#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ken h LEU 2 N 0.00 0.00 -0.30 0.99 7.12 -1.91 -3.11 115.31 118.11 1ken h LEU 2 Ca 0.00 -0.39 0.00 0.00 0.13 0.00 0.00 57.88 57.62 1ken h LEU 2 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1ken h LEU 2 CO 0.00 1.09 0.00 0.49 -0.13 0.00 0.00 178.44 179.89 1ken n PHE 3 N -4.56 0.20 0.00 1.25 3.01 -1.26 -4.89 117.46 111.22 1ken n PHE 3 Ca -0.18 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1ken n PHE 3 Cb 0.45 -0.65 0.00 0.00 -0.01 0.00 0.00 39.48 39.27 1ken n PHE 3 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ken n GLY 4 N -0.83 1.97 0.00 1.37 0.00 -1.18 -4.95 105.19 101.58 1ken n GLY 4 Ca 0.01 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1ken n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ken n ALA 5 N 0.00 0.00 -1.49 4.61 0.00 -1.26 -3.15 120.51 119.21 1ken n ALA 5 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 52.96 1ken n ALA 5 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1ken n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ken n ILE 6 N 0.00 1.62 -1.01 0.00 5.41 -1.26 0.14 119.36 124.27 1ken n ILE 6 Ca 0.00 -0.41 -0.07 0.00 1.00 0.00 0.00 62.75 63.28 1ken n ILE 6 Cb 0.00 -0.43 -0.03 0.00 -0.71 0.00 0.00 39.64 38.47 1ken n ILE 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ken n ALA 7 N 0.46 -0.10 -2.00 -1.39 0.00 -1.26 -4.22 120.51 111.99 1ken n ALA 7 Ca 0.15 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1ken n ALA 7 Cb 0.25 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1ken n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ken n GLY 8 N 0.12 0.50 0.24 0.00 0.00 0.38 -4.90 105.19 101.52 1ken n GLY 8 Ca -0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1ken n GLY 8 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1ken n PHE 9 N 0.00 0.00 -1.58 1.61 1.16 -0.05 -4.10 117.46 114.50 1ken n PHE 9 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.25 1ken n PHE 9 Cb 0.00 -0.02 0.06 0.00 -1.61 0.00 0.00 39.48 37.91 1ken n PHE 9 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 1ken n ILE 10 N -0.79 3.39 0.00 1.97 5.41 -1.22 -4.22 119.36 123.90 1ken n ILE 10 Ca 0.07 -3.42 0.00 0.00 1.00 0.00 0.00 62.75 60.40 1ken n ILE 10 Cb 0.39 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 38.15 1ken n ILE 10 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1ken n GLU 11 N -0.81 0.00 -4.35 0.38 0.28 -1.26 -4.59 120.64 110.29 1ken n GLU 11 Ca 0.57 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 57.25 1ken n GLU 11 Cb 0.66 -1.09 -0.10 0.00 1.43 0.00 0.00 31.44 32.35 1ken n GLU 11 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1ken s ASN 12 N -0.28 4.84 -0.37 -1.84 2.20 -1.26 -4.98 114.94 113.25 1ken s ASN 12 Ca 0.00 -0.11 -0.17 0.00 -0.94 0.00 0.00 52.86 51.64 1ken s ASN 12 Cb 0.00 -1.18 -0.00 0.00 -2.00 0.00 0.00 41.25 38.07 1ken s ASN 12 CO 0.00 0.27 0.44 -0.83 -2.94 0.00 0.00 177.10 174.04 1ken s GLY 13 N -1.59 1.86 0.00 0.45 0.00 -1.26 -4.97 107.32 101.81 1ken s GLY 13 Ca 0.19 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.70 1ken s GLY 13 CO 0.10 1.14 0.28 0.79 0.00 0.00 0.00 173.10 175.41 1ken n TRP 14 N 5.59 0.00 0.00 1.90 7.02 -1.26 -4.85 117.44 125.84 1ken n TRP 14 Ca -0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.41 1ken n TRP 14 Cb 0.49 -0.33 0.00 0.00 -2.42 0.00 0.00 31.31 29.05 1ken n TRP 14 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1ken n GLU 15 N 2.54 0.00 -2.48 -0.99 2.13 -1.26 -1.83 120.64 118.75 1ken n GLU 15 Ca 0.00 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.67 1ken n GLU 15 Cb 0.00 0.00 0.03 0.00 0.27 0.00 0.00 31.44 31.74 1ken n GLU 15 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ken n GLY 16 N 0.00 4.08 3.55 8.31 0.00 -1.26 -5.02 105.19 114.85 1ken n GLY 16 Ca 0.00 -1.98 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 1ken n GLY 16 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ken s MET 17 N -3.54 2.80 -0.07 1.61 1.75 -0.76 -4.78 119.30 116.32 1ken s MET 17 Ca 0.39 0.39 0.20 0.00 -1.25 0.00 0.00 55.69 55.42 1ken s MET 17 Cb 0.39 -4.33 -0.30 0.00 2.84 0.00 0.00 34.83 33.44 1ken s MET 17 CO -0.04 -2.56 0.36 0.44 -0.65 0.00 0.00 175.02 172.58 1ken n ILE 18 N 6.99 0.30 0.46 10.11 -5.35 -1.26 -4.31 119.36 126.30 1ken n ILE 18 Ca 0.16 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 1ken n ILE 18 Cb 0.51 -0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.32 1ken n ILE 18 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1ken n ASP 19 N -2.33 0.17 0.00 7.28 10.43 -1.26 -4.82 116.55 126.02 1ken n ASP 19 Ca -0.10 -0.62 0.00 0.00 2.57 0.00 0.00 54.79 56.63 1ken n ASP 19 Cb 0.67 -0.08 0.00 0.00 1.84 0.00 0.00 41.12 43.55 1ken n ASP 19 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ken n GLY 20 N 0.09 -0.53 0.16 0.44 0.00 -1.26 -4.74 105.19 99.34 1ken n GLY 20 Ca 0.00 -1.13 0.06 0.00 0.00 0.00 0.00 46.02 44.95 1ken n GLY 20 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ken n TRP 21 N 9.00 0.00 -3.70 1.61 7.02 -1.26 -4.92 117.44 125.19 1ken n TRP 21 Ca 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.45 1ken n TRP 21 Cb 0.00 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 28.88 1ken n TRP 21 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ken n TYR 22 N -0.68 -0.58 0.00 -5.99 0.53 -1.26 -4.94 117.16 104.23 1ken n TYR 22 Ca 0.04 -0.45 0.00 0.00 -1.02 0.00 0.00 57.90 56.47 1ken n TYR 22 Cb 0.23 0.10 0.00 0.00 -1.03 0.00 0.00 39.34 38.63 1ken n TYR 22 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ken n GLY 23 N -0.11 1.65 2.16 2.72 0.00 -1.25 -2.59 105.19 107.76 1ken n GLY 23 Ca 0.00 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.18 1ken n GLY 23 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ken n PHE 24 N -1.72 -0.01 -3.43 1.61 3.01 -0.44 -4.91 117.46 111.56 1ken n PHE 24 Ca 0.00 -1.41 -0.19 0.00 1.01 0.00 0.00 57.45 56.85 1ken n PHE 24 Cb 0.00 -0.22 -0.11 0.00 -0.01 0.00 0.00 39.48 39.14 1ken n PHE 24 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1ken s ARG 25 N -3.17 0.29 0.06 -1.08 0.52 -1.26 -0.67 118.95 113.64 1ken s ARG 25 Ca 0.08 -0.18 -0.22 0.00 -0.52 0.00 0.00 55.73 54.88 1ken s ARG 25 Cb -0.01 -0.79 -0.06 0.00 0.52 0.00 0.00 34.95 34.61 1ken s ARG 25 CO 0.05 -1.00 0.66 -3.38 0.02 0.00 0.00 175.30 171.65 1ken s HIS 26 N 2.31 3.77 -0.37 -0.53 -3.43 -1.19 -4.95 115.29 110.91 1ken s HIS 26 Ca 0.09 1.36 0.05 0.00 -0.80 0.00 0.00 55.06 55.76 1ken s HIS 26 Cb -0.14 -2.65 0.46 0.00 -1.43 0.00 0.00 32.58 28.82 1ken s HIS 26 CO -0.32 0.44 1.38 0.94 -2.00 0.00 0.00 174.74 175.17 1ken n GLN 27 N 2.23 3.34 -0.14 -0.38 -0.06 -1.26 -3.57 117.38 117.54 1ken n GLN 27 Ca -0.07 -3.94 -0.07 0.00 -2.00 0.00 0.00 57.00 50.92 1ken n GLN 27 Cb 0.50 -2.26 0.06 0.00 -4.06 0.00 0.00 30.24 24.48 1ken n GLN 27 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 1ken n ASN 28 N -0.77 -1.86 0.21 1.69 6.94 -1.21 -4.84 115.26 115.42 1ken n ASN 28 Ca 0.47 -0.42 0.04 0.00 -0.02 0.00 0.00 54.58 54.66 1ken n ASN 28 Cb 0.90 -0.22 0.45 0.00 -2.36 0.00 0.00 39.78 38.55 1ken n ASN 28 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1ken h SER 29 N -1.87 0.00 0.00 0.53 4.64 -1.94 -2.86 113.55 112.05 1ken h SER 29 Ca -0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1ken h SER 29 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1ken h SER 29 CO 0.05 0.26 0.00 -0.62 -0.87 0.00 0.00 176.83 175.65 1ken n GLU 30 N -4.22 0.77 0.00 4.77 4.71 -1.26 -4.98 120.64 120.44 1ken n GLU 30 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 1ken n GLU 30 Cb 0.31 -1.20 0.00 0.00 -1.01 0.00 0.00 31.44 29.54 1ken n GLU 30 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ken n GLY 31 N 0.19 1.07 1.80 0.62 0.00 -1.08 -5.00 105.19 102.79 1ken n GLY 31 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 45.00 1ken n GLY 31 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ken n THR 32 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -3.30 114.28 110.10 1ken n THR 32 Ca 0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1ken n THR 32 Cb 0.00 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1ken n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ken n GLY 33 N -0.27 3.61 3.44 3.38 0.00 -1.23 -4.97 105.19 109.15 1ken n GLY 33 Ca -0.03 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1ken n GLY 33 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ken s GLN 34 N -1.27 3.11 0.53 1.61 -0.21 -1.26 -3.16 119.66 119.02 1ken s GLN 34 Ca 0.00 -0.90 -0.19 0.00 0.02 0.00 0.00 55.36 54.29 1ken s GLN 34 Cb 0.00 -4.22 -0.06 0.00 1.00 0.00 0.00 33.01 29.73 1ken s GLN 34 CO 0.00 -1.73 1.08 0.00 -2.12 0.00 0.00 175.29 172.53 1ken s ALA 35 N 3.74 2.76 -0.07 6.09 0.00 0.15 -4.84 121.76 129.59 1ken s ALA 35 Ca 0.20 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 52.79 1ken s ALA 35 Cb -0.18 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1ken s ALA 35 CO 0.10 -0.62 0.13 0.00 0.00 0.00 0.00 175.76 175.37 1ken s ALA 36 N -1.97 3.81 0.22 0.00 0.00 -1.26 -1.33 121.76 121.22 1ken s ALA 36 Ca 0.69 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1ken s ALA 36 Cb -0.20 -1.85 0.01 0.00 0.00 0.00 0.00 23.12 21.09 1ken s ALA 36 CO 0.26 0.66 0.11 -3.47 0.00 0.00 0.00 175.76 173.33 1ken n ASP 37 N 1.61 0.23 0.00 0.00 4.64 -1.07 -4.85 116.55 117.11 1ken n ASP 37 Ca -0.16 -1.18 0.00 0.00 -1.38 0.00 0.00 54.79 52.07 1ken n ASP 37 Cb 0.54 -0.07 0.00 0.00 -1.04 0.00 0.00 41.12 40.55 1ken n ASP 37 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 1ken n LEU 38 N 0.00 0.00 0.00 -2.67 -0.00 -1.26 -4.69 117.00 108.38 1ken n LEU 38 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.03 1ken n LEU 38 Cb 0.08 0.06 0.00 0.00 -0.00 0.00 0.00 43.42 43.56 1ken n LEU 38 CO 0.05 -0.14 0.11 1.17 -0.00 0.00 0.00 177.39 178.57 1ken n LYS 39 N -1.43 0.00 0.00 1.96 4.81 -1.26 0.13 118.16 122.37 1ken n LYS 39 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1ken n LYS 39 Cb 0.00 -1.37 0.00 0.00 0.02 0.00 0.00 35.03 33.68 1ken n LYS 39 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1ken n SER 40 N -0.66 1.53 -0.10 3.14 2.88 -1.26 -3.94 113.62 115.21 1ken n SER 40 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1ken n SER 40 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 1ken n SER 40 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1ken h THR 41 N 0.00 1.30 -0.05 2.46 2.02 -0.85 -1.05 112.91 116.73 1ken h THR 41 Ca 0.00 -1.31 -0.04 0.00 0.77 0.00 0.00 66.41 65.83 1ken h THR 41 Cb 0.97 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.86 1ken h THR 41 CO 0.00 0.42 -0.14 -0.61 0.37 0.00 0.00 175.52 175.56 1ken h GLN 42 N 0.42 0.19 -0.77 6.66 5.75 0.76 -2.84 115.11 125.28 1ken h GLN 42 Ca 0.06 -0.13 0.14 0.00 -0.15 0.00 0.00 58.65 58.57 1ken h GLN 42 Cb 0.73 0.02 -0.14 0.00 1.07 0.00 0.00 27.48 29.16 1ken h GLN 42 CO 0.05 0.74 -0.32 0.00 -2.65 0.00 0.00 178.83 176.65 1ken h ALA 43 N 0.45 0.17 0.23 3.38 0.00 -1.56 3.49 119.26 125.41 1ken h ALA 43 Ca -0.00 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1ken h ALA 43 Cb 0.74 0.81 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1ken h ALA 43 CO 0.03 -0.59 -0.11 0.00 0.00 0.00 0.00 179.25 178.58 1ken h ALA 44 N 1.32 -0.75 0.00 0.00 0.00 -1.28 -2.52 119.26 116.04 1ken h ALA 44 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ken h ALA 44 Cb 0.58 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ken h ALA 44 CO -0.82 -0.73 0.28 0.82 0.00 0.00 0.00 179.25 178.81 1ken h ILE 45 N -0.41 0.00 -0.11 0.00 2.04 -1.23 0.27 117.51 118.06 1ken h ILE 45 Ca -0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 1ken h ILE 45 Cb 0.23 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1ken h ILE 45 CO 0.05 0.00 -0.03 0.44 0.00 0.00 0.00 178.15 178.61 1ken h ASP 46 N 0.00 0.23 0.31 1.72 3.45 0.70 -3.10 116.42 119.73 1ken h ASP 46 Ca 0.00 -0.38 -0.25 0.00 0.43 0.00 0.00 57.03 56.83 1ken h ASP 46 Cb 0.56 -0.06 0.01 0.00 -0.56 0.00 0.00 39.33 39.28 1ken h ASP 46 CO 0.00 0.56 -1.04 1.56 -1.57 0.00 0.00 179.24 178.75 1ken h GLN 47 N -0.10 0.45 -0.40 3.56 4.20 -0.31 -3.26 115.11 119.25 1ken h GLN 47 Ca 0.03 -0.53 0.06 0.00 0.06 0.00 0.00 58.65 58.26 1ken h GLN 47 Cb 0.46 0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.35 1ken h GLN 47 CO 0.01 1.18 0.11 0.82 -0.67 0.00 0.00 178.83 180.29 1ken h ILE 48 N 0.23 0.84 0.00 2.54 5.03 -1.44 0.57 117.51 125.28 1ken h ILE 48 Ca -0.11 -0.09 0.00 0.00 -0.12 0.00 0.00 64.86 64.55 1ken h ILE 48 Cb 1.69 0.56 0.00 0.00 -3.03 0.00 0.00 36.82 36.04 1ken h ILE 48 CO 0.18 0.05 0.00 0.59 -0.68 0.00 0.00 178.15 178.29 1ken n ASN 49 N -5.05 0.34 -0.02 1.72 5.03 -1.17 -1.56 115.26 114.54 1ken n ASN 49 Ca 0.02 -1.50 -0.06 0.00 0.87 0.00 0.00 54.58 53.91 1ken n ASN 49 Cb 0.17 -0.17 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 1ken n ASN 49 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ken n GLY 50 N 0.19 -0.21 0.29 7.41 0.00 0.18 -3.71 105.19 109.34 1ken n GLY 50 Ca 0.00 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1ken n GLY 50 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ken h LYS 51 N -0.38 0.00 0.02 1.61 2.10 -0.94 -2.52 116.57 116.45 1ken h LYS 51 Ca -0.08 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.56 1ken h LYS 51 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 1ken h LYS 51 CO -0.05 0.00 -0.01 1.25 -2.00 0.00 0.00 179.45 178.64 1ken h LEU 52 N 0.00 -0.03 -1.22 7.07 5.85 -1.50 -2.78 115.31 122.70 1ken h LEU 52 Ca 0.06 -0.62 0.30 0.00 0.84 0.00 0.00 57.88 58.46 1ken h LEU 52 Cb 0.26 0.01 -0.12 0.00 0.37 0.00 0.00 40.66 41.18 1ken h LEU 52 CO -0.00 0.63 0.66 0.78 -0.34 0.00 0.00 178.44 180.17 1ken h ASN 53 N -0.70 0.47 0.47 1.25 2.35 -1.54 0.21 115.58 118.09 1ken h ASN 53 Ca -0.00 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1ken h ASN 53 Cb 0.65 0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.06 1ken h ASN 53 CO 0.01 -0.00 -0.41 0.03 -1.65 0.00 0.00 177.43 175.41 1ken h ARG 54 N 0.37 -0.84 0.00 0.81 3.08 -1.36 -3.35 114.38 113.09 1ken h ARG 54 Ca 0.67 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.78 1ken h ARG 54 Cb 1.67 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.91 1ken h ARG 54 CO -0.42 -0.56 0.00 0.28 -1.07 0.00 0.00 179.97 178.20 1ken n VAL 55 N -5.51 0.00 -0.99 2.04 0.31 0.66 -4.85 118.33 109.99 1ken n VAL 55 Ca -0.11 0.69 -0.36 0.00 -0.01 0.00 0.00 64.34 64.55 1ken n VAL 55 Cb 0.41 -1.66 0.04 0.00 -0.91 0.00 0.00 33.84 31.72 1ken n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ken n ILE 56 N -0.21 0.00 -1.67 2.52 3.06 -0.65 -4.40 119.36 118.02 1ken n ILE 56 Ca 0.00 -0.45 -0.00 0.00 -2.50 0.00 0.00 62.75 59.79 1ken n ILE 56 Cb 0.00 -0.04 0.00 0.00 0.54 0.00 0.00 39.64 40.14 1ken n ILE 56 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1ken n GLU 57 N 2.23 -0.13 0.00 9.51 1.02 -1.26 -4.82 120.64 127.19 1ken n GLU 57 Ca -0.01 0.33 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1ken n GLU 57 Cb 0.57 -0.43 0.00 0.00 -0.02 0.00 0.00 31.44 31.56 1ken n GLU 57 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ken n LYS 58 N 0.81 0.00 -0.74 3.49 5.02 -1.26 -5.00 118.16 120.49 1ken n LYS 58 Ca -0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 1ken n LYS 58 Cb 0.22 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.27 1ken n LYS 58 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ken n THR 59 N 0.00 0.00 -1.53 -0.18 -2.24 -1.26 -4.99 114.28 104.08 1ken n THR 59 Ca 0.00 -0.02 -0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1ken n THR 59 Cb 0.00 -0.14 -0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1ken n THR 59 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ken n ASN 60 N 1.89 -1.96 -3.57 3.42 2.85 -1.26 -5.11 115.26 111.52 1ken n ASN 60 Ca 0.01 0.03 -0.26 0.00 -0.11 0.00 0.00 54.58 54.25 1ken n ASN 60 Cb 0.24 -1.10 -0.16 0.00 1.24 0.00 0.00 39.78 40.00 1ken n ASN 60 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1ken s GLU 61 N -0.99 0.12 -0.06 1.20 2.12 -1.26 -5.14 118.70 114.70 1ken s GLU 61 Ca -0.01 -0.22 0.03 0.00 0.36 0.00 0.00 54.97 55.14 1ken s GLU 61 Cb 0.00 -1.52 0.01 0.00 0.26 0.00 0.00 34.13 32.87 1ken s GLU 61 CO 0.02 -0.80 -0.15 0.15 -0.54 0.00 0.00 175.26 173.93 1ken s LYS 62 N 2.15 1.90 0.00 4.30 -0.14 -1.26 -5.12 119.74 121.57 1ken s LYS 62 Ca 0.05 -0.54 0.00 0.00 -1.36 0.00 0.00 55.97 54.12 1ken s LYS 62 Cb -0.16 -1.56 0.00 0.00 -1.68 0.00 0.00 37.83 34.43 1ken s LYS 62 CO -0.20 0.12 0.00 1.19 -0.76 0.00 0.00 175.35 175.71 1ken n PHE 63 N 3.53 0.00 -2.77 3.18 3.01 -1.26 -4.96 117.46 118.20 1ken n PHE 63 Ca -0.21 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.83 1ken n PHE 63 Cb 0.52 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 1ken n PHE 63 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1ken s HIS 64 N 0.26 3.39 0.00 1.38 2.46 -1.26 -5.00 115.29 116.52 1ken s HIS 64 Ca 0.00 1.38 0.00 0.00 0.47 0.00 0.00 55.06 56.91 1ken s HIS 64 Cb 0.00 -3.14 0.00 0.00 -0.13 0.00 0.00 32.58 29.31 1ken s HIS 64 CO 0.00 -0.35 0.00 1.04 -2.47 0.00 0.00 174.74 172.96 1ken n GLN 65 N 5.69 3.33 -3.93 2.88 6.02 -1.26 -5.15 117.38 124.96 1ken n GLN 65 Ca 0.08 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.79 1ken n GLN 65 Cb 0.48 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.70 1ken n GLN 65 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1ken s ILE 66 N 1.86 5.36 1.09 5.09 -4.36 -1.26 -5.10 121.20 123.88 1ken s ILE 66 Ca 0.00 -0.53 -0.16 0.00 -0.26 0.00 0.00 60.65 59.70 1ken s ILE 66 Cb 0.00 -3.69 0.23 0.00 1.25 0.00 0.00 42.46 40.26 1ken s ILE 66 CO 0.00 0.02 1.12 -1.61 0.24 0.00 0.00 174.94 174.71 1ken s GLU 67 N -2.87 -0.28 0.00 0.37 0.41 -1.26 -5.00 118.70 110.06 1ken s GLU 67 Ca 0.35 0.17 0.00 0.00 -0.41 0.00 0.00 54.97 55.08 1ken s GLU 67 Cb -0.12 -1.68 0.00 0.00 -1.78 0.00 0.00 34.13 30.55 1ken s GLU 67 CO 0.28 -3.13 0.00 1.63 -0.49 0.00 0.00 175.26 173.55 1ken n LYS 68 N -4.40 0.00 -4.71 1.61 5.02 -1.26 -4.96 118.16 109.47 1ken n LYS 68 Ca 0.09 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.10 1ken n LYS 68 Cb 0.59 -0.18 -0.14 0.00 -0.02 0.00 0.00 35.03 35.28 1ken n LYS 68 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ken s GLU 69 N 0.00 1.56 -0.02 1.97 2.02 -1.26 -5.04 118.70 117.93 1ken s GLU 69 Ca 0.00 -1.09 0.02 0.00 0.02 0.00 0.00 54.97 53.92 1ken s GLU 69 Cb 0.00 -1.77 0.01 0.00 0.10 0.00 0.00 34.13 32.47 1ken s GLU 69 CO 0.00 0.45 -0.06 -0.06 0.02 0.00 0.00 175.26 175.61 1ken s PHE 70 N -0.86 0.72 0.08 1.61 2.99 -1.26 -5.05 117.98 116.20 1ken s PHE 70 Ca 0.10 -0.17 -0.13 0.00 0.00 0.00 0.00 56.93 56.73 1ken s PHE 70 Cb -0.10 -0.54 -0.23 0.00 0.00 0.00 0.00 43.02 42.15 1ken s PHE 70 CO 0.03 -0.09 1.19 0.66 -0.00 0.00 0.00 175.22 177.00 1ken h SER 71 N 6.51 0.87 -4.27 1.36 4.64 -2.06 -3.47 113.55 117.12 1ken h SER 71 Ca -0.34 -0.72 -0.32 0.00 -0.47 0.00 0.00 61.79 59.95 1ken h SER 71 Cb 1.17 -0.27 -0.17 0.00 -0.31 0.00 0.00 62.40 62.82 1ken h SER 71 CO 0.49 1.52 -0.73 -1.61 -0.87 0.00 0.00 176.83 175.63 1ken s GLU 72 N -3.26 0.91 -0.39 4.77 8.01 -1.26 -5.11 118.70 122.37 1ken s GLU 72 Ca -0.09 -1.24 -0.28 0.00 0.01 0.00 0.00 54.97 53.37 1ken s GLU 72 Cb 0.07 -0.56 -0.03 0.00 -4.31 0.00 0.00 34.13 29.29 1ken s GLU 72 CO 0.92 0.08 1.99 0.08 0.01 0.00 0.00 175.26 178.34 1ken s VAL 73 N -2.69 3.29 -0.05 2.63 1.01 -1.26 -4.86 120.40 118.47 1ken s VAL 73 Ca 0.09 0.26 0.14 0.00 0.00 0.00 0.00 61.98 62.47 1ken s VAL 73 Cb -0.01 -3.48 -0.21 0.00 0.00 0.00 0.00 36.38 32.68 1ken s VAL 73 CO 0.00 -0.37 0.31 -0.62 0.00 0.00 0.00 175.10 174.43 1ken n GLU 74 N 8.73 0.51 -1.56 2.72 1.02 -1.26 -5.12 120.64 125.69 1ken n GLU 74 Ca 0.26 -0.12 0.03 0.00 -0.02 0.00 0.00 57.16 57.31 1ken n GLU 74 Cb 0.49 -1.32 -0.02 0.00 -0.02 0.00 0.00 31.44 30.57 1ken n GLU 74 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ken n GLY 75 N 1.70 -3.78 7.00 0.62 0.00 -1.26 -4.76 105.19 104.71 1ken n GLY 75 Ca -0.02 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1ken n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ken n ARG 76 N -2.96 0.00 -0.10 1.61 3.00 -1.26 -3.47 116.66 113.48 1ken n ARG 76 Ca -0.02 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.88 1ken n ARG 76 Cb 0.51 0.00 0.10 0.00 0.00 0.00 0.00 32.46 33.07 1ken n ARG 76 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1ken n ILE 77 N 0.00 -0.12 0.00 5.15 2.08 -1.26 0.21 119.36 125.42 1ken n ILE 77 Ca 0.00 0.62 -0.00 0.00 0.56 0.00 0.00 62.75 63.93 1ken n ILE 77 Cb 0.00 -0.92 -0.00 0.00 -0.75 0.00 0.00 39.64 37.97 1ken n ILE 77 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 1ken h GLN 78 N 0.00 -0.01 -0.62 0.38 5.75 -1.86 0.44 115.11 119.20 1ken h GLN 78 Ca 0.18 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.76 1ken h GLN 78 Cb 0.40 0.00 -0.09 0.00 1.07 0.00 0.00 27.48 28.87 1ken h GLN 78 CO -0.26 -0.00 -0.31 -0.25 -2.65 0.00 0.00 178.83 175.36 1ken n ASP 79 N -2.11 -0.54 0.17 -0.69 10.43 0.56 -1.28 116.55 123.09 1ken n ASP 79 Ca -0.00 1.09 -0.09 0.00 2.57 0.00 0.00 54.79 58.36 1ken n ASP 79 Cb 0.00 -0.19 -0.05 0.00 1.84 0.00 0.00 41.12 42.73 1ken n ASP 79 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1ken h LEU 80 N 0.00 -0.61 -1.48 0.64 5.85 -1.07 -0.95 115.31 117.69 1ken h LEU 80 Ca 0.15 0.04 0.43 0.00 0.84 0.00 0.00 57.88 59.34 1ken h LEU 80 Cb 0.30 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 1ken h LEU 80 CO -0.59 -0.33 1.31 -0.62 -0.34 0.00 0.00 178.44 177.86 1ken n GLU 81 N -3.75 0.01 0.00 1.25 1.02 0.15 -0.60 120.64 118.72 1ken n GLU 81 Ca -0.06 1.04 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 1ken n GLU 81 Cb 0.23 -2.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.15 1ken n GLU 81 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ken n LYS 82 N -3.54 0.00 0.24 3.49 4.76 -0.56 -3.39 118.16 119.16 1ken n LYS 82 Ca 0.33 0.10 0.03 0.00 -2.87 0.00 0.00 58.31 55.90 1ken n LYS 82 Cb 1.75 -0.60 0.04 0.00 -1.84 0.00 0.00 35.03 34.39 1ken n LYS 82 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1ken n TYR 83 N -0.83 0.00 0.01 2.13 9.36 -0.47 -0.07 117.16 127.29 1ken n TYR 83 Ca 0.00 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.16 1ken n TYR 83 Cb 0.00 -0.03 -0.04 0.00 -0.63 0.00 0.00 39.34 38.64 1ken n TYR 83 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1ken h VAL 84 N 0.00 0.43 0.34 2.97 2.07 -0.97 -2.68 116.25 118.41 1ken h VAL 84 Ca 0.05 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 1ken h VAL 84 Cb 1.85 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1ken h VAL 84 CO -0.00 0.13 -0.16 -0.08 0.02 0.00 0.00 177.57 177.48 1ken h GLU 85 N -1.00 -0.44 -0.41 1.57 4.57 -0.49 -2.58 114.58 115.79 1ken h GLU 85 Ca -0.01 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.25 1ken h GLU 85 Cb 0.32 0.10 -0.09 0.00 -0.16 0.00 0.00 28.75 28.93 1ken h GLU 85 CO 0.02 -0.22 -0.52 0.22 -1.18 0.00 0.00 179.01 177.33 1ken h ASP 86 N -0.58 -1.73 -0.83 1.04 3.58 -0.76 0.26 116.42 117.40 1ken h ASP 86 Ca -0.05 0.24 0.20 0.00 0.42 0.00 0.00 57.03 57.84 1ken h ASP 86 Cb 0.43 0.72 -0.15 0.00 1.72 0.00 0.00 39.33 42.06 1ken h ASP 86 CO 0.08 -0.40 0.04 0.74 -2.88 0.00 0.00 179.24 176.82 1ken h THR 87 N -0.38 0.26 0.00 2.25 2.02 -1.35 -1.76 112.91 113.95 1ken h THR 87 Ca 0.09 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.24 1ken h THR 87 Cb 0.60 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1ken h THR 87 CO -0.59 0.02 0.00 1.17 0.37 0.00 0.00 175.52 176.49 1ken n LYS 88 N -5.36 0.00 -0.23 6.66 4.81 0.86 -1.10 118.16 123.80 1ken n LYS 88 Ca 0.17 0.50 -0.06 0.00 -0.87 0.00 0.00 58.31 58.05 1ken n LYS 88 Cb 0.57 -1.26 -0.05 0.00 0.02 0.00 0.00 35.03 34.31 1ken n LYS 88 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1ken n ILE 89 N -1.64 -0.37 -0.32 3.15 -0.00 -0.75 0.17 119.36 119.59 1ken n ILE 89 Ca 0.00 1.48 -0.11 0.00 -0.00 0.00 0.00 62.75 64.12 1ken n ILE 89 Cb 0.00 -1.85 -0.09 0.00 -0.00 0.00 0.00 39.64 37.71 1ken n ILE 89 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 1ken h ASP 90 N 0.00 -1.98 0.00 4.38 5.19 -1.06 0.38 116.42 123.33 1ken h ASP 90 Ca 0.09 0.30 0.00 0.00 -0.62 0.00 0.00 57.03 56.79 1ken h ASP 90 Cb 0.22 0.87 0.00 0.00 0.18 0.00 0.00 39.33 40.60 1ken h ASP 90 CO -0.51 -0.29 0.00 0.18 -3.12 0.00 0.00 179.24 175.50 1ken n LEU 91 N -5.31 0.00 -0.24 1.55 4.77 0.13 -2.41 117.00 115.48 1ken n LEU 91 Ca 0.01 0.77 0.22 0.00 -0.03 0.00 0.00 56.01 56.98 1ken n LEU 91 Cb 0.30 -0.27 0.37 0.00 -2.33 0.00 0.00 43.42 41.49 1ken n LEU 91 CO -0.10 -0.27 0.67 0.79 -1.33 0.00 0.00 177.39 177.15 1ken n TRP 92 N -1.46 0.48 -0.03 -1.77 7.02 -0.61 0.12 117.44 121.19 1ken n TRP 92 Ca 0.00 0.49 -0.12 0.00 -1.02 0.00 0.00 57.50 56.85 1ken n TRP 92 Cb 0.00 -0.88 -0.07 0.00 -2.42 0.00 0.00 31.31 27.94 1ken n TRP 92 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 1ken h SER 93 N 0.00 0.17 -0.85 -0.99 0.02 -0.56 0.43 113.55 111.76 1ken h SER 93 Ca 0.50 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1ken h SER 93 Cb 1.52 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.98 1ken h SER 93 CO -0.32 0.40 0.45 0.22 -1.14 0.00 0.00 176.83 176.44 1ken h TYR 94 N -0.08 1.19 -0.49 3.45 3.20 0.11 0.73 116.97 125.09 1ken h TYR 94 Ca 0.03 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.87 1ken h TYR 94 Cb 0.31 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 1ken h TYR 94 CO 0.02 0.84 0.32 -0.91 -1.64 0.00 0.00 178.16 176.80 1ken h ASN 95 N 1.20 0.53 0.06 -2.11 4.21 -0.92 -3.16 115.58 115.40 1ken h ASN 95 Ca 0.30 -0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.79 1ken h ASN 95 Cb 0.06 -0.13 0.00 0.00 -1.12 0.00 0.00 38.32 37.13 1ken h ASN 95 CO -0.04 0.38 -0.03 0.00 -1.29 0.00 0.00 177.43 176.45 1ken h ALA 96 N 1.70 -0.23 0.00 -0.83 0.00 0.61 -2.74 119.26 117.77 1ken h ALA 96 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ken h ALA 96 Cb -0.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ken h ALA 96 CO -0.04 -0.23 0.00 0.39 0.00 0.00 0.00 179.25 179.37 1ken n GLU 97 N -2.86 0.00 0.00 0.00 -0.58 0.24 0.76 120.64 118.20 1ken n GLU 97 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1ken n GLU 97 Cb 0.03 -0.88 0.00 0.00 -0.57 0.00 0.00 31.44 30.02 1ken n GLU 97 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1ken n LEU 98 N -0.04 0.27 -0.46 -4.62 0.00 -1.20 -4.39 117.00 106.56 1ken n LEU 98 Ca 0.00 0.00 0.39 0.00 0.00 0.00 0.00 56.01 56.40 1ken n LEU 98 Cb 0.00 0.00 0.66 0.00 0.00 0.00 0.00 43.42 44.08 1ken n LEU 98 CO 0.00 -0.15 1.23 0.25 0.00 0.00 0.00 177.39 178.72 1ken h LEU 99 N 0.00 0.22 0.07 -1.96 5.85 0.66 0.16 115.31 120.32 1ken h LEU 99 Ca 0.00 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1ken h LEU 99 Cb 0.17 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1ken h LEU 99 CO 0.00 -0.23 -0.03 -0.37 -0.34 0.00 0.00 178.44 177.47 1ken h VAL 100 N 0.04 0.00 -0.60 1.05 -1.51 -1.77 -1.89 116.25 111.57 1ken h VAL 100 Ca 0.85 -0.05 0.10 0.00 -1.23 0.00 0.00 66.70 66.37 1ken h VAL 100 Cb 2.71 0.00 -0.10 0.00 -2.13 0.00 0.00 31.29 31.76 1ken h VAL 100 CO -0.45 0.00 -0.21 0.00 -1.23 0.00 0.00 177.57 175.68 1ken n ALA 101 N -2.09 -0.01 -1.00 5.19 0.00 0.43 0.20 120.51 123.22 1ken n ALA 101 Ca -0.01 0.62 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1ken n ALA 101 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1ken n ALA 101 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ken n LEU 102 N -4.92 0.00 -0.10 0.00 4.77 -0.33 -1.04 117.00 115.39 1ken n LEU 102 Ca 0.07 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.14 1ken n LEU 102 Cb 0.26 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.51 1ken n LEU 102 CO -0.08 0.00 0.30 -0.62 -1.33 0.00 0.00 177.39 175.66 1ken n GLU 103 N 0.00 -0.02 0.05 3.23 -0.58 -0.71 0.97 120.64 123.58 1ken n GLU 103 Ca 0.00 0.41 -0.12 0.00 -0.42 0.00 0.00 57.16 57.03 1ken n GLU 103 Cb 0.00 -0.72 -0.09 0.00 -0.57 0.00 0.00 31.44 30.06 1ken n GLU 103 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 1ken h ASN 104 N 0.00 -0.15 -0.00 1.62 -1.24 0.21 -0.53 115.58 115.48 1ken h ASN 104 Ca 0.24 -0.36 0.02 0.00 0.71 0.00 0.00 56.30 56.91 1ken h ASN 104 Cb 0.62 0.04 -0.03 0.00 0.73 0.00 0.00 38.32 39.68 1ken h ASN 104 CO -0.23 0.32 -0.15 -0.61 -1.29 0.00 0.00 177.43 175.47 1ken h GLN 105 N -0.68 -0.23 0.00 6.67 5.75 0.23 -1.92 115.11 124.93 1ken h GLN 105 Ca -0.02 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1ken h GLN 105 Cb 0.51 0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.11 1ken h GLN 105 CO 0.03 -0.16 0.00 1.58 -2.65 0.00 0.00 178.83 177.64 1ken n HIS 106 N -5.28 0.08 -0.07 3.99 -0.00 -0.89 -1.63 115.22 111.43 1ken n HIS 106 Ca -0.05 0.03 -0.11 0.00 0.46 0.00 0.00 57.72 58.05 1ken n HIS 106 Cb 0.20 -0.55 0.02 0.00 -0.12 0.00 0.00 29.99 29.54 1ken n HIS 106 CO 0.00 0.00 0.00 1.15 0.46 0.00 0.00 176.34 177.95 1ken h THR 107 N 0.00 1.28 0.73 3.57 2.02 -0.26 -3.21 112.91 117.04 1ken h THR 107 Ca 0.00 -1.60 -0.04 0.00 0.77 0.00 0.00 66.41 65.55 1ken h THR 107 Cb 0.27 1.48 0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1ken h THR 107 CO 0.00 0.52 -0.35 0.40 0.37 0.00 0.00 175.52 176.46 1ken h ILE 108 N 0.64 0.00 0.00 3.11 2.04 -1.18 -2.86 117.51 119.26 1ken h ILE 108 Ca 0.05 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1ken h ILE 108 Cb 0.98 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1ken h ILE 108 CO 0.09 0.00 0.00 0.47 0.00 0.00 0.00 178.15 178.71 1ken n ASP 109 N -4.90 0.02 -0.04 1.72 8.00 -1.15 0.12 116.55 120.33 1ken n ASP 109 Ca -0.12 -0.44 -0.01 0.00 0.71 0.00 0.00 54.79 54.93 1ken n ASP 109 Cb 0.38 -0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.37 1ken n ASP 109 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1ken n LEU 110 N -0.40 0.00 -0.02 0.64 -0.00 -1.10 -4.17 117.00 111.95 1ken n LEU 110 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 55.80 1ken n LEU 110 Cb 0.01 0.18 -0.13 0.00 -0.00 0.00 0.00 43.42 43.47 1ken n LEU 110 CO 0.00 0.18 -0.50 0.71 -0.00 0.00 0.00 177.39 177.78 1ken h THR 111 N 0.00 0.95 0.00 1.96 1.35 0.11 -3.27 112.91 114.00 1ken h THR 111 Ca -0.20 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.33 1ken h THR 111 Cb 1.28 2.57 0.00 0.00 -1.73 0.00 0.00 68.15 70.28 1ken h THR 111 CO 0.01 0.65 0.00 -0.67 -0.25 0.00 0.00 175.52 175.26 1ken n ASP 112 N -3.98 0.92 -0.02 5.36 2.03 0.38 -2.48 116.55 118.76 1ken n ASP 112 Ca -0.28 -1.01 -0.06 0.00 0.52 0.00 0.00 54.79 53.96 1ken n ASP 112 Cb 0.86 -0.25 -0.02 0.00 -0.72 0.00 0.00 41.12 40.99 1ken n ASP 112 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1ken n SER 113 N 0.45 1.23 -0.33 1.67 2.88 -1.23 -4.25 113.62 114.04 1ken n SER 113 Ca 0.00 0.19 0.17 0.00 -1.33 0.00 0.00 58.87 57.90 1ken n SER 113 Cb 0.18 -0.44 0.41 0.00 -0.75 0.00 0.00 64.21 63.61 1ken n SER 113 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1ken h GLU 114 N -0.39 0.57 0.00 -1.46 4.39 -1.59 -2.48 114.58 113.62 1ken h GLU 114 Ca -0.09 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1ken h GLU 114 Cb 0.65 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1ken h GLU 114 CO -0.05 0.37 0.00 -0.12 -1.16 0.00 0.00 179.01 178.05 1ken n MET 115 N -4.72 0.00 0.00 2.33 1.56 -1.23 -2.90 117.12 112.17 1ken n MET 115 Ca 0.24 0.04 0.00 0.00 -0.27 0.00 0.00 57.70 57.71 1ken n MET 115 Cb 0.71 -0.77 0.00 0.00 2.15 0.00 0.00 33.22 35.31 1ken n MET 115 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1ken n ASN 116 N -0.31 0.00 -0.48 6.12 5.15 -1.02 0.13 115.26 124.86 1ken n ASN 116 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1ken n ASN 116 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1ken n ASN 116 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1ken n LYS 117 N 0.33 0.00 0.03 1.20 5.02 -0.96 -4.57 118.16 119.20 1ken n LYS 117 Ca 0.00 -0.83 0.00 0.00 -2.02 0.00 0.00 58.31 55.46 1ken n LYS 117 Cb 0.00 -0.42 0.00 0.00 -0.02 0.00 0.00 35.03 34.59 1ken n LYS 117 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ken n LEU 118 N 0.00 0.20 -0.14 -0.35 7.94 0.34 -4.42 117.00 120.58 1ken n LEU 118 Ca 0.00 0.11 -0.08 0.00 -1.11 0.00 0.00 56.01 54.93 1ken n LEU 118 Cb 0.66 -0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.62 1ken n LEU 118 CO 0.00 -0.42 1.05 2.19 -1.11 0.00 0.00 177.39 179.10 1ken h PHE 119 N 0.00 0.53 0.00 1.96 -5.15 -1.86 1.01 116.94 113.43 1ken h PHE 119 Ca 0.00 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.78 1ken h PHE 119 Cb 0.36 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 36.35 1ken h PHE 119 CO 0.00 0.33 0.00 0.39 -2.00 0.00 0.00 178.31 177.03 1ken n GLU 120 N -4.79 0.23 -0.03 6.09 -0.58 -1.26 -0.45 120.64 119.85 1ken n GLU 120 Ca 0.01 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.70 1ken n GLU 120 Cb 0.02 -1.16 -0.03 0.00 -0.57 0.00 0.00 31.44 29.70 1ken n GLU 120 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1ken n LYS 121 N -0.66 0.17 -0.25 3.49 4.81 0.32 -4.50 118.16 121.52 1ken n LYS 121 Ca 0.02 0.04 -0.07 0.00 -0.87 0.00 0.00 58.31 57.43 1ken n LYS 121 Cb 0.01 -1.12 0.05 0.00 0.02 0.00 0.00 35.03 33.99 1ken n LYS 121 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1ken h THR 122 N -0.01 1.26 -0.11 3.15 1.35 -0.04 -2.45 112.91 116.06 1ken h THR 122 Ca -0.15 -0.90 -0.68 0.00 -0.55 0.00 0.00 66.41 64.12 1ken h THR 122 Cb 1.23 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1ken h THR 122 CO -0.03 0.35 3.60 -1.14 -0.25 0.00 0.00 175.52 178.05 1ken n ARG 123 N -4.29 3.61 0.12 4.72 0.00 0.41 -3.09 116.66 118.13 1ken n ARG 123 Ca 0.05 -2.39 0.00 0.00 -0.00 0.00 0.00 57.85 55.51 1ken n ARG 123 Cb 0.23 -2.88 0.00 0.00 0.00 0.00 0.00 32.46 29.81 1ken n ARG 123 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1ken n ARG 124 N 3.93 0.00 0.00 -0.14 3.00 -0.95 -4.80 116.66 117.70 1ken n ARG 124 Ca 0.72 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 58.66 1ken n ARG 124 Cb 0.26 0.00 0.51 0.00 0.00 0.00 0.00 32.46 33.24 1ken n ARG 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ken n GLN 125 N -3.13 0.50 -3.65 -0.14 10.64 -1.03 -4.54 117.38 116.04 1ken n GLN 125 Ca 0.00 0.02 -0.20 0.00 -1.83 0.00 0.00 57.00 54.99 1ken n GLN 125 Cb 0.00 -1.50 -0.17 0.00 -0.86 0.00 0.00 30.24 27.71 1ken n GLN 125 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1ken s LEU 126 N -2.11 0.12 0.00 2.61 0.05 -1.20 -4.07 118.68 114.08 1ken s LEU 126 Ca 0.25 -0.03 0.00 0.00 0.05 0.00 0.00 54.13 54.40 1ken s LEU 126 Cb 0.12 -0.04 0.00 0.00 -2.05 0.00 0.00 46.19 44.22 1ken s LEU 126 CO 0.22 -0.27 0.00 0.54 -0.55 0.00 0.00 176.35 176.28 1ken n ARG 127 N 5.30 0.00 0.00 1.48 1.74 -1.26 -4.60 116.66 119.32 1ken n ARG 127 Ca -0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1ken n ARG 127 Cb 0.50 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.94 1ken n ARG 127 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1ken n GLU 128 N 0.00 0.97 0.00 5.56 -0.58 -1.26 -3.83 120.64 121.50 1ken n GLU 128 Ca 0.00 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.84 1ken n GLU 128 Cb 0.00 -1.39 0.57 0.00 -0.57 0.00 0.00 31.44 30.06 1ken n GLU 128 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1ken n ASN 129 N 0.12 0.00 0.00 1.62 4.13 -1.26 -4.73 115.26 115.13 1ken n ASN 129 Ca 0.00 -0.32 0.00 0.00 1.68 0.00 0.00 54.58 55.94 1ken n ASN 129 Cb 0.29 -0.15 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 1ken n ASN 129 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ken n ALA 130 N -1.15 0.00 -3.31 5.41 0.00 -1.25 -3.70 120.51 116.51 1ken n ALA 130 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.44 1ken n ALA 130 Cb 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.43 1ken n ALA 130 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ken s GLU 131 N -2.01 0.06 -0.88 0.00 -6.30 0.00 -4.93 118.70 104.63 1ken s GLU 131 Ca 0.00 0.18 -0.21 0.00 -2.50 0.00 0.00 54.97 52.44 1ken s GLU 131 Cb 0.00 -0.08 -0.23 0.00 0.00 0.00 0.00 34.13 33.83 1ken s GLU 131 CO 0.00 -0.08 2.39 -1.91 0.02 0.00 0.00 175.26 175.67 1ken n GLU 132 N 3.57 0.27 -0.98 4.30 2.13 -1.26 -0.31 120.64 128.35 1ken n GLU 132 Ca -0.19 -0.19 -0.19 0.00 0.66 0.00 0.00 57.16 57.25 1ken n GLU 132 Cb 0.56 -2.07 -0.13 0.00 0.27 0.00 0.00 31.44 30.07 1ken n GLU 132 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 1ken n MET 133 N 7.48 0.00 0.00 5.31 0.00 0.74 -3.37 117.12 127.28 1ken n MET 133 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 58.29 1ken n MET 133 Cb 0.23 -0.79 0.00 0.00 0.00 0.00 0.00 33.22 32.67 1ken n MET 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ken n GLY 134 N 3.87 0.87 3.26 -5.12 0.00 -1.26 -4.44 105.19 102.37 1ken n GLY 134 Ca 0.44 0.41 -0.13 0.00 0.00 0.00 0.00 46.02 46.74 1ken n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ken s ASN 135 N -4.00 0.38 0.00 1.61 4.22 -1.22 -4.99 114.94 110.95 1ken s ASN 135 Ca 0.00 -1.40 0.00 0.00 -2.14 0.00 0.00 52.86 49.32 1ken s ASN 135 Cb 0.00 0.44 0.00 0.00 1.28 0.00 0.00 41.25 42.97 1ken s ASN 135 CO 0.00 -0.92 0.00 0.61 -2.04 0.00 0.00 177.10 174.75 1ken n GLY 136 N -0.34 2.05 3.96 0.45 0.00 -1.26 -4.83 105.19 105.22 1ken n GLY 136 Ca 0.02 0.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 1ken n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ken n PHE 138 N -2.53 -2.39 -3.59 0.00 3.72 -1.26 -0.18 117.46 111.23 1ken n PHE 138 Ca 0.08 -1.90 -0.25 0.00 -0.05 0.00 0.00 57.45 55.33 1ken n PHE 138 Cb 0.60 -0.51 -0.16 0.00 -0.94 0.00 0.00 39.48 38.47 1ken n PHE 138 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1ken s LYS 139 N -4.41 0.09 0.11 -1.08 2.47 0.57 -3.34 119.74 114.16 1ken s LYS 139 Ca 0.55 -0.07 0.02 0.00 -1.56 0.00 0.00 55.97 54.91 1ken s LYS 139 Cb -0.04 -1.70 -0.04 0.00 -1.46 0.00 0.00 37.83 34.59 1ken s LYS 139 CO 0.35 -0.69 0.20 0.42 0.16 0.00 0.00 175.35 175.79 1ken s ILE 140 N 2.16 5.07 -0.06 5.43 1.09 -1.26 -0.82 121.20 132.82 1ken s ILE 140 Ca 0.03 -0.68 0.13 0.00 -1.10 0.00 0.00 60.65 59.04 1ken s ILE 140 Cb -0.16 -3.54 -0.20 0.00 -1.06 0.00 0.00 42.46 37.50 1ken s ILE 140 CO -0.11 0.01 0.22 -1.22 -0.10 0.00 0.00 174.94 173.73 1ken n TYR 141 N -0.10 0.00 -2.96 3.97 4.02 -1.24 -5.01 117.16 115.84 1ken n TYR 141 Ca -0.07 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.54 1ken n TYR 141 Cb 0.53 -0.44 -0.02 0.00 -0.02 0.00 0.00 39.34 39.39 1ken n TYR 141 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1ken s HIS 142 N -2.76 3.51 -1.26 -0.72 3.76 -1.26 -4.88 115.29 111.68 1ken s HIS 142 Ca -0.06 0.79 -0.10 0.00 -0.15 0.00 0.00 55.06 55.55 1ken s HIS 142 Cb 0.07 -2.25 0.17 0.00 1.11 0.00 0.00 32.58 31.68 1ken s HIS 142 CO 0.58 -0.07 1.78 1.63 -0.85 0.00 0.00 174.74 177.81 1ken n LYS 143 N -1.57 3.60 -2.95 1.40 4.01 -1.26 -4.98 118.16 116.41 1ken n LYS 143 Ca -0.00 -3.62 -0.39 0.00 -0.51 0.00 0.00 58.31 53.80 1ken n LYS 143 Cb 0.55 -2.94 -0.06 0.00 -0.51 0.00 0.00 35.03 32.07 1ken n LYS 143 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ken n ASP 145 N 1.30 0.46 -0.37 0.00 5.75 -1.26 -3.97 116.55 118.45 1ken n ASP 145 Ca -0.04 -2.78 0.34 0.00 -0.01 0.00 0.00 54.79 52.29 1ken n ASP 145 Cb 0.49 1.06 0.59 0.00 -1.03 0.00 0.00 41.12 42.23 1ken n ASP 145 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1ken n ASN 146 N -1.75 0.25 -0.07 -1.12 6.94 -1.26 0.15 115.26 118.40 1ken n ASN 146 Ca -0.00 1.40 -0.12 0.00 -0.02 0.00 0.00 54.58 55.83 1ken n ASN 146 Cb 0.50 -0.68 -0.09 0.00 -2.36 0.00 0.00 39.78 37.14 1ken n ASN 146 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ken h ALA 147 N 1.65 0.06 -0.20 -2.53 0.00 -2.01 -3.32 119.26 112.91 1ken h ALA 147 Ca 0.80 -0.56 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1ken h ALA 147 Cb 2.36 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 20.36 1ken h ALA 147 CO -0.56 0.20 0.21 0.00 0.00 0.00 0.00 179.25 179.10 1ken h ILE 149 N 0.00 1.05 0.00 0.00 1.08 0.13 -2.85 117.51 116.93 1ken h ILE 149 Ca 0.09 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 1ken h ILE 149 Cb 0.51 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 1ken h ILE 149 CO -0.00 0.11 0.00 1.21 -0.69 0.00 0.00 178.15 178.78 1ken n GLU 150 N -4.80 0.00 0.00 2.37 4.07 -0.78 -2.47 120.64 119.04 1ken n GLU 150 Ca 0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 1ken n GLU 150 Cb 0.07 -1.22 0.00 0.00 -0.06 0.00 0.00 31.44 30.24 1ken n GLU 150 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1ken n SER 151 N 0.77 0.00 -0.11 4.31 3.41 -1.08 -4.24 113.62 116.69 1ken n SER 151 Ca 0.00 0.09 -0.14 0.00 -0.26 0.00 0.00 58.87 58.57 1ken n SER 151 Cb 0.00 -0.22 -0.02 0.00 -0.26 0.00 0.00 64.21 63.70 1ken n SER 151 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1ken h ILE 152 N 0.00 1.27 0.00 -1.33 2.04 -1.68 3.57 117.51 121.38 1ken h ILE 152 Ca 0.00 -1.61 0.00 0.00 1.00 0.00 0.00 64.86 64.25 1ken h ILE 152 Cb 0.00 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1ken h ILE 152 CO 0.00 0.53 0.00 -1.14 0.00 0.00 0.00 178.15 177.54 1ken n ARG 153 N -4.04 0.69 0.00 2.37 0.63 -1.11 -1.49 116.66 113.71 1ken n ARG 153 Ca -0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 1ken n ARG 153 Cb 0.57 -1.16 0.00 0.00 0.45 0.00 0.00 32.46 32.32 1ken n ARG 153 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1ken n ASN 154 N 1.12 0.00 -0.60 6.15 5.15 -1.06 -4.77 115.26 121.25 1ken n ASN 154 Ca 0.00 -0.16 -0.08 0.00 -0.60 0.00 0.00 54.58 53.74 1ken n ASN 154 Cb 0.34 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.56 1ken n ASN 154 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ken n GLY 155 N 0.00 0.92 2.96 8.20 0.00 0.11 -4.91 105.19 112.46 1ken n GLY 155 Ca 0.00 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1ken n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ken n THR 156 N -2.56 5.14 -3.68 2.61 -2.24 1.14 -4.93 114.28 109.76 1ken n THR 156 Ca -0.08 -5.90 -0.18 0.00 -2.27 0.00 0.00 64.05 55.63 1ken n THR 156 Cb 0.36 -2.07 -0.17 0.00 -2.10 0.00 0.00 70.33 66.36 1ken n THR 156 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ken s TYR 157 N -2.80 -0.06 -0.38 4.78 5.04 -1.23 -3.99 117.35 118.70 1ken s TYR 157 Ca 0.32 0.41 -0.18 0.00 -2.44 0.00 0.00 57.07 55.18 1ken s TYR 157 Cb 0.06 -0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.04 1ken s TYR 157 CO 0.10 -0.21 0.49 0.34 -1.34 0.00 0.00 175.55 174.93 1ken s ASP 158 N 2.03 6.26 0.00 4.32 -1.08 -1.26 -4.83 116.67 122.11 1ken s ASP 158 Ca 0.02 -0.29 0.24 0.00 -0.52 0.00 0.00 52.55 51.99 1ken s ASP 158 Cb -0.12 -2.25 1.08 0.00 -1.46 0.00 0.00 42.92 40.16 1ken s ASP 158 CO -0.04 -0.53 1.74 0.00 0.52 0.00 0.00 175.17 176.85 1ken n HIS 159 N 5.72 0.08 -0.07 -5.34 1.44 -1.26 -2.81 115.22 112.99 1ken n HIS 159 Ca -0.06 -0.04 -0.08 0.00 -2.01 0.00 0.00 57.72 55.54 1ken n HIS 159 Cb 0.48 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.57 1ken n HIS 159 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1ken n ASP 160 N -0.12 1.64 0.00 4.39 9.92 -1.26 -4.51 116.55 126.61 1ken n ASP 160 Ca 0.18 0.28 0.00 0.00 -0.53 0.00 0.00 54.79 54.72 1ken n ASP 160 Cb 0.26 -0.69 0.00 0.00 -0.64 0.00 0.00 41.12 40.04 1ken n ASP 160 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1ken n VAL 161 N -4.16 0.00 -0.79 2.53 0.31 -1.26 -3.67 118.33 111.30 1ken n VAL 161 Ca -0.12 1.17 -0.26 0.00 -0.01 0.00 0.00 64.34 65.12 1ken n VAL 161 Cb 0.43 -2.14 -0.03 0.00 -0.91 0.00 0.00 33.84 31.20 1ken n VAL 161 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ken n TYR 162 N -1.85 1.38 -0.04 3.52 9.36 -1.12 -4.18 117.16 124.24 1ken n TYR 162 Ca 0.00 -1.81 -0.03 0.00 3.32 0.00 0.00 57.90 59.37 1ken n TYR 162 Cb 0.00 -1.60 -0.06 0.00 -0.63 0.00 0.00 39.34 37.05 1ken n TYR 162 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1ken n ARG 163 N 4.99 2.54 0.00 2.98 0.63 -1.24 -4.65 116.66 121.90 1ken n ARG 163 Ca 0.43 -0.01 0.00 0.00 -0.92 0.00 0.00 57.85 57.35 1ken n ARG 163 Cb 0.19 -1.21 0.00 0.00 0.45 0.00 0.00 32.46 31.89 1ken n ARG 163 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 1ken n ASP 164 N -2.27 0.00 -4.57 6.15 5.68 -1.26 -2.92 116.55 117.37 1ken n ASP 164 Ca -0.12 0.00 -0.28 0.00 -0.50 0.00 0.00 54.79 53.89 1ken n ASP 164 Cb 0.73 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.66 1ken n ASP 164 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1ken s GLU 165 N -0.75 2.57 0.00 0.11 0.41 -1.26 -4.77 118.70 115.01 1ken s GLU 165 Ca 0.00 -0.63 0.00 0.00 -0.41 0.00 0.00 54.97 53.93 1ken s GLU 165 Cb 0.00 -5.14 0.00 0.00 -1.78 0.00 0.00 34.13 27.21 1ken s GLU 165 CO 0.00 -3.56 0.00 0.00 -0.49 0.00 0.00 175.26 171.21 1ken n ALA 166 N 13.98 0.00 -0.28 5.21 0.00 -1.15 -4.72 120.51 133.55 1ken n ALA 166 Ca 0.42 0.00 0.18 0.00 0.00 0.00 0.00 53.44 54.04 1ken n ALA 166 Cb 0.47 0.00 0.34 0.00 0.00 0.00 0.00 19.45 20.26 1ken n ALA 166 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1ken n LEU 167 N 0.00 0.06 0.00 0.00 -0.00 -1.26 -4.40 117.00 111.39 1ken n LEU 167 Ca 0.00 1.41 0.00 0.00 -0.00 0.00 0.00 56.01 57.42 1ken n LEU 167 Cb 0.00 -0.58 0.00 0.00 -0.00 0.00 0.00 43.42 42.84 1ken n LEU 167 CO 0.00 -1.49 0.00 -0.46 -0.00 0.00 0.00 177.39 175.44 1ken n ASN 168 N -5.09 0.00 0.07 1.45 0.23 -1.26 -2.12 115.26 108.55 1ken n ASN 168 Ca 0.25 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.30 1ken n ASN 168 Cb 0.82 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.52 1ken n ASN 168 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1ken n ASN 169 N 0.00 0.00 0.00 0.53 3.02 -1.26 -1.63 115.26 115.92 1ken n ASN 169 Ca 0.00 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1ken n ASN 169 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1ken n ASN 169 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ken n ARG 170 N -1.30 0.00 0.00 3.52 1.74 -0.90 -4.65 116.66 115.08 1ken n ARG 170 Ca 0.00 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.22 1ken n ARG 170 Cb 0.59 0.00 0.57 0.00 -1.02 0.00 0.00 32.46 32.60 1ken n ARG 170 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1ken n PHE 171 N 0.00 0.00 0.03 -1.55 -1.74 -1.18 -4.16 117.46 108.86 1ken n PHE 171 Ca 0.00 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.70 1ken n PHE 171 Cb 0.00 -0.20 -0.12 0.00 1.52 0.00 0.00 39.48 40.68 1ken n PHE 171 CO 0.00 0.00 0.00 0.37 -0.56 0.00 0.00 176.76 176.57 1ken h GLN 172 N 0.56 0.48 -6.90 3.97 5.75 -1.17 -3.46 115.11 114.33 1ken h GLN 172 Ca 0.00 -0.55 -0.53 0.00 -0.15 0.00 0.00 58.65 57.41 1ken h GLN 172 Cb 0.39 0.17 0.09 0.00 1.07 0.00 0.00 27.48 29.20 1ken h GLN 172 CO 0.00 1.20 0.73 0.96 -2.65 0.00 0.00 178.83 179.07 1ken s ILE 173 N -3.10 2.32 0.00 2.39 -4.36 -1.14 -4.84 121.20 112.46 1ken s ILE 173 Ca -0.12 0.32 -0.01 0.00 -0.26 0.00 0.00 60.65 60.57 1ken s ILE 173 Cb 0.04 -3.20 -0.01 0.00 1.25 0.00 0.00 42.46 40.54 1ken s ILE 173 CO 0.85 0.07 0.02 2.29 0.24 0.00 0.00 174.94 178.42 1ken n LYS 174 N 0.77 0.00 0.00 0.37 2.85 -1.26 -5.02 118.16 115.87 1ken n LYS 174 Ca 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 1ken n LYS 174 Cb 0.40 -0.04 0.00 0.00 -0.65 0.00 0.00 35.03 34.74 1ken n LYS 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76