#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zqb s LYS 5 N 0.00 4.29 -0.35 1.96 1.02 -1.26 -4.82 119.74 120.57 2zqb s LYS 5 Ca 0.00 1.33 -0.12 0.00 0.02 0.00 0.00 55.97 57.20 2zqb s LYS 5 Cb 0.00 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 2zqb s LYS 5 CO 0.00 -0.00 0.21 -1.17 -0.92 0.00 0.00 175.35 173.47 2zqb s LEU 6 N -2.68 4.52 -0.13 3.17 2.96 -1.26 -2.83 118.68 122.43 2zqb s LEU 6 Ca 0.57 -0.65 0.02 0.00 -0.22 0.00 0.00 54.13 53.85 2zqb s LEU 6 Cb -0.17 -2.07 0.00 0.00 0.50 0.00 0.00 46.19 44.45 2zqb s LEU 6 CO 0.21 -0.29 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.13 2zqb s ILE 7 N 1.65 2.32 -0.23 6.68 1.01 -0.80 -4.47 121.20 127.36 2zqb s ILE 7 Ca 0.05 -0.90 -0.18 0.00 0.00 0.00 0.00 60.65 59.61 2zqb s ILE 7 Cb -0.18 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2zqb s ILE 7 CO 0.08 0.54 0.50 -1.00 0.00 0.00 0.00 174.94 175.06 2zqb s HIS 8 N 0.64 3.33 -0.11 3.97 3.76 -0.80 -1.30 115.29 124.78 2zqb s HIS 8 Ca -0.10 0.69 0.01 0.00 -0.15 0.00 0.00 55.06 55.50 2zqb s HIS 8 Cb -0.16 -2.67 -0.02 0.00 1.11 0.00 0.00 32.58 30.84 2zqb s HIS 8 CO 0.02 -0.17 -0.14 0.42 -0.85 0.00 0.00 174.74 174.03 2zqb s ILE 9 N 1.88 2.99 -0.04 0.60 1.01 0.49 -1.30 121.20 126.83 2zqb s ILE 9 Ca 0.22 -0.70 0.05 0.00 0.00 0.00 0.00 60.65 60.22 2zqb s ILE 9 Cb -0.15 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 2zqb s ILE 9 CO 0.09 0.54 -0.19 -0.36 0.00 0.00 0.00 174.94 175.02 2zqb s PHE 10 N 0.10 2.56 0.06 3.97 0.08 0.21 -1.24 117.98 123.71 2zqb s PHE 10 Ca -0.06 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.70 2zqb s PHE 10 Cb -0.15 -1.59 -0.03 0.00 -0.57 0.00 0.00 43.02 40.68 2zqb s PHE 10 CO 0.05 0.06 -0.08 0.95 -0.10 0.00 0.00 175.22 176.10 2zqb s THR 11 N -0.60 0.63 0.16 0.64 -4.23 -1.12 -1.26 115.64 109.85 2zqb s THR 11 Ca 0.09 -1.32 -0.22 0.00 -1.18 0.00 0.00 61.69 59.06 2zqb s THR 11 Cb -0.11 -0.93 0.06 0.00 1.34 0.00 0.00 72.50 72.87 2zqb s THR 11 CO 0.00 -0.50 0.57 -0.62 -0.54 0.00 0.00 174.62 173.53 2zqb s ASP 12 N -1.98 -0.49 0.05 3.99 2.15 0.47 -4.67 116.67 116.18 2zqb s ASP 12 Ca -0.04 -0.09 0.00 0.00 0.43 0.00 0.00 52.55 52.85 2zqb s ASP 12 Cb -0.06 0.58 -0.03 0.00 -0.30 0.00 0.00 42.92 43.11 2zqb s ASP 12 CO -0.01 -0.97 -0.04 -0.83 -0.17 0.00 0.00 175.17 173.15 2zqb s GLY 13 N -2.77 0.48 -0.10 2.66 0.00 -1.26 -0.86 107.32 105.47 2zqb s GLY 13 Ca 0.02 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 43.48 2zqb s GLY 13 CO -0.12 -1.12 0.53 -0.45 0.00 0.00 0.00 173.10 171.94 2zqb s SER 14 N -2.42 -0.50 -0.09 1.64 0.15 -0.28 -4.80 113.70 107.40 2zqb s SER 14 Ca 0.00 0.68 -0.04 0.00 0.70 0.00 0.00 55.95 57.29 2zqb s SER 14 Cb 0.01 0.69 0.04 0.00 -1.71 0.00 0.00 66.02 65.04 2zqb s SER 14 CO -0.05 -0.42 0.20 0.00 1.20 0.00 0.00 173.24 174.17 2zqb s LEU 16 N 1.11 6.47 0.00 0.00 1.43 -0.50 -4.75 118.68 122.44 2zqb s LEU 16 Ca -0.08 -2.86 0.00 0.00 -1.03 0.00 0.00 54.13 50.16 2zqb s LEU 16 Cb -0.10 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.89 2zqb s LEU 16 CO -0.07 -0.55 0.00 0.61 0.23 0.00 0.00 176.35 176.57 2zqb n GLY 17 N 3.81 -1.12 3.06 -3.19 0.00 -1.26 -4.01 105.19 102.47 2zqb n GLY 17 Ca 0.18 -1.53 -0.05 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.46 -0.62 1.12 1.61 2.47 -1.26 -3.56 114.94 112.24 2zqb s ASN 18 Ca 0.00 -1.06 -0.18 0.00 0.42 0.00 0.00 52.86 52.03 2zqb s ASN 18 Cb 0.00 1.49 0.26 0.00 -1.45 0.00 0.00 41.25 41.55 2zqb s ASN 18 CO 0.00 -0.20 1.20 -0.81 -3.72 0.00 0.00 177.10 173.57 2zqb n PRO 19 N 4.35 -2.18 0.00 0.43 -0.04 -1.26 -4.98 135.00 131.31 2zqb n PRO 19 Ca 0.11 -1.89 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 2zqb n PRO 19 Cb 0.53 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2zqb n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2zqb n GLY 20 N -4.13 3.61 3.66 0.55 0.00 -1.02 -4.87 105.19 102.99 2zqb n GLY 20 Ca 0.16 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 2zqb n GLY 20 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2zqb n PRO 21 N -1.89 1.36 -4.02 1.61 -0.04 -1.01 -1.44 135.00 129.57 2zqb n PRO 21 Ca 0.00 0.50 -0.14 0.00 -0.04 0.00 0.00 63.50 63.82 2zqb n PRO 21 Cb 0.00 -2.28 -0.02 0.00 -0.04 0.00 0.00 33.50 31.16 2zqb n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2zqb n GLY 22 N 1.06 1.94 3.75 0.55 0.00 0.46 -1.41 105.19 111.54 2zqb n GLY 22 Ca 0.11 -1.58 -0.03 0.00 0.00 0.00 0.00 46.02 44.52 2zqb n GLY 22 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2zqb s GLY 23 N -3.22 -0.23 0.36 -0.02 0.00 -0.87 0.38 107.32 103.73 2zqb s GLY 23 Ca 0.28 0.16 0.04 0.00 0.00 0.00 0.00 44.72 45.20 2zqb s GLY 23 CO 0.20 0.18 0.06 -2.52 0.00 0.00 0.00 173.10 171.02 2zqb s TYR 24 N -3.09 2.01 -0.22 1.90 1.13 -0.59 -1.12 117.35 117.37 2zqb s TYR 24 Ca 0.13 -0.97 -0.16 0.00 -1.41 0.00 0.00 57.07 54.66 2zqb s TYR 24 Cb -0.01 -1.35 0.06 0.00 -1.10 0.00 0.00 41.96 39.56 2zqb s TYR 24 CO 0.02 0.04 0.56 0.20 -2.51 0.00 0.00 175.55 173.86 2zqb s GLY 25 N -3.56 -0.46 -0.10 5.49 0.00 -0.04 -2.72 107.32 105.92 2zqb s GLY 25 Ca 0.33 1.80 -0.05 0.00 0.00 0.00 0.00 44.72 46.80 2zqb s GLY 25 CO 0.15 1.72 0.23 -0.42 0.00 0.00 0.00 173.10 174.78 2zqb s ILE 26 N 0.91 -0.11 -0.07 0.90 1.01 -0.49 -0.40 121.20 122.96 2zqb s ILE 26 Ca -0.05 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.81 2zqb s ILE 26 Cb -0.05 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 42.03 2zqb s ILE 26 CO -0.08 0.08 -0.14 -0.69 0.00 0.00 0.00 174.94 174.11 2zqb s VAL 27 N 1.47 3.07 -0.18 2.92 1.01 -0.39 -1.36 120.40 126.93 2zqb s VAL 27 Ca -0.07 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.22 2zqb s VAL 27 Cb -0.11 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.08 2zqb s VAL 27 CO -0.08 0.57 -0.15 -0.04 0.00 0.00 0.00 175.10 175.41 2zqb s MET 28 N -0.41 2.43 -0.13 2.72 -1.94 -0.60 -0.62 119.30 120.76 2zqb s MET 28 Ca 0.05 -0.81 -0.03 0.00 -1.71 0.00 0.00 55.69 53.19 2zqb s MET 28 Cb -0.12 -2.42 -0.03 0.00 2.01 0.00 0.00 34.83 34.27 2zqb s MET 28 CO 0.02 -0.32 -0.02 0.15 -0.01 0.00 0.00 175.02 174.84 2zqb s LYS 29 N 1.36 3.40 -0.10 2.03 1.02 -0.42 -1.26 119.74 125.78 2zqb s LYS 29 Ca 0.02 -0.48 -0.03 0.00 0.02 0.00 0.00 55.97 55.50 2zqb s LYS 29 Cb -0.15 -2.87 0.05 0.00 -0.52 0.00 0.00 37.83 34.35 2zqb s LYS 29 CO -0.10 0.42 0.14 -0.47 -0.92 0.00 0.00 175.35 174.42 2zqb s TYR 30 N -0.12 -0.10 0.00 3.18 5.04 0.61 -1.90 117.35 124.06 2zqb s TYR 30 Ca 0.03 0.39 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 2zqb s TYR 30 Cb -0.13 -0.37 0.00 0.00 0.35 0.00 0.00 41.96 41.82 2zqb s TYR 30 CO 0.02 -0.32 0.00 1.63 -1.34 0.00 0.00 175.55 175.54 2zqb n LYS 31 N 5.31 0.00 -0.19 4.97 5.02 -1.26 -1.50 118.16 130.52 2zqb n LYS 31 Ca -0.05 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.36 2zqb n LYS 31 Cb 0.50 0.00 0.25 0.00 -0.02 0.00 0.00 35.03 35.76 2zqb n LYS 31 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zqb n GLY 32 N 0.00 1.50 3.70 0.72 0.00 -1.26 -4.90 105.19 104.95 2zqb n GLY 32 Ca 0.00 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 2zqb n GLY 32 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2zqb s HIS 33 N -1.51 3.58 -0.10 1.61 3.76 -0.56 -5.06 115.29 117.00 2zqb s HIS 33 Ca 0.38 1.54 0.04 0.00 -0.15 0.00 0.00 55.06 56.87 2zqb s HIS 33 Cb 0.22 -3.07 -0.00 0.00 1.11 0.00 0.00 32.58 30.84 2zqb s HIS 33 CO 0.30 -0.07 -0.23 0.99 -0.85 0.00 0.00 174.74 174.88 2zqb s THR 34 N 1.36 2.10 0.06 1.30 2.01 -1.26 -0.29 115.64 120.93 2zqb s THR 34 Ca 0.47 -1.00 0.05 0.00 0.31 0.00 0.00 61.69 61.51 2zqb s THR 34 Cb -0.19 -1.80 -0.03 0.00 0.01 0.00 0.00 72.50 70.49 2zqb s THR 34 CO 0.22 0.56 -0.14 -1.59 -0.69 0.00 0.00 174.62 172.98 2zqb s LYS 35 N 0.35 0.84 0.07 4.92 -2.85 -0.39 -4.99 119.74 117.68 2zqb s LYS 35 Ca -0.18 -0.87 0.06 0.00 -1.00 0.00 0.00 55.97 53.97 2zqb s LYS 35 Cb -0.18 -0.83 -0.04 0.00 -2.06 0.00 0.00 37.83 34.72 2zqb s LYS 35 CO 0.09 0.19 -0.10 -1.21 0.10 0.00 0.00 175.35 174.42 2zqb s GLU 36 N -1.52 2.26 0.04 1.78 2.02 -1.26 -1.55 118.70 120.46 2zqb s GLU 36 Ca -0.01 -0.93 0.01 0.00 0.02 0.00 0.00 54.97 54.06 2zqb s GLU 36 Cb -0.09 -2.35 -0.02 0.00 0.10 0.00 0.00 34.13 31.76 2zqb s GLU 36 CO 0.02 0.54 -0.06 -1.64 0.02 0.00 0.00 175.26 174.14 2zqb s MET 37 N -1.88 0.47 0.33 1.61 -1.94 -0.46 -5.01 119.30 112.41 2zqb s MET 37 Ca 0.19 -0.75 -0.16 0.00 -1.71 0.00 0.00 55.69 53.26 2zqb s MET 37 Cb -0.11 -0.13 0.03 0.00 2.01 0.00 0.00 34.83 36.63 2zqb s MET 37 CO 0.11 0.01 0.70 -1.54 -0.01 0.00 0.00 175.02 174.29 2zqb s SER 38 N -1.66 -0.02 -0.12 3.03 1.04 -1.26 -1.39 113.70 113.32 2zqb s SER 38 Ca -0.10 -0.96 -0.30 0.00 0.48 0.00 0.00 55.95 55.06 2zqb s SER 38 Cb -0.09 0.76 0.11 0.00 0.10 0.00 0.00 66.02 66.90 2zqb s SER 38 CO -0.01 -1.48 0.89 -0.83 0.98 0.00 0.00 173.24 172.80 2zqb s GLY 39 N -3.03 -0.38 -0.02 7.32 0.00 -1.10 -4.94 107.32 105.17 2zqb s GLY 39 Ca 0.16 1.75 0.05 0.00 0.00 0.00 0.00 44.72 46.68 2zqb s GLY 39 CO 0.10 0.97 -0.18 -0.32 0.00 0.00 0.00 173.10 173.67 2zqb s GLY 40 N -1.21 0.91 0.03 0.20 0.00 -1.26 -1.54 107.32 104.46 2zqb s GLY 40 Ca -0.04 -0.78 0.06 0.00 0.00 0.00 0.00 44.72 43.96 2zqb s GLY 40 CO 0.04 -0.61 -0.18 -1.36 0.00 0.00 0.00 173.10 170.99 2zqb s PHE 41 N -0.35 1.59 0.08 1.90 0.08 0.16 -4.38 117.98 117.06 2zqb s PHE 41 Ca 0.05 -0.35 -0.18 0.00 0.12 0.00 0.00 56.93 56.57 2zqb s PHE 41 Cb -0.08 -0.96 -0.09 0.00 -0.57 0.00 0.00 43.02 41.32 2zqb s PHE 41 CO -0.00 0.05 1.47 0.66 -0.10 0.00 0.00 175.22 177.30 2zqb h SER 42 N 5.05 0.49 -3.28 1.36 4.64 -1.09 0.13 113.55 120.84 2zqb h SER 42 Ca -0.40 -0.37 -0.52 0.00 -0.47 0.00 0.00 61.79 60.03 2zqb h SER 42 Cb 1.16 -0.13 -0.38 0.00 -0.31 0.00 0.00 62.40 62.74 2zqb h SER 42 CO 0.45 0.75 -0.78 -0.22 -0.87 0.00 0.00 176.83 176.15 2zqb s LEU 43 N -9.32 1.25 0.00 5.97 2.96 -1.26 -2.40 118.68 115.88 2zqb s LEU 43 Ca -0.14 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.25 2zqb s LEU 43 Cb 0.07 -0.73 0.00 0.00 0.50 0.00 0.00 46.19 46.03 2zqb s LEU 43 CO 0.76 -0.21 0.00 1.07 -1.32 0.00 0.00 176.35 176.66 2zqb n THR 44 N 4.98 0.00 -4.22 3.68 5.66 -0.52 -4.44 114.28 119.42 2zqb n THR 44 Ca -0.10 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.75 2zqb n THR 44 Cb 0.48 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.16 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 -2.66 1.08 0.24 1.09 -4.23 -1.26 -2.44 115.64 107.46 2zqb s THR 45 Ca 0.00 -1.87 -0.04 0.00 -1.18 0.00 0.00 61.69 58.59 2zqb s THR 45 Cb 0.00 -1.64 0.21 0.00 1.34 0.00 0.00 72.50 72.41 2zqb s THR 45 CO 0.00 -0.66 1.74 -1.13 -0.54 0.00 0.00 174.62 174.04 2zqb h ASN 46 N 3.14 0.34 -0.21 3.99 -1.24 -1.88 -2.81 115.58 116.90 2zqb h ASN 46 Ca -0.37 0.10 -0.11 0.00 0.71 0.00 0.00 56.30 56.63 2zqb h ASN 46 Cb 1.19 0.06 -0.00 0.00 0.73 0.00 0.00 38.32 40.30 2zqb h ASN 46 CO 0.59 0.15 -0.28 0.78 -1.29 0.00 0.00 177.43 177.37 2zqb h ASN 47 N 0.49 0.61 -0.50 1.15 -0.26 -1.97 -2.11 115.58 112.99 2zqb h ASN 47 Ca 0.41 -0.51 0.03 0.00 -0.56 0.00 0.00 56.30 55.67 2zqb h ASN 47 Cb 0.58 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.64 2zqb h ASN 47 CO -0.37 1.00 0.33 0.03 -1.06 0.00 0.00 177.43 177.36 2zqb h ARG 48 N 0.25 0.55 0.14 0.81 3.08 -1.96 -2.50 114.38 114.75 2zqb h ARG 48 Ca 0.02 -0.03 -0.29 0.00 0.07 0.00 0.00 59.98 59.75 2zqb h ARG 48 Cb 0.85 -0.12 0.02 0.00 0.08 0.00 0.00 29.97 30.80 2zqb h ARG 48 CO 0.07 0.36 -1.27 0.52 -1.07 0.00 0.00 179.97 178.58 2zqb h MET 49 N 0.57 0.45 -0.03 0.04 2.86 -1.34 0.18 114.93 117.65 2zqb h MET 49 Ca 0.20 -0.67 0.01 0.00 -2.06 0.00 0.00 59.70 57.18 2zqb h MET 49 Cb 0.10 0.24 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2zqb h MET 49 CO -0.05 1.30 0.03 0.93 1.06 0.00 0.00 176.91 180.18 2zqb h GLU 50 N 0.16 0.00 0.12 1.72 5.08 -1.15 -2.58 114.58 117.94 2zqb h GLU 50 Ca -0.17 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.84 2zqb h GLU 50 Cb 1.96 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.19 2zqb h GLU 50 CO 0.23 0.00 -1.89 1.25 -1.00 0.00 0.00 179.01 177.60 2zqb h LEU 51 N 0.00 0.41 -1.63 1.33 6.46 -1.27 -3.33 115.31 117.28 2zqb h LEU 51 Ca 0.02 -0.83 -0.03 0.00 -0.12 0.00 0.00 57.88 56.93 2zqb h LEU 51 Cb 0.07 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 2zqb h LEU 51 CO -0.00 1.73 -0.04 0.25 -0.62 0.00 0.00 178.44 179.76 2zqb h LEU 52 N 0.07 0.17 0.31 2.25 5.85 -0.46 -3.14 115.31 120.37 2zqb h LEU 52 Ca -0.38 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 2zqb h LEU 52 Cb 2.05 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 43.01 2zqb h LEU 52 CO 0.11 0.24 -0.36 0.00 -0.34 0.00 0.00 178.44 178.09 2zqb h ALA 53 N 1.78 -1.01 -0.16 1.25 0.00 -1.57 -0.16 119.26 119.39 2zqb h ALA 53 Ca 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2zqb h ALA 53 Cb 0.19 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2zqb h ALA 53 CO 0.01 -1.05 0.01 -1.00 0.00 0.00 0.00 179.25 177.22 2zqb h PRO 54 N -0.69 0.22 0.24 0.00 0.13 -1.75 -1.99 132.00 128.16 2zqb h PRO 54 Ca -0.04 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 2zqb h PRO 54 Cb 0.61 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.70 2zqb h PRO 54 CO -0.07 0.23 -0.12 0.82 -0.23 0.00 0.00 178.00 178.64 2zqb h ILE 55 N 0.22 0.81 -0.57 -3.56 2.04 -1.22 -0.61 117.51 114.61 2zqb h ILE 55 Ca 0.05 -0.29 0.06 0.00 1.00 0.00 0.00 64.86 65.69 2zqb h ILE 55 Cb 0.14 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 2zqb h ILE 55 CO 0.00 0.06 0.28 0.58 0.00 0.00 0.00 178.15 179.08 2zqb h VAL 56 N -0.47 0.92 -0.93 1.67 2.07 -0.87 0.29 116.25 118.94 2zqb h VAL 56 Ca -0.03 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2zqb h VAL 56 Cb 0.35 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2zqb h VAL 56 CO 0.05 0.10 0.57 0.00 0.02 0.00 0.00 177.57 178.31 2zqb h ALA 57 N 1.32 1.18 0.12 1.67 0.00 -1.21 -1.90 119.26 120.44 2zqb h ALA 57 Ca 0.26 -0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.83 2zqb h ALA 57 Cb 0.20 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2zqb h ALA 57 CO -0.20 0.63 -1.22 -0.07 0.00 0.00 0.00 179.25 178.39 2zqb h LEU 58 N 1.27 0.40 -2.55 0.00 3.38 -0.35 -3.13 115.31 114.32 2zqb h LEU 58 Ca 0.33 -0.88 0.01 0.00 0.09 0.00 0.00 57.88 57.43 2zqb h LEU 58 Cb -0.07 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2zqb h LEU 58 CO -0.06 1.54 0.13 -0.33 0.09 0.00 0.00 178.44 179.81 2zqb h GLU 59 N -0.34 0.00 0.00 1.13 5.08 -0.45 -2.23 114.58 117.77 2zqb h GLU 59 Ca -0.25 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.06 2zqb h GLU 59 Cb 1.71 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 2zqb h GLU 59 CO 0.08 0.00 -0.21 0.00 -1.00 0.00 0.00 179.01 177.88 2zqb h ALA 60 N 1.75 1.04 -2.80 3.43 0.00 -1.28 -3.45 119.26 117.95 2zqb h ALA 60 Ca 0.01 -0.19 -0.52 0.00 0.00 0.00 0.00 54.91 54.21 2zqb h ALA 60 Cb 0.28 -0.03 0.07 0.00 0.00 0.00 0.00 17.79 18.11 2zqb h ALA 60 CO -0.00 0.27 0.55 -0.51 0.00 0.00 0.00 179.25 179.56 2zqb s LEU 61 N -6.82 4.18 -0.02 0.00 1.43 -0.84 -4.92 118.68 111.69 2zqb s LEU 61 Ca 0.00 2.49 0.20 0.00 -1.03 0.00 0.00 54.13 55.79 2zqb s LEU 61 Cb 0.10 -3.99 -0.29 0.00 0.03 0.00 0.00 46.19 42.04 2zqb s LEU 61 CO 0.63 -0.80 0.51 0.29 0.23 0.00 0.00 176.35 177.21 2zqb n LYS 62 N 0.02 0.61 -3.96 1.70 5.02 -1.26 -4.97 118.16 115.32 2zqb n LYS 62 Ca 0.04 -0.14 -0.08 0.00 -2.02 0.00 0.00 58.31 56.11 2zqb n LYS 62 Cb 0.45 -1.46 -0.08 0.00 -0.02 0.00 0.00 35.03 33.92 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 -3.27 0.80 0.21 1.97 -1.05 -1.26 -5.14 118.70 110.96 2zqb s GLU 63 Ca -0.04 -1.09 -0.32 0.00 -0.15 0.00 0.00 54.97 53.37 2zqb s GLU 63 Cb 0.13 0.30 -0.14 0.00 -0.44 0.00 0.00 34.13 33.97 2zqb s GLU 63 CO 0.82 -0.23 1.30 -0.35 0.95 0.00 0.00 175.26 177.75 2zqb n PRO 64 N -0.02 1.63 -3.90 -4.83 -0.04 -1.26 -5.03 135.00 121.56 2zqb n PRO 64 Ca -0.14 0.58 -0.09 0.00 -0.04 0.00 0.00 63.50 63.81 2zqb n PRO 64 Cb 0.62 -2.17 -0.07 0.00 -0.04 0.00 0.00 33.50 31.84 2zqb n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2zqb s LYS 66 N -3.90 4.38 -0.06 0.00 2.20 -1.13 -1.42 119.74 119.80 2zqb s LYS 66 Ca 0.10 1.57 0.03 0.00 -0.36 0.00 0.00 55.97 57.31 2zqb s LYS 66 Cb 0.04 -3.55 -0.02 0.00 -1.51 0.00 0.00 37.83 32.79 2zqb s LYS 66 CO -0.07 -0.40 -0.14 0.42 -0.36 0.00 0.00 175.35 174.80 2zqb s ILE 67 N 2.15 3.05 -0.23 5.43 1.09 -0.01 -1.90 121.20 130.79 2zqb s ILE 67 Ca 0.53 -0.72 -0.06 0.00 -1.10 0.00 0.00 60.65 59.30 2zqb s ILE 67 Cb -0.22 -2.20 -0.02 0.00 -1.06 0.00 0.00 42.46 38.95 2zqb s ILE 67 CO 0.20 0.58 0.02 -0.63 -0.10 0.00 0.00 174.94 175.02 2zqb s ILE 68 N -0.60 3.96 -0.24 2.92 1.01 -0.42 -1.90 121.20 125.93 2zqb s ILE 68 Ca 0.09 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.46 2zqb s ILE 68 Cb -0.11 -2.83 0.05 0.00 0.01 0.00 0.00 42.46 39.58 2zqb s ILE 68 CO 0.01 0.38 -0.11 -0.22 0.00 0.00 0.00 174.94 175.00 2zqb s LEU 69 N 1.46 3.00 -0.18 2.97 0.20 0.24 -0.38 118.68 125.99 2zqb s LEU 69 Ca 0.05 -1.21 -0.07 0.00 0.69 0.00 0.00 54.13 53.59 2zqb s LEU 69 Cb -0.15 -1.44 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 2zqb s LEU 69 CO 0.01 -0.17 0.06 -0.89 -0.29 0.00 0.00 176.35 175.08 2zqb s THR 70 N 1.21 4.82 -0.27 3.68 2.01 -0.37 -0.35 115.64 126.37 2zqb s THR 70 Ca -0.06 -0.02 -0.17 0.00 0.31 0.00 0.00 61.69 61.75 2zqb s THR 70 Cb -0.19 -3.17 0.08 0.00 0.01 0.00 0.00 72.50 69.23 2zqb s THR 70 CO -0.07 0.47 0.68 -0.94 -0.69 0.00 0.00 174.62 174.07 2zqb s SER 71 N 0.31 -0.91 -1.15 3.53 1.04 -0.92 -2.79 113.70 112.82 2zqb s SER 71 Ca 0.04 1.48 -0.08 0.00 0.48 0.00 0.00 55.95 57.87 2zqb s SER 71 Cb -0.12 1.37 0.26 0.00 0.10 0.00 0.00 66.02 67.62 2zqb s SER 71 CO 0.00 -0.24 1.43 -0.90 0.98 0.00 0.00 173.24 174.51 2zqb n ASP 72 N 4.12 5.75 -3.31 7.02 3.85 -1.21 -3.45 116.55 129.32 2zqb n ASP 72 Ca -0.19 -3.18 -0.17 0.00 -0.71 0.00 0.00 54.79 50.53 2zqb n ASP 72 Cb 0.58 -1.38 -0.07 0.00 -1.35 0.00 0.00 41.12 38.90 2zqb n ASP 72 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 2zqb s SER 73 N 0.30 0.99 0.37 -1.12 0.15 -1.26 -4.90 113.70 108.24 2zqb s SER 73 Ca 0.34 -1.85 0.18 0.00 0.70 0.00 0.00 55.95 55.32 2zqb s SER 73 Cb -0.00 0.52 1.17 0.00 -1.71 0.00 0.00 66.02 65.99 2zqb s SER 73 CO 0.02 -0.22 1.67 1.56 1.20 0.00 0.00 173.24 177.46 2zqb h GLN 74 N 6.63 0.27 -1.03 5.44 1.08 -1.96 0.79 115.11 126.33 2zqb h GLN 74 Ca 0.09 -0.02 0.30 0.00 -1.45 0.00 0.00 58.65 57.57 2zqb h GLN 74 Cb 1.04 -0.06 -0.13 0.00 -0.05 0.00 0.00 27.48 28.28 2zqb h GLN 74 CO 0.21 0.18 0.62 -0.92 -0.95 0.00 0.00 178.83 177.96 2zqb h TYR 75 N 0.28 0.89 0.09 2.96 3.20 -1.99 -2.30 116.97 120.10 2zqb h TYR 75 Ca 0.74 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 62.37 2zqb h TYR 75 Cb 1.85 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.86 2zqb h TYR 75 CO -0.01 -0.06 -1.43 0.28 -1.64 0.00 0.00 178.16 175.31 2zqb h VAL 76 N 0.41 0.97 -0.95 1.81 2.07 0.25 -3.12 116.25 117.68 2zqb h VAL 76 Ca 0.69 -2.35 0.16 0.00 0.82 0.00 0.00 66.70 66.02 2zqb h VAL 76 Cb 1.56 2.62 -0.16 0.00 -1.52 0.00 0.00 31.29 33.79 2zqb h VAL 76 CO -0.50 0.66 -0.33 -1.14 0.02 0.00 0.00 177.57 176.28 2zqb n ARG 77 N -3.97 -0.19 0.21 1.57 0.63 -1.16 -0.76 116.66 113.01 2zqb n ARG 77 Ca -0.27 1.47 0.08 0.00 -0.92 0.00 0.00 57.85 58.21 2zqb n ARG 77 Cb 0.87 -2.18 0.47 0.00 0.45 0.00 0.00 32.46 32.07 2zqb n ARG 77 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 2zqb h GLN 78 N 0.00 0.00 0.04 -0.14 5.75 -1.51 0.46 115.11 119.70 2zqb h GLN 78 Ca 0.36 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.86 2zqb h GLN 78 Cb 0.60 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.15 2zqb h GLN 78 CO -0.95 0.28 -0.02 0.78 -2.65 0.00 0.00 178.83 176.27 2zqb h GLY 79 N 1.56 -0.05 1.59 2.39 0.00 -1.24 -1.53 103.07 105.79 2zqb h GLY 79 Ca -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 2zqb h GLY 79 CO 0.04 -0.02 -0.41 0.16 0.00 0.00 0.00 176.54 176.31 2zqb h ILE 80 N -0.86 0.01 0.04 2.60 -0.00 -0.86 -2.11 117.51 116.32 2zqb h ILE 80 Ca -0.01 -1.01 -0.00 0.00 -0.00 0.00 0.00 64.86 63.84 2zqb h ILE 80 Cb 0.69 1.80 0.00 0.00 -0.00 0.00 0.00 36.82 39.31 2zqb h ILE 80 CO 0.01 0.00 -0.02 0.24 -0.00 0.00 0.00 178.15 178.38 2zqb h MET 81 N 0.00 -0.05 0.00 0.16 0.00 -0.19 -3.45 114.93 111.40 2zqb h MET 81 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.70 2zqb h MET 81 Cb 1.00 0.01 0.00 0.00 0.00 0.00 0.00 31.60 32.61 2zqb h MET 81 CO 0.00 0.33 -0.39 2.41 0.00 0.00 0.00 176.91 179.26 2zqb n THR 82 N -4.93 0.00 0.00 2.22 -1.04 -0.81 -4.91 114.28 104.81 2zqb n THR 82 Ca -0.08 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.71 2zqb n THR 82 Cb 0.21 -0.21 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 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 0.43 -0.38 -1.42 6.55 -1.24 -3.40 115.95 116.50 2zqb h TRP 83 Ca 0.00 -0.31 0.00 0.00 0.95 0.00 0.00 58.89 59.53 2zqb h TRP 83 Cb 0.39 -0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.65 2zqb h TRP 83 CO 0.00 1.58 0.25 0.82 -1.05 0.00 0.00 178.44 180.03 2zqb h ILE 84 N -0.29 1.10 -0.73 1.49 2.04 -1.64 -1.88 117.51 117.59 2zqb h ILE 84 Ca -0.32 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 2zqb h ILE 84 Cb 1.77 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 2zqb h ILE 84 CO 0.05 0.10 0.21 1.12 0.00 0.00 0.00 178.15 179.63 2zqb h HIS 85 N 0.51 1.20 -0.64 1.37 2.07 -1.85 0.66 115.15 118.47 2zqb h HIS 85 Ca 0.14 -0.13 -0.05 0.00 -2.85 0.00 0.00 60.37 57.48 2zqb h HIS 85 Cb -0.05 -0.34 -0.03 0.00 2.57 0.00 0.00 27.41 29.56 2zqb h HIS 85 CO -0.05 0.95 0.21 0.78 -3.07 0.00 0.00 177.93 176.76 2zqb h GLY 86 N 1.09 1.05 0.84 6.13 0.00 -1.71 -1.24 103.07 109.24 2zqb h GLY 86 Ca 0.23 -0.61 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 2zqb h GLY 86 CO -0.00 0.57 -0.02 1.49 0.00 0.00 0.00 176.54 178.58 2zqb h TRP 87 N 0.91 0.48 -0.88 5.60 6.55 -0.54 -2.63 115.95 125.45 2zqb h TRP 87 Ca 0.21 -0.09 0.01 0.00 0.95 0.00 0.00 58.89 59.96 2zqb h TRP 87 Cb 0.27 -0.12 -0.04 0.00 -0.86 0.00 0.00 29.16 28.41 2zqb h TRP 87 CO 0.02 0.63 0.58 -0.22 -1.05 0.00 0.00 178.44 178.40 2zqb h LYS 88 N 0.19 1.17 -0.69 0.49 3.64 -0.74 0.49 116.57 121.12 2zqb h LYS 88 Ca 0.06 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2zqb h LYS 88 Cb 0.46 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.98 2zqb h LYS 88 CO 0.02 0.78 0.43 -0.22 -2.27 0.00 0.00 179.45 178.19 2zqb h LYS 89 N 1.20 0.92 -0.91 1.90 3.64 -0.99 -2.16 116.57 120.16 2zqb h LYS 89 Ca 0.32 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.58 2zqb h LYS 89 Cb -0.12 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.46 2zqb h LYS 89 CO -0.07 0.63 0.07 0.09 -2.27 0.00 0.00 179.45 177.91 2zqb n ASN 90 N -4.41 2.78 -3.97 4.20 4.13 -1.01 -4.90 115.26 112.08 2zqb n ASN 90 Ca 0.07 -2.38 -0.28 0.00 1.68 0.00 0.00 54.58 53.67 2zqb n ASN 90 Cb 0.05 -0.58 -0.02 0.00 -1.54 0.00 0.00 39.78 37.70 2zqb n ASN 90 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2zqb n GLY 91 N 0.12 -0.36 3.91 7.41 0.00 -0.81 -3.22 105.19 112.25 2zqb n GLY 91 Ca 0.13 0.21 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 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 -4.44 -2.19 -3.68 1.61 7.02 0.17 -4.94 117.44 110.99 2zqb n TRP 92 Ca -0.27 0.89 -0.15 0.00 -1.02 0.00 0.00 57.50 56.95 2zqb n TRP 92 Cb 0.67 -3.96 -0.08 0.00 -2.42 0.00 0.00 31.31 25.52 2zqb n TRP 92 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2zqb s MET 93 N -6.56 0.74 0.23 -0.99 0.23 -1.20 -3.66 119.30 108.10 2zqb s MET 93 Ca 0.56 0.22 -0.03 0.00 -1.03 0.00 0.00 55.69 55.41 2zqb s MET 93 Cb -0.28 0.34 0.04 0.00 -1.53 0.00 0.00 34.83 33.40 2zqb s MET 93 CO 0.84 -0.18 0.09 0.25 -2.03 0.00 0.00 175.02 173.98 2zqb n THR 94 N 1.69 0.00 0.15 3.16 -2.24 0.66 -4.81 114.28 112.90 2zqb n THR 94 Ca -0.18 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.65 2zqb n THR 94 Cb 0.56 -0.10 0.08 0.00 -2.10 0.00 0.00 70.33 68.78 2zqb n THR 94 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2zqb n SER 95 N -0.99 2.27 -3.03 3.42 3.41 -1.26 -3.74 113.62 113.69 2zqb n SER 95 Ca 0.01 -1.68 -0.17 0.00 -0.26 0.00 0.00 58.87 56.77 2zqb n SER 95 Cb 0.06 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 2zqb n SER 95 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2zqb n ASN 96 N 0.47 1.47 0.00 4.04 5.15 -1.26 -5.06 115.26 120.07 2zqb n ASN 96 Ca 0.08 -3.05 0.00 0.00 -0.60 0.00 0.00 54.58 51.01 2zqb n ASN 96 Cb 0.32 -0.59 0.00 0.00 -0.53 0.00 0.00 39.78 38.98 2zqb n ASN 96 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2zqb n GLY 97 N 0.13 2.82 3.58 8.20 0.00 -1.25 -5.02 105.19 113.65 2zqb n GLY 97 Ca 0.23 -0.67 -0.55 0.00 0.00 0.00 0.00 46.02 45.04 2zqb n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2zqb n THR 98 N 0.00 0.02 -2.53 2.61 -2.24 -1.26 -4.72 114.28 106.15 2zqb n THR 98 Ca 0.00 -0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.41 2zqb n THR 98 Cb 0.00 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 67.56 2zqb n THR 98 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2zqb s PRO 99 N 0.62 4.15 0.50 -0.78 0.02 -1.26 -0.24 135.00 138.00 2zqb s PRO 99 Ca 0.87 1.52 -0.21 0.00 0.02 0.00 0.00 61.00 63.20 2zqb s PRO 99 Cb -1.05 -2.53 -0.09 0.00 0.02 0.00 0.00 34.50 30.84 2zqb s PRO 99 CO 0.51 -0.16 0.78 1.33 -0.33 0.00 0.00 177.00 179.14 2zqb n VAL 100 N -0.10 2.53 -1.69 3.83 0.24 -1.24 -4.66 118.33 117.25 2zqb n VAL 100 Ca 0.05 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.34 61.41 2zqb n VAL 100 Cb 0.50 -0.91 -0.03 0.00 -1.47 0.00 0.00 33.84 31.92 2zqb n VAL 100 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2zqb n LYS 101 N -0.06 2.25 -2.44 7.34 4.81 -1.26 -2.57 118.16 126.22 2zqb n LYS 101 Ca 0.11 0.81 -0.21 0.00 -0.87 0.00 0.00 58.31 58.15 2zqb n LYS 101 Cb 0.43 -2.54 -0.01 0.00 0.02 0.00 0.00 35.03 32.94 2zqb n LYS 101 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2zqb n ASN 102 N 2.71 -5.87 -0.06 3.14 3.02 -1.26 -4.89 115.26 112.05 2zqb n ASN 102 Ca 0.13 -0.03 0.06 0.00 -0.03 0.00 0.00 54.58 54.71 2zqb n ASN 102 Cb 0.32 -4.88 0.42 0.00 -0.61 0.00 0.00 39.78 35.03 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 -0.09 1.05 -1.00 2.41 3.04 -1.86 -0.12 116.25 119.69 2zqb h VAL 103 Ca -0.49 -0.20 0.21 0.00 -1.01 0.00 0.00 66.70 65.21 2zqb h VAL 103 Cb 1.36 0.42 -0.10 0.00 -2.01 0.00 0.00 31.29 30.96 2zqb h VAL 103 CO 0.58 0.11 0.62 -2.24 -1.01 0.00 0.00 177.57 175.62 2zqb h ASP 104 N 0.58 0.68 0.00 3.17 2.03 -1.90 0.77 116.42 121.75 2zqb h ASP 104 Ca 0.21 0.09 -0.02 0.00 -0.73 0.00 0.00 57.03 56.58 2zqb h ASP 104 Cb 0.12 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 38.59 2zqb h ASP 104 CO -0.05 0.21 -0.15 -0.07 -1.03 0.00 0.00 179.24 178.14 2zqb h LEU 105 N 0.64 0.00 -0.77 0.15 3.38 -1.45 -3.18 115.31 114.08 2zqb h LEU 105 Ca 0.58 -0.67 0.12 0.00 0.09 0.00 0.00 57.88 57.99 2zqb h LEU 105 Cb 1.07 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.74 2zqb h LEU 105 CO -0.36 0.92 0.38 -0.50 0.09 0.00 0.00 178.44 178.98 2zqb h TRP 106 N -1.00 0.68 -0.39 1.13 4.06 -1.21 -0.47 115.95 118.76 2zqb h TRP 106 Ca -0.04 0.03 0.07 0.00 2.06 0.00 0.00 58.89 61.02 2zqb h TRP 106 Cb 0.78 -0.19 -0.07 0.00 -1.00 0.00 0.00 29.16 28.68 2zqb h TRP 106 CO 0.18 0.20 -0.05 0.87 -3.56 0.00 0.00 178.44 176.08 2zqb h LYS 107 N 0.61 0.05 -0.38 0.49 1.57 -0.97 0.56 116.57 118.49 2zqb h LYS 107 Ca 0.40 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.13 2zqb h LYS 107 Cb 0.49 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2zqb h LYS 107 CO -0.31 0.03 0.06 0.00 -0.57 0.00 0.00 179.45 178.66 2zqb h ARG 108 N 0.05 0.58 -0.04 3.15 3.08 -1.37 0.23 114.38 120.06 2zqb h ARG 108 Ca 0.19 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 2zqb h ARG 108 Cb 0.28 -0.09 0.01 0.00 0.08 0.00 0.00 29.97 30.25 2zqb h ARG 108 CO -0.36 0.56 -0.44 1.25 -1.07 0.00 0.00 179.97 179.91 2zqb h LEU 109 N 0.56 0.46 -0.15 3.04 5.85 -0.01 -2.07 115.31 122.98 2zqb h LEU 109 Ca 0.13 -0.71 0.05 0.00 0.84 0.00 0.00 57.88 58.18 2zqb h LEU 109 Cb 0.27 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2zqb h LEU 109 CO 0.00 1.10 -0.17 -0.78 -0.34 0.00 0.00 178.44 178.26 2zqb h ASP 110 N -0.15 -0.52 0.02 1.25 3.58 0.16 -0.94 116.42 119.82 2zqb h ASP 110 Ca -0.04 0.10 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 2zqb h ASP 110 Cb 1.13 0.25 -0.00 0.00 1.72 0.00 0.00 39.33 42.43 2zqb h ASP 110 CO 0.09 -0.21 -0.02 0.50 -2.88 0.00 0.00 179.24 176.72 2zqb h LYS 111 N -0.20 0.00 0.00 0.28 3.64 -0.90 -2.67 116.57 116.72 2zqb h LYS 111 Ca 0.10 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.30 2zqb h LYS 111 Cb 0.35 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 2zqb h LYS 111 CO -0.27 0.02 -1.48 0.00 -2.27 0.00 0.00 179.45 175.45 2zqb n ALA 112 N -2.53 1.88 0.06 5.00 0.00 -0.79 -3.77 120.51 120.36 2zqb n ALA 112 Ca -0.03 -0.59 -0.09 0.00 0.00 0.00 0.00 53.44 52.74 2zqb n ALA 112 Cb 0.10 -0.93 0.04 0.00 0.00 0.00 0.00 19.45 18.67 2zqb n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zqb h ALA 113 N 1.37 0.63 -0.91 0.00 0.00 -0.86 -2.94 119.26 116.56 2zqb h ALA 113 Ca -0.19 -0.60 0.05 0.00 0.00 0.00 0.00 54.91 54.16 2zqb h ALA 113 Cb 1.65 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 2zqb h ALA 113 CO 0.05 0.77 0.59 1.96 0.00 0.00 0.00 179.25 182.62 2zqb h GLN 114 N 0.25 1.07 0.00 0.00 1.08 -1.60 -1.73 115.11 114.17 2zqb h GLN 114 Ca -0.03 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 2zqb h GLN 114 Cb 1.29 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 28.47 2zqb h GLN 114 CO 0.12 0.71 0.00 1.28 -0.95 0.00 0.00 178.83 179.99 2zqb n LEU 115 N -4.46 0.00 -4.46 1.46 4.77 -1.11 -4.84 117.00 108.36 2zqb n LEU 115 Ca 0.13 0.31 -0.22 0.00 -0.03 0.00 0.00 56.01 56.20 2zqb n LEU 115 Cb 0.14 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 40.81 2zqb n LEU 115 CO 0.34 -0.10 -0.26 -1.00 -1.33 0.00 0.00 177.39 175.04 2zqb s HIS 116 N -2.62 1.94 -0.33 -1.77 3.76 -0.65 -4.65 115.29 110.96 2zqb s HIS 116 Ca 0.18 -0.99 -0.08 0.00 -0.15 0.00 0.00 55.06 54.02 2zqb s HIS 116 Cb 0.14 -1.28 0.02 0.00 1.11 0.00 0.00 32.58 32.58 2zqb s HIS 116 CO 0.32 -0.02 0.13 -1.14 -0.85 0.00 0.00 174.74 173.17 2zqb s GLN 117 N -3.87 2.85 -0.16 1.40 0.74 -0.51 -4.94 119.66 115.17 2zqb s GLN 117 Ca 0.35 -1.03 0.01 0.00 0.05 0.00 0.00 55.36 54.74 2zqb s GLN 117 Cb 0.08 -3.51 0.02 0.00 1.10 0.00 0.00 33.01 30.70 2zqb s GLN 117 CO 0.15 -0.59 -0.18 0.42 -0.55 0.00 0.00 175.29 174.54 2zqb s ILE 118 N 1.48 1.85 -0.35 -2.34 1.01 -1.26 -0.83 121.20 120.77 2zqb s ILE 118 Ca 0.01 -0.82 -0.13 0.00 0.00 0.00 0.00 60.65 59.71 2zqb s ILE 118 Cb -0.19 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.58 2zqb s ILE 118 CO 0.04 0.51 0.25 -0.62 0.00 0.00 0.00 174.94 175.12 2zqb s ASP 119 N 1.27 6.07 -0.02 3.58 2.15 -0.80 -5.00 116.67 123.92 2zqb s ASP 119 Ca 0.03 -0.48 -0.28 0.00 0.43 0.00 0.00 52.55 52.24 2zqb s ASP 119 Cb -0.13 -2.14 -0.03 0.00 -0.30 0.00 0.00 42.92 40.31 2zqb s ASP 119 CO -0.10 -0.27 0.88 0.26 -0.17 0.00 0.00 175.17 175.77 2zqb s TRP 120 N 1.72 3.63 -0.17 -5.34 0.52 -1.26 -0.59 118.94 117.45 2zqb s TRP 120 Ca 0.06 1.54 -0.06 0.00 0.02 0.00 0.00 56.10 57.66 2zqb s TRP 120 Cb -0.18 -3.01 -0.04 0.00 -1.15 0.00 0.00 33.47 29.10 2zqb s TRP 120 CO 0.10 0.02 0.03 1.03 0.02 0.00 0.00 176.95 178.16 2zqb s ARG 121 N 0.94 3.86 -0.16 4.98 1.81 0.53 -4.89 118.95 126.03 2zqb s ARG 121 Ca 0.47 -0.39 -0.04 0.00 -1.72 0.00 0.00 55.73 54.05 2zqb s ARG 121 Cb -0.20 -3.12 -0.03 0.00 -0.45 0.00 0.00 34.95 31.15 2zqb s ARG 121 CO 0.24 0.29 -0.03 -1.58 -0.68 0.00 0.00 175.30 173.54 2zqb s TRP 122 N 0.31 3.03 0.02 -0.53 0.52 -1.26 -2.16 118.94 118.86 2zqb s TRP 122 Ca 0.02 -0.32 0.00 0.00 0.02 0.00 0.00 56.10 55.82 2zqb s TRP 122 Cb -0.13 -1.98 -0.02 0.00 -1.15 0.00 0.00 33.47 30.20 2zqb s TRP 122 CO 0.01 -0.07 -0.04 0.08 0.02 0.00 0.00 176.95 176.96 2zqb s VAL 123 N 0.46 0.18 -0.21 4.03 1.01 -1.22 -4.98 120.40 119.67 2zqb s VAL 123 Ca -0.03 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 2zqb s VAL 123 Cb -0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.93 2zqb s VAL 123 CO 0.03 -0.43 -0.06 -1.59 0.00 0.00 0.00 175.10 173.04 2zqb s LYS 124 N -1.35 3.37 0.17 2.72 -2.85 -1.26 -3.35 119.74 117.19 2zqb s LYS 124 Ca -0.14 -0.64 0.06 0.00 -1.00 0.00 0.00 55.97 54.26 2zqb s LYS 124 Cb -0.09 -2.95 -0.04 0.00 -2.06 0.00 0.00 37.83 32.68 2zqb s LYS 124 CO -0.01 -0.14 -0.13 0.20 0.10 0.00 0.00 175.35 175.37 2zqb s GLY 125 N 1.32 1.25 0.00 0.59 0.00 -1.26 -5.08 107.32 104.14 2zqb s GLY 125 Ca 0.04 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 43.21 2zqb s GLY 125 CO -0.03 -1.65 0.00 0.00 0.00 0.00 0.00 173.10 171.43 2zqb n ALA 130 N -0.20 0.00 0.29 3.20 0.00 -1.26 -5.04 120.51 117.51 2zqb n ALA 130 Ca -0.10 -0.01 0.15 0.00 0.00 0.00 0.00 53.44 53.49 2zqb n ALA 130 Cb 0.60 0.00 0.89 0.00 0.00 0.00 0.00 19.45 20.94 2zqb n ALA 130 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2zqb h GLU 131 N 0.00 0.00 -0.10 0.00 3.07 -2.02 -0.65 114.58 114.88 2zqb h GLU 131 Ca 0.00 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.71 2zqb h GLU 131 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2zqb h GLU 131 CO 0.00 0.04 -0.61 -0.91 -1.40 0.00 0.00 179.01 176.14 2zqb h ASN 132 N 0.00 0.38 -0.62 1.42 4.21 -1.95 -1.26 115.58 117.75 2zqb h ASN 132 Ca -0.00 -0.21 0.05 0.00 1.21 0.00 0.00 56.30 57.35 2zqb h ASN 132 Cb 0.14 -0.11 -0.05 0.00 -1.12 0.00 0.00 38.32 37.18 2zqb h ASN 132 CO 0.01 0.89 0.34 -0.33 -1.29 0.00 0.00 177.43 177.05 2zqb h GLU 133 N 0.25 0.63 0.06 0.81 5.08 -1.56 -0.12 114.58 119.72 2zqb h GLU 133 Ca -0.01 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2zqb h GLU 133 Cb 1.13 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2zqb h GLU 133 CO 0.10 0.41 -0.03 -0.09 -1.00 0.00 0.00 179.01 178.40 2zqb h ARG 134 N 0.64 -0.08 -0.69 2.33 9.65 -0.92 0.59 114.38 125.91 2zqb h ARG 134 Ca 0.28 0.01 0.15 0.00 -1.10 0.00 0.00 59.98 59.31 2zqb h ARG 134 Cb 0.16 0.02 -0.12 0.00 -1.39 0.00 0.00 29.97 28.64 2zqb h ARG 134 CO -0.17 0.11 0.02 0.00 2.80 0.00 0.00 179.97 182.73 2zqb h HIS 136 N 0.12 1.08 -0.29 0.00 -0.00 -0.27 -0.75 115.15 115.05 2zqb h HIS 136 Ca 0.37 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.74 2zqb h HIS 136 Cb 0.62 -0.35 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 2zqb h HIS 136 CO -0.38 0.74 0.15 1.96 -0.00 0.00 0.00 177.93 180.40 2zqb h GLN 137 N 1.11 0.30 -0.54 5.26 7.50 0.58 -2.68 115.11 126.64 2zqb h GLN 137 Ca 0.28 -0.02 0.04 0.00 0.50 0.00 0.00 58.65 59.46 2zqb h GLN 137 Cb 0.01 -0.07 -0.04 0.00 0.05 0.00 0.00 27.48 27.43 2zqb h GLN 137 CO -0.05 0.20 0.29 -0.07 -1.50 0.00 0.00 178.83 177.70 2zqb h LEU 138 N 0.31 0.43 -0.18 1.46 3.38 -0.32 -2.63 115.31 117.75 2zqb h LEU 138 Ca 0.12 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 2zqb h LEU 138 Cb 0.03 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2zqb h LEU 138 CO -0.08 0.30 -0.20 0.00 0.09 0.00 0.00 178.44 178.55 2zqb h ALA 139 N 1.28 0.26 0.24 1.53 0.00 -1.10 0.47 119.26 121.95 2zqb h ALA 139 Ca 0.24 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2zqb h ALA 139 Cb 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2zqb h ALA 139 CO -0.15 0.20 -0.12 -0.09 0.00 0.00 0.00 179.25 179.09 2zqb h ARG 140 N 0.10 -0.32 -0.57 0.00 2.43 -1.48 -0.19 114.38 114.36 2zqb h ARG 140 Ca 0.03 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.33 2zqb h ARG 140 Cb 0.75 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 30.26 2zqb h ARG 140 CO 0.05 -0.19 -0.14 0.00 -1.51 0.00 0.00 179.97 178.18 2zqb h ALA 141 N 0.39 0.38 -0.56 2.80 0.00 -1.49 0.14 119.26 120.92 2zqb h ALA 141 Ca -0.03 0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2zqb h ALA 141 Cb 0.28 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2zqb h ALA 141 CO 0.05 -0.43 0.18 0.00 0.00 0.00 0.00 179.25 179.05 2zqb h ALA 142 N 1.57 0.73 -0.76 0.00 0.00 -0.44 -1.69 119.26 118.68 2zqb h ALA 142 Ca 0.27 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 55.16 2zqb h ALA 142 Cb 0.42 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 2zqb h ALA 142 CO -0.59 0.39 0.51 0.00 0.00 0.00 0.00 179.25 179.57 2zqb h ALA 143 N 1.04 2.26 -0.01 0.00 0.00 -0.18 -2.48 119.26 119.88 2zqb h ALA 143 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2zqb h ALA 143 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2zqb h ALA 143 CO -0.01 -0.47 -0.11 0.39 0.00 0.00 0.00 179.25 179.05 2zqb n GLU 144 N -4.45 1.35 -1.31 0.00 1.02 0.41 -4.27 120.64 113.38 2zqb n GLU 144 Ca 0.15 -0.81 -0.31 0.00 -0.02 0.00 0.00 57.16 56.17 2zqb n GLU 144 Cb 0.61 -1.48 0.11 0.00 -0.02 0.00 0.00 31.44 30.65 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 -0.12 6.09 -3.69 0.62 0.00 -0.94 -4.83 120.51 117.64 2zqb n ALA 145 Ca 0.16 -3.33 -0.21 0.00 0.00 0.00 0.00 53.44 50.06 2zqb n ALA 145 Cb 0.36 -1.64 0.04 0.00 0.00 0.00 0.00 19.45 18.21 2zqb n ALA 145 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2zqb n ASN 146 N -0.98 -1.43 -4.77 0.00 3.02 -1.26 -4.87 115.26 104.96 2zqb n ASN 146 Ca 0.61 -0.80 -0.38 0.00 -0.03 0.00 0.00 54.58 53.98 2zqb n ASN 146 Cb 0.95 -4.13 -0.00 0.00 -0.61 0.00 0.00 39.78 35.98 2zqb n ASN 146 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2zqb s PRO 147 N -5.97 3.77 -0.01 3.52 0.04 -1.26 -4.90 135.00 130.19 2zqb s PRO 147 Ca 0.04 1.90 0.15 0.00 0.04 0.00 0.00 61.00 63.13 2zqb s PRO 147 Cb -0.02 -2.49 -0.20 0.00 0.04 0.00 0.00 34.50 31.83 2zqb s PRO 147 CO 0.81 -0.58 0.46 0.25 0.04 0.00 0.00 177.00 177.98 2zqb n THR 148 N -0.35 0.00 -1.73 1.26 -2.24 -1.26 -3.46 114.28 106.49 2zqb n THR 148 Ca 0.07 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 2zqb n THR 148 Cb 0.47 0.56 -0.00 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.70 2.30 -3.45 -0.78 7.27 -1.26 -4.60 117.38 115.16 2zqb n GLN 149 Ca -0.00 0.81 -0.37 0.00 0.07 0.00 0.00 57.00 57.51 2zqb n GLN 149 Cb 0.31 -2.47 -0.07 0.00 2.41 0.00 0.00 30.24 30.43 2zqb n GLN 149 CO 0.00 0.00 0.00 -1.50 0.07 0.00 0.00 177.06 175.63 2zqb s ILE 150 N -1.12 5.26 -0.80 1.69 -1.16 -1.26 -0.99 121.20 122.82 2zqb s ILE 150 Ca 0.56 0.70 -0.26 0.00 -0.51 0.00 0.00 60.65 61.14 2zqb s ILE 150 Cb -0.52 -3.70 0.01 0.00 0.61 0.00 0.00 42.46 38.86 2zqb s ILE 150 CO 0.62 0.36 1.55 -0.62 -2.81 0.00 0.00 174.94 174.04 2zqb s ASP 151 N 0.56 5.89 0.45 4.50 -1.08 -1.26 -4.88 116.67 120.85 2zqb s ASP 151 Ca 0.20 -0.53 0.31 0.00 -0.52 0.00 0.00 52.55 52.01 2zqb s ASP 151 Cb -0.14 -2.56 1.51 0.00 -1.46 0.00 0.00 42.92 40.27 2zqb s ASP 151 CO 0.06 -2.01 1.93 0.00 0.52 0.00 0.00 175.17 175.67 2zqb h THR 152 N 6.58 0.00 -0.00 1.71 1.03 -1.96 -1.09 112.91 119.18 2zqb h THR 152 Ca -0.11 -0.17 0.00 0.00 -0.01 0.00 0.00 66.41 66.12 2zqb h THR 152 Cb 1.06 0.96 0.00 0.00 -1.07 0.00 0.00 68.15 69.10 2zqb h THR 152 CO 1.29 0.00 -0.00 0.61 -0.01 0.00 0.00 175.52 177.41 2zqb n GLY 153 N -0.63 -1.36 0.00 2.99 0.00 -1.26 -5.20 105.19 99.73 2zqb n GLY 153 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2zqb n GLY 153 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30