#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 5.47 0.00 1.61 1.04 -1.26 -4.37 113.70 116.20 1wxb s SER 2 Ca 0.00 0.82 0.00 0.00 0.48 0.00 0.00 55.95 57.25 1wxb s SER 2 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 1wxb s SER 2 CO 0.00 -2.13 0.00 -1.20 0.98 0.00 0.00 173.24 170.89 1wxb n SER 3 N 11.94 0.00 0.00 7.02 7.64 -1.26 -4.86 113.62 134.11 1wxb n SER 3 Ca 0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1wxb n SER 3 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1wxb n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wxb n GLY 4 N 0.00 -0.21 2.04 0.23 0.00 -1.26 -5.12 105.19 100.87 1wxb n GLY 4 Ca 0.00 -2.22 -0.02 0.00 0.00 0.00 0.00 46.02 43.78 1wxb n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wxb n SER 5 N 0.00 -4.65 -2.72 1.61 7.64 -1.26 -5.06 113.62 109.18 1wxb n SER 5 Ca 0.00 1.12 -0.04 0.00 1.01 0.00 0.00 58.87 60.97 1wxb n SER 5 Cb 0.00 -3.86 0.02 0.00 -1.01 0.00 0.00 64.21 59.36 1wxb n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wxb n SER 6 N 1.20 -2.47 -4.69 6.43 2.88 -1.26 -4.93 113.62 110.78 1wxb n SER 6 Ca -0.11 -1.96 -0.41 0.00 -1.33 0.00 0.00 58.87 55.06 1wxb n SER 6 Cb 0.18 1.25 -0.04 0.00 -0.75 0.00 0.00 64.21 64.85 1wxb n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wxb s GLY 7 N 0.88 2.45 0.25 0.46 0.00 -1.26 -5.05 107.32 105.05 1wxb s GLY 7 Ca 0.27 0.18 0.11 0.00 0.00 0.00 0.00 44.72 45.27 1wxb s GLY 7 CO -0.08 1.51 -0.12 0.54 0.00 0.00 0.00 173.10 174.95 1wxb s LYS 8 N 1.45 1.93 0.35 2.90 -0.14 -1.26 -4.81 119.74 120.17 1wxb s LYS 8 Ca 0.41 -1.55 0.04 0.00 -1.36 0.00 0.00 55.97 53.51 1wxb s LYS 8 Cb -0.18 -1.97 -0.03 0.00 -1.68 0.00 0.00 37.83 33.97 1wxb s LYS 8 CO 0.18 0.36 0.15 0.71 -0.76 0.00 0.00 175.35 175.99 1wxb s TYR 9 N -2.24 1.72 -0.02 3.18 2.02 -1.26 -3.51 117.35 117.25 1wxb s TYR 9 Ca 0.29 -1.32 0.00 0.00 -0.37 0.00 0.00 57.07 55.67 1wxb s TYR 9 Cb -0.06 -1.01 0.02 0.00 -0.40 0.00 0.00 41.96 40.51 1wxb s TYR 9 CO 0.16 -0.41 0.01 0.54 -1.57 0.00 0.00 175.55 174.28 1wxb s VAL 10 N -3.40 0.03 -0.33 0.71 0.11 -1.13 -4.01 120.40 112.39 1wxb s VAL 10 Ca 0.31 0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 59.32 1wxb s VAL 10 Cb 0.04 -0.12 -0.02 0.00 -1.53 0.00 0.00 36.38 34.75 1wxb s VAL 10 CO 0.17 0.08 0.35 -0.75 -3.33 0.00 0.00 175.10 171.62 1wxb s LYS 11 N 0.73 3.66 0.14 1.54 2.20 -0.33 -1.85 119.74 125.84 1wxb s LYS 11 Ca -0.06 -0.33 -0.31 0.00 -0.36 0.00 0.00 55.97 54.90 1wxb s LYS 11 Cb -0.09 -3.77 -0.10 0.00 -1.51 0.00 0.00 37.83 32.36 1wxb s LYS 11 CO -0.02 -0.46 1.65 0.42 -0.36 0.00 0.00 175.35 176.58 1wxb s ILE 12 N 2.01 2.63 -0.07 5.43 -1.09 0.18 -2.67 121.20 127.62 1wxb s ILE 12 Ca 0.12 0.34 0.14 0.00 -2.23 0.00 0.00 60.65 59.02 1wxb s ILE 12 Cb -0.16 -3.22 -0.22 0.00 -1.58 0.00 0.00 42.46 37.28 1wxb s ILE 12 CO 0.11 0.02 0.62 0.18 -1.23 0.00 0.00 174.94 174.64 1wxb n LEU 13 N 4.62 0.77 -3.98 2.97 4.77 0.17 -2.12 117.00 124.20 1wxb n LEU 13 Ca 0.15 0.36 -0.13 0.00 -0.03 0.00 0.00 56.01 56.36 1wxb n LEU 13 Cb 0.38 0.19 -0.13 0.00 -2.33 0.00 0.00 43.42 41.54 1wxb n LEU 13 CO 0.63 0.36 -0.39 -0.31 -1.33 0.00 0.00 177.39 176.35 1wxb s TYR 14 N -2.65 0.41 -0.05 -1.77 2.02 -1.25 -4.72 117.35 109.34 1wxb s TYR 14 Ca -0.05 -0.27 -0.30 0.00 -0.37 0.00 0.00 57.07 56.08 1wxb s TYR 14 Cb 0.08 -0.26 -0.04 0.00 -0.40 0.00 0.00 41.96 41.34 1wxb s TYR 14 CO 0.82 -0.06 1.39 0.16 -1.57 0.00 0.00 175.55 176.30 1wxb s ASP 15 N -0.77 6.86 -0.05 2.29 1.47 -1.26 -4.45 116.67 120.76 1wxb s ASP 15 Ca -0.05 2.01 0.06 0.00 1.18 0.00 0.00 52.55 55.75 1wxb s ASP 15 Cb -0.05 -2.55 -0.02 0.00 -0.34 0.00 0.00 42.92 39.96 1wxb s ASP 15 CO -0.00 -0.75 -0.23 0.12 0.68 0.00 0.00 175.17 174.99 1wxb s PHE 16 N 2.92 2.48 -0.45 2.11 5.36 -0.42 -4.91 117.98 125.06 1wxb s PHE 16 Ca 0.63 -0.51 -0.11 0.00 -0.96 0.00 0.00 56.93 55.98 1wxb s PHE 16 Cb -0.29 -1.58 0.09 0.00 -0.34 0.00 0.00 43.02 40.89 1wxb s PHE 16 CO 0.24 -0.07 0.32 0.99 -1.46 0.00 0.00 175.22 175.24 1wxb s THR 17 N -0.40 4.53 -0.39 0.12 2.01 -1.26 -1.56 115.64 118.69 1wxb s THR 17 Ca 0.04 -1.39 -0.41 0.00 0.31 0.00 0.00 61.69 60.24 1wxb s THR 17 Cb -0.12 -3.80 -0.16 0.00 0.01 0.00 0.00 72.50 68.43 1wxb s THR 17 CO 0.02 -0.59 1.94 0.00 -0.69 0.00 0.00 174.62 175.29 1wxb n ALA 18 N 5.01 0.05 0.04 7.40 0.00 -1.25 -4.78 120.51 126.97 1wxb n ALA 18 Ca -0.11 0.24 -0.00 0.00 0.00 0.00 0.00 53.44 53.58 1wxb n ALA 18 Cb 0.43 -2.22 0.29 0.00 0.00 0.00 0.00 19.45 17.95 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 8.61 0.42 0.00 0.00 2.47 -1.91 -3.46 114.38 120.50 1wxb h ARG 19 Ca -0.32 -0.11 -0.23 0.00 -1.26 0.00 0.00 59.98 58.06 1wxb h ARG 19 Cb 1.35 -0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 29.57 1wxb h ARG 19 CO 1.01 0.54 -0.18 0.09 0.56 0.00 0.00 179.97 182.00 1wxb n ASN 20 N -4.22 -0.65 -0.03 7.04 3.02 -1.26 -5.03 115.26 114.12 1wxb n ASN 20 Ca 0.00 -2.24 -0.11 0.00 -0.03 0.00 0.00 54.58 52.20 1wxb n ASN 20 Cb 0.31 1.31 -0.05 0.00 -0.61 0.00 0.00 39.78 40.73 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 1.73 0.19 -0.60 5.41 0.00 -1.98 -1.43 119.26 122.57 1wxb h ALA 21 Ca -0.16 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 54.83 1wxb h ALA 21 Cb 0.73 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1wxb h ALA 21 CO 0.22 -0.23 0.75 -2.95 0.00 0.00 0.00 179.25 177.04 1wxb h ASN 22 N 0.09 0.00 -2.74 0.00 7.08 -1.96 -3.39 115.58 114.66 1wxb h ASN 22 Ca 0.05 0.00 -0.57 0.00 -3.08 0.00 0.00 56.30 52.70 1wxb h ASN 22 Cb 0.16 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 36.37 1wxb h ASN 22 CO -0.00 0.00 -0.46 -1.61 -2.08 0.00 0.00 177.43 173.28 1wxb s GLU 23 N -4.49 3.46 -0.09 4.14 2.02 -0.54 0.19 118.70 123.38 1wxb s GLU 23 Ca -0.03 -0.49 -0.01 0.00 0.02 0.00 0.00 54.97 54.45 1wxb s GLU 23 Cb 0.14 -2.97 -0.03 0.00 0.10 0.00 0.00 34.13 31.36 1wxb s GLU 23 CO 0.48 0.54 -0.04 -1.17 0.02 0.00 0.00 175.26 175.09 1wxb s LEU 24 N -2.95 3.33 -0.25 1.80 2.96 -1.18 -4.56 118.68 117.83 1wxb s LEU 24 Ca 0.35 0.01 -0.18 0.00 -0.22 0.00 0.00 54.13 54.10 1wxb s LEU 24 Cb -0.12 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1wxb s LEU 24 CO 0.28 0.32 0.52 -0.94 -1.32 0.00 0.00 176.35 175.22 1wxb s SER 25 N -0.56 6.46 0.24 3.68 1.04 -1.26 -3.86 113.70 119.43 1wxb s SER 25 Ca 0.09 0.55 0.02 0.00 0.48 0.00 0.00 55.95 57.09 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 -0.28 0.05 0.68 0.98 0.00 0.00 173.24 174.69 1wxb s VAL 26 N 2.23 0.77 0.50 5.02 -7.23 -0.60 -4.92 120.40 116.17 1wxb s VAL 26 Ca 0.22 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1wxb s VAL 26 Cb -0.16 -2.48 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 1wxb s VAL 26 CO 0.09 -0.18 0.02 -0.76 -0.31 0.00 0.00 175.10 173.97 1wxb s LEU 27 N -3.30 2.21 0.17 1.32 1.43 -1.26 -1.30 118.68 117.94 1wxb s LEU 27 Ca 0.33 -1.68 -0.28 0.00 -1.03 0.00 0.00 54.13 51.46 1wxb s LEU 27 Cb 0.07 -0.62 -0.08 0.00 0.03 0.00 0.00 46.19 45.60 1wxb s LEU 27 CO 0.11 -0.90 0.87 -0.75 0.23 0.00 0.00 176.35 175.91 1wxb s LYS 28 N -3.86 4.69 -0.12 1.70 2.20 -1.26 -3.34 119.74 119.75 1wxb s LYS 28 Ca 0.06 1.32 0.00 0.00 -0.36 0.00 0.00 55.97 57.00 1wxb s LYS 28 Cb 0.01 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 33.03 1wxb s LYS 28 CO 0.04 0.45 0.00 -0.25 -0.36 0.00 0.00 175.35 175.22 1wxb n ASP 29 N 1.95 -2.44 -4.82 1.43 8.00 -0.90 -4.95 116.55 114.80 1wxb n ASP 29 Ca -0.02 0.02 -0.22 0.00 0.71 0.00 0.00 54.79 55.28 1wxb n ASP 29 Cb 0.48 -0.75 -0.04 0.00 -0.02 0.00 0.00 41.12 40.79 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 -2.84 2.84 -0.11 -1.24 2.02 -1.21 -4.92 118.70 113.24 1wxb s GLU 30 Ca 0.00 -1.14 -0.01 0.00 0.02 0.00 0.00 54.97 53.84 1wxb s GLU 30 Cb 0.00 -2.52 0.03 0.00 0.10 0.00 0.00 34.13 31.74 1wxb s GLU 30 CO 0.00 0.32 -0.02 0.08 0.02 0.00 0.00 175.26 175.66 1wxb s VAL 31 N -2.19 0.61 0.56 2.63 1.01 -1.26 0.49 120.40 122.25 1wxb s VAL 31 Ca 0.35 -0.13 0.07 0.00 0.00 0.00 0.00 61.98 62.27 1wxb s VAL 31 Cb -0.07 -0.79 0.06 0.00 0.00 0.00 0.00 36.38 35.58 1wxb s VAL 31 CO 0.25 0.21 0.57 -0.76 0.00 0.00 0.00 175.10 175.37 1wxb s LEU 32 N 1.87 2.85 -0.24 3.92 2.01 -0.77 -4.93 118.68 123.38 1wxb s LEU 32 Ca 0.04 -1.09 -0.06 0.00 0.01 0.00 0.00 54.13 53.02 1wxb s LEU 32 Cb -0.13 -1.35 -0.02 0.00 0.01 0.00 0.00 46.19 44.69 1wxb s LEU 32 CO -0.07 -1.22 0.04 -0.70 1.01 0.00 0.00 176.35 175.42 1wxb s GLU 33 N -4.45 3.59 0.10 1.70 2.12 -1.07 -2.83 118.70 117.86 1wxb s GLU 33 Ca 0.46 -0.51 -0.30 0.00 0.36 0.00 0.00 54.97 54.97 1wxb s GLU 33 Cb -0.04 -3.25 -0.06 0.00 0.26 0.00 0.00 34.13 31.05 1wxb s GLU 33 CO 0.29 -0.18 1.07 0.54 -0.54 0.00 0.00 175.26 176.43 1wxb s VAL 34 N 1.55 4.27 -0.02 3.70 0.11 -1.23 -1.04 120.40 127.73 1wxb s VAL 34 Ca 0.06 1.78 -0.01 0.00 -2.93 0.00 0.00 61.98 60.88 1wxb s VAL 34 Cb -0.15 -4.14 -0.01 0.00 -1.53 0.00 0.00 36.38 30.55 1wxb s VAL 34 CO 0.02 0.22 -0.03 0.18 -3.33 0.00 0.00 175.10 172.16 1wxb n LEU 35 N 3.17 1.07 -4.05 2.54 4.77 -0.87 -4.82 117.00 118.81 1wxb n LEU 35 Ca 0.05 0.02 -0.28 0.00 -0.03 0.00 0.00 56.01 55.76 1wxb n LEU 35 Cb 0.48 -0.08 -0.17 0.00 -2.33 0.00 0.00 43.42 41.33 1wxb n LEU 35 CO 0.53 0.21 -0.49 -1.61 -1.33 0.00 0.00 177.39 174.70 1wxb s GLU 36 N -2.05 2.18 0.30 3.23 2.02 -1.21 -5.01 118.70 118.16 1wxb s GLU 36 Ca -0.03 -0.54 0.03 0.00 0.02 0.00 0.00 54.97 54.44 1wxb s GLU 36 Cb 0.01 -1.88 -0.04 0.00 0.10 0.00 0.00 34.13 32.32 1wxb s GLU 36 CO 0.05 -0.08 0.13 0.16 0.02 0.00 0.00 175.26 175.54 1wxb s ASP 37 N 1.05 1.61 0.00 -0.19 -4.77 -1.26 -2.43 116.67 110.68 1wxb s ASP 37 Ca -0.05 -1.51 0.00 0.00 -3.30 0.00 0.00 52.55 47.69 1wxb s ASP 37 Cb -0.15 0.30 0.00 0.00 -1.09 0.00 0.00 42.92 41.98 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 -0.59 1.42 3.82 2.12 0.00 -1.26 -5.04 105.19 105.66 1wxb n GLY 38 Ca -0.00 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 -1.60 0.00 0.00 0.00 173.32 171.72 1wxb s ARG 39 N -0.85 2.60 0.00 1.61 3.52 -1.26 -5.06 118.95 119.51 1wxb s ARG 39 Ca 0.00 -1.40 0.00 0.00 -0.13 0.00 0.00 55.73 54.20 1wxb s ARG 39 Cb 0.00 -2.38 0.00 0.00 -1.56 0.00 0.00 34.95 31.01 1wxb s ARG 39 CO 0.00 0.05 0.44 0.94 -0.81 0.00 0.00 175.30 175.92 1wxb n GLN 40 N -1.34 0.00 -3.30 5.12 -0.06 -1.26 -4.34 117.38 112.20 1wxb n GLN 40 Ca -0.01 0.44 -0.39 0.00 -2.00 0.00 0.00 57.00 55.04 1wxb n GLN 40 Cb 0.60 -0.92 -0.06 0.00 -4.06 0.00 0.00 30.24 25.81 1wxb n GLN 40 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1wxb s TRP 41 N -0.93 3.76 0.34 3.69 0.52 -1.26 -4.38 118.94 120.68 1wxb s TRP 41 Ca 0.00 1.19 -0.04 0.00 0.02 0.00 0.00 56.10 57.27 1wxb s TRP 41 Cb 0.00 -2.49 -0.05 0.00 -1.15 0.00 0.00 33.47 29.79 1wxb s TRP 41 CO 0.00 0.53 0.60 -1.58 0.02 0.00 0.00 176.95 176.53 1wxb s TRP 42 N -0.84 3.49 -0.44 -1.98 0.51 -0.86 -4.81 118.94 114.01 1wxb s TRP 42 Ca 0.28 0.63 -0.06 0.00 -2.12 0.00 0.00 56.10 54.84 1wxb s TRP 42 Cb -0.19 -2.11 0.12 0.00 -0.81 0.00 0.00 33.47 30.48 1wxb s TRP 42 CO 0.17 0.07 0.27 0.21 -0.51 0.00 0.00 176.95 177.16 1wxb s LYS 43 N -3.93 2.22 0.46 4.98 2.20 -1.02 -1.52 119.74 123.13 1wxb s LYS 43 Ca 0.44 -1.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.27 1wxb s LYS 43 Cb -0.10 -3.74 0.01 0.00 -1.51 0.00 0.00 37.83 32.49 1wxb s LYS 43 CO 0.34 -1.13 0.66 -0.51 -0.36 0.00 0.00 175.35 174.35 1wxb s LEU 44 N 1.22 3.58 -0.04 5.43 2.01 -0.62 -2.05 118.68 128.22 1wxb s LEU 44 Ca 0.07 0.05 0.02 0.00 0.01 0.00 0.00 54.13 54.28 1wxb s LEU 44 Cb -0.24 -2.95 0.01 0.00 0.01 0.00 0.00 46.19 43.02 1wxb s LEU 44 CO -0.03 -0.80 -0.07 -0.60 1.01 0.00 0.00 176.35 175.86 1wxb s ARG 45 N -4.54 0.93 0.69 1.70 3.52 -0.21 -1.45 118.95 119.60 1wxb s ARG 45 Ca 0.51 -0.21 -0.08 0.00 -0.13 0.00 0.00 55.73 55.83 1wxb s ARG 45 Cb -0.10 -0.88 0.05 0.00 -1.56 0.00 0.00 34.95 32.46 1wxb s ARG 45 CO 0.36 0.01 1.02 -1.54 -0.81 0.00 0.00 175.30 174.34 1wxb s SER 46 N 0.56 5.03 0.00 -2.12 1.04 0.11 -2.60 113.70 115.72 1wxb s SER 46 Ca -0.08 0.63 0.14 0.00 0.48 0.00 0.00 55.95 57.12 1wxb s SER 46 Cb -0.12 -1.36 0.68 0.00 0.10 0.00 0.00 66.02 65.33 1wxb s SER 46 CO 0.01 -1.48 1.41 0.54 0.98 0.00 0.00 173.24 174.70 1wxb n ARG 47 N -2.90 0.13 -0.11 4.02 3.00 -1.26 -1.65 116.66 117.90 1wxb n ARG 47 Ca 0.07 0.19 0.06 0.00 -0.01 0.00 0.00 57.85 58.16 1wxb n ARG 47 Cb 0.59 -1.50 0.20 0.00 0.00 0.00 0.00 32.46 31.75 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 -1.36 1.31 -0.20 0.55 2.88 -1.26 -4.85 113.62 110.69 1wxb n SER 48 Ca 0.06 -1.90 -0.03 0.00 -1.33 0.00 0.00 58.87 55.67 1wxb n SER 48 Cb 0.13 -0.14 -0.01 0.00 -0.75 0.00 0.00 64.21 63.44 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 0.94 0.57 3.92 0.46 0.00 -0.66 -5.01 105.19 105.41 1wxb n GLY 49 Ca 0.10 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.42 3.57 -0.03 1.61 -0.21 -1.23 -4.91 119.66 117.03 1wxb s GLN 50 Ca 0.00 -0.19 -0.01 0.00 0.02 0.00 0.00 55.36 55.18 1wxb s GLN 50 Cb 0.00 -2.75 0.03 0.00 1.00 0.00 0.00 33.01 31.29 1wxb s GLN 50 CO 0.00 0.31 0.06 0.00 -2.12 0.00 0.00 175.29 173.54 1wxb s ALA 51 N -1.98 -0.03 0.17 6.09 0.00 -1.26 0.08 121.76 124.83 1wxb s ALA 51 Ca 0.41 0.39 -0.11 0.00 0.00 0.00 0.00 51.96 52.64 1wxb s ALA 51 Cb -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1wxb s ALA 51 CO 0.30 -0.11 0.35 0.20 0.00 0.00 0.00 175.76 176.50 1wxb s GLY 52 N 0.99 0.31 0.15 0.00 0.00 -0.53 -4.77 107.32 103.48 1wxb s GLY 52 Ca -0.08 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 43.88 1wxb s GLY 52 CO -0.03 -0.67 0.41 -0.19 0.00 0.00 0.00 173.10 172.61 1wxb s TYR 53 N -3.94 3.48 0.15 1.90 2.02 0.50 -1.58 117.35 119.87 1wxb s TYR 53 Ca 0.15 0.64 -0.12 0.00 -0.37 0.00 0.00 57.07 57.37 1wxb s TYR 53 Cb 0.02 -2.07 0.01 0.00 -0.40 0.00 0.00 41.96 39.52 1wxb s TYR 53 CO -0.01 0.41 0.34 0.14 -1.57 0.00 0.00 175.55 174.87 1wxb s VAL 54 N -1.65 0.07 0.35 0.71 -7.23 -0.58 -3.08 120.40 108.99 1wxb s VAL 54 Ca 0.41 -1.07 -0.26 0.00 -1.81 0.00 0.00 61.98 59.25 1wxb s VAL 54 Cb -0.12 -1.58 -0.09 0.00 0.56 0.00 0.00 36.38 35.15 1wxb s VAL 54 CO 0.23 -0.32 1.06 -2.16 -0.31 0.00 0.00 175.10 173.61 1wxb s PRO 55 N -3.90 4.36 0.00 4.82 0.04 -1.26 -2.03 135.00 137.04 1wxb s PRO 55 Ca 0.11 1.62 0.22 0.00 0.04 0.00 0.00 61.00 62.99 1wxb s PRO 55 Cb 0.02 -2.81 1.12 0.00 0.04 0.00 0.00 34.50 32.87 1wxb s PRO 55 CO -0.05 0.01 1.74 0.00 0.04 0.00 0.00 177.00 178.75 1wxb h ASN 57 N 0.78 0.00 0.00 0.00 -1.24 -1.94 -3.18 115.58 110.00 1wxb h ASN 57 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1wxb h ASN 57 Cb 0.17 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.22 1wxb h ASN 57 CO 0.00 0.42 -1.97 2.30 -1.29 0.00 0.00 177.43 176.89 1wxb n ILE 58 N -3.25 0.00 -0.92 2.57 -5.35 -1.18 -4.97 119.36 106.27 1wxb n ILE 58 Ca 0.02 -0.49 -0.29 0.00 -0.27 0.00 0.00 62.75 61.72 1wxb n ILE 58 Cb 0.67 0.02 0.22 0.00 -1.74 0.00 0.00 39.64 38.81 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 -4.48 0.92 -0.23 7.28 1.43 -1.20 0.45 118.68 122.85 1wxb s LEU 59 Ca -0.08 1.11 -0.29 0.00 -1.03 0.00 0.00 54.13 53.85 1wxb s LEU 59 Cb 0.14 -3.06 0.15 0.00 0.03 0.00 0.00 46.19 43.45 1wxb s LEU 59 CO 0.89 -3.84 1.15 -0.83 0.23 0.00 0.00 176.35 173.95 1wxb s GLY 60 N -3.26 -0.08 0.09 -3.19 0.00 -1.09 -4.62 107.32 95.16 1wxb s GLY 60 Ca 0.68 2.52 -0.31 0.00 0.00 0.00 0.00 44.72 47.60 1wxb s GLY 60 CO 0.59 1.28 1.85 -1.83 0.00 0.00 0.00 173.10 174.99 1wxb s GLU 61 N -0.75 4.14 -0.11 2.90 -1.05 -1.26 -1.19 118.70 121.38 1wxb s GLU 61 Ca 0.03 2.57 -0.03 0.00 -0.15 0.00 0.00 54.97 57.39 1wxb s GLU 61 Cb -0.02 -3.76 -0.03 0.00 -0.44 0.00 0.00 34.13 29.87 1wxb s GLU 61 CO -0.04 -0.87 0.03 0.00 0.95 0.00 0.00 175.26 175.33 1wxb s ALA 62 N 3.25 3.36 -0.29 -0.84 0.00 -1.26 -4.70 121.76 121.29 1wxb s ALA 62 Ca 0.82 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 52.03 1wxb s ALA 62 Cb -0.44 -1.61 0.08 0.00 0.00 0.00 0.00 23.12 21.15 1wxb s ALA 62 CO 0.37 0.51 0.00 -1.12 0.00 0.00 0.00 175.76 175.53 1wxb s SER 63 N -0.64 4.28 0.11 0.00 0.01 -1.26 -4.77 113.70 111.43 1wxb s SER 63 Ca 0.11 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 55.73 1wxb s SER 63 Cb -0.12 -1.33 0.00 0.00 0.21 0.00 0.00 66.02 64.79 1wxb s SER 63 CO 0.02 -0.31 0.02 0.61 0.41 0.00 0.00 173.24 173.99 1wxb n GLY 64 N 4.53 1.62 3.62 3.44 0.00 -1.26 -5.03 105.19 112.11 1wxb n GLY 64 Ca -0.05 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.46 1wxb n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wxb s PRO 65 N -2.16 3.82 0.39 1.61 0.04 -1.26 -4.71 135.00 132.73 1wxb s PRO 65 Ca 0.01 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1wxb s PRO 65 Cb -0.00 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1wxb s PRO 65 CO 0.01 -1.25 0.00 0.45 0.04 0.00 0.00 177.00 176.25 1wxb n SER 66 N 8.01 -6.44 -3.97 6.66 2.88 -1.26 -4.90 113.62 114.60 1wxb n SER 66 Ca 0.16 1.01 -0.30 0.00 -1.33 0.00 0.00 58.87 58.40 1wxb n SER 66 Cb 0.47 -3.26 -0.14 0.00 -0.75 0.00 0.00 64.21 60.52 1wxb n SER 66 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wxb s SER 67 N -3.42 4.48 0.00 -3.46 0.01 -1.26 -5.15 113.70 104.89 1wxb s SER 67 Ca 0.00 -2.63 0.00 0.00 1.31 0.00 0.00 55.95 54.63 1wxb s SER 67 Cb 0.00 -1.61 0.00 0.00 0.21 0.00 0.00 66.02 64.62 1wxb s SER 67 CO 0.00 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 173.96