#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wkt s ASP 2 N 0.00 2.04 0.44 1.61 1.11 -1.26 -5.09 116.67 115.52 1wkt s ASP 2 Ca 0.00 -3.06 0.00 0.00 0.18 0.00 0.00 52.55 49.67 1wkt s ASP 2 Cb 0.00 -0.59 0.00 0.00 1.07 0.00 0.00 42.92 43.40 1wkt s ASP 2 CO 0.00 -0.18 0.00 0.61 1.18 0.00 0.00 175.17 176.78 1wkt n GLY 3 N 2.88 -1.64 3.79 0.21 0.00 -1.26 -4.90 105.19 104.27 1wkt n GLY 3 Ca 0.26 -1.23 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 1wkt n GLY 3 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1wkt s TYR 4 N -0.54 0.16 -0.29 1.61 1.13 -0.48 -4.91 117.35 114.03 1wkt s TYR 4 Ca 0.00 -0.80 -0.03 0.00 -1.41 0.00 0.00 57.07 54.83 1wkt s TYR 4 Cb 0.00 0.78 0.17 0.00 -1.10 0.00 0.00 41.96 41.81 1wkt s TYR 4 CO 0.00 -1.53 0.57 -1.17 -2.51 0.00 0.00 175.55 170.91 1wkt s LEU 5 N -3.07 -1.22 0.32 -3.49 0.20 -1.26 -0.26 118.68 109.89 1wkt s LEU 5 Ca 0.16 0.87 0.10 0.00 0.69 0.00 0.00 54.13 55.96 1wkt s LEU 5 Cb -0.05 2.00 -0.06 0.00 -0.43 0.00 0.00 46.19 47.65 1wkt s LEU 5 CO 0.12 -0.26 -0.13 0.27 -0.29 0.00 0.00 176.35 176.05 1wkt s ILE 6 N 2.81 2.30 0.19 6.68 -4.36 -0.49 -4.92 121.20 123.41 1wkt s ILE 6 Ca 0.16 -2.28 -0.04 0.00 -0.26 0.00 0.00 60.65 58.23 1wkt s ILE 6 Cb -0.15 -2.51 -0.05 0.00 1.25 0.00 0.00 42.46 41.01 1wkt s ILE 6 CO -0.20 -0.28 0.42 0.00 0.24 0.00 0.00 174.94 175.12 1wkt s MET 7 N -3.58 3.60 0.15 0.37 0.00 -1.26 -0.99 119.30 117.59 1wkt s MET 7 Ca 0.31 -0.13 -0.04 0.00 0.00 0.00 0.00 55.69 55.83 1wkt s MET 7 Cb -0.00 -2.80 -0.03 0.00 0.00 0.00 0.00 34.83 32.00 1wkt s MET 7 CO 0.16 0.39 0.16 0.00 0.00 0.00 0.00 175.02 175.72 1wkt h LYS 9 N 2.72 0.00 -3.29 0.00 1.57 -1.75 -2.69 116.57 113.13 1wkt h LYS 9 Ca -0.34 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.43 1wkt h LYS 9 Cb 1.21 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 1wkt h LYS 9 CO 0.54 0.18 0.10 0.54 -0.57 0.00 0.00 179.45 180.23 1wkt s ASN 10 N -6.26 -0.07 0.00 0.86 2.20 -1.26 -4.55 114.94 105.85 1wkt s ASN 10 Ca 0.05 -0.88 0.08 0.00 -0.94 0.00 0.00 52.86 51.18 1wkt s ASN 10 Cb 0.06 0.70 0.49 0.00 -2.00 0.00 0.00 41.25 40.50 1wkt s ASN 10 CO 0.69 -1.34 0.91 0.00 -2.94 0.00 0.00 177.10 174.42 1wkt s ASP 12 N -1.84 5.85 0.52 0.00 -1.08 -1.26 -4.90 116.67 113.96 1wkt s ASP 12 Ca 0.12 -1.90 0.33 0.00 -0.52 0.00 0.00 52.55 50.58 1wkt s ASP 12 Cb 0.06 -2.07 1.33 0.00 -1.46 0.00 0.00 42.92 40.78 1wkt s ASP 12 CO 0.09 -0.74 1.96 1.55 0.52 0.00 0.00 175.17 178.55 1wkt h PRO 13 N 8.55 0.00 -0.03 4.34 0.13 -1.99 0.26 132.00 143.27 1wkt h PRO 13 Ca -0.23 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.89 1wkt h PRO 13 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1wkt h PRO 13 CO 0.91 0.00 -0.04 -0.97 -0.23 0.00 0.00 178.00 177.67 1wkt h ASN 14 N 0.00 0.08 0.00 1.44 -0.73 -1.97 -3.39 115.58 111.01 1wkt h ASN 14 Ca 0.00 -0.53 0.00 0.00 1.87 0.00 0.00 56.30 57.64 1wkt h ASN 14 Cb 0.49 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.06 1wkt h ASN 14 CO 0.00 0.60 -0.12 1.07 -0.37 0.00 0.00 177.43 178.60 1wkt n THR 15 N -4.77 0.97 0.24 -3.57 5.66 -1.22 -4.75 114.28 106.84 1wkt n THR 15 Ca -0.08 -1.12 0.08 0.00 -3.05 0.00 0.00 64.05 59.88 1wkt n THR 15 Cb 0.30 0.28 0.60 0.00 -1.55 0.00 0.00 70.33 69.95 1wkt n THR 15 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1wkt h GLY 16 N 0.00 0.00 -5.39 1.09 0.00 -0.67 -3.48 103.07 94.62 1wkt h GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wkt h GLY 16 CO 0.00 0.00 -1.08 1.44 0.00 0.00 0.00 176.54 176.90 1wkt n SER 17 N -4.09 -5.87 -4.18 0.19 7.64 -1.26 -4.30 113.62 101.75 1wkt n SER 17 Ca -0.02 1.22 -0.24 0.00 1.01 0.00 0.00 58.87 60.83 1wkt n SER 17 Cb 0.23 -4.43 -0.15 0.00 -1.01 0.00 0.00 64.21 58.85 1wkt n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wkt s ASP 19 N -0.65 6.26 -0.12 0.00 -4.77 -1.13 -4.86 116.67 111.39 1wkt s ASP 19 Ca 0.06 -0.55 -0.04 0.00 -3.30 0.00 0.00 52.55 48.72 1wkt s ASP 19 Cb -0.07 -2.46 -0.12 0.00 -1.09 0.00 0.00 42.92 39.17 1wkt s ASP 19 CO 0.00 -1.44 3.07 0.79 0.70 0.00 0.00 175.17 178.28 1wkt n TRP 20 N 8.00 0.46 -2.83 2.11 7.02 -1.26 -4.11 117.44 126.83 1wkt n TRP 20 Ca 0.01 -1.55 -0.20 0.00 -1.02 0.00 0.00 57.50 54.74 1wkt n TRP 20 Cb 0.47 -1.33 0.04 0.00 -2.42 0.00 0.00 31.31 28.07 1wkt n TRP 20 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1wkt s LYS 21 N 0.04 2.52 0.33 -0.99 3.01 -1.26 -5.09 119.74 118.30 1wkt s LYS 21 Ca 0.52 -1.12 -0.26 0.00 -1.01 0.00 0.00 55.97 54.10 1wkt s LYS 21 Cb 0.28 -2.60 -0.10 0.00 -1.01 0.00 0.00 37.83 34.40 1wkt s LYS 21 CO -0.05 -0.65 0.97 -1.14 0.51 0.00 0.00 175.35 174.99 1wkt s GLN 22 N -4.63 4.53 0.00 1.68 -0.44 -1.26 -4.97 119.66 114.57 1wkt s GLN 22 Ca 0.58 1.38 0.13 0.00 -2.50 0.00 0.00 55.36 54.95 1wkt s GLN 22 Cb -0.09 -2.79 0.21 0.00 -1.64 0.00 0.00 33.01 28.70 1wkt s GLN 22 CO 0.37 0.22 1.04 0.27 0.50 0.00 0.00 175.29 177.68 1wkt n ASN 23 N 0.51 0.25 -4.52 6.67 0.23 -1.26 -5.04 115.26 112.10 1wkt n ASN 23 Ca 0.02 -1.91 -0.41 0.00 -0.53 0.00 0.00 54.58 51.76 1wkt n ASN 23 Cb 0.50 -0.11 -0.10 0.00 -2.08 0.00 0.00 39.78 37.98 1wkt n ASN 23 CO 0.00 0.00 0.00 0.26 -0.93 0.00 0.00 177.26 176.59 1wkt s TRP 24 N 0.00 3.23 -1.28 -2.53 0.23 -1.26 -2.02 118.94 115.32 1wkt s TRP 24 Ca 0.17 -0.28 -0.08 0.00 -2.03 0.00 0.00 56.10 53.87 1wkt s TRP 24 Cb 0.19 -2.49 -0.00 0.00 0.03 0.00 0.00 33.47 31.19 1wkt s TRP 24 CO -0.08 -0.40 0.63 0.09 0.96 0.00 0.00 176.95 178.15 1wkt n ASN 25 N 5.11 -2.48 -3.76 2.95 3.02 -1.23 -4.96 115.26 113.91 1wkt n ASN 25 Ca -0.12 -0.97 -0.13 0.00 -0.03 0.00 0.00 54.58 53.33 1wkt n ASN 25 Cb 0.49 -3.43 -0.11 0.00 -0.61 0.00 0.00 39.78 36.12 1wkt n ASN 25 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1wkt s THR 26 N -3.70 -0.00 -0.60 3.41 -1.32 -1.26 -5.09 115.64 107.07 1wkt s THR 26 Ca 0.19 0.02 -0.26 0.00 -1.21 0.00 0.00 61.69 60.42 1wkt s THR 26 Cb -0.07 -0.42 -0.04 0.00 -1.51 0.00 0.00 72.50 70.47 1wkt s THR 26 CO 0.86 0.01 2.01 0.00 -2.21 0.00 0.00 174.62 175.29 1wkt s VAL 28 N 10.00 1.09 0.20 0.00 1.01 -1.23 -4.97 120.40 126.51 1wkt s VAL 28 Ca 0.75 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 1wkt s VAL 28 Cb -0.13 -1.14 -0.08 0.00 0.00 0.00 0.00 36.38 35.03 1wkt s VAL 28 CO 0.21 0.32 1.25 -0.83 0.00 0.00 0.00 175.10 176.05 1wkt s GLY 29 N 1.67 2.61 0.54 4.51 0.00 -1.25 -1.38 107.32 114.03 1wkt s GLY 29 Ca 0.04 1.03 -0.08 0.00 0.00 0.00 0.00 44.72 45.71 1wkt s GLY 29 CO -0.08 1.94 0.89 -0.42 0.00 0.00 0.00 173.10 175.42 1wkt s ILE 30 N -0.08 4.82 0.00 0.90 1.01 0.68 -4.93 121.20 123.60 1wkt s ILE 30 Ca 0.54 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.69 1wkt s ILE 30 Cb -0.35 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.26 1wkt s ILE 30 CO 0.38 -0.97 0.00 0.61 0.00 0.00 0.00 174.94 174.97 1wkt n GLY 31 N -2.44 0.55 2.22 6.18 0.00 -1.26 -4.77 105.19 105.68 1wkt n GLY 31 Ca 0.03 -0.74 -0.02 0.00 0.00 0.00 0.00 46.02 45.29 1wkt n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wkt n ALA 32 N -0.04 -2.47 -0.80 4.61 0.00 -1.26 -3.62 120.51 116.92 1wkt n ALA 32 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1wkt n ALA 32 Cb 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1wkt n ALA 32 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1wkt n ASN 33 N -0.92 -1.73 -4.55 0.00 3.02 -1.26 -4.88 115.26 104.94 1wkt n ASN 33 Ca 0.03 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.17 1wkt n ASN 33 Cb 0.37 -1.83 -0.03 0.00 -0.61 0.00 0.00 39.78 37.69 1wkt n ASN 33 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wkt s VAL 34 N -1.88 3.70 -0.29 2.41 1.01 -1.24 -4.41 120.40 119.70 1wkt s VAL 34 Ca 0.00 0.35 0.20 0.00 0.00 0.00 0.00 61.98 62.52 1wkt s VAL 34 Cb 0.00 -4.85 0.48 0.00 0.00 0.00 0.00 36.38 32.01 1wkt s VAL 34 CO 0.00 -1.79 1.15 0.00 0.00 0.00 0.00 175.10 174.46 1wkt n HIS 35 N 9.63 0.56 -3.91 5.22 1.44 -1.21 -4.64 115.22 122.31 1wkt n HIS 35 Ca 0.06 -2.23 -0.13 0.00 -2.01 0.00 0.00 57.72 53.41 1wkt n HIS 35 Cb 0.49 0.08 -0.14 0.00 0.12 0.00 0.00 29.99 30.54 1wkt n HIS 35 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1wkt s TRP 36 N -2.88 0.08 -0.11 -1.40 0.52 -1.02 0.02 118.94 114.16 1wkt s TRP 36 Ca 0.24 -0.01 -0.03 0.00 0.02 0.00 0.00 56.10 56.33 1wkt s TRP 36 Cb 0.38 -0.07 -0.03 0.00 -1.15 0.00 0.00 33.47 32.60 1wkt s TRP 36 CO -0.04 -0.01 -0.00 1.41 0.02 0.00 0.00 176.95 178.33 1wkt s MET 37 N 0.06 3.22 -0.15 4.98 1.75 -0.34 -0.48 119.30 128.33 1wkt s MET 37 Ca -0.00 -0.42 -0.00 0.00 -1.25 0.00 0.00 55.69 54.01 1wkt s MET 37 Cb -0.01 -2.86 0.03 0.00 2.84 0.00 0.00 34.83 34.83 1wkt s MET 37 CO -0.00 0.57 -0.08 0.08 -0.65 0.00 0.00 175.02 174.94 1wkt s VAL 38 N -0.51 1.17 0.36 10.11 1.01 -0.16 -0.74 120.40 131.64 1wkt s VAL 38 Ca 0.09 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.55 1wkt s VAL 38 Cb -0.12 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1wkt s VAL 38 CO 0.02 0.26 0.56 0.42 0.00 0.00 0.00 175.10 176.36 1wkt s THR 39 N 1.63 4.88 0.00 3.92 -4.23 0.19 -1.40 115.64 120.63 1wkt s THR 39 Ca 0.03 -0.52 0.09 0.00 -1.18 0.00 0.00 61.69 60.11 1wkt s THR 39 Cb -0.14 -3.78 0.16 0.00 1.34 0.00 0.00 72.50 70.08 1wkt s THR 39 CO -0.08 -0.49 0.98 0.61 -0.54 0.00 0.00 174.62 175.10 1wkt n GLY 40 N -1.81 0.76 1.83 3.99 0.00 0.63 -3.61 105.19 106.98 1wkt n GLY 40 Ca -0.04 -0.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.62 1wkt n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wkt n GLY 41 N 0.18 2.47 7.00 -0.02 0.00 -1.07 -1.38 105.19 112.37 1wkt n GLY 41 Ca -0.04 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1wkt n GLY 41 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wkt n SER 42 N 2.08 0.00 -0.02 1.61 2.88 -1.26 -1.73 113.62 117.17 1wkt n SER 42 Ca 0.19 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.71 1wkt n SER 42 Cb 0.61 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.06 1wkt n SER 42 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1wkt n THR 43 N 0.00 0.50 -1.32 2.46 -2.24 -1.26 -3.77 114.28 108.64 1wkt n THR 43 Ca 0.00 0.40 -0.22 0.00 -2.27 0.00 0.00 64.05 61.96 1wkt n THR 43 Cb 0.00 -1.81 -0.10 0.00 -2.10 0.00 0.00 70.33 66.32 1wkt n THR 43 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1wkt n ASP 44 N -3.09 6.16 -1.03 3.42 5.68 -1.26 -3.90 116.55 122.53 1wkt n ASP 44 Ca -0.03 -2.91 0.05 0.00 -0.50 0.00 0.00 54.79 51.41 1wkt n ASP 44 Cb 0.10 -1.32 0.10 0.00 -1.14 0.00 0.00 41.12 38.86 1wkt n ASP 44 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1wkt n GLY 45 N 1.63 2.82 1.17 6.12 0.00 -0.71 -5.13 105.19 111.09 1wkt n GLY 45 Ca 0.48 -1.01 0.12 0.00 0.00 0.00 0.00 46.02 45.62 1wkt n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wkt n LYS 46 N -0.26 -2.32 -1.93 1.61 5.02 -1.25 -4.80 118.16 114.24 1wkt n LYS 46 Ca 0.11 1.88 -0.39 0.00 -2.02 0.00 0.00 58.31 57.90 1wkt n LYS 46 Cb 0.92 -2.87 0.01 0.00 -0.02 0.00 0.00 35.03 33.07 1wkt n LYS 46 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1wkt s GLN 47 N -4.44 3.71 0.23 1.97 -2.07 -1.26 -3.35 119.66 114.44 1wkt s GLN 47 Ca 0.00 2.24 0.11 0.00 -1.82 0.00 0.00 55.36 55.89 1wkt s GLN 47 Cb 0.00 -2.61 -0.05 0.00 -1.09 0.00 0.00 33.01 29.27 1wkt s GLN 47 CO 0.00 -0.74 -0.14 0.20 -1.32 0.00 0.00 175.29 173.29 1wkt s GLY 48 N -0.73 1.76 0.03 2.60 0.00 -0.09 -4.90 107.32 105.97 1wkt s GLY 48 Ca 0.61 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1wkt s GLY 48 CO 0.50 -1.72 -0.04 0.00 0.00 0.00 0.00 173.10 171.85 1wkt s ALA 50 N -1.77 1.27 -0.24 0.00 0.00 -0.08 -0.34 121.76 120.59 1wkt s ALA 50 Ca -0.12 -0.66 -0.26 0.00 0.00 0.00 0.00 51.96 50.92 1wkt s ALA 50 Cb -0.08 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 1wkt s ALA 50 CO -0.02 0.31 0.88 0.99 0.00 0.00 0.00 175.76 177.92 1wkt s THR 51 N -0.37 4.80 0.07 0.00 2.01 -0.35 -0.59 115.64 121.22 1wkt s THR 51 Ca 0.06 1.66 -0.05 0.00 0.31 0.00 0.00 61.69 63.67 1wkt s THR 51 Cb -0.06 -4.16 -0.05 0.00 0.01 0.00 0.00 72.50 68.24 1wkt s THR 51 CO -0.01 -0.10 0.30 -0.63 -0.69 0.00 0.00 174.62 173.49 1wkt s ILE 52 N 2.93 5.26 0.20 1.82 1.01 0.23 -1.02 121.20 131.63 1wkt s ILE 52 Ca 0.37 0.00 0.08 0.00 0.00 0.00 0.00 60.65 61.11 1wkt s ILE 52 Cb -0.15 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 1wkt s ILE 52 CO 0.07 0.19 -0.16 0.26 0.00 0.00 0.00 174.94 175.29 1wkt s TRP 53 N -1.49 1.81 -0.12 3.97 0.51 0.60 -0.63 118.94 123.60 1wkt s TRP 53 Ca 0.35 -0.51 0.07 0.00 -2.12 0.00 0.00 56.10 53.89 1wkt s TRP 53 Cb -0.13 -0.86 -0.24 0.00 -0.81 0.00 0.00 33.47 31.44 1wkt s TRP 53 CO 0.22 0.39 0.35 -1.91 -0.51 0.00 0.00 176.95 175.49 1wkt n GLU 54 N -0.15 0.68 -2.07 4.98 2.13 0.55 -1.23 120.64 125.52 1wkt n GLU 54 Ca -0.10 0.21 -0.41 0.00 0.66 0.00 0.00 57.16 57.52 1wkt n GLU 54 Cb 0.59 -1.68 -0.02 0.00 0.27 0.00 0.00 31.44 30.60 1wkt n GLU 54 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1wkt s GLY 55 N -5.50 2.84 -1.01 8.31 0.00 0.11 -4.50 107.32 107.57 1wkt s GLY 55 Ca -0.14 1.30 -0.22 0.00 0.00 0.00 0.00 44.72 45.65 1wkt s GLY 55 CO 0.78 2.03 1.92 1.44 0.00 0.00 0.00 173.10 179.27 1wkt n SER 56 N 1.15 2.91 0.00 1.64 7.64 -1.26 -2.96 113.62 122.74 1wkt n SER 56 Ca 0.02 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.20 1wkt n SER 56 Cb 0.41 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 1wkt n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wkt n GLY 57 N 5.19 -1.19 0.00 0.23 0.00 -1.26 -4.97 105.19 103.20 1wkt n GLY 57 Ca 0.47 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.97 1wkt n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wkt s VAL 59 N 0.00 0.97 0.00 0.00 -7.23 -1.26 -4.97 120.40 107.91 1wkt s VAL 59 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1wkt s VAL 59 Cb 0.00 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.54 1wkt s VAL 59 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1wkt n GLY 60 N -1.00 -0.53 3.81 2.32 0.00 -1.26 0.06 105.19 108.60 1wkt n GLY 60 Ca -0.10 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 1wkt n GLY 60 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wkt s ARG 61 N 0.00 3.79 -0.00 1.61 3.52 -1.26 -4.78 118.95 121.83 1wkt s ARG 61 Ca 0.00 1.17 -0.19 0.00 -0.13 0.00 0.00 55.73 56.58 1wkt s ARG 61 Cb 0.00 -2.10 0.04 0.00 -1.56 0.00 0.00 34.95 31.32 1wkt s ARG 61 CO 0.00 -0.41 0.42 -1.54 -0.81 0.00 0.00 175.30 172.95 1wkt s SER 62 N -2.51 -0.32 -0.07 -2.12 1.04 -1.26 -0.33 113.70 108.13 1wkt s SER 62 Ca 0.63 0.19 -0.06 0.00 0.48 0.00 0.00 55.95 57.19 1wkt s SER 62 Cb -0.13 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.40 1wkt s SER 62 CO 0.26 -0.55 0.18 0.28 0.98 0.00 0.00 173.24 174.40 1wkt s THR 63 N -1.65 -0.01 -0.69 2.02 -1.32 0.20 -4.96 115.64 109.23 1wkt s THR 63 Ca -0.10 0.02 -0.24 0.00 -1.21 0.00 0.00 61.69 60.15 1wkt s THR 63 Cb -0.03 -0.27 0.06 0.00 -1.51 0.00 0.00 72.50 70.75 1wkt s THR 63 CO 0.03 0.01 1.09 -0.89 -2.21 0.00 0.00 174.62 172.65 1wkt s THR 64 N 0.24 4.10 -0.17 5.08 2.01 -1.26 -0.60 115.64 125.04 1wkt s THR 64 Ca -0.01 -0.09 -0.22 0.00 0.31 0.00 0.00 61.69 61.69 1wkt s THR 64 Cb -0.03 -4.78 -0.03 0.00 0.01 0.00 0.00 72.50 67.68 1wkt s THR 64 CO -0.01 -1.61 0.65 -0.32 -0.69 0.00 0.00 174.62 172.64 1wkt s MET 65 N 4.69 4.27 -0.07 4.92 1.75 0.25 -4.92 119.30 130.18 1wkt s MET 65 Ca 0.27 0.69 0.00 0.00 -1.25 0.00 0.00 55.69 55.41 1wkt s MET 65 Cb -0.13 -3.55 -0.03 0.00 2.84 0.00 0.00 34.83 33.96 1wkt s MET 65 CO 0.12 -0.18 -0.06 0.00 -0.65 0.00 0.00 175.02 174.25 1wkt n PRO 68 N 3.25 -3.70 -1.93 0.00 -0.02 -1.26 -0.92 135.00 130.42 1wkt n PRO 68 Ca -0.18 -1.19 -0.32 0.00 -2.02 0.00 0.00 63.50 59.79 1wkt n PRO 68 Cb 0.55 -1.72 0.02 0.00 -0.02 0.00 0.00 33.50 32.32 1wkt n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wkt s ALA 69 N -2.09 2.71 -0.91 3.55 0.00 -1.21 -4.44 121.76 119.38 1wkt s ALA 69 Ca 0.55 0.33 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 1wkt s ALA 69 Cb -0.10 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.83 1wkt s ALA 69 CO 0.46 -0.92 0.36 0.09 0.00 0.00 0.00 175.76 175.75 1wkt n ASN 70 N -2.28 -2.01 -3.80 0.00 3.02 -1.25 -4.88 115.26 104.06 1wkt n ASN 70 Ca 0.09 -0.91 -0.09 0.00 -0.03 0.00 0.00 54.58 53.63 1wkt n ASN 70 Cb 0.53 -1.10 -0.04 0.00 -0.61 0.00 0.00 39.78 38.55 1wkt n ASN 70 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1wkt s THR 71 N -3.97 0.02 -0.11 3.41 -1.32 -1.24 -4.96 115.64 107.47 1wkt s THR 71 Ca 0.27 -0.93 -0.09 0.00 -1.21 0.00 0.00 61.69 59.73 1wkt s THR 71 Cb -0.15 -1.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.09 1wkt s THR 71 CO 0.69 -0.11 0.19 0.00 -2.21 0.00 0.00 174.62 173.17 1wkt s ASN 74 N 0.16 6.63 -1.31 0.00 2.47 -1.26 -1.20 114.94 120.43 1wkt s ASN 74 Ca -0.03 0.52 -0.12 0.00 0.42 0.00 0.00 52.86 53.65 1wkt s ASN 74 Cb -0.09 -2.43 0.13 0.00 -1.45 0.00 0.00 41.25 37.42 1wkt s ASN 74 CO 0.01 -0.78 1.86 -0.38 -3.72 0.00 0.00 177.10 174.09 1wkt n ILE 75 N 5.84 4.11 -4.18 -5.21 -0.00 0.10 -4.90 119.36 115.12 1wkt n ILE 75 Ca 0.05 -4.15 -0.28 0.00 -0.00 0.00 0.00 62.75 58.37 1wkt n ILE 75 Cb 0.48 -2.43 -0.08 0.00 -0.00 0.00 0.00 39.64 37.61 1wkt n ILE 75 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.55 176.76 1wkt s ASN 76 N 1.98 4.78 0.00 4.38 3.84 -1.26 -4.68 114.94 123.98 1wkt s ASN 76 Ca 0.43 -0.33 0.00 0.00 0.21 0.00 0.00 52.86 53.17 1wkt s ASN 76 Cb 0.08 -1.04 0.00 0.00 -0.55 0.00 0.00 41.25 39.74 1wkt s ASN 76 CO -0.01 0.13 0.00 0.35 -2.79 0.00 0.00 177.10 174.78 1wkt n THR 77 N 0.23 0.00 0.44 -5.21 -2.24 -1.26 -5.03 114.28 101.21 1wkt n THR 77 Ca -0.11 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.80 1wkt n THR 77 Cb 0.54 0.00 0.47 0.00 -2.10 0.00 0.00 70.33 69.24 1wkt n THR 77 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1wkt h GLY 78 N 0.00 0.00 -2.85 3.38 0.00 -2.02 -3.44 103.07 98.14 1wkt h GLY 78 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1wkt h GLY 78 CO 0.00 0.00 -0.67 -0.11 0.00 0.00 0.00 176.54 175.76 1wkt s PHE 79 N -3.29 1.02 0.19 5.60 -0.12 -1.26 -5.13 117.98 115.00 1wkt s PHE 79 Ca 0.06 -1.04 -0.30 0.00 -0.05 0.00 0.00 56.93 55.60 1wkt s PHE 79 Cb 0.10 -0.59 -0.09 0.00 -0.63 0.00 0.00 43.02 41.81 1wkt s PHE 79 CO 0.48 -0.27 1.33 -0.47 -0.05 0.00 0.00 175.22 176.25 1wkt s TYR 80 N -3.74 3.24 -0.18 3.49 6.14 -1.26 -4.97 117.35 120.06 1wkt s TYR 80 Ca 0.20 1.17 -0.08 0.00 0.64 0.00 0.00 57.07 59.00 1wkt s TYR 80 Cb 0.06 -3.63 -0.04 0.00 0.42 0.00 0.00 41.96 38.77 1wkt s TYR 80 CO 0.00 -2.01 0.07 0.96 0.64 0.00 0.00 175.55 175.21 1wkt s ILE 81 N 0.24 4.84 0.00 3.14 -0.00 -1.26 -4.69 121.20 123.48 1wkt s ILE 81 Ca 0.58 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 61.22 1wkt s ILE 81 Cb -0.37 -3.19 0.00 0.00 -0.00 0.00 0.00 42.46 38.90 1wkt s ILE 81 CO 0.37 0.46 0.00 0.54 -0.00 0.00 0.00 174.94 176.31 1wkt n ARG 82 N 3.55 3.01 -4.04 0.37 1.74 -0.37 -4.90 116.66 116.03 1wkt n ARG 82 Ca -0.16 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.82 1wkt n ARG 82 Cb 0.52 -0.90 -0.06 0.00 -1.02 0.00 0.00 32.46 31.00 1wkt n ARG 82 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wkt s SER 83 N -2.51 -0.04 0.19 0.55 0.01 -0.74 -0.23 113.70 110.94 1wkt s SER 83 Ca 0.00 -1.02 -0.20 0.00 1.31 0.00 0.00 55.95 56.04 1wkt s SER 83 Cb 0.00 0.53 0.04 0.00 0.21 0.00 0.00 66.02 66.81 1wkt s SER 83 CO 0.00 -1.06 0.57 -0.72 0.41 0.00 0.00 173.24 172.44 1wkt s TYR 84 N -4.04 -0.27 -0.09 2.43 -0.85 -0.48 -0.29 117.35 113.75 1wkt s TYR 84 Ca 0.26 -0.04 0.03 0.00 -0.52 0.00 0.00 57.07 56.79 1wkt s TYR 84 Cb 0.01 0.49 0.01 0.00 0.38 0.00 0.00 41.96 42.85 1wkt s TYR 84 CO 0.09 -0.93 -0.16 1.03 -1.52 0.00 0.00 175.55 174.06 1wkt s ARG 85 N -3.83 2.23 0.27 -3.49 0.52 -0.19 -3.51 118.95 110.95 1wkt s ARG 85 Ca 0.06 -0.59 -0.31 0.00 -0.52 0.00 0.00 55.73 54.38 1wkt s ARG 85 Cb -0.02 -1.80 -0.12 0.00 0.52 0.00 0.00 34.95 33.54 1wkt s ARG 85 CO -0.05 0.04 1.59 0.54 0.02 0.00 0.00 175.30 177.44 1wkt n ARG 86 N 3.85 2.60 -0.09 3.54 5.12 -0.85 -1.21 116.66 129.62 1wkt n ARG 86 Ca -0.21 0.93 -0.18 0.00 -1.93 0.00 0.00 57.85 56.46 1wkt n ARG 86 Cb 0.52 -2.70 -0.06 0.00 -1.16 0.00 0.00 32.46 29.06 1wkt n ARG 86 CO 0.00 0.00 0.00 1.55 -1.93 0.00 0.00 177.63 177.25 1wkt n VAL 87 N 2.39 0.99 0.00 1.55 3.14 0.54 -3.51 118.33 123.42 1wkt n VAL 87 Ca 0.10 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.27 1wkt n VAL 87 Cb 0.35 -1.76 0.00 0.00 -1.06 0.00 0.00 33.84 31.38 1wkt n VAL 87 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53