#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qk5 h ALA 2 N 0.00 0.96 -2.95 3.17 0.00 -1.94 -3.46 119.26 115.04 1qk5 h ALA 2 Ca 0.00 -0.05 -0.54 0.00 0.00 0.00 0.00 54.91 54.32 1qk5 h ALA 2 Cb 0.00 -0.01 0.11 0.00 0.00 0.00 0.00 17.79 17.89 1qk5 h ALA 2 CO 0.00 0.07 0.76 -1.54 0.00 0.00 0.00 179.25 178.54 1qk5 s SER 3 N -6.22 6.29 -0.30 0.00 1.04 -1.26 -4.91 113.70 108.33 1qk5 s SER 3 Ca 0.06 3.01 -0.08 0.00 0.48 0.00 0.00 55.95 59.42 1qk5 s SER 3 Cb 0.05 -2.66 0.16 0.00 0.10 0.00 0.00 66.02 63.67 1qk5 s SER 3 CO 0.68 -0.91 0.71 -0.75 0.98 0.00 0.00 173.24 173.95 1qk5 s LYS 4 N -2.14 0.51 0.26 4.02 2.47 -1.26 -5.12 119.74 118.47 1qk5 s LYS 4 Ca 0.54 1.14 -0.31 0.00 -1.56 0.00 0.00 55.97 55.78 1qk5 s LYS 4 Cb -0.46 0.67 -0.13 0.00 -1.46 0.00 0.00 37.83 36.46 1qk5 s LYS 4 CO 0.61 -0.31 1.50 -2.30 0.16 0.00 0.00 175.35 175.02 1qk5 n PRO 5 N 5.37 2.33 -0.34 4.03 -0.02 -1.26 -4.44 135.00 140.67 1qk5 n PRO 5 Ca -0.08 0.83 0.20 0.00 -2.02 0.00 0.00 63.50 62.43 1qk5 n PRO 5 Cb 0.50 -2.55 0.42 0.00 -0.02 0.00 0.00 33.50 31.86 1qk5 n PRO 5 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1qk5 h ILE 6 N 3.22 0.47 -0.16 4.25 1.08 -1.93 -0.76 117.51 123.68 1qk5 h ILE 6 Ca -0.46 -0.17 0.05 0.00 -0.39 0.00 0.00 64.86 63.89 1qk5 h ILE 6 Cb 1.25 -0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 1qk5 h ILE 6 CO 0.79 0.09 0.21 -0.33 -0.69 0.00 0.00 178.15 178.22 1qk5 h GLU 7 N 0.50 0.00 -0.00 2.37 3.07 -1.99 -1.22 114.58 117.31 1qk5 h GLU 7 Ca 0.67 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.53 1qk5 h GLU 7 Cb 1.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1qk5 h GLU 7 CO -0.49 0.00 -0.00 -0.25 -1.40 0.00 0.00 179.01 176.87 1qk5 n ASP 8 N -3.63 0.01 -4.67 1.42 10.43 -0.29 -4.89 116.55 114.92 1qk5 n ASP 8 Ca 0.01 0.22 -0.52 0.00 2.57 0.00 0.00 54.79 57.07 1qk5 n ASP 8 Cb 0.33 -0.40 -0.06 0.00 1.84 0.00 0.00 41.12 42.83 1qk5 n ASP 8 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1qk5 n TYR 9 N -1.41 2.06 -0.60 1.24 9.36 -0.46 -1.25 117.16 126.09 1qk5 n TYR 9 Ca 0.10 0.35 0.00 0.00 3.32 0.00 0.00 57.90 61.68 1qk5 n TYR 9 Cb 0.30 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.50 1qk5 n TYR 9 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1qk5 n GLY 10 N 3.79 0.75 0.10 2.98 0.00 -1.26 -4.91 105.19 106.64 1qk5 n GLY 10 Ca 0.22 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1qk5 n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qk5 n LYS 11 N -2.28 0.60 -2.30 1.61 5.02 -0.38 -0.61 118.16 119.81 1qk5 n LYS 11 Ca 0.00 0.09 -0.16 0.00 -2.02 0.00 0.00 58.31 56.22 1qk5 n LYS 11 Cb 0.00 -1.79 -0.01 0.00 -0.02 0.00 0.00 35.03 33.21 1qk5 n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qk5 n GLY 12 N 1.19 -0.29 3.67 0.72 0.00 -1.24 -4.78 105.19 104.46 1qk5 n GLY 12 Ca -0.00 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1qk5 n GLY 12 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qk5 s LYS 13 N -4.80 4.15 -1.19 1.61 2.20 -1.26 -2.37 119.74 118.08 1qk5 s LYS 13 Ca 0.00 2.54 0.00 0.00 -0.36 0.00 0.00 55.97 58.15 1qk5 s LYS 13 Cb -0.00 -3.90 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 1qk5 s LYS 13 CO 0.00 -0.89 0.00 0.41 -0.36 0.00 0.00 175.35 174.51 1qk5 n GLY 14 N 4.35 0.66 3.85 5.54 0.00 -1.26 -5.00 105.19 113.32 1qk5 n GLY 14 Ca 0.19 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 1qk5 n GLY 14 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1qk5 s ARG 15 N -3.75 2.32 -0.14 1.61 1.70 -1.00 -5.05 118.95 114.64 1qk5 s ARG 15 Ca 0.00 0.48 -0.18 0.00 -0.47 0.00 0.00 55.73 55.56 1qk5 s ARG 15 Cb 0.00 -1.96 -0.04 0.00 -0.57 0.00 0.00 34.95 32.38 1qk5 s ARG 15 CO 0.00 -1.42 0.48 0.42 -1.08 0.00 0.00 175.30 173.70 1qk5 s ILE 16 N -3.29 5.17 0.61 4.99 1.01 -1.26 -5.05 121.20 123.37 1qk5 s ILE 16 Ca 0.60 0.94 -0.18 0.00 0.00 0.00 0.00 60.65 62.01 1qk5 s ILE 16 Cb -0.13 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1qk5 s ILE 16 CO 0.53 0.29 1.21 -1.61 0.00 0.00 0.00 174.94 175.36 1qk5 s GLU 17 N 0.90 2.89 1.11 2.79 0.41 -1.26 -4.70 118.70 120.83 1qk5 s GLU 17 Ca 0.25 1.84 -0.17 0.00 -0.41 0.00 0.00 54.97 56.47 1qk5 s GLU 17 Cb -0.15 -1.92 0.25 0.00 -1.78 0.00 0.00 34.13 30.53 1qk5 s GLU 17 CO 0.10 -1.27 1.16 -1.25 -0.49 0.00 0.00 175.26 173.50 1qk5 s PRO 18 N -3.38 -0.48 -0.13 0.39 0.04 -1.26 -4.99 135.00 125.19 1qk5 s PRO 18 Ca 0.78 -0.06 -0.29 0.00 0.04 0.00 0.00 61.00 61.46 1qk5 s PRO 18 Cb -0.31 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1qk5 s PRO 18 CO 0.34 -3.22 0.99 1.41 0.04 0.00 0.00 177.00 176.57 1qk5 s MET 19 N -5.46 4.38 -0.20 4.56 -2.45 -0.65 -4.85 119.30 114.64 1qk5 s MET 19 Ca 0.70 1.35 -0.24 0.00 -1.25 0.00 0.00 55.69 56.25 1qk5 s MET 19 Cb -0.10 -3.56 -0.01 0.00 1.25 0.00 0.00 34.83 32.41 1qk5 s MET 19 CO 0.55 -0.37 0.79 -0.47 1.05 0.00 0.00 175.02 176.57 1qk5 s TYR 20 N 2.21 3.38 -0.40 4.11 5.04 -1.26 -1.21 117.35 129.23 1qk5 s TYR 20 Ca 0.47 1.15 -0.07 0.00 -2.44 0.00 0.00 57.07 56.17 1qk5 s TYR 20 Cb -0.18 -2.98 0.08 0.00 0.35 0.00 0.00 41.96 39.23 1qk5 s TYR 20 CO 0.15 -0.27 0.21 0.42 -1.34 0.00 0.00 175.55 174.72 1qk5 s ILE 21 N 2.30 3.89 0.88 3.14 -1.09 -0.82 -4.96 121.20 124.55 1qk5 s ILE 21 Ca 0.35 -1.47 -0.11 0.00 -2.23 0.00 0.00 60.65 57.19 1qk5 s ILE 21 Cb -0.16 -3.39 0.12 0.00 -1.58 0.00 0.00 42.46 37.45 1qk5 s ILE 21 CO 0.10 -0.46 1.17 -2.16 -1.23 0.00 0.00 174.94 172.37 1qk5 s PRO 22 N 1.36 1.22 0.65 2.79 0.04 -1.26 -4.24 135.00 135.55 1qk5 s PRO 22 Ca 0.03 1.64 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 1qk5 s PRO 22 Cb -0.22 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 1qk5 s PRO 22 CO 0.01 -2.50 1.25 -0.25 0.04 0.00 0.00 177.00 175.54 1qk5 n ASP 23 N -3.89 1.87 -2.69 6.66 9.92 -1.26 -2.94 116.55 124.21 1qk5 n ASP 23 Ca 0.13 0.82 -0.20 0.00 -0.53 0.00 0.00 54.79 55.01 1qk5 n ASP 23 Cb 0.51 -1.53 0.01 0.00 -0.64 0.00 0.00 41.12 39.47 1qk5 n ASP 23 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1qk5 n ASN 24 N -1.78 -5.34 -4.21 -2.24 4.13 -1.26 -4.98 115.26 99.58 1qk5 n ASN 24 Ca 0.16 -0.09 -0.35 0.00 1.68 0.00 0.00 54.58 55.98 1qk5 n ASN 24 Cb 0.48 -4.42 -0.14 0.00 -1.54 0.00 0.00 39.78 34.16 1qk5 n ASN 24 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1qk5 s THR 25 N -2.98 3.02 0.12 3.41 2.01 -1.15 -5.08 115.64 115.00 1qk5 s THR 25 Ca 0.13 -1.08 -0.09 0.00 0.31 0.00 0.00 61.69 60.96 1qk5 s THR 25 Cb -0.06 -2.59 -0.00 0.00 0.01 0.00 0.00 72.50 69.85 1qk5 s THR 25 CO 0.16 0.10 0.24 -0.36 -0.69 0.00 0.00 174.62 174.07 1qk5 s PHE 26 N 1.32 0.25 0.26 4.92 0.40 -1.26 -4.75 117.98 119.12 1qk5 s PHE 26 Ca -0.01 -0.65 0.07 0.00 -0.60 0.00 0.00 56.93 55.74 1qk5 s PHE 26 Cb -0.18 -0.05 -0.03 0.00 0.51 0.00 0.00 43.02 43.27 1qk5 s PHE 26 CO -0.03 -0.63 0.24 0.71 0.70 0.00 0.00 175.22 176.21 1qk5 s TYR 27 N -3.91 3.16 0.03 0.36 1.51 -0.31 -4.91 117.35 113.28 1qk5 s TYR 27 Ca 0.10 -0.11 -0.20 0.00 -1.01 0.00 0.00 57.07 55.86 1qk5 s TYR 27 Cb 0.04 -1.47 -0.06 0.00 -0.11 0.00 0.00 41.96 40.36 1qk5 s TYR 27 CO -0.06 0.48 0.57 -0.80 -1.11 0.00 0.00 175.55 174.63 1qk5 s ASN 28 N -3.88 7.00 0.47 2.29 0.01 -1.26 -1.00 114.94 118.57 1qk5 s ASN 28 Ca 0.34 1.19 0.13 0.00 -0.71 0.00 0.00 52.86 53.81 1qk5 s ASN 28 Cb -0.08 -2.36 1.09 0.00 0.41 0.00 0.00 41.25 40.32 1qk5 s ASN 28 CO 0.26 0.19 2.09 0.00 -1.51 0.00 0.00 177.10 178.13 1qk5 h ALA 29 N 5.11 1.91 -0.01 0.60 0.00 -1.58 -2.27 119.26 123.02 1qk5 h ALA 29 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1qk5 h ALA 29 Cb 1.21 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1qk5 h ALA 29 CO 0.67 0.07 0.03 0.38 0.00 0.00 0.00 179.25 180.39 1qk5 h ASP 30 N 0.25 0.00 0.74 0.00 3.04 -1.90 -0.13 116.42 118.42 1qk5 h ASP 30 Ca 0.09 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.88 1qk5 h ASP 30 Cb 0.06 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.35 1qk5 h ASP 30 CO -0.02 0.00 -0.13 0.47 -2.04 0.00 0.00 179.24 177.52 1qk5 n ASP 31 N -3.27 0.19 -4.69 4.15 8.00 -0.85 -4.87 116.55 115.20 1qk5 n ASP 31 Ca -0.03 0.09 -0.24 0.00 0.71 0.00 0.00 54.79 55.33 1qk5 n ASP 31 Cb 0.10 -0.24 -0.07 0.00 -0.02 0.00 0.00 41.12 40.89 1qk5 n ASP 31 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1qk5 s PHE 32 N -2.87 2.65 -0.52 1.24 0.08 -0.06 -5.07 117.98 113.43 1qk5 s PHE 32 Ca 0.17 -0.38 -0.24 0.00 0.12 0.00 0.00 56.93 56.61 1qk5 s PHE 32 Cb 0.19 -1.53 0.04 0.00 -0.57 0.00 0.00 43.02 41.14 1qk5 s PHE 32 CO 0.55 0.42 0.89 -1.17 -0.10 0.00 0.00 175.22 175.82 1qk5 s LEU 33 N -3.78 4.18 -0.15 -0.37 2.96 -1.26 -5.00 118.68 115.26 1qk5 s LEU 33 Ca 0.36 -0.30 -0.05 0.00 -0.22 0.00 0.00 54.13 53.92 1qk5 s LEU 33 Cb -0.02 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.77 1qk5 s LEU 33 CO 0.21 -1.13 0.01 0.68 -1.32 0.00 0.00 176.35 174.80 1qk5 s VAL 34 N 3.73 4.37 0.66 1.68 -7.23 -1.26 -4.99 120.40 117.36 1qk5 s VAL 34 Ca 0.30 -0.19 -0.14 0.00 -1.81 0.00 0.00 61.98 60.13 1qk5 s VAL 34 Cb -0.13 -2.92 -0.00 0.00 0.56 0.00 0.00 36.38 33.89 1qk5 s VAL 34 CO 0.20 0.51 1.08 -2.16 -0.31 0.00 0.00 175.10 174.42 1qk5 s PRO 35 N 0.07 2.91 0.40 4.82 0.05 -1.26 -4.70 135.00 137.29 1qk5 s PRO 35 Ca 0.03 1.25 0.15 0.00 0.05 0.00 0.00 61.00 62.48 1qk5 s PRO 35 Cb -0.13 -1.97 1.02 0.00 0.05 0.00 0.00 34.50 33.46 1qk5 s PRO 35 CO 0.02 -1.14 1.86 -1.35 0.05 0.00 0.00 177.00 176.43 1qk5 h PRO 36 N -0.07 0.46 0.00 0.56 0.11 -2.00 -0.14 132.00 130.92 1qk5 h PRO 36 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1qk5 h PRO 36 Cb 1.23 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qk5 h PRO 36 CO 0.55 0.31 0.00 -2.39 -0.21 0.00 0.00 178.00 176.26 1qk5 n HIS 37 N -4.54 0.53 -0.02 0.65 1.44 -1.26 -3.09 115.22 108.94 1qk5 n HIS 37 Ca 0.19 0.18 0.05 0.00 -2.01 0.00 0.00 57.72 56.13 1qk5 n HIS 37 Cb 0.64 -0.79 -0.13 0.00 0.12 0.00 0.00 29.99 29.84 1qk5 n HIS 37 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1qk5 h LYS 39 N 0.00 0.07 0.00 0.00 3.64 -1.16 -1.18 116.57 117.94 1qk5 h LYS 39 Ca -0.09 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1qk5 h LYS 39 Cb 1.01 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1qk5 h LYS 39 CO 0.00 0.05 -0.00 -1.35 -2.27 0.00 0.00 179.45 175.88 1qk5 h PRO 40 N 0.07 0.00 0.00 1.90 0.11 -1.85 -3.27 132.00 128.96 1qk5 h PRO 40 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1qk5 h PRO 40 Cb 0.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.49 1qk5 h PRO 40 CO -0.45 0.00 -0.36 0.66 -0.21 0.00 0.00 178.00 177.64 1qk5 n TYR 41 N -3.12 0.00 -4.15 0.65 4.01 -0.51 -4.86 117.16 109.18 1qk5 n TYR 41 Ca -0.02 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.38 1qk5 n TYR 41 Cb 0.14 -0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.06 1qk5 n TYR 41 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1qk5 s ILE 42 N -1.72 4.22 0.00 -0.72 -1.09 -0.83 -4.18 121.20 116.87 1qk5 s ILE 42 Ca 0.03 -0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.22 1qk5 s ILE 42 Cb 0.06 -2.89 0.00 0.00 -1.58 0.00 0.00 42.46 38.05 1qk5 s ILE 42 CO 0.31 0.45 0.00 0.47 -1.23 0.00 0.00 174.94 174.95 1qk5 n ASP 43 N 3.82 1.00 -4.26 3.58 8.00 -1.26 -4.77 116.55 122.66 1qk5 n ASP 43 Ca -0.17 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 54.99 1qk5 n ASP 43 Cb 0.52 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.47 1qk5 n ASP 43 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1qk5 s LYS 44 N -1.94 3.26 -0.37 -1.24 1.02 -1.26 -1.55 119.74 117.66 1qk5 s LYS 44 Ca 0.00 -0.69 -0.15 0.00 0.02 0.00 0.00 55.97 55.15 1qk5 s LYS 44 Cb 0.00 -2.84 -0.00 0.00 -0.52 0.00 0.00 37.83 34.47 1qk5 s LYS 44 CO 0.00 -0.17 0.33 0.42 -0.92 0.00 0.00 175.35 175.01 1qk5 s ILE 45 N 1.32 5.20 -0.01 2.17 1.01 -0.17 -1.37 121.20 129.36 1qk5 s ILE 45 Ca 0.04 -0.21 -0.21 0.00 0.00 0.00 0.00 60.65 60.27 1qk5 s ILE 45 Cb -0.14 -3.85 -0.25 0.00 0.01 0.00 0.00 42.46 38.24 1qk5 s ILE 45 CO -0.05 -0.16 1.05 0.25 0.00 0.00 0.00 174.94 176.03 1qk5 h LEU 46 N 8.71 0.48 -7.04 2.97 5.85 -1.01 -0.81 115.31 124.46 1qk5 h LEU 46 Ca -0.29 -0.80 -0.50 0.00 0.84 0.00 0.00 57.88 57.13 1qk5 h LEU 46 Cb 1.14 -0.15 -0.40 0.00 0.37 0.00 0.00 40.66 41.62 1qk5 h LEU 46 CO 0.70 1.22 -0.76 -0.76 -0.34 0.00 0.00 178.44 178.50 1qk5 s LEU 47 N -8.28 0.76 0.50 2.25 1.43 -0.47 -4.83 118.68 110.04 1qk5 s LEU 47 Ca -0.14 -0.94 -0.23 0.00 -1.03 0.00 0.00 54.13 51.79 1qk5 s LEU 47 Cb 0.03 -0.41 -0.07 0.00 0.03 0.00 0.00 46.19 45.77 1qk5 s LEU 47 CO 0.81 -0.37 1.25 -2.65 0.23 0.00 0.00 176.35 175.62 1qk5 n PRO 48 N 5.18 1.66 -0.25 1.29 -0.02 -1.26 -0.54 135.00 141.06 1qk5 n PRO 48 Ca -0.07 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.11 1qk5 n PRO 48 Cb 0.46 -2.41 0.35 0.00 -0.02 0.00 0.00 33.50 31.88 1qk5 n PRO 48 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1qk5 h GLY 49 N 1.57 1.13 2.00 -1.23 0.00 -1.90 0.01 103.07 104.66 1qk5 h GLY 49 Ca -0.49 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 46.49 1qk5 h GLY 49 CO 0.57 0.16 -0.15 -1.33 0.00 0.00 0.00 176.54 175.79 1qk5 h GLY 50 N 0.75 0.00 1.20 4.60 0.00 -1.89 -1.33 103.07 106.39 1qk5 h GLY 50 Ca 0.40 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.60 1qk5 h GLY 50 CO -0.17 0.00 -0.21 -2.00 0.00 0.00 0.00 176.54 174.16 1qk5 h LEU 51 N 0.00 0.94 -0.13 3.11 6.46 -1.36 -1.59 115.31 122.73 1qk5 h LEU 51 Ca -0.00 -0.35 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1qk5 h LEU 51 Cb 0.79 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1qk5 h LEU 51 CO 0.02 1.12 0.09 0.58 -0.62 0.00 0.00 178.44 179.62 1qk5 h VAL 52 N 0.80 1.04 -0.61 1.05 2.07 -1.18 -1.97 116.25 117.44 1qk5 h VAL 52 Ca 0.11 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.58 1qk5 h VAL 52 Cb 0.77 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 1qk5 h VAL 52 CO 0.06 0.04 0.37 0.11 0.02 0.00 0.00 177.57 178.17 1qk5 h LYS 53 N 0.17 0.72 -0.51 1.57 1.57 -1.02 -0.80 116.57 118.27 1qk5 h LYS 53 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1qk5 h LYS 53 Cb -0.01 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 1qk5 h LYS 53 CO -0.01 0.47 0.33 -0.44 -0.57 0.00 0.00 179.45 179.24 1qk5 h ASP 54 N 0.74 0.58 0.00 0.86 3.32 -1.13 -1.39 116.42 119.39 1qk5 h ASP 54 Ca 0.25 -0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.09 1qk5 h ASP 54 Cb 0.02 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1qk5 h ASP 54 CO -0.10 0.42 -0.69 -0.09 -1.72 0.00 0.00 179.24 177.06 1qk5 h ARG 55 N 0.69 0.63 -0.43 3.56 9.65 -0.68 -2.89 114.38 124.91 1qk5 h ARG 55 Ca 0.19 -0.48 -0.05 0.00 -1.10 0.00 0.00 59.98 58.54 1qk5 h ARG 55 Cb -0.08 0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 1qk5 h ARG 55 CO -0.04 1.10 0.06 0.28 2.80 0.00 0.00 179.97 184.17 1qk5 h VAL 56 N 0.45 1.21 -0.65 0.20 2.07 -0.91 -0.46 116.25 118.16 1qk5 h VAL 56 Ca -0.03 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 66.73 1qk5 h VAL 56 Cb 1.29 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 1qk5 h VAL 56 CO 0.13 0.28 0.40 -0.08 0.02 0.00 0.00 177.57 178.33 1qk5 h GLU 57 N 0.64 0.78 -0.41 1.57 4.81 -1.04 0.04 114.58 120.96 1qk5 h GLU 57 Ca 0.14 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 1qk5 h GLU 57 Cb 0.31 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1qk5 h GLU 57 CO 0.00 0.51 -0.20 -0.22 -0.73 0.00 0.00 179.01 178.38 1qk5 h LYS 58 N 0.80 0.80 -0.41 1.92 1.63 -1.24 -0.93 116.57 119.14 1qk5 h LYS 58 Ca 0.26 -0.31 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1qk5 h LYS 58 Cb 0.00 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.57 1qk5 h LYS 58 CO -0.10 0.93 0.21 -0.07 -3.45 0.00 0.00 179.45 176.97 1qk5 h LEU 59 N 0.70 0.52 -0.36 5.20 3.38 -0.78 -0.95 115.31 123.01 1qk5 h LEU 59 Ca 0.10 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1qk5 h LEU 59 Cb 0.71 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1qk5 h LEU 59 CO 0.05 0.49 0.12 0.00 0.09 0.00 0.00 178.44 179.19 1qk5 h ALA 60 N 1.06 0.42 -0.91 1.53 0.00 -0.79 0.21 119.26 120.77 1qk5 h ALA 60 Ca 0.14 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1qk5 h ALA 60 Cb 0.09 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1qk5 h ALA 60 CO -0.02 -0.28 0.59 -0.92 0.00 0.00 0.00 179.25 178.62 1qk5 h TYR 61 N 0.26 1.10 -0.65 0.00 3.20 -0.60 0.53 116.97 120.82 1qk5 h TYR 61 Ca 0.17 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1qk5 h TYR 61 Cb 0.15 -0.37 -0.04 0.00 1.54 0.00 0.00 36.73 38.02 1qk5 h TYR 61 CO -0.15 0.64 0.42 -0.44 -1.64 0.00 0.00 178.16 176.98 1qk5 h ASP 62 N 1.14 0.70 -0.44 -2.11 3.32 -0.50 -1.38 116.42 117.16 1qk5 h ASP 62 Ca 0.36 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.35 1qk5 h ASP 62 Cb -0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1qk5 h ASP 62 CO -0.12 0.50 0.09 0.40 -1.72 0.00 0.00 179.24 178.40 1qk5 h ILE 63 N 0.83 1.24 -0.85 0.35 2.04 -0.17 -2.43 117.51 118.52 1qk5 h ILE 63 Ca 0.25 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 1qk5 h ILE 63 Cb -0.04 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1qk5 h ILE 63 CO -0.08 0.30 0.49 -0.74 0.00 0.00 0.00 178.15 178.12 1qk5 h HIS 64 N 0.58 1.13 -0.24 1.37 -0.00 -0.58 -1.58 115.15 115.83 1qk5 h HIS 64 Ca 0.14 -0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.43 1qk5 h HIS 64 Cb 0.34 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.37 1qk5 h HIS 64 CO 0.02 0.76 -0.12 0.00 -0.00 0.00 0.00 177.93 178.59 1qk5 h ARG 65 N 1.17 0.40 0.02 5.26 2.47 -1.10 -1.17 114.38 121.43 1qk5 h ARG 65 Ca 0.30 -0.11 -0.25 0.00 -1.26 0.00 0.00 59.98 58.67 1qk5 h ARG 65 Cb -0.02 -0.05 0.02 0.00 -1.65 0.00 0.00 29.97 28.28 1qk5 h ARG 65 CO -0.05 0.53 -0.98 1.15 0.56 0.00 0.00 179.97 181.18 1qk5 h THR 66 N 0.37 1.31 -0.01 2.04 2.02 -0.87 -3.40 112.91 114.37 1qk5 h THR 66 Ca 0.07 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 65.01 1qk5 h THR 66 Cb 0.44 2.48 0.00 0.00 -1.74 0.00 0.00 68.15 69.33 1qk5 h THR 66 CO 0.03 0.68 -0.06 -1.22 0.37 0.00 0.00 175.52 175.32 1qk5 n TYR 67 N -3.93 0.00 -1.59 3.16 4.02 -0.67 -3.26 117.16 114.89 1qk5 n TYR 67 Ca -0.11 0.00 -0.51 0.00 -0.01 0.00 0.00 57.90 57.27 1qk5 n TYR 67 Cb 0.85 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 40.12 1qk5 n TYR 67 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1qk5 n PHE 68 N 0.37 1.50 -1.00 -0.72 7.35 -0.45 -0.40 117.46 124.11 1qk5 n PHE 68 Ca 0.06 0.63 -0.00 0.00 -0.76 0.00 0.00 57.45 57.38 1qk5 n PHE 68 Cb 0.25 -2.33 -0.00 0.00 0.35 0.00 0.00 39.48 37.75 1qk5 n PHE 68 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1qk5 n GLY 69 N 2.44 0.38 3.30 7.13 0.00 -1.26 -5.00 105.19 112.19 1qk5 n GLY 69 Ca 0.18 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1qk5 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qk5 s GLU 70 N -0.53 2.15 0.08 1.61 0.41 0.47 -4.91 118.70 117.98 1qk5 s GLU 70 Ca 0.00 -0.92 -0.31 0.00 -0.41 0.00 0.00 54.97 53.33 1qk5 s GLU 70 Cb 0.00 -2.04 -0.08 0.00 -1.78 0.00 0.00 34.13 30.22 1qk5 s GLU 70 CO 0.00 0.54 1.62 -2.00 -0.49 0.00 0.00 175.26 174.93 1qk5 s GLU 71 N -0.55 4.21 -0.15 1.61 2.12 -1.26 -4.96 118.70 119.71 1qk5 s GLU 71 Ca 0.08 2.31 0.01 0.00 0.36 0.00 0.00 54.97 57.73 1qk5 s GLU 71 Cb -0.10 -3.53 0.02 0.00 0.26 0.00 0.00 34.13 30.77 1qk5 s GLU 71 CO -0.00 -0.70 -0.16 -1.17 -0.54 0.00 0.00 175.26 172.68 1qk5 s LEU 72 N 2.40 1.80 -0.32 2.70 2.96 -1.26 -4.14 118.68 122.83 1qk5 s LEU 72 Ca 0.73 -0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 54.01 1qk5 s LEU 72 Cb -0.40 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 1qk5 s LEU 72 CO 0.32 -0.04 0.17 -1.00 -1.32 0.00 0.00 176.35 174.48 1qk5 s HIS 73 N 1.40 3.19 -0.17 5.38 3.76 0.15 -0.69 115.29 128.31 1qk5 s HIS 73 Ca 0.04 -0.50 -0.04 0.00 -0.15 0.00 0.00 55.06 54.42 1qk5 s HIS 73 Cb -0.13 -2.38 -0.02 0.00 1.11 0.00 0.00 32.58 31.15 1qk5 s HIS 73 CO -0.11 -0.44 -0.03 0.42 -0.85 0.00 0.00 174.74 173.73 1qk5 s ILE 74 N 1.64 3.80 -0.24 0.60 1.01 -0.18 -0.94 121.20 126.89 1qk5 s ILE 74 Ca 0.05 -0.38 -0.06 0.00 0.00 0.00 0.00 60.65 60.26 1qk5 s ILE 74 Cb -0.17 -2.68 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 1qk5 s ILE 74 CO 0.07 0.47 0.03 -0.63 0.00 0.00 0.00 174.94 174.89 1qk5 s ILE 75 N 0.62 4.04 -0.24 2.92 1.01 -0.15 -0.96 121.20 128.45 1qk5 s ILE 75 Ca -0.02 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.16 1qk5 s ILE 75 Cb -0.14 -2.87 -0.02 0.00 0.01 0.00 0.00 42.46 39.43 1qk5 s ILE 75 CO 0.02 0.37 0.60 0.00 0.00 0.00 0.00 174.94 175.93 1qk5 s ILE 77 N 2.25 4.06 0.55 0.00 -1.09 -0.84 -1.38 121.20 124.75 1qk5 s ILE 77 Ca 0.25 0.23 -0.13 0.00 -2.23 0.00 0.00 60.65 58.78 1qk5 s ILE 77 Cb -0.16 -4.76 -0.06 0.00 -1.58 0.00 0.00 42.46 35.91 1qk5 s ILE 77 CO 0.09 -1.54 0.97 -0.76 -1.23 0.00 0.00 174.94 172.47 1qk5 s LEU 78 N 4.82 3.46 0.22 2.97 1.43 0.22 -1.93 118.68 129.87 1qk5 s LEU 78 Ca 0.32 1.41 0.15 0.00 -1.03 0.00 0.00 54.13 54.98 1qk5 s LEU 78 Cb -0.11 -4.40 0.00 0.00 0.03 0.00 0.00 46.19 41.71 1qk5 s LEU 78 CO 0.16 -0.70 1.27 0.11 0.23 0.00 0.00 176.35 177.42 1qk5 h LYS 79 N 0.32 0.00 -0.98 1.70 1.57 -1.89 -3.15 116.57 114.14 1qk5 h LYS 79 Ca -0.46 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.45 1qk5 h LYS 79 Cb 1.19 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.41 1qk5 h LYS 79 CO 0.62 0.46 0.60 0.78 -0.57 0.00 0.00 179.45 181.34 1qk5 h GLY 80 N 3.54 1.60 1.03 3.86 0.00 -1.82 -2.62 103.07 108.65 1qk5 h GLY 80 Ca -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1qk5 h GLY 80 CO 0.06 0.14 0.00 1.44 0.00 0.00 0.00 176.54 178.18 1qk5 n SER 81 N -4.65 0.00 -0.14 0.19 7.64 -0.81 -4.26 113.62 111.58 1qk5 n SER 81 Ca 0.18 -0.82 -0.03 0.00 1.01 0.00 0.00 58.87 59.21 1qk5 n SER 81 Cb 0.36 -0.01 0.05 0.00 -1.01 0.00 0.00 64.21 63.59 1qk5 n SER 81 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1qk5 h ARG 82 N 0.00 0.12 0.27 1.43 2.43 -1.70 0.35 114.38 117.28 1qk5 h ARG 82 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1qk5 h ARG 82 Cb 0.01 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1qk5 h ARG 82 CO 0.00 0.08 -0.13 0.78 -1.51 0.00 0.00 179.97 179.19 1qk5 h GLY 83 N 0.12 -0.38 0.99 2.80 0.00 -1.84 0.39 103.07 105.16 1qk5 h GLY 83 Ca 0.23 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.69 1qk5 h GLY 83 CO -0.38 -0.14 0.35 -2.75 0.00 0.00 0.00 176.54 173.63 1qk5 h PHE 84 N -0.50 0.78 -0.12 5.60 3.57 -1.80 -1.38 116.94 123.09 1qk5 h PHE 84 Ca -0.04 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1qk5 h PHE 84 Cb 0.37 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1qk5 h PHE 84 CO -0.02 0.54 0.04 0.35 -2.23 0.00 0.00 178.31 177.00 1qk5 h PHE 85 N 0.80 0.18 -0.85 0.41 3.57 -0.15 -0.05 116.94 120.85 1qk5 h PHE 85 Ca 0.21 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1qk5 h PHE 85 Cb -0.00 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1qk5 h PHE 85 CO -0.02 0.29 0.44 -0.91 -2.23 0.00 0.00 178.31 175.88 1qk5 h ASN 86 N 0.03 1.08 -0.45 0.41 2.35 -0.81 -0.86 115.58 117.33 1qk5 h ASN 86 Ca 0.04 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1qk5 h ASN 86 Cb 0.18 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1qk5 h ASN 86 CO -0.00 0.89 0.25 -0.07 -1.65 0.00 0.00 177.43 176.84 1qk5 h LEU 87 N 1.20 0.57 -0.44 1.61 3.38 -1.08 -2.36 115.31 118.19 1qk5 h LEU 87 Ca 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1qk5 h LEU 87 Cb 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1qk5 h LEU 87 CO -0.04 0.49 0.23 0.25 0.09 0.00 0.00 178.44 179.46 1qk5 h LEU 88 N 0.59 0.56 -0.96 1.67 5.85 -0.63 -0.74 115.31 121.65 1qk5 h LEU 88 Ca 0.16 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 1qk5 h LEU 88 Cb 0.05 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 1qk5 h LEU 88 CO -0.03 0.51 -0.50 0.16 -0.34 0.00 0.00 178.44 178.24 1qk5 h ILE 89 N 0.57 1.36 -0.06 4.05 3.07 -1.17 0.11 117.51 125.44 1qk5 h ILE 89 Ca 0.15 -1.72 -0.00 0.00 1.55 0.00 0.00 64.86 64.83 1qk5 h ILE 89 Cb 0.08 1.91 -0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1qk5 h ILE 89 CO -0.02 0.50 0.02 -0.78 -1.05 0.00 0.00 178.15 176.81 1qk5 h ASP 90 N 0.04 0.09 -0.60 2.16 1.82 -0.86 -2.11 116.42 116.97 1qk5 h ASP 90 Ca -0.00 -0.20 0.02 0.00 -0.39 0.00 0.00 57.03 56.46 1qk5 h ASP 90 Cb 0.90 -0.02 -0.03 0.00 0.68 0.00 0.00 39.33 40.85 1qk5 h ASP 90 CO 0.07 0.26 0.38 1.88 -1.61 0.00 0.00 179.24 180.22 1qk5 h TYR 91 N -0.09 0.71 -0.67 0.28 0.99 -0.84 -1.76 116.97 115.59 1qk5 h TYR 91 Ca 0.02 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.79 1qk5 h TYR 91 Cb 0.21 -0.24 -0.04 0.00 1.00 0.00 0.00 36.73 37.66 1qk5 h TYR 91 CO -0.01 0.43 0.43 -0.07 -0.00 0.00 0.00 178.16 178.94 1qk5 h LEU 92 N 0.76 0.72 -0.39 3.88 3.38 -0.75 0.21 115.31 123.12 1qk5 h LEU 92 Ca 0.23 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 1qk5 h LEU 92 Cb -0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1qk5 h LEU 92 CO -0.08 0.51 0.09 0.00 0.09 0.00 0.00 178.44 179.05 1qk5 h ALA 93 N 1.27 0.52 -0.23 1.53 0.00 -1.19 -1.87 119.26 119.29 1qk5 h ALA 93 Ca 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1qk5 h ALA 93 Cb -0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1qk5 h ALA 93 CO -0.09 0.20 0.12 1.15 0.00 0.00 0.00 179.25 180.63 1qk5 h THR 94 N 0.49 1.13 -0.46 0.00 2.02 -0.77 -0.54 112.91 114.77 1qk5 h THR 94 Ca 0.12 -0.35 0.05 0.00 0.77 0.00 0.00 66.41 67.00 1qk5 h THR 94 Cb 0.32 0.94 -0.05 0.00 -1.74 0.00 0.00 68.15 67.62 1qk5 h THR 94 CO 0.00 0.12 0.20 0.40 0.37 0.00 0.00 175.52 176.62 1qk5 h ILE 95 N 0.26 0.90 -0.32 3.11 2.04 -0.56 -0.63 117.51 122.31 1qk5 h ILE 95 Ca 0.08 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1qk5 h ILE 95 Cb 0.09 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1qk5 h ILE 95 CO -0.01 0.07 -0.05 -0.61 0.00 0.00 0.00 178.15 177.55 1qk5 h GLN 96 N 0.40 0.51 -0.07 2.37 4.15 -1.19 -0.02 115.11 121.25 1qk5 h GLN 96 Ca 0.21 -0.12 -0.08 0.00 0.77 0.00 0.00 58.65 59.43 1qk5 h GLN 96 Cb 0.17 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1qk5 h GLN 96 CO -0.18 0.57 -0.31 -0.22 -1.93 0.00 0.00 178.83 176.76 1qk5 h LYS 97 N 0.48 0.13 -0.01 1.69 3.64 -0.38 -2.84 116.57 119.29 1qk5 h LYS 97 Ca 0.10 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1qk5 h LYS 97 Cb 0.39 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1qk5 h LYS 97 CO 0.02 0.43 -0.70 0.66 -2.27 0.00 0.00 179.45 177.58 1qk5 n TYR 98 N -4.14 0.00 -2.14 1.91 0.53 -0.31 -4.97 117.16 108.04 1qk5 n TYR 98 Ca -0.01 0.00 -0.38 0.00 -1.02 0.00 0.00 57.90 56.49 1qk5 n TYR 98 Cb 0.38 -0.05 -0.00 0.00 -1.03 0.00 0.00 39.34 38.64 1qk5 n TYR 98 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1qk5 s SER 99 N -2.81 6.06 0.30 7.72 0.15 -0.07 -4.91 113.70 120.15 1qk5 s SER 99 Ca 0.13 2.45 0.14 0.00 0.70 0.00 0.00 55.95 59.37 1qk5 s SER 99 Cb 0.17 -2.62 0.41 0.00 -1.71 0.00 0.00 66.02 62.28 1qk5 s SER 99 CO 0.73 -1.00 1.61 1.23 1.20 0.00 0.00 173.24 177.01 1qk5 h GLY 100 N 2.10 0.00 -4.02 9.45 0.00 -1.90 -3.42 103.07 105.28 1qk5 h GLY 100 Ca -0.50 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.32 1qk5 h GLY 100 CO 0.60 0.00 0.48 0.50 0.00 0.00 0.00 176.54 178.13 1qk5 s ARG 101 N -3.45 4.60 -0.12 4.80 0.52 -1.26 -5.03 118.95 119.00 1qk5 s ARG 101 Ca 0.00 1.75 0.00 0.00 -0.52 0.00 0.00 55.73 56.97 1qk5 s ARG 101 Cb 0.11 -3.25 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 1qk5 s ARG 101 CO 0.73 0.09 -0.14 -1.21 0.02 0.00 0.00 175.30 174.80 1qk5 s GLU 102 N -0.60 3.30 0.08 3.54 2.02 -1.26 -5.03 118.70 120.74 1qk5 s GLU 102 Ca 0.49 -0.70 0.07 0.00 0.02 0.00 0.00 54.97 54.85 1qk5 s GLU 102 Cb -0.30 -2.59 -0.03 0.00 0.10 0.00 0.00 34.13 31.30 1qk5 s GLU 102 CO 0.36 0.24 -0.18 0.45 0.02 0.00 0.00 175.26 176.15 1qk5 s SER 103 N 0.27 2.20 0.00 -0.19 0.15 -1.26 -5.02 113.70 109.84 1qk5 s SER 103 Ca -0.10 -0.64 0.26 0.00 0.70 0.00 0.00 55.95 56.18 1qk5 s SER 103 Cb -0.16 -0.11 0.67 0.00 -1.71 0.00 0.00 66.02 64.71 1qk5 s SER 103 CO 0.06 0.02 1.52 -1.54 1.20 0.00 0.00 173.24 174.50 1qk5 n SER 104 N 1.25 1.68 -4.77 5.45 3.41 -1.26 -4.85 113.62 114.53 1qk5 n SER 104 Ca -0.20 -1.40 -0.37 0.00 -0.26 0.00 0.00 58.87 56.64 1qk5 n SER 104 Cb 0.54 0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.53 1qk5 n SER 104 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1qk5 s VAL 105 N -2.22 5.24 0.85 -3.33 1.01 -1.26 -5.08 120.40 115.61 1qk5 s VAL 105 Ca 0.29 0.65 -0.13 0.00 0.00 0.00 0.00 61.98 62.80 1qk5 s VAL 105 Cb 0.20 -3.66 0.08 0.00 0.00 0.00 0.00 36.38 33.00 1qk5 s VAL 105 CO 0.42 0.44 0.99 -2.65 0.00 0.00 0.00 175.10 174.30 1qk5 n PRO 106 N 3.03 -0.02 0.27 2.72 -0.02 -1.26 -4.86 135.00 134.85 1qk5 n PRO 106 Ca -0.12 0.06 0.11 0.00 -2.02 0.00 0.00 63.50 61.53 1qk5 n PRO 106 Cb 0.52 -2.26 0.73 0.00 -0.02 0.00 0.00 33.50 32.47 1qk5 n PRO 106 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1qk5 h PRO 107 N -1.17 0.00 -1.70 0.52 0.13 -1.93 -3.44 132.00 124.40 1qk5 h PRO 107 Ca -0.45 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.90 1qk5 h PRO 107 Cb 1.30 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.25 1qk5 h PRO 107 CO 0.43 0.08 0.72 -0.59 -0.23 0.00 0.00 178.00 178.41 1qk5 s PHE 108 N -4.53 -0.18 -0.21 1.56 -0.12 -1.26 -4.77 117.98 108.47 1qk5 s PHE 108 Ca -0.04 0.10 0.01 0.00 -0.05 0.00 0.00 56.93 56.95 1qk5 s PHE 108 Cb 0.15 0.52 0.03 0.00 -0.63 0.00 0.00 43.02 43.09 1qk5 s PHE 108 CO 0.61 -0.31 -0.16 -0.06 -0.05 0.00 0.00 175.22 175.25 1qk5 s PHE 109 N -2.62 2.94 0.33 3.49 0.40 0.14 -4.95 117.98 117.71 1qk5 s PHE 109 Ca 0.09 -1.77 -0.10 0.00 -0.60 0.00 0.00 56.93 54.54 1qk5 s PHE 109 Cb -0.01 -1.95 -0.07 0.00 0.51 0.00 0.00 43.02 41.51 1qk5 s PHE 109 CO -0.06 -0.81 0.68 -1.83 0.70 0.00 0.00 175.22 173.91 1qk5 s GLU 110 N 1.26 3.81 0.06 0.44 -1.05 -1.26 -1.01 118.70 120.94 1qk5 s GLU 110 Ca 0.01 0.40 -0.08 0.00 -0.15 0.00 0.00 54.97 55.14 1qk5 s GLU 110 Cb -0.15 -2.49 -0.00 0.00 -0.44 0.00 0.00 34.13 31.04 1qk5 s GLU 110 CO -0.10 0.12 0.17 -1.01 0.95 0.00 0.00 175.26 175.39 1qk5 s HIS 111 N -2.13 0.13 -0.02 4.83 3.76 -0.13 -4.91 115.29 116.82 1qk5 s HIS 111 Ca 0.50 -0.46 0.03 0.00 -0.15 0.00 0.00 55.06 54.98 1qk5 s HIS 111 Cb -0.10 -0.07 -0.00 0.00 1.11 0.00 0.00 32.58 33.51 1qk5 s HIS 111 CO 0.26 -0.46 -0.11 0.71 -0.85 0.00 0.00 174.74 174.29 1qk5 s TYR 112 N -3.15 1.05 -0.02 1.40 1.51 -1.26 -0.53 117.35 116.35 1qk5 s TYR 112 Ca -0.00 -0.25 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 1qk5 s TYR 112 Cb 0.02 -0.72 0.02 0.00 -0.11 0.00 0.00 41.96 41.17 1qk5 s TYR 112 CO -0.07 -0.08 0.00 0.08 -1.11 0.00 0.00 175.55 174.37 1qk5 s VAL 113 N 0.02 0.10 -0.23 0.71 1.01 -0.48 -4.48 120.40 117.05 1qk5 s VAL 113 Ca -0.01 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 1qk5 s VAL 113 Cb -0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1qk5 s VAL 113 CO 0.00 0.10 0.03 -0.60 0.00 0.00 0.00 175.10 174.63 1qk5 s ARG 114 N 0.70 3.61 -0.07 2.72 3.00 0.10 -0.61 118.95 128.41 1qk5 s ARG 114 Ca -0.07 -0.51 0.02 0.00 -1.00 0.00 0.00 55.73 54.18 1qk5 s ARG 114 Cb -0.10 -3.20 -0.03 0.00 0.00 0.00 0.00 34.95 31.63 1qk5 s ARG 114 CO -0.02 -0.12 -0.12 -0.51 0.00 0.00 0.00 175.30 174.53 1qk5 s LEU 115 N 1.38 2.85 0.00 -0.88 1.43 -1.19 -0.72 118.68 121.54 1qk5 s LEU 115 Ca 0.05 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1qk5 s LEU 115 Cb -0.15 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.47 1qk5 s LEU 115 CO 0.02 0.32 0.62 1.17 0.23 0.00 0.00 176.35 178.71 1qk5 n LYS 116 N 2.49 0.00 0.00 1.70 3.00 -1.16 -4.73 118.16 119.46 1qk5 n LYS 116 Ca -0.17 -0.57 0.00 0.00 -0.00 0.00 0.00 58.31 57.56 1qk5 n LYS 116 Cb 0.52 -0.39 0.00 0.00 0.00 0.00 0.00 35.03 35.16 1qk5 n LYS 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1qk5 n GLN 126 N 0.00 0.00 -3.42 1.64 0.00 -1.26 -2.44 117.38 111.91 1qk5 n GLN 126 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 57.00 56.62 1qk5 n GLN 126 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.75 1qk5 n GLN 126 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1qk5 s LEU 127 N 0.00 4.43 -0.10 2.61 2.96 -1.26 -5.08 118.68 122.24 1qk5 s LEU 127 Ca 0.00 0.97 -0.06 0.00 -0.22 0.00 0.00 54.13 54.82 1qk5 s LEU 127 Cb 0.00 -2.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 1qk5 s LEU 127 CO 0.00 0.23 0.11 -0.89 -1.32 0.00 0.00 176.35 174.48 1qk5 s THR 128 N -0.62 5.25 -0.17 3.68 2.01 -1.02 -5.09 115.64 119.68 1qk5 s THR 128 Ca 0.25 0.08 -0.00 0.00 0.31 0.00 0.00 61.69 62.32 1qk5 s THR 128 Cb -0.17 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 69.10 1qk5 s THR 128 CO 0.13 0.59 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.91 1qk5 s VAL 129 N -1.03 1.15 -0.30 3.82 1.01 -1.26 -2.97 120.40 120.82 1qk5 s VAL 129 Ca 0.16 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 1qk5 s VAL 129 Cb -0.12 -1.32 0.03 0.00 0.00 0.00 0.00 36.38 34.98 1qk5 s VAL 129 CO 0.05 0.14 0.03 -0.22 0.00 0.00 0.00 175.10 175.10 1qk5 s LEU 130 N 1.62 3.86 0.10 3.92 2.96 0.10 -4.98 118.68 126.26 1qk5 s LEU 130 Ca 0.01 -1.03 -0.26 0.00 -0.22 0.00 0.00 54.13 52.62 1qk5 s LEU 130 Cb -0.15 -1.78 0.08 0.00 0.50 0.00 0.00 46.19 44.84 1qk5 s LEU 130 CO -0.08 -0.24 1.08 -0.94 -1.32 0.00 0.00 176.35 174.86 1qk5 s SER 131 N 1.36 -0.10 1.09 3.68 1.04 -1.26 0.01 113.70 119.52 1qk5 s SER 131 Ca -0.02 -0.36 -0.14 0.00 0.48 0.00 0.00 55.95 55.92 1qk5 s SER 131 Cb -0.18 0.38 0.24 0.00 0.10 0.00 0.00 66.02 66.55 1qk5 s SER 131 CO 0.00 -0.72 1.07 -1.81 0.98 0.00 0.00 173.24 172.77 1qk5 s ASP 132 N -3.06 1.78 -0.01 7.02 1.01 -1.26 -4.89 116.67 117.26 1qk5 s ASP 132 Ca 0.15 1.17 -0.33 0.00 0.71 0.00 0.00 52.55 54.26 1qk5 s ASP 132 Cb 0.00 -1.82 -0.11 0.00 1.01 0.00 0.00 42.92 42.00 1qk5 s ASP 132 CO 0.01 -3.65 1.89 -0.67 0.21 0.00 0.00 175.17 172.95 1qk5 n ASP 133 N -4.52 3.71 0.04 0.27 -0.08 -1.26 -4.83 116.55 109.89 1qk5 n ASP 133 Ca 0.05 0.96 0.06 0.00 -1.51 0.00 0.00 54.79 54.35 1qk5 n ASP 133 Cb 0.57 -1.44 0.29 0.00 2.34 0.00 0.00 41.12 42.88 1qk5 n ASP 133 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1qk5 n LEU 134 N 6.64 0.19 0.32 -2.67 4.77 -1.26 -2.76 117.00 122.23 1qk5 n LEU 134 Ca 0.21 0.56 0.22 0.00 -0.03 0.00 0.00 56.01 56.97 1qk5 n LEU 134 Cb 0.34 -0.56 1.12 0.00 -2.33 0.00 0.00 43.42 41.99 1qk5 n LEU 134 CO 0.70 -0.47 1.15 0.28 -1.33 0.00 0.00 177.39 177.72 1qk5 h SER 135 N 0.00 0.00 0.37 -1.43 0.02 -1.95 -2.01 113.55 108.55 1qk5 h SER 135 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qk5 h SER 135 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1qk5 h SER 135 CO 0.00 0.00 0.00 0.16 -1.14 0.00 0.00 176.83 175.85 1qk5 h ILE 136 N 0.00 0.00 -0.05 3.27 3.07 -1.91 -1.77 117.51 120.12 1qk5 h ILE 136 Ca 0.00 -0.15 0.00 0.00 1.55 0.00 0.00 64.86 66.26 1qk5 h ILE 136 Cb 0.09 0.90 0.00 0.00 -0.27 0.00 0.00 36.82 37.54 1qk5 h ILE 136 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 1qk5 n PHE 137 N -2.57 0.05 -1.89 0.16 3.01 -0.75 -4.84 117.46 110.61 1qk5 n PHE 137 Ca -0.01 -0.02 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 1qk5 n PHE 137 Cb 0.14 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.58 1qk5 n PHE 137 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1qk5 s ARG 138 N -1.95 4.19 -1.50 -1.08 3.52 -0.67 -1.57 118.95 119.90 1qk5 s ARG 138 Ca 0.38 2.40 0.00 0.00 -0.13 0.00 0.00 55.73 58.38 1qk5 s ARG 138 Cb 0.20 -3.24 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 1qk5 s ARG 138 CO 0.32 -0.66 0.00 -3.47 -0.81 0.00 0.00 175.30 170.67 1qk5 n ASP 139 N 4.34 -4.72 -4.73 -2.12 2.03 -0.07 -4.85 116.55 106.44 1qk5 n ASP 139 Ca 0.15 0.26 -0.23 0.00 0.52 0.00 0.00 54.79 55.48 1qk5 n ASP 139 Cb 0.38 -3.63 -0.06 0.00 -0.72 0.00 0.00 41.12 37.10 1qk5 n ASP 139 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1qk5 s LYS 140 N -3.69 2.60 -0.26 -0.67 -0.14 -0.61 -4.38 119.74 112.59 1qk5 s LYS 140 Ca 0.00 -1.21 -0.27 0.00 -1.36 0.00 0.00 55.97 53.14 1qk5 s LYS 140 Cb 0.00 -2.37 0.00 0.00 -1.68 0.00 0.00 37.83 33.78 1qk5 s LYS 140 CO 0.00 0.40 0.94 -1.01 -0.76 0.00 0.00 175.35 174.91 1qk5 s HIS 141 N -2.15 3.28 -0.08 3.18 3.76 -1.26 -0.99 115.29 121.03 1qk5 s HIS 141 Ca 0.32 1.22 0.02 0.00 -0.15 0.00 0.00 55.06 56.47 1qk5 s HIS 141 Cb -0.07 -3.25 -0.02 0.00 1.11 0.00 0.00 32.58 30.34 1qk5 s HIS 141 CO 0.22 -0.51 -0.14 0.08 -0.85 0.00 0.00 174.74 173.54 1qk5 s VAL 142 N 3.12 3.06 -0.24 -0.90 1.01 -0.55 -0.68 120.40 125.22 1qk5 s VAL 142 Ca 0.39 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1qk5 s VAL 142 Cb -0.15 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.05 1qk5 s VAL 142 CO 0.09 0.57 -0.12 -0.22 0.00 0.00 0.00 175.10 175.42 1qk5 s LEU 143 N -0.33 3.15 -0.19 3.92 2.96 -0.12 -1.69 118.68 126.39 1qk5 s LEU 143 Ca 0.03 -1.16 -0.26 0.00 -0.22 0.00 0.00 54.13 52.52 1qk5 s LEU 143 Cb -0.13 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 45.00 1qk5 s LEU 143 CO 0.02 -0.14 0.87 -0.63 -1.32 0.00 0.00 176.35 175.15 1qk5 s ILE 144 N 1.18 4.84 -0.28 6.68 1.01 -0.15 -0.97 121.20 133.51 1qk5 s ILE 144 Ca -0.04 1.70 -0.07 0.00 0.00 0.00 0.00 60.65 62.23 1qk5 s ILE 144 Cb -0.18 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.12 1qk5 s ILE 144 CO -0.06 -0.02 0.08 -0.69 0.00 0.00 0.00 174.94 174.25 1qk5 s VAL 145 N 2.40 4.17 0.08 2.92 1.01 0.70 -0.51 120.40 131.17 1qk5 s VAL 145 Ca 0.39 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.99 1qk5 s VAL 145 Cb -0.16 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1qk5 s VAL 145 CO 0.11 0.18 -0.21 -0.70 0.00 0.00 0.00 175.10 174.48 1qk5 s GLU 146 N 1.56 1.23 -0.07 2.72 2.56 0.28 -1.99 118.70 125.00 1qk5 s GLU 146 Ca 0.04 -1.06 -0.25 0.00 0.00 0.00 0.00 54.97 53.71 1qk5 s GLU 146 Cb -0.16 -1.43 -0.26 0.00 2.00 0.00 0.00 34.13 34.28 1qk5 s GLU 146 CO 0.03 0.35 0.93 0.38 -0.56 0.00 0.00 175.26 176.39 1qk5 h ASP 147 N 4.44 0.23 -3.73 -1.70 2.03 -1.84 -2.62 116.42 113.22 1qk5 h ASP 147 Ca -0.44 -0.88 -0.08 0.00 -0.73 0.00 0.00 57.03 54.89 1qk5 h ASP 147 Cb 1.17 -0.07 -0.23 0.00 -0.83 0.00 0.00 39.33 39.37 1qk5 h ASP 147 CO 0.41 1.09 -0.12 -0.51 -1.03 0.00 0.00 179.24 179.09 1qk5 s ILE 148 N -2.70 -0.00 -0.08 4.15 2.07 -1.26 -2.48 121.20 120.89 1qk5 s ILE 148 Ca -0.16 0.01 -0.00 0.00 -1.41 0.00 0.00 60.65 59.09 1qk5 s ILE 148 Cb -0.00 -0.74 -0.03 0.00 0.13 0.00 0.00 42.46 41.82 1qk5 s ILE 148 CO 0.75 0.01 -0.06 -0.69 -1.91 0.00 0.00 174.94 173.04 1qk5 s VAL 149 N 0.58 3.76 0.00 4.00 1.01 -0.67 -5.02 120.40 124.07 1qk5 s VAL 149 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1qk5 s VAL 149 Cb -0.05 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1qk5 s VAL 149 CO -0.03 0.58 0.00 0.00 0.00 0.00 0.00 175.10 175.65 1qk5 n ALA 150 N 2.46 1.40 0.19 5.51 0.00 -1.26 -1.72 120.51 127.10 1qk5 n ALA 150 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.34 1qk5 n ALA 150 Cb 0.53 0.00 0.26 0.00 0.00 0.00 0.00 19.45 20.24 1qk5 n ALA 150 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1qk5 h THR 151 N 0.00 0.56 0.00 0.00 1.35 -1.96 -3.44 112.91 109.42 1qk5 h THR 151 Ca 0.00 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.37 1qk5 h THR 151 Cb 0.00 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1qk5 h THR 151 CO 0.00 0.28 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 1qk5 n GLY 152 N 0.71 0.64 0.17 5.82 0.00 -1.26 -4.33 105.19 106.94 1qk5 n GLY 152 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1qk5 n GLY 152 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1qk5 h PHE 153 N 0.00 0.47 -0.04 1.61 3.57 -1.98 -0.83 116.94 119.74 1qk5 h PHE 153 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1qk5 h PHE 153 Cb 0.00 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 1qk5 h PHE 153 CO 0.00 0.29 0.03 1.15 -2.23 0.00 0.00 178.31 177.54 1qk5 h THR 154 N 0.51 1.03 0.00 4.41 2.02 -1.99 -1.95 112.91 116.94 1qk5 h THR 154 Ca 0.15 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.24 1qk5 h THR 154 Cb -0.03 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1qk5 h THR 154 CO -0.05 0.02 -0.13 -0.07 0.37 0.00 0.00 175.52 175.66 1qk5 h LEU 155 N 0.04 0.00 -0.11 2.58 4.07 -1.95 -1.61 115.31 118.32 1qk5 h LEU 155 Ca 0.01 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.93 1qk5 h LEU 155 Cb 0.01 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1qk5 h LEU 155 CO -0.00 0.13 -0.12 0.74 -1.08 0.00 0.00 178.44 178.11 1qk5 h THR 156 N 0.00 1.36 -0.10 0.22 2.02 -0.93 -1.83 112.91 113.65 1qk5 h THR 156 Ca -0.00 -1.28 -0.03 0.00 0.77 0.00 0.00 66.41 65.87 1qk5 h THR 156 Cb 0.88 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.24 1qk5 h THR 156 CO 0.02 0.37 -0.05 -0.33 0.37 0.00 0.00 175.52 175.90 1qk5 h GLU 157 N -0.12 0.21 -0.40 6.66 4.39 -1.31 -1.54 114.58 122.47 1qk5 h GLU 157 Ca 0.02 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 1qk5 h GLU 157 Cb 0.64 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 1qk5 h GLU 157 CO 0.03 0.57 0.07 0.35 -1.16 0.00 0.00 179.01 178.86 1qk5 h PHE 158 N -0.15 0.61 -0.38 4.33 3.57 -1.41 -1.81 116.94 121.71 1qk5 h PHE 158 Ca 0.02 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 1qk5 h PHE 158 Cb 0.50 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1qk5 h PHE 158 CO 0.07 0.55 -0.08 0.78 -2.23 0.00 0.00 178.31 177.39 1qk5 h GLY 159 N 0.83 0.69 1.27 2.40 0.00 -1.12 -1.56 103.07 105.58 1qk5 h GLY 159 Ca 0.13 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 46.89 1qk5 h GLY 159 CO 0.00 0.45 -0.05 -2.09 0.00 0.00 0.00 176.54 174.85 1qk5 h GLU 160 N 0.59 0.88 -0.18 4.80 4.57 -0.44 -0.77 114.58 124.03 1qk5 h GLU 160 Ca 0.11 -0.27 -0.13 0.00 -1.18 0.00 0.00 59.36 57.89 1qk5 h GLU 160 Cb 0.50 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 1qk5 h GLU 160 CO 0.03 0.90 -0.45 0.00 -1.18 0.00 0.00 179.01 178.31 1qk5 h ARG 161 N 0.80 0.43 -0.04 1.92 3.08 -1.06 -2.79 114.38 116.72 1qk5 h ARG 161 Ca 0.14 -0.23 -0.18 0.00 0.07 0.00 0.00 59.98 59.79 1qk5 h ARG 161 Cb 0.54 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1qk5 h ARG 161 CO 0.03 0.80 -0.76 1.25 -1.07 0.00 0.00 179.97 180.22 1qk5 h LEU 162 N 0.35 0.30 -1.46 3.04 5.85 -1.04 -3.01 115.31 119.35 1qk5 h LEU 162 Ca 0.02 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.58 1qk5 h LEU 162 Cb 0.92 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 1qk5 h LEU 162 CO 0.08 0.95 0.41 0.11 -0.34 0.00 0.00 178.44 179.65 1qk5 h LYS 163 N 0.16 0.67 -0.12 1.25 1.57 -0.88 -1.76 116.57 117.45 1qk5 h LYS 163 Ca -0.03 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1qk5 h LYS 163 Cb 1.33 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 1qk5 h LYS 163 CO 0.12 0.44 0.13 0.00 -0.57 0.00 0.00 179.45 179.57 1qk5 h ALA 164 N 1.65 1.77 0.00 3.86 0.00 -1.37 0.10 119.26 125.27 1qk5 h ALA 164 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1qk5 h ALA 164 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1qk5 h ALA 164 CO -0.07 -0.19 -0.33 -0.39 0.00 0.00 0.00 179.25 178.26 1qk5 h VAL 165 N 0.00 0.00 -2.64 0.00 -1.51 -1.44 -3.48 116.25 107.17 1qk5 h VAL 165 Ca 0.06 -0.61 -0.00 0.00 -1.23 0.00 0.00 66.70 64.92 1qk5 h VAL 165 Cb 0.32 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 30.88 1qk5 h VAL 165 CO -0.00 0.00 -0.01 0.61 -1.23 0.00 0.00 177.57 176.94 1qk5 n GLY 166 N 1.28 0.73 3.65 5.19 0.00 0.35 -4.42 105.19 111.96 1qk5 n GLY 166 Ca 0.04 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 1qk5 n GLY 166 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qk5 s PRO 167 N -3.39 0.62 0.01 1.61 0.04 -1.26 -0.89 135.00 131.74 1qk5 s PRO 167 Ca 0.00 0.95 -0.20 0.00 0.04 0.00 0.00 61.00 61.79 1qk5 s PRO 167 Cb -0.00 -1.72 -0.21 0.00 0.04 0.00 0.00 34.50 32.61 1qk5 s PRO 167 CO 0.01 -2.72 1.15 -0.22 0.04 0.00 0.00 177.00 175.26 1qk5 h LYS 168 N -1.90 0.40 -3.45 4.56 3.64 -1.26 -3.41 116.57 115.14 1qk5 h LYS 168 Ca -0.52 -0.37 -0.10 0.00 -1.27 0.00 0.00 60.65 58.40 1qk5 h LYS 168 Cb 1.30 0.09 -0.17 0.00 -0.41 0.00 0.00 32.23 33.04 1qk5 h LYS 168 CO 0.51 1.02 -0.32 -1.54 -2.27 0.00 0.00 179.45 176.86 1qk5 s SER 169 N -6.59 -0.04 -0.12 4.20 1.04 -1.13 -4.66 113.70 106.39 1qk5 s SER 169 Ca -0.14 -0.30 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 1qk5 s SER 169 Cb 0.04 0.33 0.05 0.00 0.10 0.00 0.00 66.02 66.53 1qk5 s SER 169 CO 0.80 -0.60 0.05 -0.04 0.98 0.00 0.00 173.24 174.44 1qk5 s MET 170 N -2.65 0.27 0.24 4.02 -1.94 -1.26 -1.48 119.30 116.49 1qk5 s MET 170 Ca -0.04 -0.00 0.10 0.00 -1.71 0.00 0.00 55.69 54.03 1qk5 s MET 170 Cb -0.01 -1.39 -0.05 0.00 2.01 0.00 0.00 34.83 35.40 1qk5 s MET 170 CO -0.04 -0.50 -0.17 1.03 -0.01 0.00 0.00 175.02 175.32 1qk5 s ARG 171 N 2.05 1.49 -0.13 2.03 0.52 -0.68 -4.61 118.95 119.63 1qk5 s ARG 171 Ca 0.03 -1.67 0.02 0.00 -0.52 0.00 0.00 55.73 53.59 1qk5 s ARG 171 Cb -0.14 -1.44 0.01 0.00 0.52 0.00 0.00 34.95 33.90 1qk5 s ARG 171 CO -0.07 0.26 -0.20 0.42 0.02 0.00 0.00 175.30 175.74 1qk5 s ILE 172 N -2.71 1.85 -0.20 1.52 1.01 -1.26 -0.97 121.20 120.44 1qk5 s ILE 172 Ca 0.26 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 60.02 1qk5 s ILE 172 Cb -0.03 -1.65 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 1qk5 s ILE 172 CO 0.11 0.51 -0.06 0.00 0.00 0.00 0.00 174.94 175.50 1qk5 s ALA 173 N 0.86 2.79 -0.03 9.38 0.00 0.33 0.03 121.76 135.12 1qk5 s ALA 173 Ca -0.07 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.80 1qk5 s ALA 173 Cb -0.15 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.36 1qk5 s ALA 173 CO -0.01 -0.29 -0.08 -0.08 0.00 0.00 0.00 175.76 175.30 1qk5 s THR 174 N 1.23 0.72 0.12 0.00 -1.32 -0.27 -0.55 115.64 115.56 1qk5 s THR 174 Ca 0.03 -0.31 -0.12 0.00 -1.21 0.00 0.00 61.69 60.08 1qk5 s THR 174 Cb -0.14 -0.65 -0.11 0.00 -1.51 0.00 0.00 72.50 70.09 1qk5 s THR 174 CO -0.02 0.23 1.38 0.25 -2.21 0.00 0.00 174.62 174.25 1qk5 h LEU 175 N 6.50 0.97 -8.14 9.08 5.85 -1.38 -2.16 115.31 126.02 1qk5 h LEU 175 Ca -0.34 -0.56 -0.43 0.00 0.84 0.00 0.00 57.88 57.40 1qk5 h LEU 175 Cb 1.17 -0.28 -0.28 0.00 0.37 0.00 0.00 40.66 41.64 1qk5 h LEU 175 CO 0.49 1.35 -0.79 -0.69 -0.34 0.00 0.00 178.44 178.45 1qk5 s VAL 176 N -4.04 0.89 -0.04 1.05 1.01 -1.04 -0.44 120.40 117.79 1qk5 s VAL 176 Ca -0.11 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.36 1qk5 s VAL 176 Cb 0.10 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 1qk5 s VAL 176 CO 0.89 0.19 -0.21 -1.83 0.00 0.00 0.00 175.10 174.14 1qk5 s GLU 177 N -0.43 1.98 0.22 2.72 -1.05 0.22 -1.66 118.70 120.69 1qk5 s GLU 177 Ca 0.03 -0.74 -0.06 0.00 -0.15 0.00 0.00 54.97 54.05 1qk5 s GLU 177 Cb -0.05 -1.76 -0.06 0.00 -0.44 0.00 0.00 34.13 31.82 1qk5 s GLU 177 CO -0.00 0.36 0.48 0.15 0.95 0.00 0.00 175.26 177.20 1qk5 s LYS 178 N -0.20 3.66 -0.75 -4.83 1.02 -0.70 -1.76 119.74 116.19 1qk5 s LYS 178 Ca 0.00 0.02 -0.17 0.00 0.02 0.00 0.00 55.97 55.84 1qk5 s LYS 178 Cb -0.11 -2.73 0.16 0.00 -0.52 0.00 0.00 37.83 34.63 1qk5 s LYS 178 CO 0.02 0.34 0.80 1.03 -0.92 0.00 0.00 175.35 176.61 1qk5 s ARG 179 N -3.06 3.37 0.00 1.68 0.52 -0.58 -4.86 118.95 116.02 1qk5 s ARG 179 Ca 0.43 -1.90 0.00 0.00 -0.52 0.00 0.00 55.73 53.75 1qk5 s ARG 179 Cb -0.11 -4.47 0.00 0.00 0.52 0.00 0.00 34.95 30.89 1qk5 s ARG 179 CO 0.26 -1.47 0.00 0.25 0.02 0.00 0.00 175.30 174.36 1qk5 n THR 180 N 4.90 0.00 0.00 0.02 -2.24 -1.26 -3.68 114.28 112.02 1qk5 n THR 180 Ca 0.06 0.24 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1qk5 n THR 180 Cb 0.45 -1.17 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 1qk5 n THR 180 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1qk5 n SER 185 N -1.89 0.00 -4.66 3.42 7.64 -1.26 -5.12 113.62 111.75 1qk5 n SER 185 Ca 0.00 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.50 1qk5 n SER 185 Cb 0.00 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.25 1qk5 n SER 185 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1qk5 n LEU 186 N 0.00 4.33 -4.11 -3.43 0.00 -1.26 -5.01 117.00 107.51 1qk5 n LEU 186 Ca 0.00 0.89 -0.18 0.00 0.00 0.00 0.00 56.01 56.71 1qk5 n LEU 186 Cb 0.00 -1.46 -0.13 0.00 0.00 0.00 0.00 43.42 41.83 1qk5 n LEU 186 CO 0.00 -1.35 -0.45 -0.54 0.00 0.00 0.00 177.39 175.06 1qk5 s LYS 187 N -2.76 0.82 0.66 1.96 -0.14 0.22 -4.81 119.74 115.70 1qk5 s LYS 187 Ca 0.74 -0.71 -0.08 0.00 -1.36 0.00 0.00 55.97 54.56 1qk5 s LYS 187 Cb -0.43 -0.79 0.03 0.00 -1.68 0.00 0.00 37.83 34.96 1qk5 s LYS 187 CO 0.48 0.19 0.99 0.20 -0.76 0.00 0.00 175.35 176.46 1qk5 s GLY 188 N -1.12 1.64 -0.08 -3.33 0.00 -1.26 -3.67 107.32 99.49 1qk5 s GLY 188 Ca -0.00 -0.71 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 1qk5 s GLY 188 CO 0.01 -0.35 0.52 -0.55 0.00 0.00 0.00 173.10 172.73 1qk5 h ASP 189 N -0.46 0.31 -3.55 1.64 3.32 -0.77 -3.40 116.42 113.50 1qk5 h ASP 189 Ca -0.45 -0.64 -0.63 0.00 0.02 0.00 0.00 57.03 55.33 1qk5 h ASP 189 Cb 1.28 -0.10 -0.39 0.00 0.22 0.00 0.00 39.33 40.34 1qk5 h ASP 189 CO 0.61 1.57 -0.75 -0.36 -1.72 0.00 0.00 179.24 178.59 1qk5 s PHE 190 N -2.58 2.91 -0.08 4.55 0.40 0.00 -4.36 117.98 118.82 1qk5 s PHE 190 Ca -0.15 -2.37 0.05 0.00 -0.60 0.00 0.00 56.93 53.85 1qk5 s PHE 190 Cb 0.07 -2.26 -0.00 0.00 0.51 0.00 0.00 43.02 41.33 1qk5 s PHE 190 CO 0.80 -0.89 -0.24 0.08 0.70 0.00 0.00 175.22 175.67 1qk5 s VAL 191 N 1.20 2.05 -0.08 -0.44 1.01 -1.26 -1.11 120.40 121.77 1qk5 s VAL 191 Ca 0.06 -1.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.95 1qk5 s VAL 191 Cb -0.19 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1qk5 s VAL 191 CO -0.12 0.56 0.21 1.23 0.00 0.00 0.00 175.10 176.98 1qk5 h GLY 192 N 6.45 -0.19 -4.63 4.51 0.00 -0.88 -3.38 103.07 104.95 1qk5 h GLY 192 Ca -0.24 0.07 -0.36 0.00 0.00 0.00 0.00 47.33 46.79 1qk5 h GLY 192 CO 0.47 -0.07 -0.76 -1.36 0.00 0.00 0.00 176.54 174.82 1qk5 s PHE 193 N -2.14 1.00 -0.22 5.60 0.40 0.41 -1.63 117.98 121.40 1qk5 s PHE 193 Ca -0.03 -0.45 -0.05 0.00 -0.60 0.00 0.00 56.93 55.81 1qk5 s PHE 193 Cb 0.00 -0.58 -0.02 0.00 0.51 0.00 0.00 43.02 42.94 1qk5 s PHE 193 CO 0.08 0.00 -0.01 0.45 0.70 0.00 0.00 175.22 176.44 1qk5 s SER 194 N -1.57 4.56 0.30 1.36 0.15 -0.35 -0.61 113.70 117.54 1qk5 s SER 194 Ca -0.04 -0.32 0.07 0.00 0.70 0.00 0.00 55.95 56.35 1qk5 s SER 194 Cb -0.10 -1.79 -0.06 0.00 -1.71 0.00 0.00 66.02 62.36 1qk5 s SER 194 CO 0.01 -0.01 -0.05 0.27 1.20 0.00 0.00 173.24 174.67 1qk5 s ILE 195 N 1.43 1.69 0.77 6.45 -4.36 -0.72 -1.94 121.20 124.51 1qk5 s ILE 195 Ca 0.05 -2.11 -0.11 0.00 -0.26 0.00 0.00 60.65 58.22 1qk5 s ILE 195 Cb -0.14 -2.55 0.05 0.00 1.25 0.00 0.00 42.46 41.07 1qk5 s ILE 195 CO -0.01 -0.24 1.08 -1.83 0.24 0.00 0.00 174.94 174.19 1qk5 s GLU 196 N -3.73 2.34 -1.17 0.37 -1.05 -1.26 -1.52 118.70 112.67 1qk5 s GLU 196 Ca 0.31 1.00 -0.21 0.00 -0.15 0.00 0.00 54.97 55.92 1qk5 s GLU 196 Cb 0.04 -1.92 -0.00 0.00 -0.44 0.00 0.00 34.13 31.82 1qk5 s GLU 196 CO 0.13 -1.54 1.79 0.34 0.95 0.00 0.00 175.26 176.93 1qk5 s ASP 197 N -3.58 5.96 0.17 0.83 -1.08 -1.24 -4.63 116.67 113.11 1qk5 s ASP 197 Ca 0.60 -1.82 0.03 0.00 -0.52 0.00 0.00 52.55 50.84 1qk5 s ASP 197 Cb -0.16 -2.58 -0.05 0.00 -1.46 0.00 0.00 42.92 38.67 1qk5 s ASP 197 CO 0.56 -2.07 -0.03 0.68 0.52 0.00 0.00 175.17 174.83 1qk5 s VAL 198 N 7.38 0.86 -0.10 1.11 -7.23 -1.26 -5.07 120.40 116.09 1qk5 s VAL 198 Ca 0.60 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.54 1qk5 s VAL 198 Cb 0.00 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 1qk5 s VAL 198 CO 0.06 -0.53 0.67 0.86 -0.31 0.00 0.00 175.10 175.85 1qk5 s TRP 199 N -3.53 3.53 0.14 2.82 -0.11 -1.26 -5.02 118.94 115.51 1qk5 s TRP 199 Ca 0.22 1.16 0.08 0.00 1.22 0.00 0.00 56.10 58.78 1qk5 s TRP 199 Cb 0.05 -2.79 -0.04 0.00 -1.50 0.00 0.00 33.47 29.19 1qk5 s TRP 199 CO 0.04 0.04 -0.10 0.96 -4.62 0.00 0.00 176.95 173.26 1qk5 s ILE 200 N 1.04 3.24 0.08 5.86 -4.36 -1.26 -0.71 121.20 125.09 1qk5 s ILE 200 Ca 0.35 -1.49 -0.04 0.00 -0.26 0.00 0.00 60.65 59.21 1qk5 s ILE 200 Cb -0.17 -2.56 -0.02 0.00 1.25 0.00 0.00 42.46 40.96 1qk5 s ILE 200 CO 0.16 -0.00 0.08 0.68 0.24 0.00 0.00 174.94 176.09 1qk5 s VAL 201 N -1.46 0.17 0.00 8.37 -7.23 -0.55 -4.39 120.40 115.32 1qk5 s VAL 201 Ca 0.23 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 1qk5 s VAL 201 Cb -0.10 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.32 1qk5 s VAL 201 CO 0.14 -0.77 0.00 0.61 -0.31 0.00 0.00 175.10 174.77 1qk5 n GLY 202 N 0.01 1.48 3.96 2.32 0.00 0.56 -0.10 105.19 113.43 1qk5 n GLY 202 Ca -0.13 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 43.77 1qk5 n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qk5 s TYR 205 N -1.97 3.74 0.43 0.00 1.51 -0.22 -4.65 117.35 116.18 1qk5 s TYR 205 Ca 0.00 1.76 0.04 0.00 -1.01 0.00 0.00 57.07 57.86 1qk5 s TYR 205 Cb 0.00 -3.16 -0.05 0.00 -0.11 0.00 0.00 41.96 38.64 1qk5 s TYR 205 CO 0.00 -0.15 0.04 0.16 -1.11 0.00 0.00 175.55 174.48 1qk5 s ASP 206 N -0.74 3.48 -0.25 2.29 -4.77 -1.26 -0.32 116.67 115.10 1qk5 s ASP 206 Ca 0.45 -1.51 -0.03 0.00 -3.30 0.00 0.00 52.55 48.15 1qk5 s ASP 206 Cb -0.29 0.11 0.09 0.00 -1.09 0.00 0.00 42.92 41.74 1qk5 s ASP 206 CO 0.36 -0.69 0.10 0.12 0.70 0.00 0.00 175.17 175.76 1qk5 s PHE 207 N -2.96 0.66 -1.39 2.11 5.36 -0.68 -4.75 117.98 116.32 1qk5 s PHE 207 Ca 0.24 -0.92 -0.05 0.00 -0.96 0.00 0.00 56.93 55.25 1qk5 s PHE 207 Cb 0.06 -1.03 0.03 0.00 -0.34 0.00 0.00 43.02 41.74 1qk5 s PHE 207 CO 0.12 -0.74 0.76 0.09 -1.46 0.00 0.00 175.22 173.99 1qk5 n ASN 208 N 5.15 -2.23 0.00 6.13 3.02 -1.26 -1.50 115.26 124.57 1qk5 n ASN 208 Ca -0.06 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1qk5 n ASN 208 Cb 0.44 -3.88 0.00 0.00 -0.61 0.00 0.00 39.78 35.73 1qk5 n ASN 208 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1qk5 n GLU 209 N -4.42 0.00 -3.55 3.52 -0.58 -1.26 -5.02 120.64 109.33 1qk5 n GLU 209 Ca -0.19 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.29 1qk5 n GLU 209 Cb 0.63 -1.93 -0.02 0.00 -0.57 0.00 0.00 31.44 29.55 1qk5 n GLU 209 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 1qk5 s MET 210 N -0.01 3.52 0.00 3.49 1.75 -0.56 -4.54 119.30 122.95 1qk5 s MET 210 Ca 0.00 -0.31 0.00 0.00 -1.25 0.00 0.00 55.69 54.13 1qk5 s MET 210 Cb 0.00 -2.75 0.00 0.00 2.84 0.00 0.00 34.83 34.92 1qk5 s MET 210 CO 0.00 0.29 0.00 1.19 -0.65 0.00 0.00 175.02 175.85 1qk5 n PHE 211 N -1.12 0.00 -0.16 4.11 3.72 -1.26 -1.68 117.46 121.06 1qk5 n PHE 211 Ca -0.04 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.43 1qk5 n PHE 211 Cb 0.55 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.47 1qk5 n PHE 211 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qk5 h ARG 212 N 3.04 0.67 0.00 -1.08 3.08 -1.80 -2.07 114.38 116.22 1qk5 h ARG 212 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1qk5 h ARG 212 Cb 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1qk5 h ARG 212 CO 0.00 0.45 0.00 -0.40 -1.07 0.00 0.00 179.97 178.95 1qk5 n ASP 213 N -4.48 0.00 -4.77 7.04 5.68 -1.26 -1.33 116.55 117.43 1qk5 n ASP 213 Ca 0.10 0.47 -0.41 0.00 -0.50 0.00 0.00 54.79 54.45 1qk5 n ASP 213 Cb 0.25 -0.49 -0.01 0.00 -1.14 0.00 0.00 41.12 39.73 1qk5 n ASP 213 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1qk5 s PHE 214 N -2.97 2.83 -0.74 2.11 5.36 -0.78 -4.85 117.98 118.94 1qk5 s PHE 214 Ca 0.13 1.29 0.26 0.00 -0.96 0.00 0.00 56.93 57.64 1qk5 s PHE 214 Cb 0.16 -3.84 0.90 0.00 -0.34 0.00 0.00 43.02 39.90 1qk5 s PHE 214 CO 0.44 -2.41 1.78 -0.25 -1.46 0.00 0.00 175.22 173.32 1qk5 n ASP 215 N 0.70 0.64 -4.41 6.13 10.43 -1.26 0.14 116.55 128.91 1qk5 n ASP 215 Ca 0.01 0.58 -0.21 0.00 2.57 0.00 0.00 54.79 57.73 1qk5 n ASP 215 Cb 0.41 -0.74 -0.10 0.00 1.84 0.00 0.00 41.12 42.52 1qk5 n ASP 215 CO 0.00 0.00 0.00 -1.00 -1.07 0.00 0.00 177.20 175.13 1qk5 s HIS 216 N -3.12 2.02 -0.40 1.24 3.76 -1.26 -3.19 115.29 114.34 1qk5 s HIS 216 Ca 0.10 -0.44 -0.23 0.00 -0.15 0.00 0.00 55.06 54.34 1qk5 s HIS 216 Cb 0.13 -0.90 0.01 0.00 1.11 0.00 0.00 32.58 32.93 1qk5 s HIS 216 CO 0.54 0.55 0.75 0.08 -0.85 0.00 0.00 174.74 175.81 1qk5 s VAL 217 N -2.71 4.73 0.42 -0.90 1.01 0.30 -3.41 120.40 119.85 1qk5 s VAL 217 Ca 0.26 0.64 0.07 0.00 0.00 0.00 0.00 61.98 62.95 1qk5 s VAL 217 Cb -0.03 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 1qk5 s VAL 217 CO 0.11 -0.52 0.20 0.00 0.00 0.00 0.00 175.10 174.89 1qk5 s ALA 218 N 3.09 3.67 0.07 5.51 0.00 0.86 -0.39 121.76 134.58 1qk5 s ALA 218 Ca 0.29 -2.02 -0.19 0.00 0.00 0.00 0.00 51.96 50.05 1qk5 s ALA 218 Cb -0.13 -0.42 -0.07 0.00 0.00 0.00 0.00 23.12 22.50 1qk5 s ALA 218 CO 0.19 -0.18 0.55 0.08 0.00 0.00 0.00 175.76 176.40 1qk5 s VAL 219 N -2.61 4.77 0.03 0.00 1.01 -0.47 -1.48 120.40 121.65 1qk5 s VAL 219 Ca 0.40 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 63.25 1qk5 s VAL 219 Cb 0.03 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 1qk5 s VAL 219 CO 0.22 0.55 1.44 -0.22 0.00 0.00 0.00 175.10 177.09 1qk5 s LEU 220 N -1.14 4.33 0.45 3.92 2.96 0.11 -4.72 118.68 124.60 1qk5 s LEU 220 Ca 0.29 2.21 -0.08 0.00 -0.22 0.00 0.00 54.13 56.33 1qk5 s LEU 220 Cb -0.19 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 1qk5 s LEU 220 CO 0.18 -0.74 0.78 -0.94 -1.32 0.00 0.00 176.35 174.32 1qk5 s SER 221 N 1.85 6.37 0.43 3.68 1.04 -1.26 -4.92 113.70 120.89 1qk5 s SER 221 Ca 0.66 1.02 0.09 0.00 0.48 0.00 0.00 55.95 58.20 1qk5 s SER 221 Cb -0.34 -2.28 0.92 0.00 0.10 0.00 0.00 66.02 64.42 1qk5 s SER 221 CO 0.28 -0.51 2.06 0.44 0.98 0.00 0.00 173.24 176.50 1qk5 h ASP 222 N 0.67 0.37 -0.42 7.02 5.19 -1.94 0.17 116.42 127.47 1qk5 h ASP 222 Ca -0.47 -0.02 -0.09 0.00 -0.62 0.00 0.00 57.03 55.83 1qk5 h ASP 222 Cb 1.20 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.60 1qk5 h ASP 222 CO 0.63 0.29 -0.07 0.00 -3.12 0.00 0.00 179.24 176.96 1qk5 h ALA 223 N 1.78 0.96 0.09 3.45 0.00 -1.93 -1.58 119.26 122.02 1qk5 h ALA 223 Ca 0.11 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1qk5 h ALA 223 Cb -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1qk5 h ALA 223 CO -0.02 0.62 -0.04 0.00 0.00 0.00 0.00 179.25 179.81 1qk5 h ALA 224 N 1.13 -0.12 -0.69 0.00 0.00 -1.18 -2.35 119.26 116.05 1qk5 h ALA 224 Ca 0.14 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 54.93 1qk5 h ALA 224 Cb 0.57 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.32 1qk5 h ALA 224 CO 0.03 -0.31 0.23 -0.09 0.00 0.00 0.00 179.25 179.12 1qk5 h ARG 225 N -0.64 0.36 -0.24 0.00 2.43 -0.68 0.23 114.38 115.85 1qk5 h ARG 225 Ca -0.01 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.97 1qk5 h ARG 225 Cb 0.52 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1qk5 h ARG 225 CO 0.02 0.24 -0.50 0.87 -1.51 0.00 0.00 179.97 179.09 1qk5 h LYS 226 N 0.37 0.67 -0.08 0.20 1.57 -1.35 -2.17 116.57 115.79 1qk5 h LYS 226 Ca 0.37 -0.40 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 1qk5 h LYS 226 Cb 0.55 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1qk5 h LYS 226 CO -0.40 1.02 -0.60 -0.22 -0.57 0.00 0.00 179.45 178.68 1qk5 h LYS 227 N 0.53 0.28 -0.23 3.15 1.63 -0.77 -3.32 116.57 117.84 1qk5 h LYS 227 Ca 0.02 -0.19 -0.14 0.00 -0.85 0.00 0.00 60.65 59.49 1qk5 h LYS 227 Cb 1.06 0.03 -0.09 0.00 -0.60 0.00 0.00 32.23 32.63 1qk5 h LYS 227 CO 0.10 0.79 -0.32 1.19 -3.45 0.00 0.00 179.45 177.76 1qk5 n PHE 228 N -3.88 0.76 -3.22 1.91 3.01 -0.01 -5.02 117.46 111.01 1qk5 n PHE 228 Ca -0.03 -1.64 -0.39 0.00 1.01 0.00 0.00 57.45 56.40 1qk5 n PHE 228 Cb 0.62 -0.39 -0.06 0.00 -0.01 0.00 0.00 39.48 39.64 1qk5 n PHE 228 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1qk5 s GLU 229 N -3.29 4.22 0.00 -1.08 2.02 -0.82 -4.70 118.70 115.05 1qk5 s GLU 229 Ca 0.42 0.48 0.00 0.00 0.02 0.00 0.00 54.97 55.89 1qk5 s GLU 229 Cb 0.39 -3.55 0.00 0.00 0.10 0.00 0.00 34.13 31.07 1qk5 s GLU 229 CO -0.03 -0.14 0.00 0.36 0.02 0.00 0.00 175.26 175.47