#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 6.63 -0.06 6.55 1.11 -1.26 -4.90 116.67 124.74 2k0q s ASP 2 Ca 0.00 0.44 0.05 0.00 0.18 0.00 0.00 52.55 53.22 2k0q s ASP 2 Cb 0.00 -2.51 0.25 0.00 1.07 0.00 0.00 42.92 41.73 2k0q s ASP 2 CO 0.00 -1.10 0.95 0.23 1.18 0.00 0.00 175.17 176.43 2k0q n MET 3 N 7.40 2.07 0.11 8.23 2.81 -1.26 -3.81 117.12 132.68 2k0q n MET 3 Ca 0.10 -0.95 -0.02 0.00 -1.81 0.00 0.00 57.70 55.01 2k0q n MET 3 Cb 0.49 -1.62 -0.01 0.00 -0.71 0.00 0.00 33.22 31.37 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 1.27 0.00 -0.42 7.83 0.02 -2.04 -3.14 113.55 117.07 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 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2k0q h SER 4 CO 0.12 0.74 0.00 -0.46 -1.14 0.00 0.00 176.83 176.09 2k0q n ASN 5 N -3.34 3.13 -4.64 3.07 2.04 -1.25 -4.95 115.26 109.33 2k0q n ASN 5 Ca 0.01 -1.98 -0.35 0.00 -0.44 0.00 0.00 54.58 51.81 2k0q n ASN 5 Cb 0.81 -0.28 -0.10 0.00 -2.53 0.00 0.00 39.78 37.68 2k0q n ASN 5 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 2k0q s VAL 6 N -1.01 4.98 -0.20 3.53 1.01 -1.19 0.28 120.40 127.80 2k0q s VAL 6 Ca 0.29 0.04 0.19 0.00 0.00 0.00 0.00 61.98 62.49 2k0q s VAL 6 Cb 0.15 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.26 2k0q s VAL 6 CO 0.20 0.42 1.11 -0.37 0.00 0.00 0.00 175.10 176.46 2k0q h VAL 7 N 4.94 0.37 -1.63 2.92 -1.51 -1.49 -3.45 116.25 116.41 2k0q h VAL 7 Ca -0.38 -1.64 0.06 0.00 -1.23 0.00 0.00 66.70 63.51 2k0q h VAL 7 Cb 1.17 1.96 -0.26 0.00 -2.13 0.00 0.00 31.29 32.03 2k0q h VAL 7 CO 0.69 0.21 0.41 -0.75 -1.23 0.00 0.00 177.57 176.90 2k0q s LYS 8 N -3.09 0.52 0.04 5.19 2.47 -1.11 -5.03 119.74 118.72 2k0q s LYS 8 Ca 0.00 0.65 0.09 0.00 -1.56 0.00 0.00 55.97 55.15 2k0q s LYS 8 Cb 0.08 0.24 -0.03 0.00 -1.46 0.00 0.00 37.83 36.66 2k0q s LYS 8 CO 0.77 -0.07 -0.25 0.99 0.16 0.00 0.00 175.35 176.95 2k0q s THR 9 N 0.38 2.05 -0.09 3.43 2.01 -1.26 -0.08 115.64 122.08 2k0q s THR 9 Ca 0.01 -1.33 0.03 0.00 0.31 0.00 0.00 61.69 60.72 2k0q s THR 9 Cb -0.05 -1.75 0.01 0.00 0.01 0.00 0.00 72.50 70.71 2k0q s THR 9 CO -0.07 0.36 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.71 2k0q s TYR 10 N -0.78 2.22 -0.21 4.92 2.02 0.36 -4.94 117.35 120.93 2k0q s TYR 10 Ca 0.11 -0.92 -0.14 0.00 -0.37 0.00 0.00 57.07 55.76 2k0q s TYR 10 Cb -0.10 -1.52 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 2k0q s TYR 10 CO 0.02 -0.40 0.30 -0.51 -1.57 0.00 0.00 175.55 173.39 2k0q s ASP 11 N 0.50 6.31 0.39 2.29 1.01 -1.26 0.68 116.67 126.59 2k0q s ASP 11 Ca -0.16 0.35 -0.21 0.00 0.71 0.00 0.00 52.55 53.24 2k0q s ASP 11 Cb -0.17 -2.18 -0.10 0.00 1.01 0.00 0.00 42.92 41.48 2k0q s ASP 11 CO 0.06 -0.01 0.92 -0.76 0.21 0.00 0.00 175.17 175.59 2k0q s LEU 12 N 1.16 4.04 0.00 1.23 1.43 0.16 0.39 118.68 127.09 2k0q s LEU 12 Ca 0.14 1.66 0.08 0.00 -1.03 0.00 0.00 54.13 54.98 2k0q s LEU 12 Cb -0.14 -4.36 0.39 0.00 0.03 0.00 0.00 46.19 42.11 2k0q s LEU 12 CO 0.06 -0.28 1.10 0.00 0.23 0.00 0.00 176.35 177.46 2k0q n GLN 13 N -0.35 0.12 -0.05 1.70 6.02 -1.25 -1.10 117.38 122.47 2k0q n GLN 13 Ca 0.05 0.20 -0.04 0.00 -0.01 0.00 0.00 57.00 57.21 2k0q n GLN 13 Cb 0.53 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 30.15 2k0q n GLN 13 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2k0q n ASP 14 N -1.27 0.24 0.00 1.08 5.75 -1.26 -4.99 116.55 116.10 2k0q n ASP 14 Ca 0.04 0.11 0.00 0.00 -0.01 0.00 0.00 54.79 54.92 2k0q n ASP 14 Cb 0.06 0.96 0.00 0.00 -1.03 0.00 0.00 41.12 41.11 2k0q n ASP 14 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k0q n GLY 15 N 1.56 1.27 3.76 6.12 0.00 -0.26 -4.83 105.19 112.82 2k0q n GLY 15 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.48 4.87 -0.09 1.61 0.01 -1.26 -3.70 113.70 114.65 2k0q s SER 16 Ca 0.00 2.03 0.02 0.00 1.31 0.00 0.00 55.95 59.32 2k0q s SER 16 Cb 0.00 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.69 2k0q s SER 16 CO 0.00 -1.80 -0.16 -0.54 0.41 0.00 0.00 173.24 171.15 2k0q s LYS 17 N -4.17 2.27 -0.02 12.44 1.02 0.23 0.41 119.74 131.91 2k0q s LYS 17 Ca 0.67 -0.59 0.01 0.00 0.02 0.00 0.00 55.97 56.08 2k0q s LYS 17 Cb -0.21 -1.85 -0.03 0.00 -0.52 0.00 0.00 37.83 35.21 2k0q s LYS 17 CO 0.44 0.02 -0.01 0.08 -0.92 0.00 0.00 175.35 174.95 2k0q s VAL 18 N 0.75 4.09 -0.05 3.17 1.01 0.22 0.75 120.40 130.33 2k0q s VAL 18 Ca -0.12 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2k0q s VAL 18 Cb -0.16 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.45 2k0q s VAL 18 CO 0.02 0.44 -0.09 -1.00 0.00 0.00 0.00 175.10 174.47 2k0q s HIS 19 N -1.02 1.15 -0.33 5.22 0.09 0.14 0.13 115.29 120.68 2k0q s HIS 19 Ca 0.18 -0.39 -0.17 0.00 -0.00 0.00 0.00 55.06 54.68 2k0q s HIS 19 Cb -0.11 -0.89 -0.01 0.00 -0.00 0.00 0.00 32.58 31.56 2k0q s HIS 19 CO 0.08 -0.23 0.46 0.08 -0.00 0.00 0.00 174.74 175.12 2k0q s VAL 20 N 0.74 5.08 0.42 -0.90 1.01 0.88 -0.90 120.40 126.74 2k0q s VAL 20 Ca -0.13 0.37 -0.11 0.00 0.00 0.00 0.00 61.98 62.12 2k0q s VAL 20 Cb -0.15 -3.88 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 2k0q s VAL 20 CO 0.02 -0.10 0.79 -0.36 0.00 0.00 0.00 175.10 175.46 2k0q s PHE 21 N 2.25 3.48 0.63 5.22 0.40 0.25 -1.38 117.98 128.83 2k0q s PHE 21 Ca 0.17 1.07 0.34 0.00 -0.60 0.00 0.00 56.93 57.90 2k0q s PHE 21 Cb -0.16 -2.47 1.91 0.00 0.51 0.00 0.00 43.02 42.82 2k0q s PHE 21 CO 0.12 -0.16 2.17 1.57 0.70 0.00 0.00 175.22 179.62 2k0q h LYS 22 N 1.11 0.00 -0.15 0.44 2.10 -0.47 0.20 116.57 119.79 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 -3.42 2.35 0.00 7.07 8.00 -1.26 -4.91 116.55 124.38 2k0q n ASP 23 Ca -0.01 -1.79 0.00 0.00 0.71 0.00 0.00 54.79 53.70 2k0q n ASP 23 Cb 0.23 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 2k0q n ASP 23 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k0q n GLY 24 N 1.28 0.57 3.95 0.44 0.00 0.69 -5.07 105.19 107.04 2k0q n GLY 24 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.98 0.49 0.01 1.61 3.01 -1.25 -4.69 119.74 117.94 2k0q s LYS 25 Ca 0.00 -0.63 0.00 0.00 -1.01 0.00 0.00 55.97 54.33 2k0q s LYS 25 Cb 0.00 -1.89 -0.01 0.00 -1.01 0.00 0.00 37.83 34.92 2k0q s LYS 25 CO 0.00 -2.47 -0.02 -1.64 0.51 0.00 0.00 175.35 171.73 2k0q s MET 26 N -5.86 0.16 0.02 1.68 -1.94 -1.26 0.88 119.30 112.98 2k0q s MET 26 Ca 0.76 -0.25 0.02 0.00 -1.71 0.00 0.00 55.69 54.51 2k0q s MET 26 Cb -0.02 -0.02 -0.02 0.00 2.01 0.00 0.00 34.83 36.78 2k0q s MET 26 CO 0.53 -0.00 -0.06 0.20 -0.01 0.00 0.00 175.02 175.68 2k0q s GLY 27 N -0.55 0.36 0.05 -0.03 0.00 -0.08 -4.90 107.32 102.18 2k0q s GLY 27 Ca -0.05 -0.53 0.08 0.00 0.00 0.00 0.00 44.72 44.22 2k0q s GLY 27 CO -0.00 -0.55 -0.23 -0.29 0.00 0.00 0.00 173.10 172.03 2k0q s MET 28 N -1.01 1.56 0.08 2.90 1.75 -1.05 0.28 119.30 123.81 2k0q s MET 28 Ca -0.06 -1.02 0.07 0.00 -1.25 0.00 0.00 55.69 53.43 2k0q s MET 28 Cb -0.07 -1.71 -0.03 0.00 2.84 0.00 0.00 34.83 35.86 2k0q s MET 28 CO 0.00 0.44 -0.19 -1.21 -0.65 0.00 0.00 175.02 173.41 2k0q s GLU 29 N -1.22 1.07 0.69 4.11 2.02 0.23 0.85 118.70 126.46 2k0q s GLU 29 Ca 0.09 -1.05 -0.06 0.00 0.02 0.00 0.00 54.97 53.98 2k0q s GLU 29 Cb -0.09 -1.24 0.06 0.00 0.10 0.00 0.00 34.13 32.96 2k0q s GLU 29 CO 0.02 0.29 0.99 0.54 0.02 0.00 0.00 175.26 177.13 2k0q s ASN 30 N -1.70 4.81 0.00 -0.19 2.20 0.82 0.75 114.94 121.63 2k0q s ASN 30 Ca 0.04 0.37 0.00 0.00 -0.94 0.00 0.00 52.86 52.33 2k0q s ASN 30 Cb -0.10 -1.02 0.00 0.00 -2.00 0.00 0.00 41.25 38.13 2k0q s ASN 30 CO 0.03 -1.58 0.37 2.29 -2.94 0.00 0.00 177.10 175.27 2k0q n LYS 31 N -2.87 0.00 0.00 3.55 2.85 -1.24 -0.03 118.16 120.41 2k0q n LYS 31 Ca 0.08 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.42 2k0q n LYS 31 Cb 0.60 -1.41 0.04 0.00 -0.65 0.00 0.00 35.03 33.61 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 -0.87 0.00 -0.89 5.58 3.72 -1.26 -4.90 117.46 118.84 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 0.93 0.60 3.54 1.37 0.00 0.96 -5.04 105.19 107.55 2k0q n GLY 33 Ca 0.08 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 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 -1.85 2.90 0.26 1.61 -0.14 -1.25 -4.84 119.74 116.43 2k0q s LYS 34 Ca 0.00 -0.57 -0.30 0.00 -1.36 0.00 0.00 55.97 53.74 2k0q s LYS 34 Cb 0.00 -2.61 -0.09 0.00 -1.68 0.00 0.00 37.83 33.45 2k0q s LYS 34 CO 0.00 0.57 1.10 -1.12 -0.76 0.00 0.00 175.35 175.13 2k0q s SER 35 N -0.55 7.27 0.36 2.83 0.01 -1.26 -0.13 113.70 122.23 2k0q s SER 35 Ca 0.08 2.23 -0.05 0.00 1.31 0.00 0.00 55.95 59.52 2k0q s SER 35 Cb -0.12 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.50 2k0q s SER 35 CO 0.02 -0.15 0.54 0.00 0.41 0.00 0.00 173.24 174.06 2k0q s MET 36 N -1.21 2.00 0.23 12.44 0.23 0.25 -4.91 119.30 128.33 2k0q s MET 36 Ca 0.45 -1.71 0.06 0.00 -1.03 0.00 0.00 55.69 53.47 2k0q s MET 36 Cb -0.31 0.48 -0.04 0.00 -1.53 0.00 0.00 34.83 33.43 2k0q s MET 36 CO 0.40 -0.85 0.21 0.54 -2.03 0.00 0.00 175.02 173.28 2k0q s ASN 37 N -3.21 5.66 -0.19 -1.18 2.20 -1.26 -2.52 114.94 114.43 2k0q s ASN 37 Ca 0.28 -0.17 -0.09 0.00 -0.94 0.00 0.00 52.86 51.93 2k0q s ASN 37 Cb -0.01 -1.49 -0.05 0.00 -2.00 0.00 0.00 41.25 37.70 2k0q s ASN 37 CO 0.19 -0.02 0.10 -0.32 -2.94 0.00 0.00 177.10 174.11 2k0q s MET 38 N -3.71 4.09 0.13 3.55 -2.45 -1.26 -4.89 119.30 114.75 2k0q s MET 38 Ca 0.33 -0.27 -0.30 0.00 -1.25 0.00 0.00 55.69 54.20 2k0q s MET 38 Cb -0.08 -3.33 -0.07 0.00 1.25 0.00 0.00 34.83 32.59 2k0q s MET 38 CO 0.25 0.30 1.18 -1.25 1.05 0.00 0.00 175.02 176.55 2k0q s PRO 39 N 0.33 4.49 0.25 4.11 0.04 -1.26 -4.96 135.00 138.00 2k0q s PRO 39 Ca 0.06 1.79 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2k0q s PRO 39 Cb -0.12 -3.30 -0.09 0.00 0.04 0.00 0.00 34.50 31.04 2k0q s PRO 39 CO -0.01 -0.13 1.13 -2.00 0.04 0.00 0.00 177.00 176.02 2k0q s GLU 40 N 0.34 4.59 0.00 4.56 2.12 -1.26 -3.38 118.70 125.68 2k0q s GLU 40 Ca 0.55 1.82 0.00 0.00 0.36 0.00 0.00 54.97 57.70 2k0q s GLU 40 Cb -0.30 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 30.88 2k0q s GLU 40 CO 0.33 0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.58 2k0q n GLY 41 N 1.49 1.88 3.62 -1.50 0.00 -1.06 -4.99 105.19 104.63 2k0q n GLY 41 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.88 3.96 -0.13 1.61 -0.14 -1.22 -5.02 119.74 117.93 2k0q s LYS 42 Ca 0.00 -0.34 -0.14 0.00 -1.36 0.00 0.00 55.97 54.13 2k0q s LYS 42 Cb 0.00 -3.33 -0.05 0.00 -1.68 0.00 0.00 37.83 32.77 2k0q s LYS 42 CO 0.00 0.14 0.32 0.54 -0.76 0.00 0.00 175.35 175.59 2k0q s VAL 43 N 0.76 5.27 0.11 3.17 0.11 -1.26 -4.34 120.40 124.21 2k0q s VAL 43 Ca 0.05 0.61 0.10 0.00 -2.93 0.00 0.00 61.98 59.81 2k0q s VAL 43 Cb -0.13 -3.64 -0.04 0.00 -1.53 0.00 0.00 36.38 31.04 2k0q s VAL 43 CO 0.02 0.43 -0.26 -0.04 -3.33 0.00 0.00 175.10 171.92 2k0q s MET 44 N 0.15 1.55 0.02 1.54 -1.94 0.11 -4.89 119.30 115.84 2k0q s MET 44 Ca 0.18 -1.27 -0.00 0.00 -1.71 0.00 0.00 55.69 52.90 2k0q s MET 44 Cb -0.14 -1.95 -0.04 0.00 2.01 0.00 0.00 34.83 34.71 2k0q s MET 44 CO 0.06 0.47 0.12 -2.00 -0.01 0.00 0.00 175.02 173.66 2k0q s GLU 45 N -1.86 3.16 0.30 2.03 2.12 -1.26 -0.53 118.70 122.66 2k0q s GLU 45 Ca 0.14 -0.49 0.08 0.00 0.36 0.00 0.00 54.97 55.06 2k0q s GLU 45 Cb -0.10 -2.91 -0.04 0.00 0.26 0.00 0.00 34.13 31.34 2k0q s GLU 45 CO 0.05 0.63 0.13 0.95 -0.54 0.00 0.00 175.26 176.49 2k0q s THR 46 N -1.32 3.57 0.58 -1.70 -4.23 0.42 -3.83 115.64 109.13 2k0q s THR 46 Ca 0.27 -1.64 0.27 0.00 -1.18 0.00 0.00 61.69 59.41 2k0q s THR 46 Cb -0.12 -3.07 0.35 0.00 1.34 0.00 0.00 72.50 70.99 2k0q s THR 46 CO 0.19 -0.28 2.19 0.03 -0.54 0.00 0.00 174.62 176.21 2k0q h ARG 47 N 1.59 0.00 0.00 3.99 3.08 -0.31 -1.60 114.38 121.13 2k0q h ARG 47 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 2k0q h ARG 47 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2k0q h ARG 47 CO 0.61 0.00 -0.57 -0.40 -1.07 0.00 0.00 179.97 178.54 2k0q n ASP 48 N -3.95 0.72 0.00 7.04 5.75 -1.26 -4.93 116.55 119.91 2k0q n ASP 48 Ca -0.01 0.16 0.00 0.00 -0.01 0.00 0.00 54.79 54.93 2k0q n ASP 48 Cb 0.17 0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 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 1.70 3.74 6.12 0.00 -0.60 -5.12 105.19 112.37 2k0q n GLY 49 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 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 3.06 0.03 2.61 2.01 -1.26 -4.90 115.64 115.19 2k0q s THR 50 Ca 0.00 -1.66 0.08 0.00 0.31 0.00 0.00 61.69 60.42 2k0q s THR 50 Cb 0.00 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 2k0q s THR 50 CO 0.00 -0.18 -0.23 -0.54 -0.69 0.00 0.00 174.62 172.98 2k0q s LYS 51 N -3.86 1.63 0.04 4.92 1.02 -1.26 -0.44 119.74 121.79 2k0q s LYS 51 Ca 0.38 -0.99 0.02 0.00 0.02 0.00 0.00 55.97 55.40 2k0q s LYS 51 Cb -0.03 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.52 2k0q s LYS 51 CO 0.23 0.45 -0.07 0.96 -0.92 0.00 0.00 175.35 176.00 2k0q s ILE 52 N -0.76 0.51 -0.16 2.17 -4.36 0.31 -1.60 121.20 117.32 2k0q s ILE 52 Ca 0.09 -1.11 -0.25 0.00 -0.26 0.00 0.00 60.65 59.12 2k0q s ILE 52 Cb -0.09 -0.63 0.06 0.00 1.25 0.00 0.00 42.46 43.05 2k0q s ILE 52 CO 0.01 -0.42 0.64 -0.51 0.24 0.00 0.00 174.94 174.90 2k0q s ILE 53 N -1.50 0.00 -0.13 8.37 -1.16 -0.61 0.07 121.20 126.24 2k0q s ILE 53 Ca -0.09 -0.04 -0.08 0.00 -0.51 0.00 0.00 60.65 59.93 2k0q s ILE 53 Cb -0.09 -0.92 -0.04 0.00 0.61 0.00 0.00 42.46 42.02 2k0q s ILE 53 CO 0.00 -0.02 0.14 -0.32 -2.81 0.00 0.00 174.94 171.93 2k0q s MET 54 N -0.32 3.58 -0.26 3.50 -2.45 -1.26 0.13 119.30 122.21 2k0q s MET 54 Ca -0.05 -0.15 -0.03 0.00 -1.25 0.00 0.00 55.69 54.22 2k0q s MET 54 Cb -0.03 -3.23 0.11 0.00 1.25 0.00 0.00 34.83 32.93 2k0q s MET 54 CO 0.04 0.69 0.22 0.21 1.05 0.00 0.00 175.02 177.24 2k0q s LYS 55 N -0.78 0.24 3.11 4.11 2.47 -0.72 -2.55 119.74 125.61 2k0q s LYS 55 Ca 0.14 -0.14 0.00 0.00 -1.56 0.00 0.00 55.97 54.41 2k0q s LYS 55 Cb -0.12 -1.00 0.00 0.00 -1.46 0.00 0.00 37.83 35.25 2k0q s LYS 55 CO 0.03 -0.90 0.00 0.41 0.16 0.00 0.00 175.35 175.05 2k0q n GLY 56 N 5.30 -0.12 0.24 5.54 0.00 -1.26 -3.25 105.19 111.64 2k0q n GLY 56 Ca -0.04 -1.00 0.04 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.42 0.70 -4.97 1.61 4.05 -1.26 -4.84 115.26 110.13 2k0q n ASN 57 Ca 0.00 -1.88 -0.23 0.00 0.45 0.00 0.00 54.58 52.93 2k0q n ASN 57 Cb 0.00 -0.08 0.02 0.00 1.23 0.00 0.00 39.78 40.96 2k0q n ASN 57 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2k0q s GLU 58 N -1.85 2.31 -0.04 1.20 8.01 -1.20 -4.48 118.70 122.65 2k0q s GLU 58 Ca 0.14 -1.79 -0.05 0.00 0.01 0.00 0.00 54.97 53.28 2k0q s GLU 58 Cb 0.07 -2.39 0.01 0.00 -4.31 0.00 0.00 34.13 27.51 2k0q s GLU 58 CO 0.11 -0.70 0.13 -1.50 0.01 0.00 0.00 175.26 173.30 2k0q s ILE 59 N -2.70 0.01 -0.36 -1.63 2.07 -1.26 -1.76 121.20 115.57 2k0q s ILE 59 Ca 0.48 -0.09 -0.27 0.00 -1.41 0.00 0.00 60.65 59.36 2k0q s ILE 59 Cb -0.04 -0.21 0.02 0.00 0.13 0.00 0.00 42.46 42.35 2k0q s ILE 59 CO 0.30 -0.05 0.99 0.12 -1.91 0.00 0.00 174.94 174.39 2k0q s PHE 60 N -0.11 3.08 -0.37 3.50 2.19 0.34 -4.94 117.98 121.67 2k0q s PHE 60 Ca -0.02 0.90 -0.02 0.00 0.33 0.00 0.00 56.93 58.13 2k0q s PHE 60 Cb -0.02 -3.72 0.09 0.00 -1.31 0.00 0.00 43.02 38.07 2k0q s PHE 60 CO 0.00 -0.84 0.13 0.50 1.83 0.00 0.00 175.22 176.84 2k0q s ARG 61 N 3.60 2.05 0.00 10.12 3.00 -1.26 -1.58 118.95 134.88 2k0q s ARG 61 Ca 0.41 -1.68 0.00 0.00 -1.00 0.00 0.00 55.73 53.47 2k0q s ARG 61 Cb -0.12 -3.42 0.00 0.00 0.00 0.00 0.00 34.95 31.41 2k0q s ARG 61 CO 0.19 -0.93 0.00 -0.11 0.00 0.00 0.00 175.30 174.45 2k0q n LEU 62 N 4.55 0.00 -2.27 -0.88 -0.00 -0.63 -3.56 117.00 114.21 2k0q n LEU 62 Ca -0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 55.90 2k0q n LEU 62 Cb 0.42 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.87 2k0q n LEU 62 CO 0.30 0.00 0.02 -0.67 -0.00 0.00 0.00 177.39 177.03 2k0q n ASP 63 N 0.01 -4.07 0.00 1.96 2.03 -1.26 -4.80 116.55 110.42 2k0q n ASP 63 Ca 0.00 -0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.01 2k0q n ASP 63 Cb 0.00 -2.59 0.00 0.00 -0.72 0.00 0.00 41.12 37.81 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 -2.23 0.00 0.04 -0.67 2.13 -1.23 -4.94 120.64 113.74 2k0q n GLU 64 Ca -0.03 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.64 2k0q n GLU 64 Cb 0.55 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.17 2k0q n GLU 64 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k0q h ALA 65 N 0.00 -0.87 0.00 4.31 0.00 -1.87 0.86 119.26 121.69 2k0q h ALA 65 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2k0q h ALA 65 Cb 0.00 0.92 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k0q h ALA 65 CO 0.00 -1.07 -0.55 1.47 0.00 0.00 0.00 179.25 179.10 2k0q n LEU 66 N -5.46 0.54 0.01 0.00 -0.00 -1.26 -4.40 117.00 106.45 2k0q n LEU 66 Ca -0.07 0.07 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 2k0q n LEU 66 Cb 0.39 -0.23 -0.01 0.00 -0.00 0.00 0.00 43.42 43.56 2k0q n LEU 66 CO 0.12 0.07 0.07 -0.09 -0.00 0.00 0.00 177.39 177.56 2k0q h ARG 67 N 0.00 -0.14 -2.94 1.47 2.43 -1.65 -3.40 114.38 110.16 2k0q h ARG 67 Ca 0.00 0.01 -0.73 0.00 -0.81 0.00 0.00 59.98 58.45 2k0q h ARG 67 Cb 0.57 0.03 -0.34 0.00 -0.42 0.00 0.00 29.97 29.82 2k0q h ARG 67 CO 0.00 -0.08 0.16 1.63 -1.51 0.00 0.00 179.97 180.18 2k0q n LYS 68 N -4.87 3.37 0.00 0.20 5.02 0.22 -4.58 118.16 117.52 2k0q n LYS 68 Ca -0.02 -4.55 0.00 0.00 -2.02 0.00 0.00 58.31 51.72 2k0q n LYS 68 Cb 0.07 -2.43 0.00 0.00 -0.02 0.00 0.00 35.03 32.65 2k0q n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k0q n GLY 69 N 1.65 -0.33 0.11 0.72 0.00 -1.26 -4.92 105.19 101.15 2k0q n GLY 69 Ca 0.25 0.12 -0.16 0.00 0.00 0.00 0.00 46.02 46.24 2k0q n GLY 69 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2k0q h HIS 70 N 0.00 0.36 -3.44 1.61 3.86 -1.81 -3.43 115.15 112.30 2k0q h HIS 70 Ca 0.00 -0.26 -0.72 0.00 -1.16 0.00 0.00 60.37 58.23 2k0q h HIS 70 Cb 0.00 -0.01 -0.27 0.00 1.06 0.00 0.00 27.41 28.19 2k0q h HIS 70 CO 0.00 1.37 -0.45 -1.12 0.86 0.00 0.00 177.93 178.59 2k0q s SER 71 N -6.81 5.71 0.48 2.45 0.01 -1.26 -5.07 113.70 109.22 2k0q s SER 71 Ca -0.10 -1.44 0.03 0.00 1.31 0.00 0.00 55.95 55.75 2k0q s SER 71 Cb 0.07 -2.02 -0.03 0.00 0.21 0.00 0.00 66.02 64.25 2k0q s SER 71 CO 0.83 -0.54 0.03 -1.83 0.41 0.00 0.00 173.24 172.14 2k0q s GLU 72 N 1.46 2.13 -0.69 12.44 -1.05 -1.26 -4.75 118.70 126.98 2k0q s GLU 72 Ca 0.03 -2.29 0.00 0.00 -0.15 0.00 0.00 54.97 52.56 2k0q s GLU 72 Cb -0.23 -1.60 0.00 0.00 -0.44 0.00 0.00 34.13 31.86 2k0q s GLU 72 CO 0.03 -0.27 0.00 0.41 0.95 0.00 0.00 175.26 176.38 2k0q n GLY 73 N -1.20 0.66 0.00 -3.83 0.00 -1.26 -5.26 105.19 94.30 2k0q n GLY 73 Ca -0.14 -0.69 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