#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kx7 s ASP -2 N 0.00 -0.98 -1.12 0.00 -4.77 -1.26 -5.07 116.67 103.48 1kx7 s ASP -2 Ca 0.00 1.40 -0.19 0.00 -3.30 0.00 0.00 52.55 50.46 1kx7 s ASP -2 Cb 0.00 1.91 -0.05 0.00 -1.09 0.00 0.00 42.92 43.69 1kx7 s ASP -2 CO 0.00 -0.20 2.01 -0.11 0.70 0.00 0.00 175.17 177.56 1kx7 n LEU -1 N 4.98 4.99 -0.05 2.11 7.94 -1.26 -4.35 117.00 131.36 1kx7 n LEU -1 Ca -0.14 -3.47 -0.02 0.00 -1.11 0.00 0.00 56.01 51.26 1kx7 n LEU -1 Cb 0.53 -1.46 -0.11 0.00 0.53 0.00 0.00 43.42 42.91 1kx7 n LEU -1 CO -0.03 0.00 -0.85 0.00 -1.11 0.00 0.00 177.39 175.40 1kx7 n GLN 1 N 7.04 1.35 -3.60 1.96 3.00 -1.26 -4.90 117.38 120.97 1kx7 n GLN 1 Ca 0.50 -0.05 -0.19 0.00 -0.01 0.00 0.00 57.00 57.25 1kx7 n GLN 1 Cb 0.41 -1.35 -0.15 0.00 0.00 0.00 0.00 30.24 29.16 1kx7 n GLN 1 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1kx7 s ASP 2 N -4.34 1.19 0.41 1.08 -1.08 -1.26 -5.03 116.67 107.63 1kx7 s ASP 2 Ca -0.06 0.01 0.24 0.00 -0.52 0.00 0.00 52.55 52.22 1kx7 s ASP 2 Cb 0.06 0.25 1.29 0.00 -1.46 0.00 0.00 42.92 43.06 1kx7 s ASP 2 CO 0.57 -0.29 1.66 0.00 0.52 0.00 0.00 175.17 177.63 1kx7 h ALA 3 N 8.35 2.46 -0.22 3.66 0.00 -1.91 0.30 119.26 131.91 1kx7 h ALA 3 Ca -0.15 0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1kx7 h ALA 3 Cb 1.13 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1kx7 h ALA 3 CO 0.21 -1.05 -0.11 1.49 0.00 0.00 0.00 179.25 179.80 1kx7 h GLU 4 N 0.19 -0.08 -0.21 0.00 4.81 -1.91 -0.76 114.58 116.61 1kx7 h GLU 4 Ca 0.76 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.90 1kx7 h GLU 4 Cb 2.17 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.56 1kx7 h GLU 4 CO -0.45 -0.05 -0.30 0.00 -0.73 0.00 0.00 179.01 177.48 1kx7 h ALA 5 N 1.10 1.10 0.07 2.92 0.00 -0.89 0.97 119.26 124.54 1kx7 h ALA 5 Ca 0.12 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1kx7 h ALA 5 Cb 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1kx7 h ALA 5 CO -0.27 0.56 -0.04 0.82 0.00 0.00 0.00 179.25 180.33 1kx7 h ILE 6 N 0.37 1.12 -0.52 0.00 1.08 -0.84 0.84 117.51 119.56 1kx7 h ILE 6 Ca 0.05 -0.69 -0.12 0.00 -0.39 0.00 0.00 64.86 63.71 1kx7 h ILE 6 Cb 0.71 1.56 -0.02 0.00 -3.07 0.00 0.00 36.82 36.01 1kx7 h ILE 6 CO 0.05 0.17 -0.15 0.10 -0.69 0.00 0.00 178.15 177.64 1kx7 h TYR 7 N -0.41 1.15 0.00 1.37 -0.00 -0.88 0.22 116.97 118.43 1kx7 h TYR 7 Ca -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 58.73 58.44 1kx7 h TYR 7 Cb 0.35 -0.28 -0.00 0.00 0.00 0.00 0.00 36.73 36.80 1kx7 h TYR 7 CO 0.03 1.08 -0.12 -0.97 -0.00 0.00 0.00 178.16 178.19 1kx7 h ASN 8 N 0.89 0.00 0.19 0.10 -1.24 -0.78 0.20 115.58 114.94 1kx7 h ASN 8 Ca 0.13 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.91 1kx7 h ASN 8 Cb 0.72 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.73 1kx7 h ASN 8 CO 0.06 0.12 -2.03 1.17 -1.29 0.00 0.00 177.43 175.45 1kx7 n LYS 9 N -3.32 0.66 -0.01 6.67 4.81 0.29 -4.68 118.16 122.57 1kx7 n LYS 9 Ca -0.00 0.02 -0.01 0.00 -0.87 0.00 0.00 58.31 57.44 1kx7 n LYS 9 Cb 0.33 -1.60 -0.00 0.00 0.02 0.00 0.00 35.03 33.77 1kx7 n LYS 9 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1kx7 n ALA 10 N -2.54 0.61 -0.50 3.14 0.00 0.76 -4.68 120.51 117.30 1kx7 n ALA 10 Ca -0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 53.44 52.93 1kx7 n ALA 10 Cb 0.94 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 20.37 1kx7 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kx7 n THR 12 N 1.78 0.00 -0.10 0.00 5.66 -1.20 -4.13 114.28 116.30 1kx7 n THR 12 Ca 0.07 -0.33 -0.19 0.00 -3.05 0.00 0.00 64.05 60.55 1kx7 n THR 12 Cb 0.49 1.33 -0.06 0.00 -1.55 0.00 0.00 70.33 70.53 1kx7 n THR 12 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1kx7 n VAL 13 N -0.02 1.29 -0.02 1.08 0.31 -1.25 -4.41 118.33 115.30 1kx7 n VAL 13 Ca 0.00 -0.15 -0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1kx7 n VAL 13 Cb 0.08 -1.93 -0.00 0.00 -0.91 0.00 0.00 33.84 31.09 1kx7 n VAL 13 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kx7 h HIS 15 N -0.42 0.00 -0.35 0.00 -0.00 -1.78 0.40 115.15 113.01 1kx7 h HIS 15 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.23 1kx7 h HIS 15 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.41 1kx7 h HIS 15 CO -0.00 0.00 -0.32 1.03 -0.00 0.00 0.00 177.93 178.64 1kx7 h SER 16 N 0.00 0.89 0.00 2.45 0.87 -1.77 -0.60 113.55 115.39 1kx7 h SER 16 Ca 0.00 -0.46 -0.04 0.00 -1.23 0.00 0.00 61.79 60.06 1kx7 h SER 16 Cb 0.51 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1kx7 h SER 16 CO 0.00 1.16 -1.17 0.80 -0.53 0.00 0.00 176.83 177.10 1kx7 n MET 17 N -4.16 1.58 -0.43 2.24 1.56 -1.17 -4.64 117.12 112.10 1kx7 n MET 17 Ca -0.03 0.01 0.00 0.00 -0.27 0.00 0.00 57.70 57.41 1kx7 n MET 17 Cb 0.50 -1.06 0.00 0.00 2.15 0.00 0.00 33.22 34.81 1kx7 n MET 17 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1kx7 n GLY 18 N 3.14 0.76 0.08 -5.12 0.00 0.14 -4.99 105.19 99.21 1kx7 n GLY 18 Ca -0.05 -0.49 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 1kx7 n GLY 18 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1kx7 h VAL 19 N 0.00 0.84 -0.15 1.61 2.07 -1.82 -3.32 116.25 115.48 1kx7 h VAL 19 Ca 0.00 -1.53 -0.09 0.00 0.82 0.00 0.00 66.70 65.91 1kx7 h VAL 19 Cb 0.26 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 1kx7 h VAL 19 CO 0.00 0.27 0.11 0.00 0.02 0.00 0.00 177.57 177.97 1kx7 n ALA 20 N -2.68 3.37 -2.61 1.67 0.00 -1.26 -4.68 120.51 114.32 1kx7 n ALA 20 Ca -0.05 -0.47 -0.19 0.00 0.00 0.00 0.00 53.44 52.72 1kx7 n ALA 20 Cb 0.24 -1.08 0.01 0.00 0.00 0.00 0.00 19.45 18.61 1kx7 n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kx7 n GLY 21 N 0.50 -0.41 3.79 0.00 0.00 -1.25 -5.00 105.19 102.82 1kx7 n GLY 21 Ca 0.09 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1kx7 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kx7 s ALA 22 N -3.02 2.98 0.64 4.61 0.00 -1.26 -5.04 121.76 120.66 1kx7 s ALA 22 Ca 0.12 0.63 -0.15 0.00 0.00 0.00 0.00 51.96 52.55 1kx7 s ALA 22 Cb -0.05 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 1kx7 s ALA 22 CO 0.15 -0.22 1.09 -1.25 0.00 0.00 0.00 175.76 175.52 1kx7 s PRO 23 N -2.90 3.00 0.16 0.00 0.04 -1.26 -4.35 135.00 129.69 1kx7 s PRO 23 Ca 0.63 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 1kx7 s PRO 23 Cb -0.18 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 1kx7 s PRO 23 CO 0.22 -1.08 0.97 0.15 0.04 0.00 0.00 177.00 177.30 1kx7 s LYS 24 N -4.11 4.74 0.38 4.56 1.02 -1.26 -4.43 119.74 120.64 1kx7 s LYS 24 Ca 0.65 1.50 0.29 0.00 0.02 0.00 0.00 55.97 58.43 1kx7 s LYS 24 Cb -0.19 -3.33 1.30 0.00 -0.52 0.00 0.00 37.83 35.09 1kx7 s LYS 24 CO 0.40 0.30 1.35 0.43 -0.92 0.00 0.00 175.35 176.92 1kx7 n SER 25 N 2.28 0.18 -3.84 2.83 7.64 -0.23 -3.70 113.62 118.77 1kx7 n SER 25 Ca 0.01 1.19 -0.26 0.00 1.01 0.00 0.00 58.87 60.81 1kx7 n SER 25 Cb 0.48 -0.58 -0.17 0.00 -1.01 0.00 0.00 64.21 62.93 1kx7 n SER 25 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 1kx7 s HIS 26 N -5.01 1.25 0.16 1.43 0.00 -1.26 -4.75 115.29 107.10 1kx7 s HIS 26 Ca -0.06 -0.68 -0.15 0.00 -3.00 0.00 0.00 55.06 51.16 1kx7 s HIS 26 Cb 0.27 -1.10 0.03 0.00 -4.00 0.00 0.00 32.58 27.77 1kx7 s HIS 26 CO 0.71 -0.50 0.42 -0.80 -1.00 0.00 0.00 174.74 173.57 1kx7 s ASN 27 N 1.79 -0.19 -0.11 7.38 0.01 -1.24 -5.08 114.94 117.48 1kx7 s ASN 27 Ca 0.03 -0.47 0.04 0.00 -0.71 0.00 0.00 52.86 51.75 1kx7 s ASN 27 Cb -0.14 0.50 -0.10 0.00 0.41 0.00 0.00 41.25 41.93 1kx7 s ASN 27 CO -0.07 -0.93 -0.06 0.41 -1.51 0.00 0.00 177.10 174.94 1kx7 n THR 28 N -0.26 0.70 0.13 1.60 -1.04 -1.26 -4.45 114.28 109.70 1kx7 n THR 28 Ca -0.13 -0.32 0.02 0.00 -2.04 0.00 0.00 64.05 61.58 1kx7 n THR 28 Cb 0.63 -0.87 0.01 0.00 -1.82 0.00 0.00 70.33 68.28 1kx7 n THR 28 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1kx7 h ALA 29 N 0.17 0.66 0.03 2.41 0.00 -1.99 0.04 119.26 120.58 1kx7 h ALA 29 Ca -0.27 -0.50 -0.22 0.00 0.00 0.00 0.00 54.91 53.92 1kx7 h ALA 29 Cb 1.49 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 1kx7 h ALA 29 CO -0.02 0.67 -1.02 0.22 0.00 0.00 0.00 179.25 179.09 1kx7 h ASP 30 N 0.00 0.13 0.52 0.00 1.82 -1.98 -3.33 116.42 113.57 1kx7 h ASP 30 Ca -0.02 -0.13 -0.29 0.00 -0.39 0.00 0.00 57.03 56.20 1kx7 h ASP 30 Cb 1.41 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 41.37 1kx7 h ASP 30 CO 0.07 1.07 -1.47 -0.50 -1.61 0.00 0.00 179.24 176.79 1kx7 h TRP 31 N 0.03 0.38 -0.82 0.28 4.06 -1.74 -3.39 115.95 114.75 1kx7 h TRP 31 Ca -0.04 -0.28 0.09 0.00 2.06 0.00 0.00 58.89 60.72 1kx7 h TRP 31 Cb 1.75 -0.02 -0.11 0.00 -1.00 0.00 0.00 29.16 29.78 1kx7 h TRP 31 CO 0.02 1.31 -0.55 1.49 -3.56 0.00 0.00 178.44 177.16 1kx7 h GLU 32 N 0.06 -0.11 0.00 0.49 4.81 -1.09 0.12 114.58 118.86 1kx7 h GLU 32 Ca -0.22 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1kx7 h GLU 32 Cb 1.99 0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.39 1kx7 h GLU 32 CO 0.16 -0.07 0.00 -0.35 -0.73 0.00 0.00 179.01 178.01 1kx7 n PRO 33 N -5.32 0.69 -0.10 0.92 -0.04 -1.26 -2.20 135.00 127.69 1kx7 n PRO 33 Ca 0.02 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.32 1kx7 n PRO 33 Cb 0.30 -1.16 -0.09 0.00 -0.04 0.00 0.00 33.50 32.51 1kx7 n PRO 33 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1kx7 n ARG 34 N -0.66 0.49 0.00 0.54 3.00 -0.13 -4.38 116.66 115.52 1kx7 n ARG 34 Ca 0.05 0.13 0.00 0.00 -0.01 0.00 0.00 57.85 58.02 1kx7 n ARG 34 Cb 0.02 -1.37 0.00 0.00 0.00 0.00 0.00 32.46 31.12 1kx7 n ARG 34 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1kx7 n LEU 35 N -3.25 0.42 -0.00 0.55 4.77 -0.27 -3.34 117.00 115.88 1kx7 n LEU 35 Ca -0.36 -0.21 -0.18 0.00 -0.03 0.00 0.00 56.01 55.23 1kx7 n LEU 35 Cb 0.86 -0.15 -0.14 0.00 -2.33 0.00 0.00 43.42 41.66 1kx7 n LEU 35 CO 0.16 0.09 -0.72 0.00 -1.33 0.00 0.00 177.39 175.59 1kx7 n ALA 36 N 0.46 1.06 0.00 -1.18 0.00 -1.14 -4.33 120.51 115.38 1kx7 n ALA 36 Ca 0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 53.44 52.72 1kx7 n ALA 36 Cb 0.09 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 18.73 1kx7 n ALA 36 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1kx7 h LYS 37 N 0.05 -0.12 0.00 0.00 1.57 -1.87 -3.49 116.57 112.70 1kx7 h LYS 37 Ca -0.38 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1kx7 h LYS 37 Cb 2.03 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.37 1kx7 h LYS 37 CO 0.09 0.33 0.00 0.41 -0.57 0.00 0.00 179.45 179.71 1kx7 n GLY 38 N 1.13 0.15 1.33 3.86 0.00 -1.26 -5.09 105.19 105.33 1kx7 n GLY 38 Ca -0.06 -0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.10 1kx7 n GLY 38 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1kx7 n VAL 39 N 0.00 -0.42 0.00 1.61 0.31 -1.26 -4.81 118.33 113.77 1kx7 n VAL 39 Ca 0.00 0.66 0.00 0.00 -0.01 0.00 0.00 64.34 64.99 1kx7 n VAL 39 Cb 0.00 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 31.82 1kx7 n VAL 39 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1kx7 n ASP 40 N -4.17 0.00 -0.30 4.52 8.00 -1.26 -4.59 116.55 118.75 1kx7 n ASP 40 Ca -0.06 0.00 0.27 0.00 0.71 0.00 0.00 54.79 55.71 1kx7 n ASP 40 Cb 0.63 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.22 1kx7 n ASP 40 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1kx7 n ASN 41 N 2.69 0.25 0.02 -2.24 3.02 -1.26 -0.58 115.26 117.17 1kx7 n ASN 41 Ca 0.00 1.52 -0.13 0.00 -0.03 0.00 0.00 54.58 55.94 1kx7 n ASN 41 Cb 0.00 -0.71 -0.09 0.00 -0.61 0.00 0.00 39.78 38.37 1kx7 n ASN 41 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1kx7 h LEU 42 N 0.00 -0.06 -1.97 3.41 -0.00 -1.81 0.15 115.31 115.03 1kx7 h LEU 42 Ca 0.74 -0.38 0.26 0.00 -0.00 0.00 0.00 57.88 58.50 1kx7 h LEU 42 Cb 1.90 0.02 -0.04 0.00 -0.00 0.00 0.00 40.66 42.54 1kx7 h LEU 42 CO -0.73 0.36 0.67 1.62 -0.00 0.00 0.00 178.44 180.36 1kx7 h VAL 43 N -0.49 0.49 0.18 1.22 3.04 -1.07 0.40 116.25 120.02 1kx7 h VAL 43 Ca -0.01 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 65.37 1kx7 h VAL 43 Cb 0.44 0.52 0.01 0.00 -2.01 0.00 0.00 31.29 30.25 1kx7 h VAL 43 CO 0.01 0.00 -1.45 0.11 -1.01 0.00 0.00 177.57 175.23 1kx7 h LYS 44 N 0.00 0.37 0.00 4.17 1.57 -0.48 -2.17 116.57 120.03 1kx7 h LYS 44 Ca 0.42 -0.63 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1kx7 h LYS 44 Cb 1.76 0.24 0.00 0.00 0.08 0.00 0.00 32.23 34.31 1kx7 h LYS 44 CO -0.00 1.28 0.00 0.77 -0.57 0.00 0.00 179.45 180.93 1kx7 h SER 45 N 0.10 0.00 0.12 0.86 0.02 0.34 -3.18 113.55 111.81 1kx7 h SER 45 Ca -0.23 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.38 1kx7 h SER 45 Cb 2.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.59 1kx7 h SER 45 CO 0.22 0.00 -1.84 1.62 -1.14 0.00 0.00 176.83 175.68 1kx7 h VAL 46 N 0.00 0.74 -0.98 2.27 3.04 -0.32 -2.89 116.25 118.10 1kx7 h VAL 46 Ca 0.00 -2.36 0.15 0.00 -1.01 0.00 0.00 66.70 63.48 1kx7 h VAL 46 Cb 0.68 2.54 -0.09 0.00 -2.01 0.00 0.00 31.29 32.41 1kx7 h VAL 46 CO 0.00 0.83 0.62 0.07 -1.01 0.00 0.00 177.57 178.07 1kx7 h LYS 47 N -0.05 0.81 -0.15 4.17 5.09 -1.42 -1.28 116.57 123.74 1kx7 h LYS 47 Ca -0.39 -0.05 -0.22 0.00 0.09 0.00 0.00 60.65 60.08 1kx7 h LYS 47 Cb 1.96 -0.18 0.01 0.00 0.10 0.00 0.00 32.23 34.11 1kx7 h LYS 47 CO 0.07 0.54 -0.76 0.00 -2.09 0.00 0.00 179.45 177.21 1kx7 h THR 48 N 0.84 1.29 -2.63 0.07 1.03 -1.69 -1.35 112.91 110.47 1kx7 h THR 48 Ca 0.52 -1.99 0.00 0.00 -0.01 0.00 0.00 66.41 64.93 1kx7 h THR 48 Cb 0.72 1.98 0.00 0.00 -1.07 0.00 0.00 68.15 69.78 1kx7 h THR 48 CO -0.30 0.63 0.00 0.61 -0.01 0.00 0.00 175.52 176.45 1kx7 n GLY 49 N 0.66 -2.54 3.44 2.99 0.00 -0.52 -4.38 105.19 104.84 1kx7 n GLY 49 Ca -0.07 -0.44 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 1kx7 n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1kx7 n LEU 50 N 0.00 -1.51 -0.11 0.99 7.94 -1.22 -4.80 117.00 118.28 1kx7 n LEU 50 Ca 0.00 -0.14 -0.12 0.00 -1.11 0.00 0.00 56.01 54.64 1kx7 n LEU 50 Cb 0.00 -1.21 -0.07 0.00 0.53 0.00 0.00 43.42 42.67 1kx7 n LEU 50 CO 0.00 -3.25 0.55 0.78 -1.11 0.00 0.00 177.39 174.36 1kx7 h ASN 51 N -2.58 -1.57 -0.26 1.96 2.35 -1.97 0.22 115.58 113.74 1kx7 h ASN 51 Ca -0.60 0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1kx7 h ASN 51 Cb 1.34 0.66 0.00 0.00 0.05 0.00 0.00 38.32 40.37 1kx7 h ASN 51 CO 0.47 -0.39 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 1kx7 n ALA 52 N -3.06 2.73 -2.65 -0.83 0.00 -1.26 -4.88 120.51 110.56 1kx7 n ALA 52 Ca -0.02 -0.62 -0.27 0.00 0.00 0.00 0.00 53.44 52.53 1kx7 n ALA 52 Cb 0.35 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.71 1kx7 n ALA 52 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1kx7 s MET 53 N -1.65 2.38 0.60 0.00 -1.94 0.79 -5.04 119.30 114.44 1kx7 s MET 53 Ca 0.20 -1.07 -0.16 0.00 -1.71 0.00 0.00 55.69 52.95 1kx7 s MET 53 Cb 0.13 -2.37 -0.03 0.00 2.01 0.00 0.00 34.83 34.57 1kx7 s MET 53 CO 0.10 0.47 1.08 -1.25 -0.01 0.00 0.00 175.02 175.41 1kx7 s PRO 54 N -2.78 3.19 0.23 2.03 0.04 -1.26 -4.43 135.00 132.03 1kx7 s PRO 54 Ca 0.26 1.30 -0.31 0.00 0.04 0.00 0.00 61.00 62.30 1kx7 s PRO 54 Cb -0.10 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.32 1kx7 s PRO 54 CO 0.18 -0.92 1.60 -1.25 0.04 0.00 0.00 177.00 176.65 1kx7 s PRO 55 N -3.97 4.17 -1.51 0.56 0.04 -1.26 -1.98 135.00 131.04 1kx7 s PRO 55 Ca 0.66 2.49 -0.00 0.00 0.04 0.00 0.00 61.00 64.19 1kx7 s PRO 55 Cb -0.18 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1kx7 s PRO 55 CO 0.36 -0.63 0.02 0.41 0.04 0.00 0.00 177.00 177.21 1kx7 n GLY 56 N 3.07 -0.36 2.90 0.56 0.00 -0.51 -2.57 105.19 108.28 1kx7 n GLY 56 Ca 0.12 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 1kx7 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kx7 n GLY 57 N -1.03 -0.49 2.38 -0.02 0.00 -0.84 -0.63 105.19 104.57 1kx7 n GLY 57 Ca -0.21 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1kx7 n GLY 57 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1kx7 n MET 58 N -3.00 -3.63 -4.32 1.61 1.56 -1.06 -4.51 117.12 103.77 1kx7 n MET 58 Ca -0.02 0.41 -0.20 0.00 -0.27 0.00 0.00 57.70 57.62 1kx7 n MET 58 Cb 0.53 -4.16 -0.11 0.00 2.15 0.00 0.00 33.22 31.63 1kx7 n MET 58 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1kx7 n THR 60 N 0.16 0.00 -2.22 0.00 -1.04 -1.26 -4.80 114.28 105.13 1kx7 n THR 60 Ca -0.12 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.47 1kx7 n THR 60 Cb 0.58 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 1kx7 n THR 60 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1kx7 n ASP 61 N 0.00 6.16 -4.24 8.00 8.00 -1.26 -4.93 116.55 128.27 1kx7 n ASP 61 Ca 0.00 -3.12 -0.33 0.00 0.71 0.00 0.00 54.79 52.05 1kx7 n ASP 61 Cb 0.00 -1.43 -0.16 0.00 -0.02 0.00 0.00 41.12 39.51 1kx7 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1kx7 s THR 63 N 0.62 1.91 0.30 0.00 2.01 -1.26 -4.94 115.64 114.27 1kx7 s THR 63 Ca -0.10 -1.39 0.12 0.00 0.31 0.00 0.00 61.69 60.63 1kx7 s THR 63 Cb -0.16 -1.66 0.33 0.00 0.01 0.00 0.00 72.50 71.01 1kx7 s THR 63 CO 0.03 0.20 1.36 0.47 -0.69 0.00 0.00 174.62 175.99 1kx7 n ASP 64 N 1.59 0.15 -0.30 3.53 9.92 -1.26 -0.86 116.55 129.32 1kx7 n ASP 64 Ca -0.18 1.44 0.00 0.00 -0.53 0.00 0.00 54.79 55.53 1kx7 n ASP 64 Cb 0.53 -0.64 0.05 0.00 -0.64 0.00 0.00 41.12 40.42 1kx7 n ASP 64 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1kx7 n GLU 65 N -5.06 -0.16 -0.11 -1.24 0.28 -1.26 -0.40 120.64 112.69 1kx7 n GLU 65 Ca 0.28 1.23 -0.12 0.00 -0.16 0.00 0.00 57.16 58.38 1kx7 n GLU 65 Cb 0.95 -1.82 -0.14 0.00 1.43 0.00 0.00 31.44 31.85 1kx7 n GLU 65 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1kx7 n ASP 66 N -5.20 0.81 -0.35 -1.84 9.92 -0.26 -4.20 116.55 115.43 1kx7 n ASP 66 Ca 0.09 -0.05 0.13 0.00 -0.53 0.00 0.00 54.79 54.43 1kx7 n ASP 66 Cb 0.34 0.50 0.32 0.00 -0.64 0.00 0.00 41.12 41.64 1kx7 n ASP 66 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 1kx7 h TYR 67 N 0.00 1.06 -0.08 1.24 5.03 -0.67 0.11 116.97 123.66 1kx7 h TYR 67 Ca -0.54 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 60.77 1kx7 h TYR 67 Cb 2.10 -0.32 -0.00 0.00 1.55 0.00 0.00 36.73 40.06 1kx7 h TYR 67 CO 0.01 0.22 -0.05 1.57 -1.32 0.00 0.00 178.16 178.59 1kx7 h LYS 68 N 0.75 0.17 -0.60 1.82 2.10 -0.95 -2.69 116.57 117.17 1kx7 h LYS 68 Ca 0.58 -0.08 0.13 0.00 -2.00 0.00 0.00 60.65 59.28 1kx7 h LYS 68 Cb 0.91 -0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.21 1kx7 h LYS 68 CO -0.39 0.57 0.41 0.00 -2.00 0.00 0.00 179.45 178.05 1kx7 h ALA 69 N 0.59 2.23 -0.40 0.07 0.00 -1.38 0.26 119.26 120.64 1kx7 h ALA 69 Ca 0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1kx7 h ALA 69 Cb 0.53 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1kx7 h ALA 69 CO 0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 179.25 178.77 1kx7 h ALA 70 N 1.71 0.55 0.11 0.00 0.00 -0.63 0.24 119.26 121.24 1kx7 h ALA 70 Ca 0.29 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1kx7 h ALA 70 Cb 0.79 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1kx7 h ALA 70 CO -0.06 0.44 -0.05 0.82 0.00 0.00 0.00 179.25 180.39 1kx7 h ILE 71 N 0.60 1.08 -0.36 0.00 2.04 -0.98 -3.26 117.51 116.63 1kx7 h ILE 71 Ca 0.10 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.16 1kx7 h ILE 71 Cb 0.64 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 1kx7 h ILE 71 CO 0.04 0.20 0.24 -0.33 0.00 0.00 0.00 178.15 178.30 1kx7 h GLU 72 N -0.55 0.34 -0.62 2.37 5.08 -0.45 -2.62 114.58 118.13 1kx7 h GLU 72 Ca -0.02 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.45 1kx7 h GLU 72 Cb 0.44 -0.08 -0.12 0.00 0.50 0.00 0.00 28.75 29.50 1kx7 h GLU 72 CO 0.03 0.22 -0.18 0.35 -1.00 0.00 0.00 179.01 178.43 1kx7 h PHE 73 N 0.35 -0.40 -0.25 4.33 3.04 -0.56 -1.95 116.94 121.50 1kx7 h PHE 73 Ca 0.15 0.06 -0.05 0.00 3.98 0.00 0.00 57.97 62.11 1kx7 h PHE 73 Cb 0.16 0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.93 1kx7 h PHE 73 CO -0.00 -0.28 -0.02 0.52 -2.02 0.00 0.00 178.31 176.50 1kx7 h MET 74 N -0.02 0.46 0.00 1.11 2.86 -1.61 -3.47 114.93 114.25 1kx7 h MET 74 Ca 0.29 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1kx7 h MET 74 Cb 0.47 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1kx7 h MET 74 CO -0.65 0.65 0.00 0.45 1.06 0.00 0.00 176.91 178.42 1kx7 n SER 75 N -4.60 0.00 0.00 1.22 2.88 -0.73 -4.89 113.62 107.51 1kx7 n SER 75 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 1kx7 n SER 75 Cb 0.27 0.37 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1kx7 n SER 75 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1kx7 n LYS 76 N -2.16 0.00 0.00 -1.46 2.85 -1.25 -4.72 118.16 111.43 1kx7 n LYS 76 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1kx7 n LYS 76 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1kx7 n LYS 76 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1kx7 n ALA 77 N 0.00 0.00 1.38 0.58 0.00 -1.26 -4.58 120.51 116.63 1kx7 n ALA 77 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1kx7 n ALA 77 Cb 0.00 0.00 0.43 0.00 0.00 0.00 0.00 19.45 19.88 1kx7 n ALA 77 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86