#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wkt n ASP 2 N 0.00 0.00 0.00 1.61 2.03 -1.23 -4.91 116.55 114.05 1wkt n ASP 2 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1wkt n ASP 2 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1wkt n ASP 2 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wkt n GLY 3 N -1.11 -1.36 3.65 0.27 0.00 -1.04 -4.55 105.19 101.05 1wkt n GLY 3 Ca 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.62 -0.18 -0.37 1.61 -0.85 -1.26 -4.71 117.35 108.97 1wkt s TYR 4 Ca 0.00 -0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.52 1wkt s TYR 4 Cb 0.00 0.59 0.13 0.00 0.38 0.00 0.00 41.96 43.06 1wkt s TYR 4 CO 0.00 -0.64 0.20 -1.17 -1.52 0.00 0.00 175.55 172.42 1wkt s LEU 5 N -2.77 1.56 0.25 -3.49 0.20 -1.26 -1.15 118.68 112.02 1wkt s LEU 5 Ca 0.10 -2.21 0.09 0.00 0.69 0.00 0.00 54.13 52.80 1wkt s LEU 5 Cb -0.00 -0.62 -0.04 0.00 -0.43 0.00 0.00 46.19 45.09 1wkt s LEU 5 CO -0.02 -0.32 0.04 0.27 -0.29 0.00 0.00 176.35 176.04 1wkt s ILE 6 N 0.98 3.72 0.37 6.68 -4.36 -1.25 -4.65 121.20 122.69 1wkt s ILE 6 Ca 0.17 -1.73 0.08 0.00 -0.26 0.00 0.00 60.65 58.90 1wkt s ILE 6 Cb -0.23 -2.98 -0.04 0.00 1.25 0.00 0.00 42.46 40.46 1wkt s ILE 6 CO -0.04 -0.34 0.18 -0.04 0.24 0.00 0.00 174.94 174.94 1wkt s MET 7 N -3.62 2.35 0.11 0.37 -1.94 -1.26 -0.95 119.30 114.36 1wkt s MET 7 Ca 0.31 -1.62 -0.13 0.00 -1.71 0.00 0.00 55.69 52.54 1wkt s MET 7 Cb -0.07 -2.14 0.02 0.00 2.01 0.00 0.00 34.83 34.64 1wkt s MET 7 CO 0.21 0.02 0.32 0.00 -0.01 0.00 0.00 175.02 175.56 1wkt h LYS 9 N 2.50 0.91 0.00 0.00 1.79 -1.56 -0.22 116.57 119.99 1wkt h LYS 9 Ca -0.34 -0.45 -0.01 0.00 -2.18 0.00 0.00 60.65 57.67 1wkt h LYS 9 Cb 1.23 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1wkt h LYS 9 CO 0.50 1.11 -0.01 0.27 -1.08 0.00 0.00 179.45 180.24 1wkt n ASN 10 N -4.07 0.09 0.00 0.86 6.94 -1.26 -4.35 115.26 113.47 1wkt n ASN 10 Ca -0.01 -1.04 0.08 0.00 -0.02 0.00 0.00 54.58 53.59 1wkt n ASN 10 Cb 0.52 0.03 0.49 0.00 -2.36 0.00 0.00 39.78 38.46 1wkt n ASN 10 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wkt s ASP 12 N -1.71 5.62 0.52 0.00 -1.08 -1.26 -4.94 116.67 113.82 1wkt s ASP 12 Ca 0.25 -1.56 0.29 0.00 -0.52 0.00 0.00 52.55 51.01 1wkt s ASP 12 Cb 0.11 -1.98 1.43 0.00 -1.46 0.00 0.00 42.92 41.03 1wkt s ASP 12 CO 0.19 -0.55 2.04 1.55 0.52 0.00 0.00 175.17 178.92 1wkt h PRO 13 N 8.39 0.00 0.18 4.34 0.13 -1.97 0.77 132.00 143.84 1wkt h PRO 13 Ca -0.22 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.90 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 0.76 0.11 -0.08 -0.97 -0.23 0.00 0.00 178.00 177.59 1wkt h ASN 14 N 0.00 -0.20 0.00 1.44 -0.00 -1.99 -3.42 115.58 111.41 1wkt h ASN 14 Ca -0.00 -0.26 0.00 0.00 -0.00 0.00 0.00 56.30 56.04 1wkt h ASN 14 Cb 0.41 0.05 0.00 0.00 -0.00 0.00 0.00 38.32 38.78 1wkt h ASN 14 CO 0.01 0.35 -0.12 1.07 -0.00 0.00 0.00 177.43 178.75 1wkt n THR 15 N -4.92 0.48 -0.06 -3.57 5.66 -1.24 -4.70 114.28 105.93 1wkt n THR 15 Ca -0.06 -0.53 -0.13 0.00 -3.05 0.00 0.00 64.05 60.27 1wkt n THR 15 Cb 0.23 0.59 -0.06 0.00 -1.55 0.00 0.00 70.33 69.54 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 0.43 -1.14 1.09 0.00 -1.08 -3.50 103.07 98.87 1wkt h GLY 16 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1wkt h GLY 16 CO 0.00 0.38 -0.16 -1.26 0.00 0.00 0.00 176.54 175.51 1wkt n SER 17 N -4.54 -3.17 -3.95 0.19 2.88 -1.26 -4.51 113.62 99.27 1wkt n SER 17 Ca -0.06 0.22 -0.15 0.00 -1.33 0.00 0.00 58.87 57.55 1wkt n SER 17 Cb 0.36 -0.88 -0.14 0.00 -0.75 0.00 0.00 64.21 62.79 1wkt n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wkt s ASP 19 N -0.12 6.26 -0.58 0.00 -4.77 0.36 -4.84 116.67 112.98 1wkt s ASP 19 Ca 0.02 -0.88 -0.07 0.00 -3.30 0.00 0.00 52.55 48.32 1wkt s ASP 19 Cb -0.02 -2.51 -0.14 0.00 -1.09 0.00 0.00 42.92 39.16 1wkt s ASP 19 CO -0.00 -1.62 3.22 0.79 0.70 0.00 0.00 175.17 178.25 1wkt n TRP 20 N 8.66 1.07 -2.65 2.11 7.02 -1.26 -4.39 117.44 128.00 1wkt n TRP 20 Ca 0.08 -2.07 -0.30 0.00 -1.02 0.00 0.00 57.50 54.19 1wkt n TRP 20 Cb 0.48 -1.80 -0.02 0.00 -2.42 0.00 0.00 31.31 27.56 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 0.62 3.74 0.26 -0.99 -0.14 -1.26 -5.10 119.74 116.87 1wkt s LYS 21 Ca 0.65 0.51 -0.23 0.00 -1.36 0.00 0.00 55.97 55.55 1wkt s LYS 21 Cb 0.29 -2.32 -0.09 0.00 -1.68 0.00 0.00 37.83 34.03 1wkt s LYS 21 CO -0.06 -0.15 0.82 -1.14 -0.76 0.00 0.00 175.35 174.06 1wkt s GLN 22 N -4.18 4.42 -0.28 1.68 -0.44 -1.26 -4.86 119.66 114.74 1wkt s GLN 22 Ca 0.52 1.09 0.21 0.00 -2.50 0.00 0.00 55.36 54.68 1wkt s GLN 22 Cb -0.10 -2.87 0.49 0.00 -1.64 0.00 0.00 33.01 28.88 1wkt s GLN 22 CO 0.36 0.36 1.16 0.09 0.50 0.00 0.00 175.29 177.76 1wkt n ASN 23 N 0.72 1.07 -4.11 6.67 3.02 -1.26 -5.06 115.26 116.31 1wkt n ASN 23 Ca -0.01 -2.11 -0.28 0.00 -0.03 0.00 0.00 54.58 52.15 1wkt n ASN 23 Cb 0.50 -0.29 -0.17 0.00 -0.61 0.00 0.00 39.78 39.21 1wkt n ASN 23 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1wkt s TRP 24 N -3.13 1.92 -1.22 3.10 -0.11 -1.26 -4.10 118.94 114.13 1wkt s TRP 24 Ca 0.24 -0.74 -0.11 0.00 1.22 0.00 0.00 56.10 56.72 1wkt s TRP 24 Cb 0.35 -1.33 -0.01 0.00 -1.50 0.00 0.00 33.47 30.98 1wkt s TRP 24 CO -0.05 -0.32 0.70 -1.71 -4.62 0.00 0.00 176.95 170.95 1wkt n ASN 25 N 3.64 -3.46 -3.56 5.86 5.15 -1.26 -5.00 115.26 116.64 1wkt n ASN 25 Ca -0.21 -0.95 -0.16 0.00 -0.60 0.00 0.00 54.58 52.65 1wkt n ASN 25 Cb 0.52 -3.59 -0.06 0.00 -0.53 0.00 0.00 39.78 36.12 1wkt n ASN 25 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1wkt s THR 26 N -3.61 0.00 -1.40 -0.44 -1.32 -1.26 -5.08 115.64 102.53 1wkt s THR 26 Ca 0.27 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.60 1wkt s THR 26 Cb -0.09 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.94 1wkt s THR 26 CO 0.85 0.00 2.13 0.00 -2.21 0.00 0.00 174.62 175.39 1wkt s VAL 28 N 3.51 4.43 0.25 0.00 1.01 -0.35 -4.86 120.40 124.40 1wkt s VAL 28 Ca 0.49 1.69 -0.30 0.00 0.00 0.00 0.00 61.98 63.86 1wkt s VAL 28 Cb 0.12 -4.13 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 1wkt s VAL 28 CO -0.05 0.50 1.07 -0.83 0.00 0.00 0.00 175.10 175.79 1wkt s GLY 29 N -0.96 3.04 0.39 4.51 0.00 -1.26 -0.57 107.32 112.47 1wkt s GLY 29 Ca 0.36 0.83 0.05 0.00 0.00 0.00 0.00 44.72 45.97 1wkt s GLY 29 CO 0.26 1.47 0.55 -0.42 0.00 0.00 0.00 173.10 174.95 1wkt s ILE 30 N -1.01 3.78 0.00 0.90 -1.09 0.19 -4.83 121.20 119.13 1wkt s ILE 30 Ca 0.45 -0.88 0.00 0.00 -2.23 0.00 0.00 60.65 57.99 1wkt s ILE 30 Cb -0.30 -3.33 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 1wkt s ILE 30 CO 0.38 -0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.55 1wkt n GLY 31 N -1.81 0.72 2.63 6.18 0.00 -1.26 -4.64 105.19 107.00 1wkt n GLY 31 Ca 0.02 -1.91 -0.05 0.00 0.00 0.00 0.00 46.02 44.09 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 1.16 -3.29 -1.03 4.61 0.00 -1.26 -4.26 120.51 116.43 1wkt n ALA 32 Ca 0.00 2.06 -0.01 0.00 0.00 0.00 0.00 53.44 55.49 1wkt n ALA 32 Cb 0.00 -4.13 -0.01 0.00 0.00 0.00 0.00 19.45 15.32 1wkt n ALA 32 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1wkt n ASN 33 N 1.83 -5.46 -3.72 0.00 6.94 -1.26 -4.92 115.26 108.67 1wkt n ASN 33 Ca -0.35 0.03 -0.26 0.00 -0.02 0.00 0.00 54.58 53.98 1wkt n ASN 33 Cb 0.55 -3.06 -0.17 0.00 -2.36 0.00 0.00 39.78 34.73 1wkt n ASN 33 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1wkt s VAL 34 N -1.27 0.33 0.00 3.53 1.01 -1.26 -3.60 120.40 119.14 1wkt s VAL 34 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1wkt s VAL 34 Cb 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1wkt s VAL 34 CO 0.00 -0.08 0.74 0.00 0.00 0.00 0.00 175.10 175.75 1wkt n HIS 35 N 5.13 0.00 -3.67 5.22 1.44 -0.36 -4.02 115.22 118.96 1wkt n HIS 35 Ca -0.08 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.39 1wkt n HIS 35 Cb 0.48 0.05 -0.17 0.00 0.12 0.00 0.00 29.99 30.47 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 0.00 0.38 -0.15 -1.40 0.52 -0.24 -0.64 118.94 117.41 1wkt s TRP 36 Ca 0.00 -0.24 -0.24 0.00 0.02 0.00 0.00 56.10 55.64 1wkt s TRP 36 Cb 0.00 -0.71 -0.02 0.00 -1.15 0.00 0.00 33.47 31.59 1wkt s TRP 36 CO 0.00 -0.42 0.78 1.41 0.02 0.00 0.00 176.95 178.74 1wkt s MET 37 N 2.07 4.31 -0.41 4.98 1.75 0.18 0.32 119.30 132.50 1wkt s MET 37 Ca 0.03 0.94 0.03 0.00 -1.25 0.00 0.00 55.69 55.44 1wkt s MET 37 Cb -0.15 -3.55 0.12 0.00 2.84 0.00 0.00 34.83 34.09 1wkt s MET 37 CO -0.07 -0.25 0.16 0.08 -0.65 0.00 0.00 175.02 174.30 1wkt s VAL 38 N 1.87 2.03 -0.17 10.11 1.01 -0.13 -0.36 120.40 134.76 1wkt s VAL 38 Ca 0.37 -2.58 -0.16 0.00 0.00 0.00 0.00 61.98 59.61 1wkt s VAL 38 Cb -0.17 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1wkt s VAL 38 CO 0.13 -0.73 0.40 0.28 0.00 0.00 0.00 175.10 175.18 1wkt s THR 39 N 0.50 5.22 -0.01 3.92 -1.32 -0.85 -3.86 115.64 119.25 1wkt s THR 39 Ca 0.14 0.75 -0.22 0.00 -1.21 0.00 0.00 61.69 61.15 1wkt s THR 39 Cb -0.22 -3.74 -0.12 0.00 -1.51 0.00 0.00 72.50 66.91 1wkt s THR 39 CO -0.06 0.30 0.91 1.23 -2.21 0.00 0.00 174.62 174.79 1wkt h GLY 40 N 7.21 -0.82 -3.26 6.08 0.00 -1.43 -1.53 103.07 109.32 1wkt h GLY 40 Ca -0.38 0.30 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 1wkt h GLY 40 CO 0.74 -0.30 -0.16 0.61 0.00 0.00 0.00 176.54 177.43 1wkt n GLY 41 N -0.22 -0.03 3.76 4.60 0.00 -0.72 0.68 105.19 113.26 1wkt n GLY 41 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1wkt n GLY 41 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wkt s SER 42 N -1.84 4.82 0.00 1.61 0.01 -1.26 -1.74 113.70 115.29 1wkt s SER 42 Ca 0.00 2.04 0.00 0.00 1.31 0.00 0.00 55.95 59.30 1wkt s SER 42 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1wkt s SER 42 CO 0.00 -1.83 0.00 0.41 0.41 0.00 0.00 173.24 172.23 1wkt n THR 43 N -2.65 0.00 -4.11 1.44 -1.04 -1.26 -2.50 114.28 104.16 1wkt n THR 43 Ca 0.11 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.77 1wkt n THR 43 Cb 0.52 -0.10 -0.14 0.00 -1.82 0.00 0.00 70.33 68.79 1wkt n THR 43 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1wkt s ASP 44 N -2.95 4.31 0.18 8.00 1.11 -0.71 -4.97 116.67 121.63 1wkt s ASP 44 Ca 0.00 -0.35 0.08 0.00 0.18 0.00 0.00 52.55 52.46 1wkt s ASP 44 Cb 0.00 -1.72 0.02 0.00 1.07 0.00 0.00 42.92 42.29 1wkt s ASP 44 CO 0.00 0.03 1.41 1.23 1.18 0.00 0.00 175.17 179.03 1wkt h GLY 45 N 7.72 0.00 -4.16 0.21 0.00 -1.93 -3.44 103.07 101.46 1wkt h GLY 45 Ca -0.38 -0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.42 1wkt h GLY 45 CO 0.60 0.00 0.77 -1.59 0.00 0.00 0.00 176.54 176.32 1wkt s LYS 46 N -3.08 4.23 0.34 4.80 -2.85 -1.26 -4.47 119.74 117.46 1wkt s LYS 46 Ca 0.00 2.38 -0.24 0.00 -1.00 0.00 0.00 55.97 57.11 1wkt s LYS 46 Cb 0.11 -3.07 -0.15 0.00 -2.06 0.00 0.00 37.83 32.67 1wkt s LYS 46 CO 0.80 -0.44 0.53 0.00 0.10 0.00 0.00 175.35 176.33 1wkt n GLN 47 N 1.82 0.44 -3.55 1.78 10.64 -1.26 -4.27 117.38 122.96 1wkt n GLN 47 Ca 0.05 0.16 -0.35 0.00 -1.83 0.00 0.00 57.00 55.03 1wkt n GLN 47 Cb 0.40 -1.33 -0.06 0.00 -0.86 0.00 0.00 30.24 28.39 1wkt n GLN 47 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 1wkt s GLY 48 N -0.91 2.37 0.03 2.61 0.00 -0.08 -4.89 107.32 106.45 1wkt s GLY 48 Ca 0.62 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.01 1wkt s GLY 48 CO 0.59 -0.08 -0.04 0.00 0.00 0.00 0.00 173.10 173.56 1wkt s ALA 50 N -1.98 -0.03 0.07 0.00 0.00 -0.33 -0.72 121.76 118.76 1wkt s ALA 50 Ca -0.09 0.01 -0.26 0.00 0.00 0.00 0.00 51.96 51.62 1wkt s ALA 50 Cb -0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 1wkt s ALA 50 CO -0.02 -0.01 0.80 0.99 0.00 0.00 0.00 175.76 177.51 1wkt s THR 51 N -0.07 4.65 0.15 0.00 2.01 -0.35 -0.80 115.64 121.23 1wkt s THR 51 Ca -0.01 1.71 0.10 0.00 0.31 0.00 0.00 61.69 63.80 1wkt s THR 51 Cb -0.01 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1wkt s THR 51 CO -0.00 0.37 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.45 1wkt s ILE 52 N -0.17 2.01 0.03 1.82 1.01 -0.43 -0.98 121.20 124.49 1wkt s ILE 52 Ca 0.40 -1.83 -0.00 0.00 0.00 0.00 0.00 60.65 59.22 1wkt s ILE 52 Cb -0.21 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 1wkt s ILE 52 CO 0.24 -0.13 -0.03 0.26 0.00 0.00 0.00 174.94 175.29 1wkt s TRP 53 N -1.55 0.36 -0.01 3.97 0.51 0.39 -0.75 118.94 121.85 1wkt s TRP 53 Ca 0.14 -0.69 -0.13 0.00 -2.12 0.00 0.00 56.10 53.31 1wkt s TRP 53 Cb -0.08 -0.26 -0.33 0.00 -0.81 0.00 0.00 33.47 31.99 1wkt s TRP 53 CO 0.07 -0.24 0.83 1.49 -0.51 0.00 0.00 176.95 178.59 1wkt h GLU 54 N 4.19 0.46 -6.49 4.98 4.57 -0.88 -1.69 114.58 119.72 1wkt h GLU 54 Ca -0.33 -0.79 -0.53 0.00 -1.18 0.00 0.00 59.36 56.53 1wkt h GLU 54 Cb 1.19 0.29 0.03 0.00 -0.16 0.00 0.00 28.75 30.11 1wkt h GLU 54 CO 0.48 1.38 1.08 0.20 -1.18 0.00 0.00 179.01 180.97 1wkt s GLY 55 N -4.87 1.41 -0.40 1.92 0.00 0.71 -4.56 107.32 101.52 1wkt s GLY 55 Ca -0.12 1.38 -0.28 0.00 0.00 0.00 0.00 44.72 45.69 1wkt s GLY 55 CO 0.90 3.07 1.85 -0.56 0.00 0.00 0.00 173.10 178.37 1wkt s SER 56 N 2.64 5.66 0.00 1.64 0.01 -1.26 -1.86 113.70 120.54 1wkt s SER 56 Ca 0.79 1.09 0.00 0.00 1.31 0.00 0.00 55.95 59.14 1wkt s SER 56 Cb -0.44 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.26 1wkt s SER 56 CO 0.35 -1.93 0.00 0.61 0.41 0.00 0.00 173.24 172.68 1wkt n GLY 57 N 5.52 0.90 4.14 3.44 0.00 -1.26 -4.81 105.19 113.12 1wkt n GLY 57 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.86 0.92 0.00 0.00 -7.23 -1.24 -5.01 120.40 103.98 1wkt s VAL 59 Ca 0.23 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1wkt s VAL 59 Cb -0.13 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.42 1wkt s VAL 59 CO 0.93 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 176.33 1wkt n GLY 60 N -0.99 -1.41 3.78 2.32 0.00 -1.26 -0.21 105.19 107.41 1wkt n GLY 60 Ca -0.09 -1.74 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 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 3.32 0.24 1.61 3.52 -1.26 -4.79 118.95 121.59 1wkt s ARG 61 Ca 0.00 1.56 -0.00 0.00 -0.13 0.00 0.00 55.73 57.15 1wkt s ARG 61 Cb 0.00 -2.01 -0.03 0.00 -1.56 0.00 0.00 34.95 31.35 1wkt s ARG 61 CO 0.00 -0.87 0.22 -1.54 -0.81 0.00 0.00 175.30 172.30 1wkt s SER 62 N -1.91 0.51 0.19 -2.12 1.04 -1.26 -0.42 113.70 109.74 1wkt s SER 62 Ca 0.71 -1.43 0.02 0.00 0.48 0.00 0.00 55.95 55.73 1wkt s SER 62 Cb -0.23 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 1wkt s SER 62 CO 0.28 -0.95 0.21 1.07 0.98 0.00 0.00 173.24 174.84 1wkt n THR 63 N -0.38 0.00 -4.11 2.02 5.66 0.07 -4.94 114.28 112.59 1wkt n THR 63 Ca 0.03 -1.19 -0.27 0.00 -3.05 0.00 0.00 64.05 59.57 1wkt n THR 63 Cb 0.64 0.65 -0.17 0.00 -1.55 0.00 0.00 70.33 69.91 1wkt n THR 63 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1wkt s THR 64 N -2.70 1.20 -0.18 1.09 -1.32 -1.26 -1.31 115.64 111.15 1wkt s THR 64 Ca 0.19 -0.43 0.01 0.00 -1.21 0.00 0.00 61.69 60.26 1wkt s THR 64 Cb 0.00 -1.16 0.03 0.00 -1.51 0.00 0.00 72.50 69.86 1wkt s THR 64 CO 0.14 0.39 -0.17 -0.32 -2.21 0.00 0.00 174.62 172.45 1wkt s MET 65 N 1.40 2.65 0.06 7.08 1.75 0.02 -4.98 119.30 127.27 1wkt s MET 65 Ca 0.00 -0.80 0.06 0.00 -1.25 0.00 0.00 55.69 53.70 1wkt s MET 65 Cb -0.13 -2.45 -0.04 0.00 2.84 0.00 0.00 34.83 35.05 1wkt s MET 65 CO -0.06 -0.27 -0.13 0.00 -0.65 0.00 0.00 175.02 173.92 1wkt n PRO 68 N 5.02 0.47 -2.42 0.00 -0.02 -1.26 -0.91 135.00 135.88 1wkt n PRO 68 Ca -0.09 0.19 -0.38 0.00 -2.02 0.00 0.00 63.50 61.20 1wkt n PRO 68 Cb 0.50 -1.78 -0.03 0.00 -0.02 0.00 0.00 33.50 32.16 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 -1.76 3.20 -1.04 3.55 0.00 -1.26 -3.32 121.76 121.13 1wkt s ALA 69 Ca 0.68 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 53.39 1wkt s ALA 69 Cb -0.41 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 1wkt s ALA 69 CO 0.55 -0.33 0.83 0.09 0.00 0.00 0.00 175.76 176.90 1wkt n ASN 70 N 0.33 -6.16 -3.62 0.00 3.02 0.21 -4.96 115.26 104.08 1wkt n ASN 70 Ca 0.03 -0.78 -0.12 0.00 -0.03 0.00 0.00 54.58 53.69 1wkt n ASN 70 Cb 0.47 -4.29 -0.05 0.00 -0.61 0.00 0.00 39.78 35.30 1wkt n ASN 70 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1wkt s THR 71 N -3.36 0.05 -0.21 3.41 2.01 -0.94 -5.02 115.64 111.58 1wkt s THR 71 Ca 0.39 -0.44 -0.06 0.00 0.31 0.00 0.00 61.69 61.89 1wkt s THR 71 Cb -0.10 -1.05 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 1wkt s THR 71 CO 0.80 -0.24 0.04 0.00 -0.69 0.00 0.00 174.62 174.53 1wkt s ASN 74 N 1.63 6.90 -0.42 0.00 3.04 -1.26 -0.65 114.94 124.17 1wkt s ASN 74 Ca -0.00 2.13 -0.25 0.00 0.04 0.00 0.00 52.86 54.78 1wkt s ASN 74 Cb -0.16 -2.57 0.02 0.00 -1.54 0.00 0.00 41.25 37.00 1wkt s ASN 74 CO -0.07 -0.65 0.87 -0.63 -3.04 0.00 0.00 177.10 173.58 1wkt s ILE 75 N 1.82 4.57 -0.30 -5.21 1.09 0.19 -4.91 121.20 118.45 1wkt s ILE 75 Ca 0.63 0.79 0.02 0.00 -1.10 0.00 0.00 60.65 60.99 1wkt s ILE 75 Cb -0.32 -4.35 0.19 0.00 -1.06 0.00 0.00 42.46 36.92 1wkt s ILE 75 CO 0.28 -0.69 0.71 0.20 -0.10 0.00 0.00 174.94 175.33 1wkt s ASN 76 N 2.10 -1.33 0.00 3.58 0.01 -1.26 -4.80 114.94 113.24 1wkt s ASN 76 Ca 0.35 0.06 0.00 0.00 -0.71 0.00 0.00 52.86 52.56 1wkt s ASN 76 Cb -0.11 1.82 0.00 0.00 0.41 0.00 0.00 41.25 43.36 1wkt s ASN 76 CO 0.23 -0.23 0.00 0.35 -1.51 0.00 0.00 177.10 175.93 1wkt n THR 77 N 5.21 0.00 1.71 1.60 -2.24 -1.26 -4.90 114.28 114.39 1wkt n THR 77 Ca 0.07 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.99 1wkt n THR 77 Cb 0.55 -1.08 0.84 0.00 -2.10 0.00 0.00 70.33 68.54 1wkt n THR 77 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wkt n GLY 78 N 3.59 -1.05 3.26 3.38 0.00 -1.26 -4.90 105.19 108.21 1wkt n GLY 78 Ca 0.00 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 1wkt n GLY 78 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1wkt s PHE 79 N -2.20 1.39 0.09 1.61 -0.71 -1.26 -5.13 117.98 111.77 1wkt s PHE 79 Ca 0.39 -1.48 -0.30 0.00 -1.04 0.00 0.00 56.93 54.50 1wkt s PHE 79 Cb 0.20 -0.59 -0.05 0.00 -1.21 0.00 0.00 43.02 41.37 1wkt s PHE 79 CO 0.38 -0.77 0.97 -0.47 -1.34 0.00 0.00 175.22 174.00 1wkt s TYR 80 N -3.81 3.77 -0.12 3.49 5.04 -1.26 -4.95 117.35 119.51 1wkt s TYR 80 Ca 0.39 1.77 -0.13 0.00 -2.44 0.00 0.00 57.07 56.65 1wkt s TYR 80 Cb 0.05 -3.08 -0.05 0.00 0.35 0.00 0.00 41.96 39.23 1wkt s TYR 80 CO 0.19 0.12 0.30 0.96 -1.34 0.00 0.00 175.55 175.78 1wkt s ILE 81 N 0.21 5.27 0.00 3.14 -0.00 -1.26 -4.66 121.20 123.91 1wkt s ILE 81 Ca 0.48 0.58 0.00 0.00 -0.00 0.00 0.00 60.65 61.71 1wkt s ILE 81 Cb -0.23 -3.63 0.00 0.00 -0.00 0.00 0.00 42.46 38.60 1wkt s ILE 81 CO 0.30 0.45 0.00 0.54 -0.00 0.00 0.00 174.94 176.23 1wkt n ARG 82 N 3.03 1.02 -4.07 0.37 1.74 -0.73 -4.18 116.66 113.84 1wkt n ARG 82 Ca -0.13 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.86 1wkt n ARG 82 Cb 0.52 -0.84 -0.09 0.00 -1.02 0.00 0.00 32.46 31.03 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 -3.21 0.30 0.23 0.55 0.01 -0.72 -0.64 113.70 110.23 1wkt s SER 83 Ca 0.00 -1.04 -0.12 0.00 1.31 0.00 0.00 55.95 56.10 1wkt s SER 83 Cb 0.00 0.29 -0.00 0.00 0.21 0.00 0.00 66.02 66.52 1wkt s SER 83 CO 0.00 -0.72 0.45 -0.72 0.41 0.00 0.00 173.24 172.66 1wkt s TYR 84 N -3.98 0.37 -0.25 2.43 1.13 0.26 -0.46 117.35 116.85 1wkt s TYR 84 Ca 0.16 -0.72 -0.12 0.00 -1.41 0.00 0.00 57.07 54.98 1wkt s TYR 84 Cb 0.07 0.15 0.09 0.00 -1.10 0.00 0.00 41.96 41.16 1wkt s TYR 84 CO -0.03 -0.95 0.58 0.50 -2.51 0.00 0.00 175.55 173.14 1wkt s ARG 85 N -4.01 0.55 0.39 -3.49 3.00 -0.16 -1.21 118.95 114.03 1wkt s ARG 85 Ca 0.22 1.17 -0.26 0.00 -1.00 0.00 0.00 55.73 55.86 1wkt s ARG 85 Cb 0.00 0.32 -0.11 0.00 0.00 0.00 0.00 34.95 35.16 1wkt s ARG 85 CO 0.08 -0.18 1.22 0.54 0.00 0.00 0.00 175.30 176.95 1wkt n ARG 86 N 4.75 1.85 -0.10 5.12 1.74 -1.26 -1.22 116.66 127.55 1wkt n ARG 86 Ca -0.17 0.66 -0.22 0.00 -0.77 0.00 0.00 57.85 57.34 1wkt n ARG 86 Cb 0.54 -2.28 -0.12 0.00 -1.02 0.00 0.00 32.46 29.58 1wkt n ARG 86 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1wkt n VAL 87 N -0.09 1.56 -1.34 1.55 0.24 0.10 -4.24 118.33 116.11 1wkt n VAL 87 Ca 0.07 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 1wkt n VAL 87 Cb 0.38 -1.67 0.00 0.00 -1.47 0.00 0.00 33.84 31.08 1wkt n VAL 87 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90