#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 6.66 -0.02 -1.34 2.15 -1.26 -4.92 116.67 117.95 2k0q s ASP 2 Ca 0.00 2.63 0.18 0.00 0.43 0.00 0.00 52.55 55.79 2k0q s ASP 2 Cb 0.00 -2.62 0.54 0.00 -0.30 0.00 0.00 42.92 40.54 2k0q s ASP 2 CO 0.00 -0.71 1.45 0.23 -0.17 0.00 0.00 175.17 175.97 2k0q n MET 3 N 2.68 2.89 -0.05 4.34 2.81 -1.26 -4.40 117.12 124.13 2k0q n MET 3 Ca 0.08 -2.49 -0.04 0.00 -1.81 0.00 0.00 57.70 53.44 2k0q n MET 3 Cb 0.40 -1.51 -0.15 0.00 -0.71 0.00 0.00 33.22 31.26 2k0q n MET 3 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2k0q n SER 4 N 1.15 0.24 -1.40 7.83 7.64 -1.26 -4.18 113.62 123.64 2k0q n SER 4 Ca 0.20 0.11 0.10 0.00 1.01 0.00 0.00 58.87 60.29 2k0q n SER 4 Cb 0.59 0.92 0.33 0.00 -1.01 0.00 0.00 64.21 65.04 2k0q n SER 4 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2k0q n ASN 5 N -2.72 4.25 -4.50 6.43 2.04 -1.26 -4.90 115.26 114.60 2k0q n ASN 5 Ca -0.22 -2.23 -0.34 0.00 -0.44 0.00 0.00 54.58 51.35 2k0q n ASN 5 Cb 0.99 -0.51 -0.12 0.00 -2.53 0.00 0.00 39.78 37.61 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 -1.42 4.11 -0.22 3.53 0.11 -1.26 0.03 120.40 125.27 2k0q s VAL 6 Ca 0.48 -0.27 0.17 0.00 -2.93 0.00 0.00 61.98 59.43 2k0q s VAL 6 Cb 0.28 -2.84 0.12 0.00 -1.53 0.00 0.00 36.38 32.41 2k0q s VAL 6 CO 0.28 0.45 1.46 -0.37 -3.33 0.00 0.00 175.10 173.59 2k0q h VAL 7 N 5.21 0.66 -1.58 2.04 -1.51 -1.56 -3.46 116.25 116.06 2k0q h VAL 7 Ca -0.34 -1.93 0.10 0.00 -1.23 0.00 0.00 66.70 63.30 2k0q h VAL 7 Cb 1.18 2.32 -0.26 0.00 -2.13 0.00 0.00 31.29 32.40 2k0q h VAL 7 CO 0.63 0.37 0.31 -0.75 -1.23 0.00 0.00 177.57 176.91 2k0q s LYS 8 N -3.02 0.42 -0.12 5.19 2.47 -1.19 -5.03 119.74 118.46 2k0q s LYS 8 Ca 0.04 0.76 -0.06 0.00 -1.56 0.00 0.00 55.97 55.15 2k0q s LYS 8 Cb 0.07 0.12 -0.04 0.00 -1.46 0.00 0.00 37.83 36.52 2k0q s LYS 8 CO 0.73 -0.09 0.09 0.99 0.16 0.00 0.00 175.35 177.23 2k0q s THR 9 N 1.48 5.06 -0.21 3.43 2.01 -1.26 -0.86 115.64 125.29 2k0q s THR 9 Ca -0.09 0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.90 2k0q s THR 9 Cb -0.04 -3.20 -0.02 0.00 0.01 0.00 0.00 72.50 69.24 2k0q s THR 9 CO -0.16 0.59 0.02 -0.31 -0.69 0.00 0.00 174.62 174.06 2k0q s TYR 10 N -0.74 3.05 -0.36 4.92 2.02 0.34 -4.92 117.35 121.66 2k0q s TYR 10 Ca 0.13 -0.48 -0.17 0.00 -0.37 0.00 0.00 57.07 56.17 2k0q s TYR 10 Cb -0.12 -2.12 -0.00 0.00 -0.40 0.00 0.00 41.96 39.32 2k0q s TYR 10 CO 0.03 -0.29 0.47 -0.51 -1.57 0.00 0.00 175.55 173.68 2k0q s ASP 11 N 1.18 6.26 0.33 2.29 1.01 -1.26 -0.14 116.67 126.35 2k0q s ASP 11 Ca 0.03 -0.19 -0.11 0.00 0.71 0.00 0.00 52.55 52.99 2k0q s ASP 11 Cb -0.14 -2.25 -0.07 0.00 1.01 0.00 0.00 42.92 41.47 2k0q s ASP 11 CO 0.02 -0.48 0.69 -0.76 0.21 0.00 0.00 175.17 174.85 2k0q s LEU 12 N 2.29 3.99 0.00 1.23 1.43 0.30 -0.83 118.68 127.08 2k0q s LEU 12 Ca 0.16 1.08 0.14 0.00 -1.03 0.00 0.00 54.13 54.49 2k0q s LEU 12 Cb -0.16 -3.91 0.70 0.00 0.03 0.00 0.00 46.19 42.85 2k0q s LEU 12 CO 0.13 -0.26 1.39 1.67 0.23 0.00 0.00 176.35 179.52 2k0q n GLN 13 N -0.77 0.17 0.00 1.70 7.27 -1.15 -0.88 117.38 123.73 2k0q n GLN 13 Ca 0.02 0.17 0.11 0.00 0.07 0.00 0.00 57.00 57.37 2k0q n GLN 13 Cb 0.53 -1.50 0.11 0.00 2.41 0.00 0.00 30.24 31.80 2k0q n GLN 13 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2k0q n ASP 14 N -1.32 1.07 0.00 1.69 9.92 -1.26 -4.93 116.55 121.72 2k0q n ASP 14 Ca 0.06 -0.86 0.00 0.00 -0.53 0.00 0.00 54.79 53.46 2k0q n ASP 14 Cb 0.12 0.50 0.00 0.00 -0.64 0.00 0.00 41.12 41.10 2k0q n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k0q n GLY 15 N 1.45 3.10 3.75 0.44 0.00 -0.06 -4.54 105.19 109.34 2k0q n GLY 15 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.16 5.47 -0.13 1.61 0.01 -1.26 -3.29 113.70 114.96 2k0q s SER 16 Ca 0.00 2.72 0.02 0.00 1.31 0.00 0.00 55.95 60.00 2k0q s SER 16 Cb 0.00 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.61 2k0q s SER 16 CO 0.00 -1.43 -0.21 -0.54 0.41 0.00 0.00 173.24 171.47 2k0q s LYS 17 N -2.81 2.91 0.16 12.44 1.02 0.16 -0.54 119.74 133.08 2k0q s LYS 17 Ca 0.69 -0.82 0.05 0.00 0.02 0.00 0.00 55.97 55.91 2k0q s LYS 17 Cb -0.39 -2.36 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 2k0q s LYS 17 CO 0.47 -0.02 0.13 0.08 -0.92 0.00 0.00 175.35 175.09 2k0q s VAL 18 N 0.83 4.47 -0.02 3.17 1.01 0.80 1.00 120.40 131.67 2k0q s VAL 18 Ca -0.07 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.84 2k0q s VAL 18 Cb -0.15 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.96 2k0q s VAL 18 CO -0.02 -0.10 -0.03 -1.00 0.00 0.00 0.00 175.10 173.96 2k0q s HIS 19 N -1.73 0.43 -0.39 5.22 0.09 0.55 0.13 115.29 119.58 2k0q s HIS 19 Ca 0.31 -0.07 -0.16 0.00 -0.00 0.00 0.00 55.06 55.13 2k0q s HIS 19 Cb -0.10 -0.38 0.01 0.00 -0.00 0.00 0.00 32.58 32.11 2k0q s HIS 19 CO 0.23 -0.08 0.39 0.08 -0.00 0.00 0.00 174.74 175.36 2k0q s VAL 20 N 0.46 5.14 0.44 -0.90 1.01 -0.04 -1.65 120.40 124.85 2k0q s VAL 20 Ca -0.05 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2k0q s VAL 20 Cb -0.08 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.29 2k0q s VAL 20 CO -0.01 -0.29 0.83 -0.36 0.00 0.00 0.00 175.10 175.28 2k0q s PHE 21 N 2.03 3.47 0.62 5.22 0.08 0.20 -1.53 117.98 128.07 2k0q s PHE 21 Ca 0.11 1.16 0.34 0.00 0.12 0.00 0.00 56.93 58.66 2k0q s PHE 21 Cb -0.17 -2.54 1.94 0.00 -0.57 0.00 0.00 43.02 41.68 2k0q s PHE 21 CO 0.12 -0.19 2.22 1.57 -0.10 0.00 0.00 175.22 178.85 2k0q h LYS 22 N 1.12 0.00 -0.46 0.44 2.10 -0.69 0.20 116.57 119.29 2k0q h LYS 22 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2k0q h LYS 22 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2k0q h LYS 22 CO 0.63 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.83 2k0q n ASP 23 N -3.54 3.30 0.00 7.07 9.92 -1.26 -4.08 116.55 127.96 2k0q n ASP 23 Ca -0.02 -1.97 0.00 0.00 -0.53 0.00 0.00 54.79 52.28 2k0q n ASP 23 Cb 0.17 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 2k0q n ASP 23 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k0q n GLY 24 N 1.49 0.63 3.92 0.44 0.00 0.72 -5.06 105.19 107.32 2k0q n GLY 24 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.78 1.77 0.01 1.61 3.01 -1.25 -4.76 119.74 119.34 2k0q s LYS 25 Ca 0.00 -0.13 0.01 0.00 -1.01 0.00 0.00 55.97 54.85 2k0q s LYS 25 Cb 0.00 -2.00 -0.01 0.00 -1.01 0.00 0.00 37.83 34.81 2k0q s LYS 25 CO 0.00 -1.65 -0.05 -1.64 0.51 0.00 0.00 175.35 172.52 2k0q s MET 26 N -5.53 0.37 0.01 1.68 -1.94 -1.26 0.60 119.30 113.24 2k0q s MET 26 Ca 0.64 -0.34 0.02 0.00 -1.71 0.00 0.00 55.69 54.30 2k0q s MET 26 Cb -0.09 -0.27 -0.01 0.00 2.01 0.00 0.00 34.83 36.47 2k0q s MET 26 CO 0.48 0.06 -0.07 0.20 -0.01 0.00 0.00 175.02 175.68 2k0q s GLY 27 N -0.60 0.41 -0.06 -0.03 0.00 -0.66 -4.95 107.32 101.42 2k0q s GLY 27 Ca -0.03 -0.46 0.05 0.00 0.00 0.00 0.00 44.72 44.29 2k0q s GLY 27 CO -0.00 -0.44 -0.22 -0.29 0.00 0.00 0.00 173.10 172.15 2k0q s MET 28 N -0.62 2.59 0.14 2.90 1.75 -1.26 -0.33 119.30 124.47 2k0q s MET 28 Ca -0.01 -0.86 0.08 0.00 -1.25 0.00 0.00 55.69 53.66 2k0q s MET 28 Cb -0.05 -2.23 -0.04 0.00 2.84 0.00 0.00 34.83 35.35 2k0q s MET 28 CO 0.00 0.41 -0.18 -1.21 -0.65 0.00 0.00 175.02 173.39 2k0q s GLU 29 N -0.23 1.20 0.60 4.11 2.02 0.28 0.25 118.70 126.93 2k0q s GLU 29 Ca -0.01 -1.32 -0.03 0.00 0.02 0.00 0.00 54.97 53.63 2k0q s GLU 29 Cb -0.13 -1.27 0.03 0.00 0.10 0.00 0.00 34.13 32.86 2k0q s GLU 29 CO 0.03 0.27 0.88 0.54 0.02 0.00 0.00 175.26 176.99 2k0q s ASN 30 N -2.45 5.23 0.00 -0.19 4.22 -0.51 0.38 114.94 121.62 2k0q s ASN 30 Ca 0.12 0.34 0.00 0.00 -2.14 0.00 0.00 52.86 51.18 2k0q s ASN 30 Cb -0.07 -1.20 0.00 0.00 1.28 0.00 0.00 41.25 41.27 2k0q s ASN 30 CO 0.05 -1.24 0.27 2.29 -2.04 0.00 0.00 177.10 176.43 2k0q n LYS 31 N -2.57 0.00 0.00 3.55 2.85 -1.21 -0.32 118.16 120.46 2k0q n LYS 31 Ca 0.07 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.38 2k0q n LYS 31 Cb 0.59 -1.40 0.02 0.00 -0.65 0.00 0.00 35.03 33.59 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 -0.74 0.00 -1.68 5.58 3.72 -1.26 -4.94 117.46 118.14 2k0q n PHE 32 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2k0q n PHE 32 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 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 0.77 0.62 3.36 1.37 0.00 0.56 -5.07 105.19 106.80 2k0q n GLY 33 Ca 0.05 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 2k0q n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k0q s LYS 34 N -3.52 1.55 0.02 1.61 0.00 -1.26 -4.60 119.74 113.54 2k0q s LYS 34 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 55.97 54.44 2k0q s LYS 34 Cb 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 37.83 35.89 2k0q s LYS 34 CO 0.00 0.47 1.21 -1.54 0.00 0.00 0.00 175.35 175.48 2k0q s SER 35 N -1.68 7.06 0.45 0.03 1.04 -1.26 -1.42 113.70 117.92 2k0q s SER 35 Ca 0.12 1.94 0.03 0.00 0.48 0.00 0.00 55.95 58.52 2k0q s SER 35 Cb -0.10 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.44 2k0q s SER 35 CO 0.04 -0.52 0.10 1.15 0.98 0.00 0.00 173.24 174.99 2k0q n MET 36 N 4.46 0.64 -2.12 4.02 0.00 0.14 -4.95 117.12 119.31 2k0q n MET 36 Ca 0.10 -3.61 -0.33 0.00 0.00 0.00 0.00 57.70 53.86 2k0q n MET 36 Cb 0.46 1.59 0.00 0.00 0.00 0.00 0.00 33.22 35.28 2k0q n MET 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2k0q s ASN 37 N -3.66 5.93 -0.12 3.17 2.20 -1.26 -4.31 114.94 116.90 2k0q s ASN 37 Ca 0.14 1.79 0.03 0.00 -0.94 0.00 0.00 52.86 53.88 2k0q s ASN 37 Cb 0.01 -2.53 0.01 0.00 -2.00 0.00 0.00 41.25 36.73 2k0q s ASN 37 CO 0.10 -1.06 -0.23 -0.32 -2.94 0.00 0.00 177.10 172.65 2k0q s MET 38 N -4.02 3.04 0.45 3.55 1.75 -1.26 -4.87 119.30 117.93 2k0q s MET 38 Ca 0.63 -0.86 -0.22 0.00 -1.25 0.00 0.00 55.69 53.99 2k0q s MET 38 Cb -0.15 -2.38 -0.09 0.00 2.84 0.00 0.00 34.83 35.05 2k0q s MET 38 CO 0.35 0.07 1.04 -1.25 -0.65 0.00 0.00 175.02 174.58 2k0q s PRO 39 N 0.60 3.96 -0.08 4.11 0.04 -1.26 -5.06 135.00 137.31 2k0q s PRO 39 Ca -0.12 1.40 -0.00 0.00 0.04 0.00 0.00 61.00 62.31 2k0q s PRO 39 Cb -0.17 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 2k0q s PRO 39 CO 0.03 -0.30 -0.04 -2.00 0.04 0.00 0.00 177.00 174.73 2k0q s GLU 40 N -2.96 2.85 0.00 4.56 2.12 -1.26 -4.39 118.70 119.62 2k0q s GLU 40 Ca 0.63 -0.50 0.00 0.00 0.36 0.00 0.00 54.97 55.47 2k0q s GLU 40 Cb -0.18 -2.67 0.00 0.00 0.26 0.00 0.00 34.13 31.54 2k0q s GLU 40 CO 0.22 0.67 0.00 0.41 -0.54 0.00 0.00 175.26 176.02 2k0q n GLY 41 N 2.23 2.63 3.78 -1.50 0.00 -0.25 -4.98 105.19 107.09 2k0q n GLY 41 Ca -0.18 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 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 0.00 4.59 -0.17 1.61 1.02 -1.26 -4.93 119.74 120.60 2k0q s LYS 42 Ca 0.00 1.24 -0.12 0.00 0.02 0.00 0.00 55.97 57.11 2k0q s LYS 42 Cb 0.00 -3.05 -0.05 0.00 -0.52 0.00 0.00 37.83 34.21 2k0q s LYS 42 CO 0.00 0.44 0.23 0.54 -0.92 0.00 0.00 175.35 175.64 2k0q s VAL 43 N -1.37 5.34 -0.10 3.17 0.11 -1.26 -4.29 120.40 122.01 2k0q s VAL 43 Ca 0.43 0.42 -0.05 0.00 -2.93 0.00 0.00 61.98 59.85 2k0q s VAL 43 Cb -0.21 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.03 2k0q s VAL 43 CO 0.26 0.41 0.09 -0.04 -3.33 0.00 0.00 175.10 172.49 2k0q s MET 44 N 0.41 3.25 0.02 1.54 -1.94 0.19 -4.90 119.30 117.86 2k0q s MET 44 Ca 0.13 -0.26 0.00 0.00 -1.71 0.00 0.00 55.69 53.85 2k0q s MET 44 Cb -0.12 -3.02 -0.04 0.00 2.01 0.00 0.00 34.83 33.66 2k0q s MET 44 CO 0.02 0.74 0.11 -2.00 -0.01 0.00 0.00 175.02 173.88 2k0q s GLU 45 N -1.05 3.12 0.39 2.03 2.12 -1.26 -1.23 118.70 122.82 2k0q s GLU 45 Ca 0.15 -0.50 0.07 0.00 0.36 0.00 0.00 54.97 55.06 2k0q s GLU 45 Cb -0.12 -2.88 0.00 0.00 0.26 0.00 0.00 34.13 31.39 2k0q s GLU 45 CO 0.04 0.63 0.52 0.95 -0.54 0.00 0.00 175.26 176.86 2k0q s THR 46 N -1.29 3.37 0.32 -1.70 -4.23 -0.26 -2.92 115.64 108.92 2k0q s THR 46 Ca 0.26 -1.02 0.09 0.00 -1.18 0.00 0.00 61.69 59.84 2k0q s THR 46 Cb -0.12 -3.15 0.31 0.00 1.34 0.00 0.00 72.50 70.88 2k0q s THR 46 CO 0.18 -0.06 1.69 0.03 -0.54 0.00 0.00 174.62 175.91 2k0q h ARG 47 N 0.76 0.38 0.03 3.99 3.08 -1.16 -3.17 114.38 118.28 2k0q h ARG 47 Ca -0.42 -0.02 -0.38 0.00 0.07 0.00 0.00 59.98 59.23 2k0q h ARG 47 Cb 1.27 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 31.18 2k0q h ARG 47 CO 0.49 0.25 -2.20 -3.47 -1.07 0.00 0.00 179.97 173.97 2k0q n ASP 48 N -5.03 2.00 0.00 7.04 2.03 -1.26 -4.85 116.55 116.48 2k0q n ASP 48 Ca 0.27 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.71 2k0q n ASP 48 Cb 0.80 -0.69 0.00 0.00 -0.72 0.00 0.00 41.12 40.51 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 1.86 0.00 3.85 0.27 0.00 -1.20 -5.15 105.19 104.82 2k0q n GLY 49 Ca -0.42 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 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 0.00 5.01 0.03 2.61 2.01 -1.26 -4.90 115.64 119.15 2k0q s THR 50 Ca 0.00 -0.51 0.06 0.00 0.31 0.00 0.00 61.69 61.55 2k0q s THR 50 Cb 0.00 -3.41 -0.02 0.00 0.01 0.00 0.00 72.50 69.07 2k0q s THR 50 CO 0.00 0.17 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.37 2k0q s LYS 51 N -2.35 1.30 0.06 4.92 1.02 -1.26 -1.11 119.74 122.32 2k0q s LYS 51 Ca 0.31 -0.84 0.00 0.00 0.02 0.00 0.00 55.97 55.46 2k0q s LYS 51 Cb -0.13 -1.36 -0.04 0.00 -0.52 0.00 0.00 37.83 35.79 2k0q s LYS 51 CO 0.24 0.35 -0.05 0.96 -0.92 0.00 0.00 175.35 175.93 2k0q s ILE 52 N -0.74 0.42 -0.07 2.17 -4.36 -0.36 -2.08 121.20 116.18 2k0q s ILE 52 Ca 0.06 -1.69 -0.30 0.00 -0.26 0.00 0.00 60.65 58.46 2k0q s ILE 52 Cb -0.08 -1.36 0.07 0.00 1.25 0.00 0.00 42.46 42.34 2k0q s ILE 52 CO 0.01 -0.84 0.68 -0.51 0.24 0.00 0.00 174.94 174.53 2k0q s ILE 53 N -3.29 0.00 -0.17 8.37 -1.16 -0.84 0.56 121.20 124.67 2k0q s ILE 53 Ca 0.05 -0.00 -0.03 0.00 -0.51 0.00 0.00 60.65 60.16 2k0q s ILE 53 Cb 0.03 -1.00 -0.02 0.00 0.61 0.00 0.00 42.46 42.09 2k0q s ILE 53 CO -0.06 -0.00 -0.07 -0.32 -2.81 0.00 0.00 174.94 171.68 2k0q s MET 54 N -1.02 3.49 -0.09 3.50 -2.45 -1.26 0.46 119.30 121.94 2k0q s MET 54 Ca -0.10 -0.60 -0.04 0.00 -1.25 0.00 0.00 55.69 53.70 2k0q s MET 54 Cb -0.01 -2.85 0.04 0.00 1.25 0.00 0.00 34.83 33.27 2k0q s MET 54 CO 0.09 0.10 0.20 0.21 1.05 0.00 0.00 175.02 176.68 2k0q s LYS 55 N 0.69 0.15 -1.50 4.11 2.47 0.78 -1.09 119.74 125.35 2k0q s LYS 55 Ca -0.04 0.47 -0.06 0.00 -1.56 0.00 0.00 55.97 54.79 2k0q s LYS 55 Cb -0.15 -0.15 0.01 0.00 -1.46 0.00 0.00 37.83 36.09 2k0q s LYS 55 CO 0.02 -0.17 0.77 0.41 0.16 0.00 0.00 175.35 176.54 2k0q n GLY 56 N 4.29 -0.53 3.80 5.54 0.00 -1.26 -1.21 105.19 115.83 2k0q n GLY 56 Ca -0.25 0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.66 0.00 -4.78 1.61 3.02 -1.26 -4.96 115.26 106.23 2k0q n ASN 57 Ca -0.07 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.09 2k0q n ASN 57 Cb 0.60 -0.63 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 2k0q n ASN 57 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2k0q s GLU 58 N -0.02 4.43 -0.23 3.52 0.41 -0.35 -4.98 118.70 121.48 2k0q s GLU 58 Ca 0.00 0.99 -0.09 0.00 -0.41 0.00 0.00 54.97 55.46 2k0q s GLU 58 Cb 0.00 -3.27 -0.04 0.00 -1.78 0.00 0.00 34.13 29.04 2k0q s GLU 58 CO 0.00 0.55 0.12 0.42 -0.49 0.00 0.00 175.26 175.86 2k0q s ILE 59 N -0.97 5.02 -0.25 -1.63 -1.09 -1.26 -0.16 121.20 120.86 2k0q s ILE 59 Ca 0.34 0.06 -0.25 0.00 -2.23 0.00 0.00 60.65 58.57 2k0q s ILE 59 Cb -0.21 -3.33 -0.00 0.00 -1.58 0.00 0.00 42.46 37.34 2k0q s ILE 59 CO 0.23 0.36 0.85 0.12 -1.23 0.00 0.00 174.94 175.28 2k0q s PHE 60 N 1.06 3.30 -0.37 3.97 2.19 0.17 -4.95 117.98 123.35 2k0q s PHE 60 Ca 0.06 1.14 0.00 0.00 0.33 0.00 0.00 56.93 58.46 2k0q s PHE 60 Cb -0.14 -3.11 0.10 0.00 -1.31 0.00 0.00 43.02 38.57 2k0q s PHE 60 CO 0.04 -0.44 0.12 0.50 1.83 0.00 0.00 175.22 177.28 2k0q s ARG 61 N 2.91 1.84 0.00 10.12 3.52 -1.26 -1.99 118.95 134.09 2k0q s ARG 61 Ca 0.36 -1.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.17 2k0q s ARG 61 Cb -0.15 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 2k0q s ARG 61 CO 0.08 -0.98 0.00 1.47 -0.81 0.00 0.00 175.30 175.06 2k0q n LEU 62 N 4.46 0.00 -1.20 -0.88 -0.00 -0.88 -4.06 117.00 114.44 2k0q n LEU 62 Ca -0.01 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.13 2k0q n LEU 62 Cb 0.42 -0.27 -0.05 0.00 -0.00 0.00 0.00 43.42 43.51 2k0q n LEU 62 CO 0.28 0.00 -0.35 -0.67 -0.00 0.00 0.00 177.39 176.65 2k0q n ASP 63 N 1.63 -6.22 0.00 1.45 2.03 -1.26 -4.78 116.55 109.40 2k0q n ASP 63 Ca 0.00 0.80 0.00 0.00 0.52 0.00 0.00 54.79 56.11 2k0q n ASP 63 Cb 0.00 -3.87 0.00 0.00 -0.72 0.00 0.00 41.12 36.53 2k0q n ASP 63 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2k0q n GLU 64 N -3.72 0.00 -0.31 -0.67 4.07 -1.26 -4.60 120.64 114.15 2k0q n GLU 64 Ca -0.03 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.18 2k0q n GLU 64 Cb 0.62 -0.09 0.35 0.00 -0.06 0.00 0.00 31.44 32.25 2k0q n GLU 64 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2k0q h ALA 65 N 0.00 1.77 0.00 4.31 0.00 -1.84 0.10 119.26 123.60 2k0q h ALA 65 Ca 0.00 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 2k0q h ALA 65 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2k0q h ALA 65 CO 0.00 -0.05 -1.83 1.28 0.00 0.00 0.00 179.25 178.65 2k0q n LEU 66 N -4.61 0.34 0.20 0.00 4.32 -1.26 -3.09 117.00 112.89 2k0q n LEU 66 Ca 0.19 0.15 -0.15 0.00 -0.02 0.00 0.00 56.01 56.18 2k0q n LEU 66 Cb 0.49 0.15 -0.08 0.00 -1.62 0.00 0.00 43.42 42.36 2k0q n LEU 66 CO 0.27 0.16 0.70 -0.09 -1.22 0.00 0.00 177.39 177.21 2k0q h ARG 67 N 0.00 -0.45 -3.61 3.23 2.43 -1.65 -3.37 114.38 110.97 2k0q h ARG 67 Ca -0.19 0.03 -0.56 0.00 -0.81 0.00 0.00 59.98 58.45 2k0q h ARG 67 Cb 1.51 0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 30.76 2k0q h ARG 67 CO 0.02 -0.24 -0.76 0.15 -1.51 0.00 0.00 179.97 177.63 2k0q s LYS 68 N -5.73 0.77 0.00 0.20 1.02 -0.07 -4.83 119.74 111.10 2k0q s LYS 68 Ca -0.15 -0.76 0.00 0.00 0.02 0.00 0.00 55.97 55.07 2k0q s LYS 68 Cb 0.04 -2.08 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 2k0q s LYS 68 CO 0.62 -0.80 0.00 0.41 -0.92 0.00 0.00 175.35 174.66 2k0q n GLY 69 N 4.93 1.95 0.00 -3.33 0.00 -1.26 -4.68 105.19 102.81 2k0q n GLY 69 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2k0q n GLY 69 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2k0q n HIS 70 N -0.10 0.00 -4.10 1.61 -0.00 -1.18 -4.86 115.22 106.59 2k0q n HIS 70 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.38 2k0q n HIS 70 Cb 0.00 -0.13 -0.00 0.00 -0.00 0.00 0.00 29.99 29.85 2k0q n HIS 70 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2k0q n SER 71 N -1.41 -4.00 -4.79 0.26 7.64 -1.26 -4.89 113.62 105.17 2k0q n SER 71 Ca 0.00 -0.91 -0.36 0.00 1.01 0.00 0.00 58.87 58.61 2k0q n SER 71 Cb 0.00 -3.24 -0.07 0.00 -1.01 0.00 0.00 64.21 59.89 2k0q n SER 71 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2k0q s GLU 72 N -6.80 4.47 0.00 1.43 2.12 -1.26 -3.79 118.70 114.86 2k0q s GLU 72 Ca 0.72 1.25 0.00 0.00 0.36 0.00 0.00 54.97 57.30 2k0q s GLU 72 Cb -0.38 -2.62 0.00 0.00 0.26 0.00 0.00 34.13 31.40 2k0q s GLU 72 CO 0.89 0.19 0.00 0.41 -0.54 0.00 0.00 175.26 176.21 2k0q n GLY 73 N 0.20 1.83 0.00 -1.50 0.00 -1.26 -5.02 105.19 99.45 2k0q n GLY 73 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2k0q n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93