#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kn9 n ALA 2 N 0.00 -3.35 -3.30 3.04 0.00 -1.26 -4.98 120.51 110.67 2kn9 n ALA 2 Ca 0.00 1.05 -0.45 0.00 0.00 0.00 0.00 53.44 54.04 2kn9 n ALA 2 Cb 0.00 -2.05 -0.06 0.00 0.00 0.00 0.00 19.45 17.34 2kn9 n ALA 2 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2kn9 s HIS 3 N -0.43 3.27 0.11 0.00 5.04 -1.26 -5.03 115.29 116.98 2kn9 s HIS 3 Ca -0.12 -1.33 -0.05 0.00 -1.54 0.00 0.00 55.06 52.02 2kn9 s HIS 3 Cb 0.01 -3.70 -0.02 0.00 0.04 0.00 0.00 32.58 28.91 2kn9 s HIS 3 CO 0.40 -1.00 0.13 -3.38 -2.34 0.00 0.00 174.74 168.55 2kn9 s HIS 4 N 1.57 0.46 0.16 3.88 -3.43 -1.26 -5.17 115.29 111.50 2kn9 s HIS 4 Ca 0.03 -0.89 0.03 0.00 -0.80 0.00 0.00 55.06 53.43 2kn9 s HIS 4 Cb -0.29 -0.23 -0.04 0.00 -1.43 0.00 0.00 32.58 30.59 2kn9 s HIS 4 CO 0.03 -0.54 0.27 -1.01 -2.00 0.00 0.00 174.74 171.49 2kn9 s HIS 5 N -3.94 3.45 -0.29 0.38 3.76 -1.26 -5.09 115.29 112.29 2kn9 s HIS 5 Ca 0.13 0.09 -0.01 0.00 -0.15 0.00 0.00 55.06 55.12 2kn9 s HIS 5 Cb 0.06 -1.64 0.09 0.00 1.11 0.00 0.00 32.58 32.20 2kn9 s HIS 5 CO -0.05 0.51 0.07 -1.58 -0.85 0.00 0.00 174.74 172.84 2kn9 s HIS 6 N -1.76 1.83 0.20 1.40 5.04 -1.26 -5.14 115.29 115.61 2kn9 s HIS 6 Ca 0.34 -1.71 0.03 0.00 -1.54 0.00 0.00 55.06 52.18 2kn9 s HIS 6 Cb -0.11 -1.70 -0.03 0.00 0.04 0.00 0.00 32.58 30.78 2kn9 s HIS 6 CO 0.28 -0.84 0.34 -3.38 -2.34 0.00 0.00 174.74 168.80 2kn9 s HIS 7 N 1.58 3.47 0.56 3.88 -3.43 -1.26 -5.09 115.29 115.00 2kn9 s HIS 7 Ca 0.07 0.10 -0.17 0.00 -0.80 0.00 0.00 55.06 54.26 2kn9 s HIS 7 Cb -0.17 -1.66 -0.05 0.00 -1.43 0.00 0.00 32.58 29.26 2kn9 s HIS 7 CO -0.20 0.45 1.07 -1.01 -2.00 0.00 0.00 174.74 173.05 2kn9 s HIS 8 N -1.88 2.91 0.10 0.38 3.76 -1.26 -4.97 115.29 114.33 2kn9 s HIS 8 Ca 0.35 1.54 -0.02 0.00 -0.15 0.00 0.00 55.06 56.78 2kn9 s HIS 8 Cb -0.10 -3.08 -0.22 0.00 1.11 0.00 0.00 32.58 30.29 2kn9 s HIS 8 CO 0.29 -1.15 1.21 0.52 -0.85 0.00 0.00 174.74 174.75 2kn9 h MET 9 N 0.82 0.23 -1.77 1.40 2.86 -2.08 -3.47 114.93 112.92 2kn9 h MET 9 Ca -0.48 -0.36 0.13 0.00 -2.06 0.00 0.00 59.70 56.94 2kn9 h MET 9 Cb 1.23 0.13 -0.20 0.00 0.06 0.00 0.00 31.60 32.82 2kn9 h MET 9 CO 0.57 1.14 0.60 0.20 1.06 0.00 0.00 176.91 180.49 2kn9 s GLY 10 N -4.63 -0.32 -0.32 8.32 0.00 -1.26 -5.13 107.32 103.98 2kn9 s GLY 10 Ca -0.03 1.63 0.00 0.00 0.00 0.00 0.00 44.72 46.32 2kn9 s GLY 10 CO 0.87 0.69 0.29 -1.59 0.00 0.00 0.00 173.10 173.35 2kn9 s THR 11 N -2.08 -0.28 0.00 0.90 2.01 -1.26 -5.13 115.64 109.80 2kn9 s THR 11 Ca 0.03 -0.81 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 2kn9 s THR 11 Cb -0.01 -0.91 0.10 0.00 0.01 0.00 0.00 72.50 71.70 2kn9 s THR 11 CO -0.04 -0.59 1.11 -0.22 -0.69 0.00 0.00 174.62 174.18 2kn9 s LEU 12 N 1.90 -0.16 -0.04 4.42 2.96 -1.26 -5.14 118.68 121.36 2kn9 s LEU 12 Ca 0.13 -0.16 -0.30 0.00 -0.22 0.00 0.00 54.13 53.57 2kn9 s LEU 12 Cb -0.16 1.72 -0.03 0.00 0.50 0.00 0.00 46.19 48.23 2kn9 s LEU 12 CO -0.21 -0.52 1.14 -1.61 -1.32 0.00 0.00 176.35 173.84 2kn9 s GLU 13 N -2.80 4.40 0.13 1.98 2.02 -1.26 -4.92 118.70 118.25 2kn9 s GLU 13 Ca 0.11 1.61 0.22 0.00 0.02 0.00 0.00 54.97 56.93 2kn9 s GLU 13 Cb 0.01 -3.51 -0.08 0.00 0.10 0.00 0.00 34.13 30.64 2kn9 s GLU 13 CO -0.03 -0.36 0.90 0.00 0.02 0.00 0.00 175.26 175.79 2kn9 n ALA 14 N 4.86 2.64 -0.09 5.21 0.00 -1.26 -4.62 120.51 127.25 2kn9 n ALA 14 Ca 0.10 -0.31 -0.19 0.00 0.00 0.00 0.00 53.44 53.04 2kn9 n ALA 14 Cb 0.47 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.85 2kn9 n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kn9 n GLN 15 N -2.53 0.40 -3.36 0.00 10.64 -1.26 -5.04 117.38 116.23 2kn9 n GLN 15 Ca -0.01 0.18 -0.16 0.00 -1.83 0.00 0.00 57.00 55.17 2kn9 n GLN 15 Cb 0.55 -1.18 0.04 0.00 -0.86 0.00 0.00 30.24 28.78 2kn9 n GLN 15 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 2kn9 n THR 16 N -3.92 -8.07 -1.62 -0.39 -1.04 -1.26 -4.82 114.28 93.16 2kn9 n THR 16 Ca -0.34 -0.84 -0.62 0.00 -2.04 0.00 0.00 64.05 60.21 2kn9 n THR 16 Cb 0.71 -5.75 -0.09 0.00 -1.82 0.00 0.00 70.33 63.39 2kn9 n THR 16 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2kn9 n GLN 17 N -3.06 0.15 -4.12 -2.82 7.27 -1.26 -4.98 117.38 108.55 2kn9 n GLN 17 Ca -0.08 0.05 -0.09 0.00 0.07 0.00 0.00 57.00 56.96 2kn9 n GLN 17 Cb 0.58 -1.58 -0.10 0.00 2.41 0.00 0.00 30.24 31.56 2kn9 n GLN 17 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 2kn9 s GLY 18 N 1.47 0.76 0.71 1.69 0.00 -1.26 -5.17 107.32 105.52 2kn9 s GLY 18 Ca 0.97 -1.36 -0.11 0.00 0.00 0.00 0.00 44.72 44.22 2kn9 s GLY 18 CO 0.67 -1.35 1.07 -4.14 0.00 0.00 0.00 173.10 169.35 2kn9 s PRO 19 N -3.99 2.78 0.17 2.90 0.02 -1.26 -5.09 135.00 130.53 2kn9 s PRO 19 Ca 0.16 0.77 0.04 0.00 0.02 0.00 0.00 61.00 62.00 2kn9 s PRO 19 Cb 0.08 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2kn9 s PRO 19 CO -0.04 -1.16 -0.08 0.20 -0.33 0.00 0.00 177.00 175.59 2kn9 s GLY 20 N -3.95 1.20 -0.56 0.52 0.00 -1.26 -5.11 107.32 98.17 2kn9 s GLY 20 Ca 0.58 -1.56 -0.22 0.00 0.00 0.00 0.00 44.72 43.52 2kn9 s GLY 20 CO 0.54 -1.62 0.82 -0.45 0.00 0.00 0.00 173.10 172.39 2kn9 s SER 21 N -3.21 6.26 -0.06 1.64 0.15 -1.26 -4.81 113.70 112.41 2kn9 s SER 21 Ca 0.20 -0.72 -0.07 0.00 0.70 0.00 0.00 55.95 56.06 2kn9 s SER 21 Cb 0.03 -2.37 -0.04 0.00 -1.71 0.00 0.00 66.02 61.93 2kn9 s SER 21 CO 0.03 -1.14 -0.15 0.23 1.20 0.00 0.00 173.24 173.41 2kn9 n MET 22 N 6.99 0.23 -4.28 5.44 2.81 -1.26 -4.91 117.12 122.13 2kn9 n MET 22 Ca -0.03 0.10 -0.28 0.00 -1.81 0.00 0.00 57.70 55.67 2kn9 n MET 22 Cb 0.46 -0.89 -0.05 0.00 -0.71 0.00 0.00 33.22 32.03 2kn9 n MET 22 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2kn9 s ASN 23 N -5.99 4.38 -0.84 7.83 0.01 -1.26 -5.04 114.94 114.02 2kn9 s ASN 23 Ca -0.14 -1.36 -0.25 0.00 -0.71 0.00 0.00 52.86 50.41 2kn9 s ASN 23 Cb 0.04 0.21 0.00 0.00 0.41 0.00 0.00 41.25 41.91 2kn9 s ASN 23 CO 0.19 -0.86 1.63 -0.62 -1.51 0.00 0.00 177.10 175.93 2kn9 s ASP 24 N -4.03 5.81 0.13 -1.22 -1.08 -1.26 -4.94 116.67 110.08 2kn9 s ASP 24 Ca 0.26 -0.65 0.07 0.00 -0.52 0.00 0.00 52.55 51.70 2kn9 s ASP 24 Cb 0.01 -2.56 -0.04 0.00 -1.46 0.00 0.00 42.92 38.88 2kn9 s ASP 24 CO 0.15 -2.09 -0.16 -0.31 0.52 0.00 0.00 175.17 173.28 2kn9 s TYR 25 N 7.36 1.55 0.21 -5.34 2.02 -1.26 -5.07 117.35 116.83 2kn9 s TYR 25 Ca 0.54 -0.52 0.05 0.00 -0.37 0.00 0.00 57.07 56.78 2kn9 s TYR 25 Cb -0.06 -0.80 -0.04 0.00 -0.40 0.00 0.00 41.96 40.66 2kn9 s TYR 25 CO 0.04 0.20 0.23 0.15 -1.57 0.00 0.00 175.55 174.60 2kn9 s LYS 26 N -2.65 3.10 -0.30 -0.62 3.01 -1.26 -4.21 119.74 116.80 2kn9 s LYS 26 Ca 0.11 -0.88 -0.02 0.00 -1.01 0.00 0.00 55.97 54.17 2kn9 s LYS 26 Cb -0.05 -2.71 0.05 0.00 -1.01 0.00 0.00 37.83 34.11 2kn9 s LYS 26 CO 0.04 0.45 -0.00 -0.51 0.51 0.00 0.00 175.35 175.84 2kn9 s LEU 27 N -3.58 3.90 -0.38 3.17 1.43 0.77 -1.46 118.68 122.54 2kn9 s LEU 27 Ca 0.33 -1.30 -0.15 0.00 -1.03 0.00 0.00 54.13 51.98 2kn9 s LEU 27 Cb -0.09 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.43 2kn9 s LEU 27 CO 0.26 -0.26 0.36 -0.36 0.23 0.00 0.00 176.35 176.57 2kn9 s PHE 28 N 1.24 3.21 -0.19 0.29 0.40 0.91 0.13 117.98 123.97 2kn9 s PHE 28 Ca -0.05 -0.26 -0.07 0.00 -0.60 0.00 0.00 56.93 55.96 2kn9 s PHE 28 Cb -0.20 -2.70 -0.04 0.00 0.51 0.00 0.00 43.02 40.60 2kn9 s PHE 28 CO -0.01 -0.53 0.04 0.50 0.70 0.00 0.00 175.22 175.91 2kn9 s ARG 29 N 1.95 3.85 0.05 0.44 3.52 -0.42 -0.02 118.95 128.32 2kn9 s ARG 29 Ca 0.10 -0.41 -0.31 0.00 -0.13 0.00 0.00 55.73 54.98 2kn9 s ARG 29 Cb -0.17 -3.16 -0.06 0.00 -1.56 0.00 0.00 34.95 29.99 2kn9 s ARG 29 CO 0.12 0.19 1.33 0.00 -0.81 0.00 0.00 175.30 176.13 2kn9 n ILE 31 N 4.26 0.00 0.36 0.00 -5.35 -0.09 0.35 119.36 118.88 2kn9 n ILE 31 Ca 0.11 -0.01 0.12 0.00 -0.27 0.00 0.00 62.75 62.70 2kn9 n ILE 31 Cb 0.44 -0.30 0.18 0.00 -1.74 0.00 0.00 39.64 38.22 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 0.14 0.00 0.00 6.28 1.08 -1.91 -3.43 115.11 117.27 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 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 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 -0.26 1.09 3.62 0.00 0.00 0.15 -5.03 105.19 104.77 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 0.33 0.00 0.00 0.00 173.32 173.65 2kn9 n PHE 35 N -0.94 2.20 -3.47 1.61 7.35 -1.24 -4.60 117.46 118.36 2kn9 n PHE 35 Ca 0.00 -0.22 -0.40 0.00 -0.76 0.00 0.00 57.45 56.07 2kn9 n PHE 35 Cb 0.00 -2.75 -0.10 0.00 0.35 0.00 0.00 39.48 36.98 2kn9 n PHE 35 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2kn9 s GLU 36 N 5.49 3.54 -0.37 -4.13 2.02 -1.26 0.07 118.70 124.06 2kn9 s GLU 36 Ca 0.96 -0.53 -0.12 0.00 0.02 0.00 0.00 54.97 55.29 2kn9 s GLU 36 Cb -0.41 -3.80 0.01 0.00 0.10 0.00 0.00 34.13 30.03 2kn9 s GLU 36 CO 0.39 -0.47 0.23 -0.47 0.02 0.00 0.00 175.26 174.96 2kn9 s TYR 37 N 1.85 3.23 -0.14 1.61 5.04 0.97 -4.95 117.35 124.96 2kn9 s TYR 37 Ca 0.09 -0.62 -0.24 0.00 -2.44 0.00 0.00 57.07 53.85 2kn9 s TYR 37 Cb -0.17 -2.48 -0.02 0.00 0.35 0.00 0.00 41.96 39.64 2kn9 s TYR 37 CO 0.11 -0.54 0.78 -0.51 -1.34 0.00 0.00 175.55 174.06 2kn9 s ASP 38 N 1.64 6.95 0.42 4.32 1.11 -1.26 -0.06 116.67 129.78 2kn9 s ASP 38 Ca 0.04 1.16 0.12 0.00 0.18 0.00 0.00 52.55 54.04 2kn9 s ASP 38 Cb -0.18 -2.44 0.96 0.00 1.07 0.00 0.00 42.92 42.33 2kn9 s ASP 38 CO 0.08 -0.32 1.98 -0.33 1.18 0.00 0.00 175.17 177.77 2kn9 h GLU 39 N 7.20 0.48 0.00 8.23 5.08 -1.56 0.41 114.58 134.42 2kn9 h GLU 39 Ca -0.33 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 2kn9 h GLU 39 Cb 1.15 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 2kn9 h GLU 39 CO 0.81 0.32 -0.07 0.00 -1.00 0.00 0.00 179.01 179.07 2kn9 h ALA 40 N 1.68 1.00 0.04 3.43 0.00 -1.89 0.11 119.26 123.63 2kn9 h ALA 40 Ca 0.28 -0.06 -0.36 0.00 0.00 0.00 0.00 54.91 54.77 2kn9 h ALA 40 Cb 0.44 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2kn9 h ALA 40 CO -0.08 0.08 -2.04 -0.11 0.00 0.00 0.00 179.25 177.10 2kn9 n LEU 41 N -3.17 2.38 0.00 0.00 7.94 -0.28 -3.96 117.00 119.91 2kn9 n LEU 41 Ca 0.01 0.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 2kn9 n LEU 41 Cb 0.38 -0.97 0.00 0.00 0.53 0.00 0.00 43.42 43.35 2kn9 n LEU 41 CO 0.30 0.67 0.00 0.61 -1.11 0.00 0.00 177.39 177.86 2kn9 n GLY 42 N 1.76 -1.62 2.98 -3.96 0.00 -0.02 -4.02 105.19 100.31 2kn9 n GLY 42 Ca -0.40 -1.33 -0.03 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 -1.50 0.45 1.61 -0.11 0.78 -4.79 118.94 115.38 2kn9 s TRP 43 Ca 0.00 -0.21 0.27 0.00 1.22 0.00 0.00 56.10 57.38 2kn9 s TRP 43 Cb 0.00 0.23 1.49 0.00 -1.50 0.00 0.00 33.47 33.69 2kn9 s TRP 43 CO 0.00 -1.19 2.10 -1.35 -4.62 0.00 0.00 176.95 171.89 2kn9 h PRO 44 N 6.21 0.00 -0.86 5.86 0.11 -1.85 0.32 132.00 141.79 2kn9 h PRO 44 Ca 0.06 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.19 2kn9 h PRO 44 Cb 1.14 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 2kn9 h PRO 44 CO 0.08 0.10 0.57 0.93 -0.21 0.00 0.00 178.00 179.47 2kn9 h GLU 45 N 0.00 1.10 0.00 1.05 4.39 -1.96 -2.41 114.58 116.76 2kn9 h GLU 45 Ca -0.00 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.56 2kn9 h GLU 45 Cb 0.27 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2kn9 h GLU 45 CO 0.01 0.73 -1.42 -3.47 -1.16 0.00 0.00 179.01 173.70 2kn9 n ASP 46 N -4.42 0.62 0.00 1.42 2.03 -0.95 -4.96 116.55 110.29 2kn9 n ASP 46 Ca 0.10 0.25 0.00 0.00 0.52 0.00 0.00 54.79 55.66 2kn9 n ASP 46 Cb 0.05 0.73 0.00 0.00 -0.72 0.00 0.00 41.12 41.18 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 1.29 1.45 3.57 0.27 0.00 -0.88 -5.09 105.19 105.80 2kn9 n GLY 47 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 4.74 0.46 -0.61 -1.09 0.05 -4.93 121.20 117.82 2kn9 s ILE 48 Ca 0.00 0.70 -0.21 0.00 -2.23 0.00 0.00 60.65 58.91 2kn9 s ILE 48 Cb 0.00 -4.22 -0.09 0.00 -1.58 0.00 0.00 42.46 36.58 2kn9 s ILE 48 CO 0.00 -0.49 1.03 0.00 -1.23 0.00 0.00 174.94 174.25 2kn9 s ALA 49 N 3.08 2.95 -0.18 9.38 0.00 -1.26 -0.16 121.76 135.57 2kn9 s ALA 49 Ca 0.30 0.61 -0.28 0.00 0.00 0.00 0.00 51.96 52.59 2kn9 s ALA 49 Cb -0.13 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 2kn9 s ALA 49 CO 0.18 -0.24 2.18 0.00 0.00 0.00 0.00 175.76 177.88 2kn9 s ALA 50 N -1.91 2.87 0.00 0.00 0.00 -1.26 -0.92 121.76 120.54 2kn9 s ALA 50 Ca 0.64 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.47 2kn9 s ALA 50 Cb -0.17 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 18.91 2kn9 s ALA 50 CO 0.21 -2.60 0.00 0.41 0.00 0.00 0.00 175.76 173.79 2kn9 n GLY 51 N 5.56 1.02 3.69 0.00 0.00 0.38 -4.93 105.19 110.90 2kn9 n GLY 51 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 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 4.27 0.39 2.61 2.01 -0.09 -4.96 115.64 117.86 2kn9 s THR 52 Ca 0.00 1.59 -0.25 0.00 0.31 0.00 0.00 61.69 63.34 2kn9 s THR 52 Cb 0.00 -4.02 -0.09 0.00 0.01 0.00 0.00 72.50 68.40 2kn9 s THR 52 CO 0.00 -0.01 1.08 -0.13 -0.69 0.00 0.00 174.62 174.87 2kn9 s ARG 53 N 2.29 4.19 0.59 4.92 1.81 -1.26 -4.79 118.95 126.69 2kn9 s ARG 53 Ca 0.55 1.61 0.29 0.00 -1.72 0.00 0.00 55.73 56.46 2kn9 s ARG 53 Cb -0.24 -2.64 1.67 0.00 -0.45 0.00 0.00 34.95 33.29 2kn9 s ARG 53 CO 0.21 -0.14 2.12 2.35 -0.68 0.00 0.00 175.30 179.15 2kn9 h TRP 54 N 2.66 0.00 -0.71 -0.53 2.91 -1.94 -0.76 115.95 117.58 2kn9 h TRP 54 Ca -0.48 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 59.47 2kn9 h TRP 54 Cb 1.22 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.84 2kn9 h TRP 54 CO 0.57 0.00 0.17 -0.44 -1.03 0.00 0.00 178.44 177.72 2kn9 h ASP 55 N 0.00 1.08 1.81 2.65 5.19 -2.01 -2.77 116.42 122.37 2kn9 h ASP 55 Ca 0.08 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.25 2kn9 h ASP 55 Cb 0.44 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2kn9 h ASP 55 CO -0.00 1.03 0.00 -0.78 -3.12 0.00 0.00 179.24 176.37 2kn9 h ASP 56 N 1.08 0.00 -2.91 6.45 3.58 -1.52 -3.44 116.42 119.66 2kn9 h ASP 56 Ca 0.22 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 57.12 2kn9 h ASP 56 Cb 0.38 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.40 2kn9 h ASP 56 CO 0.00 0.00 0.86 -0.63 -2.88 0.00 0.00 179.24 176.59 2kn9 s ILE 57 N -3.29 4.02 0.50 2.25 1.01 -1.05 -4.97 121.20 119.67 2kn9 s ILE 57 Ca 0.06 1.32 -0.22 0.00 0.00 0.00 0.00 60.65 61.81 2kn9 s ILE 57 Cb 0.06 -3.85 -0.08 0.00 0.01 0.00 0.00 42.46 38.60 2kn9 s ILE 57 CO 0.65 -0.06 1.05 -0.81 0.00 0.00 0.00 174.94 175.77 2kn9 n PRO 58 N 5.98 1.30 0.27 2.79 -0.04 -1.26 -4.88 135.00 139.15 2kn9 n PRO 58 Ca 0.13 0.48 0.13 0.00 -0.04 0.00 0.00 63.50 64.20 2kn9 n PRO 58 Cb 0.45 -2.17 0.74 0.00 -0.04 0.00 0.00 33.50 32.47 2kn9 n PRO 58 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2kn9 h ASP 59 N 1.23 0.00 0.05 3.54 3.32 -1.94 -0.81 116.42 121.80 2kn9 h ASP 59 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2kn9 h ASP 59 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2kn9 h ASP 59 CO 0.55 0.11 -0.03 -0.90 -1.72 0.00 0.00 179.24 177.25 2kn9 n ASP 60 N -3.60 0.94 -4.66 6.45 5.75 -1.26 -4.44 116.55 115.71 2kn9 n ASP 60 Ca -0.02 -1.22 -0.42 0.00 -0.01 0.00 0.00 54.79 53.12 2kn9 n ASP 60 Cb 0.24 -0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 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 -2.08 1.77 0.08 2.11 -0.00 -0.31 -4.97 118.94 115.53 2kn9 s TRP 61 Ca 0.39 -0.02 0.01 0.00 -0.00 0.00 0.00 56.10 56.48 2kn9 s TRP 61 Cb 0.21 -4.03 -0.04 0.00 -0.00 0.00 0.00 33.47 29.61 2kn9 s TRP 61 CO 0.37 -4.44 0.19 -1.54 -0.00 0.00 0.00 176.95 171.53 2kn9 s SER 62 N 3.65 6.16 -0.04 5.86 1.04 -1.26 -3.29 113.70 125.82 2kn9 s SER 62 Ca 0.78 0.19 -0.30 0.00 0.48 0.00 0.00 55.95 57.10 2kn9 s SER 62 Cb -0.37 -1.84 -0.08 0.00 0.10 0.00 0.00 66.02 63.83 2kn9 s SER 62 CO 0.34 0.15 2.03 0.00 0.98 0.00 0.00 173.24 176.74 2kn9 n PRO 64 N 7.74 0.11 -0.02 0.00 -0.04 -1.26 -0.50 135.00 141.02 2kn9 n PRO 64 Ca 0.23 0.59 -0.19 0.00 -0.04 0.00 0.00 63.50 64.09 2kn9 n PRO 64 Cb 0.40 -1.92 -0.13 0.00 -0.04 0.00 0.00 33.50 31.81 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 0.22 0.00 3.54 3.58 -1.97 -3.45 116.42 118.34 2kn9 h ASP 65 Ca 0.00 -0.86 0.00 0.00 0.42 0.00 0.00 57.03 56.59 2kn9 h ASP 65 Cb 0.15 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2kn9 h ASP 65 CO 0.00 1.36 -0.88 0.00 -2.88 0.00 0.00 179.24 176.84 2kn9 n GLY 67 N 2.91 0.41 3.77 0.00 0.00 0.34 -4.98 105.19 107.63 2kn9 n GLY 67 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.36 2.87 0.92 4.61 0.00 -1.26 -4.43 121.76 123.11 2kn9 s ALA 68 Ca 0.00 0.95 -0.13 0.00 0.00 0.00 0.00 51.96 52.78 2kn9 s ALA 68 Cb 0.00 -3.40 0.19 0.00 0.00 0.00 0.00 23.12 19.91 2kn9 s ALA 68 CO 0.00 -0.78 1.26 0.00 0.00 0.00 0.00 175.76 176.24 2kn9 s ALA 69 N -1.58 2.52 0.50 0.00 0.00 -1.26 0.61 121.76 122.55 2kn9 s ALA 69 Ca 0.67 -1.32 0.20 0.00 0.00 0.00 0.00 51.96 51.51 2kn9 s ALA 69 Cb -0.29 -2.62 1.26 0.00 0.00 0.00 0.00 23.12 21.48 2kn9 s ALA 69 CO 0.34 -2.26 2.02 0.87 0.00 0.00 0.00 175.76 176.73 2kn9 h LYS 70 N -1.43 0.12 0.00 0.00 1.57 -1.77 0.18 116.57 115.24 2kn9 h LYS 70 Ca -0.43 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2kn9 h LYS 70 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2kn9 h LYS 70 CO 0.38 0.08 0.00 0.77 -0.57 0.00 0.00 179.45 180.11 2kn9 h SER 71 N 0.12 0.00 -0.56 0.86 0.02 -1.92 -0.73 113.55 111.35 2kn9 h SER 71 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2kn9 h SER 71 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2kn9 h SER 71 CO -0.02 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.14 2kn9 n ASP 72 N -2.54 4.68 -4.83 3.07 8.00 0.05 -4.93 116.55 120.06 2kn9 n ASP 72 Ca -0.01 -2.58 -0.29 0.00 0.71 0.00 0.00 54.79 52.63 2kn9 n ASP 72 Cb 0.10 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 40.58 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 -2.08 3.27 -0.09 1.24 0.40 -0.28 -0.91 117.98 119.53 2kn9 s PHE 73 Ca 0.48 0.08 0.01 0.00 -0.60 0.00 0.00 56.93 56.91 2kn9 s PHE 73 Cb 0.33 -1.62 -0.02 0.00 0.51 0.00 0.00 43.02 42.22 2kn9 s PHE 73 CO 0.20 0.53 -0.11 -1.83 0.70 0.00 0.00 175.22 174.72 2kn9 s GLU 74 N -2.71 2.95 -0.55 0.44 -1.05 0.10 -4.90 118.70 112.98 2kn9 s GLU 74 Ca 0.31 -0.63 -0.27 0.00 -0.15 0.00 0.00 54.97 54.23 2kn9 s GLU 74 Cb -0.12 -2.57 0.03 0.00 -0.44 0.00 0.00 34.13 31.04 2kn9 s GLU 74 CO 0.24 0.47 1.11 1.41 0.95 0.00 0.00 175.26 179.44 2kn9 s MET 75 N -0.32 3.51 -0.16 -4.83 -2.45 -1.26 -1.30 119.30 112.49 2kn9 s MET 75 Ca 0.04 0.19 -0.08 0.00 -1.25 0.00 0.00 55.69 54.58 2kn9 s MET 75 Cb -0.13 -4.00 -0.04 0.00 1.25 0.00 0.00 34.83 31.91 2kn9 s MET 75 CO 0.02 -1.55 0.11 0.08 1.05 0.00 0.00 175.02 174.73 2kn9 s VAL 76 N 4.56 5.24 0.12 10.11 1.01 0.12 -4.97 120.40 136.59 2kn9 s VAL 76 Ca 0.41 0.12 -0.13 0.00 0.00 0.00 0.00 61.98 62.38 2kn9 s VAL 76 Cb -0.09 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 2kn9 s VAL 76 CO 0.25 0.51 0.50 -1.83 0.00 0.00 0.00 175.10 174.53 2kn9 s GLU 77 N -0.15 3.91 0.27 2.72 -1.05 -1.26 -0.16 118.70 122.98 2kn9 s GLU 77 Ca 0.09 0.39 -0.30 0.00 -0.15 0.00 0.00 54.97 55.01 2kn9 s GLU 77 Cb -0.12 -2.97 -0.10 0.00 -0.44 0.00 0.00 34.13 30.51 2kn9 s GLU 77 CO 0.01 0.52 1.39 0.14 0.95 0.00 0.00 175.26 178.26 2kn9 s VAL 78 N -1.42 2.73 -0.09 1.83 -7.23 -1.26 -4.90 120.40 110.06 2kn9 s VAL 78 Ca 0.36 0.64 -0.30 0.00 -1.81 0.00 0.00 61.98 60.87 2kn9 s VAL 78 Cb -0.15 -3.41 -0.03 0.00 0.56 0.00 0.00 36.38 33.35 2kn9 s VAL 78 CO 0.19 0.12 1.33 0.00 -0.31 0.00 0.00 175.10 176.42 2kn9 s ALA 79 N -0.34 3.60 -0.51 1.32 0.00 -1.26 -4.95 121.76 119.62 2kn9 s ALA 79 Ca 0.56 0.66 -0.28 0.00 0.00 0.00 0.00 51.96 52.90 2kn9 s ALA 79 Cb -0.41 -3.60 -0.01 0.00 0.00 0.00 0.00 23.12 19.10 2kn9 s ALA 79 CO 0.46 -1.04 1.65 1.03 0.00 0.00 0.00 175.76 177.87 2kn9 s ARG 80 N 2.98 3.11 0.00 0.00 3.00 -1.26 -4.87 118.95 121.92 2kn9 s ARG 80 Ca 0.59 0.78 0.26 0.00 0.00 0.00 0.00 55.73 57.37 2kn9 s ARG 80 Cb -0.26 -4.22 0.69 0.00 0.00 0.00 0.00 34.95 31.16 2kn9 s ARG 80 CO 0.21 -2.15 1.54 0.43 0.00 0.00 0.00 175.30 175.34