#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k0q n ASP 2 N 0.00 -6.04 -0.03 4.52 8.00 -1.26 -4.78 116.55 116.96 2k0q n ASP 2 Ca 0.00 1.16 0.15 0.00 0.71 0.00 0.00 54.79 56.81 2k0q n ASP 2 Cb 0.00 -3.73 0.88 0.00 -0.02 0.00 0.00 41.12 38.25 2k0q n ASP 2 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2k0q n MET 3 N 1.17 1.04 0.04 -1.24 2.81 -1.26 -3.04 117.12 116.65 2k0q n MET 3 Ca -0.04 -0.06 0.04 0.00 -1.81 0.00 0.00 57.70 55.83 2k0q n MET 3 Cb 0.06 -1.48 -0.07 0.00 -0.71 0.00 0.00 33.22 31.02 2k0q n MET 3 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2k0q n SER 4 N -0.91 0.74 -0.68 7.83 2.88 -1.26 -4.13 113.62 118.09 2k0q n SER 4 Ca 0.23 0.31 0.06 0.00 -1.33 0.00 0.00 58.87 58.14 2k0q n SER 4 Cb 0.12 0.44 0.15 0.00 -0.75 0.00 0.00 64.21 64.17 2k0q n SER 4 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2k0q n ASN 5 N -2.77 2.83 -4.50 -3.46 2.04 -1.17 -4.92 115.26 103.31 2k0q n ASN 5 Ca -0.08 -1.89 -0.34 0.00 -0.44 0.00 0.00 54.58 51.83 2k0q n ASN 5 Cb 0.75 -0.21 -0.12 0.00 -2.53 0.00 0.00 39.78 37.67 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 -1.01 3.98 -0.02 3.53 0.11 -1.23 0.11 120.40 125.87 2k0q s VAL 6 Ca 0.24 -0.32 0.11 0.00 -2.93 0.00 0.00 61.98 59.08 2k0q s VAL 6 Cb 0.13 -2.76 -0.11 0.00 -1.53 0.00 0.00 36.38 32.11 2k0q s VAL 6 CO 0.17 0.48 1.25 -0.37 -3.33 0.00 0.00 175.10 173.30 2k0q h VAL 7 N 5.17 1.23 -1.63 2.04 -1.51 -1.26 -3.46 116.25 116.83 2k0q h VAL 7 Ca -0.33 -2.81 0.08 0.00 -1.23 0.00 0.00 66.70 62.41 2k0q h VAL 7 Cb 1.19 2.59 -0.26 0.00 -2.13 0.00 0.00 31.29 32.68 2k0q h VAL 7 CO 0.63 0.70 0.36 -0.75 -1.23 0.00 0.00 177.57 177.28 2k0q s LYS 8 N -2.81 0.48 -0.10 5.19 2.47 -1.19 -5.03 119.74 118.76 2k0q s LYS 8 Ca 0.01 0.72 -0.02 0.00 -1.56 0.00 0.00 55.97 55.12 2k0q s LYS 8 Cb 0.09 0.16 -0.03 0.00 -1.46 0.00 0.00 37.83 36.59 2k0q s LYS 8 CO 0.79 -0.08 -0.02 0.99 0.16 0.00 0.00 175.35 177.19 2k0q s THR 9 N 0.90 4.07 -0.17 3.43 2.01 -1.26 -0.71 115.64 123.92 2k0q s THR 9 Ca -0.04 -0.33 -0.03 0.00 0.31 0.00 0.00 61.69 61.60 2k0q s THR 9 Cb -0.04 -2.72 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 2k0q s THR 9 CO -0.11 0.57 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.02 2k0q s TYR 10 N -0.53 2.97 -0.29 4.92 2.02 0.36 -4.96 117.35 121.84 2k0q s TYR 10 Ca 0.09 -0.52 -0.11 0.00 -0.37 0.00 0.00 57.07 56.16 2k0q s TYR 10 Cb -0.12 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.42 2k0q s TYR 10 CO 0.02 -0.20 0.20 0.34 -1.57 0.00 0.00 175.55 174.34 2k0q s ASP 11 N 0.66 6.01 0.41 2.29 -1.08 -1.26 0.34 116.67 124.05 2k0q s ASP 11 Ca -0.03 -0.08 -0.21 0.00 -0.52 0.00 0.00 52.55 51.71 2k0q s ASP 11 Cb -0.15 -2.12 -0.11 0.00 -1.46 0.00 0.00 42.92 39.09 2k0q s ASP 11 CO 0.02 -0.08 0.93 -0.76 0.52 0.00 0.00 175.17 175.80 2k0q s LEU 12 N 1.75 3.98 0.11 -1.34 1.02 0.15 -0.86 118.68 123.49 2k0q s LEU 12 Ca 0.07 1.67 0.14 0.00 0.02 0.00 0.00 54.13 56.02 2k0q s LEU 12 Cb -0.16 -4.46 0.62 0.00 0.02 0.00 0.00 46.19 42.21 2k0q s LEU 12 CO 0.11 -0.32 1.42 1.67 0.02 0.00 0.00 176.35 179.25 2k0q n GLN 13 N -0.52 0.07 0.06 1.70 7.27 -0.95 -0.61 117.38 124.40 2k0q n GLN 13 Ca 0.06 0.42 0.12 0.00 0.07 0.00 0.00 57.00 57.67 2k0q n GLN 13 Cb 0.54 -1.66 0.08 0.00 2.41 0.00 0.00 30.24 31.60 2k0q n GLN 13 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2k0q n ASP 14 N -1.79 0.71 0.00 1.69 2.03 -1.26 -4.88 116.55 113.05 2k0q n ASP 14 Ca 0.01 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.43 2k0q n ASP 14 Cb 0.11 0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 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 1.29 2.57 3.72 0.27 0.00 0.22 -4.69 105.19 108.57 2k0q n GLY 15 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 2k0q n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k0q s SER 16 N -1.20 3.75 0.03 1.61 0.01 -1.26 -3.36 113.70 113.28 2k0q s SER 16 Ca 0.00 1.78 0.03 0.00 1.31 0.00 0.00 55.95 59.07 2k0q s SER 16 Cb 0.00 -2.42 -0.02 0.00 0.21 0.00 0.00 66.02 63.80 2k0q s SER 16 CO 0.00 -2.51 -0.10 -0.54 0.41 0.00 0.00 173.24 170.51 2k0q s LYS 17 N -4.85 0.65 0.09 12.44 1.02 0.25 0.30 119.74 129.64 2k0q s LYS 17 Ca 0.63 -0.65 0.09 0.00 0.02 0.00 0.00 55.97 56.06 2k0q s LYS 17 Cb -0.19 -0.55 -0.03 0.00 -0.52 0.00 0.00 37.83 36.54 2k0q s LYS 17 CO 0.57 0.13 -0.23 0.08 -0.92 0.00 0.00 175.35 174.98 2k0q s VAL 18 N -0.94 1.85 -0.04 3.17 1.01 0.15 0.59 120.40 126.19 2k0q s VAL 18 Ca -0.03 -1.51 0.01 0.00 0.00 0.00 0.00 61.98 60.45 2k0q s VAL 18 Cb -0.08 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.68 2k0q s VAL 18 CO 0.01 0.06 -0.05 -1.00 0.00 0.00 0.00 175.10 174.12 2k0q s HIS 19 N -1.04 0.73 -0.30 5.22 0.09 0.58 0.13 115.29 120.70 2k0q s HIS 19 Ca 0.09 -0.19 -0.17 0.00 -0.00 0.00 0.00 55.06 54.78 2k0q s HIS 19 Cb -0.10 -0.64 -0.02 0.00 -0.00 0.00 0.00 32.58 31.83 2k0q s HIS 19 CO 0.04 -0.17 0.49 0.08 -0.00 0.00 0.00 174.74 175.18 2k0q s VAL 20 N 0.83 5.06 0.37 -0.90 1.01 0.11 -1.25 120.40 125.64 2k0q s VAL 20 Ca -0.11 0.58 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 2k0q s VAL 20 Cb -0.14 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 2k0q s VAL 20 CO 0.00 -0.04 0.67 -0.36 0.00 0.00 0.00 175.10 175.37 2k0q s PHE 21 N 2.31 3.49 -0.76 5.22 0.40 0.14 -0.84 117.98 127.95 2k0q s PHE 21 Ca 0.19 0.80 0.17 0.00 -0.60 0.00 0.00 56.93 57.49 2k0q s PHE 21 Cb -0.16 -2.25 0.72 0.00 0.51 0.00 0.00 43.02 41.85 2k0q s PHE 21 CO 0.11 -0.01 1.52 1.63 0.70 0.00 0.00 175.22 179.17 2k0q n LYS 22 N -1.34 0.08 0.00 0.44 5.02 0.30 -0.40 118.16 122.27 2k0q n LYS 22 Ca -0.00 0.37 0.13 0.00 -2.02 0.00 0.00 58.31 56.79 2k0q n LYS 22 Cb 0.54 -1.67 0.38 0.00 -0.02 0.00 0.00 35.03 34.26 2k0q n LYS 22 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2k0q n ASP 23 N -1.82 1.15 0.00 4.39 2.03 -1.26 -4.94 116.55 116.10 2k0q n ASP 23 Ca 0.02 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.33 2k0q n ASP 23 Cb 0.16 0.13 0.00 0.00 -0.72 0.00 0.00 41.12 40.70 2k0q n ASP 23 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k0q n GLY 24 N 1.32 1.17 2.80 0.27 0.00 0.47 -5.06 105.19 106.16 2k0q n GLY 24 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 2k0q n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k0q n LYS 25 N -2.00 -0.27 -3.93 1.61 4.01 -1.26 -4.76 118.16 111.57 2k0q n LYS 25 Ca 0.00 -1.80 -0.10 0.00 -0.51 0.00 0.00 58.31 55.90 2k0q n LYS 25 Cb 0.00 -0.66 -0.12 0.00 -0.51 0.00 0.00 35.03 33.74 2k0q n LYS 25 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 2k0q s MET 26 N -4.61 0.19 -0.03 1.97 -1.94 -1.26 0.27 119.30 113.89 2k0q s MET 26 Ca 0.50 -0.33 0.05 0.00 -1.71 0.00 0.00 55.69 54.20 2k0q s MET 26 Cb -0.02 0.07 -0.01 0.00 2.01 0.00 0.00 34.83 36.88 2k0q s MET 26 CO 0.34 -0.03 -0.17 0.20 -0.01 0.00 0.00 175.02 175.35 2k0q s GLY 27 N -0.81 0.91 -0.01 -0.03 0.00 -0.38 -4.93 107.32 102.07 2k0q s GLY 27 Ca -0.09 -0.72 0.07 0.00 0.00 0.00 0.00 44.72 43.99 2k0q s GLY 27 CO -0.00 -0.44 -0.23 -0.29 0.00 0.00 0.00 173.10 172.13 2k0q s MET 28 N -0.10 2.15 0.11 2.90 1.75 -1.25 -0.30 119.30 124.55 2k0q s MET 28 Ca -0.01 -0.91 0.05 0.00 -1.25 0.00 0.00 55.69 53.58 2k0q s MET 28 Cb -0.10 -2.11 -0.04 0.00 2.84 0.00 0.00 34.83 35.42 2k0q s MET 28 CO 0.01 0.57 -0.13 -1.21 -0.65 0.00 0.00 175.02 173.61 2k0q s GLU 29 N -0.77 0.96 0.66 4.11 2.02 0.20 -0.45 118.70 125.43 2k0q s GLU 29 Ca 0.11 -1.21 -0.05 0.00 0.02 0.00 0.00 54.97 53.84 2k0q s GLU 29 Cb -0.10 -0.77 0.05 0.00 0.10 0.00 0.00 34.13 33.41 2k0q s GLU 29 CO 0.00 0.14 0.95 0.54 0.02 0.00 0.00 175.26 176.91 2k0q s ASN 30 N -2.45 4.96 0.00 -0.19 4.22 0.51 0.85 114.94 122.84 2k0q s ASN 30 Ca 0.08 0.34 0.00 0.00 -2.14 0.00 0.00 52.86 51.14 2k0q s ASN 30 Cb -0.04 -1.06 0.00 0.00 1.28 0.00 0.00 41.25 41.42 2k0q s ASN 30 CO 0.02 -1.46 0.14 2.29 -2.04 0.00 0.00 177.10 176.05 2k0q n LYS 31 N -2.76 0.00 -0.00 3.55 2.85 -1.21 -0.12 118.16 120.47 2k0q n LYS 31 Ca 0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2k0q n LYS 31 Cb 0.60 -1.21 0.00 0.00 -0.65 0.00 0.00 35.03 33.77 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 -0.53 0.01 -1.45 5.58 3.72 -1.26 -4.89 117.46 118.62 2k0q n PHE 32 Ca 0.00 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.01 2k0q n PHE 32 Cb 0.00 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 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 -0.37 0.40 3.45 1.37 0.00 0.83 -5.03 105.19 105.84 2k0q n GLY 33 Ca 0.00 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.92 2.77 0.01 1.61 -0.14 -1.25 -4.87 119.74 114.96 2k0q s LYS 34 Ca 0.00 -0.69 -0.30 0.00 -1.36 0.00 0.00 55.97 53.62 2k0q s LYS 34 Cb 0.00 -2.46 -0.04 0.00 -1.68 0.00 0.00 37.83 33.65 2k0q s LYS 34 CO 0.00 0.50 1.05 -1.12 -0.76 0.00 0.00 175.35 175.03 2k0q s SER 35 N -0.41 7.26 0.03 2.83 0.01 -1.26 -0.36 113.70 121.80 2k0q s SER 35 Ca 0.05 1.76 -0.12 0.00 1.31 0.00 0.00 55.95 58.95 2k0q s SER 35 Cb -0.12 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.55 2k0q s SER 35 CO 0.02 -0.35 0.25 0.00 0.41 0.00 0.00 173.24 173.57 2k0q s MET 36 N 1.15 0.71 0.36 12.44 0.23 0.41 -4.95 119.30 129.64 2k0q s MET 36 Ca 0.54 -0.49 -0.28 0.00 -1.03 0.00 0.00 55.69 54.43 2k0q s MET 36 Cb -0.23 0.30 -0.10 0.00 -1.53 0.00 0.00 34.83 33.27 2k0q s MET 36 CO 0.27 -0.21 1.28 0.54 -2.03 0.00 0.00 175.02 174.88 2k0q s ASN 37 N -1.88 6.64 -0.20 -1.18 2.20 -1.26 -3.89 114.94 115.36 2k0q s ASN 37 Ca -0.07 2.63 -0.22 0.00 -0.94 0.00 0.00 52.86 54.25 2k0q s ASN 37 Cb -0.02 -2.64 -0.02 0.00 -2.00 0.00 0.00 41.25 36.57 2k0q s ASN 37 CO -0.02 -0.62 0.69 -0.32 -2.94 0.00 0.00 177.10 173.90 2k0q s MET 38 N -1.95 4.21 0.00 3.55 -2.45 -1.26 -5.00 119.30 116.41 2k0q s MET 38 Ca 0.52 0.73 -0.30 0.00 -1.25 0.00 0.00 55.69 55.38 2k0q s MET 38 Cb -0.38 -3.59 -0.07 0.00 1.25 0.00 0.00 34.83 32.04 2k0q s MET 38 CO 0.50 -0.31 1.66 -2.14 1.05 0.00 0.00 175.02 175.78 2k0q s PRO 39 N 2.13 4.19 0.38 4.11 0.02 -1.26 -4.96 135.00 139.61 2k0q s PRO 39 Ca 0.31 2.26 -0.26 0.00 0.02 0.00 0.00 61.00 63.33 2k0q s PRO 39 Cb -0.16 -3.83 -0.09 0.00 0.02 0.00 0.00 34.50 30.45 2k0q s PRO 39 CO 0.10 -0.79 1.21 -2.00 -0.33 0.00 0.00 177.00 175.18 2k0q s GLU 40 N 3.43 4.13 0.00 5.54 2.12 -1.26 -3.28 118.70 129.37 2k0q s GLU 40 Ca 0.74 1.94 0.00 0.00 0.36 0.00 0.00 54.97 58.02 2k0q s GLU 40 Cb -0.36 -2.79 0.00 0.00 0.26 0.00 0.00 34.13 31.24 2k0q s GLU 40 CO 0.31 -0.29 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 2k0q n GLY 41 N 0.71 1.49 3.64 -1.50 0.00 -0.79 -5.00 105.19 103.74 2k0q n GLY 41 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.58 4.03 -0.12 1.61 -0.14 -1.21 -5.02 119.74 118.33 2k0q s LYS 42 Ca 0.00 -0.27 -0.19 0.00 -1.36 0.00 0.00 55.97 54.16 2k0q s LYS 42 Cb 0.00 -3.58 -0.04 0.00 -1.68 0.00 0.00 37.83 32.53 2k0q s LYS 42 CO 0.00 -0.03 0.50 0.54 -0.76 0.00 0.00 175.35 175.60 2k0q s VAL 43 N 1.31 5.17 0.20 3.17 0.11 -1.26 -4.21 120.40 124.89 2k0q s VAL 43 Ca 0.08 1.00 0.07 0.00 -2.93 0.00 0.00 61.98 60.20 2k0q s VAL 43 Cb -0.14 -3.84 -0.05 0.00 -1.53 0.00 0.00 36.38 30.82 2k0q s VAL 43 CO 0.07 0.31 -0.14 -0.04 -3.33 0.00 0.00 175.10 171.97 2k0q s MET 44 N 0.69 1.31 0.26 1.54 -1.94 0.11 -4.92 119.30 116.34 2k0q s MET 44 Ca 0.27 -1.58 0.07 0.00 -1.71 0.00 0.00 55.69 52.74 2k0q s MET 44 Cb -0.15 -1.08 -0.03 0.00 2.01 0.00 0.00 34.83 35.57 2k0q s MET 44 CO 0.11 0.18 0.24 -1.21 -0.01 0.00 0.00 175.02 174.33 2k0q s GLU 45 N -3.65 3.02 0.34 2.03 2.02 -1.26 -0.88 118.70 120.32 2k0q s GLU 45 Ca 0.22 -1.01 0.09 0.00 0.02 0.00 0.00 54.97 54.28 2k0q s GLU 45 Cb -0.01 -2.63 -0.05 0.00 0.10 0.00 0.00 34.13 31.55 2k0q s GLU 45 CO 0.06 0.38 0.08 0.95 0.02 0.00 0.00 175.26 176.75 2k0q s THR 46 N -2.12 2.79 0.12 3.63 -4.23 -0.49 -2.24 115.64 113.11 2k0q s THR 46 Ca 0.34 -1.83 0.33 0.00 -1.18 0.00 0.00 61.69 59.35 2k0q s THR 46 Cb -0.08 -2.89 0.36 0.00 1.34 0.00 0.00 72.50 71.22 2k0q s THR 46 CO 0.26 -0.18 2.00 0.08 -0.54 0.00 0.00 174.62 176.24 2k0q h ARG 47 N 1.67 0.00 0.00 3.99 0.11 -1.16 -2.42 114.38 116.57 2k0q h ARG 47 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.65 2k0q h ARG 47 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2k0q h ARG 47 CO 0.65 0.00 -0.83 -3.47 0.10 0.00 0.00 179.97 176.42 2k0q n ASP 48 N -2.80 0.66 0.00 0.08 2.03 -1.26 -4.94 116.55 110.33 2k0q n ASP 48 Ca -0.01 -0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2k0q n ASP 48 Cb 0.17 0.46 0.00 0.00 -0.72 0.00 0.00 41.12 41.04 2k0q n ASP 48 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k0q n GLY 49 N 1.34 1.06 3.93 0.27 0.00 -0.91 -5.10 105.19 105.79 2k0q n GLY 49 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 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 5.24 -0.06 2.61 2.01 -1.26 -4.89 115.64 117.28 2k0q s THR 50 Ca 0.00 -0.46 0.05 0.00 0.31 0.00 0.00 61.69 61.58 2k0q s THR 50 Cb 0.00 -3.74 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 2k0q s THR 50 CO 0.00 -0.15 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.03 2k0q s LYS 51 N -3.31 2.64 0.08 4.92 1.02 -1.26 -1.39 119.74 122.44 2k0q s LYS 51 Ca 0.37 -0.83 0.02 0.00 0.02 0.00 0.00 55.97 55.55 2k0q s LYS 51 Cb -0.11 -2.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.89 2k0q s LYS 51 CO 0.29 0.42 -0.06 0.96 -0.92 0.00 0.00 175.35 176.03 2k0q s ILE 52 N -0.23 0.62 -0.06 2.17 -4.36 -0.06 -1.90 121.20 117.37 2k0q s ILE 52 Ca -0.01 -1.75 -0.26 0.00 -0.26 0.00 0.00 60.65 58.37 2k0q s ILE 52 Cb -0.13 -1.45 0.06 0.00 1.25 0.00 0.00 42.46 42.19 2k0q s ILE 52 CO 0.03 -0.79 0.58 -0.51 0.24 0.00 0.00 174.94 174.50 2k0q s ILE 53 N -3.20 0.01 -0.30 8.37 2.07 -0.89 0.06 121.20 127.33 2k0q s ILE 53 Ca 0.07 -0.12 -0.12 0.00 -1.41 0.00 0.00 60.65 59.08 2k0q s ILE 53 Cb 0.02 -0.89 -0.04 0.00 0.13 0.00 0.00 42.46 41.69 2k0q s ILE 53 CO -0.04 -0.06 0.21 -0.32 -1.91 0.00 0.00 174.94 172.81 2k0q s MET 54 N -1.05 3.77 -0.03 3.50 -2.45 -1.26 0.25 119.30 122.03 2k0q s MET 54 Ca -0.10 -0.44 -0.01 0.00 -1.25 0.00 0.00 55.69 53.89 2k0q s MET 54 Cb -0.02 -3.70 0.03 0.00 1.25 0.00 0.00 34.83 32.39 2k0q s MET 54 CO 0.08 -0.28 0.05 0.21 1.05 0.00 0.00 175.02 176.13 2k0q s LYS 55 N 1.74 -0.01 -1.41 4.11 2.47 -0.74 -1.88 119.74 124.02 2k0q s LYS 55 Ca 0.07 0.21 -0.08 0.00 -1.56 0.00 0.00 55.97 54.60 2k0q s LYS 55 Cb -0.16 -0.22 0.01 0.00 -1.46 0.00 0.00 37.83 36.00 2k0q s LYS 55 CO 0.11 -0.16 1.04 0.41 0.16 0.00 0.00 175.35 176.91 2k0q n GLY 56 N 4.11 -0.54 2.62 5.54 0.00 -1.26 -1.22 105.19 114.43 2k0q n GLY 56 Ca -0.27 0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2k0q n GLY 56 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k0q n ASN 57 N -2.88 -4.48 -4.21 1.61 4.05 -1.26 -4.96 115.26 103.12 2k0q n ASN 57 Ca -0.02 0.00 -0.21 0.00 0.45 0.00 0.00 54.58 54.79 2k0q n ASN 57 Cb 0.58 -2.17 -0.01 0.00 1.23 0.00 0.00 39.78 39.41 2k0q n ASN 57 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2k0q n GLU 58 N -0.78 0.88 -3.88 1.20 1.02 -0.36 -4.92 120.64 113.80 2k0q n GLU 58 Ca 0.00 -2.75 -0.23 0.00 -0.02 0.00 0.00 57.16 54.17 2k0q n GLU 58 Cb 0.27 0.38 -0.17 0.00 -0.02 0.00 0.00 31.44 31.90 2k0q n GLU 58 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2k0q s ILE 59 N -2.20 0.50 -0.31 -3.67 -1.09 -1.26 -1.79 121.20 111.38 2k0q s ILE 59 Ca 0.20 0.01 -0.26 0.00 -2.23 0.00 0.00 60.65 58.37 2k0q s ILE 59 Cb -0.02 -0.61 0.01 0.00 -1.58 0.00 0.00 42.46 40.27 2k0q s ILE 59 CO 0.13 0.27 0.94 0.12 -1.23 0.00 0.00 174.94 175.16 2k0q s PHE 60 N 1.70 3.19 -0.40 3.97 2.19 0.14 -4.94 117.98 123.83 2k0q s PHE 60 Ca 0.01 1.04 -0.03 0.00 0.33 0.00 0.00 56.93 58.28 2k0q s PHE 60 Cb -0.13 -3.44 0.11 0.00 -1.31 0.00 0.00 43.02 38.25 2k0q s PHE 60 CO -0.04 -0.65 0.20 0.50 1.83 0.00 0.00 175.22 177.06 2k0q s ARG 61 N 3.29 2.08 0.00 10.12 3.52 -1.26 -2.09 118.95 134.60 2k0q s ARG 61 Ca 0.39 -1.76 0.00 0.00 -0.13 0.00 0.00 55.73 54.23 2k0q s ARG 61 Cb -0.13 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 2k0q s ARG 61 CO 0.13 -1.04 0.00 1.47 -0.81 0.00 0.00 175.30 175.05 2k0q n LEU 62 N 4.62 0.00 0.00 -0.88 -0.00 -0.80 -2.70 117.00 117.24 2k0q n LEU 62 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.97 2k0q n LEU 62 Cb 0.41 -0.42 0.00 0.00 -0.00 0.00 0.00 43.42 43.41 2k0q n LEU 62 CO 0.33 0.00 0.00 -0.67 -0.00 0.00 0.00 177.39 177.05 2k0q n ASP 63 N 1.68 0.00 0.16 1.45 2.03 -1.26 -4.41 116.55 116.20 2k0q n ASP 63 Ca 0.00 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.44 2k0q n ASP 63 Cb 0.00 0.00 0.53 0.00 -0.72 0.00 0.00 41.12 40.93 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 0.00 -0.67 5.08 -1.98 0.98 114.58 117.98 2k0q h GLU 64 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 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 0.00 -0.29 0.00 -1.00 0.00 0.00 179.01 177.72 2k0q h ALA 65 N 2.22 1.10 0.02 3.43 0.00 -1.72 -1.21 119.26 123.10 2k0q h ALA 65 Ca 0.00 -0.26 -0.28 0.00 0.00 0.00 0.00 54.91 54.37 2k0q h ALA 65 Cb 0.38 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2k0q h ALA 65 CO 0.00 0.36 -1.55 -0.07 0.00 0.00 0.00 179.25 177.99 2k0q h LEU 66 N 0.00 0.07 0.33 0.00 3.38 -1.04 -2.24 115.31 115.81 2k0q h LEU 66 Ca -0.00 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2k0q h LEU 66 Cb 0.72 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2k0q h LEU 66 CO 0.04 1.10 -0.17 -0.09 0.09 0.00 0.00 178.44 179.41 2k0q h ARG 67 N 0.01 -0.44 0.00 1.13 2.43 -0.70 -3.40 114.38 113.41 2k0q h ARG 67 Ca -0.23 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 2k0q h ARG 67 Cb 1.96 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.61 2k0q h ARG 67 CO 0.10 -0.29 -0.19 0.36 -1.51 0.00 0.00 179.97 178.44 2k0q n LYS 68 N -3.28 0.76 -0.88 0.20 2.85 -0.50 -4.78 118.16 112.53 2k0q n LYS 68 Ca -0.06 -1.33 -0.05 0.00 -1.05 0.00 0.00 58.31 55.82 2k0q n LYS 68 Cb 0.18 -0.81 0.26 0.00 -0.65 0.00 0.00 35.03 34.01 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 -0.42 3.34 3.56 2.58 0.00 -0.84 -4.87 105.19 108.54 2k0q n GLY 69 Ca 0.04 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2k0q n GLY 69 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k0q s HIS 70 N -2.61 2.94 -0.02 1.61 3.76 -1.24 -4.82 115.29 114.91 2k0q s HIS 70 Ca 0.47 0.32 0.06 0.00 -0.15 0.00 0.00 55.06 55.75 2k0q s HIS 70 Cb 0.37 -3.87 -0.09 0.00 1.11 0.00 0.00 32.58 30.11 2k0q s HIS 70 CO 0.12 -1.06 0.11 0.43 -0.85 0.00 0.00 174.74 173.48 2k0q n SER 71 N 7.02 3.64 -2.48 1.40 7.64 -1.26 -5.08 113.62 124.50 2k0q n SER 71 Ca 0.05 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.92 2k0q n SER 71 Cb 0.48 1.13 0.00 0.00 -1.01 0.00 0.00 64.21 64.82 2k0q n SER 71 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2k0q n GLU 72 N -1.81 -2.63 0.00 1.43 4.07 -1.26 -4.71 120.64 115.72 2k0q n GLU 72 Ca -0.03 2.24 0.00 0.00 -0.06 0.00 0.00 57.16 59.31 2k0q n GLU 72 Cb 0.27 -4.55 0.00 0.00 -0.06 0.00 0.00 31.44 27.10 2k0q n GLU 72 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k0q n GLY 73 N 0.40 1.36 0.00 8.31 0.00 -1.26 -5.32 105.19 108.67 2k0q n GLY 73 Ca 0.02 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2k0q n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93