#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyk n ILE 2 N 0.00 0.00 0.04 0.00 2.08 -1.26 -4.63 119.36 115.59 3hyk n ILE 2 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 3hyk n ILE 2 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 38.82 3hyk n ILE 2 CO 0.00 0.00 0.00 -0.37 0.56 0.00 0.00 176.55 176.74 3hyk h VAL 3 N 0.00 0.51 0.00 1.39 -1.51 -1.06 -3.47 116.25 112.11 3hyk h VAL 3 Ca 0.00 -1.99 0.00 0.00 -1.23 0.00 0.00 66.70 63.48 3hyk h VAL 3 Cb 0.00 2.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.21 3hyk h VAL 3 CO 0.00 0.29 0.00 0.61 -1.23 0.00 0.00 177.57 177.24 3hyk n GLY 4 N 1.38 1.27 3.28 5.19 0.00 -1.22 -4.96 105.19 110.13 3hyk n GLY 4 Ca -0.08 -0.77 -0.17 0.00 0.00 0.00 0.00 46.02 45.00 3hyk n GLY 4 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hyk s ILE 5 N -2.00 1.43 -0.14 -0.61 -4.36 -1.26 -0.73 121.20 113.53 3hyk s ILE 5 Ca 0.00 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.26 3hyk s ILE 5 Cb 0.00 -1.81 0.04 0.00 1.25 0.00 0.00 42.46 41.94 3hyk s ILE 5 CO 0.00 -0.58 0.38 -0.83 0.24 0.00 0.00 174.94 174.15 3hyk s GLY 6 N -2.97 -0.28 0.04 6.27 0.00 0.61 -3.23 107.32 107.75 3hyk s GLY 6 Ca 0.16 1.08 0.04 0.00 0.00 0.00 0.00 44.72 46.00 3hyk s GLY 6 CO 0.04 0.95 -0.12 -1.50 0.00 0.00 0.00 173.10 172.47 3hyk s ILE 7 N 0.26 0.92 -0.09 0.90 1.10 -1.26 0.05 121.20 123.08 3hyk s ILE 7 Ca -0.00 -0.94 -0.07 0.00 -0.51 0.00 0.00 60.65 59.13 3hyk s ILE 7 Cb -0.03 -0.86 0.03 0.00 0.15 0.00 0.00 42.46 41.75 3hyk s ILE 7 CO -0.00 -0.07 0.22 -0.62 -2.11 0.00 0.00 174.94 172.37 3hyk s ASP 8 N -1.13 -0.23 -0.08 4.50 2.15 -0.12 -4.71 116.67 117.04 3hyk s ASP 8 Ca -0.01 0.46 0.04 0.00 0.43 0.00 0.00 52.55 53.47 3hyk s ASP 8 Cb -0.08 0.42 0.00 0.00 -0.30 0.00 0.00 42.92 42.97 3hyk s ASP 8 CO 0.01 -0.11 -0.21 -0.51 -0.17 0.00 0.00 175.17 174.18 3hyk s ILE 9 N 0.54 1.79 -0.03 4.11 2.07 -1.26 -1.86 121.20 126.56 3hyk s ILE 9 Ca -0.03 -0.88 0.01 0.00 -1.41 0.00 0.00 60.65 58.33 3hyk s ILE 9 Cb -0.05 -1.56 0.02 0.00 0.13 0.00 0.00 42.46 41.01 3hyk s ILE 9 CO -0.03 0.50 -0.03 -0.51 -1.91 0.00 0.00 174.94 172.96 3hyk s ILE 10 N 0.29 0.41 -0.01 2.00 -1.16 -0.44 -5.00 121.20 117.30 3hyk s ILE 10 Ca -0.14 -0.08 -0.30 0.00 -0.51 0.00 0.00 60.65 59.62 3hyk s ILE 10 Cb -0.16 -0.44 -0.05 0.00 0.61 0.00 0.00 42.46 42.42 3hyk s ILE 10 CO 0.06 0.18 1.34 -0.70 -2.81 0.00 0.00 174.94 173.01 3hyk s GLU 11 N 0.77 4.31 0.20 3.50 2.12 -1.26 -1.58 118.70 126.76 3hyk s GLU 11 Ca -0.09 1.88 -0.09 0.00 0.36 0.00 0.00 54.97 57.03 3hyk s GLU 11 Cb -0.12 -3.55 0.13 0.00 0.26 0.00 0.00 34.13 30.85 3hyk s GLU 11 CO -0.00 -0.52 1.76 -0.07 -0.54 0.00 0.00 175.26 175.89 3hyk h LEU 12 N 8.19 1.01 -1.75 2.70 3.38 -1.51 -2.57 115.31 124.75 3hyk h LEU 12 Ca -0.37 -0.17 0.12 0.00 0.09 0.00 0.00 57.88 57.55 3hyk h LEU 12 Cb 1.18 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 3hyk h LEU 12 CO 0.89 0.90 0.40 -1.13 0.09 0.00 0.00 178.44 179.60 3hyk h ASN 13 N 1.05 0.24 -0.31 -0.43 -0.00 -1.91 -0.14 115.58 114.08 3hyk h ASN 13 Ca 0.24 0.01 -0.10 0.00 -0.00 0.00 0.00 56.30 56.45 3hyk h ASN 13 Cb 0.21 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.48 3hyk h ASN 13 CO -0.02 0.14 -0.21 -0.09 -0.00 0.00 0.00 177.43 177.25 3hyk h ARG 14 N 0.26 0.68 -0.42 6.67 2.43 -1.85 -1.36 114.38 120.80 3hyk h ARG 14 Ca 0.28 -0.32 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 3hyk h ARG 14 Cb 0.75 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 3hyk h ARG 14 CO -0.06 0.93 -0.19 0.82 -1.51 0.00 0.00 179.97 179.96 3hyk h ILE 15 N 0.44 1.28 -0.57 1.20 1.08 -1.24 -3.02 117.51 116.67 3hyk h ILE 15 Ca 0.06 -1.33 0.09 0.00 -0.39 0.00 0.00 64.86 63.29 3hyk h ILE 15 Cb 0.75 1.24 -0.07 0.00 -3.07 0.00 0.00 36.82 35.68 3hyk h ILE 15 CO 0.06 0.45 0.20 -0.08 -0.69 0.00 0.00 178.15 178.09 3hyk h GLU 16 N 0.69 0.36 -1.87 2.37 4.81 -0.94 -0.30 114.58 119.71 3hyk h GLU 16 Ca 0.10 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3hyk h GLU 16 Cb 0.75 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3hyk h GLU 16 CO 0.06 0.24 0.00 1.63 -0.73 0.00 0.00 179.01 180.21 3hyk n LYS 17 N -5.01 0.16 0.00 1.92 5.02 -0.52 -2.16 118.16 117.57 3hyk n LYS 17 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 3hyk n LYS 17 Cb 0.25 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 3hyk n LYS 17 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hyk n LEU 19 N 1.10 0.00 -3.45 -0.35 4.77 -0.12 -5.11 117.00 113.84 3hyk n LEU 19 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 3hyk n LEU 19 Cb 0.08 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 3hyk n LEU 19 CO 0.00 0.00 3.06 0.47 -1.33 0.00 0.00 177.39 179.59 3hyk n ASP 20 N 0.00 6.71 0.00 -1.43 8.00 -0.92 -4.88 116.55 124.03 3hyk n ASP 20 Ca 0.00 -2.64 0.00 0.00 0.71 0.00 0.00 54.79 52.86 3hyk n ASP 20 Cb 0.00 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 39.56 3hyk n ASP 20 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3hyk n LYS 24 N 4.56 0.00 0.00 -1.24 3.00 -1.26 -5.15 118.16 118.07 3hyk n LYS 24 Ca 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.98 3hyk n LYS 24 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.31 3hyk n LYS 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3hyk n PHE 25 N 0.00 0.00 0.00 5.64 7.35 -1.26 -2.23 117.46 126.96 3hyk n PHE 25 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3hyk n PHE 25 Cb 0.00 -0.02 0.00 0.00 0.35 0.00 0.00 39.48 39.81 3hyk n PHE 25 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 3hyk n GLU 27 N 0.59 0.00 0.07 -4.13 2.13 -1.26 -2.22 120.64 115.82 3hyk n GLU 27 Ca 0.00 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.79 3hyk n GLU 27 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.64 3hyk n GLU 27 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hyk h ARG 28 N 0.00 0.00 0.00 5.31 3.08 -1.90 -3.39 114.38 117.48 3hyk h ARG 28 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 3hyk h ARG 28 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 3hyk h ARG 28 CO 0.00 0.66 -2.41 -0.89 -1.07 0.00 0.00 179.97 176.26 3hyk n ILE 29 N -3.20 1.41 -4.35 2.04 2.08 -0.94 -4.52 119.36 111.88 3hyk n ILE 29 Ca -0.03 -0.76 -0.35 0.00 0.56 0.00 0.00 62.75 62.17 3hyk n ILE 29 Cb 0.87 -0.77 -0.09 0.00 -0.75 0.00 0.00 39.64 38.90 3hyk n ILE 29 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3hyk s LEU 30 N -5.81 3.60 0.95 1.39 1.43 -1.26 -4.62 118.68 114.36 3hyk s LEU 30 Ca -0.18 0.14 -0.15 0.00 -1.03 0.00 0.00 54.13 52.91 3hyk s LEU 30 Cb 0.07 -1.86 0.17 0.00 0.03 0.00 0.00 46.19 44.60 3hyk s LEU 30 CO 0.75 0.37 1.23 0.42 0.23 0.00 0.00 176.35 179.34 3hyk s THR 31 N -0.92 1.95 0.12 5.49 -4.23 -1.26 -4.64 115.64 112.15 3hyk s THR 31 Ca 0.14 0.00 -0.27 0.00 -1.18 0.00 0.00 61.69 60.39 3hyk s THR 31 Cb -0.11 -2.89 -0.06 0.00 1.34 0.00 0.00 72.50 70.78 3hyk s THR 31 CO 0.03 0.00 1.63 -0.33 -0.54 0.00 0.00 174.62 175.41 3hyk h GLU 32 N -1.61 -0.43 -0.58 3.99 4.39 -1.96 -0.14 114.58 118.23 3hyk h GLU 32 Ca -0.46 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.31 3hyk h GLU 32 Cb 1.28 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.98 3hyk h GLU 32 CO 0.48 -0.29 0.33 -0.91 -1.16 0.00 0.00 179.01 177.46 3hyk h ASN 33 N -0.45 0.50 -0.41 1.42 2.35 -2.00 -1.94 115.58 115.06 3hyk h ASN 33 Ca 0.06 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 3hyk h ASN 33 Cb 0.52 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 3hyk h ASN 33 CO -0.23 0.34 0.10 -0.33 -1.65 0.00 0.00 177.43 175.66 3hyk h GLU 34 N 0.63 0.73 0.00 0.81 5.08 -1.80 -2.41 114.58 117.62 3hyk h GLU 34 Ca 0.25 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 3hyk h GLU 34 Cb 0.11 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3hyk h GLU 34 CO -0.14 0.67 -0.42 0.00 -1.00 0.00 0.00 179.01 178.12 3hyk h ARG 35 N 0.70 0.00 0.00 2.33 3.08 -0.37 -1.13 114.38 118.99 3hyk h ARG 35 Ca 0.16 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.12 3hyk h ARG 35 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3hyk h ARG 35 CO 0.00 0.42 -0.39 -0.91 -1.07 0.00 0.00 179.97 178.02 3hyk h ASN 36 N 0.00 0.00 -0.00 7.04 2.35 -0.87 -0.44 115.58 123.66 3hyk h ASN 36 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3hyk h ASN 36 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 3hyk h ASN 36 CO 0.05 0.39 -0.04 0.58 -1.65 0.00 0.00 177.43 176.77 3hyk h VAL 37 N 0.00 1.60 -0.30 2.81 2.07 -1.21 -3.27 116.25 117.94 3hyk h VAL 37 Ca -0.00 -1.80 0.09 0.00 0.82 0.00 0.00 66.70 65.80 3hyk h VAL 37 Cb 0.74 2.80 -0.01 0.00 -1.52 0.00 0.00 31.29 33.30 3hyk h VAL 37 CO 0.05 0.47 0.24 0.00 0.02 0.00 0.00 177.57 178.36 3hyk h ALA 38 N 0.25 2.17 0.00 1.67 0.00 -0.99 -1.43 119.26 120.93 3hyk h ALA 38 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hyk h ALA 38 Cb 0.79 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3hyk h ALA 38 CO 0.01 -0.40 -0.05 -0.22 0.00 0.00 0.00 179.25 178.59 3hyk h LYS 39 N 0.00 0.00 -0.02 0.00 3.64 -1.13 -0.84 116.57 118.22 3hyk h LYS 39 Ca 0.14 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3hyk h LYS 39 Cb 0.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3hyk h LYS 39 CO -0.00 0.05 -0.05 0.41 -2.27 0.00 0.00 179.45 177.58 3hyk n GLY 40 N -0.95 0.47 3.87 5.01 0.00 -0.54 -4.95 105.19 108.10 3hyk n GLY 40 Ca -0.02 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 3hyk n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hyk s LEU 41 N -2.07 4.00 0.25 0.99 1.43 -0.32 -5.09 118.68 117.87 3hyk s LEU 41 Ca 0.31 -0.12 -0.10 0.00 -1.03 0.00 0.00 54.13 53.19 3hyk s LEU 41 Cb 0.20 -2.54 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 3hyk s LEU 41 CO 0.35 -0.04 0.44 -1.59 0.23 0.00 0.00 176.35 175.74 3hyk s LYS 42 N -3.80 1.55 3.39 1.70 -2.85 -1.26 -4.70 119.74 113.77 3hyk s LYS 42 Ca 0.33 -1.36 0.00 0.00 -1.00 0.00 0.00 55.97 53.94 3hyk s LYS 42 Cb -0.09 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.13 3hyk s LYS 42 CO 0.26 -0.63 0.00 0.41 0.10 0.00 0.00 175.35 175.49 3hyk n GLY 43 N -0.39 2.06 0.28 0.59 0.00 -1.26 -2.16 105.19 104.32 3hyk n GLY 43 Ca -0.01 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.76 3hyk n GLY 43 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hyk h SER 44 N 5.90 0.00 -0.33 1.61 4.64 -1.99 -1.36 113.55 122.01 3hyk h SER 44 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 3hyk h SER 44 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3hyk h SER 44 CO 0.00 0.01 -0.23 -0.09 -0.87 0.00 0.00 176.83 175.65 3hyk h ARG 45 N 0.00 0.74 -0.37 4.77 9.65 -1.85 -0.45 114.38 126.87 3hyk h ARG 45 Ca -0.00 -0.35 -0.04 0.00 -1.10 0.00 0.00 59.98 58.49 3hyk h ARG 45 Cb 0.02 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 3hyk h ARG 45 CO 0.00 0.97 0.07 1.25 2.80 0.00 0.00 179.97 185.06 3hyk h LEU 46 N 0.51 0.58 -0.38 3.80 5.85 -0.91 -1.26 115.31 123.51 3hyk h LEU 46 Ca 0.07 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.54 3hyk h LEU 46 Cb 0.78 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3hyk h LEU 46 CO 0.06 0.68 0.25 0.74 -0.34 0.00 0.00 178.44 179.83 3hyk h THR 47 N 0.45 1.09 -0.37 1.05 2.02 -1.33 -1.26 112.91 114.55 3hyk h THR 47 Ca 0.11 -0.17 -0.11 0.00 0.77 0.00 0.00 66.41 67.01 3hyk h THR 47 Cb 0.34 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 3hyk h THR 47 CO 0.01 0.09 -0.24 1.05 0.37 0.00 0.00 175.52 176.80 3hyk h GLU 48 N 0.50 0.74 0.46 6.66 4.11 -1.03 -0.50 114.58 125.52 3hyk h GLU 48 Ca 0.14 -0.30 -0.02 0.00 0.07 0.00 0.00 59.36 59.25 3hyk h GLU 48 Cb -0.05 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3hyk h GLU 48 CO -0.04 0.90 -0.25 0.35 0.07 0.00 0.00 179.01 180.04 3hyk h PHE 49 N 0.64 -0.66 -0.93 2.06 3.57 -0.87 0.19 116.94 120.95 3hyk h PHE 49 Ca 0.09 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.59 3hyk h PHE 49 Cb 0.74 0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 3hyk h PHE 49 CO 0.04 -0.40 0.61 0.28 -2.23 0.00 0.00 178.31 176.61 3hyk h VAL 50 N -0.67 1.24 -0.42 1.41 2.07 -1.18 -2.19 116.25 116.52 3hyk h VAL 50 Ca -0.06 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 3hyk h VAL 50 Cb 0.53 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3hyk h VAL 50 CO 0.07 0.23 0.15 0.00 0.02 0.00 0.00 177.57 178.05 3hyk h ALA 51 N 1.34 0.55 -0.31 1.67 0.00 -0.70 0.19 119.26 122.00 3hyk h ALA 51 Ca 0.34 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 3hyk h ALA 51 Cb -0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3hyk h ALA 51 CO -0.07 0.18 0.02 0.78 0.00 0.00 0.00 179.25 180.16 3hyk h GLY 52 N 0.54 0.49 0.79 0.00 0.00 -0.48 -1.39 103.07 103.02 3hyk h GLY 52 Ca 0.14 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 3hyk h GLY 52 CO -0.01 0.25 -0.18 3.21 0.00 0.00 0.00 176.54 179.81 3hyk h ARG 53 N 0.45 0.43 0.01 4.80 -0.00 -0.77 -0.81 114.38 118.49 3hyk h ARG 53 Ca 0.10 -0.23 0.03 0.00 -0.50 0.00 0.00 59.98 59.38 3hyk h ARG 53 Cb 0.26 0.01 -0.05 0.00 0.00 0.00 0.00 29.97 30.19 3hyk h ARG 53 CO 0.00 0.80 -0.33 0.35 0.00 0.00 0.00 179.97 180.79 3hyk h PHE 54 N 0.07 -0.91 -0.83 3.04 3.57 -0.74 -1.29 116.94 119.86 3hyk h PHE 54 Ca 0.03 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3hyk h PHE 54 Cb 0.72 0.40 -0.04 0.00 2.79 0.00 0.00 35.95 39.82 3hyk h PHE 54 CO 0.08 -0.42 0.41 0.00 -2.23 0.00 0.00 178.31 176.15 3hyk h ALA 55 N 0.21 1.17 -0.23 2.41 0.00 -1.29 0.92 119.26 122.45 3hyk h ALA 55 Ca 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3hyk h ALA 55 Cb 0.57 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3hyk h ALA 55 CO -0.26 0.64 0.12 0.00 0.00 0.00 0.00 179.25 179.74 3hyk h ALA 56 N 1.28 0.30 -0.46 0.00 0.00 -0.95 0.13 119.26 119.56 3hyk h ALA 56 Ca 0.29 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 3hyk h ALA 56 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hyk h ALA 56 CO -0.04 -0.14 -0.08 0.87 0.00 0.00 0.00 179.25 179.86 3hyk h LYS 57 N 0.25 0.87 -0.36 0.00 1.57 -0.92 -0.34 116.57 117.65 3hyk h LYS 57 Ca 0.08 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.51 3hyk h LYS 57 Cb 0.11 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3hyk h LYS 57 CO -0.01 0.95 0.11 1.49 -0.57 0.00 0.00 179.45 181.42 3hyk h GLU 58 N 0.71 0.57 -0.67 3.15 4.81 -0.68 -1.95 114.58 120.51 3hyk h GLU 58 Ca 0.12 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3hyk h GLU 58 Cb 0.61 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 3hyk h GLU 58 CO 0.04 0.59 0.27 0.00 -0.73 0.00 0.00 179.01 179.17 3hyk h ALA 59 N 0.95 1.20 -0.17 2.92 0.00 -0.63 -1.49 119.26 122.04 3hyk h ALA 59 Ca 0.12 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3hyk h ALA 59 Cb 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hyk h ALA 59 CO -0.00 0.58 0.09 -0.92 0.00 0.00 0.00 179.25 179.00 3hyk h TYR 60 N 0.97 0.18 -0.20 0.00 3.20 -0.88 -1.28 116.97 118.96 3hyk h TYR 60 Ca 0.23 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.11 3hyk h TYR 60 Cb 0.19 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 3hyk h TYR 60 CO 0.02 0.11 0.13 0.66 -1.64 0.00 0.00 178.16 177.43 3hyk h SER 61 N 0.20 0.22 -0.22 -2.11 4.64 -0.74 -0.35 113.55 115.18 3hyk h SER 61 Ca 0.06 -0.01 -0.19 0.00 -0.47 0.00 0.00 61.79 61.19 3hyk h SER 61 Cb -0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3hyk h SER 61 CO -0.03 0.16 -0.59 0.11 -0.87 0.00 0.00 176.83 175.60 3hyk h LYS 62 N 0.25 0.83 -0.94 4.77 1.57 -0.91 -0.95 116.57 121.19 3hyk h LYS 62 Ca 0.08 -0.55 0.07 0.00 -1.87 0.00 0.00 60.65 58.38 3hyk h LYS 62 Cb -0.00 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.31 3hyk h LYS 62 CO -0.02 1.18 0.59 0.00 -0.57 0.00 0.00 179.45 180.64 3hyk h ALA 63 N 0.70 1.32 0.00 3.86 0.00 0.02 0.21 119.26 125.37 3hyk h ALA 63 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3hyk h ALA 63 Cb 1.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3hyk h ALA 63 CO 0.13 0.33 -0.33 0.28 0.00 0.00 0.00 179.25 179.66 3hyk h VAL 64 N 1.06 1.02 0.00 0.00 2.07 -0.91 -3.38 116.25 116.11 3hyk h VAL 64 Ca 0.42 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3hyk h VAL 64 Cb 0.22 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3hyk h VAL 64 CO -0.19 0.32 0.00 0.61 0.02 0.00 0.00 177.57 178.33 3hyk n GLY 65 N -0.29 0.82 0.02 2.17 0.00 0.72 -4.93 105.19 103.70 3hyk n GLY 65 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 3hyk n GLY 65 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hyk n THR 66 N -2.32 0.27 -0.52 2.61 -2.24 -1.02 -5.01 114.28 106.05 3hyk n THR 66 Ca 0.00 -0.22 0.07 0.00 -2.27 0.00 0.00 64.05 61.63 3hyk n THR 66 Cb 0.00 -0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 67.80 3hyk n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hyk n GLY 67 N 2.45 -1.81 3.71 3.38 0.00 -0.44 -4.73 105.19 107.74 3hyk n GLY 67 Ca -0.07 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 3hyk n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hyk s ILE 68 N -1.90 2.85 -0.03 -0.61 -1.09 -1.26 -4.62 121.20 114.54 3hyk s ILE 68 Ca 0.00 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 3hyk s ILE 68 Cb 0.00 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.54 3hyk s ILE 68 CO 0.00 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.35 3hyk n GLY 69 N 3.79 -0.92 0.19 6.18 0.00 -0.01 -5.00 105.19 109.42 3hyk n GLY 69 Ca 0.14 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.09 3hyk n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hyk h LYS 70 N 0.00 0.00 0.00 1.61 1.57 -1.95 -3.24 116.57 114.56 3hyk h LYS 70 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 3hyk h LYS 70 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 3hyk h LYS 70 CO 0.00 0.37 -1.72 -0.85 -0.57 0.00 0.00 179.45 176.68 3hyk n GLU 71 N -3.69 0.64 -3.67 3.15 0.00 -1.26 -4.87 120.64 110.94 3hyk n GLU 71 Ca -0.01 0.23 -0.18 0.00 0.00 0.00 0.00 57.16 57.20 3hyk n GLU 71 Cb 0.47 -1.76 -0.16 0.00 0.00 0.00 0.00 31.44 29.99 3hyk n GLU 71 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3hyk s VAL 72 N -2.69 -0.21 0.25 3.84 1.01 -1.22 -5.12 120.40 116.25 3hyk s VAL 72 Ca -0.05 0.37 0.09 0.00 0.00 0.00 0.00 61.98 62.40 3hyk s VAL 72 Cb 0.08 -0.25 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 3hyk s VAL 72 CO 0.82 0.15 -0.15 -0.94 0.00 0.00 0.00 175.10 174.98 3hyk s SER 73 N 2.25 3.06 0.29 3.32 1.04 -1.25 -0.83 113.70 121.59 3hyk s SER 73 Ca 0.04 -1.05 0.04 0.00 0.48 0.00 0.00 55.95 55.45 3hyk s SER 73 Cb -0.12 -0.22 0.75 0.00 0.10 0.00 0.00 66.02 66.53 3hyk s SER 73 CO -0.05 -0.11 1.68 -0.26 0.98 0.00 0.00 173.24 175.48 3hyk h PHE 74 N 2.38 0.57 -0.00 5.02 0.04 -1.90 -1.59 116.94 121.47 3hyk h PHE 74 Ca -0.39 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.42 3hyk h PHE 74 Cb 1.24 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 39.28 3hyk h PHE 74 CO 0.75 -0.11 -0.01 1.28 -0.60 0.00 0.00 178.31 179.62 3hyk n LEU 75 N -5.10 0.14 0.01 1.54 4.77 -1.26 -2.11 117.00 114.98 3hyk n LEU 75 Ca 0.22 0.06 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 3hyk n LEU 75 Cb 0.69 -0.11 0.40 0.00 -2.33 0.00 0.00 43.42 42.07 3hyk n LEU 75 CO 0.11 0.02 0.67 0.47 -1.33 0.00 0.00 177.39 177.33 3hyk n ASP 76 N -1.02 0.32 -4.22 -1.43 8.00 -0.60 -4.85 116.55 112.75 3hyk n ASP 76 Ca 0.20 0.10 -0.30 0.00 0.71 0.00 0.00 54.79 55.50 3hyk n ASP 76 Cb 0.19 -0.09 -0.16 0.00 -0.02 0.00 0.00 41.12 41.03 3hyk n ASP 76 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hyk s ILE 77 N -3.01 1.87 -0.08 0.53 1.01 -0.90 -4.41 121.20 116.21 3hyk s ILE 77 Ca 0.12 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.84 3hyk s ILE 77 Cb 0.18 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 41.06 3hyk s ILE 77 CO 0.63 0.52 -0.17 -0.70 0.00 0.00 0.00 174.94 175.22 3hyk s GLU 78 N -0.05 2.25 -0.34 2.79 2.12 -0.57 -4.66 118.70 120.24 3hyk s GLU 78 Ca -0.05 -0.62 -0.08 0.00 0.36 0.00 0.00 54.97 54.58 3hyk s GLU 78 Cb -0.14 -1.78 0.03 0.00 0.26 0.00 0.00 34.13 32.50 3hyk s GLU 78 CO 0.04 0.11 0.13 0.08 -0.54 0.00 0.00 175.26 175.07 3hyk s VAL 79 N 0.47 3.99 -0.13 3.70 1.01 -1.26 -0.32 120.40 127.86 3hyk s VAL 79 Ca -0.15 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.81 3hyk s VAL 79 Cb -0.16 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 3hyk s VAL 79 CO 0.06 -0.16 -0.12 -0.13 0.00 0.00 0.00 175.10 174.75 3hyk s ARG 80 N 1.45 3.42 0.12 2.72 0.52 0.00 -4.90 118.95 122.28 3hyk s ARG 80 Ca -0.00 -0.67 -0.22 0.00 -0.52 0.00 0.00 55.73 54.32 3hyk s ARG 80 Cb -0.19 -2.67 -0.07 0.00 0.52 0.00 0.00 34.95 32.54 3hyk s ARG 80 CO 0.04 0.21 0.67 0.54 0.02 0.00 0.00 175.30 176.78 3hyk s ASN 81 N 0.37 7.22 0.99 0.23 6.03 -1.26 0.23 114.94 128.75 3hyk s ASN 81 Ca -0.10 1.45 -0.05 0.00 -1.03 0.00 0.00 52.86 53.13 3hyk s ASN 81 Cb -0.16 -2.43 0.07 0.00 -3.03 0.00 0.00 41.25 35.70 3hyk s ASN 81 CO 0.05 0.24 0.41 -0.90 -2.03 0.00 0.00 177.10 174.87 3hyk n ASP 82 N 1.67 0.04 0.32 3.54 5.68 0.12 -4.83 116.55 123.09 3hyk n ASP 82 Ca -0.08 -1.15 0.21 0.00 -0.50 0.00 0.00 54.79 53.27 3hyk n ASP 82 Cb 0.50 -0.31 1.07 0.00 -1.14 0.00 0.00 41.12 41.23 3hyk n ASP 82 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 3hyk h ASP 83 N -0.53 0.00 0.32 -1.12 2.03 -1.98 -1.55 116.42 113.60 3hyk h ASP 83 Ca -0.13 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.17 3hyk h ASP 83 Cb 0.36 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.86 3hyk h ASP 83 CO 0.09 0.01 -0.70 0.54 -1.03 0.00 0.00 179.24 178.15 3hyk n ARG 84 N -3.16 0.01 0.00 4.15 5.12 -1.26 -4.95 116.66 116.58 3hyk n ARG 84 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 3hyk n ARG 84 Cb 0.13 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.93 3hyk n ARG 84 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hyk n GLY 85 N 1.49 0.58 3.71 -0.13 0.00 -0.58 -5.08 105.19 105.19 3hyk n GLY 85 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3hyk n GLY 85 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hyk s LYS 86 N -0.72 4.27 -0.05 1.61 2.20 -1.26 -4.56 119.74 121.24 3hyk s LYS 86 Ca 0.00 2.19 -0.30 0.00 -0.36 0.00 0.00 55.97 57.50 3hyk s LYS 86 Cb 0.00 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 33.03 3hyk s LYS 86 CO 0.00 -0.52 1.27 -1.25 -0.36 0.00 0.00 175.35 174.49 3hyk s PRO 87 N 1.26 4.32 -0.21 4.03 0.04 -1.26 0.10 135.00 143.29 3hyk s PRO 87 Ca 0.67 1.77 -0.02 0.00 0.04 0.00 0.00 61.00 63.46 3hyk s PRO 87 Cb -0.39 -3.58 0.01 0.00 0.04 0.00 0.00 34.50 30.57 3hyk s PRO 87 CO 0.31 -0.51 -0.11 0.42 0.04 0.00 0.00 177.00 177.14 3hyk s ILE 88 N 2.39 2.80 -0.23 0.56 -1.09 0.14 -4.69 121.20 121.08 3hyk s ILE 88 Ca 0.58 -0.72 -0.21 0.00 -2.23 0.00 0.00 60.65 58.07 3hyk s ILE 88 Cb -0.27 -2.25 -0.02 0.00 -1.58 0.00 0.00 42.46 38.34 3hyk s ILE 88 CO 0.23 0.45 0.67 -0.22 -1.23 0.00 0.00 174.94 174.84 3hyk s LEU 89 N 1.39 4.10 -0.28 2.97 0.20 -1.26 -0.82 118.68 124.98 3hyk s LEU 89 Ca 0.05 0.82 -0.04 0.00 0.69 0.00 0.00 54.13 55.65 3hyk s LEU 89 Cb -0.14 -2.93 0.02 0.00 -0.43 0.00 0.00 46.19 42.71 3hyk s LEU 89 CO -0.07 -0.36 0.02 -0.63 -0.29 0.00 0.00 176.35 175.01 3hyk s ILE 90 N 2.32 3.40 0.26 6.68 1.01 0.56 -4.87 121.20 130.56 3hyk s ILE 90 Ca 0.29 -0.94 -0.16 0.00 0.00 0.00 0.00 60.65 59.84 3hyk s ILE 90 Cb -0.16 -2.78 0.01 0.00 0.01 0.00 0.00 42.46 39.54 3hyk s ILE 90 CO 0.09 0.09 0.58 0.28 0.00 0.00 0.00 174.94 175.98 3hyk s THR 91 N 1.39 0.00 -0.44 2.92 -1.32 -1.26 -1.51 115.64 115.42 3hyk s THR 91 Ca 0.00 -1.24 -0.29 0.00 -1.21 0.00 0.00 61.69 58.96 3hyk s THR 91 Cb -0.17 -2.13 0.02 0.00 -1.51 0.00 0.00 72.50 68.70 3hyk s THR 91 CO -0.01 0.00 1.21 -0.44 -2.21 0.00 0.00 174.62 173.18 3hyk s SER 92 N -2.98 6.58 -0.02 8.08 0.01 -1.26 -4.98 113.70 119.12 3hyk s SER 92 Ca 0.18 0.63 -0.29 0.00 1.31 0.00 0.00 55.95 57.79 3hyk s SER 92 Cb -0.03 -2.55 0.10 0.00 0.21 0.00 0.00 66.02 63.75 3hyk s SER 92 CO 0.08 -1.27 0.85 -0.89 0.41 0.00 0.00 173.24 172.42 3hyk s THR 93 N 4.65 0.00 -1.03 1.44 2.01 -1.26 -5.01 115.64 116.45 3hyk s THR 93 Ca 0.52 0.00 0.26 0.00 0.31 0.00 0.00 61.69 62.78 3hyk s THR 93 Cb -0.10 -1.00 0.09 0.00 0.01 0.00 0.00 72.50 71.50 3hyk s THR 93 CO 0.30 0.00 1.58 -0.62 -0.69 0.00 0.00 174.62 175.20 3hyk n GLU 94 N 0.11 0.03 -3.37 4.92 1.02 -1.26 -4.93 120.64 117.15 3hyk n GLU 94 Ca -0.12 -0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.79 3hyk n GLU 94 Cb 0.61 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.52 3hyk n GLU 94 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3hyk s HIS 95 N -2.98 3.36 -0.12 -0.32 3.76 -1.26 -4.32 115.29 113.41 3hyk s HIS 95 Ca 0.12 0.17 -0.21 0.00 -0.15 0.00 0.00 55.06 55.00 3hyk s HIS 95 Cb 0.18 -1.98 -0.04 0.00 1.11 0.00 0.00 32.58 31.86 3hyk s HIS 95 CO 0.64 0.02 0.62 0.42 -0.85 0.00 0.00 174.74 175.58 3hyk s ILE 96 N -2.31 5.08 -0.28 0.60 1.01 -0.02 -4.94 121.20 120.35 3hyk s ILE 96 Ca 0.42 1.23 -0.09 0.00 0.00 0.00 0.00 60.65 62.22 3hyk s ILE 96 Cb -0.10 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.40 3hyk s ILE 96 CO 0.35 0.24 0.12 -0.69 0.00 0.00 0.00 174.94 174.95 3hyk s VAL 97 N 1.03 4.52 -0.15 2.92 1.01 -1.26 -1.16 120.40 127.32 3hyk s VAL 97 Ca 0.32 -0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.00 3hyk s VAL 97 Cb -0.16 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 3hyk s VAL 97 CO 0.14 0.22 0.05 -1.00 0.00 0.00 0.00 175.10 174.51 3hyk s HIS 98 N 1.63 3.26 0.02 5.22 3.76 0.03 -4.76 115.29 124.44 3hyk s HIS 98 Ca 0.06 0.13 -0.01 0.00 -0.15 0.00 0.00 55.06 55.09 3hyk s HIS 98 Cb -0.16 -1.99 -0.02 0.00 1.11 0.00 0.00 32.58 31.52 3hyk s HIS 98 CO 0.05 0.28 -0.01 -1.17 -0.85 0.00 0.00 174.74 173.04 3hyk s LEU 99 N -0.08 2.15 -0.03 0.89 2.96 -1.26 -1.47 118.68 121.84 3hyk s LEU 99 Ca 0.06 -0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 53.45 3hyk s LEU 99 Cb -0.12 0.13 0.02 0.00 0.50 0.00 0.00 46.19 46.72 3hyk s LEU 99 CO 0.01 -0.27 0.25 -0.55 -1.32 0.00 0.00 176.35 174.47 3hyk s SER 100 N -1.26 -0.15 0.06 3.68 0.15 -0.80 -4.82 113.70 110.56 3hyk s SER 100 Ca -0.14 0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.68 3hyk s SER 100 Cb -0.09 0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.54 3hyk s SER 100 CO -0.01 -0.32 -0.13 -0.63 1.20 0.00 0.00 173.24 173.35 3hyk s ILE 101 N -0.93 0.98 -0.06 6.45 1.01 -1.26 -1.55 121.20 125.84 3hyk s ILE 101 Ca -0.10 -1.21 -0.14 0.00 0.00 0.00 0.00 60.65 59.20 3hyk s ILE 101 Cb -0.05 -0.96 0.03 0.00 0.01 0.00 0.00 42.46 41.49 3hyk s ILE 101 CO 0.02 -0.23 0.32 -0.55 0.00 0.00 0.00 174.94 174.50 3hyk s SER 102 N -1.62 -0.25 -0.12 3.58 0.15 -0.44 -5.00 113.70 110.00 3hyk s SER 102 Ca -0.03 0.31 -0.05 0.00 0.70 0.00 0.00 55.95 56.88 3hyk s SER 102 Cb -0.10 0.46 0.05 0.00 -1.71 0.00 0.00 66.02 64.72 3hyk s SER 102 CO 0.02 -0.32 0.25 -1.38 1.20 0.00 0.00 173.24 173.00 3hyk s HIS 103 N -0.77 -0.37 0.00 3.44 -3.43 -1.26 -0.55 115.29 112.36 3hyk s HIS 103 Ca -0.09 0.86 0.00 0.00 -0.80 0.00 0.00 55.06 55.04 3hyk s HIS 103 Cb -0.04 0.00 0.00 0.00 -1.43 0.00 0.00 32.58 31.11 3hyk s HIS 103 CO 0.03 -0.29 0.00 -1.13 -2.00 0.00 0.00 174.74 171.35 3hyk n SER 104 N 4.74 0.00 -0.20 7.38 3.41 -0.01 -4.99 113.62 123.95 3hyk n SER 104 Ca -0.16 -0.70 -0.04 0.00 -0.26 0.00 0.00 58.87 57.71 3hyk n SER 104 Cb 0.51 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.61 3hyk n SER 104 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3hyk h LYS 105 N 0.00 1.00 -0.00 4.33 1.57 -2.02 -3.34 116.57 118.10 3hyk h LYS 105 Ca 0.00 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3hyk h LYS 105 Cb 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.15 3hyk h LYS 105 CO 0.00 0.84 -0.03 0.39 -0.57 0.00 0.00 179.45 180.08 3hyk n GLU 106 N -4.28 0.58 -3.96 3.15 -0.58 -1.26 -4.87 120.64 109.41 3hyk n GLU 106 Ca 0.06 -0.60 -0.09 0.00 -0.42 0.00 0.00 57.16 56.10 3hyk n GLU 106 Cb 0.20 -1.00 -0.11 0.00 -0.57 0.00 0.00 31.44 29.95 3hyk n GLU 106 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3hyk s PHE 107 N -0.48 0.23 0.04 -0.32 0.08 -1.25 -1.25 117.98 115.02 3hyk s PHE 107 Ca 0.04 -0.46 0.09 0.00 0.12 0.00 0.00 56.93 56.72 3hyk s PHE 107 Cb 0.03 -0.17 -0.03 0.00 -0.57 0.00 0.00 43.02 42.29 3hyk s PHE 107 CO 0.06 -0.18 -0.26 0.00 -0.10 0.00 0.00 175.22 174.74 3hyk s ALA 108 N -1.35 2.22 0.04 5.36 0.00 -0.62 -0.83 121.76 126.58 3hyk s ALA 108 Ca -0.15 -1.25 0.02 0.00 0.00 0.00 0.00 51.96 50.58 3hyk s ALA 108 Cb -0.09 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 3hyk s ALA 108 CO -0.01 0.53 -0.07 0.14 0.00 0.00 0.00 175.76 176.35 3hyk s VAL 109 N -0.78 0.47 -0.03 0.00 -7.23 0.29 -1.33 120.40 111.79 3hyk s VAL 109 Ca 0.11 -1.03 -0.11 0.00 -1.81 0.00 0.00 61.98 59.14 3hyk s VAL 109 Cb -0.10 -0.54 0.02 0.00 0.56 0.00 0.00 36.38 36.31 3hyk s VAL 109 CO 0.02 -0.39 0.25 0.00 -0.31 0.00 0.00 175.10 174.66 3hyk s ALA 110 N -1.37 -0.62 0.04 1.32 0.00 -0.78 -1.33 121.76 119.02 3hyk s ALA 110 Ca -0.11 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.15 3hyk s ALA 110 Cb -0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 3hyk s ALA 110 CO 0.00 -0.21 -0.05 1.14 0.00 0.00 0.00 175.76 176.63 3hyk s GLN 111 N -1.01 0.45 0.00 0.00 -2.07 -0.60 -0.94 119.66 115.49 3hyk s GLN 111 Ca -0.11 -0.75 0.02 0.00 -1.82 0.00 0.00 55.36 52.70 3hyk s GLN 111 Cb -0.05 -0.09 -0.01 0.00 -1.09 0.00 0.00 33.01 31.77 3hyk s GLN 111 CO 0.03 -0.00 -0.06 0.08 -1.32 0.00 0.00 175.29 174.01 3hyk s VAL 112 N -1.66 0.46 -0.11 3.63 1.01 0.11 -1.91 120.40 121.94 3hyk s VAL 112 Ca -0.11 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3hyk s VAL 112 Cb -0.08 -0.41 0.02 0.00 0.00 0.00 0.00 36.38 35.90 3hyk s VAL 112 CO -0.01 0.07 -0.13 -0.69 0.00 0.00 0.00 175.10 174.34 3hyk s VAL 113 N -0.28 1.33 -0.20 2.92 1.01 -0.54 -0.28 120.40 124.36 3hyk s VAL 113 Ca 0.01 -0.52 -0.09 0.00 0.00 0.00 0.00 61.98 61.38 3hyk s VAL 113 Cb -0.03 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3hyk s VAL 113 CO -0.00 0.41 0.10 -0.76 0.00 0.00 0.00 175.10 174.85 3hyk s LEU 114 N 1.24 3.94 0.02 3.92 1.43 0.09 -0.79 118.68 128.53 3hyk s LEU 114 Ca -0.02 0.11 0.08 0.00 -1.03 0.00 0.00 54.13 53.26 3hyk s LEU 114 Cb -0.14 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 3hyk s LEU 114 CO -0.05 0.15 -0.23 -0.70 0.23 0.00 0.00 176.35 175.75 3hyk s GLU 115 N 0.56 2.03 0.23 1.70 2.12 -0.30 -0.41 118.70 124.62 3hyk s GLU 115 Ca 0.05 -0.99 -0.30 0.00 0.36 0.00 0.00 54.97 54.10 3hyk s GLU 115 Cb -0.12 -2.10 -0.09 0.00 0.26 0.00 0.00 34.13 32.08 3hyk s GLU 115 CO 0.01 0.54 0.93 -1.54 -0.54 0.00 0.00 175.26 174.66 3hyk s SER 116 N -1.10 7.62 -1.03 -1.70 1.04 -1.26 -0.84 113.70 116.43 3hyk s SER 116 Ca 0.12 1.92 -0.14 0.00 0.48 0.00 0.00 55.95 58.33 3hyk s SER 116 Cb -0.10 -2.60 0.20 0.00 0.10 0.00 0.00 66.02 63.62 3hyk s SER 116 CO 0.02 0.16 1.13 -0.94 0.98 0.00 0.00 173.24 174.58 3hyk s SER 117 N -1.13 6.96 0.00 7.02 1.04 -1.26 -4.87 113.70 121.46 3hyk s SER 117 Ca 0.41 -2.85 0.00 0.00 0.48 0.00 0.00 55.95 53.99 3hyk s SER 117 Cb -0.26 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.55 3hyk s SER 117 CO 0.31 -0.67 0.00 -0.24 0.98 0.00 0.00 173.24 173.63