#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kn9 s ALA 2 N 0.00 2.93 0.13 3.17 0.00 -1.26 -4.95 121.76 121.78 2kn9 s ALA 2 Ca 0.00 -0.85 -0.24 0.00 0.00 0.00 0.00 51.96 50.87 2kn9 s ALA 2 Cb 0.00 -4.08 0.07 0.00 0.00 0.00 0.00 23.12 19.12 2kn9 s ALA 2 CO 0.00 -2.79 0.68 -3.38 0.00 0.00 0.00 175.76 170.27 2kn9 s HIS 3 N 5.30 -0.47 -0.23 0.00 -0.00 -1.26 -5.15 115.29 113.48 2kn9 s HIS 3 Ca 0.44 0.26 0.01 0.00 -0.00 0.00 0.00 55.06 55.78 2kn9 s HIS 3 Cb -0.08 0.56 0.05 0.00 -0.00 0.00 0.00 32.58 33.12 2kn9 s HIS 3 CO 0.24 -0.80 -0.08 -1.01 -0.00 0.00 0.00 174.74 173.09 2kn9 s HIS 4 N -3.61 2.61 -0.31 0.38 3.76 -1.26 -5.08 115.29 111.78 2kn9 s HIS 4 Ca 0.03 -1.84 -0.29 0.00 -0.15 0.00 0.00 55.06 52.81 2kn9 s HIS 4 Cb -0.01 -1.68 -0.01 0.00 1.11 0.00 0.00 32.58 31.99 2kn9 s HIS 4 CO -0.11 -0.79 1.53 -1.58 -0.85 0.00 0.00 174.74 172.94 2kn9 s HIS 5 N 1.33 2.25 0.02 1.40 2.46 -1.26 -4.99 115.29 116.50 2kn9 s HIS 5 Ca -0.05 0.66 0.02 0.00 0.47 0.00 0.00 55.06 56.16 2kn9 s HIS 5 Cb -0.18 -4.08 -0.01 0.00 -0.13 0.00 0.00 32.58 28.17 2kn9 s HIS 5 CO -0.07 -2.43 -0.07 -3.38 -2.47 0.00 0.00 174.74 166.32 2kn9 s HIS 6 N 5.39 0.64 -0.05 3.88 0.00 -1.26 -5.09 115.29 118.80 2kn9 s HIS 6 Ca 0.67 -0.26 -0.02 0.00 -3.00 0.00 0.00 55.06 52.45 2kn9 s HIS 6 Cb -0.20 -0.40 -0.01 0.00 -4.00 0.00 0.00 32.58 27.97 2kn9 s HIS 6 CO 0.30 -0.03 0.11 0.45 -1.00 0.00 0.00 174.74 174.57 2kn9 h HIS 7 N 5.37 -0.06 -5.03 0.38 -0.00 -2.09 -3.47 115.15 110.25 2kn9 h HIS 7 Ca -0.32 -0.00 -0.41 0.00 -0.00 0.00 0.00 60.37 59.64 2kn9 h HIS 7 Cb 1.19 0.02 0.04 0.00 -0.00 0.00 0.00 27.41 28.67 2kn9 h HIS 7 CO 0.50 -0.04 -0.63 1.58 -0.00 0.00 0.00 177.93 179.35 2kn9 n HIS 8 N -3.70 -2.13 -0.81 2.45 -0.00 -1.26 -4.87 115.22 104.90 2kn9 n HIS 8 Ca -0.01 0.63 -0.13 0.00 -0.00 0.00 0.00 57.72 58.22 2kn9 n HIS 8 Cb 0.03 -4.30 0.21 0.00 -0.00 0.00 0.00 29.99 25.92 2kn9 n HIS 8 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2kn9 n MET 9 N -4.21 2.71 -2.32 1.57 1.56 -1.26 -4.83 117.12 110.33 2kn9 n MET 9 Ca -0.06 -2.59 -0.36 0.00 -0.27 0.00 0.00 57.70 54.41 2kn9 n MET 9 Cb 0.59 -2.05 -0.03 0.00 2.15 0.00 0.00 33.22 33.89 2kn9 n MET 9 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2kn9 n GLY 10 N -0.49 1.91 4.01 -5.12 0.00 -1.26 -4.93 105.19 99.31 2kn9 n GLY 10 Ca 0.43 -1.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.15 2kn9 n GLY 10 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2kn9 s THR 11 N 7.30 2.54 -0.02 2.61 -1.32 -1.26 -5.12 115.64 120.37 2kn9 s THR 11 Ca 0.60 -0.89 0.06 0.00 -1.21 0.00 0.00 61.69 60.25 2kn9 s THR 11 Cb 0.02 -2.65 -0.01 0.00 -1.51 0.00 0.00 72.50 68.35 2kn9 s THR 11 CO 0.10 0.00 -0.20 -1.48 -2.21 0.00 0.00 174.62 170.83 2kn9 s LEU 12 N -4.63 2.03 -1.22 9.08 2.34 -1.26 -5.04 118.68 119.99 2kn9 s LEU 12 Ca 0.59 -0.36 -0.18 0.00 0.06 0.00 0.00 54.13 54.24 2kn9 s LEU 12 Cb -0.08 -1.03 -0.02 0.00 -0.56 0.00 0.00 46.19 44.50 2kn9 s LEU 12 CO 0.37 0.24 1.98 -0.62 -1.06 0.00 0.00 176.35 177.26 2kn9 n GLU 13 N 2.62 2.45 0.00 1.48 4.71 -1.26 -4.72 120.64 125.92 2kn9 n GLU 13 Ca -0.15 -2.60 0.13 0.00 -0.01 0.00 0.00 57.16 54.52 2kn9 n GLU 13 Cb 0.53 -3.34 0.63 0.00 -1.01 0.00 0.00 31.44 28.25 2kn9 n GLU 13 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2kn9 n ALA 14 N 8.39 2.27 -0.39 0.62 0.00 -1.26 -4.28 120.51 125.87 2kn9 n ALA 14 Ca 0.49 -0.12 -0.11 0.00 0.00 0.00 0.00 53.44 53.71 2kn9 n ALA 14 Cb 0.42 -1.42 -0.10 0.00 0.00 0.00 0.00 19.45 18.36 2kn9 n ALA 14 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2kn9 h GLN 15 N 0.00 -0.04 -6.31 0.00 4.20 -2.06 -3.45 115.11 107.45 2kn9 h GLN 15 Ca 0.00 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.23 2kn9 h GLN 15 Cb 0.28 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 27.93 2kn9 h GLN 15 CO 0.00 -0.02 -0.74 0.25 -0.67 0.00 0.00 178.83 177.65 2kn9 n THR 16 N -5.24 -1.16 1.74 -0.54 -2.24 -1.26 -4.82 114.28 100.75 2kn9 n THR 16 Ca 0.01 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.94 2kn9 n THR 16 Cb 0.27 -1.89 0.70 0.00 -2.10 0.00 0.00 70.33 67.30 2kn9 n THR 16 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2kn9 n GLN 17 N -4.24 1.32 0.00 -0.78 7.27 -1.26 -4.84 117.38 114.85 2kn9 n GLN 17 Ca 0.05 -0.47 0.00 0.00 0.07 0.00 0.00 57.00 56.65 2kn9 n GLN 17 Cb 0.51 -1.47 0.00 0.00 2.41 0.00 0.00 30.24 31.69 2kn9 n GLN 17 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2kn9 n GLY 18 N 1.06 0.64 3.77 1.69 0.00 -1.26 -5.01 105.19 106.08 2kn9 n GLY 18 Ca 0.21 -1.56 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 2kn9 n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kn9 s PRO 19 N 0.33 3.98 -0.11 1.61 0.04 -1.26 -4.97 135.00 134.62 2kn9 s PRO 19 Ca 0.00 1.85 -0.05 0.00 0.04 0.00 0.00 61.00 62.84 2kn9 s PRO 19 Cb 0.00 -2.62 -0.05 0.00 0.04 0.00 0.00 34.50 31.87 2kn9 s PRO 19 CO 0.00 -0.39 -0.14 0.41 0.04 0.00 0.00 177.00 176.93 2kn9 n GLY 20 N 0.59 -0.18 3.48 0.56 0.00 -1.26 -4.93 105.19 103.45 2kn9 n GLY 20 Ca 0.05 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2kn9 n GLY 20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kn9 s SER 21 N -5.86 6.18 0.21 1.61 0.01 -1.26 -4.95 113.70 109.64 2kn9 s SER 21 Ca -0.16 -0.70 -0.08 0.00 1.31 0.00 0.00 55.95 56.32 2kn9 s SER 21 Cb 0.06 -2.21 0.16 0.00 0.21 0.00 0.00 66.02 64.23 2kn9 s SER 21 CO 0.21 -0.56 1.80 0.00 0.41 0.00 0.00 173.24 175.10 2kn9 h MET 22 N 8.71 1.15 -0.96 12.44 -0.00 -1.94 -3.46 114.93 130.86 2kn9 h MET 22 Ca -0.27 -0.17 -0.34 0.00 -0.00 0.00 0.00 59.70 58.92 2kn9 h MET 22 Cb 1.11 -0.20 -0.13 0.00 -0.00 0.00 0.00 31.60 32.37 2kn9 h MET 22 CO 0.78 0.90 -0.31 0.09 -0.00 0.00 0.00 176.91 178.37 2kn9 n ASN 23 N -4.35 -5.02 -0.18 -0.10 3.02 -1.26 -1.17 115.26 106.21 2kn9 n ASN 23 Ca 0.07 0.41 -0.02 0.00 -0.03 0.00 0.00 54.58 55.01 2kn9 n ASN 23 Cb 0.14 -4.27 -0.01 0.00 -0.61 0.00 0.00 39.78 35.03 2kn9 n ASN 23 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2kn9 n ASP 24 N -1.07 -4.81 -4.82 6.41 2.03 -1.26 -4.99 116.55 108.03 2kn9 n ASP 24 Ca -0.16 0.06 -0.33 0.00 0.52 0.00 0.00 54.79 54.87 2kn9 n ASP 24 Cb 0.60 -2.52 -0.07 0.00 -0.72 0.00 0.00 41.12 38.41 2kn9 n ASP 24 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2kn9 s TYR 25 N -1.58 3.31 0.34 -0.67 1.51 -0.32 -4.88 117.35 115.07 2kn9 s TYR 25 Ca 0.00 1.62 -0.03 0.00 -1.01 0.00 0.00 57.07 57.65 2kn9 s TYR 25 Cb 0.00 -2.86 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 2kn9 s TYR 25 CO 0.00 -0.13 0.58 0.15 -1.11 0.00 0.00 175.55 175.05 2kn9 s LYS 26 N -3.13 3.56 -0.28 -0.62 3.01 -1.26 -4.68 119.74 116.34 2kn9 s LYS 26 Ca 0.62 -0.10 -0.07 0.00 -1.01 0.00 0.00 55.97 55.41 2kn9 s LYS 26 Cb -0.10 -2.61 -0.00 0.00 -1.01 0.00 0.00 37.83 34.10 2kn9 s LYS 26 CO 0.14 0.13 0.08 -0.51 0.51 0.00 0.00 175.35 175.70 2kn9 s LEU 27 N -4.01 3.70 -0.36 3.17 1.43 -0.42 -1.48 118.68 120.71 2kn9 s LEU 27 Ca 0.43 -0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 2kn9 s LEU 27 Cb -0.10 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.23 2kn9 s LEU 27 CO 0.34 -0.14 0.23 -0.36 0.23 0.00 0.00 176.35 176.66 2kn9 s PHE 28 N 1.54 3.22 -0.18 0.29 0.40 0.15 0.37 117.98 123.78 2kn9 s PHE 28 Ca 0.04 -0.55 -0.06 0.00 -0.60 0.00 0.00 56.93 55.76 2kn9 s PHE 28 Cb -0.16 -2.47 -0.03 0.00 0.51 0.00 0.00 43.02 40.86 2kn9 s PHE 28 CO 0.03 -0.50 0.02 0.50 0.70 0.00 0.00 175.22 175.96 2kn9 s ARG 29 N 1.65 3.80 -0.15 0.44 3.52 -0.27 0.00 118.95 127.94 2kn9 s ARG 29 Ca 0.05 -0.44 -0.29 0.00 -0.13 0.00 0.00 55.73 54.91 2kn9 s ARG 29 Cb -0.18 -3.09 -0.02 0.00 -1.56 0.00 0.00 34.95 30.10 2kn9 s ARG 29 CO 0.09 0.21 1.36 0.00 -0.81 0.00 0.00 175.30 176.15 2kn9 n ILE 31 N 5.47 0.00 0.58 0.00 -5.35 0.32 -0.21 119.36 120.16 2kn9 n ILE 31 Ca 0.15 -0.03 0.12 0.00 -0.27 0.00 0.00 62.75 62.73 2kn9 n ILE 31 Cb 0.44 -0.38 0.28 0.00 -1.74 0.00 0.00 39.64 38.25 2kn9 n ILE 31 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2kn9 h GLN 32 N 0.24 0.00 0.00 6.28 1.08 -1.90 -3.44 115.11 117.37 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 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 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 -0.34 -0.72 3.63 0.00 0.00 0.70 -5.04 105.19 103.42 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 -0.24 1.40 -0.32 1.61 5.36 -1.25 -4.68 117.98 119.87 2kn9 s PHE 35 Ca 0.00 0.14 -0.11 0.00 -0.96 0.00 0.00 56.93 56.00 2kn9 s PHE 35 Cb 0.00 -4.07 -0.02 0.00 -0.34 0.00 0.00 43.02 38.60 2kn9 s PHE 35 CO 0.00 -4.45 0.19 -1.21 -1.46 0.00 0.00 175.22 168.29 2kn9 s GLU 36 N 5.26 3.49 -0.25 10.12 2.02 -1.26 0.11 118.70 138.19 2kn9 s GLU 36 Ca 0.90 -0.63 -0.11 0.00 0.02 0.00 0.00 54.97 55.15 2kn9 s GLU 36 Cb -0.35 -3.66 -0.05 0.00 0.10 0.00 0.00 34.13 30.17 2kn9 s GLU 36 CO 0.36 -0.39 0.19 -0.47 0.02 0.00 0.00 175.26 174.98 2kn9 s TYR 37 N 1.68 3.28 -0.21 1.61 5.04 0.10 -4.92 117.35 123.93 2kn9 s TYR 37 Ca 0.06 0.22 -0.13 0.00 -2.44 0.00 0.00 57.07 54.78 2kn9 s TYR 37 Cb -0.17 -2.34 -0.05 0.00 0.35 0.00 0.00 41.96 39.76 2kn9 s TYR 37 CO 0.08 -0.03 0.25 0.34 -1.34 0.00 0.00 175.55 174.85 2kn9 s ASP 38 N 1.33 6.28 0.47 4.32 2.15 -1.26 0.34 116.67 130.31 2kn9 s ASP 38 Ca 0.08 0.32 0.20 0.00 0.43 0.00 0.00 52.55 53.58 2kn9 s ASP 38 Cb -0.15 -2.15 1.18 0.00 -0.30 0.00 0.00 42.92 41.50 2kn9 s ASP 38 CO 0.07 0.05 2.02 -0.33 -0.17 0.00 0.00 175.17 176.81 2kn9 h GLU 39 N 7.18 0.00 0.07 4.34 5.08 -1.54 0.68 114.58 130.39 2kn9 h GLU 39 Ca -0.39 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.72 2kn9 h GLU 39 Cb 1.16 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.42 2kn9 h GLU 39 CO 0.71 0.17 -1.11 0.00 -1.00 0.00 0.00 179.01 177.78 2kn9 h ALA 40 N 1.83 0.19 0.17 3.43 0.00 -1.86 -0.21 119.26 122.81 2kn9 h ALA 40 Ca -0.00 -0.78 -0.28 0.00 0.00 0.00 0.00 54.91 53.85 2kn9 h ALA 40 Cb 0.35 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.18 2kn9 h ALA 40 CO 0.02 0.83 -1.30 1.25 0.00 0.00 0.00 179.25 180.06 2kn9 h LEU 41 N 0.19 0.57 0.00 0.00 5.85 -1.86 -3.27 115.31 116.79 2kn9 h LEU 41 Ca -0.12 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.68 2kn9 h LEU 41 Cb 1.78 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.63 2kn9 h LEU 41 CO 0.19 1.60 0.00 0.61 -0.34 0.00 0.00 178.44 180.50 2kn9 n GLY 42 N 1.73 -1.57 2.75 3.75 0.00 0.21 -3.67 105.19 108.39 2kn9 n GLY 42 Ca -0.19 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 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 -0.55 0.23 1.61 -0.11 0.89 -4.67 118.94 116.34 2kn9 s TRP 43 Ca 0.00 -0.93 0.36 0.00 1.22 0.00 0.00 56.10 56.75 2kn9 s TRP 43 Cb 0.00 -0.22 1.62 0.00 -1.50 0.00 0.00 33.47 33.37 2kn9 s TRP 43 CO 0.00 -1.05 2.08 -1.35 -4.62 0.00 0.00 176.95 172.01 2kn9 h PRO 44 N 6.21 0.00 -0.45 5.86 0.11 -1.84 0.26 132.00 142.14 2kn9 h PRO 44 Ca 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 2kn9 h PRO 44 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2kn9 h PRO 44 CO 0.17 0.00 0.22 0.93 -0.21 0.00 0.00 178.00 179.11 2kn9 h GLU 45 N 0.00 0.62 0.00 1.05 4.39 -1.95 -2.85 114.58 115.85 2kn9 h GLU 45 Ca 0.00 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.55 2kn9 h GLU 45 Cb 0.39 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2kn9 h GLU 45 CO 0.00 0.49 -2.02 -3.47 -1.16 0.00 0.00 179.01 172.84 2kn9 n ASP 46 N -4.40 0.06 0.00 1.42 2.03 -0.91 -4.98 116.55 109.78 2kn9 n ASP 46 Ca 0.03 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.37 2kn9 n ASP 46 Cb 0.12 1.67 0.00 0.00 -0.72 0.00 0.00 41.12 42.19 2kn9 n ASP 46 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kn9 n GLY 47 N 1.36 1.11 3.62 0.27 0.00 -0.81 -5.08 105.19 105.66 2kn9 n GLY 47 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 3.94 0.39 -0.61 -1.09 0.01 -4.88 121.20 116.97 2kn9 s ILE 48 Ca 0.00 1.03 -0.15 0.00 -2.23 0.00 0.00 60.65 59.30 2kn9 s ILE 48 Cb 0.00 -4.04 -0.08 0.00 -1.58 0.00 0.00 42.46 36.75 2kn9 s ILE 48 CO 0.00 -0.51 0.82 0.00 -1.23 0.00 0.00 174.94 174.02 2kn9 s ALA 49 N 4.98 3.24 -0.03 9.38 0.00 -1.26 -0.07 121.76 137.99 2kn9 s ALA 49 Ca 0.62 0.05 -0.34 0.00 0.00 0.00 0.00 51.96 52.30 2kn9 s ALA 49 Cb -0.18 -2.87 -0.12 0.00 0.00 0.00 0.00 23.12 19.95 2kn9 s ALA 49 CO 0.28 0.11 1.84 0.00 0.00 0.00 0.00 175.76 177.99 2kn9 n ALA 50 N -0.87 1.05 0.00 0.00 0.00 -1.24 -1.14 120.51 118.31 2kn9 n ALA 50 Ca 0.04 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2kn9 n ALA 50 Cb 0.54 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.49 2kn9 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kn9 n GLY 51 N 4.25 0.57 3.70 0.00 0.00 -0.09 -4.95 105.19 108.67 2kn9 n GLY 51 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 3.54 0.48 2.61 2.01 -0.29 -4.98 115.64 117.00 2kn9 s THR 52 Ca 0.00 1.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.89 2kn9 s THR 52 Cb 0.00 -3.66 -0.07 0.00 0.01 0.00 0.00 72.50 68.78 2kn9 s THR 52 CO 0.00 0.04 0.90 -0.13 -0.69 0.00 0.00 174.62 174.74 2kn9 s ARG 53 N 1.82 3.87 0.58 4.92 1.81 -1.26 -4.71 118.95 125.97 2kn9 s ARG 53 Ca 0.64 0.76 0.28 0.00 -1.72 0.00 0.00 55.73 55.69 2kn9 s ARG 53 Cb -0.34 -2.23 1.75 0.00 -0.45 0.00 0.00 34.95 33.68 2kn9 s ARG 53 CO 0.28 -0.19 2.24 2.35 -0.68 0.00 0.00 175.30 179.30 2kn9 h TRP 54 N 1.00 0.00 -0.48 -0.53 2.91 -1.94 -0.69 115.95 116.22 2kn9 h TRP 54 Ca -0.47 0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.45 2kn9 h TRP 54 Cb 1.19 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.82 2kn9 h TRP 54 CO 0.63 0.01 -0.11 -0.44 -1.03 0.00 0.00 178.44 177.49 2kn9 h ASP 55 N 0.00 0.88 0.38 2.65 3.32 -2.02 -3.09 116.42 118.55 2kn9 h ASP 55 Ca -0.00 -0.28 -0.19 0.00 0.02 0.00 0.00 57.03 56.58 2kn9 h ASP 55 Cb 0.02 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2kn9 h ASP 55 CO 0.00 1.01 -0.79 0.44 -1.72 0.00 0.00 179.24 178.17 2kn9 h ASP 56 N 0.79 0.40 -2.56 6.45 3.32 -1.52 -3.43 116.42 119.87 2kn9 h ASP 56 Ca 0.13 -0.28 -0.54 0.00 0.02 0.00 0.00 57.03 56.36 2kn9 h ASP 56 Cb 0.63 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 40.07 2kn9 h ASP 56 CO 0.04 1.04 1.10 -0.63 -1.72 0.00 0.00 179.24 179.08 2kn9 s ILE 57 N -3.45 3.19 0.56 0.35 1.01 -0.83 -4.97 121.20 117.07 2kn9 s ILE 57 Ca -0.05 0.41 -0.19 0.00 0.00 0.00 0.00 60.65 60.82 2kn9 s ILE 57 Cb 0.10 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.26 2kn9 s ILE 57 CO 0.84 -0.02 1.16 -2.84 0.00 0.00 0.00 174.94 174.07 2kn9 s PRO 58 N 3.66 3.20 0.00 2.79 0.02 -1.26 -4.91 135.00 138.50 2kn9 s PRO 58 Ca 0.78 1.70 0.17 0.00 0.02 0.00 0.00 61.00 63.68 2kn9 s PRO 58 Cb -0.39 -1.97 0.79 0.00 0.02 0.00 0.00 34.50 32.95 2kn9 s PRO 58 CO 0.34 -0.99 1.55 -0.40 -0.33 0.00 0.00 177.00 177.17 2kn9 n ASP 59 N -1.41 0.00 -0.17 2.53 5.75 -1.26 -1.03 116.55 120.96 2kn9 n ASP 59 Ca 0.12 0.35 0.15 0.00 -0.01 0.00 0.00 54.79 55.40 2kn9 n ASP 59 Cb 0.50 -0.43 0.79 0.00 -1.03 0.00 0.00 41.12 40.95 2kn9 n ASP 59 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2kn9 n ASP 60 N -1.43 0.53 -4.62 -1.12 9.92 -1.26 -4.70 116.55 113.87 2kn9 n ASP 60 Ca 0.06 -1.13 -0.40 0.00 -0.53 0.00 0.00 54.79 52.79 2kn9 n ASP 60 Cb 0.18 -0.01 -0.07 0.00 -0.64 0.00 0.00 41.12 40.58 2kn9 n ASP 60 CO 0.00 0.00 0.00 0.86 0.13 0.00 0.00 177.20 178.19 2kn9 s TRP 61 N -2.04 3.26 0.25 1.24 -0.00 -0.20 -5.07 118.94 116.39 2kn9 s TRP 61 Ca 0.43 0.65 -0.00 0.00 -0.00 0.00 0.00 56.10 57.18 2kn9 s TRP 61 Cb 0.22 -2.75 -0.04 0.00 -0.00 0.00 0.00 33.47 30.89 2kn9 s TRP 61 CO 0.37 -0.30 0.43 -1.54 -0.00 0.00 0.00 176.95 175.91 2kn9 s SER 62 N 1.55 6.36 -0.01 5.86 1.04 -1.26 -4.22 113.70 123.02 2kn9 s SER 62 Ca 0.22 0.39 -0.32 0.00 0.48 0.00 0.00 55.95 56.72 2kn9 s SER 62 Cb -0.16 -2.00 -0.10 0.00 0.10 0.00 0.00 66.02 63.86 2kn9 s SER 62 CO 0.09 -0.11 1.92 0.00 0.98 0.00 0.00 173.24 176.12 2kn9 n PRO 64 N 6.96 0.00 -0.07 0.00 -0.04 -1.26 0.20 135.00 140.80 2kn9 n PRO 64 Ca 0.21 0.40 -0.07 0.00 -0.04 0.00 0.00 63.50 64.01 2kn9 n PRO 64 Cb 0.35 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.28 2kn9 n PRO 64 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2kn9 h ASP 65 N 0.00 0.00 0.00 3.54 3.58 -1.97 -3.44 116.42 118.13 2kn9 h ASP 65 Ca 0.00 -0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 2kn9 h ASP 65 Cb 0.10 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.14 2kn9 h ASP 65 CO 0.00 0.81 -1.10 0.00 -2.88 0.00 0.00 179.24 176.07 2kn9 n GLY 67 N 2.74 0.91 3.74 0.00 0.00 0.13 -4.99 105.19 107.73 2kn9 n GLY 67 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.00 2.29 0.80 4.61 0.00 -1.26 -4.32 121.76 121.87 2kn9 s ALA 68 Ca 0.00 0.82 -0.10 0.00 0.00 0.00 0.00 51.96 52.68 2kn9 s ALA 68 Cb 0.00 -3.43 0.11 0.00 0.00 0.00 0.00 23.12 19.80 2kn9 s ALA 68 CO 0.00 -1.59 1.14 0.00 0.00 0.00 0.00 175.76 175.31 2kn9 s ALA 69 N -2.00 2.83 0.49 0.00 0.00 -1.26 0.18 121.76 122.01 2kn9 s ALA 69 Ca 0.73 -0.98 0.18 0.00 0.00 0.00 0.00 51.96 51.88 2kn9 s ALA 69 Cb -0.27 -2.69 1.20 0.00 0.00 0.00 0.00 23.12 21.35 2kn9 s ALA 69 CO 0.42 -1.70 2.04 0.87 0.00 0.00 0.00 175.76 177.38 2kn9 h LYS 70 N -0.98 0.17 0.00 0.00 1.57 -1.84 0.43 116.57 115.92 2kn9 h LYS 70 Ca -0.44 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2kn9 h LYS 70 Cb 1.30 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2kn9 h LYS 70 CO 0.55 0.12 0.00 0.45 -0.57 0.00 0.00 179.45 179.99 2kn9 n SER 71 N -4.46 0.44 -1.53 0.86 2.88 -1.26 -1.13 113.62 109.42 2kn9 n SER 71 Ca 0.06 0.64 0.10 0.00 -1.33 0.00 0.00 58.87 58.35 2kn9 n SER 71 Cb 0.35 -0.72 0.35 0.00 -0.75 0.00 0.00 64.21 63.44 2kn9 n SER 71 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2kn9 n ASP 72 N -2.03 4.52 -4.83 -3.46 8.00 0.14 -4.92 116.55 113.98 2kn9 n ASP 72 Ca 0.01 -2.28 -0.30 0.00 0.71 0.00 0.00 54.79 52.93 2kn9 n ASP 72 Cb 0.14 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 40.62 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 -1.53 3.30 0.10 1.24 0.40 -0.28 -0.52 117.98 120.68 2kn9 s PHE 73 Ca 0.51 0.13 0.07 0.00 -0.60 0.00 0.00 56.93 57.04 2kn9 s PHE 73 Cb 0.31 -1.66 -0.04 0.00 0.51 0.00 0.00 43.02 42.14 2kn9 s PHE 73 CO 0.29 0.54 -0.10 -1.83 0.70 0.00 0.00 175.22 174.82 2kn9 s GLU 74 N -2.48 2.15 -0.51 0.44 -1.05 0.11 -4.90 118.70 112.46 2kn9 s GLU 74 Ca 0.31 -1.01 -0.19 0.00 -0.15 0.00 0.00 54.97 53.94 2kn9 s GLU 74 Cb -0.12 -2.31 0.06 0.00 -0.44 0.00 0.00 34.13 31.32 2kn9 s GLU 74 CO 0.24 0.51 0.61 1.41 0.95 0.00 0.00 175.26 178.99 2kn9 s MET 75 N -2.15 3.10 -0.25 -4.83 -2.45 -1.26 -1.12 119.30 110.35 2kn9 s MET 75 Ca 0.21 -0.97 -0.17 0.00 -1.25 0.00 0.00 55.69 53.51 2kn9 s MET 75 Cb -0.11 -4.12 -0.03 0.00 1.25 0.00 0.00 34.83 31.82 2kn9 s MET 75 CO 0.13 -1.24 0.47 0.08 1.05 0.00 0.00 175.02 175.52 2kn9 s VAL 76 N 2.55 5.11 0.57 10.11 1.01 0.16 -4.99 120.40 134.93 2kn9 s VAL 76 Ca 0.14 0.81 -0.06 0.00 0.00 0.00 0.00 61.98 62.87 2kn9 s VAL 76 Cb -0.20 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.39 2kn9 s VAL 76 CO 0.11 0.13 0.88 -1.83 0.00 0.00 0.00 175.10 174.39 2kn9 s GLU 77 N 2.04 2.98 -0.15 2.72 -1.05 -1.26 -1.30 118.70 122.68 2kn9 s GLU 77 Ca 0.20 -0.01 -0.25 0.00 -0.15 0.00 0.00 54.97 54.77 2kn9 s GLU 77 Cb -0.16 -2.29 -0.02 0.00 -0.44 0.00 0.00 34.13 31.22 2kn9 s GLU 77 CO 0.09 -0.64 0.80 0.08 0.95 0.00 0.00 175.26 176.55 2kn9 s VAL 78 N -2.95 4.92 -0.75 1.83 1.01 -1.26 -4.88 120.40 118.31 2kn9 s VAL 78 Ca 0.53 1.59 -0.26 0.00 0.00 0.00 0.00 61.98 63.84 2kn9 s VAL 78 Cb -0.10 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 2kn9 s VAL 78 CO 0.45 0.07 1.76 0.00 0.00 0.00 0.00 175.10 177.38 2kn9 s ALA 79 N 1.89 2.17 -0.45 5.51 0.00 -1.26 -4.93 121.76 124.68 2kn9 s ALA 79 Ca 0.38 -1.15 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 2kn9 s ALA 79 Cb -0.17 -4.39 0.01 0.00 0.00 0.00 0.00 23.12 18.57 2kn9 s ALA 79 CO 0.14 -4.04 1.43 1.03 0.00 0.00 0.00 175.76 174.32 2kn9 s ARG 80 N 6.65 3.49 0.00 0.00 1.81 -1.26 -5.19 118.95 124.45 2kn9 s ARG 80 Ca 0.61 0.83 0.27 0.00 -1.72 0.00 0.00 55.73 55.72 2kn9 s ARG 80 Cb -0.09 -4.06 0.80 0.00 -0.45 0.00 0.00 34.95 31.15 2kn9 s ARG 80 CO 0.11 -1.68 1.60 0.43 -0.68 0.00 0.00 175.30 175.08