wxb n SER 2 Cb 0.00 3.34 0.01 0.00 -1.01 0.00 0.00 64.21 66.55 1wxb n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wxb s SER 3 N -2.16 -1.44 0.44 6.43 0.15 -1.26 -5.13 113.70 110.74 1wxb s SER 3 Ca 0.00 -1.71 0.00 0.00 0.70 0.00 0.00 55.95 54.94 1wxb s SER 3 Cb 0.00 1.89 0.00 0.00 -1.71 0.00 0.00 66.02 66.20 1wxb s SER 3 CO 0.00 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1wxb n GLY 4 N 3.00 -3.76 3.03 9.45 0.00 -1.26 -4.88 105.19 110.77 1wxb n GLY 4 Ca 0.18 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1wxb n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wxb s SER 5 N -4.80 4.80 -0.22 1.61 0.15 -1.26 -5.05 113.70 108.93 1wxb s SER 5 Ca 0.00 -2.24 -0.33 0.00 0.70 0.00 0.00 55.95 54.08 1wxb s SER 5 Cb 0.00 -1.66 0.15 0.00 -1.71 0.00 0.00 66.02 62.80 1wxb s SER 5 CO 0.00 -0.39 1.23 -0.44 1.20 0.00 0.00 173.24 174.84 1wxb s SER 6 N 0.90 -0.13 0.00 5.45 0.01 -1.26 -5.18 113.70 113.48 1wxb s SER 6 Ca 0.11 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.44 1wxb s SER 6 Cb -0.20 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1wxb s SER 6 CO -0.07 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.01 1wxb n GLY 7 N 0.21 3.00 3.64 3.44 0.00 -1.26 -5.15 105.19 109.07 1wxb n GLY 7 Ca -0.01 -1.89 -0.27 0.00 0.00 0.00 0.00 46.02 43.85 1wxb n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wxb s LYS 8 N 3.24 2.01 0.22 1.61 2.20 -1.26 -5.16 119.74 122.60 1wxb s LYS 8 Ca 0.00 -2.00 0.00 0.00 -0.36 0.00 0.00 55.97 53.61 1wxb s LYS 8 Cb 0.00 -1.75 -0.04 0.00 -1.51 0.00 0.00 37.83 34.53 1wxb s LYS 8 CO 0.00 -0.03 0.15 0.71 -0.36 0.00 0.00 175.35 175.82 1wxb s TYR 9 N -2.66 1.24 -0.01 4.03 2.02 -1.26 -4.03 117.35 116.69 1wxb s TYR 9 Ca 0.36 -1.41 0.01 0.00 -0.37 0.00 0.00 57.07 55.67 1wxb s TYR 9 Cb 0.07 -0.59 -0.00 0.00 -0.40 0.00 0.00 41.96 41.04 1wxb s TYR 9 CO 0.19 -0.66 -0.05 0.54 -1.57 0.00 0.00 175.55 174.00 1wxb s VAL 10 N -4.06 0.38 -0.32 0.71 0.11 -1.10 -3.88 120.40 112.24 1wxb s VAL 10 Ca 0.39 -0.20 -0.06 0.00 -2.93 0.00 0.00 61.98 59.19 1wxb s VAL 10 Cb 0.06 -0.33 0.03 0.00 -1.53 0.00 0.00 36.38 34.62 1wxb s VAL 10 CO 0.14 0.11 0.08 -0.75 -3.33 0.00 0.00 175.10 171.35 1wxb s LYS 11 N -0.05 2.71 0.46 1.54 2.20 -0.94 -1.12 119.74 124.54 1wxb s LYS 11 Ca 0.01 -1.11 -0.23 0.00 -0.36 0.00 0.00 55.97 54.28 1wxb s LYS 11 Cb -0.03 -3.39 -0.10 0.00 -1.51 0.00 0.00 37.83 32.81 1wxb s LYS 11 CO -0.00 -0.60 0.95 -0.89 -0.36 0.00 0.00 175.35 174.44 1wxb n ILE 12 N 4.80 2.58 -0.06 5.43 2.08 0.28 -3.50 119.36 130.97 1wxb n ILE 12 Ca -0.13 -0.50 -0.06 0.00 0.56 0.00 0.00 62.75 62.62 1wxb n ILE 12 Cb 0.45 -1.09 -0.08 0.00 -0.75 0.00 0.00 39.64 38.17 1wxb n ILE 12 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1wxb n LEU 13 N 0.35 0.49 -4.08 1.39 4.77 -0.17 -3.30 117.00 116.46 1wxb n LEU 13 Ca 0.10 -0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 55.89 1wxb n LEU 13 Cb 0.41 0.15 -0.14 0.00 -2.33 0.00 0.00 43.42 41.51 1wxb n LEU 13 CO 0.55 0.35 -0.44 -0.31 -1.33 0.00 0.00 177.39 176.21 1wxb s TYR 14 N -2.27 0.96 -0.18 -1.77 2.02 -1.26 -4.66 117.35 110.20 1wxb s TYR 14 Ca -0.08 -0.29 -0.29 0.00 -0.37 0.00 0.00 57.07 56.05 1wxb s TYR 14 Cb 0.04 -0.59 -0.02 0.00 -0.40 0.00 0.00 41.96 40.98 1wxb s TYR 14 CO 0.43 -0.00 1.46 0.16 -1.57 0.00 0.00 175.55 176.02 1wxb s ASP 15 N -0.79 6.67 0.21 2.29 1.47 -1.26 -4.38 116.67 120.87 1wxb s ASP 15 Ca 0.01 1.71 0.10 0.00 1.18 0.00 0.00 52.55 55.55 1wxb s ASP 15 Cb -0.06 -2.54 -0.04 0.00 -0.34 0.00 0.00 42.92 39.94 1wxb s ASP 15 CO 0.00 -1.00 -0.15 0.12 0.68 0.00 0.00 175.17 174.82 1wxb s PHE 16 N 4.27 2.48 -0.24 2.11 5.36 -0.94 -4.90 117.98 126.12 1wxb s PHE 16 Ca 0.64 -0.28 0.02 0.00 -0.96 0.00 0.00 56.93 56.34 1wxb s PHE 16 Cb -0.24 -1.18 0.06 0.00 -0.34 0.00 0.00 43.02 41.31 1wxb s PHE 16 CO 0.24 0.55 -0.08 0.99 -1.46 0.00 0.00 175.22 175.45 1wxb s THR 17 N -1.87 1.82 -0.38 0.12 2.01 -1.26 -2.59 115.64 113.50 1wxb s THR 17 Ca 0.25 -1.39 -0.40 0.00 0.31 0.00 0.00 61.69 60.46 1wxb s THR 17 Cb -0.08 -2.01 -0.15 0.00 0.01 0.00 0.00 72.50 70.28 1wxb s THR 17 CO 0.14 -0.05 2.00 0.00 -0.69 0.00 0.00 174.62 176.02 1wxb n ALA 18 N 4.56 0.30 0.19 7.40 0.00 -1.25 -4.78 120.51 126.93 1wxb n ALA 18 Ca -0.13 0.18 0.03 0.00 0.00 0.00 0.00 53.44 53.52 1wxb n ALA 18 Cb 0.43 -2.28 0.37 0.00 0.00 0.00 0.00 19.45 17.97 1wxb n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wxb h ARG 19 N 9.39 0.02 0.00 0.00 2.47 -1.90 -3.46 114.38 120.90 1wxb h ARG 19 Ca -0.30 -0.01 -0.11 0.00 -1.26 0.00 0.00 59.98 58.31 1wxb h ARG 19 Cb 1.35 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.64 1wxb h ARG 19 CO 1.02 0.35 -0.09 0.09 0.56 0.00 0.00 179.97 181.90 1wxb n ASN 20 N -4.13 -0.31 -0.03 7.04 3.02 -1.26 -5.03 115.26 114.55 1wxb n ASN 20 Ca -0.02 -1.59 -0.13 0.00 -0.03 0.00 0.00 54.58 52.81 1wxb n ASN 20 Cb 0.38 0.62 -0.08 0.00 -0.61 0.00 0.00 39.78 40.09 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 1.46 0.11 -0.37 5.41 0.00 -1.98 -2.55 119.26 121.35 1wxb h ALA 21 Ca -0.07 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 54.68 1wxb h ALA 21 Cb 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1wxb h ALA 21 CO 0.10 -0.10 0.60 -2.95 0.00 0.00 0.00 179.25 176.90 1wxb h ASN 22 N -0.22 0.00 -2.92 0.00 7.08 -1.96 -3.39 115.58 114.17 1wxb h ASN 22 Ca 0.02 0.00 -0.62 0.00 -3.08 0.00 0.00 56.30 52.62 1wxb h ASN 22 Cb 0.53 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 36.73 1wxb h ASN 22 CO 0.02 0.00 -0.48 -1.61 -2.08 0.00 0.00 177.43 173.27 1wxb s GLU 23 N -4.38 3.46 -0.10 4.14 2.02 -0.96 0.19 118.70 123.05 1wxb s GLU 23 Ca -0.03 -0.40 -0.03 0.00 0.02 0.00 0.00 54.97 54.52 1wxb s GLU 23 Cb 0.12 -3.03 -0.03 0.00 0.10 0.00 0.00 34.13 31.29 1wxb s GLU 23 CO 0.41 0.60 0.03 -1.17 0.02 0.00 0.00 175.26 175.15 1wxb s LEU 24 N -2.47 3.73 -0.32 1.80 2.96 -1.20 -4.60 118.68 118.57 1wxb s LEU 24 Ca 0.35 0.18 -0.19 0.00 -0.22 0.00 0.00 54.13 54.25 1wxb s LEU 24 Cb -0.13 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 1wxb s LEU 24 CO 0.27 0.35 0.54 -0.94 -1.32 0.00 0.00 176.35 175.25 1wxb s SER 25 N -0.73 6.38 0.41 3.68 1.04 -1.26 -3.81 113.70 119.41 1wxb s SER 25 Ca 0.12 0.21 0.04 0.00 0.48 0.00 0.00 55.95 56.80 1wxb s SER 25 Cb -0.12 -2.29 -0.05 0.00 0.10 0.00 0.00 66.02 63.67 1wxb s SER 25 CO 0.02 -0.44 0.05 0.68 0.98 0.00 0.00 173.24 174.54 1wxb s VAL 26 N 2.43 1.21 0.44 5.02 -7.23 -1.07 -4.89 120.40 116.33 1wxb s VAL 26 Ca 0.21 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.41 1wxb s VAL 26 Cb -0.15 -2.59 -0.02 0.00 0.56 0.00 0.00 36.38 34.18 1wxb s VAL 26 CO 0.12 0.00 0.11 -0.76 -0.31 0.00 0.00 175.10 174.26 1wxb s LEU 27 N -3.65 2.04 0.43 1.32 1.43 -1.26 -2.20 118.68 116.79 1wxb s LEU 27 Ca 0.26 -1.71 -0.21 0.00 -1.03 0.00 0.00 54.13 51.44 1wxb s LEU 27 Cb 0.06 -0.21 -0.10 0.00 0.03 0.00 0.00 46.19 45.96 1wxb s LEU 27 CO 0.13 -0.96 0.97 -0.75 0.23 0.00 0.00 176.35 175.98 1wxb s LYS 28 N -3.72 4.15 -1.37 1.70 2.20 -1.26 -3.57 119.74 117.88 1wxb s LYS 28 Ca 0.18 1.20 -0.08 0.00 -0.36 0.00 0.00 55.97 56.91 1wxb s LYS 28 Cb 0.01 -2.21 0.01 0.00 -1.51 0.00 0.00 37.83 34.13 1wxb s LYS 28 CO 0.12 -0.10 1.12 -0.25 -0.36 0.00 0.00 175.35 175.87 1wxb n ASP 29 N -0.61 -6.34 -4.56 1.43 9.92 -1.21 -4.95 116.55 110.23 1wxb n ASP 29 Ca 0.07 -0.51 -0.24 0.00 -0.53 0.00 0.00 54.79 53.59 1wxb n ASP 29 Cb 0.53 -4.98 -0.09 0.00 -0.64 0.00 0.00 41.12 35.94 1wxb n ASP 29 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1wxb s GLU 30 N -6.24 1.99 -0.11 -1.24 2.02 -1.23 -4.95 118.70 108.94 1wxb s GLU 30 Ca 0.56 -1.60 -0.00 0.00 0.02 0.00 0.00 54.97 53.94 1wxb s GLU 30 Cb -0.24 -1.97 0.02 0.00 0.10 0.00 0.00 34.13 32.04 1wxb s GLU 30 CO 0.69 0.34 -0.07 0.08 0.02 0.00 0.00 175.26 176.31 1wxb s VAL 31 N -2.42 0.96 0.48 2.63 1.01 -1.26 0.98 120.40 122.78 1wxb s VAL 31 Ca 0.31 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.10 1wxb s VAL 31 Cb -0.05 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.34 1wxb s VAL 31 CO 0.18 0.36 0.32 -0.76 0.00 0.00 0.00 175.10 175.19 1wxb s LEU 32 N 1.69 2.93 -0.39 3.92 2.01 -0.27 -4.97 118.68 123.59 1wxb s LEU 32 Ca 0.04 -1.12 -0.11 0.00 0.01 0.00 0.00 54.13 52.95 1wxb s LEU 32 Cb -0.13 -1.41 0.04 0.00 0.01 0.00 0.00 46.19 44.71 1wxb s LEU 32 CO -0.07 -0.86 0.23 -0.70 1.01 0.00 0.00 176.35 175.95 1wxb s GLU 33 N -4.14 2.76 0.04 1.70 2.12 -1.17 -2.71 118.70 117.30 1wxb s GLU 33 Ca 0.37 -1.20 -0.30 0.00 0.36 0.00 0.00 54.97 54.20 1wxb s GLU 33 Cb -0.01 -3.75 -0.06 0.00 0.26 0.00 0.00 34.13 30.57 1wxb s GLU 33 CO 0.22 -0.79 1.27 0.54 -0.54 0.00 0.00 175.26 175.96 1wxb s VAL 34 N 1.52 3.89 -0.12 3.70 0.11 -1.26 -1.80 120.40 126.43 1wxb s VAL 34 Ca 0.02 1.32 -0.02 0.00 -2.93 0.00 0.00 61.98 60.37 1wxb s VAL 34 Cb -0.20 -3.85 -0.07 0.00 -1.53 0.00 0.00 36.38 30.73 1wxb s VAL 34 CO 0.05 0.06 -0.13 0.18 -3.33 0.00 0.00 175.10 171.94 1wxb n LEU 35 N 4.42 2.24 -3.99 2.54 4.77 -0.64 -4.77 117.00 121.56 1wxb n LEU 35 Ca 0.10 0.02 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 1wxb n LEU 35 Cb 0.45 -0.40 -0.17 0.00 -2.33 0.00 0.00 43.42 40.97 1wxb n LEU 35 CO 0.57 0.54 -0.46 -1.61 -1.33 0.00 0.00 177.39 175.10 1wxb s GLU 36 N -2.24 1.58 0.25 3.23 2.02 -1.19 -5.01 118.70 117.34 1wxb s GLU 36 Ca -0.17 -0.36 0.01 0.00 0.02 0.00 0.00 54.97 54.48 1wxb s GLU 36 Cb 0.05 -1.36 -0.04 0.00 0.10 0.00 0.00 34.13 32.88 1wxb s GLU 36 CO 0.26 -0.02 0.14 0.16 0.02 0.00 0.00 175.26 175.82 1wxb s ASP 37 N 0.83 0.87 0.00 -0.19 -4.77 -1.26 -1.83 116.67 110.32 1wxb s ASP 37 Ca -0.12 -1.47 0.00 0.00 -3.30 0.00 0.00 52.55 47.67 1wxb s ASP 37 Cb -0.15 0.35 0.00 0.00 -1.09 0.00 0.00 42.92 42.03 1wxb s ASP 37 CO 0.02 -0.85 0.00 0.61 0.70 0.00 0.00 175.17 175.65 1wxb n GLY 38 N -0.42 0.45 3.74 2.12 0.00 -1.26 -5.06 105.19 104.75 1wxb n GLY 38 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1wxb n GLY 38 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wxb s ARG 39 N -0.89 2.45 0.23 1.61 3.52 -1.26 -5.02 118.95 119.58 1wxb s ARG 39 Ca 0.00 -1.44 -0.17 0.00 -0.13 0.00 0.00 55.73 53.99 1wxb s ARG 39 Cb 0.00 -2.24 0.24 0.00 -1.56 0.00 0.00 34.95 31.39 1wxb s ARG 39 CO 0.00 0.19 1.57 -0.56 -0.81 0.00 0.00 175.30 175.69 1wxb h GLN 40 N 1.58 -0.04 -5.91 5.12 3.07 -1.97 -3.37 115.11 113.59 1wxb h GLN 40 Ca -0.44 0.00 -0.68 0.00 0.09 0.00 0.00 58.65 57.62 1wxb h GLN 40 Cb 1.25 0.01 -0.26 0.00 0.08 0.00 0.00 27.48 28.56 1wxb h GLN 40 CO 0.62 -0.03 -0.80 -1.58 0.09 0.00 0.00 178.83 177.13 1wxb s TRP 41 N -6.03 2.67 0.51 0.06 0.52 -1.26 -4.06 118.94 111.35 1wxb s TRP 41 Ca -0.14 -0.46 -0.04 0.00 0.02 0.00 0.00 56.10 55.47 1wxb s TRP 41 Cb 0.20 -1.69 -0.02 0.00 -1.15 0.00 0.00 33.47 30.81 1wxb s TRP 41 CO 0.72 -0.05 0.80 -1.58 0.02 0.00 0.00 176.95 176.86 1wxb s TRP 42 N -0.23 3.42 -0.37 -1.98 0.51 -0.91 -4.83 118.94 114.54 1wxb s TRP 42 Ca 0.00 0.66 0.01 0.00 -2.12 0.00 0.00 56.10 54.65 1wxb s TRP 42 Cb -0.13 -2.43 0.10 0.00 -0.81 0.00 0.00 33.47 30.21 1wxb s TRP 42 CO 0.03 -0.45 0.12 0.21 -0.51 0.00 0.00 176.95 176.35 1wxb s LYS 43 N -4.78 1.72 0.37 4.98 2.20 -0.76 -2.16 119.74 121.31 1wxb s LYS 43 Ca 0.49 -1.86 0.06 0.00 -0.36 0.00 0.00 55.97 54.31 1wxb s LYS 43 Cb -0.10 -3.38 -0.00 0.00 -1.51 0.00 0.00 37.83 32.84 1wxb s LYS 43 CO 0.44 -1.00 0.52 -0.51 -0.36 0.00 0.00 175.35 174.44 1wxb s LEU 44 N 1.00 3.84 -0.05 5.43 2.01 -0.99 -1.62 118.68 128.30 1wxb s LEU 44 Ca 0.10 -0.22 -0.00 0.00 0.01 0.00 0.00 54.13 54.02 1wxb s LEU 44 Cb -0.21 -2.76 0.03 0.00 0.01 0.00 0.00 46.19 43.26 1wxb s LEU 44 CO -0.06 -0.57 -0.02 -0.60 1.01 0.00 0.00 176.35 176.11 1wxb s ARG 45 N -4.27 0.65 0.83 1.70 3.52 -0.74 -1.95 118.95 118.69 1wxb s ARG 45 Ca 0.48 0.01 -0.12 0.00 -0.13 0.00 0.00 55.73 55.98 1wxb s ARG 45 Cb -0.10 -0.84 0.09 0.00 -1.56 0.00 0.00 34.95 32.55 1wxb s ARG 45 CO 0.32 -0.18 1.12 -1.54 -0.81 0.00 0.00 175.30 174.22 1wxb s SER 46 N 1.36 4.22 0.00 -2.12 1.04 0.14 -3.07 113.70 115.27 1wxb s SER 46 Ca -0.04 1.08 0.14 0.00 0.48 0.00 0.00 55.95 57.61 1wxb s SER 46 Cb -0.13 -1.73 0.61 0.00 0.10 0.00 0.00 66.02 64.87 1wxb s SER 46 CO -0.02 -2.12 1.42 0.54 0.98 0.00 0.00 173.24 174.04 1wxb n ARG 47 N -3.50 0.04 -0.07 4.02 3.00 -1.26 -1.64 116.66 117.26 1wxb n ARG 47 Ca 0.07 0.24 0.05 0.00 -0.01 0.00 0.00 57.85 58.20 1wxb n ARG 47 Cb 0.58 -1.50 0.21 0.00 0.00 0.00 0.00 32.46 31.75 1wxb n ARG 47 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1wxb n SER 48 N -1.45 0.85 -0.10 0.55 7.64 -1.26 -4.84 113.62 115.01 1wxb n SER 48 Ca 0.04 -1.84 -0.01 0.00 1.01 0.00 0.00 58.87 58.06 1wxb n SER 48 Cb 0.15 -0.09 -0.01 0.00 -1.01 0.00 0.00 64.21 63.25 1wxb n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wxb n GLY 49 N 0.83 0.48 3.88 0.23 0.00 -0.65 -5.01 105.19 104.95 1wxb n GLY 49 Ca 0.09 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.97 3.73 -0.04 1.61 -0.21 -1.24 -4.91 119.66 117.64 1wxb s GLN 50 Ca 0.00 0.13 0.01 0.00 0.02 0.00 0.00 55.36 55.52 1wxb s GLN 50 Cb 0.00 -2.78 0.02 0.00 1.00 0.00 0.00 33.01 31.25 1wxb s GLN 50 CO 0.00 0.41 -0.03 0.00 -2.12 0.00 0.00 175.29 173.55 1wxb s ALA 51 N -1.69 0.56 0.16 6.09 0.00 -1.26 0.26 121.76 125.88 1wxb s ALA 51 Ca 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 1wxb s ALA 51 Cb -0.12 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.63 1wxb s ALA 51 CO 0.22 -0.01 0.35 0.20 0.00 0.00 0.00 175.76 176.52 1wxb s GLY 52 N 0.88 0.20 0.14 0.00 0.00 -0.82 -4.76 107.32 102.95 1wxb s GLY 52 Ca -0.11 -0.58 -0.06 0.00 0.00 0.00 0.00 44.72 43.96 1wxb s GLY 52 CO -0.00 -0.62 0.40 -0.19 0.00 0.00 0.00 173.10 172.68 1wxb s TYR 53 N -3.91 3.49 0.17 1.90 2.02 0.50 -2.34 117.35 119.18 1wxb s TYR 53 Ca 0.12 0.63 -0.12 0.00 -0.37 0.00 0.00 57.07 57.32 1wxb s TYR 53 Cb 0.02 -2.06 0.01 0.00 -0.40 0.00 0.00 41.96 39.53 1wxb s TYR 53 CO -0.03 0.43 0.36 0.14 -1.57 0.00 0.00 175.55 174.88 1wxb s VAL 54 N -1.63 0.06 0.42 0.71 -7.23 -0.92 -3.26 120.40 108.55 1wxb s VAL 54 Ca 0.40 -1.14 -0.23 0.00 -1.81 0.00 0.00 61.98 59.20 1wxb s VAL 54 Cb -0.12 -1.70 -0.09 0.00 0.56 0.00 0.00 36.38 35.02 1wxb s VAL 54 CO 0.23 -0.26 1.05 -2.16 -0.31 0.00 0.00 175.10 173.65 1wxb s PRO 55 N -3.92 4.07 0.00 4.82 0.04 -1.26 -2.15 135.00 136.60 1wxb s PRO 55 Ca 0.13 1.48 0.29 0.00 0.04 0.00 0.00 61.00 62.95 1wxb s PRO 55 Cb 0.02 -2.43 1.34 0.00 0.04 0.00 0.00 34.50 33.47 1wxb s PRO 55 CO -0.02 -0.22 1.92 0.00 0.04 0.00 0.00 177.00 178.72 1wxb h ASN 57 N 1.00 0.00 0.00 0.00 2.35 -1.91 -2.89 115.58 114.14 1wxb h ASN 57 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1wxb h ASN 57 Cb 0.31 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1wxb h ASN 57 CO 0.00 0.12 -1.85 2.30 -1.65 0.00 0.00 177.43 176.35 1wxb n ILE 58 N -3.24 0.22 -0.91 2.81 -5.35 -1.21 -4.98 119.36 106.70 1wxb n ILE 58 Ca 0.01 -0.45 -0.29 0.00 -0.27 0.00 0.00 62.75 61.75 1wxb n ILE 58 Cb 0.39 -0.03 0.20 0.00 -1.74 0.00 0.00 39.64 38.46 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 -4.40 1.44 -0.12 7.28 1.43 -1.09 -1.00 118.68 122.23 1wxb s LEU 59 Ca -0.07 1.40 -0.30 0.00 -1.03 0.00 0.00 54.13 54.13 1wxb s LEU 59 Cb 0.10 -3.52 0.12 0.00 0.03 0.00 0.00 46.19 42.92 1wxb s LEU 59 CO 0.71 -3.49 0.97 -0.83 0.23 0.00 0.00 176.35 173.94 1wxb s GLY 60 N -3.05 -0.33 0.61 -3.19 0.00 -1.23 -4.75 107.32 95.37 1wxb s GLY 60 Ca 0.66 1.73 -0.19 0.00 0.00 0.00 0.00 44.72 46.92 1wxb s GLY 60 CO 0.60 0.83 1.31 -1.83 0.00 0.00 0.00 173.10 174.01 1wxb s GLU 61 N -1.68 2.80 -0.06 2.90 1.03 -1.26 -2.21 118.70 120.22 1wxb s GLU 61 Ca 0.00 2.10 0.04 0.00 0.03 0.00 0.00 54.97 57.14 1wxb s GLU 61 Cb -0.01 -1.99 0.00 0.00 -0.80 0.00 0.00 34.13 31.33 1wxb s GLU 61 CO -0.01 -1.41 -0.18 0.00 -1.33 0.00 0.00 175.26 172.33 1wxb s ALA 62 N -1.38 1.61 -0.23 -0.84 0.00 -1.25 -4.47 121.76 115.20 1wxb s ALA 62 Ca 0.78 -0.69 -0.18 0.00 0.00 0.00 0.00 51.96 51.87 1wxb s ALA 62 Cb -0.38 -0.59 -0.16 0.00 0.00 0.00 0.00 23.12 22.00 1wxb s ALA 62 CO 0.42 0.25 -0.02 0.43 0.00 0.00 0.00 175.76 176.83 1wxb n SER 63 N 3.37 1.90 0.00 0.00 7.64 -1.26 -4.80 113.62 120.47 1wxb n SER 63 Ca -0.19 0.39 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1wxb n SER 63 Cb 0.53 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1wxb n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wxb n GLY 64 N 1.37 2.98 0.15 0.23 0.00 -1.26 -4.89 105.19 103.77 1wxb n GLY 64 Ca -0.40 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 43.56 1wxb n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wxb h PRO 65 N 0.00 0.30 -6.49 1.61 0.13 -2.04 -3.43 132.00 122.08 1wxb h PRO 65 Ca 0.00 -0.29 -0.53 0.00 -0.87 0.00 0.00 66.00 64.31 1wxb h PRO 65 Cb 0.00 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.17 1wxb h PRO 65 CO 0.00 0.97 0.21 0.45 -0.23 0.00 0.00 178.00 179.40 1wxb s SER 66 N -6.97 7.38 -0.41 1.44 0.15 -1.26 -4.39 113.70 109.63 1wxb s SER 66 Ca -0.04 1.64 -0.18 0.00 0.70 0.00 0.00 55.95 58.07 1wxb s SER 66 Cb 0.10 -2.51 0.02 0.00 -1.71 0.00 0.00 66.02 61.92 1wxb s SER 66 CO 0.84 0.12 0.54 -1.20 1.20 0.00 0.00 173.24 174.75 1wxb n SER 67 N 2.03 -7.60 0.00 5.45 7.64 -1.26 -5.08 113.62 114.80 1wxb n SER 67 Ca -0.04 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.36 1wxb n SER 67 Cb 0.49 -4.79 0.00 0.00 -1.01 0.00 0.00 64.21 58.90 1wxb n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64