#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kn9 h ALA 2 N 0.00 1.00 -3.42 3.04 0.00 -2.14 -3.41 119.26 114.33 2kn9 h ALA 2 Ca 0.00 -0.54 -0.69 0.00 0.00 0.00 0.00 54.91 53.68 2kn9 h ALA 2 Cb 0.00 -0.09 -0.32 0.00 0.00 0.00 0.00 17.79 17.38 2kn9 h ALA 2 CO 0.00 0.74 -0.68 -1.58 0.00 0.00 0.00 179.25 177.74 2kn9 s HIS 3 N -3.67 3.27 0.15 0.00 5.65 -1.26 -5.07 115.29 114.36 2kn9 s HIS 3 Ca -0.02 -1.78 -0.05 0.00 0.25 0.00 0.00 55.06 53.46 2kn9 s HIS 3 Cb 0.13 -2.16 -0.02 0.00 -1.18 0.00 0.00 32.58 29.34 2kn9 s HIS 3 CO 0.76 -0.79 0.18 -3.38 -0.65 0.00 0.00 174.74 170.86 2kn9 s HIS 4 N 1.28 0.62 0.35 3.88 -0.00 -1.26 -5.18 115.29 114.98 2kn9 s HIS 4 Ca -0.04 -0.99 -0.02 0.00 -0.00 0.00 0.00 55.06 54.01 2kn9 s HIS 4 Cb -0.20 -0.26 0.00 0.00 -0.00 0.00 0.00 32.58 32.12 2kn9 s HIS 4 CO -0.00 -0.63 0.47 -3.38 -0.00 0.00 0.00 174.74 171.20 2kn9 s HIS 5 N -4.01 1.12 0.49 0.38 -3.43 -1.26 -5.18 115.29 103.41 2kn9 s HIS 5 Ca 0.21 -1.33 0.06 0.00 -0.80 0.00 0.00 55.06 53.19 2kn9 s HIS 5 Cb 0.05 -0.12 0.00 0.00 -1.43 0.00 0.00 32.58 31.08 2kn9 s HIS 5 CO 0.01 -1.13 0.31 -1.01 -2.00 0.00 0.00 174.74 170.92 2kn9 s HIS 6 N -3.03 2.07 0.21 0.38 0.09 -1.26 -5.16 115.29 108.58 2kn9 s HIS 6 Ca 0.31 -0.73 -0.00 0.00 -0.00 0.00 0.00 55.06 54.64 2kn9 s HIS 6 Cb -0.00 -1.95 -0.04 0.00 -0.00 0.00 0.00 32.58 30.59 2kn9 s HIS 6 CO 0.21 -0.20 0.12 -3.38 -0.00 0.00 0.00 174.74 171.49 2kn9 s HIS 7 N -2.69 1.22 0.39 1.40 -0.00 -1.26 -5.15 115.29 109.21 2kn9 s HIS 7 Ca 0.36 -1.32 -0.23 0.00 -0.00 0.00 0.00 55.06 53.87 2kn9 s HIS 7 Cb -0.01 -0.63 -0.10 0.00 -0.00 0.00 0.00 32.58 31.84 2kn9 s HIS 7 CO 0.21 -0.56 0.96 -1.01 -0.00 0.00 0.00 174.74 174.34 2kn9 s HIS 8 N -4.05 3.43 -0.10 0.38 3.76 -1.26 -5.00 115.29 112.44 2kn9 s HIS 8 Ca 0.37 1.67 -0.26 0.00 -0.15 0.00 0.00 55.06 56.70 2kn9 s HIS 8 Cb 0.07 -2.90 -0.22 0.00 1.11 0.00 0.00 32.58 30.64 2kn9 s HIS 8 CO 0.12 -0.05 0.85 0.52 -0.85 0.00 0.00 174.74 175.33 2kn9 h MET 9 N 2.36 -0.02 0.00 1.40 0.00 -2.09 -3.50 114.93 113.09 2kn9 h MET 9 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.22 2kn9 h MET 9 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.79 2kn9 h MET 9 CO 0.62 0.76 0.00 0.41 0.00 0.00 0.00 176.91 178.70 2kn9 n GLY 10 N 1.22 0.52 3.08 8.32 0.00 -1.26 -5.14 105.19 111.92 2kn9 n GLY 10 Ca -0.09 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 2kn9 n GLY 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kn9 s THR 11 N -3.14 0.16 0.34 2.61 -4.23 -1.26 -5.18 115.64 104.95 2kn9 s THR 11 Ca 0.00 -1.33 0.05 0.00 -1.18 0.00 0.00 61.69 59.23 2kn9 s THR 11 Cb 0.00 -1.00 -0.07 0.00 1.34 0.00 0.00 72.50 72.77 2kn9 s THR 11 CO 0.00 -0.73 0.03 -0.76 -0.54 0.00 0.00 174.62 172.61 2kn9 s LEU 12 N -2.30 2.43 -0.41 4.79 1.43 -1.26 -5.07 118.68 118.28 2kn9 s LEU 12 Ca -0.03 -1.35 -0.27 0.00 -1.03 0.00 0.00 54.13 51.45 2kn9 s LEU 12 Cb 0.00 -0.58 -0.03 0.00 0.03 0.00 0.00 46.19 45.61 2kn9 s LEU 12 CO -0.06 -0.52 2.01 -1.61 0.23 0.00 0.00 176.35 176.40 2kn9 s GLU 13 N -3.81 2.87 0.00 1.70 8.01 -1.26 -4.81 118.70 121.40 2kn9 s GLU 13 Ca 0.35 1.32 0.25 0.00 0.01 0.00 0.00 54.97 56.90 2kn9 s GLU 13 Cb 0.08 -4.35 0.44 0.00 -4.31 0.00 0.00 34.13 25.99 2kn9 s GLU 13 CO 0.16 -2.41 1.37 0.00 0.01 0.00 0.00 175.26 174.38 2kn9 n ALA 14 N 12.29 3.51 -0.54 5.21 0.00 -1.26 -4.59 120.51 135.13 2kn9 n ALA 14 Ca 0.26 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2kn9 n ALA 14 Cb 0.49 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.91 2kn9 n ALA 14 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2kn9 n GLN 15 N -0.94 0.00 -4.13 0.00 1.13 -1.26 -4.89 117.38 107.29 2kn9 n GLN 15 Ca 0.09 0.23 -0.30 0.00 -1.94 0.00 0.00 57.00 55.07 2kn9 n GLN 15 Cb 0.36 -1.15 -0.04 0.00 0.11 0.00 0.00 30.24 29.52 2kn9 n GLN 15 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2kn9 n THR 16 N -1.19 -1.94 0.05 5.09 -2.24 -1.26 -4.87 114.28 107.91 2kn9 n THR 16 Ca 0.00 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.31 2kn9 n THR 16 Cb 0.00 -1.94 -0.09 0.00 -2.10 0.00 0.00 70.33 66.20 2kn9 n THR 16 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2kn9 h GLN 17 N -1.69 -0.10 0.00 -0.78 4.15 -2.00 -3.49 115.11 111.20 2kn9 h GLN 17 Ca -0.62 0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.80 2kn9 h GLN 17 Cb 1.38 0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.10 2kn9 h GLN 17 CO 0.70 0.20 0.00 0.41 -1.93 0.00 0.00 178.83 178.21 2kn9 n GLY 18 N -0.33 0.90 0.02 2.39 0.00 -1.26 -4.88 105.19 102.03 2kn9 n GLY 18 Ca -0.08 -1.87 0.14 0.00 0.00 0.00 0.00 46.02 44.20 2kn9 n GLY 18 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kn9 n PRO 19 N 0.00 0.15 0.00 1.61 -0.05 -1.26 -4.97 135.00 130.47 2kn9 n PRO 19 Ca 0.00 -0.04 0.00 0.00 -0.05 0.00 0.00 63.50 63.41 2kn9 n PRO 19 Cb 0.00 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 31.95 2kn9 n PRO 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 2kn9 n GLY 20 N 1.45 2.04 2.79 0.55 0.00 -1.26 -4.86 105.19 105.89 2kn9 n GLY 20 Ca 0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 46.02 45.65 2kn9 n GLY 20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kn9 n SER 21 N 3.85 -7.99 0.11 1.61 7.64 -1.26 -4.85 113.62 112.73 2kn9 n SER 21 Ca 0.00 1.04 0.12 0.00 1.01 0.00 0.00 58.87 61.03 2kn9 n SER 21 Cb 0.00 -5.31 0.11 0.00 -1.01 0.00 0.00 64.21 58.01 2kn9 n SER 21 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2kn9 h MET 22 N 2.61 0.00 -6.16 1.43 2.86 -1.98 -3.44 114.93 110.25 2kn9 h MET 22 Ca -0.01 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.11 2kn9 h MET 22 Cb 0.45 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 2kn9 h MET 22 CO 0.14 0.00 -0.31 -0.80 1.06 0.00 0.00 176.91 177.00 2kn9 s ASN 23 N -5.03 4.92 -1.07 1.22 -0.87 -1.26 -5.03 114.94 107.82 2kn9 s ASN 23 Ca 0.04 -0.93 -0.21 0.00 -1.57 0.00 0.00 52.86 50.18 2kn9 s ASN 23 Cb 0.10 -0.10 0.06 0.00 -0.02 0.00 0.00 41.25 41.29 2kn9 s ASN 23 CO 0.74 -0.91 1.48 -0.62 -2.57 0.00 0.00 177.10 175.21 2kn9 s ASP 24 N -4.26 6.59 0.24 -1.22 2.15 -1.26 -4.92 116.67 113.99 2kn9 s ASP 24 Ca 0.45 -1.72 0.06 0.00 0.43 0.00 0.00 52.55 51.77 2kn9 s ASP 24 Cb -0.03 -2.55 -0.05 0.00 -0.30 0.00 0.00 42.92 39.98 2kn9 s ASP 24 CO 0.27 -1.39 -0.06 -0.31 -0.17 0.00 0.00 175.17 173.51 2kn9 s TYR 25 N 4.57 1.74 0.25 -5.34 1.51 -1.26 -5.04 117.35 113.77 2kn9 s TYR 25 Ca 0.46 -0.75 0.09 0.00 -1.01 0.00 0.00 57.07 55.86 2kn9 s TYR 25 Cb 0.00 -0.96 -0.04 0.00 -0.11 0.00 0.00 41.96 40.85 2kn9 s TYR 25 CO -0.06 0.18 0.05 0.15 -1.11 0.00 0.00 175.55 174.75 2kn9 s LYS 26 N -3.76 2.47 -0.17 -0.62 -0.14 -1.26 -4.42 119.74 111.84 2kn9 s LYS 26 Ca 0.27 -1.27 -0.01 0.00 -1.36 0.00 0.00 55.97 53.59 2kn9 s LYS 26 Cb 0.04 -2.29 -0.01 0.00 -1.68 0.00 0.00 37.83 33.88 2kn9 s LYS 26 CO 0.09 0.39 -0.11 -1.17 -0.76 0.00 0.00 175.35 173.80 2kn9 s LEU 27 N -3.59 2.70 -0.36 3.17 0.20 -0.44 -1.38 118.68 118.99 2kn9 s LEU 27 Ca 0.31 -0.40 -0.13 0.00 0.69 0.00 0.00 54.13 54.61 2kn9 s LEU 27 Cb -0.07 -1.64 0.00 0.00 -0.43 0.00 0.00 46.19 44.05 2kn9 s LEU 27 CO 0.21 0.07 0.24 -0.36 -0.29 0.00 0.00 176.35 176.22 2kn9 s PHE 28 N 0.92 3.23 -0.24 5.38 0.40 0.26 0.65 117.98 128.58 2kn9 s PHE 28 Ca -0.02 -0.54 -0.10 0.00 -0.60 0.00 0.00 56.93 55.67 2kn9 s PHE 28 Cb -0.15 -2.48 -0.05 0.00 0.51 0.00 0.00 43.02 40.85 2kn9 s PHE 28 CO -0.00 -0.50 0.14 0.50 0.70 0.00 0.00 175.22 176.05 2kn9 s ARG 29 N 1.66 3.95 0.00 0.44 3.52 -0.14 -0.16 118.95 128.23 2kn9 s ARG 29 Ca 0.05 -0.33 -0.30 0.00 -0.13 0.00 0.00 55.73 55.02 2kn9 s ARG 29 Cb -0.18 -3.49 -0.06 0.00 -1.56 0.00 0.00 34.95 29.65 2kn9 s ARG 29 CO 0.09 -0.02 1.57 0.00 -0.81 0.00 0.00 175.30 176.13 2kn9 h ILE 31 N 5.10 0.00 0.00 0.00 3.07 -0.89 0.53 117.51 125.31 2kn9 h ILE 31 Ca -0.40 -0.49 0.00 0.00 1.55 0.00 0.00 64.86 65.53 2kn9 h ILE 31 Cb 1.18 1.41 0.00 0.00 -0.27 0.00 0.00 36.82 39.15 2kn9 h ILE 31 CO 0.93 0.00 -0.28 1.56 -1.05 0.00 0.00 178.15 179.31 2kn9 h GLN 32 N 0.00 0.00 0.00 0.16 1.08 -1.90 -3.42 115.11 111.03 2kn9 h GLN 32 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2kn9 h GLN 32 Cb 0.65 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 2kn9 h GLN 32 CO 0.00 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 2kn9 n GLY 34 N 0.18 1.27 3.64 0.00 0.00 0.18 -5.03 105.19 105.43 2kn9 n GLY 34 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2kn9 n GLY 34 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2kn9 s PHE 35 N -2.00 1.88 -0.26 1.61 5.36 -1.25 -4.64 117.98 118.69 2kn9 s PHE 35 Ca 0.00 0.34 -0.13 0.00 -0.96 0.00 0.00 56.93 56.19 2kn9 s PHE 35 Cb 0.00 -3.99 -0.04 0.00 -0.34 0.00 0.00 43.02 38.65 2kn9 s PHE 35 CO 0.00 -3.58 0.27 -1.21 -1.46 0.00 0.00 175.22 169.23 2kn9 s GLU 36 N 4.66 4.02 -0.17 10.12 2.02 -1.26 0.20 118.70 138.30 2kn9 s GLU 36 Ca 0.77 -0.13 -0.05 0.00 0.02 0.00 0.00 54.97 55.58 2kn9 s GLU 36 Cb -0.30 -3.62 -0.03 0.00 0.10 0.00 0.00 34.13 30.28 2kn9 s GLU 36 CO 0.31 -0.14 -0.00 -0.47 0.02 0.00 0.00 175.26 174.98 2kn9 s TYR 37 N 1.65 3.09 -0.12 1.61 5.04 0.78 -4.95 117.35 124.45 2kn9 s TYR 37 Ca 0.11 -0.20 -0.01 0.00 -2.44 0.00 0.00 57.07 54.53 2kn9 s TYR 37 Cb -0.15 -2.01 -0.02 0.00 0.35 0.00 0.00 41.96 40.13 2kn9 s TYR 37 CO 0.09 0.00 -0.09 0.34 -1.34 0.00 0.00 175.55 174.56 2kn9 s ASP 38 N 0.42 4.41 0.50 4.32 2.15 -1.26 0.92 116.67 128.13 2kn9 s ASP 38 Ca -0.01 -0.19 0.29 0.00 0.43 0.00 0.00 52.55 53.07 2kn9 s ASP 38 Cb -0.14 -1.54 1.18 0.00 -0.30 0.00 0.00 42.92 42.12 2kn9 s ASP 38 CO 0.02 0.22 1.92 -0.33 -0.17 0.00 0.00 175.17 176.83 2kn9 h GLU 39 N 6.34 0.00 -0.01 4.34 5.08 -1.50 0.77 114.58 129.61 2kn9 h GLU 39 Ca -0.33 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.85 2kn9 h GLU 39 Cb 1.19 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.46 2kn9 h GLU 39 CO 0.57 0.10 -0.68 0.00 -1.00 0.00 0.00 179.01 177.99 2kn9 h ALA 40 N 1.90 0.09 0.14 3.43 0.00 -1.88 -0.21 119.26 122.74 2kn9 h ALA 40 Ca -0.00 -0.59 -0.34 0.00 0.00 0.00 0.00 54.91 53.97 2kn9 h ALA 40 Cb 0.61 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2kn9 h ALA 40 CO 0.01 0.42 -1.79 1.25 0.00 0.00 0.00 179.25 179.14 2kn9 h LEU 41 N 0.00 0.47 0.00 0.00 7.12 -1.90 -3.24 115.31 117.77 2kn9 h LEU 41 Ca -0.08 -0.81 0.00 0.00 0.13 0.00 0.00 57.88 57.12 2kn9 h LEU 41 Cb 1.38 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.36 2kn9 h LEU 41 CO 0.13 1.70 0.00 0.61 -0.13 0.00 0.00 178.44 180.76 2kn9 n GLY 42 N 1.85 -0.97 2.74 3.75 0.00 0.26 -3.36 105.19 109.46 2kn9 n GLY 42 Ca -0.25 -1.47 -0.12 0.00 0.00 0.00 0.00 46.02 44.18 2kn9 n GLY 42 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kn9 s TRP 43 N 0.00 -0.67 0.50 1.61 -0.11 -0.07 -4.56 118.94 115.64 2kn9 s TRP 43 Ca 0.00 -0.94 0.28 0.00 1.22 0.00 0.00 56.10 56.66 2kn9 s TRP 43 Cb 0.00 -0.15 1.61 0.00 -1.50 0.00 0.00 33.47 33.43 2kn9 s TRP 43 CO 0.00 -1.08 2.16 -1.35 -4.62 0.00 0.00 176.95 172.06 2kn9 h PRO 44 N 5.94 0.00 -0.47 5.86 0.11 -1.80 -0.17 132.00 141.46 2kn9 h PRO 44 Ca 0.11 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.31 2kn9 h PRO 44 Cb 1.06 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.09 2kn9 h PRO 44 CO 0.15 0.06 0.01 0.93 -0.21 0.00 0.00 178.00 178.94 2kn9 h GLU 45 N 0.00 0.12 -0.48 1.05 4.39 -1.95 -0.43 114.58 117.27 2kn9 h GLU 45 Ca -0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2kn9 h GLU 45 Cb 0.17 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2kn9 h GLU 45 CO 0.01 0.08 0.00 -0.25 -1.16 0.00 0.00 179.01 177.69 2kn9 n ASP 46 N -5.21 2.58 0.00 1.42 9.92 -0.92 -4.88 116.55 119.46 2kn9 n ASP 46 Ca 0.05 -2.00 0.00 0.00 -0.53 0.00 0.00 54.79 52.31 2kn9 n ASP 46 Cb 0.25 -0.32 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 2kn9 n ASP 46 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kn9 n GLY 47 N 1.26 0.58 3.62 0.44 0.00 -0.17 -5.01 105.19 105.91 2kn9 n GLY 47 Ca 0.16 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2kn9 n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kn9 s ILE 48 N -2.00 4.61 0.42 -0.61 1.01 -0.12 -4.91 121.20 119.60 2kn9 s ILE 48 Ca 0.00 1.39 -0.09 0.00 0.00 0.00 0.00 60.65 61.95 2kn9 s ILE 48 Cb 0.00 -4.32 -0.06 0.00 0.01 0.00 0.00 42.46 38.10 2kn9 s ILE 48 CO 0.00 -0.44 0.78 0.00 0.00 0.00 0.00 174.94 175.28 2kn9 s ALA 49 N 3.40 3.36 0.02 9.38 0.00 -1.26 -0.89 121.76 135.76 2kn9 s ALA 49 Ca 0.39 -0.26 -0.30 0.00 0.00 0.00 0.00 51.96 51.79 2kn9 s ALA 49 Cb -0.13 -2.69 -0.08 0.00 0.00 0.00 0.00 23.12 20.23 2kn9 s ALA 49 CO 0.16 -0.09 1.82 0.00 0.00 0.00 0.00 175.76 177.65 2kn9 s ALA 50 N -2.46 3.62 0.00 0.00 0.00 -1.21 -1.20 121.76 120.50 2kn9 s ALA 50 Ca 0.50 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2kn9 s ALA 50 Cb -0.10 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2kn9 s ALA 50 CO 0.34 -1.44 0.00 0.41 0.00 0.00 0.00 175.76 175.07 2kn9 n GLY 51 N 4.33 1.27 3.65 0.00 0.00 -0.09 -4.95 105.19 109.41 2kn9 n GLY 51 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2kn9 n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kn9 s THR 52 N -2.17 3.78 0.58 2.61 2.01 -0.34 -4.98 115.64 117.13 2kn9 s THR 52 Ca 0.00 0.93 -0.14 0.00 0.31 0.00 0.00 61.69 62.79 2kn9 s THR 52 Cb 0.00 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 2kn9 s THR 52 CO 0.00 -0.13 1.02 -0.13 -0.69 0.00 0.00 174.62 174.69 2kn9 s ARG 53 N 4.03 3.65 0.56 4.92 1.81 -1.26 -4.70 118.95 127.95 2kn9 s ARG 53 Ca 0.68 0.91 0.26 0.00 -1.72 0.00 0.00 55.73 55.86 2kn9 s ARG 53 Cb -0.29 -2.09 1.47 0.00 -0.45 0.00 0.00 34.95 33.60 2kn9 s ARG 53 CO 0.26 -0.53 2.01 2.35 -0.68 0.00 0.00 175.30 178.71 2kn9 h TRP 54 N 0.23 0.00 -0.11 -0.53 2.91 -1.95 -0.58 115.95 115.93 2kn9 h TRP 54 Ca -0.45 0.00 -0.09 0.00 1.13 0.00 0.00 58.89 59.47 2kn9 h TRP 54 Cb 1.19 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.83 2kn9 h TRP 54 CO 0.64 0.00 -0.35 -0.44 -1.03 0.00 0.00 178.44 177.26 2kn9 h ASP 55 N 0.00 0.23 0.43 2.65 5.19 -2.01 -3.08 116.42 119.83 2kn9 h ASP 55 Ca 0.19 -0.09 -0.26 0.00 -0.62 0.00 0.00 57.03 56.26 2kn9 h ASP 55 Cb 0.87 -0.06 0.01 0.00 0.18 0.00 0.00 39.33 40.32 2kn9 h ASP 55 CO -0.00 0.58 -1.12 -0.78 -3.12 0.00 0.00 179.24 174.79 2kn9 h ASP 56 N 0.20 0.54 -2.30 6.45 3.58 -1.47 -3.45 116.42 119.96 2kn9 h ASP 56 Ca 0.02 -0.51 -0.58 0.00 0.42 0.00 0.00 57.03 56.39 2kn9 h ASP 56 Cb 0.72 -0.17 0.06 0.00 1.72 0.00 0.00 39.33 41.66 2kn9 h ASP 56 CO 0.05 1.34 0.83 -0.38 -2.88 0.00 0.00 179.24 178.21 2kn9 n ILE 57 N -3.67 0.02 -1.49 2.25 5.41 -1.16 -4.84 119.36 115.88 2kn9 n ILE 57 Ca -0.09 -0.00 -0.52 0.00 1.00 0.00 0.00 62.75 63.14 2kn9 n ILE 57 Cb 0.94 -1.60 -0.05 0.00 -0.71 0.00 0.00 39.64 38.22 2kn9 n ILE 57 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2kn9 n PRO 58 N 3.59 0.41 0.30 0.38 -0.02 -1.26 -4.84 135.00 133.56 2kn9 n PRO 58 Ca 0.17 0.15 0.19 0.00 -2.02 0.00 0.00 63.50 61.98 2kn9 n PRO 58 Cb 0.29 -1.48 0.91 0.00 -0.02 0.00 0.00 33.50 33.21 2kn9 n PRO 58 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2kn9 h ASP 59 N 2.42 0.00 0.03 2.55 2.03 -1.92 -0.67 116.42 120.85 2kn9 h ASP 59 Ca -0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 2kn9 h ASP 59 Cb 1.40 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.90 2kn9 h ASP 59 CO 0.64 0.03 -0.14 -0.90 -1.03 0.00 0.00 179.24 177.83 2kn9 n ASP 60 N -3.22 2.01 -4.73 4.15 5.75 -1.26 -4.76 116.55 114.49 2kn9 n ASP 60 Ca -0.01 -1.56 -0.42 0.00 -0.01 0.00 0.00 54.79 52.79 2kn9 n ASP 60 Cb 0.19 0.12 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 2kn9 n ASP 60 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 2kn9 s TRP 61 N -2.19 3.22 0.29 2.11 -0.00 -0.26 -4.99 118.94 117.12 2kn9 s TRP 61 Ca 0.28 1.07 0.10 0.00 -0.00 0.00 0.00 56.10 57.55 2kn9 s TRP 61 Cb 0.20 -3.67 -0.05 0.00 -0.00 0.00 0.00 33.47 29.95 2kn9 s TRP 61 CO 0.41 -2.22 -0.04 -1.12 -0.00 0.00 0.00 176.95 173.98 2kn9 s SER 62 N 0.67 4.26 -0.03 5.86 0.01 -1.26 -3.41 113.70 119.79 2kn9 s SER 62 Ca 0.61 -0.82 -0.35 0.00 1.31 0.00 0.00 55.95 56.69 2kn9 s SER 62 Cb -0.37 -0.65 -0.14 0.00 0.21 0.00 0.00 66.02 65.07 2kn9 s SER 62 CO 0.35 -0.06 1.71 0.00 0.41 0.00 0.00 173.24 175.65 2kn9 n PRO 64 N 5.02 0.61 -0.01 0.00 -0.04 -1.26 -0.54 135.00 138.78 2kn9 n PRO 64 Ca 0.21 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.63 2kn9 n PRO 64 Cb 0.25 -1.04 -0.01 0.00 -0.04 0.00 0.00 33.50 32.66 2kn9 n PRO 64 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2kn9 n ASP 65 N -0.40 1.43 -0.04 3.54 2.03 -1.26 -4.90 116.55 116.94 2kn9 n ASP 65 Ca 0.00 0.21 -0.01 0.00 0.52 0.00 0.00 54.79 55.51 2kn9 n ASP 65 Cb 0.02 -0.49 -0.11 0.00 -0.72 0.00 0.00 41.12 39.82 2kn9 n ASP 65 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kn9 n GLY 67 N 2.00 0.77 3.77 0.00 0.00 0.30 -4.98 105.19 107.05 2kn9 n GLY 67 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2kn9 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kn9 s ALA 68 N -2.09 2.86 1.02 4.61 0.00 -1.26 -4.35 121.76 122.56 2kn9 s ALA 68 Ca 0.00 1.00 -0.14 0.00 0.00 0.00 0.00 51.96 52.82 2kn9 s ALA 68 Cb 0.00 -3.42 0.20 0.00 0.00 0.00 0.00 23.12 19.90 2kn9 s ALA 68 CO 0.00 -0.86 1.12 0.00 0.00 0.00 0.00 175.76 176.03 2kn9 s ALA 69 N -1.53 1.15 0.53 0.00 0.00 -1.26 0.97 121.76 121.62 2kn9 s ALA 69 Ca 0.68 -0.60 0.20 0.00 0.00 0.00 0.00 51.96 52.24 2kn9 s ALA 69 Cb -0.30 -3.02 1.36 0.00 0.00 0.00 0.00 23.12 21.16 2kn9 s ALA 69 CO 0.36 -2.85 2.11 0.87 0.00 0.00 0.00 175.76 176.24 2kn9 h LYS 70 N -1.94 0.00 0.00 0.00 1.57 -1.85 -0.65 116.57 113.70 2kn9 h LYS 70 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 2kn9 h LYS 70 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2kn9 h LYS 70 CO 0.53 0.00 0.00 0.77 -0.57 0.00 0.00 179.45 180.18 2kn9 h SER 71 N 0.00 0.00 -0.30 0.86 0.02 -1.92 -0.96 113.55 111.25 2kn9 h SER 71 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2kn9 h SER 71 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2kn9 h SER 71 CO -0.00 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.16 2kn9 n ASP 72 N -2.92 2.10 -4.85 3.07 8.00 -0.25 -4.85 116.55 116.85 2kn9 n ASP 72 Ca -0.02 -1.87 -0.34 0.00 0.71 0.00 0.00 54.79 53.27 2kn9 n ASP 72 Cb 0.12 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 2kn9 n ASP 72 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2kn9 s PHE 73 N -1.60 3.46 -0.02 1.24 0.40 -0.37 -0.16 117.98 120.92 2kn9 s PHE 73 Ca 0.31 0.35 0.04 0.00 -0.60 0.00 0.00 56.93 57.02 2kn9 s PHE 73 Cb 0.17 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.84 2kn9 s PHE 73 CO 0.23 0.63 -0.11 -1.83 0.70 0.00 0.00 175.22 174.84 2kn9 s GLU 74 N -1.57 2.48 -0.31 0.44 -1.05 0.18 -4.86 118.70 114.01 2kn9 s GLU 74 Ca 0.22 -0.73 -0.29 0.00 -0.15 0.00 0.00 54.97 54.01 2kn9 s GLU 74 Cb -0.12 -2.42 0.01 0.00 -0.44 0.00 0.00 34.13 31.16 2kn9 s GLU 74 CO 0.12 0.61 1.17 1.41 0.95 0.00 0.00 175.26 179.52 2kn9 s MET 75 N -1.12 4.00 -0.04 -4.83 -2.45 -1.26 -0.97 119.30 112.63 2kn9 s MET 75 Ca 0.14 1.13 0.05 0.00 -1.25 0.00 0.00 55.69 55.77 2kn9 s MET 75 Cb -0.11 -3.80 -0.02 0.00 1.25 0.00 0.00 34.83 32.15 2kn9 s MET 75 CO 0.04 -1.01 -0.20 0.08 1.05 0.00 0.00 175.02 174.99 2kn9 s VAL 76 N 3.97 2.59 0.39 10.11 1.01 0.21 -4.98 120.40 133.70 2kn9 s VAL 76 Ca 0.50 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 2kn9 s VAL 76 Cb -0.14 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.18 2kn9 s VAL 76 CO 0.19 0.58 1.21 -1.61 0.00 0.00 0.00 175.10 175.48 2kn9 s GLU 77 N -0.58 4.08 -0.15 2.72 0.41 -1.26 -1.32 118.70 122.59 2kn9 s GLU 77 Ca 0.08 1.95 -0.15 0.00 -0.41 0.00 0.00 54.97 56.45 2kn9 s GLU 77 Cb -0.11 -2.76 -0.04 0.00 -1.78 0.00 0.00 34.13 29.44 2kn9 s GLU 77 CO 0.00 -0.33 0.35 0.08 -0.49 0.00 0.00 175.26 174.88 2kn9 s VAL 78 N -1.33 5.27 -0.54 2.63 1.01 -1.26 -4.84 120.40 121.32 2kn9 s VAL 78 Ca 0.56 0.68 -0.28 0.00 0.00 0.00 0.00 61.98 62.93 2kn9 s VAL 78 Cb -0.33 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.38 2kn9 s VAL 78 CO 0.43 0.36 1.28 0.00 0.00 0.00 0.00 175.10 177.16 2kn9 s ALA 79 N 0.56 2.97 -2.74 5.51 0.00 -1.26 -4.83 121.76 121.97 2kn9 s ALA 79 Ca 0.19 -0.66 0.22 0.00 0.00 0.00 0.00 51.96 51.72 2kn9 s ALA 79 Cb -0.14 -4.03 0.17 0.00 0.00 0.00 0.00 23.12 19.12 2kn9 s ALA 79 CO 0.06 -2.66 1.20 2.89 0.00 0.00 0.00 175.76 177.25 2kn9 n ARG 80 N 8.39 2.06 0.00 0.00 1.85 -1.26 -5.01 116.66 122.69 2kn9 n ARG 80 Ca 0.11 -1.78 0.00 0.00 -1.00 0.00 0.00 57.85 55.18 2kn9 n ARG 80 Cb 0.49 -1.43 0.00 0.00 -1.05 0.00 0.00 32.46 30.47 2kn9 n ARG 80 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05