#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 3.88 0.10 1.61 0.15 -1.26 -5.05 113.70 113.14 1wxb s SER 2 Ca 0.00 -1.13 -0.20 0.00 0.70 0.00 0.00 55.95 55.32 1wxb s SER 2 Cb 0.00 -0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 63.85 1wxb s SER 2 CO 0.00 -0.22 1.35 0.28 1.20 0.00 0.00 173.24 175.86 1wxb h SER 3 N 1.95 -1.41 -5.21 5.45 0.02 -2.09 -3.46 113.55 108.80 1wxb h SER 3 Ca -0.42 0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 1wxb h SER 3 Cb 1.25 0.62 0.02 0.00 0.14 0.00 0.00 62.40 64.43 1wxb h SER 3 CO 0.69 -0.15 -0.07 0.61 -1.14 0.00 0.00 176.83 176.77 1wxb n GLY 4 N -1.17 -1.16 2.55 -3.77 0.00 -1.26 -4.48 105.19 95.90 1wxb n GLY 4 Ca 0.01 0.43 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.84 -7.11 -4.80 1.61 2.88 -1.26 -4.97 113.62 98.12 1wxb n SER 5 Ca -0.01 1.10 -0.34 0.00 -1.33 0.00 0.00 58.87 58.30 1wxb n SER 5 Cb 0.51 -4.70 -0.05 0.00 -0.75 0.00 0.00 64.21 59.23 1wxb n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wxb s SER 6 N -1.54 6.53 0.00 -3.46 0.01 -1.26 -4.94 113.70 109.04 1wxb s SER 6 Ca 0.03 1.85 0.00 0.00 1.31 0.00 0.00 55.95 59.14 1wxb s SER 6 Cb -0.01 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1wxb s SER 6 CO 0.66 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 174.28 1wxb n GLY 7 N -0.38 -0.70 3.58 3.44 0.00 -1.26 -5.16 105.19 104.71 1wxb n GLY 7 Ca 0.09 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.56 1.88 0.19 1.61 1.02 -1.26 -5.13 119.74 117.50 1wxb s LYS 8 Ca 0.00 -2.03 -0.05 0.00 0.02 0.00 0.00 55.97 53.92 1wxb s LYS 8 Cb 0.00 -1.63 -0.03 0.00 -0.52 0.00 0.00 37.83 35.65 1wxb s LYS 8 CO 0.00 0.03 0.22 0.71 -0.92 0.00 0.00 175.35 175.38 1wxb s TYR 9 N -2.70 0.83 -0.02 3.18 2.02 -1.26 -3.78 117.35 115.62 1wxb s TYR 9 Ca 0.34 -1.13 0.02 0.00 -0.37 0.00 0.00 57.07 55.93 1wxb s TYR 9 Cb 0.07 -0.31 0.01 0.00 -0.40 0.00 0.00 41.96 41.32 1wxb s TYR 9 CO 0.17 -0.71 -0.06 0.54 -1.57 0.00 0.00 175.55 173.92 1wxb s VAL 10 N -4.08 0.58 -0.24 0.71 0.11 -0.61 -3.34 120.40 113.53 1wxb s VAL 10 Ca 0.30 -0.24 -0.17 0.00 -2.93 0.00 0.00 61.98 58.93 1wxb s VAL 10 Cb 0.05 -0.53 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 1wxb s VAL 10 CO 0.08 0.19 0.47 -0.75 -3.33 0.00 0.00 175.10 171.77 1wxb s LYS 11 N 0.28 4.10 -0.27 1.54 2.20 -1.26 -1.30 119.74 125.03 1wxb s LYS 11 Ca -0.04 0.28 -0.28 0.00 -0.36 0.00 0.00 55.97 55.57 1wxb s LYS 11 Cb -0.08 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 1wxb s LYS 11 CO 0.00 -0.25 1.86 0.42 -0.36 0.00 0.00 175.35 177.02 1wxb s ILE 12 N 1.98 3.40 0.12 5.43 -1.09 0.46 -2.83 121.20 128.67 1wxb s ILE 12 Ca 0.20 0.42 0.11 0.00 -2.23 0.00 0.00 60.65 59.16 1wxb s ILE 12 Cb -0.15 -3.50 -0.06 0.00 -1.58 0.00 0.00 42.46 37.17 1wxb s ILE 12 CO 0.09 -0.29 1.47 -0.07 -1.23 0.00 0.00 174.94 174.91 1wxb h LEU 13 N 13.46 0.00 -7.76 2.97 3.38 -1.38 0.04 115.31 126.00 1wxb h LEU 13 Ca -0.36 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.43 1wxb h LEU 13 Cb 1.18 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.69 1wxb h LEU 13 CO 1.01 0.71 -0.61 -0.31 0.09 0.00 0.00 178.44 179.32 1wxb s TYR 14 N -3.15 0.04 -0.02 1.13 2.02 -1.25 -4.71 117.35 111.41 1wxb s TYR 14 Ca 0.01 -0.07 -0.30 0.00 -0.37 0.00 0.00 57.07 56.33 1wxb s TYR 14 Cb 0.10 -0.05 -0.05 0.00 -0.40 0.00 0.00 41.96 41.57 1wxb s TYR 14 CO 0.77 -0.14 1.33 0.16 -1.57 0.00 0.00 175.55 176.10 1wxb s ASP 15 N -0.70 6.92 0.04 2.29 -4.77 -1.26 -4.41 116.67 114.78 1wxb s ASP 15 Ca -0.08 2.01 0.07 0.00 -3.30 0.00 0.00 52.55 51.26 1wxb s ASP 15 Cb -0.05 -2.56 -0.02 0.00 -1.09 0.00 0.00 42.92 39.20 1wxb s ASP 15 CO 0.00 -0.67 -0.20 0.12 0.70 0.00 0.00 175.17 175.12 1wxb s PHE 16 N 2.31 1.75 -0.21 2.11 5.36 -0.98 -4.88 117.98 123.44 1wxb s PHE 16 Ca 0.61 -0.37 0.02 0.00 -0.96 0.00 0.00 56.93 56.22 1wxb s PHE 16 Cb -0.29 -1.04 0.04 0.00 -0.34 0.00 0.00 43.02 41.39 1wxb s PHE 16 CO 0.25 0.09 -0.13 0.99 -1.46 0.00 0.00 175.22 174.96 1wxb s THR 17 N -0.81 1.91 -0.49 0.12 2.01 -1.26 -0.69 115.64 116.43 1wxb s THR 17 Ca 0.07 -1.19 -0.46 0.00 0.31 0.00 0.00 61.69 60.42 1wxb s THR 17 Cb -0.09 -1.93 -0.19 0.00 0.01 0.00 0.00 72.50 70.30 1wxb s THR 17 CO 0.02 0.20 1.81 0.00 -0.69 0.00 0.00 174.62 175.96 1wxb n ALA 18 N 4.59 -0.71 0.56 7.40 0.00 -1.21 -4.78 120.51 126.36 1wxb n ALA 18 Ca -0.16 0.38 0.11 0.00 0.00 0.00 0.00 53.44 53.77 1wxb n ALA 18 Cb 0.46 -2.00 0.02 0.00 0.00 0.00 0.00 19.45 17.94 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 5.39 0.29 -3.30 0.00 5.12 -1.26 -4.93 116.66 117.96 1wxb n ARG 19 Ca 0.40 -0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 56.18 1wxb n ARG 19 Cb -0.04 -1.60 -0.04 0.00 -1.16 0.00 0.00 32.46 29.62 1wxb n ARG 19 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1wxb n ASN 20 N -1.97 0.81 0.09 0.55 3.02 -1.26 -5.04 115.26 111.45 1wxb n ASN 20 Ca 0.02 -2.20 -0.04 0.00 -0.03 0.00 0.00 54.58 52.34 1wxb n ASN 20 Cb 0.44 0.63 -0.07 0.00 -0.61 0.00 0.00 39.78 40.17 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 1.41 0.47 -0.65 5.41 0.00 -2.01 -3.24 119.26 120.65 1wxb h ALA 21 Ca -0.17 -0.76 -0.48 0.00 0.00 0.00 0.00 54.91 53.51 1wxb h ALA 21 Cb 0.67 -0.12 -0.19 0.00 0.00 0.00 0.00 17.79 18.14 1wxb h ALA 21 CO 0.26 1.03 0.57 0.09 0.00 0.00 0.00 179.25 181.20 1wxb n ASN 22 N -3.30 6.85 -4.04 0.00 3.02 -1.26 -4.88 115.26 111.66 1wxb n ASN 22 Ca 0.00 -3.32 -0.08 0.00 -0.03 0.00 0.00 54.58 51.15 1wxb n ASN 22 Cb 0.87 -1.07 -0.09 0.00 -0.61 0.00 0.00 39.78 38.88 1wxb n ASN 22 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1wxb s GLU 23 N -2.45 0.81 0.03 3.52 2.02 -1.22 -2.38 118.70 119.02 1wxb s GLU 23 Ca 0.46 -1.22 0.07 0.00 0.02 0.00 0.00 54.97 54.31 1wxb s GLU 23 Cb 0.35 0.27 -0.02 0.00 0.10 0.00 0.00 34.13 34.82 1wxb s GLU 23 CO -0.08 -0.22 -0.22 -1.17 0.02 0.00 0.00 175.26 173.59 1wxb s LEU 24 N -2.95 2.13 -0.36 1.80 2.96 -1.21 -4.34 118.68 116.72 1wxb s LEU 24 Ca 0.12 -0.50 -0.17 0.00 -0.22 0.00 0.00 54.13 53.36 1wxb s LEU 24 Cb 0.07 -1.06 -0.00 0.00 0.50 0.00 0.00 46.19 45.70 1wxb s LEU 24 CO -0.06 0.20 0.46 -0.94 -1.32 0.00 0.00 176.35 174.70 1wxb s SER 25 N -1.01 6.26 0.41 3.68 1.04 -1.26 -3.35 113.70 119.48 1wxb s SER 25 Ca 0.08 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.39 1wxb s SER 25 Cb -0.09 -2.24 -0.05 0.00 0.10 0.00 0.00 66.02 63.73 1wxb s SER 25 CO 0.01 -0.46 0.04 0.68 0.98 0.00 0.00 173.24 174.49 1wxb s VAL 26 N 2.27 1.42 0.37 5.02 -7.23 0.14 -4.92 120.40 117.46 1wxb s VAL 26 Ca 0.16 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.41 1wxb s VAL 26 Cb -0.16 -2.68 -0.07 0.00 0.56 0.00 0.00 36.38 34.03 1wxb s VAL 26 CO 0.13 0.00 -0.02 -0.22 -0.31 0.00 0.00 175.10 174.68 1wxb s LEU 27 N -3.67 2.75 0.19 1.32 2.96 -1.26 -2.31 118.68 118.66 1wxb s LEU 27 Ca 0.28 -1.31 -0.27 0.00 -0.22 0.00 0.00 54.13 52.61 1wxb s LEU 27 Cb 0.07 -0.88 -0.08 0.00 0.50 0.00 0.00 46.19 45.80 1wxb s LEU 27 CO 0.14 -0.38 0.83 -0.75 -1.32 0.00 0.00 176.35 174.86 1wxb s LYS 28 N -3.69 4.65 0.00 1.98 2.20 -1.26 -3.17 119.74 120.45 1wxb s LYS 28 Ca 0.34 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 57.20 1wxb s LYS 28 Cb 0.07 -3.26 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 1wxb s LYS 28 CO 0.17 0.55 0.00 -0.25 -0.36 0.00 0.00 175.35 175.46 1wxb n ASP 29 N 1.54 -1.08 -4.95 1.43 8.00 -0.00 -4.91 116.55 116.57 1wxb n ASP 29 Ca -0.04 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.22 1wxb n ASP 29 Cb 0.48 -0.18 0.02 0.00 -0.02 0.00 0.00 41.12 41.42 1wxb n ASP 29 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1wxb s GLU 30 N -0.08 2.99 -0.09 -1.24 2.02 -1.19 -4.82 118.70 116.29 1wxb s GLU 30 Ca 0.00 -0.42 -0.01 0.00 0.02 0.00 0.00 54.97 54.56 1wxb s GLU 30 Cb 0.00 -2.50 0.03 0.00 0.10 0.00 0.00 34.13 31.76 1wxb s GLU 30 CO 0.00 -0.39 -0.02 0.08 0.02 0.00 0.00 175.26 174.95 1wxb s VAL 31 N -2.66 0.56 0.54 2.63 1.01 -1.26 0.17 120.40 121.39 1wxb s VAL 31 Ca 0.50 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.52 1wxb s VAL 31 Cb -0.10 -0.70 0.04 0.00 0.00 0.00 0.00 36.38 35.62 1wxb s VAL 31 CO 0.39 0.27 0.42 -0.76 0.00 0.00 0.00 175.10 175.42 1wxb s LEU 32 N 1.90 2.75 -0.14 3.92 2.01 -0.42 -4.91 118.68 123.78 1wxb s LEU 32 Ca 0.05 -1.21 -0.04 0.00 0.01 0.00 0.00 54.13 52.94 1wxb s LEU 32 Cb -0.13 -1.24 -0.03 0.00 0.01 0.00 0.00 46.19 44.80 1wxb s LEU 32 CO -0.06 -1.09 -0.02 -0.70 1.01 0.00 0.00 176.35 175.49 1wxb s GLU 33 N -4.29 3.55 -0.03 1.70 2.12 -1.26 -1.57 118.70 118.93 1wxb s GLU 33 Ca 0.36 -0.48 -0.26 0.00 0.36 0.00 0.00 54.97 54.95 1wxb s GLU 33 Cb -0.02 -2.92 -0.03 0.00 0.26 0.00 0.00 34.13 31.41 1wxb s GLU 33 CO 0.22 0.35 0.83 0.54 -0.54 0.00 0.00 175.26 176.66 1wxb s VAL 34 N 0.08 4.94 -0.25 3.70 0.11 -1.25 -2.14 120.40 125.60 1wxb s VAL 34 Ca 0.01 1.73 -0.16 0.00 -2.93 0.00 0.00 61.98 60.64 1wxb s VAL 34 Cb -0.13 -4.17 -0.12 0.00 -1.53 0.00 0.00 36.38 30.43 1wxb s VAL 34 CO 0.02 0.22 -0.27 0.18 -3.33 0.00 0.00 175.10 171.92 1wxb n LEU 35 N 3.76 1.94 -4.08 2.54 4.32 0.51 -4.85 117.00 121.14 1wxb n LEU 35 Ca 0.02 0.36 -0.24 0.00 -0.02 0.00 0.00 56.01 56.13 1wxb n LEU 35 Cb 0.51 -0.83 -0.16 0.00 -1.62 0.00 0.00 43.42 41.32 1wxb n LEU 35 CO 0.49 0.38 -0.48 -1.61 -1.22 0.00 0.00 177.39 174.95 1wxb s GLU 36 N -2.54 1.41 0.34 3.23 0.41 -1.12 -4.99 118.70 115.44 1wxb s GLU 36 Ca -0.35 -0.48 0.03 0.00 -0.41 0.00 0.00 54.97 53.76 1wxb s GLU 36 Cb 0.12 -1.26 -0.04 0.00 -1.78 0.00 0.00 34.13 31.17 1wxb s GLU 36 CO 0.49 0.20 0.13 0.16 -0.49 0.00 0.00 175.26 175.74 1wxb s ASP 37 N 0.06 2.09 0.00 -0.19 -4.77 -1.26 -2.38 116.67 110.23 1wxb s ASP 37 Ca -0.03 -1.55 0.00 0.00 -3.30 0.00 0.00 52.55 47.67 1wxb s ASP 37 Cb -0.10 0.33 0.00 0.00 -1.09 0.00 0.00 42.92 42.06 1wxb s ASP 37 CO 0.01 -0.84 0.00 0.61 0.70 0.00 0.00 175.17 175.65 1wxb n GLY 38 N -0.71 0.30 3.47 2.12 0.00 -1.26 -5.06 105.19 104.05 1wxb n GLY 38 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.00 1.65 0.00 1.61 0.52 -1.26 -5.07 118.95 115.39 1wxb s ARG 39 Ca 0.00 -1.80 0.00 0.00 -0.52 0.00 0.00 55.73 53.41 1wxb s ARG 39 Cb 0.00 -1.54 0.00 0.00 0.52 0.00 0.00 34.95 33.93 1wxb s ARG 39 CO 0.00 0.20 0.87 1.04 0.02 0.00 0.00 175.30 177.43 1wxb n GLN 40 N -0.63 0.00 -2.93 3.54 3.00 -1.26 -4.27 117.38 114.82 1wxb n GLN 40 Ca -0.06 0.74 -0.41 0.00 -0.01 0.00 0.00 57.00 57.27 1wxb n GLN 40 Cb 0.62 -1.37 -0.04 0.00 0.00 0.00 0.00 30.24 29.44 1wxb n GLN 40 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1wxb s TRP 41 N -2.50 3.56 0.55 1.08 0.52 -1.26 -3.92 118.94 116.97 1wxb s TRP 41 Ca 0.00 1.36 -0.05 0.00 0.02 0.00 0.00 56.10 57.42 1wxb s TRP 41 Cb 0.00 -2.92 -0.01 0.00 -1.15 0.00 0.00 33.47 29.39 1wxb s TRP 41 CO 0.00 -0.01 0.85 -1.58 0.02 0.00 0.00 176.95 176.24 1wxb s TRP 42 N 1.14 3.37 -0.35 -1.98 0.52 -0.85 -4.80 118.94 115.99 1wxb s TRP 42 Ca 0.41 0.70 -0.02 0.00 0.02 0.00 0.00 56.10 57.21 1wxb s TRP 42 Cb -0.18 -2.57 0.08 0.00 -1.15 0.00 0.00 33.47 29.65 1wxb s TRP 42 CO 0.19 -0.61 0.09 0.21 0.02 0.00 0.00 176.95 176.85 1wxb s LYS 43 N -4.89 2.18 0.37 4.98 2.20 -1.00 -2.34 119.74 121.24 1wxb s LYS 43 Ca 0.51 -1.53 0.08 0.00 -0.36 0.00 0.00 55.97 54.67 1wxb s LYS 43 Cb -0.10 -3.35 -0.03 0.00 -1.51 0.00 0.00 37.83 32.84 1wxb s LYS 43 CO 0.45 -0.83 0.32 -0.51 -0.36 0.00 0.00 175.35 174.42 1wxb s LEU 44 N 1.18 3.50 -0.04 5.43 2.01 -1.12 0.19 118.68 129.83 1wxb s LEU 44 Ca 0.02 -0.61 0.00 0.00 0.01 0.00 0.00 54.13 53.55 1wxb s LEU 44 Cb -0.21 -2.13 0.03 0.00 0.01 0.00 0.00 46.19 43.89 1wxb s LEU 44 CO -0.03 -0.47 -0.00 -0.60 1.01 0.00 0.00 176.35 176.26 1wxb s ARG 45 N -4.04 0.39 0.80 1.70 3.52 -0.91 -2.11 118.95 118.30 1wxb s ARG 45 Ca 0.44 0.08 -0.12 0.00 -0.13 0.00 0.00 55.73 56.00 1wxb s ARG 45 Cb -0.05 -0.61 0.07 0.00 -1.56 0.00 0.00 34.95 32.80 1wxb s ARG 45 CO 0.27 -0.17 1.12 -1.54 -0.81 0.00 0.00 175.30 174.17 1wxb s SER 46 N 1.25 4.54 0.08 -2.12 1.04 0.30 -3.99 113.70 114.79 1wxb s SER 46 Ca -0.06 1.10 0.15 0.00 0.48 0.00 0.00 55.95 57.62 1wxb s SER 46 Cb -0.13 -1.78 0.66 0.00 0.10 0.00 0.00 66.02 64.87 1wxb s SER 46 CO -0.02 -1.92 1.48 -2.11 0.98 0.00 0.00 173.24 171.65 1wxb n ARG 47 N -3.37 0.05 -0.07 4.02 0.00 -1.26 -1.47 116.66 114.57 1wxb n ARG 47 Ca 0.07 0.34 0.05 0.00 -0.00 0.00 0.00 57.85 58.31 1wxb n ARG 47 Cb 0.58 -1.61 0.20 0.00 -0.00 0.00 0.00 32.46 31.63 1wxb n ARG 47 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1wxb n SER 48 N -1.72 0.82 -0.07 2.89 2.88 -1.26 -4.84 113.62 112.33 1wxb n SER 48 Ca 0.03 -1.85 -0.01 0.00 -1.33 0.00 0.00 58.87 55.70 1wxb n SER 48 Cb 0.16 -0.09 -0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1wxb n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wxb n GLY 49 N 0.82 0.46 3.84 0.46 0.00 -0.54 -5.01 105.19 105.22 1wxb n GLY 49 Ca 0.08 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.80 3.99 -0.06 1.61 -1.52 -1.23 -4.88 119.66 116.77 1wxb s GLN 50 Ca 0.00 0.49 0.01 0.00 -1.95 0.00 0.00 55.36 53.91 1wxb s GLN 50 Cb 0.00 -3.04 0.02 0.00 -0.22 0.00 0.00 33.01 29.77 1wxb s GLN 50 CO 0.00 0.55 -0.06 0.00 -0.25 0.00 0.00 175.29 175.53 1wxb s ALA 51 N -1.33 0.84 0.08 6.09 0.00 -1.26 0.11 121.76 126.29 1wxb s ALA 51 Ca 0.33 -0.17 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1wxb s ALA 51 Cb -0.16 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1wxb s ALA 51 CO 0.18 -0.08 0.30 0.20 0.00 0.00 0.00 175.76 176.37 1wxb s GLY 52 N 1.06 -0.11 0.34 0.00 0.00 -0.90 -4.78 107.32 102.93 1wxb s GLY 52 Ca -0.09 -0.18 -0.10 0.00 0.00 0.00 0.00 44.72 44.36 1wxb s GLY 52 CO -0.01 -0.40 0.68 -0.19 0.00 0.00 0.00 173.10 173.19 1wxb s TYR 53 N -3.31 3.45 0.19 1.90 2.02 -1.00 -2.79 117.35 117.81 1wxb s TYR 53 Ca 0.00 0.96 -0.15 0.00 -0.37 0.00 0.00 57.07 57.51 1wxb s TYR 53 Cb 0.02 -2.36 0.02 0.00 -0.40 0.00 0.00 41.96 39.24 1wxb s TYR 53 CO -0.08 0.04 0.46 0.14 -1.57 0.00 0.00 175.55 174.54 1wxb s VAL 54 N -2.16 0.04 0.36 0.71 -7.23 -0.99 -3.29 120.40 107.84 1wxb s VAL 54 Ca 0.50 -0.97 -0.26 0.00 -1.81 0.00 0.00 61.98 59.44 1wxb s VAL 54 Cb -0.10 -1.68 -0.09 0.00 0.56 0.00 0.00 36.38 35.07 1wxb s VAL 54 CO 0.27 -0.16 1.06 -2.16 -0.31 0.00 0.00 175.10 173.81 1wxb s PRO 55 N -3.90 4.30 0.00 4.82 0.04 -1.26 -2.01 135.00 136.98 1wxb s PRO 55 Ca 0.12 1.60 0.28 0.00 0.04 0.00 0.00 61.00 63.04 1wxb s PRO 55 Cb 0.00 -2.73 1.45 0.00 0.04 0.00 0.00 34.50 33.26 1wxb s PRO 55 CO -0.01 -0.04 1.96 0.00 0.04 0.00 0.00 177.00 178.94 1wxb h ASN 57 N 0.92 0.00 0.00 0.00 4.21 -1.91 -2.97 115.58 115.84 1wxb h ASN 57 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1wxb h ASN 57 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1wxb h ASN 57 CO 0.00 0.07 -1.66 2.30 -1.29 0.00 0.00 177.43 176.85 1wxb n ILE 58 N -3.16 0.00 -2.17 2.81 -5.35 -1.19 -4.98 119.36 105.32 1wxb n ILE 58 Ca 0.02 -0.35 -0.33 0.00 -0.27 0.00 0.00 62.75 61.81 1wxb n ILE 58 Cb 0.43 0.20 -0.00 0.00 -1.74 0.00 0.00 39.64 38.53 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 -4.02 3.59 0.00 7.28 1.43 -1.12 -1.02 118.68 124.82 1wxb s LEU 59 Ca -0.05 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.92 1wxb s LEU 59 Cb 0.11 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.78 1wxb s LEU 59 CO 0.68 -1.08 0.00 0.61 0.23 0.00 0.00 176.35 176.79 1wxb n GLY 60 N -0.73 5.54 3.33 -3.19 0.00 -1.13 -4.85 105.19 104.16 1wxb n GLY 60 Ca 0.09 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 1wxb n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wxb s GLU 61 N 3.53 1.92 0.13 1.61 2.12 -1.26 -4.40 118.70 122.34 1wxb s GLU 61 Ca 0.00 -1.04 0.10 0.00 0.36 0.00 0.00 54.97 54.39 1wxb s GLU 61 Cb 0.00 -2.01 -0.04 0.00 0.26 0.00 0.00 34.13 32.35 1wxb s GLU 61 CO 0.00 0.53 -0.24 0.00 -0.54 0.00 0.00 175.26 175.01 1wxb s ALA 62 N -0.74 2.19 -0.24 6.30 0.00 -1.21 -4.23 121.76 123.83 1wxb s ALA 62 Ca 0.11 -1.41 -0.16 0.00 0.00 0.00 0.00 51.96 50.51 1wxb s ALA 62 Cb -0.10 -0.32 0.07 0.00 0.00 0.00 0.00 23.12 22.77 1wxb s ALA 62 CO 0.01 0.46 0.60 -1.12 0.00 0.00 0.00 175.76 175.71 1wxb s SER 63 N -2.07 -0.77 0.25 0.00 0.01 -1.26 -4.76 113.70 105.10 1wxb s SER 63 Ca 0.12 1.30 0.02 0.00 1.31 0.00 0.00 55.95 58.69 1wxb s SER 63 Cb -0.10 1.20 -0.04 0.00 0.21 0.00 0.00 66.02 67.30 1wxb s SER 63 CO 0.06 -0.22 0.42 -0.83 0.41 0.00 0.00 173.24 173.08 1wxb s GLY 64 N 1.27 1.48 -1.22 3.44 0.00 -1.26 -4.98 107.32 106.05 1wxb s GLY 64 Ca -0.08 -0.99 -0.08 0.00 0.00 0.00 0.00 44.72 43.58 1wxb s GLY 64 CO -0.13 -0.96 2.46 -1.55 0.00 0.00 0.00 173.10 172.92 1wxb n PRO 65 N -1.21 2.76 -2.78 2.90 -0.04 -1.26 -4.87 135.00 130.49 1wxb n PRO 65 Ca -0.06 -1.80 -0.43 0.00 -0.04 0.00 0.00 63.50 61.17 1wxb n PRO 65 Cb 0.55 -2.63 -0.04 0.00 -0.04 0.00 0.00 33.50 31.35 1wxb n PRO 65 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1wxb s SER 66 N 2.94 6.59 -0.47 3.54 0.01 -1.26 -4.99 113.70 120.05 1wxb s SER 66 Ca 0.53 0.34 -0.29 0.00 1.31 0.00 0.00 55.95 57.84 1wxb s SER 66 Cb 0.14 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.91 1wxb s SER 66 CO -0.04 -1.02 1.28 -0.55 0.41 0.00 0.00 173.24 173.32 1wxb s SER 67 N 2.16 6.45 0.00 2.44 0.15 -1.26 -5.28 113.70 118.36 1wxb s SER 67 Ca 0.39 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.59 1wxb s SER 67 Cb -0.10 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1wxb s SER 67 CO 0.25 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 173.90