#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 1.84 -2.91 1.61 2.88 -1.26 -5.06 113.62 110.72 1wxb n SER 2 Ca 0.00 0.56 -0.10 0.00 -1.33 0.00 0.00 58.87 57.99 1wxb n SER 2 Cb 0.00 -0.87 0.01 0.00 -0.75 0.00 0.00 64.21 62.61 1wxb n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wxb n SER 3 N -4.56 -7.74 0.00 -3.46 7.64 -1.26 -4.79 113.62 99.45 1wxb n SER 3 Ca -0.13 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1wxb n SER 3 Cb 0.38 -5.04 0.00 0.00 -1.01 0.00 0.00 64.21 58.53 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 -0.23 -0.08 3.55 0.23 0.00 -1.26 -5.09 105.19 102.31 1wxb n GLY 4 Ca 0.09 0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 6.46 -0.72 1.61 0.15 -1.26 -4.99 113.70 114.95 1wxb s SER 5 Ca 0.00 0.02 -0.16 0.00 0.70 0.00 0.00 55.95 56.51 1wxb s SER 5 Cb 0.00 -2.44 0.17 0.00 -1.71 0.00 0.00 66.02 62.04 1wxb s SER 5 CO 0.00 -1.05 0.72 -0.44 1.20 0.00 0.00 173.24 173.67 1wxb s SER 6 N 2.31 6.51 -0.19 5.45 0.01 -1.26 -5.01 113.70 121.52 1wxb s SER 6 Ca 0.35 -2.20 -0.25 0.00 1.31 0.00 0.00 55.95 55.16 1wxb s SER 6 Cb -0.11 -2.24 -0.01 0.00 0.21 0.00 0.00 66.02 63.87 1wxb s SER 6 CO 0.25 -0.78 0.81 -0.83 0.41 0.00 0.00 173.24 173.10 1wxb s GLY 7 N 2.92 2.00 0.24 3.44 0.00 -1.26 -5.05 107.32 109.60 1wxb s GLY 7 Ca 0.14 -0.05 0.08 0.00 0.00 0.00 0.00 44.72 44.90 1wxb s GLY 7 CO -0.03 1.67 0.05 1.25 0.00 0.00 0.00 173.10 176.04 1wxb s LYS 8 N 2.32 2.49 0.10 2.90 2.20 -1.26 -4.53 119.74 123.96 1wxb s LYS 8 Ca 0.36 -1.24 0.01 0.00 -0.36 0.00 0.00 55.97 54.74 1wxb s LYS 8 Cb -0.16 -2.32 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 1wxb s LYS 8 CO 0.11 0.40 -0.02 0.71 -0.36 0.00 0.00 175.35 176.18 1wxb s TYR 9 N -2.11 0.84 -0.02 4.03 2.02 -1.26 -3.52 117.35 117.34 1wxb s TYR 9 Ca 0.31 -1.03 0.04 0.00 -0.37 0.00 0.00 57.07 56.02 1wxb s TYR 9 Cb -0.08 -0.51 -0.01 0.00 -0.40 0.00 0.00 41.96 40.97 1wxb s TYR 9 CO 0.21 -0.28 -0.13 0.54 -1.57 0.00 0.00 175.55 174.31 1wxb s VAL 10 N -3.78 1.07 -0.35 0.71 0.11 -1.10 -3.71 120.40 113.35 1wxb s VAL 10 Ca 0.15 -0.57 -0.11 0.00 -2.93 0.00 0.00 61.98 58.52 1wxb s VAL 10 Cb 0.07 -0.90 0.01 0.00 -1.53 0.00 0.00 36.38 34.02 1wxb s VAL 10 CO -0.04 0.31 0.20 -0.75 -3.33 0.00 0.00 175.10 171.49 1wxb s LYS 11 N -0.21 3.14 0.02 1.54 2.20 -1.09 -1.74 119.74 123.60 1wxb s LYS 11 Ca 0.03 -0.87 -0.31 0.00 -0.36 0.00 0.00 55.97 54.46 1wxb s LYS 11 Cb -0.06 -3.70 -0.10 0.00 -1.51 0.00 0.00 37.83 32.46 1wxb s LYS 11 CO -0.00 -0.55 1.92 -0.89 -0.36 0.00 0.00 175.35 175.46 1wxb n ILE 12 N 5.02 0.64 0.12 5.43 2.08 0.30 -3.28 119.36 129.67 1wxb n ILE 12 Ca -0.13 -0.11 0.06 0.00 0.56 0.00 0.00 62.75 63.12 1wxb n ILE 12 Cb 0.48 -2.15 0.02 0.00 -0.75 0.00 0.00 39.64 37.24 1wxb n ILE 12 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1wxb h LEU 13 N 9.77 0.00 -7.39 1.39 3.38 -0.73 -1.85 115.31 119.88 1wxb h LEU 13 Ca -0.49 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.35 1wxb h LEU 13 Cb 1.25 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.76 1wxb h LEU 13 CO 0.94 0.32 -0.30 -0.31 0.09 0.00 0.00 178.44 179.19 1wxb s TYR 14 N -3.08 -0.36 0.34 1.13 2.02 -1.26 -4.75 117.35 111.39 1wxb s TYR 14 Ca 0.02 0.84 -0.29 0.00 -0.37 0.00 0.00 57.07 57.27 1wxb s TYR 14 Cb 0.08 0.13 -0.11 0.00 -0.40 0.00 0.00 41.96 41.66 1wxb s TYR 14 CO 0.76 -0.22 1.46 0.16 -1.57 0.00 0.00 175.55 176.14 1wxb s ASP 15 N -0.06 6.47 0.02 2.29 1.47 -1.26 -4.47 116.67 121.12 1wxb s ASP 15 Ca -0.02 2.92 0.03 0.00 1.18 0.00 0.00 52.55 56.67 1wxb s ASP 15 Cb -0.03 -2.65 -0.02 0.00 -0.34 0.00 0.00 42.92 39.88 1wxb s ASP 15 CO 0.01 -0.80 -0.11 0.12 0.68 0.00 0.00 175.17 175.08 1wxb s PHE 16 N -0.82 0.93 -0.30 2.11 5.36 0.33 -4.89 117.98 120.71 1wxb s PHE 16 Ca 0.54 -0.28 -0.03 0.00 -0.96 0.00 0.00 56.93 56.21 1wxb s PHE 16 Cb -0.45 -0.57 0.04 0.00 -0.34 0.00 0.00 43.02 41.70 1wxb s PHE 16 CO 0.57 -0.01 0.01 0.99 -1.46 0.00 0.00 175.22 175.32 1wxb s THR 17 N -0.64 3.15 -0.20 0.12 2.01 -1.26 -1.68 115.64 117.14 1wxb s THR 17 Ca 0.01 -1.24 -0.32 0.00 0.31 0.00 0.00 61.69 60.45 1wxb s THR 17 Cb -0.06 -2.76 -0.09 0.00 0.01 0.00 0.00 72.50 69.60 1wxb s THR 17 CO 0.00 -0.05 2.10 0.00 -0.69 0.00 0.00 174.62 175.99 1wxb n ALA 18 N 4.67 1.35 0.42 7.40 0.00 -1.25 -4.80 120.51 128.30 1wxb n ALA 18 Ca -0.14 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.41 1wxb n ALA 18 Cb 0.44 -2.69 0.31 0.00 0.00 0.00 0.00 19.45 17.52 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 12.45 0.00 -4.97 0.00 2.47 -1.92 -3.46 114.38 118.95 1wxb h ARG 19 Ca -0.40 0.00 -0.52 0.00 -1.26 0.00 0.00 59.98 57.80 1wxb h ARG 19 Cb 1.27 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.46 1wxb h ARG 19 CO 0.97 0.00 -0.50 -0.80 0.56 0.00 0.00 179.97 180.20 1wxb s ASN 20 N -5.31 2.29 0.08 7.04 0.01 -1.26 -5.05 114.94 112.73 1wxb s ASN 20 Ca 0.08 -1.73 -0.08 0.00 -0.71 0.00 0.00 52.86 50.42 1wxb s ASN 20 Cb 0.09 0.56 -0.24 0.00 0.41 0.00 0.00 41.25 42.06 1wxb s ASN 20 CO 0.62 -1.01 1.16 0.00 -1.51 0.00 0.00 177.10 176.36 1wxb h ALA 21 N 1.94 0.11 0.00 0.60 0.00 -1.99 -3.01 119.26 116.90 1wxb h ALA 21 Ca -0.30 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 53.80 1wxb h ALA 21 Cb 1.26 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1wxb h ALA 21 CO 0.47 0.83 0.00 0.09 0.00 0.00 0.00 179.25 180.64 1wxb n ASN 22 N -3.67 0.57 -4.95 0.00 4.13 -1.26 -4.63 115.26 105.44 1wxb n ASN 22 Ca -0.10 0.71 -0.23 0.00 1.68 0.00 0.00 54.58 56.63 1wxb n ASN 22 Cb 0.98 -0.80 -0.02 0.00 -1.54 0.00 0.00 39.78 38.39 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 -3.43 3.47 -0.03 3.52 2.02 -1.14 0.19 118.70 123.30 1wxb s GLU 23 Ca 0.00 -0.55 0.05 0.00 0.02 0.00 0.00 54.97 54.49 1wxb s GLU 23 Cb 0.07 -2.81 -0.03 0.00 0.10 0.00 0.00 34.13 31.46 1wxb s GLU 23 CO 0.26 0.34 -0.18 -1.17 0.02 0.00 0.00 175.26 174.54 1wxb s LEU 24 N -3.95 2.55 -0.24 1.80 2.96 -1.11 -4.45 118.68 116.24 1wxb s LEU 24 Ca 0.37 -0.29 -0.12 0.00 -0.22 0.00 0.00 54.13 53.87 1wxb s LEU 24 Cb -0.10 -1.50 -0.05 0.00 0.50 0.00 0.00 46.19 45.05 1wxb s LEU 24 CO 0.31 0.33 0.22 -0.44 -1.32 0.00 0.00 176.35 175.45 1wxb s SER 25 N -0.79 6.16 0.25 3.68 0.01 -1.26 -3.95 113.70 117.80 1wxb s SER 25 Ca 0.11 0.17 0.01 0.00 1.31 0.00 0.00 55.95 57.56 1wxb s SER 25 Cb -0.10 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 1wxb s SER 25 CO 0.01 0.01 0.14 0.68 0.41 0.00 0.00 173.24 174.49 1wxb s VAL 26 N 1.26 0.22 0.51 3.43 -7.23 -0.68 -4.94 120.40 112.98 1wxb s VAL 26 Ca 0.10 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 1wxb s VAL 26 Cb -0.14 -2.54 -0.01 0.00 0.56 0.00 0.00 36.38 34.25 1wxb s VAL 26 CO 0.06 0.00 0.01 -0.76 -0.31 0.00 0.00 175.10 174.11 1wxb s LEU 27 N -3.27 2.22 0.27 1.32 1.43 -1.26 -0.51 118.68 118.88 1wxb s LEU 27 Ca 0.38 -1.69 -0.24 0.00 -1.03 0.00 0.00 54.13 51.56 1wxb s LEU 27 Cb 0.06 -0.66 -0.09 0.00 0.03 0.00 0.00 46.19 45.53 1wxb s LEU 27 CO 0.15 -0.90 0.85 -0.75 0.23 0.00 0.00 176.35 175.93 1wxb s LYS 28 N -3.87 4.46 0.00 1.70 2.20 -1.26 -3.21 119.74 119.75 1wxb s LYS 28 Ca 0.05 1.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 1wxb s LYS 28 Cb 0.01 -2.86 0.00 0.00 -1.51 0.00 0.00 37.83 33.47 1wxb s LYS 28 CO 0.03 0.34 0.00 -0.25 -0.36 0.00 0.00 175.35 175.11 1wxb n ASP 29 N 0.69 -1.19 -4.91 1.43 8.00 -0.69 -4.92 116.55 114.96 1wxb n ASP 29 Ca -0.00 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.21 1wxb n ASP 29 Cb 0.50 -0.32 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 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 -0.07 3.62 -0.09 -1.24 2.02 -1.20 -4.87 118.70 116.88 1wxb s GLU 30 Ca 0.00 -0.07 0.02 0.00 0.02 0.00 0.00 54.97 54.94 1wxb s GLU 30 Cb 0.00 -2.74 0.01 0.00 0.10 0.00 0.00 34.13 31.51 1wxb s GLU 30 CO 0.00 0.32 -0.15 0.08 0.02 0.00 0.00 175.26 175.53 1wxb s VAL 31 N -1.91 1.42 0.50 2.63 1.01 -1.26 0.11 120.40 122.90 1wxb s VAL 31 Ca 0.42 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.83 1wxb s VAL 31 Cb -0.11 -1.28 0.00 0.00 0.00 0.00 0.00 36.38 34.99 1wxb s VAL 31 CO 0.28 0.42 0.27 -0.76 0.00 0.00 0.00 175.10 175.31 1wxb s LEU 32 N 0.72 2.77 -0.38 3.92 2.01 -0.71 -4.96 118.68 122.05 1wxb s LEU 32 Ca -0.13 -1.25 -0.12 0.00 0.01 0.00 0.00 54.13 52.64 1wxb s LEU 32 Cb -0.16 -1.22 0.02 0.00 0.01 0.00 0.00 46.19 44.85 1wxb s LEU 32 CO 0.03 -0.89 0.23 -0.70 1.01 0.00 0.00 176.35 176.02 1wxb s GLU 33 N -4.11 2.93 0.07 1.70 2.12 -1.17 -2.70 118.70 117.54 1wxb s GLU 33 Ca 0.31 -1.02 -0.30 0.00 0.36 0.00 0.00 54.97 54.32 1wxb s GLU 33 Cb -0.00 -3.78 -0.05 0.00 0.26 0.00 0.00 34.13 30.55 1wxb s GLU 33 CO 0.18 -0.68 1.12 0.54 -0.54 0.00 0.00 175.26 175.89 1wxb s VAL 34 N 1.60 4.21 -0.08 3.70 0.11 -1.23 -1.53 120.40 127.17 1wxb s VAL 34 Ca 0.03 1.65 -0.01 0.00 -2.93 0.00 0.00 61.98 60.72 1wxb s VAL 34 Cb -0.19 -4.05 -0.05 0.00 -1.53 0.00 0.00 36.38 30.56 1wxb s VAL 34 CO 0.08 0.16 -0.08 0.18 -3.33 0.00 0.00 175.10 172.10 1wxb n LEU 35 N 3.60 2.20 -4.12 2.54 4.77 -0.58 -4.67 117.00 120.74 1wxb n LEU 35 Ca 0.07 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.77 1wxb n LEU 35 Cb 0.47 -0.27 -0.17 0.00 -2.33 0.00 0.00 43.42 41.13 1wxb n LEU 35 CO 0.54 0.48 -0.51 -1.61 -1.33 0.00 0.00 177.39 174.96 1wxb s GLU 36 N -2.16 2.43 0.25 3.23 2.02 -1.20 -5.00 118.70 118.28 1wxb s GLU 36 Ca -0.11 -0.66 0.01 0.00 0.02 0.00 0.00 54.97 54.23 1wxb s GLU 36 Cb 0.03 -1.94 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 1wxb s GLU 36 CO 0.17 0.06 0.14 0.16 0.02 0.00 0.00 175.26 175.82 1wxb s ASP 37 N 0.63 0.91 0.00 -0.19 -4.77 -1.26 -1.94 116.67 110.05 1wxb s ASP 37 Ca -0.14 -1.47 0.00 0.00 -3.30 0.00 0.00 52.55 47.64 1wxb s ASP 37 Cb -0.16 0.35 0.00 0.00 -1.09 0.00 0.00 42.92 42.02 1wxb s ASP 37 CO 0.04 -0.85 0.00 0.61 0.70 0.00 0.00 175.17 175.67 1wxb n GLY 38 N -0.43 0.78 3.37 2.12 0.00 -1.26 -5.06 105.19 104.70 1wxb n GLY 38 Ca 0.02 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.62 1.41 0.12 1.61 3.52 -1.26 -5.05 118.95 118.67 1wxb s ARG 39 Ca 0.00 -1.69 -0.23 0.00 -0.13 0.00 0.00 55.73 53.68 1wxb s ARG 39 Cb 0.00 -0.95 -0.05 0.00 -1.56 0.00 0.00 34.95 32.39 1wxb s ARG 39 CO 0.00 0.03 1.34 1.04 -0.81 0.00 0.00 175.30 176.90 1wxb n GLN 40 N -0.47 -0.33 -4.74 5.12 6.02 -1.26 -4.23 117.38 117.50 1wxb n GLN 40 Ca -0.06 1.32 -0.33 0.00 -0.01 0.00 0.00 57.00 57.92 1wxb n GLN 40 Cb 0.63 -1.95 -0.13 0.00 1.02 0.00 0.00 30.24 29.81 1wxb n GLN 40 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1wxb s TRP 41 N -4.95 2.83 0.58 1.08 0.52 -1.26 -4.03 118.94 113.71 1wxb s TRP 41 Ca -0.09 -0.29 -0.07 0.00 0.02 0.00 0.00 56.10 55.67 1wxb s TRP 41 Cb 0.08 -1.76 -0.01 0.00 -1.15 0.00 0.00 33.47 30.64 1wxb s TRP 41 CO 0.46 0.06 0.91 -1.58 0.02 0.00 0.00 176.95 176.82 1wxb s TRP 42 N -0.27 3.39 -0.40 -1.98 0.51 -0.95 -4.78 118.94 114.47 1wxb s TRP 42 Ca 0.02 0.82 -0.02 0.00 -2.12 0.00 0.00 56.10 54.80 1wxb s TRP 42 Cb -0.13 -2.66 0.11 0.00 -0.81 0.00 0.00 33.47 29.98 1wxb s TRP 42 CO 0.03 -0.70 0.19 0.21 -0.51 0.00 0.00 176.95 176.16 1wxb s LYS 43 N -4.99 1.94 0.43 4.98 2.20 -0.82 -2.04 119.74 121.43 1wxb s LYS 43 Ca 0.53 -1.83 0.04 0.00 -0.36 0.00 0.00 55.97 54.35 1wxb s LYS 43 Cb -0.11 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.68 1wxb s LYS 43 CO 0.47 -1.06 0.61 -0.51 -0.36 0.00 0.00 175.35 174.50 1wxb s LEU 44 N 1.11 3.68 -0.04 5.43 2.01 -0.91 -1.52 118.68 128.44 1wxb s LEU 44 Ca 0.09 -0.06 0.01 0.00 0.01 0.00 0.00 54.13 54.18 1wxb s LEU 44 Cb -0.22 -2.88 0.02 0.00 0.01 0.00 0.00 46.19 43.12 1wxb s LEU 44 CO -0.05 -0.71 -0.04 -0.60 1.01 0.00 0.00 176.35 175.96 1wxb s ARG 45 N -4.44 0.71 0.90 1.70 3.52 -0.58 -1.65 118.95 119.11 1wxb s ARG 45 Ca 0.50 -0.09 -0.12 0.00 -0.13 0.00 0.00 55.73 55.89 1wxb s ARG 45 Cb -0.10 -0.74 0.13 0.00 -1.56 0.00 0.00 34.95 32.69 1wxb s ARG 45 CO 0.35 -0.06 1.14 -1.54 -0.81 0.00 0.00 175.30 174.37 1wxb s SER 46 N 0.80 3.57 0.00 -2.12 1.04 0.18 -3.03 113.70 114.14 1wxb s SER 46 Ca -0.10 0.98 0.19 0.00 0.48 0.00 0.00 55.95 57.50 1wxb s SER 46 Cb -0.13 -1.56 0.94 0.00 0.10 0.00 0.00 66.02 65.37 1wxb s SER 46 CO -0.00 -2.52 1.58 0.54 0.98 0.00 0.00 173.24 173.82 1wxb n ARG 47 N -3.74 0.26 0.00 4.02 1.74 -1.26 -1.68 116.66 116.00 1wxb n ARG 47 Ca 0.07 0.11 0.13 0.00 -0.77 0.00 0.00 57.85 57.39 1wxb n ARG 47 Cb 0.59 -1.50 0.41 0.00 -1.02 0.00 0.00 32.46 30.94 1wxb n ARG 47 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1wxb n SER 48 N -1.29 1.37 0.00 0.55 7.64 -1.26 -4.90 113.62 115.73 1wxb n SER 48 Ca 0.09 -1.23 0.00 0.00 1.01 0.00 0.00 58.87 58.73 1wxb n SER 48 Cb 0.15 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 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 1.27 0.70 3.77 0.23 0.00 -0.67 -5.05 105.19 105.44 1wxb n GLY 49 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.76 2.86 -0.07 1.61 -0.21 -1.25 -4.77 119.66 117.06 1wxb s GLN 50 Ca 0.00 1.45 -0.03 0.00 0.02 0.00 0.00 55.36 56.79 1wxb s GLN 50 Cb 0.00 -1.95 0.04 0.00 1.00 0.00 0.00 33.01 32.10 1wxb s GLN 50 CO 0.00 -1.21 0.16 0.00 -2.12 0.00 0.00 175.29 172.11 1wxb s ALA 51 N -2.23 -0.29 0.12 6.09 0.00 -1.26 0.51 121.76 124.70 1wxb s ALA 51 Ca 0.68 0.72 -0.12 0.00 0.00 0.00 0.00 51.96 53.24 1wxb s ALA 51 Cb -0.21 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.44 1wxb s ALA 51 CO 0.39 -0.16 0.30 0.20 0.00 0.00 0.00 175.76 176.49 1wxb s GLY 52 N 1.19 0.02 0.30 0.00 0.00 -0.66 -4.76 107.32 103.41 1wxb s GLY 52 Ca -0.09 -0.44 -0.10 0.00 0.00 0.00 0.00 44.72 44.09 1wxb s GLY 52 CO -0.06 -0.60 0.63 -0.19 0.00 0.00 0.00 173.10 172.88 1wxb s TYR 53 N -3.86 3.44 0.14 1.90 2.02 0.50 -2.15 117.35 119.34 1wxb s TYR 53 Ca 0.07 0.92 -0.13 0.00 -0.37 0.00 0.00 57.07 57.55 1wxb s TYR 53 Cb 0.03 -2.31 0.02 0.00 -0.40 0.00 0.00 41.96 39.29 1wxb s TYR 53 CO -0.09 0.13 0.36 0.14 -1.57 0.00 0.00 175.55 174.53 1wxb s VAL 54 N -2.03 0.07 0.36 0.71 -7.23 -0.87 -2.76 120.40 108.65 1wxb s VAL 54 Ca 0.49 -0.94 -0.26 0.00 -1.81 0.00 0.00 61.98 59.46 1wxb s VAL 54 Cb -0.11 -1.46 -0.09 0.00 0.56 0.00 0.00 36.38 35.28 1wxb s VAL 54 CO 0.25 -0.33 1.06 -2.16 -0.31 0.00 0.00 175.10 173.61 1wxb s PRO 55 N -3.87 4.34 0.00 4.82 0.04 -1.26 -2.24 135.00 136.82 1wxb s PRO 55 Ca 0.08 1.61 0.28 0.00 0.04 0.00 0.00 61.00 63.01 1wxb s PRO 55 Cb 0.02 -2.77 1.54 0.00 0.04 0.00 0.00 34.50 33.33 1wxb s PRO 55 CO -0.07 -0.01 2.01 0.00 0.04 0.00 0.00 177.00 178.97 1wxb h ASN 57 N 0.46 0.00 0.00 0.00 -0.73 -1.91 -2.82 115.58 110.57 1wxb h ASN 57 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1wxb h ASN 57 Cb 0.10 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 1wxb h ASN 57 CO 0.00 0.10 -1.15 2.30 -0.37 0.00 0.00 177.43 178.31 1wxb n ILE 58 N -3.21 0.00 -1.90 2.57 -5.35 -1.18 -4.97 119.36 105.32 1wxb n ILE 58 Ca 0.01 -0.26 -0.33 0.00 -0.27 0.00 0.00 62.75 61.90 1wxb n ILE 58 Cb 0.38 0.56 0.03 0.00 -1.74 0.00 0.00 39.64 38.87 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 -3.32 3.46 -0.14 7.28 1.43 -1.07 0.00 118.68 126.32 1wxb s LEU 59 Ca -0.01 1.96 -0.10 0.00 -1.03 0.00 0.00 54.13 54.95 1wxb s LEU 59 Cb 0.09 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.80 1wxb s LEU 59 CO 0.53 -1.44 0.35 -0.83 0.23 0.00 0.00 176.35 175.19 1wxb s GLY 60 N -2.57 -0.26 -0.14 -3.19 0.00 -1.20 -4.81 107.32 95.15 1wxb s GLY 60 Ca 0.66 1.14 -0.29 0.00 0.00 0.00 0.00 44.72 46.23 1wxb s GLY 60 CO 0.39 1.15 2.09 -0.54 0.00 0.00 0.00 173.10 176.18 1wxb s GLU 61 N 0.71 3.51 0.28 2.90 2.02 -1.26 -2.68 118.70 124.18 1wxb s GLU 61 Ca -0.04 2.18 0.04 0.00 0.02 0.00 0.00 54.97 57.17 1wxb s GLU 61 Cb -0.05 -4.28 -0.03 0.00 0.10 0.00 0.00 34.13 29.87 1wxb s GLU 61 CO -0.05 -1.67 0.42 0.00 0.02 0.00 0.00 175.26 173.98 1wxb s ALA 62 N 6.81 3.89 0.67 5.21 0.00 -1.24 -4.91 121.76 132.19 1wxb s ALA 62 Ca 0.94 -1.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.59 1wxb s ALA 62 Cb -0.35 -1.83 0.01 0.00 0.00 0.00 0.00 23.12 20.95 1wxb s ALA 62 CO 0.37 0.15 1.15 0.45 0.00 0.00 0.00 175.76 177.88 1wxb s SER 63 N -4.01 4.81 0.63 0.00 0.15 -1.26 -4.82 113.70 109.19 1wxb s SER 63 Ca 0.36 2.17 -0.05 0.00 0.70 0.00 0.00 55.95 59.14 1wxb s SER 63 Cb -0.09 -2.57 0.04 0.00 -1.71 0.00 0.00 66.02 61.69 1wxb s SER 63 CO 0.31 -1.84 0.92 -0.83 1.20 0.00 0.00 173.24 173.00 1wxb s GLY 64 N -2.26 1.68 -1.19 9.45 0.00 -1.26 -4.72 107.32 109.02 1wxb s GLY 64 Ca 0.71 -0.94 -0.19 0.00 0.00 0.00 0.00 44.72 44.29 1wxb s GLY 64 CO 0.41 -0.61 1.93 -1.55 0.00 0.00 0.00 173.10 173.29 1wxb n PRO 65 N -2.67 2.32 0.39 2.90 -0.04 -1.26 -4.73 135.00 131.90 1wxb n PRO 65 Ca 0.07 -2.62 -0.17 0.00 -0.04 0.00 0.00 63.50 60.73 1wxb n PRO 65 Cb 0.59 -3.41 -0.09 0.00 -0.04 0.00 0.00 33.50 30.56 1wxb n PRO 65 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1wxb h SER 66 N 7.96 -0.84 -1.52 3.54 0.02 -1.99 -3.45 113.55 117.28 1wxb h SER 66 Ca 0.40 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.44 1wxb h SER 66 Cb 0.81 0.22 -0.21 0.00 0.14 0.00 0.00 62.40 63.36 1wxb h SER 66 CO 1.58 -0.53 -0.19 -0.94 -1.14 0.00 0.00 176.83 175.61 1wxb s SER 67 N -4.38 -1.25 0.00 3.07 1.04 -1.26 -5.08 113.70 105.84 1wxb s SER 67 Ca -0.17 1.24 0.10 0.00 0.48 0.00 0.00 55.95 57.60 1wxb s SER 67 Cb 0.02 2.23 0.59 0.00 0.10 0.00 0.00 66.02 68.96 1wxb s SER 67 CO 0.55 -0.24 1.03 0.61 0.98 0.00 0.00 173.24 176.17