#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zqb n LYS 5 N 0.00 1.35 -3.82 1.47 4.81 -1.26 -4.62 118.16 116.09 2zqb n LYS 5 Ca 0.00 0.49 -0.36 0.00 -0.87 0.00 0.00 58.31 57.57 2zqb n LYS 5 Cb 0.00 -2.18 -0.13 0.00 0.02 0.00 0.00 35.03 32.74 2zqb n LYS 5 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2zqb s LEU 6 N 1.88 3.65 0.03 3.14 2.96 -1.26 0.49 118.68 129.58 2zqb s LEU 6 Ca 0.89 -0.77 0.06 0.00 -0.22 0.00 0.00 54.13 54.09 2zqb s LEU 6 Cb -0.94 -1.81 -0.02 0.00 0.50 0.00 0.00 46.19 43.92 2zqb s LEU 6 CO 0.53 -0.17 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.59 2zqb s ILE 7 N 1.44 1.31 -0.16 6.68 1.01 0.19 -4.78 121.20 126.89 2zqb s ILE 7 Ca 0.02 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 2zqb s ILE 7 Cb -0.17 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 2zqb s ILE 7 CO 0.00 0.15 -0.10 -1.00 0.00 0.00 0.00 174.94 173.99 2zqb s HIS 8 N -0.72 2.87 -0.03 3.97 3.76 -0.71 -0.36 115.29 124.07 2zqb s HIS 8 Ca 0.04 -0.76 -0.01 0.00 -0.15 0.00 0.00 55.06 54.18 2zqb s HIS 8 Cb -0.08 -1.93 0.03 0.00 1.11 0.00 0.00 32.58 31.71 2zqb s HIS 8 CO 0.01 -0.33 0.04 0.42 -0.85 0.00 0.00 174.74 174.03 2zqb s ILE 9 N 0.72 -0.06 -0.04 0.60 1.01 -0.87 0.21 121.20 122.78 2zqb s ILE 9 Ca -0.05 0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.96 2zqb s ILE 9 Cb -0.15 -0.13 -0.01 0.00 0.01 0.00 0.00 42.46 42.18 2zqb s ILE 9 CO 0.02 0.13 -0.21 -0.36 0.00 0.00 0.00 174.94 174.52 2zqb s PHE 10 N 1.56 2.05 0.05 3.97 0.08 -0.44 -1.35 117.98 123.91 2zqb s PHE 10 Ca -0.03 -0.53 0.04 0.00 0.12 0.00 0.00 56.93 56.53 2zqb s PHE 10 Cb -0.13 -1.35 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 2zqb s PHE 10 CO -0.03 -0.14 -0.11 0.95 -0.10 0.00 0.00 175.22 175.79 2zqb s THR 11 N -0.21 0.85 0.07 0.64 -4.23 -1.11 -1.26 115.64 110.39 2zqb s THR 11 Ca 0.00 -1.13 -0.10 0.00 -1.18 0.00 0.00 61.69 59.29 2zqb s THR 11 Cb -0.11 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 72.89 2zqb s THR 11 CO 0.02 -0.24 0.22 -0.62 -0.54 0.00 0.00 174.62 173.45 2zqb s ASP 12 N -1.53 0.04 0.09 3.99 2.15 -0.69 -4.43 116.67 116.30 2zqb s ASP 12 Ca -0.05 -0.50 0.04 0.00 0.43 0.00 0.00 52.55 52.48 2zqb s ASP 12 Cb -0.09 0.34 -0.03 0.00 -0.30 0.00 0.00 42.92 42.83 2zqb s ASP 12 CO 0.01 -0.68 -0.11 -0.83 -0.17 0.00 0.00 175.17 173.40 2zqb s GLY 13 N -2.55 0.86 0.09 2.66 0.00 -1.25 -0.98 107.32 106.14 2zqb s GLY 13 Ca 0.01 -1.16 -0.07 0.00 0.00 0.00 0.00 44.72 43.50 2zqb s GLY 13 CO -0.08 -1.23 0.15 -0.45 0.00 0.00 0.00 173.10 171.49 2zqb s SER 14 N -2.34 0.20 0.00 1.64 0.15 -0.41 -4.69 113.70 108.25 2zqb s SER 14 Ca 0.04 -0.79 0.00 0.00 0.70 0.00 0.00 55.95 55.91 2zqb s SER 14 Cb -0.04 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 2zqb s SER 14 CO 0.01 -0.72 0.00 0.00 1.20 0.00 0.00 173.24 173.72 2zqb n LEU 16 N -0.52 -4.91 0.00 0.00 4.77 -1.26 -4.04 117.00 111.04 2zqb n LEU 16 Ca 0.00 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 2zqb n LEU 16 Cb 0.02 -2.75 0.00 0.00 -2.33 0.00 0.00 43.42 38.36 2zqb n LEU 16 CO 0.00 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 2zqb n GLY 17 N -1.26 -1.85 3.11 -0.72 0.00 -1.26 -4.49 105.19 98.72 2zqb n GLY 17 Ca -0.07 -1.44 0.02 0.00 0.00 0.00 0.00 46.02 44.53 2zqb n GLY 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2zqb s ASN 18 N -2.78 -1.30 0.92 1.61 3.84 -1.26 -3.63 114.94 112.34 2zqb s ASN 18 Ca 0.00 0.10 -0.12 0.00 0.21 0.00 0.00 52.86 53.05 2zqb s ASN 18 Cb 0.00 1.89 0.14 0.00 -0.55 0.00 0.00 41.25 42.73 2zqb s ASN 18 CO 0.00 -0.31 1.10 -2.16 -2.79 0.00 0.00 177.10 172.94 2zqb s PRO 19 N 2.78 1.05 0.00 0.43 0.04 -1.26 -5.01 135.00 133.03 2zqb s PRO 19 Ca 0.10 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.75 2zqb s PRO 19 Cb -0.10 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2zqb s PRO 19 CO -0.27 -2.33 0.00 0.41 0.04 0.00 0.00 177.00 174.85 2zqb n GLY 20 N -1.39 -1.65 3.65 0.56 0.00 -0.90 -4.90 105.19 100.56 2zqb n GLY 20 Ca 0.06 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 2zqb n GLY 20 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2zqb n PRO 21 N -0.24 1.40 -3.93 1.61 -0.02 -1.15 -0.71 135.00 131.96 2zqb n PRO 21 Ca 0.00 0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 61.90 2zqb n PRO 21 Cb 0.00 -2.24 -0.08 0.00 -0.02 0.00 0.00 33.50 31.16 2zqb n PRO 21 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2zqb s GLY 22 N -0.87 0.26 0.23 -1.23 0.00 -0.65 -4.30 107.32 100.75 2zqb s GLY 22 Ca 0.68 -0.80 -0.17 0.00 0.00 0.00 0.00 44.72 44.43 2zqb s GLY 22 CO 0.53 -0.92 0.55 -0.32 0.00 0.00 0.00 173.10 172.93 2zqb s GLY 23 N -2.90 0.08 0.15 0.20 0.00 -0.82 -0.92 107.32 103.11 2zqb s GLY 23 Ca 0.08 -0.43 0.07 0.00 0.00 0.00 0.00 44.72 44.45 2zqb s GLY 23 CO -0.08 -0.33 -0.16 -2.52 0.00 0.00 0.00 173.10 170.00 2zqb s TYR 24 N -3.92 1.64 -0.00 1.90 1.13 -0.55 -1.29 117.35 116.26 2zqb s TYR 24 Ca 0.13 -0.51 0.01 0.00 -1.41 0.00 0.00 57.07 55.29 2zqb s TYR 24 Cb -0.02 -0.83 0.00 0.00 -1.10 0.00 0.00 41.96 40.01 2zqb s TYR 24 CO 0.02 0.25 -0.02 0.20 -2.51 0.00 0.00 175.55 173.50 2zqb s GLY 25 N -2.61 0.13 -0.04 5.49 0.00 -0.16 -2.99 107.32 107.15 2zqb s GLY 25 Ca 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 44.72 44.75 2zqb s GLY 25 CO 0.05 -0.02 0.09 -0.42 0.00 0.00 0.00 173.10 172.80 2zqb s ILE 26 N 0.04 -0.01 -0.07 0.90 1.01 -0.20 -1.71 121.20 121.16 2zqb s ILE 26 Ca -0.00 0.03 0.04 0.00 0.00 0.00 0.00 60.65 60.72 2zqb s ILE 26 Cb -0.02 -0.14 0.00 0.00 0.01 0.00 0.00 42.46 42.31 2zqb s ILE 26 CO -0.00 0.01 -0.18 -0.69 0.00 0.00 0.00 174.94 174.08 2zqb s VAL 27 N 0.24 1.56 -0.13 2.92 1.01 -0.39 -2.36 120.40 123.25 2zqb s VAL 27 Ca -0.02 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.24 2zqb s VAL 27 Cb -0.03 -1.36 0.01 0.00 0.00 0.00 0.00 36.38 35.00 2zqb s VAL 27 CO -0.01 0.45 -0.21 -0.04 0.00 0.00 0.00 175.10 175.29 2zqb s MET 28 N 0.31 2.85 -0.04 2.72 -1.94 0.15 -1.32 119.30 122.03 2zqb s MET 28 Ca -0.12 -0.80 0.07 0.00 -1.71 0.00 0.00 55.69 53.13 2zqb s MET 28 Cb -0.15 -2.29 -0.01 0.00 2.01 0.00 0.00 34.83 34.39 2zqb s MET 28 CO 0.05 0.01 -0.25 0.15 -0.01 0.00 0.00 175.02 174.97 2zqb s LYS 29 N 0.75 2.36 -0.28 2.03 1.02 0.56 -1.06 119.74 125.13 2zqb s LYS 29 Ca -0.09 -0.91 0.01 0.00 0.02 0.00 0.00 55.97 55.00 2zqb s LYS 29 Cb -0.16 -2.10 0.17 0.00 -0.52 0.00 0.00 37.83 35.22 2zqb s LYS 29 CO 0.00 0.45 0.47 -0.47 -0.92 0.00 0.00 175.35 174.88 2zqb s TYR 30 N -0.33 -1.24 0.00 3.18 5.04 -0.44 -1.74 117.35 121.82 2zqb s TYR 30 Ca 0.02 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.45 2zqb s TYR 30 Cb -0.12 0.09 0.00 0.00 0.35 0.00 0.00 41.96 42.28 2zqb s TYR 30 CO 0.02 -0.94 0.00 1.63 -1.34 0.00 0.00 175.55 174.92 2zqb n LYS 31 N 5.38 0.00 0.16 4.97 5.02 -1.26 -2.26 118.16 130.16 2zqb n LYS 31 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2zqb n LYS 31 Cb 0.51 0.00 0.30 0.00 -0.02 0.00 0.00 35.03 35.82 2zqb n LYS 31 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2zqb h GLY 32 N 0.00 0.00 -6.04 0.72 0.00 -2.02 -3.45 103.07 92.28 2zqb h GLY 32 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 2zqb h GLY 32 CO 0.00 0.00 0.97 0.30 0.00 0.00 0.00 176.54 177.81 2zqb s HIS 33 N -3.16 2.68 -0.24 5.60 3.76 -0.96 -5.04 115.29 117.94 2zqb s HIS 33 Ca 0.09 0.86 -0.08 0.00 -0.15 0.00 0.00 55.06 55.78 2zqb s HIS 33 Cb 0.09 -3.95 -0.03 0.00 1.11 0.00 0.00 32.58 29.79 2zqb s HIS 33 CO 0.63 -1.68 0.08 0.99 -0.85 0.00 0.00 174.74 173.91 2zqb s THR 34 N 4.44 4.49 0.19 1.30 2.01 -1.26 -1.32 115.64 125.50 2zqb s THR 34 Ca 0.56 -0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.54 2zqb s THR 34 Cb -0.16 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2zqb s THR 34 CO 0.24 0.35 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.85 2zqb s LYS 35 N 1.43 1.94 0.01 4.92 1.02 -0.23 -4.96 119.74 123.87 2zqb s LYS 35 Ca 0.06 -1.36 0.06 0.00 0.02 0.00 0.00 55.97 54.75 2zqb s LYS 35 Cb -0.15 -2.07 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 2zqb s LYS 35 CO 0.04 0.42 -0.19 -1.21 -0.92 0.00 0.00 175.35 173.49 2zqb s GLU 36 N -2.88 1.39 -0.04 1.68 2.02 -1.26 0.30 118.70 119.92 2zqb s GLU 36 Ca 0.25 -0.78 -0.06 0.00 0.02 0.00 0.00 54.97 54.40 2zqb s GLU 36 Cb -0.08 -1.41 0.01 0.00 0.10 0.00 0.00 34.13 32.74 2zqb s GLU 36 CO 0.14 0.37 0.16 -1.64 0.02 0.00 0.00 175.26 174.31 2zqb s MET 37 N -0.79 0.28 0.35 1.61 -1.94 -1.00 -5.00 119.30 112.81 2zqb s MET 37 Ca 0.07 0.05 -0.09 0.00 -1.71 0.00 0.00 55.69 54.00 2zqb s MET 37 Cb -0.08 0.12 0.02 0.00 2.01 0.00 0.00 34.83 36.91 2zqb s MET 37 CO 0.00 -0.05 0.61 -1.54 -0.01 0.00 0.00 175.02 174.04 2zqb s SER 38 N -0.34 0.41 -0.29 3.03 1.04 -1.26 -1.04 113.70 115.26 2zqb s SER 38 Ca -0.04 -1.26 -0.26 0.00 0.48 0.00 0.00 55.95 54.87 2zqb s SER 38 Cb -0.03 0.73 0.18 0.00 0.10 0.00 0.00 66.02 67.01 2zqb s SER 38 CO 0.01 -1.44 1.37 -0.83 0.98 0.00 0.00 173.24 173.33 2zqb s GLY 39 N -3.14 0.24 0.13 7.32 0.00 -1.16 -4.94 107.32 105.77 2zqb s GLY 39 Ca 0.23 3.27 0.08 0.00 0.00 0.00 0.00 44.72 48.30 2zqb s GLY 39 CO 0.15 1.75 -0.18 -0.32 0.00 0.00 0.00 173.10 174.50 2zqb s GLY 40 N -0.18 1.25 0.02 0.20 0.00 -1.26 -1.48 107.32 105.87 2zqb s GLY 40 Ca 0.07 -1.33 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 2zqb s GLY 40 CO -0.13 -1.37 -0.02 -1.36 0.00 0.00 0.00 173.10 170.22 2zqb s PHE 41 N -1.70 0.28 -0.24 1.90 0.08 -0.09 -4.50 117.98 113.71 2zqb s PHE 41 Ca 0.10 -0.58 0.19 0.00 0.12 0.00 0.00 56.93 56.76 2zqb s PHE 41 Cb -0.07 -0.21 0.09 0.00 -0.57 0.00 0.00 43.02 42.26 2zqb s PHE 41 CO 0.05 -0.22 1.30 0.66 -0.10 0.00 0.00 175.22 176.90 2zqb h SER 42 N 4.42 0.00 -2.13 1.36 4.64 -0.06 -1.73 113.55 120.04 2zqb h SER 42 Ca -0.32 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.93 2zqb h SER 42 Cb 1.20 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.02 2zqb h SER 42 CO 0.44 0.30 -0.36 -0.22 -0.87 0.00 0.00 176.83 176.12 2zqb s LEU 43 N -6.07 -0.78 0.00 5.97 2.96 -1.24 -2.94 118.68 116.58 2zqb s LEU 43 Ca 0.03 0.84 0.00 0.00 -0.22 0.00 0.00 54.13 54.78 2zqb s LEU 43 Cb 0.07 1.48 0.00 0.00 0.50 0.00 0.00 46.19 48.25 2zqb s LEU 43 CO 0.75 -0.25 0.00 1.07 -1.32 0.00 0.00 176.35 176.59 2zqb n THR 44 N 5.39 0.00 -4.47 3.68 5.66 0.12 -4.49 114.28 120.16 2zqb n THR 44 Ca -0.07 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.70 2zqb n THR 44 Cb 0.50 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.17 2zqb n THR 44 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2zqb s THR 45 N -2.84 2.14 0.13 1.09 -4.23 -1.26 -2.12 115.64 108.55 2zqb s THR 45 Ca 0.00 -2.25 -0.19 0.00 -1.18 0.00 0.00 61.69 58.07 2zqb s THR 45 Cb 0.00 -2.43 -0.02 0.00 1.34 0.00 0.00 72.50 71.39 2zqb s THR 45 CO 0.00 -0.33 1.72 -1.13 -0.54 0.00 0.00 174.62 174.34 2zqb h ASN 46 N 2.21 -0.05 -0.59 3.99 -1.24 -1.91 -2.11 115.58 115.88 2zqb h ASN 46 Ca -0.40 0.05 0.01 0.00 0.71 0.00 0.00 56.30 56.66 2zqb h ASN 46 Cb 1.25 0.08 -0.03 0.00 0.73 0.00 0.00 38.32 40.34 2zqb h ASN 46 CO 0.66 0.00 0.38 0.78 -1.29 0.00 0.00 177.43 177.96 2zqb h ASN 47 N 0.10 0.66 -0.88 1.15 -0.26 -1.96 -1.39 115.58 112.99 2zqb h ASN 47 Ca 0.11 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.84 2zqb h ASN 47 Cb 0.13 -0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.18 2zqb h ASN 47 CO -0.17 0.47 0.55 0.03 -1.06 0.00 0.00 177.43 177.26 2zqb h ARG 48 N 0.78 1.18 -0.33 0.81 3.08 -1.93 -2.21 114.38 115.76 2zqb h ARG 48 Ca 0.22 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.06 2zqb h ARG 48 Cb -0.07 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.71 2zqb h ARG 48 CO -0.05 0.81 -0.28 0.52 -1.07 0.00 0.00 179.97 179.90 2zqb h MET 49 N 1.21 0.69 0.00 0.04 2.86 -1.19 0.19 114.93 118.73 2zqb h MET 49 Ca 0.32 -0.29 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2zqb h MET 49 Cb -0.08 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 2zqb h MET 49 CO -0.06 0.89 -0.23 0.93 1.06 0.00 0.00 176.91 179.49 2zqb h GLU 50 N 0.59 0.00 0.10 1.72 5.08 -0.98 -3.01 114.58 118.08 2zqb h GLU 50 Ca 0.07 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.16 2zqb h GLU 50 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2zqb h GLU 50 CO 0.06 0.23 -1.43 1.25 -1.00 0.00 0.00 179.01 178.12 2zqb h LEU 51 N 0.00 0.32 -1.72 1.33 6.46 -1.24 -3.37 115.31 117.09 2zqb h LEU 51 Ca -0.00 -0.82 -0.02 0.00 -0.12 0.00 0.00 57.88 56.92 2zqb h LEU 51 Cb 0.45 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 2zqb h LEU 51 CO 0.03 1.62 0.00 0.25 -0.62 0.00 0.00 178.44 179.72 2zqb h LEU 52 N -0.37 0.16 0.09 2.25 5.85 -0.63 -3.03 115.31 119.62 2zqb h LEU 52 Ca -0.32 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 2zqb h LEU 52 Cb 1.71 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.70 2zqb h LEU 52 CO 0.02 0.19 -0.04 0.00 -0.34 0.00 0.00 178.44 178.27 2zqb h ALA 53 N 1.83 -0.12 -0.07 1.25 0.00 -1.68 -0.92 119.26 119.56 2zqb h ALA 53 Ca 0.04 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2zqb h ALA 53 Cb 0.12 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2zqb h ALA 53 CO 0.00 -0.53 -0.42 -1.00 0.00 0.00 0.00 179.25 177.31 2zqb h PRO 54 N -0.21 0.15 0.07 0.00 0.13 -1.74 -2.89 132.00 127.52 2zqb h PRO 54 Ca -0.01 -0.07 0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2zqb h PRO 54 Cb 0.17 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.25 2zqb h PRO 54 CO 0.02 0.54 -0.37 0.82 -0.23 0.00 0.00 178.00 178.79 2zqb h ILE 55 N 0.13 0.23 -0.44 -3.56 2.04 -1.35 -0.58 117.51 113.97 2zqb h ILE 55 Ca 0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 2zqb h ILE 55 Cb 0.79 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 2zqb h ILE 55 CO 0.06 0.00 0.05 0.58 0.00 0.00 0.00 178.15 178.84 2zqb h VAL 56 N -0.57 1.22 -0.34 1.67 2.07 -1.16 0.17 116.25 119.31 2zqb h VAL 56 Ca 0.04 -0.84 -0.07 0.00 0.82 0.00 0.00 66.70 66.64 2zqb h VAL 56 Cb 0.62 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2zqb h VAL 56 CO -0.25 0.30 -0.07 0.00 0.02 0.00 0.00 177.57 177.57 2zqb h ALA 57 N 1.39 0.46 -0.49 1.67 0.00 -1.29 -1.51 119.26 119.50 2zqb h ALA 57 Ca 0.14 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2zqb h ALA 57 Cb 0.34 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2zqb h ALA 57 CO 0.01 0.30 -0.10 -0.07 0.00 0.00 0.00 179.25 179.39 2zqb h LEU 58 N 0.43 0.93 -1.95 0.00 3.38 -0.68 -3.11 115.31 114.31 2zqb h LEU 58 Ca 0.09 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2zqb h LEU 58 Cb 0.57 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2zqb h LEU 58 CO 0.03 1.07 -0.09 -0.33 0.09 0.00 0.00 178.44 179.21 2zqb h GLU 59 N 0.78 0.00 0.00 1.13 5.08 -0.44 -2.19 114.58 118.94 2zqb h GLU 59 Ca 0.13 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2zqb h GLU 59 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2zqb h GLU 59 CO 0.04 0.09 -0.27 0.00 -1.00 0.00 0.00 179.01 177.87 2zqb h ALA 60 N 1.91 0.98 -2.96 3.43 0.00 -1.20 -3.45 119.26 117.97 2zqb h ALA 60 Ca -0.00 -0.24 -0.54 0.00 0.00 0.00 0.00 54.91 54.12 2zqb h ALA 60 Cb 0.18 -0.04 0.11 0.00 0.00 0.00 0.00 17.79 18.04 2zqb h ALA 60 CO 0.01 0.33 0.74 -0.51 0.00 0.00 0.00 179.25 179.83 2zqb s LEU 61 N -6.76 4.22 0.05 0.00 1.43 -0.83 -4.93 118.68 111.87 2zqb s LEU 61 Ca 0.01 2.99 0.23 0.00 -1.03 0.00 0.00 54.13 56.33 2zqb s LEU 61 Cb 0.10 -3.79 0.05 0.00 0.03 0.00 0.00 46.19 42.57 2zqb s LEU 61 CO 0.66 -1.01 1.03 0.29 0.23 0.00 0.00 176.35 177.54 2zqb n LYS 62 N 0.16 0.30 -3.59 1.70 5.02 -1.26 -4.97 118.16 115.51 2zqb n LYS 62 Ca 0.03 -0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.19 2zqb n LYS 62 Cb 0.40 -1.60 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 2zqb n LYS 62 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2zqb s GLU 63 N -3.20 1.05 0.44 1.97 -1.05 -1.26 -5.14 118.70 111.50 2zqb s GLU 63 Ca 0.04 -0.39 -0.23 0.00 -0.15 0.00 0.00 54.97 54.23 2zqb s GLU 63 Cb 0.14 0.47 -0.11 0.00 -0.44 0.00 0.00 34.13 34.20 2zqb s GLU 63 CO 0.80 -0.39 0.82 -2.30 0.95 0.00 0.00 175.26 175.13 2zqb n PRO 64 N 0.19 0.98 -3.75 -4.83 -0.02 -1.26 -5.01 135.00 121.30 2zqb n PRO 64 Ca -0.18 0.36 -0.13 0.00 -2.02 0.00 0.00 63.50 61.53 2zqb n PRO 64 Cb 0.61 -1.83 -0.09 0.00 -0.02 0.00 0.00 33.50 32.17 2zqb n PRO 64 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2zqb s LYS 66 N -0.60 3.86 -0.18 0.00 1.02 0.18 -1.90 119.74 122.12 2zqb s LYS 66 Ca -0.07 1.07 -0.02 0.00 0.02 0.00 0.00 55.97 56.97 2zqb s LYS 66 Cb -0.04 -3.88 -0.01 0.00 -0.52 0.00 0.00 37.83 33.38 2zqb s LYS 66 CO 0.03 -1.19 -0.08 0.42 -0.92 0.00 0.00 175.35 173.60 2zqb s ILE 67 N 4.43 3.23 -0.45 2.17 1.01 -0.23 0.55 121.20 131.90 2zqb s ILE 67 Ca 0.54 -0.57 -0.20 0.00 0.00 0.00 0.00 60.65 60.42 2zqb s ILE 67 Cb -0.14 -2.42 0.03 0.00 0.01 0.00 0.00 42.46 39.94 2zqb s ILE 67 CO 0.25 0.48 0.62 -0.63 0.00 0.00 0.00 174.94 175.66 2zqb s ILE 68 N 0.92 4.85 -0.31 2.92 1.01 0.52 0.96 121.20 132.06 2zqb s ILE 68 Ca -0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 60.65 60.51 2zqb s ILE 68 Cb -0.15 -4.22 0.02 0.00 0.01 0.00 0.00 42.46 38.13 2zqb s ILE 68 CO 0.00 -0.63 0.08 -0.22 0.00 0.00 0.00 174.94 174.17 2zqb s LEU 69 N 2.74 4.01 -0.24 2.97 0.20 -0.25 -2.04 118.68 126.07 2zqb s LEU 69 Ca 0.20 -0.89 -0.07 0.00 0.69 0.00 0.00 54.13 54.06 2zqb s LEU 69 Cb -0.15 -1.87 -0.03 0.00 -0.43 0.00 0.00 46.19 43.71 2zqb s LEU 69 CO 0.17 -0.24 0.07 -0.89 -0.29 0.00 0.00 176.35 175.17 2zqb s THR 70 N 1.45 4.36 0.11 3.68 2.01 -0.45 0.35 115.64 127.15 2zqb s THR 70 Ca 0.01 -0.16 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 2zqb s THR 70 Cb -0.18 -3.03 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 2zqb s THR 70 CO 0.02 0.35 0.10 -0.55 -0.69 0.00 0.00 174.62 173.86 2zqb s SER 71 N 1.50 0.27 0.00 3.53 0.15 -0.21 -2.75 113.70 116.18 2zqb s SER 71 Ca 0.06 -0.97 0.16 0.00 0.70 0.00 0.00 55.95 55.89 2zqb s SER 71 Cb -0.15 0.31 0.28 0.00 -1.71 0.00 0.00 66.02 64.75 2zqb s SER 71 CO 0.04 -0.73 1.19 -0.90 1.20 0.00 0.00 173.24 174.04 2zqb n ASP 72 N -0.05 2.83 -4.64 5.45 5.68 -1.26 -1.63 116.55 122.93 2zqb n ASP 72 Ca -0.10 -1.83 -0.43 0.00 -0.50 0.00 0.00 54.79 51.93 2zqb n ASP 72 Cb 0.63 -0.17 -0.02 0.00 -1.14 0.00 0.00 41.12 40.42 2zqb n ASP 72 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2zqb s SER 73 N -1.17 6.69 0.22 -1.12 0.15 -1.26 -4.84 113.70 112.37 2zqb s SER 73 Ca 0.26 1.57 0.13 0.00 0.70 0.00 0.00 55.95 58.61 2zqb s SER 73 Cb 0.15 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.91 2zqb s SER 73 CO 0.21 -1.01 1.34 1.56 1.20 0.00 0.00 173.24 176.54 2zqb h GLN 74 N 9.33 0.00 -0.76 5.44 1.08 -1.94 -1.94 115.11 126.31 2zqb h GLN 74 Ca -0.29 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 56.98 2zqb h GLN 74 Cb 1.12 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.49 2zqb h GLN 74 CO 1.00 0.59 0.44 -0.92 -0.95 0.00 0.00 178.83 178.99 2zqb h TYR 75 N 0.00 0.80 0.18 2.96 3.20 -1.99 0.60 116.97 122.72 2zqb h TYR 75 Ca -0.03 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2zqb h TYR 75 Cb 1.50 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 39.52 2zqb h TYR 75 CO 0.00 0.37 -0.08 0.28 -1.64 0.00 0.00 178.16 177.09 2zqb h VAL 76 N 0.79 0.88 -0.79 1.81 2.07 -1.87 -3.15 116.25 115.98 2zqb h VAL 76 Ca 0.35 -1.01 0.19 0.00 0.82 0.00 0.00 66.70 67.04 2zqb h VAL 76 Cb 0.23 1.43 -0.12 0.00 -1.52 0.00 0.00 31.29 31.31 2zqb h VAL 76 CO -0.20 0.21 0.17 -0.09 0.02 0.00 0.00 177.57 177.68 2zqb h ARG 77 N -0.79 0.22 0.00 1.57 2.43 -1.21 0.28 114.38 116.88 2zqb h ARG 77 Ca -0.02 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 2zqb h ARG 77 Cb 0.52 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2zqb h ARG 77 CO 0.04 0.15 -0.45 0.37 -1.51 0.00 0.00 179.97 178.56 2zqb h GLN 78 N 0.23 0.00 -0.08 0.20 5.75 -0.94 -1.15 115.11 119.11 2zqb h GLN 78 Ca 0.46 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.91 2zqb h GLN 78 Cb 0.85 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.40 2zqb h GLN 78 CO -0.58 0.45 -0.14 0.78 -2.65 0.00 0.00 178.83 176.69 2zqb h GLY 79 N 1.61 0.26 1.45 2.39 0.00 -0.94 -1.17 103.07 106.66 2zqb h GLY 79 Ca -0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 46.99 2zqb h GLY 79 CO 0.06 0.27 0.12 -2.22 0.00 0.00 0.00 176.54 174.76 2zqb h ILE 80 N -0.23 1.20 0.19 2.60 1.08 -1.07 -0.54 117.51 120.73 2zqb h ILE 80 Ca 0.01 -0.71 -0.34 0.00 -0.39 0.00 0.00 64.86 63.43 2zqb h ILE 80 Cb 0.71 0.72 0.01 0.00 -3.07 0.00 0.00 36.82 35.19 2zqb h ILE 80 CO 0.03 0.26 -1.63 0.24 -0.69 0.00 0.00 178.15 176.36 2zqb h MET 81 N 0.68 0.39 0.00 2.37 2.86 -1.23 -3.46 114.93 116.55 2zqb h MET 81 Ca 0.15 -0.67 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 2zqb h MET 81 Cb 0.24 0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.16 2zqb h MET 81 CO -0.00 1.30 0.00 2.41 1.06 0.00 0.00 176.91 181.68 2zqb n THR 82 N -3.59 0.10 -0.04 2.22 -1.04 -0.59 -4.90 114.28 106.44 2zqb n THR 82 Ca -0.21 0.03 -0.06 0.00 -2.04 0.00 0.00 64.05 61.77 2zqb n THR 82 Cb 1.08 -0.42 0.13 0.00 -1.82 0.00 0.00 70.33 69.30 2zqb n THR 82 CO 0.00 0.00 0.00 -0.50 -0.64 0.00 0.00 175.07 173.93 2zqb h TRP 83 N 0.00 0.73 0.11 -1.42 6.55 -1.11 -2.62 115.95 118.18 2zqb h TRP 83 Ca 0.00 -0.16 -0.01 0.00 0.95 0.00 0.00 58.89 59.67 2zqb h TRP 83 Cb 0.00 -0.18 0.00 0.00 -0.86 0.00 0.00 29.16 28.13 2zqb h TRP 83 CO 0.00 0.83 -0.05 0.82 -1.05 0.00 0.00 178.44 178.99 2zqb h ILE 84 N 0.56 0.99 -0.32 1.49 2.04 -1.35 -1.19 117.51 119.73 2zqb h ILE 84 Ca 0.08 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.63 2zqb h ILE 84 Cb 0.72 1.23 -0.07 0.00 -0.74 0.00 0.00 36.82 37.96 2zqb h ILE 84 CO 0.06 0.09 -0.15 -0.74 0.00 0.00 0.00 178.15 177.41 2zqb h HIS 85 N -0.32 -0.35 0.00 1.37 2.76 -1.74 -1.65 115.15 115.22 2zqb h HIS 85 Ca -0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2zqb h HIS 85 Cb 0.26 0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.43 2zqb h HIS 85 CO -0.02 -0.22 0.00 0.41 -1.30 0.00 0.00 177.93 176.81 2zqb n GLY 86 N -1.32 -2.87 0.40 5.26 0.00 -1.00 -2.96 105.19 102.70 2zqb n GLY 86 Ca 0.01 0.36 0.20 0.00 0.00 0.00 0.00 46.02 46.59 2zqb n GLY 86 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2zqb h TRP 87 N 0.00 0.39 -0.81 1.61 6.55 -1.06 -1.26 115.95 121.38 2zqb h TRP 87 Ca 0.00 0.01 0.06 0.00 0.95 0.00 0.00 58.89 59.91 2zqb h TRP 87 Cb 0.00 -0.12 -0.05 0.00 -0.86 0.00 0.00 29.16 28.13 2zqb h TRP 87 CO -0.47 0.12 0.53 0.87 -1.05 0.00 0.00 178.44 178.43 2zqb h LYS 88 N 0.31 0.88 -0.48 0.49 1.57 -1.19 0.53 116.57 118.68 2zqb h LYS 88 Ca 0.42 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2zqb h LYS 88 Cb 1.17 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.28 2zqb h LYS 88 CO -0.12 0.58 0.00 1.63 -0.57 0.00 0.00 179.45 180.97 2zqb n LYS 89 N -4.48 2.13 -0.26 3.15 5.02 -0.48 -3.67 118.16 119.58 2zqb n LYS 89 Ca 0.12 -1.73 0.05 0.00 -2.02 0.00 0.00 58.31 54.73 2zqb n LYS 89 Cb 0.19 -1.38 0.06 0.00 -0.02 0.00 0.00 35.03 33.89 2zqb n LYS 89 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2zqb n ASN 90 N 0.89 1.18 -3.57 4.39 5.15 -0.99 -5.00 115.26 117.31 2zqb n ASN 90 Ca 0.16 -2.45 -0.26 0.00 -0.60 0.00 0.00 54.58 51.42 2zqb n ASN 90 Cb 0.41 -0.29 0.02 0.00 -0.53 0.00 0.00 39.78 39.39 2zqb n ASN 90 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2zqb n GLY 91 N -0.69 -0.50 3.30 8.20 0.00 -1.19 -3.25 105.19 111.07 2zqb n GLY 91 Ca 0.07 0.14 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 2zqb n GLY 91 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2zqb n TRP 92 N -4.38 -2.45 -4.06 1.61 7.02 0.18 -5.03 117.44 110.34 2zqb n TRP 92 Ca -0.00 0.82 -0.23 0.00 -1.02 0.00 0.00 57.50 57.06 2zqb n TRP 92 Cb 0.55 -4.61 -0.06 0.00 -2.42 0.00 0.00 31.31 24.76 2zqb n TRP 92 CO 0.00 0.00 0.00 -1.64 -2.02 0.00 0.00 177.69 174.03 2zqb s MET 93 N -6.05 2.34 0.92 -0.99 -1.94 -1.20 -3.58 119.30 108.79 2zqb s MET 93 Ca 0.47 -1.63 -0.13 0.00 -1.71 0.00 0.00 55.69 52.69 2zqb s MET 93 Cb -0.21 -2.13 0.14 0.00 2.01 0.00 0.00 34.83 34.64 2zqb s MET 93 CO 0.59 0.02 1.15 0.95 -0.01 0.00 0.00 175.02 177.71 2zqb s THR 94 N -2.48 1.98 0.66 2.05 -4.23 0.50 -4.71 115.64 109.42 2zqb s THR 94 Ca 0.40 0.00 0.31 0.00 -1.18 0.00 0.00 61.69 61.22 2zqb s THR 94 Cb -0.01 -2.77 0.32 0.00 1.34 0.00 0.00 72.50 71.38 2zqb s THR 94 CO 0.23 0.00 1.97 0.77 -0.54 0.00 0.00 174.62 177.05 2zqb h SER 95 N -1.51 0.00 -2.29 3.99 4.64 -1.99 -2.83 113.55 113.56 2zqb h SER 95 Ca -0.50 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.18 2zqb h SER 95 Cb 1.33 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 63.03 2zqb h SER 95 CO 0.60 0.00 -0.24 -0.46 -0.87 0.00 0.00 176.83 175.86 2zqb n ASN 96 N -2.94 5.10 -4.37 4.97 6.94 -1.26 -4.97 115.26 118.74 2zqb n ASN 96 Ca -0.02 -3.66 -0.53 0.00 -0.02 0.00 0.00 54.58 50.35 2zqb n ASN 96 Cb 0.35 -0.72 -0.10 0.00 -2.36 0.00 0.00 39.78 36.95 2zqb n ASN 96 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2zqb n GLY 97 N -0.07 0.02 3.51 4.83 0.00 -1.07 -4.99 105.19 107.42 2zqb n GLY 97 Ca 0.34 1.04 -0.24 0.00 0.00 0.00 0.00 46.02 47.17 2zqb n GLY 97 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zqb s THR 98 N 7.22 1.32 0.48 2.61 -4.23 -1.26 -4.83 115.64 116.96 2zqb s THR 98 Ca 1.18 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 59.45 2zqb s THR 98 Cb -1.18 -2.77 -0.07 0.00 1.34 0.00 0.00 72.50 69.81 2zqb s THR 98 CO 0.56 0.00 1.39 -2.84 -0.54 0.00 0.00 174.62 173.19 2zqb s PRO 99 N -3.84 3.51 0.12 3.99 0.02 -1.26 -0.37 135.00 137.17 2zqb s PRO 99 Ca 0.34 2.33 -0.30 0.00 0.02 0.00 0.00 61.00 63.39 2zqb s PRO 99 Cb 0.08 -2.51 -0.06 0.00 0.02 0.00 0.00 34.50 32.03 2zqb s PRO 99 CO 0.15 -0.93 1.06 0.08 -0.33 0.00 0.00 177.00 177.03 2zqb s VAL 100 N -1.25 4.20 0.02 3.83 1.01 -1.23 -4.64 120.40 122.33 2zqb s VAL 100 Ca 0.65 1.79 -0.30 0.00 0.00 0.00 0.00 61.98 64.11 2zqb s VAL 100 Cb -0.42 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 31.74 2zqb s VAL 100 CO 0.52 0.26 1.71 -0.75 0.00 0.00 0.00 175.10 176.85 2zqb s LYS 101 N 0.09 4.18 -0.71 2.72 2.36 -1.26 -2.08 119.74 125.03 2zqb s LYS 101 Ca 0.50 2.33 0.00 0.00 -2.55 0.00 0.00 55.97 56.25 2zqb s LYS 101 Cb -0.27 -3.85 0.00 0.00 -1.05 0.00 0.00 37.83 32.66 2zqb s LYS 101 CO 0.32 -0.82 0.00 0.09 1.55 0.00 0.00 175.35 176.49 2zqb n ASN 102 N 6.54 -3.35 -0.35 1.43 3.02 -1.26 -4.94 115.26 116.34 2zqb n ASN 102 Ca 0.17 0.09 0.14 0.00 -0.03 0.00 0.00 54.58 54.95 2zqb n ASN 102 Cb 0.41 -2.04 0.33 0.00 -0.61 0.00 0.00 39.78 37.88 2zqb n ASN 102 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2zqb h VAL 103 N 0.00 0.68 -0.10 2.41 3.04 -1.82 0.52 116.25 120.98 2zqb h VAL 103 Ca -0.16 -0.25 0.03 0.00 -1.01 0.00 0.00 66.70 65.31 2zqb h VAL 103 Cb 0.78 -0.12 -0.06 0.00 -2.01 0.00 0.00 31.29 29.88 2zqb h VAL 103 CO 0.21 0.13 -0.49 -2.24 -1.01 0.00 0.00 177.57 174.18 2zqb h ASP 104 N 0.73 -1.54 -0.05 3.17 -0.00 -1.92 -0.30 116.42 116.51 2zqb h ASP 104 Ca 0.59 0.19 0.01 0.00 -0.00 0.00 0.00 57.03 57.81 2zqb h ASP 104 Cb 0.95 0.61 -0.01 0.00 -0.00 0.00 0.00 39.33 40.88 2zqb h ASP 104 CO -0.39 -0.47 -0.01 -0.07 -0.00 0.00 0.00 179.24 178.30 2zqb h LEU 105 N -0.57 -0.04 -1.17 0.15 3.38 -1.86 -2.47 115.31 112.73 2zqb h LEU 105 Ca 0.05 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2zqb h LEU 105 Cb 0.67 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 2zqb h LEU 105 CO -0.40 -0.01 0.56 -0.50 0.09 0.00 0.00 178.44 178.18 2zqb h TRP 106 N 0.00 1.07 -0.61 1.13 4.06 -0.65 -0.36 115.95 120.59 2zqb h TRP 106 Ca 0.02 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 60.95 2zqb h TRP 106 Cb 0.03 -0.36 -0.03 0.00 -1.00 0.00 0.00 29.16 27.81 2zqb h TRP 106 CO -0.11 0.67 0.18 0.87 -3.56 0.00 0.00 178.44 176.49 2zqb h LYS 107 N 1.15 0.93 0.00 0.49 1.57 -0.98 -0.93 116.57 118.80 2zqb h LYS 107 Ca 0.31 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 2zqb h LYS 107 Cb -0.12 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.03 2zqb h LYS 107 CO -0.07 0.81 -0.34 0.00 -0.57 0.00 0.00 179.45 179.28 2zqb h ARG 108 N 0.90 0.00 0.07 3.15 3.08 -0.63 -0.47 114.38 120.47 2zqb h ARG 108 Ca 0.20 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.12 2zqb h ARG 108 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.34 2zqb h ARG 108 CO -0.01 0.34 -0.57 1.25 -1.07 0.00 0.00 179.97 179.90 2zqb h LEU 109 N 0.00 0.38 -0.29 3.04 5.85 -0.99 -0.71 115.31 122.60 2zqb h LEU 109 Ca -0.00 -0.89 0.07 0.00 0.84 0.00 0.00 57.88 57.90 2zqb h LEU 109 Cb 0.72 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 2zqb h LEU 109 CO 0.04 1.24 -0.22 -0.78 -0.34 0.00 0.00 178.44 178.39 2zqb h ASP 110 N -0.41 -0.70 -0.16 1.25 3.58 -0.96 0.52 116.42 119.53 2zqb h ASP 110 Ca -0.09 0.14 0.05 0.00 0.42 0.00 0.00 57.03 57.55 2zqb h ASP 110 Cb 1.39 0.35 -0.06 0.00 1.72 0.00 0.00 39.33 42.72 2zqb h ASP 110 CO 0.11 -0.25 -0.29 0.11 -2.88 0.00 0.00 179.24 176.04 2zqb h LYS 111 N -0.19 -0.33 -0.25 0.28 1.57 -1.09 -2.75 116.57 113.81 2zqb h LYS 111 Ca 0.15 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2zqb h LYS 111 Cb 0.43 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2zqb h LYS 111 CO -0.41 -0.22 0.07 0.00 -0.57 0.00 0.00 179.45 178.32 2zqb h ALA 112 N 0.55 0.33 -0.89 3.86 0.00 -0.68 -2.82 119.26 119.61 2zqb h ALA 112 Ca 0.11 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 54.99 2zqb h ALA 112 Cb 0.51 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.06 2zqb h ALA 112 CO -0.36 -0.03 -0.41 0.00 0.00 0.00 0.00 179.25 178.45 2zqb h ALA 113 N 0.89 -0.01 0.00 0.00 0.00 0.08 -2.02 119.26 118.21 2zqb h ALA 113 Ca 0.08 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2zqb h ALA 113 Cb 0.26 1.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2zqb h ALA 113 CO -0.00 -0.70 0.00 1.96 0.00 0.00 0.00 179.25 180.51 2zqb h GLN 114 N -0.05 0.00 0.00 0.00 4.20 -1.22 -0.97 115.11 117.07 2zqb h GLN 114 Ca 0.29 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.96 2zqb h GLN 114 Cb 0.56 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 2zqb h GLN 114 CO -0.90 0.00 -0.26 -0.07 -0.67 0.00 0.00 178.83 176.92 2zqb h LEU 115 N 0.00 0.00 -8.92 1.46 3.38 -1.38 -3.47 115.31 106.38 2zqb h LEU 115 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2zqb h LEU 115 Cb 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 40.58 2zqb h LEU 115 CO 0.00 0.19 -0.79 -1.00 0.09 0.00 0.00 178.44 176.93 2zqb s HIS 116 N -3.12 1.99 -0.52 1.13 3.76 -0.37 -4.52 115.29 113.64 2zqb s HIS 116 Ca 0.05 -0.43 -0.17 0.00 -0.15 0.00 0.00 55.06 54.36 2zqb s HIS 116 Cb 0.06 -0.98 0.08 0.00 1.11 0.00 0.00 32.58 32.85 2zqb s HIS 116 CO 0.71 0.41 0.55 -1.14 -0.85 0.00 0.00 174.74 174.42 2zqb s GLN 117 N -2.81 3.04 -0.27 1.40 0.74 -0.80 -4.90 119.66 116.07 2zqb s GLN 117 Ca 0.18 -1.25 -0.07 0.00 0.05 0.00 0.00 55.36 54.27 2zqb s GLN 117 Cb -0.06 -4.18 -0.01 0.00 1.10 0.00 0.00 33.01 29.86 2zqb s GLN 117 CO 0.08 -1.25 0.07 0.42 -0.55 0.00 0.00 175.29 174.06 2zqb s ILE 118 N 2.19 4.12 -0.55 -2.34 1.01 -1.26 -1.06 121.20 123.30 2zqb s ILE 118 Ca 0.09 -0.42 -0.27 0.00 0.00 0.00 0.00 60.65 60.05 2zqb s ILE 118 Cb -0.23 -3.01 0.03 0.00 0.01 0.00 0.00 42.46 39.25 2zqb s ILE 118 CO 0.08 0.22 1.10 -0.62 0.00 0.00 0.00 174.94 175.72 2zqb s ASP 119 N 1.56 6.45 -0.17 3.58 2.15 0.27 -4.95 116.67 125.56 2zqb s ASP 119 Ca 0.05 0.04 -0.29 0.00 0.43 0.00 0.00 52.55 52.78 2zqb s ASP 119 Cb -0.16 -2.51 -0.01 0.00 -0.30 0.00 0.00 42.92 39.94 2zqb s ASP 119 CO 0.03 -1.35 1.15 0.26 -0.17 0.00 0.00 175.17 175.09 2zqb s TRP 120 N 4.52 3.12 -0.14 -5.34 0.52 -1.26 -1.08 118.94 119.29 2zqb s TRP 120 Ca 0.40 1.25 -0.01 0.00 0.02 0.00 0.00 56.10 57.76 2zqb s TRP 120 Cb -0.09 -3.38 -0.02 0.00 -1.15 0.00 0.00 33.47 28.83 2zqb s TRP 120 CO 0.25 -1.09 -0.11 1.03 0.02 0.00 0.00 176.95 177.05 2zqb s ARG 121 N 3.10 3.46 -0.04 4.98 1.81 0.16 -4.95 118.95 127.47 2zqb s ARG 121 Ca 0.50 -0.65 0.00 0.00 -1.72 0.00 0.00 55.73 53.87 2zqb s ARG 121 Cb -0.19 -2.70 -0.03 0.00 -0.45 0.00 0.00 34.95 31.57 2zqb s ARG 121 CO 0.13 0.22 0.00 -1.58 -0.68 0.00 0.00 175.30 173.39 2zqb s TRP 122 N 0.35 3.11 0.23 -0.53 0.52 -1.26 -1.05 118.94 120.31 2zqb s TRP 122 Ca -0.09 0.13 0.02 0.00 0.02 0.00 0.00 56.10 56.17 2zqb s TRP 122 Cb -0.16 -1.72 -0.05 0.00 -1.15 0.00 0.00 33.47 30.39 2zqb s TRP 122 CO 0.05 0.46 0.06 0.08 0.02 0.00 0.00 176.95 177.62 2zqb s VAL 123 N -1.00 0.62 -0.35 4.03 1.01 -0.64 -4.93 120.40 119.14 2zqb s VAL 123 Ca 0.17 -1.99 0.23 0.00 0.00 0.00 0.00 61.98 60.38 2zqb s VAL 123 Cb -0.11 -2.44 -0.11 0.00 0.00 0.00 0.00 36.38 33.71 2zqb s VAL 123 CO 0.07 -0.18 0.93 2.29 0.00 0.00 0.00 175.10 178.20 2zqb n LYS 124 N -0.38 0.49 -3.04 2.72 0.00 -1.26 -4.49 118.16 112.18 2zqb n LYS 124 Ca -0.02 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 2zqb n LYS 124 Cb 0.65 -1.67 0.00 0.00 -0.00 0.00 0.00 35.03 34.01 2zqb n LYS 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2zqb n GLY 125 N 1.27 -0.92 0.13 2.58 0.00 -1.26 -5.03 105.19 101.95 2zqb n GLY 125 Ca -0.00 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 2zqb n GLY 125 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2zqb n HIS 126 N 0.40 0.79 -0.90 1.61 1.44 -1.26 -4.76 115.22 112.54 2zqb n HIS 126 Ca 0.00 0.23 -0.36 0.00 -2.01 0.00 0.00 57.72 55.58 2zqb n HIS 126 Cb 0.00 -1.09 -0.05 0.00 0.12 0.00 0.00 29.99 28.97 2zqb n HIS 126 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2zqb n ALA 127 N -3.33 -2.24 -3.93 1.59 0.00 -1.26 -3.44 120.51 107.91 2zqb n ALA 127 Ca -0.38 0.35 -0.28 0.00 0.00 0.00 0.00 53.44 53.13 2zqb n ALA 127 Cb 0.92 -1.05 -0.17 0.00 0.00 0.00 0.00 19.45 19.15 2zqb n ALA 127 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2zqb s GLY 128 N 0.16 0.97 0.17 0.00 0.00 -1.26 -4.90 107.32 102.47 2zqb s GLY 128 Ca 0.55 -0.71 -0.16 0.00 0.00 0.00 0.00 44.72 44.39 2zqb s GLY 128 CO 0.35 0.63 0.62 0.30 0.00 0.00 0.00 173.10 175.00 2zqb s HIS 129 N 1.53 3.63 0.22 1.90 3.76 -1.24 -5.06 115.29 120.04 2zqb s HIS 129 Ca 0.04 1.19 0.09 0.00 -0.15 0.00 0.00 55.06 56.23 2zqb s HIS 129 Cb -0.13 -2.47 0.72 0.00 1.11 0.00 0.00 32.58 31.81 2zqb s HIS 129 CO -0.09 0.40 1.01 0.00 -0.85 0.00 0.00 174.74 175.21 2zqb n ALA 130 N 0.79 0.53 0.08 -1.40 0.00 -1.26 -2.21 120.51 117.04 2zqb n ALA 130 Ca -0.04 0.67 -0.12 0.00 0.00 0.00 0.00 53.44 53.95 2zqb n ALA 130 Cb 0.51 -0.60 -0.05 0.00 0.00 0.00 0.00 19.45 19.32 2zqb n ALA 130 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2zqb h GLU 131 N 0.00 0.29 -0.72 0.00 4.11 -1.97 0.73 114.58 117.02 2zqb h GLU 131 Ca 0.48 -0.34 -0.06 0.00 0.07 0.00 0.00 59.36 59.52 2zqb h GLU 131 Cb 1.19 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 2zqb h GLU 131 CO -0.54 1.06 0.21 -0.91 0.07 0.00 0.00 179.01 178.90 2zqb h ASN 132 N 0.15 1.05 -0.68 3.06 2.35 -1.66 -1.21 115.58 118.64 2zqb h ASN 132 Ca -0.07 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 2zqb h ASN 132 Cb 1.61 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.67 2zqb h ASN 132 CO 0.16 0.99 0.42 -0.33 -1.65 0.00 0.00 177.43 177.02 2zqb h GLU 133 N 1.08 0.92 0.37 0.81 4.39 -0.83 -1.72 114.58 119.59 2zqb h GLU 133 Ca 0.23 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 2zqb h GLU 133 Cb 0.32 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2zqb h GLU 133 CO -0.01 0.64 -0.18 -0.09 -1.16 0.00 0.00 179.01 178.22 2zqb h ARG 134 N 0.93 -0.48 -0.45 2.33 9.65 0.82 -1.81 114.38 125.37 2zqb h ARG 134 Ca 0.25 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 59.20 2zqb h ARG 134 Cb -0.05 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 2zqb h ARG 134 CO -0.05 -0.26 -0.26 0.00 2.80 0.00 0.00 179.97 182.20 2zqb h HIS 136 N 0.00 1.06 -0.53 0.00 -0.00 -1.12 0.78 115.15 115.35 2zqb h HIS 136 Ca 0.07 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.46 2zqb h HIS 136 Cb 0.18 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 27.25 2zqb h HIS 136 CO -0.85 0.31 0.25 1.96 -0.00 0.00 0.00 177.93 179.60 2zqb h GLN 137 N 0.83 0.76 -0.67 5.26 4.20 -0.58 -1.58 115.11 123.34 2zqb h GLN 137 Ca 0.53 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 59.12 2zqb h GLN 137 Cb 0.71 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 2zqb h GLN 137 CO -0.34 0.63 0.38 -0.07 -0.67 0.00 0.00 178.83 178.76 2zqb h LEU 138 N 0.70 0.82 0.03 1.46 3.38 0.12 -0.40 115.31 121.41 2zqb h LEU 138 Ca 0.18 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2zqb h LEU 138 Cb 0.12 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2zqb h LEU 138 CO -0.02 0.66 -0.01 0.00 0.09 0.00 0.00 178.44 179.15 2zqb h ALA 139 N 1.19 -0.04 -0.61 1.53 0.00 0.53 -1.97 119.26 119.90 2zqb h ALA 139 Ca 0.24 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.09 2zqb h ALA 139 Cb 0.01 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.71 2zqb h ALA 139 CO -0.04 -0.34 0.05 0.00 0.00 0.00 0.00 179.25 178.92 2zqb h ARG 140 N -0.40 0.16 -0.20 0.00 2.47 -1.23 -1.10 114.38 114.08 2zqb h ARG 140 Ca -0.00 -0.01 -0.14 0.00 -1.26 0.00 0.00 59.98 58.57 2zqb h ARG 140 Cb 0.38 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 2zqb h ARG 140 CO 0.01 0.10 -0.45 0.00 0.56 0.00 0.00 179.97 180.19 2zqb h ALA 141 N 1.53 0.86 -0.33 0.04 0.00 -1.03 0.40 119.26 120.73 2zqb h ALA 141 Ca 0.32 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2zqb h ALA 141 Cb 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2zqb h ALA 141 CO -0.48 0.65 0.11 0.00 0.00 0.00 0.00 179.25 179.52 2zqb h ALA 142 N 1.12 0.43 -0.88 0.00 0.00 -1.02 -2.94 119.26 115.98 2zqb h ALA 142 Ca 0.03 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2zqb h ALA 142 Cb 0.94 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2zqb h ALA 142 CO 0.08 0.07 0.58 0.00 0.00 0.00 0.00 179.25 179.98 2zqb h ALA 143 N 0.95 1.42 -0.00 0.00 0.00 -0.77 -3.14 119.26 117.72 2zqb h ALA 143 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2zqb h ALA 143 Cb 0.24 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2zqb h ALA 143 CO -0.00 0.50 0.00 0.39 0.00 0.00 0.00 179.25 180.14 2zqb n GLU 144 N -4.43 1.00 -1.21 0.00 1.02 0.13 -3.98 120.64 113.18 2zqb n GLU 144 Ca 0.11 -0.01 -0.24 0.00 -0.02 0.00 0.00 57.16 57.00 2zqb n GLU 144 Cb 0.08 -1.33 0.17 0.00 -0.02 0.00 0.00 31.44 30.34 2zqb n GLU 144 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2zqb n ALA 145 N -0.82 5.58 -4.12 0.62 0.00 -1.12 -4.93 120.51 115.72 2zqb n ALA 145 Ca 0.16 -2.86 -0.29 0.00 0.00 0.00 0.00 53.44 50.45 2zqb n ALA 145 Cb 0.07 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.02 2zqb n ALA 145 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2zqb n ASN 146 N -1.10 -0.20 -4.69 0.00 4.05 -1.26 -4.83 115.26 107.24 2zqb n ASN 146 Ca 0.59 -1.11 -0.42 0.00 0.45 0.00 0.00 54.58 54.09 2zqb n ASN 146 Cb 1.60 -2.49 0.00 0.00 1.23 0.00 0.00 39.78 40.13 2zqb n ASN 146 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2zqb n PRO 147 N -4.45 1.97 -0.00 1.20 -0.04 -1.26 -4.92 135.00 127.50 2zqb n PRO 147 Ca -0.27 0.70 0.07 0.00 -0.04 0.00 0.00 63.50 63.95 2zqb n PRO 147 Cb 0.67 -2.30 -0.10 0.00 -0.04 0.00 0.00 33.50 31.73 2zqb n PRO 147 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2zqb n THR 148 N 0.09 0.00 -1.65 0.52 -2.24 -1.26 -4.14 114.28 105.61 2zqb n THR 148 Ca 0.06 -0.28 -0.38 0.00 -2.27 0.00 0.00 64.05 61.18 2zqb n THR 148 Cb 0.37 0.42 0.04 0.00 -2.10 0.00 0.00 70.33 69.06 2zqb n THR 148 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2zqb n GLN 149 N -1.79 1.15 -4.26 -0.78 7.27 -1.26 -4.63 117.38 113.07 2zqb n GLN 149 Ca -0.01 0.43 -0.34 0.00 0.07 0.00 0.00 57.00 57.15 2zqb n GLN 149 Cb 0.31 -2.25 -0.11 0.00 2.41 0.00 0.00 30.24 30.61 2zqb n GLN 149 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2zqb s ILE 150 N -1.42 4.31 -0.43 1.69 1.09 -1.26 0.54 121.20 125.72 2zqb s ILE 150 Ca 0.73 -0.22 -0.26 0.00 -1.10 0.00 0.00 60.65 59.80 2zqb s ILE 150 Cb -0.44 -2.89 0.02 0.00 -1.06 0.00 0.00 42.46 38.10 2zqb s ILE 150 CO 0.49 0.52 0.94 -0.62 -0.10 0.00 0.00 174.94 176.16 2zqb s ASP 151 N -0.01 6.56 -0.01 3.58 -1.08 -1.26 -4.97 116.67 119.49 2zqb s ASP 151 Ca 0.03 0.28 -0.24 0.00 -0.52 0.00 0.00 52.55 52.11 2zqb s ASP 151 Cb -0.13 -2.46 -0.15 0.00 -1.46 0.00 0.00 42.92 38.72 2zqb s ASP 151 CO 0.02 -1.00 1.10 0.71 0.52 0.00 0.00 175.17 176.51 2zqb h THR 152 N 6.01 0.58 0.00 1.71 1.35 -1.97 -2.67 112.91 117.93 2zqb h THR 152 Ca -0.24 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.96 2zqb h THR 152 Cb 1.08 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 2zqb h THR 152 CO 1.02 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 177.01 2zqb n GLY 153 N -0.11 1.78 0.00 5.82 0.00 -1.26 -5.24 105.19 106.18 2zqb n GLY 153 Ca -0.09 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.78 2zqb n GLY 153 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30