#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k0q s ASP 2 N 0.00 6.97 0.00 6.55 1.11 -1.26 -4.90 116.67 125.14 2k0q s ASP 2 Ca 0.00 1.89 0.11 0.00 0.18 0.00 0.00 52.55 54.73 2k0q s ASP 2 Cb 0.00 -2.55 0.35 0.00 1.07 0.00 0.00 42.92 41.78 2k0q s ASP 2 CO 0.00 -0.66 1.27 0.23 1.18 0.00 0.00 175.17 177.19 2k0q n MET 3 N 5.54 1.64 0.05 8.23 2.81 -1.26 -3.89 117.12 130.24 2k0q n MET 3 Ca 0.12 -1.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.00 2k0q n MET 3 Cb 0.45 -1.25 -0.07 0.00 -0.71 0.00 0.00 33.22 31.64 2k0q n MET 3 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2k0q h SER 4 N 1.68 0.00 -0.20 7.83 0.02 -2.04 -3.34 113.55 117.49 2k0q h SER 4 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k0q h SER 4 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2k0q h SER 4 CO 0.00 0.69 0.00 -0.46 -1.14 0.00 0.00 176.83 175.92 2k0q n ASN 5 N -3.06 2.74 -4.53 3.07 2.04 -1.25 -4.97 115.26 109.29 2k0q n ASN 5 Ca -0.07 -2.25 -0.34 0.00 -0.44 0.00 0.00 54.58 51.48 2k0q n ASN 5 Cb 0.87 -0.23 -0.12 0.00 -2.53 0.00 0.00 39.78 37.77 2k0q n ASN 5 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 2k0q s VAL 6 N -1.44 3.77 -0.10 3.53 0.11 -1.26 0.91 120.40 125.93 2k0q s VAL 6 Ca 0.20 -0.42 0.15 0.00 -2.93 0.00 0.00 61.98 58.97 2k0q s VAL 6 Cb 0.13 -2.60 -0.11 0.00 -1.53 0.00 0.00 36.38 32.28 2k0q s VAL 6 CO 0.09 0.55 0.99 -0.37 -3.33 0.00 0.00 175.10 173.03 2k0q h VAL 7 N 4.74 0.73 -1.57 2.04 -1.51 -0.92 -3.44 116.25 116.32 2k0q h VAL 7 Ca -0.39 -2.25 0.09 0.00 -1.23 0.00 0.00 66.70 62.92 2k0q h VAL 7 Cb 1.19 2.24 -0.27 0.00 -2.13 0.00 0.00 31.29 32.32 2k0q h VAL 7 CO 0.57 0.42 0.38 -0.75 -1.23 0.00 0.00 177.57 176.96 2k0q s LYS 8 N -2.88 0.43 -0.01 5.19 2.47 -1.15 -5.02 119.74 118.77 2k0q s LYS 8 Ca -0.01 0.67 0.03 0.00 -1.56 0.00 0.00 55.97 55.10 2k0q s LYS 8 Cb 0.08 0.12 -0.03 0.00 -1.46 0.00 0.00 37.83 36.54 2k0q s LYS 8 CO 0.80 -0.08 -0.06 0.99 0.16 0.00 0.00 175.35 177.16 2k0q s THR 9 N 1.06 3.73 -0.08 3.43 2.01 -1.26 -0.58 115.64 123.94 2k0q s THR 9 Ca -0.06 -0.69 0.04 0.00 0.31 0.00 0.00 61.69 61.29 2k0q s THR 9 Cb -0.04 -2.61 -0.01 0.00 0.01 0.00 0.00 72.50 69.85 2k0q s THR 9 CO -0.13 0.43 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.71 2k0q s TYR 10 N -0.97 2.59 -0.28 4.92 2.02 0.39 -4.94 117.35 121.07 2k0q s TYR 10 Ca 0.16 -0.73 -0.13 0.00 -0.37 0.00 0.00 57.07 56.01 2k0q s TYR 10 Cb -0.11 -1.69 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 2k0q s TYR 10 CO 0.07 -0.22 0.27 0.34 -1.57 0.00 0.00 175.55 174.43 2k0q s ASP 11 N 0.02 6.11 0.16 2.29 -1.08 -1.26 0.33 116.67 123.25 2k0q s ASP 11 Ca -0.08 0.06 -0.26 0.00 -0.52 0.00 0.00 52.55 51.75 2k0q s ASP 11 Cb -0.15 -2.16 -0.08 0.00 -1.46 0.00 0.00 42.92 39.07 2k0q s ASP 11 CO 0.05 -0.12 0.82 -0.76 0.52 0.00 0.00 175.17 175.68 2k0q s LEU 12 N 1.88 4.58 0.60 -1.34 1.43 0.15 -0.08 118.68 125.90 2k0q s LEU 12 Ca 0.10 1.69 0.40 0.00 -1.03 0.00 0.00 54.13 55.29 2k0q s LEU 12 Cb -0.16 -3.37 2.07 0.00 0.03 0.00 0.00 46.19 44.76 2k0q s LEU 12 CO 0.11 0.16 2.21 -0.61 0.23 0.00 0.00 176.35 178.44 2k0q h GLN 13 N 4.53 0.00 0.00 1.70 4.15 -1.58 -2.93 115.11 120.98 2k0q h GLN 13 Ca -0.46 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 58.63 2k0q h GLN 13 Cb 1.21 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.84 2k0q h GLN 13 CO 0.67 0.00 -2.19 -3.47 -1.93 0.00 0.00 178.83 171.91 2k0q n ASP 14 N -2.96 2.06 0.00 -0.69 2.03 -1.26 -4.92 116.55 110.81 2k0q n ASP 14 Ca -0.02 0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2k0q n ASP 14 Cb 0.11 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.06 2k0q n ASP 14 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k0q n GLY 15 N 2.16 -1.66 3.62 0.27 0.00 -1.10 -4.96 105.19 103.51 2k0q n GLY 15 Ca -0.39 0.74 -0.04 0.00 0.00 0.00 0.00 46.02 46.33 2k0q n GLY 15 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k0q s SER 16 N 0.00 -0.11 -0.09 1.61 0.15 -1.25 -1.43 113.70 112.58 2k0q s SER 16 Ca 0.00 0.08 0.01 0.00 0.70 0.00 0.00 55.95 56.74 2k0q s SER 16 Cb 0.00 0.10 0.02 0.00 -1.71 0.00 0.00 66.02 64.42 2k0q s SER 16 CO 0.00 -0.13 -0.11 -0.54 1.20 0.00 0.00 173.24 173.66 2k0q s LYS 17 N -1.47 1.75 0.04 5.44 1.02 -0.91 0.30 119.74 125.90 2k0q s LYS 17 Ca 0.08 -0.39 0.01 0.00 0.02 0.00 0.00 55.97 55.69 2k0q s LYS 17 Cb -0.01 -1.56 -0.04 0.00 -0.52 0.00 0.00 37.83 35.70 2k0q s LYS 17 CO -0.05 -0.09 0.11 0.08 -0.92 0.00 0.00 175.35 174.48 2k0q s VAL 18 N 1.08 4.80 -0.02 3.17 1.01 0.15 0.67 120.40 131.26 2k0q s VAL 18 Ca -0.06 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2k0q s VAL 18 Cb -0.14 -3.28 0.02 0.00 0.00 0.00 0.00 36.38 32.98 2k0q s VAL 18 CO -0.02 0.21 0.01 -1.00 0.00 0.00 0.00 175.10 174.30 2k0q s HIS 19 N -1.34 0.17 -0.29 5.22 0.09 0.16 0.15 115.29 119.44 2k0q s HIS 19 Ca 0.28 0.04 -0.14 0.00 -0.00 0.00 0.00 55.06 55.24 2k0q s HIS 19 Cb -0.12 -0.28 -0.03 0.00 -0.00 0.00 0.00 32.58 32.15 2k0q s HIS 19 CO 0.20 -0.09 0.34 0.08 -0.00 0.00 0.00 174.74 175.27 2k0q s VAL 20 N 0.82 5.20 0.41 -0.90 1.01 0.25 -0.52 120.40 126.67 2k0q s VAL 20 Ca -0.08 0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.14 2k0q s VAL 20 Cb -0.11 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 2k0q s VAL 20 CO -0.02 0.09 0.76 -0.36 0.00 0.00 0.00 175.10 175.58 2k0q s PHE 21 N 2.00 3.48 0.43 5.22 0.40 0.21 -0.32 117.98 129.40 2k0q s PHE 21 Ca 0.12 1.00 0.35 0.00 -0.60 0.00 0.00 56.93 57.80 2k0q s PHE 21 Cb -0.16 -2.41 1.78 0.00 0.51 0.00 0.00 43.02 42.74 2k0q s PHE 21 CO 0.11 -0.11 2.16 0.87 0.70 0.00 0.00 175.22 178.95 2k0q h LYS 22 N 1.16 0.00 -0.01 0.44 1.57 0.24 0.10 116.57 120.06 2k0q h LYS 22 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2k0q h LYS 22 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2k0q h LYS 22 CO 0.64 0.04 -0.10 -0.40 -0.57 0.00 0.00 179.45 179.06 2k0q n ASP 23 N -3.33 1.45 0.00 0.86 5.75 -1.26 -4.91 116.55 115.10 2k0q n ASP 23 Ca -0.02 -1.32 0.00 0.00 -0.01 0.00 0.00 54.79 53.44 2k0q n ASP 23 Cb 0.19 0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 2k0q n ASP 23 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k0q n GLY 24 N 1.25 0.34 3.64 6.12 0.00 0.35 -5.09 105.19 111.80 2k0q n GLY 24 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2k0q n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k0q s LYS 25 N -0.81 -0.46 -0.02 1.61 1.02 -1.25 -4.65 119.74 115.18 2k0q s LYS 25 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 55.97 56.19 2k0q s LYS 25 Cb 0.00 -1.66 0.02 0.00 -0.52 0.00 0.00 37.83 35.67 2k0q s LYS 25 CO 0.00 -3.26 0.00 -1.64 -0.92 0.00 0.00 175.35 169.53 2k0q s MET 26 N -5.20 0.24 0.02 1.68 -1.94 -1.26 0.64 119.30 113.49 2k0q s MET 26 Ca 0.68 0.06 0.05 0.00 -1.71 0.00 0.00 55.69 54.77 2k0q s MET 26 Cb -0.14 -0.41 -0.02 0.00 2.01 0.00 0.00 34.83 36.28 2k0q s MET 26 CO 0.57 -0.11 -0.14 0.20 -0.01 0.00 0.00 175.02 175.53 2k0q s GLY 27 N 0.86 0.73 -0.02 -0.03 0.00 0.32 -4.91 107.32 104.27 2k0q s GLY 27 Ca -0.08 -0.74 0.06 0.00 0.00 0.00 0.00 44.72 43.96 2k0q s GLY 27 CO -0.02 -0.70 -0.21 -0.29 0.00 0.00 0.00 173.10 171.88 2k0q s MET 28 N -0.90 1.72 0.24 2.90 1.75 -1.21 0.41 119.30 124.21 2k0q s MET 28 Ca 0.02 -0.75 0.09 0.00 -1.25 0.00 0.00 55.69 53.80 2k0q s MET 28 Cb -0.07 -1.66 -0.04 0.00 2.84 0.00 0.00 34.83 35.90 2k0q s MET 28 CO 0.01 0.45 -0.03 -1.21 -0.65 0.00 0.00 175.02 173.59 2k0q s GLU 29 N -0.48 2.25 0.55 4.11 0.41 0.21 0.36 118.70 126.11 2k0q s GLU 29 Ca 0.08 -1.36 -0.04 0.00 -0.41 0.00 0.00 54.97 53.24 2k0q s GLU 29 Cb -0.08 -2.18 0.01 0.00 -1.78 0.00 0.00 34.13 30.10 2k0q s GLU 29 CO -0.01 0.39 0.84 0.54 -0.49 0.00 0.00 175.26 176.53 2k0q s ASN 30 N -3.41 5.65 0.00 -0.19 2.20 0.92 -2.15 114.94 117.95 2k0q s ASN 30 Ca 0.30 0.59 0.00 0.00 -0.94 0.00 0.00 52.86 52.81 2k0q s ASN 30 Cb -0.07 -1.65 0.00 0.00 -2.00 0.00 0.00 41.25 37.53 2k0q s ASN 30 CO 0.19 -0.97 0.43 2.29 -2.94 0.00 0.00 177.10 176.10 2k0q n LYS 31 N -2.45 0.00 -0.01 3.55 2.85 -0.51 -0.42 118.16 121.17 2k0q n LYS 31 Ca 0.04 0.08 0.08 0.00 -1.05 0.00 0.00 58.31 57.46 2k0q n LYS 31 Cb 0.58 -1.56 0.07 0.00 -0.65 0.00 0.00 35.03 33.47 2k0q n LYS 31 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2k0q n PHE 32 N -0.93 0.01 -1.05 5.58 3.72 -1.26 -4.94 117.46 118.59 2k0q n PHE 32 Ca 0.00 -0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2k0q n PHE 32 Cb 0.06 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 2k0q n PHE 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k0q n GLY 33 N 0.90 0.74 3.57 1.37 0.00 0.44 -5.06 105.19 107.15 2k0q n GLY 33 Ca 0.09 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2k0q n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k0q s LYS 34 N -2.27 2.39 -0.18 1.61 -0.14 -1.25 -4.84 119.74 115.06 2k0q s LYS 34 Ca 0.00 -0.83 -0.23 0.00 -1.36 0.00 0.00 55.97 53.55 2k0q s LYS 34 Cb 0.00 -2.41 -0.02 0.00 -1.68 0.00 0.00 37.83 33.72 2k0q s LYS 34 CO 0.00 0.57 0.73 -1.12 -0.76 0.00 0.00 175.35 174.77 2k0q s SER 35 N -1.59 6.83 0.33 2.83 0.01 -1.26 -0.06 113.70 120.79 2k0q s SER 35 Ca 0.18 1.01 0.06 0.00 1.31 0.00 0.00 55.95 58.51 2k0q s SER 35 Cb -0.11 -2.40 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2k0q s SER 35 CO 0.09 -0.33 0.24 0.00 0.41 0.00 0.00 173.24 173.65 2k0q s MET 36 N 2.00 1.74 0.06 12.44 0.23 0.16 -4.96 119.30 130.96 2k0q s MET 36 Ca 0.34 -2.01 -0.16 0.00 -1.03 0.00 0.00 55.69 52.83 2k0q s MET 36 Cb -0.16 0.18 -0.06 0.00 -1.53 0.00 0.00 34.83 33.26 2k0q s MET 36 CO 0.11 -0.60 0.49 0.54 -2.03 0.00 0.00 175.02 173.54 2k0q s ASN 37 N -3.39 6.89 -0.13 -1.18 2.20 -1.26 -3.33 114.94 114.74 2k0q s ASN 37 Ca 0.38 1.08 -0.23 0.00 -0.94 0.00 0.00 52.86 53.15 2k0q s ASN 37 Cb 0.03 -2.29 -0.03 0.00 -2.00 0.00 0.00 41.25 36.96 2k0q s ASN 37 CO 0.24 0.25 0.71 -0.32 -2.94 0.00 0.00 177.10 175.04 2k0q s MET 38 N -1.33 4.33 -0.04 3.55 -2.45 -1.26 -4.95 119.30 117.15 2k0q s MET 38 Ca 0.29 0.83 -0.30 0.00 -1.25 0.00 0.00 55.69 55.26 2k0q s MET 38 Cb -0.17 -3.52 -0.04 0.00 1.25 0.00 0.00 34.83 32.35 2k0q s MET 38 CO 0.17 -0.12 1.29 -1.25 1.05 0.00 0.00 175.02 176.16 2k0q s PRO 39 N 1.47 4.32 0.12 4.11 0.04 -1.26 -5.01 135.00 138.79 2k0q s PRO 39 Ca 0.35 1.80 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 2k0q s PRO 39 Cb -0.17 -3.58 -0.06 0.00 0.04 0.00 0.00 34.50 30.73 2k0q s PRO 39 CO 0.14 -0.52 0.98 -2.00 0.04 0.00 0.00 177.00 175.65 2k0q s GLU 40 N 2.37 4.68 0.00 4.56 2.12 -1.26 -3.94 118.70 127.23 2k0q s GLU 40 Ca 0.59 1.49 0.00 0.00 0.36 0.00 0.00 54.97 57.41 2k0q s GLU 40 Cb -0.27 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.75 2k0q s GLU 40 CO 0.24 0.19 0.00 0.41 -0.54 0.00 0.00 175.26 175.55 2k0q n GLY 41 N 2.24 1.37 3.56 -1.50 0.00 -0.40 -5.01 105.19 105.44 2k0q n GLY 41 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2k0q n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k0q s LYS 42 N -0.35 3.84 -0.22 1.61 1.02 -1.25 -5.01 119.74 119.37 2k0q s LYS 42 Ca 0.00 -0.41 -0.19 0.00 0.02 0.00 0.00 55.97 55.39 2k0q s LYS 42 Cb 0.00 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 34.07 2k0q s LYS 42 CO 0.00 0.13 0.55 0.54 -0.92 0.00 0.00 175.35 175.65 2k0q s VAL 43 N 0.75 5.06 0.21 3.17 0.11 -1.26 -4.21 120.40 124.24 2k0q s VAL 43 Ca 0.03 1.00 0.11 0.00 -2.93 0.00 0.00 61.98 60.19 2k0q s VAL 43 Cb -0.14 -3.87 -0.05 0.00 -1.53 0.00 0.00 36.38 30.80 2k0q s VAL 43 CO 0.02 0.12 -0.21 -0.04 -3.33 0.00 0.00 175.10 171.66 2k0q s MET 44 N 1.98 1.64 0.20 1.54 -1.94 0.14 -4.92 119.30 117.94 2k0q s MET 44 Ca 0.24 -1.55 0.06 0.00 -1.71 0.00 0.00 55.69 52.74 2k0q s MET 44 Cb -0.16 -1.88 -0.04 0.00 2.01 0.00 0.00 34.83 34.77 2k0q s MET 44 CO 0.09 0.39 0.11 -1.21 -0.01 0.00 0.00 175.02 174.39 2k0q s GLU 45 N -2.91 2.76 0.26 2.03 2.02 -1.26 -1.00 118.70 120.60 2k0q s GLU 45 Ca 0.24 -1.01 0.08 0.00 0.02 0.00 0.00 54.97 54.30 2k0q s GLU 45 Cb -0.07 -2.53 -0.04 0.00 0.10 0.00 0.00 34.13 31.59 2k0q s GLU 45 CO 0.12 0.45 0.09 0.95 0.02 0.00 0.00 175.26 176.89 2k0q s THR 46 N -1.89 3.94 0.61 3.63 -4.23 -0.02 -1.75 115.64 115.93 2k0q s THR 46 Ca 0.31 -1.65 0.33 0.00 -1.18 0.00 0.00 61.69 59.50 2k0q s THR 46 Cb -0.09 -3.11 0.38 0.00 1.34 0.00 0.00 72.50 71.01 2k0q s THR 46 CO 0.23 -0.35 2.25 0.03 -0.54 0.00 0.00 174.62 176.24 2k0q h ARG 47 N 1.73 0.00 -0.02 3.99 3.08 -0.75 -1.32 114.38 121.09 2k0q h ARG 47 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 2k0q h ARG 47 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2k0q h ARG 47 CO 0.60 0.00 -0.20 -0.40 -1.07 0.00 0.00 179.97 178.91 2k0q n ASP 48 N -3.64 2.02 0.00 7.04 5.75 -1.26 -4.93 116.55 121.53 2k0q n ASP 48 Ca -0.02 -1.54 0.00 0.00 -0.01 0.00 0.00 54.79 53.22 2k0q n ASP 48 Cb 0.12 0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 2k0q n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k0q n GLY 49 N 1.33 0.99 3.87 6.12 0.00 -0.50 -5.08 105.19 111.93 2k0q n GLY 49 Ca 0.13 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2k0q n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k0q s THR 50 N -2.00 5.08 -0.13 2.61 2.01 -1.26 -4.87 115.64 117.09 2k0q s THR 50 Ca 0.00 0.42 -0.03 0.00 0.31 0.00 0.00 61.69 62.38 2k0q s THR 50 Cb 0.00 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 2k0q s THR 50 CO 0.00 0.23 -0.01 -0.54 -0.69 0.00 0.00 174.62 173.60 2k0q s LYS 51 N -2.08 3.41 0.06 4.92 1.02 -1.26 -0.84 119.74 124.97 2k0q s LYS 51 Ca 0.35 -0.46 0.00 0.00 0.02 0.00 0.00 55.97 55.89 2k0q s LYS 51 Cb -0.14 -2.89 -0.03 0.00 -0.52 0.00 0.00 37.83 34.25 2k0q s LYS 51 CO 0.19 0.43 -0.05 0.96 -0.92 0.00 0.00 175.35 175.97 2k0q s ILE 52 N -0.14 0.39 0.03 2.17 -4.36 -0.17 -3.26 121.20 115.86 2k0q s ILE 52 Ca 0.04 -1.59 -0.26 0.00 -0.26 0.00 0.00 60.65 58.59 2k0q s ILE 52 Cb -0.13 -1.22 0.06 0.00 1.25 0.00 0.00 42.46 42.43 2k0q s ILE 52 CO 0.02 -0.79 0.59 -0.51 0.24 0.00 0.00 174.94 174.50 2k0q s ILE 53 N -3.04 0.01 -0.25 8.37 2.07 -0.85 0.25 121.20 127.77 2k0q s ILE 53 Ca 0.02 -0.10 -0.06 0.00 -1.41 0.00 0.00 60.65 59.09 2k0q s ILE 53 Cb 0.01 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.60 2k0q s ILE 53 CO -0.05 -0.06 0.04 -0.32 -1.91 0.00 0.00 174.94 172.64 2k0q s MET 54 N -2.24 3.54 -0.01 3.50 -2.45 -1.26 0.68 119.30 121.05 2k0q s MET 54 Ca -0.06 -0.55 0.00 0.00 -1.25 0.00 0.00 55.69 53.84 2k0q s MET 54 Cb -0.01 -3.25 0.01 0.00 1.25 0.00 0.00 34.83 32.83 2k0q s MET 54 CO 0.00 -0.21 -0.00 0.15 1.05 0.00 0.00 175.02 176.00 2k0q s LYS 55 N 1.57 0.17 -1.59 4.11 -0.14 0.10 -1.28 119.74 122.69 2k0q s LYS 55 Ca 0.06 0.03 -0.00 0.00 -1.36 0.00 0.00 55.97 54.69 2k0q s LYS 55 Cb -0.15 -0.28 0.00 0.00 -1.68 0.00 0.00 37.83 35.72 2k0q s LYS 55 CO 0.02 -0.06 0.04 0.41 -0.76 0.00 0.00 175.35 175.00 2k0q n GLY 56 N 3.60 -0.40 2.43 -3.33 0.00 -1.26 -1.04 105.19 105.19 2k0q n GLY 56 Ca -0.20 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 2k0q n GLY 56 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k0q n ASN 57 N -1.61 -5.30 -4.33 1.61 5.03 -1.26 -5.00 115.26 104.41 2k0q n ASN 57 Ca -0.21 0.18 -0.25 0.00 0.87 0.00 0.00 54.58 55.17 2k0q n ASN 57 Cb 0.66 -4.39 -0.12 0.00 -1.02 0.00 0.00 39.78 34.92 2k0q n ASN 57 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2k0q s GLU 58 N -4.35 1.24 -0.26 3.52 2.02 -0.21 -5.05 118.70 115.61 2k0q s GLU 58 Ca 0.00 -1.28 -0.13 0.00 0.02 0.00 0.00 54.97 53.58 2k0q s GLU 58 Cb 0.00 -1.52 -0.05 0.00 0.10 0.00 0.00 34.13 32.66 2k0q s GLU 58 CO 0.00 0.34 0.26 0.42 0.02 0.00 0.00 175.26 176.30 2k0q s ILE 59 N -1.36 5.27 -0.42 -1.63 -1.09 -1.26 0.03 121.20 120.73 2k0q s ILE 59 Ca 0.11 0.34 -0.26 0.00 -2.23 0.00 0.00 60.65 58.61 2k0q s ILE 59 Cb -0.09 -3.59 0.02 0.00 -1.58 0.00 0.00 42.46 37.22 2k0q s ILE 59 CO 0.06 0.24 0.96 0.12 -1.23 0.00 0.00 174.94 175.08 2k0q s PHE 60 N 1.69 2.97 -0.26 3.97 2.19 0.21 -4.94 117.98 123.81 2k0q s PHE 60 Ca 0.11 0.60 0.02 0.00 0.33 0.00 0.00 56.93 57.99 2k0q s PHE 60 Cb -0.15 -3.90 0.06 0.00 -1.31 0.00 0.00 43.02 37.72 2k0q s PHE 60 CO 0.09 -1.01 -0.07 0.50 1.83 0.00 0.00 175.22 176.56 2k0q s ARG 61 N 3.73 1.93 0.00 10.12 3.00 -1.26 -2.01 118.95 134.46 2k0q s ARG 61 Ca 0.39 -1.27 0.00 0.00 -1.00 0.00 0.00 55.73 53.85 2k0q s ARG 61 Cb -0.10 -2.80 0.00 0.00 0.00 0.00 0.00 34.95 32.04 2k0q s ARG 61 CO 0.24 -0.62 0.00 1.28 0.00 0.00 0.00 175.30 176.19 2k0q n LEU 62 N 4.50 0.00 0.00 -0.88 7.99 -1.20 -3.61 117.00 123.80 2k0q n LEU 62 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.89 2k0q n LEU 62 Cb 0.43 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.74 2k0q n LEU 62 CO 0.20 0.00 0.00 -0.67 -1.51 0.00 0.00 177.39 175.41 2k0q n ASP 63 N 0.00 0.00 0.21 -1.43 2.03 -1.26 -4.54 116.55 111.56 2k0q n ASP 63 Ca 0.00 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.37 2k0q n ASP 63 Cb 0.00 0.00 0.45 0.00 -0.72 0.00 0.00 41.12 40.85 2k0q n ASP 63 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k0q h GLU 64 N 0.00 0.00 -0.18 -0.67 5.08 -1.98 0.37 114.58 117.20 2k0q h GLU 64 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2k0q h GLU 64 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2k0q h GLU 64 CO 0.00 0.30 0.03 0.00 -1.00 0.00 0.00 179.01 178.34 2k0q h ALA 65 N 1.70 0.23 -0.01 3.43 0.00 -1.80 -0.24 119.26 122.57 2k0q h ALA 65 Ca -0.00 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 2k0q h ALA 65 Cb 0.66 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2k0q h ALA 65 CO 0.04 -0.10 -0.75 -0.07 0.00 0.00 0.00 179.25 178.37 2k0q h LEU 66 N 0.08 0.12 0.34 0.00 4.07 -1.66 -0.69 115.31 117.58 2k0q h LEU 66 Ca 0.05 -0.09 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 2k0q h LEU 66 Cb 0.31 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 2k0q h LEU 66 CO 0.00 0.83 -0.41 -0.09 -1.08 0.00 0.00 178.44 177.69 2k0q h ARG 67 N 0.06 -0.74 0.00 1.13 2.43 -0.64 -3.42 114.38 113.20 2k0q h ARG 67 Ca -0.02 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2k0q h ARG 67 Cb 1.33 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 31.05 2k0q h ARG 67 CO 0.11 -0.50 0.00 0.36 -1.51 0.00 0.00 179.97 178.43 2k0q n LYS 68 N -4.89 0.00 -2.02 0.20 2.85 -0.21 -4.98 118.16 109.10 2k0q n LYS 68 Ca -0.09 -0.09 -0.37 0.00 -1.05 0.00 0.00 58.31 56.71 2k0q n LYS 68 Cb 0.36 -0.18 -0.00 0.00 -0.65 0.00 0.00 35.03 34.56 2k0q n LYS 68 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k0q n GLY 69 N 0.00 5.29 2.88 2.58 0.00 -0.27 -4.84 105.19 110.83 2k0q n GLY 69 Ca 0.00 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.39 2k0q n GLY 69 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k0q n HIS 70 N 0.76 3.24 -3.15 1.61 8.25 -1.23 -4.67 115.22 120.04 2k0q n HIS 70 Ca 0.54 -2.87 0.04 0.00 -0.26 0.00 0.00 57.72 55.18 2k0q n HIS 70 Cb 0.32 -2.13 -0.00 0.00 1.12 0.00 0.00 29.99 29.30 2k0q n HIS 70 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k0q s SER 71 N 1.63 -1.19 0.10 0.41 0.15 -1.26 -5.17 113.70 108.38 2k0q s SER 71 Ca 0.42 0.30 0.07 0.00 0.70 0.00 0.00 55.95 57.44 2k0q s SER 71 Cb 0.10 1.82 -0.03 0.00 -1.71 0.00 0.00 66.02 66.19 2k0q s SER 71 CO -0.02 -0.22 -0.19 -0.70 1.20 0.00 0.00 173.24 173.31 2k0q s GLU 72 N 2.88 1.05 -0.62 5.44 2.12 -1.26 -5.09 118.70 123.21 2k0q s GLU 72 Ca 0.15 -1.12 -0.27 0.00 0.36 0.00 0.00 54.97 54.09 2k0q s GLU 72 Cb -0.09 -1.24 0.03 0.00 0.26 0.00 0.00 34.13 33.09 2k0q s GLU 72 CO -0.23 0.28 1.18 0.20 -0.54 0.00 0.00 175.26 176.16 2k0q s GLY 73 N -1.90 1.10 0.00 -1.50 0.00 -1.26 -5.28 107.32 98.48 2k0q s GLY 73 Ca 0.05 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.72 2k0q s GLY 73 CO 0.04 2.48 0.00 0.61 0.00 0.00 0.00 173.10 176.23