#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 7.40 0.00 6.55 -1.08 -1.26 -4.95 116.67 123.32 2k0q s ASP 2 Ca 0.00 1.87 0.21 0.00 -0.52 0.00 0.00 52.55 54.11 2k0q s ASP 2 Cb 0.00 -2.59 0.53 0.00 -1.46 0.00 0.00 42.92 39.40 2k0q s ASP 2 CO 0.00 -0.15 1.45 0.23 0.52 0.00 0.00 175.17 177.22 2k0q n MET 3 N 2.87 2.64 -0.02 4.34 2.81 -1.26 -4.26 117.12 124.23 2k0q n MET 3 Ca 0.03 -2.46 -0.03 0.00 -1.81 0.00 0.00 57.70 53.44 2k0q n MET 3 Cb 0.48 -1.51 -0.13 0.00 -0.71 0.00 0.00 33.22 31.36 2k0q n MET 3 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2k0q n SER 4 N 1.44 0.49 -1.42 7.83 3.41 -1.26 -4.14 113.62 119.97 2k0q n SER 4 Ca 0.21 0.22 0.10 0.00 -0.26 0.00 0.00 58.87 59.14 2k0q n SER 4 Cb 0.59 0.61 0.33 0.00 -0.26 0.00 0.00 64.21 65.48 2k0q n SER 4 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2k0q n ASN 5 N -2.79 4.41 -4.43 4.04 2.04 -1.26 -4.92 115.26 112.35 2k0q n ASN 5 Ca -0.17 -2.35 -0.33 0.00 -0.44 0.00 0.00 54.58 51.28 2k0q n ASN 5 Cb 0.94 -0.53 -0.13 0.00 -2.53 0.00 0.00 39.78 37.52 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 -1.66 3.45 -0.11 3.53 0.11 -1.26 0.78 120.40 125.24 2k0q s VAL 6 Ca 0.48 -0.52 0.21 0.00 -2.93 0.00 0.00 61.98 59.22 2k0q s VAL 6 Cb 0.30 -2.48 -0.22 0.00 -1.53 0.00 0.00 36.38 32.45 2k0q s VAL 6 CO 0.25 0.51 0.61 1.33 -3.33 0.00 0.00 175.10 174.47 2k0q n VAL 7 N 3.52 0.51 -3.63 2.04 0.24 -0.65 -4.76 118.33 115.59 2k0q n VAL 7 Ca -0.18 -0.59 -0.13 0.00 -2.04 0.00 0.00 64.34 61.41 2k0q n VAL 7 Cb 0.53 -0.25 -0.07 0.00 -1.47 0.00 0.00 33.84 32.58 2k0q n VAL 7 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2k0q s LYS 8 N -3.26 0.81 0.00 7.34 2.47 -1.02 -5.02 119.74 121.06 2k0q s LYS 8 Ca -0.06 1.02 0.07 0.00 -1.56 0.00 0.00 55.97 55.44 2k0q s LYS 8 Cb 0.11 0.36 -0.02 0.00 -1.46 0.00 0.00 37.83 36.83 2k0q s LYS 8 CO 0.86 -0.11 -0.22 0.99 0.16 0.00 0.00 175.35 177.03 2k0q s THR 9 N 0.56 1.73 -0.06 3.43 2.01 -1.26 -0.05 115.64 121.99 2k0q s THR 9 Ca -0.01 -1.01 0.05 0.00 0.31 0.00 0.00 61.69 61.03 2k0q s THR 9 Cb -0.05 -1.45 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 2k0q s THR 9 CO -0.02 0.42 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.78 2k0q s TYR 10 N -0.59 2.27 -0.22 4.92 2.02 0.31 -4.96 117.35 121.10 2k0q s TYR 10 Ca 0.08 -0.71 -0.09 0.00 -0.37 0.00 0.00 57.07 55.98 2k0q s TYR 10 Cb -0.09 -1.50 -0.05 0.00 -0.40 0.00 0.00 41.96 39.93 2k0q s TYR 10 CO -0.00 -0.23 0.12 0.34 -1.57 0.00 0.00 175.55 174.21 2k0q s ASP 11 N -0.04 5.94 0.00 2.29 -1.08 -1.26 0.21 116.67 122.73 2k0q s ASP 11 Ca -0.06 0.10 0.29 0.00 -0.52 0.00 0.00 52.55 52.36 2k0q s ASP 11 Cb -0.14 -2.05 1.63 0.00 -1.46 0.00 0.00 42.92 40.90 2k0q s ASP 11 CO 0.04 0.10 2.05 0.18 0.52 0.00 0.00 175.17 178.06 2k0q n LEU 12 N 4.03 0.00 0.00 -1.34 4.32 0.49 -0.29 117.00 124.20 2k0q n LEU 12 Ca -0.16 0.11 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 2k0q n LEU 12 Cb 0.52 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 2k0q n LEU 12 CO 0.35 -0.01 0.00 1.67 -1.22 0.00 0.00 177.39 178.18 2k0q n GLN 13 N -1.11 0.00 0.00 3.23 7.27 -1.26 -4.48 117.38 121.03 2k0q n GLN 13 Ca 0.19 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.36 2k0q n GLN 13 Cb 0.15 0.00 0.01 0.00 2.41 0.00 0.00 30.24 32.81 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 0.78 0.91 0.00 1.69 8.00 -1.26 -4.95 116.55 121.72 2k0q n ASP 14 Ca 0.00 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.70 2k0q n ASP 14 Cb 0.00 0.72 0.00 0.00 -0.02 0.00 0.00 41.12 41.82 2k0q n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k0q n GLY 15 N 1.49 3.62 3.79 0.44 0.00 -1.26 -4.85 105.19 108.42 2k0q n GLY 15 Ca 0.05 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.03 4.80 0.02 1.61 0.01 -1.26 -3.82 113.70 115.03 2k0q s SER 16 Ca 0.00 1.75 0.03 0.00 1.31 0.00 0.00 55.95 59.04 2k0q s SER 16 Cb 0.00 -2.51 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 2k0q s SER 16 CO 0.00 -1.83 -0.09 -0.54 0.41 0.00 0.00 173.24 171.18 2k0q s LYS 17 N -4.95 0.69 0.01 12.44 1.02 0.21 -0.38 119.74 128.78 2k0q s LYS 17 Ca 0.60 -0.50 0.08 0.00 0.02 0.00 0.00 55.97 56.16 2k0q s LYS 17 Cb -0.16 -0.63 -0.03 0.00 -0.52 0.00 0.00 37.83 36.49 2k0q s LYS 17 CO 0.56 0.16 -0.23 0.08 -0.92 0.00 0.00 175.35 175.00 2k0q s VAL 18 N -0.60 2.41 -0.05 3.17 1.01 0.13 0.97 120.40 127.44 2k0q s VAL 18 Ca 0.00 -1.16 0.03 0.00 0.00 0.00 0.00 61.98 60.84 2k0q s VAL 18 Cb -0.06 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.40 2k0q s VAL 18 CO 0.00 0.45 -0.13 -1.00 0.00 0.00 0.00 175.10 174.43 2k0q s HIS 19 N -0.77 1.40 -0.40 5.22 0.09 0.78 0.11 115.29 121.72 2k0q s HIS 19 Ca 0.12 -0.44 -0.19 0.00 -0.00 0.00 0.00 55.06 54.55 2k0q s HIS 19 Cb -0.10 -0.99 0.01 0.00 -0.00 0.00 0.00 32.58 31.50 2k0q s HIS 19 CO 0.02 -0.20 0.54 0.08 -0.00 0.00 0.00 174.74 175.18 2k0q s VAL 20 N 0.36 4.96 0.48 -0.90 1.01 0.92 -1.58 120.40 125.65 2k0q s VAL 20 Ca -0.08 0.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 2k0q s VAL 20 Cb -0.13 -4.08 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 2k0q s VAL 20 CO 0.02 -0.42 0.87 -0.36 0.00 0.00 0.00 175.10 175.21 2k0q s PHE 21 N 2.48 3.50 0.63 5.22 0.08 0.17 -1.64 117.98 128.43 2k0q s PHE 21 Ca 0.18 1.16 0.43 0.00 0.12 0.00 0.00 56.93 58.82 2k0q s PHE 21 Cb -0.15 -2.56 2.33 0.00 -0.57 0.00 0.00 43.02 42.07 2k0q s PHE 21 CO 0.16 -0.29 2.35 1.57 -0.10 0.00 0.00 175.22 178.91 2k0q h LYS 22 N 0.79 0.00 -0.48 0.44 2.10 0.08 0.17 116.57 119.68 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 -3.15 3.17 0.00 7.07 8.00 -1.26 -4.92 116.55 125.46 2k0q n ASP 23 Ca -0.03 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.51 2k0q n ASP 23 Cb 0.09 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 40.87 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 1.45 1.18 3.96 0.44 0.00 0.60 -5.04 105.19 107.78 2k0q n GLY 24 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.56 1.52 0.04 1.61 3.01 -1.25 -4.76 119.74 119.34 2k0q s LYS 25 Ca 0.00 -0.66 0.02 0.00 -1.01 0.00 0.00 55.97 54.33 2k0q s LYS 25 Cb 0.00 -2.14 -0.02 0.00 -1.01 0.00 0.00 37.83 34.66 2k0q s LYS 25 CO 0.00 -1.67 -0.08 -1.64 0.51 0.00 0.00 175.35 172.48 2k0q s MET 26 N -5.39 0.52 0.00 1.68 -1.94 -1.26 0.45 119.30 113.36 2k0q s MET 26 Ca 0.67 -0.69 -0.05 0.00 -1.71 0.00 0.00 55.69 53.91 2k0q s MET 26 Cb -0.06 -0.32 -0.00 0.00 2.01 0.00 0.00 34.83 36.45 2k0q s MET 26 CO 0.47 0.06 0.10 0.20 -0.01 0.00 0.00 175.02 175.84 2k0q s GLY 27 N -1.39 0.08 0.04 -0.03 0.00 -0.62 -4.88 107.32 100.51 2k0q s GLY 27 Ca -0.08 -0.19 0.08 0.00 0.00 0.00 0.00 44.72 44.53 2k0q s GLY 27 CO 0.00 -0.30 -0.21 -0.29 0.00 0.00 0.00 173.10 172.30 2k0q s MET 28 N -1.24 1.99 0.07 2.90 1.75 -0.97 -0.16 119.30 123.64 2k0q s MET 28 Ca -0.13 -1.02 0.08 0.00 -1.25 0.00 0.00 55.69 53.37 2k0q s MET 28 Cb -0.07 -2.11 -0.03 0.00 2.84 0.00 0.00 34.83 35.45 2k0q s MET 28 CO 0.01 0.53 -0.23 -1.21 -0.65 0.00 0.00 175.02 173.47 2k0q s GLU 29 N -1.32 1.42 0.52 4.11 2.02 0.27 0.65 118.70 126.38 2k0q s GLU 29 Ca 0.13 -1.09 -0.03 0.00 0.02 0.00 0.00 54.97 54.01 2k0q s GLU 29 Cb -0.10 -1.64 0.00 0.00 0.10 0.00 0.00 34.13 32.49 2k0q s GLU 29 CO 0.04 0.41 0.79 0.54 0.02 0.00 0.00 175.26 177.06 2k0q s ASN 30 N -1.48 5.70 0.08 -0.19 6.03 -0.62 0.64 114.94 125.11 2k0q s ASN 30 Ca 0.09 0.50 0.03 0.00 -1.03 0.00 0.00 52.86 52.45 2k0q s ASN 30 Cb -0.09 -1.61 0.16 0.00 -3.03 0.00 0.00 41.25 36.68 2k0q s ASN 30 CO 0.03 -0.90 0.89 2.29 -2.03 0.00 0.00 177.10 177.39 2k0q n LYS 31 N -2.34 0.02 -0.29 3.55 2.85 -1.25 0.25 118.16 120.94 2k0q n LYS 31 Ca 0.03 0.35 0.10 0.00 -1.05 0.00 0.00 58.31 57.74 2k0q n LYS 31 Cb 0.58 -1.82 0.27 0.00 -0.65 0.00 0.00 35.03 33.41 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 -1.46 0.77 -1.73 5.58 3.72 -1.26 -4.86 117.46 118.22 2k0q n PHE 32 Ca -0.00 -0.38 -0.05 0.00 -0.05 0.00 0.00 57.45 56.97 2k0q n PHE 32 Cb 0.26 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.79 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 1.47 0.39 3.44 1.37 0.00 0.14 -5.03 105.19 106.98 2k0q n GLY 33 Ca 0.20 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 -3.53 1.84 0.16 1.61 0.00 -1.25 -4.73 119.74 113.84 2k0q s LYS 34 Ca 0.00 -1.12 -0.26 0.00 0.00 0.00 0.00 55.97 54.59 2k0q s LYS 34 Cb 0.00 -2.09 -0.08 0.00 0.00 0.00 0.00 37.83 35.66 2k0q s LYS 34 CO 0.00 0.50 0.80 -1.54 0.00 0.00 0.00 175.35 175.11 2k0q s SER 35 N -1.75 7.40 0.30 0.03 1.04 -1.26 -1.58 113.70 117.87 2k0q s SER 35 Ca 0.15 1.66 -0.06 0.00 0.48 0.00 0.00 55.95 58.18 2k0q s SER 35 Cb -0.10 -2.51 -0.00 0.00 0.10 0.00 0.00 66.02 63.51 2k0q s SER 35 CO 0.07 0.17 0.45 0.00 0.98 0.00 0.00 173.24 174.91 2k0q s MET 36 N -0.97 1.75 0.18 4.02 0.23 0.21 -4.95 119.30 119.77 2k0q s MET 36 Ca 0.37 -1.59 -0.04 0.00 -1.03 0.00 0.00 55.69 53.40 2k0q s MET 36 Cb -0.23 0.44 -0.05 0.00 -1.53 0.00 0.00 34.83 33.46 2k0q s MET 36 CO 0.27 -0.72 0.42 0.54 -2.03 0.00 0.00 175.02 173.49 2k0q s ASN 37 N -3.16 6.46 -0.13 -1.18 2.20 -1.26 -2.28 114.94 115.59 2k0q s ASN 37 Ca 0.28 0.58 -0.19 0.00 -0.94 0.00 0.00 52.86 52.59 2k0q s ASN 37 Cb 0.00 -2.08 -0.04 0.00 -2.00 0.00 0.00 41.25 37.13 2k0q s ASN 37 CO 0.16 -0.02 0.52 -0.32 -2.94 0.00 0.00 177.10 174.50 2k0q s MET 38 N -2.97 4.33 -0.18 3.55 -2.45 -1.26 -4.83 119.30 115.49 2k0q s MET 38 Ca 0.41 0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 55.07 2k0q s MET 38 Cb -0.12 -3.46 -0.04 0.00 1.25 0.00 0.00 34.83 32.46 2k0q s MET 38 CO 0.26 0.09 1.79 -1.25 1.05 0.00 0.00 175.02 176.96 2k0q s PRO 39 N 0.84 3.72 0.13 4.11 0.04 -1.26 -4.97 135.00 137.61 2k0q s PRO 39 Ca 0.27 1.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 2k0q s PRO 39 Cb -0.15 -4.12 -0.07 0.00 0.04 0.00 0.00 34.50 30.19 2k0q s PRO 39 CO 0.11 -1.41 1.16 -2.00 0.04 0.00 0.00 177.00 174.90 2k0q s GLU 40 N 4.98 4.51 0.00 4.56 2.12 -1.26 -3.81 118.70 129.79 2k0q s GLU 40 Ca 0.80 1.76 0.00 0.00 0.36 0.00 0.00 54.97 57.89 2k0q s GLU 40 Cb -0.29 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 30.80 2k0q s GLU 40 CO 0.32 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.36 2k0q n GLY 41 N 2.54 1.25 3.34 -1.50 0.00 -0.58 -5.01 105.19 105.22 2k0q n GLY 41 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.14 2.00 -0.15 1.61 1.02 -1.25 -5.03 119.74 117.80 2k0q s LYS 42 Ca 0.00 -1.00 -0.09 0.00 0.02 0.00 0.00 55.97 54.90 2k0q s LYS 42 Cb 0.00 -2.04 -0.04 0.00 -0.52 0.00 0.00 37.83 35.23 2k0q s LYS 42 CO 0.00 0.54 0.16 0.54 -0.92 0.00 0.00 175.35 175.67 2k0q s VAL 43 N -0.71 5.44 0.19 3.17 0.11 -1.26 -4.06 120.40 123.27 2k0q s VAL 43 Ca 0.11 0.25 0.07 0.00 -2.93 0.00 0.00 61.98 59.49 2k0q s VAL 43 Cb -0.10 -3.46 -0.05 0.00 -1.53 0.00 0.00 36.38 31.25 2k0q s VAL 43 CO 0.01 0.54 -0.14 -0.04 -3.33 0.00 0.00 175.10 172.13 2k0q s MET 44 N -0.42 1.26 0.31 1.54 -1.94 0.14 -4.91 119.30 115.29 2k0q s MET 44 Ca 0.13 -1.53 0.06 0.00 -1.71 0.00 0.00 55.69 52.64 2k0q s MET 44 Cb -0.12 -1.05 -0.02 0.00 2.01 0.00 0.00 34.83 35.66 2k0q s MET 44 CO 0.02 0.17 0.45 -1.21 -0.01 0.00 0.00 175.02 174.44 2k0q s GLU 45 N -3.53 3.21 0.31 2.03 2.02 -1.26 -0.60 118.70 120.89 2k0q s GLU 45 Ca 0.20 -0.91 0.11 0.00 0.02 0.00 0.00 54.97 54.39 2k0q s GLU 45 Cb -0.01 -2.83 -0.06 0.00 0.10 0.00 0.00 34.13 31.33 2k0q s GLU 45 CO 0.06 0.16 -0.13 0.95 0.02 0.00 0.00 175.26 176.31 2k0q s THR 46 N -2.13 2.39 0.57 3.63 -4.23 -0.40 -4.24 115.64 111.22 2k0q s THR 46 Ca 0.42 -2.28 0.27 0.00 -1.18 0.00 0.00 61.69 58.92 2k0q s THR 46 Cb -0.09 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.61 2k0q s THR 46 CO 0.31 -0.29 2.04 0.03 -0.54 0.00 0.00 174.62 176.16 2k0q h ARG 47 N 2.12 0.00 -0.02 3.99 3.08 -0.90 -2.07 114.38 120.58 2k0q h ARG 47 Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.64 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 0.65 0.00 -0.20 -0.40 -1.07 0.00 0.00 179.97 178.96 2k0q n ASP 48 N -4.03 1.97 0.00 7.04 5.75 -1.26 -4.94 116.55 121.07 2k0q n ASP 48 Ca 0.05 -1.51 0.00 0.00 -0.01 0.00 0.00 54.79 53.32 2k0q n ASP 48 Cb 0.45 0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 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 1.01 3.73 6.12 0.00 -0.78 -5.10 105.19 111.51 2k0q n GLY 49 Ca 0.13 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2k0q n GLY 49 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k0q s THR 50 N -2.00 2.68 0.03 2.61 -1.32 -1.26 -4.92 115.64 111.47 2k0q s THR 50 Ca 0.00 -1.70 0.08 0.00 -1.21 0.00 0.00 61.69 58.86 2k0q s THR 50 Cb 0.00 -2.97 -0.02 0.00 -1.51 0.00 0.00 72.50 68.00 2k0q s THR 50 CO 0.00 -0.10 -0.23 -0.54 -2.21 0.00 0.00 174.62 171.54 2k0q s LYS 51 N -3.87 1.61 0.04 7.08 1.02 -1.26 -1.28 119.74 123.08 2k0q s LYS 51 Ca 0.39 -0.98 -0.00 0.00 0.02 0.00 0.00 55.97 55.41 2k0q s LYS 51 Cb 0.00 -1.72 -0.03 0.00 -0.52 0.00 0.00 37.83 35.56 2k0q s LYS 51 CO 0.23 0.45 -0.03 0.96 -0.92 0.00 0.00 175.35 176.03 2k0q s ILE 52 N -0.75 0.21 -0.04 2.17 -4.36 0.23 -3.81 121.20 114.84 2k0q s ILE 52 Ca 0.09 -1.31 -0.23 0.00 -0.26 0.00 0.00 60.65 58.94 2k0q s ILE 52 Cb -0.09 -0.82 0.05 0.00 1.25 0.00 0.00 42.46 42.84 2k0q s ILE 52 CO 0.01 -0.70 0.50 -0.51 0.24 0.00 0.00 174.94 174.49 2k0q s ILE 53 N -2.48 0.03 -0.31 8.37 2.07 -0.89 0.27 121.20 128.25 2k0q s ILE 53 Ca -0.06 -0.22 -0.07 0.00 -1.41 0.00 0.00 60.65 58.89 2k0q s ILE 53 Cb -0.03 -0.81 0.02 0.00 0.13 0.00 0.00 42.46 41.77 2k0q s ILE 53 CO -0.04 -0.12 0.10 -0.32 -1.91 0.00 0.00 174.94 172.64 2k0q s MET 54 N -1.23 2.94 -0.06 3.50 -2.45 -1.26 0.80 119.30 121.54 2k0q s MET 54 Ca -0.12 -0.96 -0.05 0.00 -1.25 0.00 0.00 55.69 53.31 2k0q s MET 54 Cb -0.03 -3.42 0.02 0.00 1.25 0.00 0.00 34.83 32.65 2k0q s MET 54 CO 0.07 -0.52 0.16 0.21 1.05 0.00 0.00 175.02 175.99 2k0q s LYS 55 N 1.48 0.18 -1.12 4.11 2.47 0.77 -1.53 119.74 126.10 2k0q s LYS 55 Ca 0.01 0.24 -0.01 0.00 -1.56 0.00 0.00 55.97 54.66 2k0q s LYS 55 Cb -0.18 0.06 0.00 0.00 -1.46 0.00 0.00 37.83 36.25 2k0q s LYS 55 CO 0.03 -0.04 0.08 0.41 0.16 0.00 0.00 175.35 175.99 2k0q n GLY 56 N 3.13 -0.16 2.48 5.54 0.00 -1.26 -2.31 105.19 112.61 2k0q n GLY 56 Ca -0.14 -0.30 -0.19 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.64 -5.32 -4.24 1.61 5.03 -1.26 -4.97 115.26 105.47 2k0q n ASN 57 Ca -0.14 0.30 -0.14 0.00 0.87 0.00 0.00 54.58 55.47 2k0q n ASN 57 Cb 0.61 -4.44 -0.10 0.00 -1.02 0.00 0.00 39.78 34.83 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 -4.05 1.04 -0.23 3.52 2.02 -0.98 -5.05 118.70 114.97 2k0q s GLU 58 Ca 0.00 -1.44 -0.08 0.00 0.02 0.00 0.00 54.97 53.47 2k0q s GLU 58 Cb 0.00 -0.57 -0.04 0.00 0.10 0.00 0.00 34.13 33.62 2k0q s GLU 58 CO 0.00 0.06 0.10 0.42 0.02 0.00 0.00 175.26 175.86 2k0q s ILE 59 N -3.36 4.78 -0.48 -1.63 -1.09 -1.26 -0.16 121.20 117.99 2k0q s ILE 59 Ca 0.16 -0.02 -0.27 0.00 -2.23 0.00 0.00 60.65 58.29 2k0q s ILE 59 Cb 0.03 -3.21 0.03 0.00 -1.58 0.00 0.00 42.46 37.73 2k0q s ILE 59 CO -0.00 0.37 1.04 0.12 -1.23 0.00 0.00 174.94 175.24 2k0q s PHE 60 N 1.11 2.85 -0.29 3.97 2.19 0.24 -4.97 117.98 123.08 2k0q s PHE 60 Ca 0.05 0.53 0.03 0.00 0.33 0.00 0.00 56.93 57.87 2k0q s PHE 60 Cb -0.14 -4.23 0.08 0.00 -1.31 0.00 0.00 43.02 37.42 2k0q s PHE 60 CO 0.04 -1.21 -0.03 0.50 1.83 0.00 0.00 175.22 176.35 2k0q s ARG 61 N 4.15 1.77 0.00 10.12 3.00 -1.26 -2.09 118.95 134.63 2k0q s ARG 61 Ca 0.42 -1.49 0.00 0.00 -1.00 0.00 0.00 55.73 53.66 2k0q s ARG 61 Cb -0.09 -2.92 0.00 0.00 0.00 0.00 0.00 34.95 31.94 2k0q s ARG 61 CO 0.29 -0.74 0.00 1.28 0.00 0.00 0.00 175.30 176.13 2k0q n LEU 62 N 4.42 0.00 0.00 -0.88 7.99 -1.25 -4.02 117.00 123.26 2k0q n LEU 62 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.94 2k0q n LEU 62 Cb 0.42 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.73 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 0.07 -1.43 2.03 -1.26 -4.66 116.55 111.30 2k0q n ASP 63 Ca 0.00 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.10 2k0q n ASP 63 Cb 0.00 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.25 2k0q n ASP 63 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2k0q h GLU 64 N 0.36 0.36 -0.51 -0.67 4.22 -1.99 -2.85 114.58 113.49 2k0q h GLU 64 Ca 0.00 -0.62 -0.02 0.00 0.08 0.00 0.00 59.36 58.81 2k0q h GLU 64 Cb 0.00 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2k0q h GLU 64 CO 0.00 1.26 0.25 0.00 -2.18 0.00 0.00 179.01 178.34 2k0q h ALA 65 N 0.24 1.48 -0.01 2.92 0.00 -1.83 -0.97 119.26 121.08 2k0q h ALA 65 Ca -0.31 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2k0q h ALA 65 Cb 2.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2k0q h ALA 65 CO 0.18 0.42 -0.08 1.28 0.00 0.00 0.00 179.25 181.05 2k0q n LEU 66 N -4.38 1.34 0.01 0.00 4.77 -1.25 -4.35 117.00 113.13 2k0q n LEU 66 Ca 0.04 -0.42 -0.01 0.00 -0.03 0.00 0.00 56.01 55.59 2k0q n LEU 66 Cb 0.12 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2k0q n LEU 66 CO 0.37 0.23 0.06 -0.09 -1.33 0.00 0.00 177.39 176.64 2k0q h ARG 67 N 1.98 -0.05 -6.19 3.23 9.65 -0.92 -3.48 114.38 118.60 2k0q h ARG 67 Ca 0.00 0.00 -0.52 0.00 -1.10 0.00 0.00 59.98 58.36 2k0q h ARG 67 Cb 0.50 0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 29.02 2k0q h ARG 67 CO 0.00 -0.03 -0.57 -1.59 2.80 0.00 0.00 179.97 180.58 2k0q s LYS 68 N -1.51 2.66 0.00 0.20 -2.85 -1.22 -4.68 119.74 112.34 2k0q s LYS 68 Ca -0.01 -1.22 0.00 0.00 -1.00 0.00 0.00 55.97 53.74 2k0q s LYS 68 Cb 0.00 -2.39 0.00 0.00 -2.06 0.00 0.00 37.83 33.38 2k0q s LYS 68 CO 0.02 0.36 0.00 0.41 0.10 0.00 0.00 175.35 176.24 2k0q n GLY 69 N -1.08 1.96 3.59 0.59 0.00 -1.26 -4.90 105.19 104.08 2k0q n GLY 69 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 2k0q n GLY 69 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k0q s HIS 70 N -1.95 -1.00 0.08 1.61 -3.43 -1.26 -4.99 115.29 104.36 2k0q s HIS 70 Ca 0.00 2.01 -0.16 0.00 -0.80 0.00 0.00 55.06 56.11 2k0q s HIS 70 Cb 0.00 0.58 -0.13 0.00 -1.43 0.00 0.00 32.58 31.60 2k0q s HIS 70 CO 0.00 -0.50 1.34 0.77 -2.00 0.00 0.00 174.74 174.35 2k0q h SER 71 N 6.99 0.72 0.00 7.38 0.02 -1.97 -3.44 113.55 123.25 2k0q h SER 71 Ca -0.31 -0.55 0.00 0.00 -0.84 0.00 0.00 61.79 60.09 2k0q h SER 71 Cb 1.22 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2k0q h SER 71 CO 0.18 1.14 0.00 1.21 -1.14 0.00 0.00 176.83 178.22 2k0q n GLU 72 N -4.22 0.00 0.00 3.45 2.13 -1.26 -5.14 120.64 115.60 2k0q n GLU 72 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 2k0q n GLU 72 Cb 0.55 -0.14 0.00 0.00 0.27 0.00 0.00 31.44 32.12 2k0q n GLU 72 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k0q n GLY 73 N 2.12 1.83 0.00 8.31 0.00 -1.26 -5.20 105.19 110.99 2k0q n GLY 73 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2k0q n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93