#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 0.93 -2.19 -5.12 0.00 -1.87 -3.44 119.26 107.57 1qk5 h ALA 2 Ca 0.00 -0.33 -0.59 0.00 0.00 0.00 0.00 54.91 53.99 1qk5 h ALA 2 Cb 0.00 -0.18 0.12 0.00 0.00 0.00 0.00 17.79 17.73 1qk5 h ALA 2 CO 0.00 0.62 0.10 0.43 0.00 0.00 0.00 179.25 180.41 1qk5 n SER 3 N -4.16 1.11 -3.64 0.00 7.64 -1.26 -4.85 113.62 108.46 1qk5 n SER 3 Ca 0.01 1.09 -0.05 0.00 1.01 0.00 0.00 58.87 60.93 1qk5 n SER 3 Cb 0.38 -1.31 -0.07 0.00 -1.01 0.00 0.00 64.21 62.20 1qk5 n SER 3 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1qk5 s LYS 4 N -1.77 0.50 0.34 1.43 2.20 -1.26 -5.10 119.74 116.07 1qk5 s LYS 4 Ca 0.61 0.80 -0.29 0.00 -0.36 0.00 0.00 55.97 56.73 1qk5 s LYS 4 Cb -0.62 0.14 -0.11 0.00 -1.51 0.00 0.00 37.83 35.72 1qk5 s LYS 4 CO 0.58 -0.09 1.55 -0.35 -0.36 0.00 0.00 175.35 176.68 1qk5 n PRO 5 N 3.53 2.70 -0.10 4.03 -0.04 -1.26 -4.55 135.00 139.31 1qk5 n PRO 5 Ca -0.18 0.95 0.10 0.00 -0.04 0.00 0.00 63.50 64.34 1qk5 n PRO 5 Cb 0.57 -2.71 0.46 0.00 -0.04 0.00 0.00 33.50 31.79 1qk5 n PRO 5 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1qk5 h ILE 6 N 3.15 0.93 0.00 0.52 1.08 -1.93 -0.53 117.51 120.73 1qk5 h ILE 6 Ca -0.49 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.81 1qk5 h ILE 6 Cb 1.23 0.39 0.00 0.00 -3.07 0.00 0.00 36.82 35.38 1qk5 h ILE 6 CO 0.72 0.09 0.00 -0.08 -0.69 0.00 0.00 178.15 178.19 1qk5 h GLU 7 N 0.49 0.00 -0.00 2.37 4.81 -1.99 -1.94 114.58 118.32 1qk5 h GLU 7 Ca 0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1qk5 h GLU 7 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1qk5 h GLU 7 CO -0.08 0.00 -0.10 -0.25 -0.73 0.00 0.00 179.01 177.85 1qk5 n ASP 8 N -2.51 0.51 -4.62 1.04 8.00 -0.21 -4.92 116.55 113.84 1qk5 n ASP 8 Ca 0.00 -0.66 -0.49 0.00 0.71 0.00 0.00 54.79 54.36 1qk5 n ASP 8 Cb 0.18 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.17 1qk5 n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qk5 n TYR 9 N -0.89 1.80 -0.98 1.24 9.36 -0.73 -2.29 117.16 124.67 1qk5 n TYR 9 Ca 0.15 0.50 0.00 0.00 3.32 0.00 0.00 57.90 61.87 1qk5 n TYR 9 Cb 0.27 -2.41 0.00 0.00 -0.63 0.00 0.00 39.34 36.57 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 2.77 0.80 0.03 2.98 0.00 -1.26 -4.87 105.19 105.64 1qk5 n GLY 10 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.26 0.40 -2.61 1.61 5.02 -0.97 -1.02 118.16 118.32 1qk5 n LYS 11 Ca 0.00 -0.07 -0.21 0.00 -2.02 0.00 0.00 58.31 56.01 1qk5 n LYS 11 Cb 0.01 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 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 1.34 -0.51 3.65 0.72 0.00 -1.25 -4.81 105.19 104.32 1qk5 n GLY 12 Ca -0.00 0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -5.27 4.00 -0.04 1.61 2.20 -1.26 -2.27 119.74 118.71 1qk5 s LYS 13 Ca 0.10 2.14 0.00 0.00 -0.36 0.00 0.00 55.97 57.85 1qk5 s LYS 13 Cb -0.05 -4.06 0.00 0.00 -1.51 0.00 0.00 37.83 32.21 1qk5 s LYS 13 CO 0.13 -1.07 0.00 0.41 -0.36 0.00 0.00 175.35 174.46 1qk5 n GLY 14 N 4.45 0.43 3.87 5.54 0.00 -1.26 -5.04 105.19 113.19 1qk5 n GLY 14 Ca 0.19 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.64 2.25 -0.18 1.61 1.70 -0.96 -5.03 118.95 116.71 1qk5 s ARG 15 Ca 0.00 0.32 -0.19 0.00 -0.47 0.00 0.00 55.73 55.39 1qk5 s ARG 15 Cb 0.00 -1.96 -0.03 0.00 -0.57 0.00 0.00 34.95 32.38 1qk5 s ARG 15 CO 0.00 -1.44 0.54 0.42 -1.08 0.00 0.00 175.30 173.74 1qk5 s ILE 16 N -3.42 5.11 0.56 4.99 1.01 -1.26 -5.04 121.20 123.15 1qk5 s ILE 16 Ca 0.61 1.02 -0.20 0.00 0.00 0.00 0.00 60.65 62.07 1qk5 s ILE 16 Cb -0.12 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1qk5 s ILE 16 CO 0.51 0.20 1.22 -1.61 0.00 0.00 0.00 174.94 175.26 1qk5 s GLU 17 N 1.42 3.14 0.99 2.79 0.41 -1.26 -4.64 118.70 121.55 1qk5 s GLU 17 Ca 0.26 1.86 -0.14 0.00 -0.41 0.00 0.00 54.97 56.54 1qk5 s GLU 17 Cb -0.16 -2.05 0.19 0.00 -1.78 0.00 0.00 34.13 30.33 1qk5 s GLU 17 CO 0.10 -1.08 1.15 -1.25 -0.49 0.00 0.00 175.26 173.69 1qk5 s PRO 18 N -3.17 0.45 -0.03 0.39 0.04 -1.26 -4.98 135.00 126.45 1qk5 s PRO 18 Ca 0.74 0.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.63 1qk5 s PRO 18 Cb -0.31 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 1qk5 s PRO 18 CO 0.35 -2.63 1.66 1.41 0.04 0.00 0.00 177.00 177.82 1qk5 s MET 19 N -5.34 4.19 -0.29 4.56 -2.45 -0.79 -4.75 119.30 114.42 1qk5 s MET 19 Ca 0.67 2.21 -0.19 0.00 -1.25 0.00 0.00 55.69 57.13 1qk5 s MET 19 Cb -0.13 -3.93 -0.02 0.00 1.25 0.00 0.00 34.83 32.00 1qk5 s MET 19 CO 0.54 -0.83 0.56 -0.47 1.05 0.00 0.00 175.02 175.88 1qk5 s TYR 20 N 3.83 3.23 -0.37 4.11 5.04 -1.26 -1.04 117.35 130.90 1qk5 s TYR 20 Ca 0.74 0.53 -0.15 0.00 -2.44 0.00 0.00 57.07 55.75 1qk5 s TYR 20 Cb -0.34 -2.87 -0.00 0.00 0.35 0.00 0.00 41.96 39.10 1qk5 s TYR 20 CO 0.30 -0.41 0.35 0.42 -1.34 0.00 0.00 175.55 174.88 1qk5 s ILE 21 N 2.45 5.18 0.75 3.14 -1.09 -0.34 -4.97 121.20 126.32 1qk5 s ILE 21 Ca 0.22 -0.16 -0.13 0.00 -2.23 0.00 0.00 60.65 58.34 1qk5 s ILE 21 Cb -0.15 -3.86 0.05 0.00 -1.58 0.00 0.00 42.46 36.92 1qk5 s ILE 21 CO 0.11 -0.17 1.16 -2.84 -1.23 0.00 0.00 174.94 171.96 1qk5 s PRO 22 N 1.95 2.09 0.62 2.79 0.02 -1.26 -4.33 135.00 136.89 1qk5 s PRO 22 Ca 0.10 1.56 -0.18 0.00 0.02 0.00 0.00 61.00 62.50 1qk5 s PRO 22 Cb -0.17 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1qk5 s PRO 22 CO 0.12 -1.83 1.05 -0.25 -0.33 0.00 0.00 177.00 175.75 1qk5 n ASP 23 N -3.04 1.08 -3.84 2.53 10.43 -1.26 -3.01 116.55 119.44 1qk5 n ASP 23 Ca 0.12 0.80 -0.28 0.00 2.57 0.00 0.00 54.79 58.00 1qk5 n ASP 23 Cb 0.51 -1.43 0.04 0.00 1.84 0.00 0.00 41.12 42.08 1qk5 n ASP 23 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1qk5 n ASN 24 N -1.10 -4.75 -4.15 -2.24 3.02 -1.26 -4.97 115.26 99.81 1qk5 n ASN 24 Ca 0.14 -0.74 -0.34 0.00 -0.03 0.00 0.00 54.58 53.61 1qk5 n ASN 24 Cb 0.48 -4.11 -0.14 0.00 -0.61 0.00 0.00 39.78 35.40 1qk5 n ASN 24 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1qk5 s THR 25 N -3.34 2.78 0.06 3.41 2.01 -1.16 -5.09 115.64 114.31 1qk5 s THR 25 Ca 0.59 -1.46 -0.07 0.00 0.31 0.00 0.00 61.69 61.06 1qk5 s THR 25 Cb -0.29 -2.61 -0.01 0.00 0.01 0.00 0.00 72.50 69.61 1qk5 s THR 25 CO 0.81 -0.09 0.15 -0.36 -0.69 0.00 0.00 174.62 174.44 1qk5 s PHE 26 N 1.21 0.17 0.15 4.92 0.40 -1.26 -4.78 117.98 118.78 1qk5 s PHE 26 Ca -0.06 -0.52 0.04 0.00 -0.60 0.00 0.00 56.93 55.79 1qk5 s PHE 26 Cb -0.20 -0.10 -0.04 0.00 0.51 0.00 0.00 43.02 43.19 1qk5 s PHE 26 CO -0.02 -0.46 0.15 0.71 0.70 0.00 0.00 175.22 176.31 1qk5 s TYR 27 N -3.21 3.22 0.02 0.36 2.02 0.13 -4.91 117.35 114.98 1qk5 s TYR 27 Ca 0.00 0.03 -0.29 0.00 -0.37 0.00 0.00 57.07 56.44 1qk5 s TYR 27 Cb 0.02 -1.56 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 1qk5 s TYR 27 CO -0.07 0.52 0.94 1.21 -1.57 0.00 0.00 175.55 176.57 1qk5 s ASN 28 N -3.01 7.35 0.48 2.29 3.84 -1.26 -0.74 114.94 123.89 1qk5 s ASN 28 Ca 0.31 1.63 0.19 0.00 0.21 0.00 0.00 52.86 55.20 1qk5 s ASN 28 Cb -0.11 -2.55 1.21 0.00 -0.55 0.00 0.00 41.25 39.26 1qk5 s ASN 28 CO 0.24 -0.20 2.00 0.00 -2.79 0.00 0.00 177.10 176.35 1qk5 h ALA 29 N 6.51 2.24 0.00 1.71 0.00 -1.58 -1.27 119.26 126.87 1qk5 h ALA 29 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1qk5 h ALA 29 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1qk5 h ALA 29 CO 0.74 -0.37 0.00 -0.25 0.00 0.00 0.00 179.25 179.37 1qk5 n ASP 30 N -4.44 0.39 -0.19 0.00 10.43 -1.26 -1.45 116.55 120.02 1qk5 n ASP 30 Ca 0.09 0.67 0.13 0.00 2.57 0.00 0.00 54.79 58.24 1qk5 n ASP 30 Cb 0.47 -0.72 0.31 0.00 1.84 0.00 0.00 41.12 43.01 1qk5 n ASP 30 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1qk5 n ASP 31 N -2.01 0.96 -4.68 -2.24 10.43 -0.48 -4.88 116.55 113.65 1qk5 n ASP 31 Ca -0.00 -0.77 -0.23 0.00 2.57 0.00 0.00 54.79 56.35 1qk5 n ASP 31 Cb 0.05 0.21 -0.07 0.00 1.84 0.00 0.00 41.12 43.15 1qk5 n ASP 31 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1qk5 s PHE 32 N -2.64 2.69 -0.48 1.24 0.08 -0.53 -5.09 117.98 113.26 1qk5 s PHE 32 Ca 0.20 -0.29 -0.27 0.00 0.12 0.00 0.00 56.93 56.69 1qk5 s PHE 32 Cb 0.19 -1.37 0.03 0.00 -0.57 0.00 0.00 43.02 41.29 1qk5 s PHE 32 CO 0.58 0.51 1.02 -1.17 -0.10 0.00 0.00 175.22 176.06 1qk5 s LEU 33 N -3.74 3.84 -0.16 -0.37 0.20 -1.26 -5.01 118.68 112.19 1qk5 s LEU 33 Ca 0.34 0.23 -0.01 0.00 0.69 0.00 0.00 54.13 55.38 1qk5 s LEU 33 Cb -0.05 -3.32 -0.01 0.00 -0.43 0.00 0.00 46.19 42.38 1qk5 s LEU 33 CO 0.21 -1.16 -0.10 -0.69 -0.29 0.00 0.00 176.35 174.31 1qk5 s VAL 34 N 4.10 3.15 0.59 1.68 1.01 -1.26 -4.98 120.40 124.68 1qk5 s VAL 34 Ca 0.41 -0.61 -0.15 0.00 0.00 0.00 0.00 61.98 61.63 1qk5 s VAL 34 Cb -0.09 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1qk5 s VAL 34 CO 0.28 0.50 1.04 -2.16 0.00 0.00 0.00 175.10 174.76 1qk5 s PRO 35 N 0.68 3.41 0.42 2.72 0.04 -1.26 -4.70 135.00 136.31 1qk5 s PRO 35 Ca -0.05 1.14 0.21 0.00 0.04 0.00 0.00 61.00 62.34 1qk5 s PRO 35 Cb -0.15 -2.05 1.18 0.00 0.04 0.00 0.00 34.50 33.52 1qk5 s PRO 35 CO 0.02 -0.73 1.76 -1.35 0.04 0.00 0.00 177.00 176.75 1qk5 h PRO 36 N 0.44 0.31 0.00 0.56 0.11 -1.99 -0.65 132.00 130.78 1qk5 h PRO 36 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1qk5 h PRO 36 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1qk5 h PRO 36 CO 0.58 0.21 0.00 1.12 -0.21 0.00 0.00 178.00 179.70 1qk5 h HIS 37 N 0.32 0.00 0.00 0.65 2.07 -2.06 -2.98 115.15 113.16 1qk5 h HIS 37 Ca 0.61 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.13 1qk5 h HIS 37 Cb 1.67 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.65 1qk5 h HIS 37 CO -0.00 0.00 -1.60 0.00 -3.07 0.00 0.00 177.93 173.26 1qk5 h LYS 39 N 0.00 0.46 0.00 0.00 3.64 -1.07 -0.65 116.57 118.95 1qk5 h LYS 39 Ca 0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1qk5 h LYS 39 Cb 0.66 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1qk5 h LYS 39 CO 0.00 0.30 -0.03 -1.35 -2.27 0.00 0.00 179.45 176.10 1qk5 h PRO 40 N 0.47 0.00 0.00 1.90 0.11 -1.85 -3.32 132.00 129.31 1qk5 h PRO 40 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1qk5 h PRO 40 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1qk5 h PRO 40 CO -0.39 0.03 -0.80 0.66 -0.21 0.00 0.00 178.00 177.29 1qk5 n TYR 41 N -3.15 0.00 -3.78 0.65 4.02 -0.31 -4.82 117.16 109.77 1qk5 n TYR 41 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.53 1qk5 n TYR 41 Cb 0.31 -0.05 -0.13 0.00 -0.02 0.00 0.00 39.34 39.46 1qk5 n TYR 41 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1qk5 s ILE 42 N -2.39 4.16 -0.00 -0.72 -1.09 -0.82 -4.30 121.20 116.04 1qk5 s ILE 42 Ca 0.04 -0.23 -0.00 0.00 -2.23 0.00 0.00 60.65 58.22 1qk5 s ILE 42 Cb 0.10 -2.94 -0.00 0.00 -1.58 0.00 0.00 42.46 38.04 1qk5 s ILE 42 CO 0.56 0.35 -0.00 -0.67 -1.23 0.00 0.00 174.94 173.95 1qk5 n ASP 43 N 4.90 3.02 -4.33 3.58 -0.08 -1.26 -4.77 116.55 117.61 1qk5 n ASP 43 Ca -0.16 -0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.79 1qk5 n ASP 43 Cb 0.51 -0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.82 1qk5 n ASP 43 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1qk5 s LYS 44 N -2.00 2.94 -0.22 -0.67 1.02 -1.26 -1.53 119.74 118.01 1qk5 s LYS 44 Ca -0.00 -0.79 -0.06 0.00 0.02 0.00 0.00 55.97 55.14 1qk5 s LYS 44 Cb 0.00 -2.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.89 1qk5 s LYS 44 CO 0.00 0.32 0.02 0.42 -0.92 0.00 0.00 175.35 175.20 1qk5 s ILE 45 N 0.02 3.98 -0.10 2.17 1.01 0.08 -2.19 121.20 126.18 1qk5 s ILE 45 Ca -0.07 -0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.04 1qk5 s ILE 45 Cb -0.15 -2.83 -0.28 0.00 0.01 0.00 0.00 42.46 39.21 1qk5 s ILE 45 CO 0.05 0.39 0.77 0.25 0.00 0.00 0.00 174.94 176.40 1qk5 h LEU 46 N 7.93 0.22 -7.40 2.97 5.85 -0.86 0.41 115.31 124.43 1qk5 h LEU 46 Ca -0.38 -0.94 -0.53 0.00 0.84 0.00 0.00 57.88 56.87 1qk5 h LEU 46 Cb 1.17 -0.07 -0.39 0.00 0.37 0.00 0.00 40.66 41.74 1qk5 h LEU 46 CO 0.60 1.24 -0.77 -0.76 -0.34 0.00 0.00 178.44 178.40 1qk5 s LEU 47 N -8.01 1.40 0.49 2.25 1.43 -0.65 -4.77 118.68 110.82 1qk5 s LEU 47 Ca -0.18 -0.78 -0.24 0.00 -1.03 0.00 0.00 54.13 51.91 1qk5 s LEU 47 Cb -0.00 -0.72 -0.07 0.00 0.03 0.00 0.00 46.19 45.43 1qk5 s LEU 47 CO 0.75 -0.27 1.35 -2.65 0.23 0.00 0.00 176.35 175.76 1qk5 n PRO 48 N 4.98 1.90 -0.34 1.29 -0.02 -1.26 -0.98 135.00 140.56 1qk5 n PRO 48 Ca -0.10 0.68 0.06 0.00 -2.02 0.00 0.00 63.50 62.13 1qk5 n PRO 48 Cb 0.47 -2.53 0.23 0.00 -0.02 0.00 0.00 33.50 31.64 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 1.82 1.55 1.54 -1.23 0.00 -1.91 0.65 103.07 105.49 1qk5 h GLY 49 Ca -0.50 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.37 1qk5 h GLY 49 CO 0.59 0.12 -0.14 -1.33 0.00 0.00 0.00 176.54 175.78 1qk5 h GLY 50 N 0.90 0.60 1.08 4.60 0.00 -1.89 -1.26 103.07 107.10 1qk5 h GLY 50 Ca 0.48 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 47.27 1qk5 h GLY 50 CO -0.28 0.40 -0.09 -2.00 0.00 0.00 0.00 176.54 174.57 1qk5 h LEU 51 N 0.51 1.01 -0.14 3.11 5.85 -1.25 -1.71 115.31 122.68 1qk5 h LEU 51 Ca 0.09 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.50 1qk5 h LEU 51 Cb 0.54 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1qk5 h LEU 51 CO 0.03 1.12 -0.08 0.58 -0.34 0.00 0.00 178.44 179.75 1qk5 h VAL 52 N 0.88 0.75 -0.94 1.05 2.07 -1.06 -1.06 116.25 117.95 1qk5 h VAL 52 Ca 0.14 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.70 1qk5 h VAL 52 Cb 0.65 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 1qk5 h VAL 52 CO 0.05 0.00 0.62 0.11 0.02 0.00 0.00 177.57 178.36 1qk5 h LYS 53 N -0.07 1.13 -0.48 1.57 1.57 -1.08 0.34 116.57 119.55 1qk5 h LYS 53 Ca 0.08 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 1qk5 h LYS 53 Cb 0.20 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1qk5 h LYS 53 CO -0.19 0.75 -0.12 -0.44 -0.57 0.00 0.00 179.45 178.87 1qk5 h ASP 54 N 1.16 0.89 0.03 0.86 3.32 -0.90 -1.08 116.42 120.69 1qk5 h ASP 54 Ca 0.38 -0.28 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 1qk5 h ASP 54 Cb 0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1qk5 h ASP 54 CO -0.12 1.02 -0.57 -0.09 -1.72 0.00 0.00 179.24 177.76 1qk5 h ARG 55 N 0.79 0.56 -0.22 3.56 9.65 -0.60 -2.90 114.38 125.23 1qk5 h ARG 55 Ca 0.13 -0.36 -0.07 0.00 -1.10 0.00 0.00 59.98 58.57 1qk5 h ARG 55 Cb 0.65 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.26 1qk5 h ARG 55 CO 0.05 0.98 -0.16 0.28 2.80 0.00 0.00 179.97 183.92 1qk5 h VAL 56 N 0.43 1.22 -0.81 0.20 2.07 -0.59 -1.05 116.25 117.71 1qk5 h VAL 56 Ca 0.00 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1qk5 h VAL 56 Cb 1.12 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 1qk5 h VAL 56 CO 0.11 0.31 0.44 -0.08 0.02 0.00 0.00 177.57 178.37 1qk5 h GLU 57 N 0.35 1.13 -0.55 1.57 4.81 -1.01 0.02 114.58 120.90 1qk5 h GLU 57 Ca 0.06 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 1qk5 h GLU 57 Cb 0.48 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1qk5 h GLU 57 CO 0.03 0.83 0.03 -0.22 -0.73 0.00 0.00 179.01 178.95 1qk5 h LYS 58 N 1.13 0.95 -0.76 1.92 1.63 -1.13 -1.68 116.57 118.62 1qk5 h LYS 58 Ca 0.29 -0.29 -0.05 0.00 -0.85 0.00 0.00 60.65 59.75 1qk5 h LYS 58 Cb 0.03 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 1qk5 h LYS 58 CO -0.05 0.94 0.27 -0.07 -3.45 0.00 0.00 179.45 177.10 1qk5 h LEU 59 N 0.83 1.07 -0.95 5.20 3.38 -0.87 -0.18 115.31 123.79 1qk5 h LEU 59 Ca 0.16 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1qk5 h LEU 59 Cb 0.50 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 1qk5 h LEU 59 CO 0.02 0.97 0.42 0.00 0.09 0.00 0.00 178.44 179.95 1qk5 h ALA 60 N 1.14 1.19 -0.43 1.53 0.00 -0.73 0.13 119.26 122.09 1qk5 h ALA 60 Ca 0.25 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1qk5 h ALA 60 Cb 0.26 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1qk5 h ALA 60 CO -0.01 0.63 -0.01 -0.92 0.00 0.00 0.00 179.25 178.93 1qk5 h TYR 61 N 1.16 0.85 -0.69 0.00 3.20 -0.45 0.89 116.97 121.94 1qk5 h TYR 61 Ca 0.29 -0.15 0.05 0.00 3.14 0.00 0.00 58.73 62.06 1qk5 h TYR 61 Cb 0.07 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.07 1qk5 h TYR 61 CO 0.01 0.84 0.40 -0.44 -1.64 0.00 0.00 178.16 177.33 1qk5 h ASP 62 N 0.61 0.61 -0.50 -2.11 3.32 -0.33 -0.60 116.42 117.43 1qk5 h ASP 62 Ca 0.12 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.07 1qk5 h ASP 62 Cb 0.51 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1qk5 h ASP 62 CO 0.02 0.40 -0.15 0.40 -1.72 0.00 0.00 179.24 178.19 1qk5 h ILE 63 N 0.74 1.27 -0.42 0.35 2.04 -0.37 -2.55 117.51 118.57 1qk5 h ILE 63 Ca 0.30 -1.31 0.03 0.00 1.00 0.00 0.00 64.86 64.88 1qk5 h ILE 63 Cb 0.15 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 1qk5 h ILE 63 CO -0.16 0.46 0.21 -0.74 0.00 0.00 0.00 178.15 177.92 1qk5 h HIS 64 N 0.87 0.39 -0.46 1.37 2.76 -0.36 -0.28 115.15 119.45 1qk5 h HIS 64 Ca 0.13 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.29 1qk5 h HIS 64 Cb 0.72 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.54 1qk5 h HIS 64 CO 0.05 0.21 0.19 0.00 -1.30 0.00 0.00 177.93 177.07 1qk5 h ARG 65 N 0.43 0.65 -0.02 5.26 3.08 -0.99 0.81 114.38 123.60 1qk5 h ARG 65 Ca 0.18 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 1qk5 h ARG 65 Cb 0.07 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1qk5 h ARG 65 CO -0.12 0.54 -0.15 1.15 -1.07 0.00 0.00 179.97 180.32 1qk5 h THR 66 N 0.65 1.51 -0.02 2.04 2.02 -0.88 -3.38 112.91 114.85 1qk5 h THR 66 Ca 0.16 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.62 1qk5 h THR 66 Cb 0.13 2.58 0.00 0.00 -1.74 0.00 0.00 68.15 69.11 1qk5 h THR 66 CO -0.02 0.47 -0.36 -1.22 0.37 0.00 0.00 175.52 174.76 1qk5 n TYR 67 N -4.60 0.00 -1.62 3.16 4.02 -0.21 -2.59 117.16 115.33 1qk5 n TYR 67 Ca -0.09 0.00 -0.47 0.00 -0.01 0.00 0.00 57.90 57.33 1qk5 n TYR 67 Cb 0.43 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.71 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 0.10 1.64 -0.87 -0.72 7.35 0.27 -0.86 117.46 124.37 1qk5 n PHE 68 Ca 0.09 0.58 0.00 0.00 -0.76 0.00 0.00 57.45 57.36 1qk5 n PHE 68 Cb 0.43 -2.35 0.00 0.00 0.35 0.00 0.00 39.48 37.91 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 2.01 0.87 3.39 7.13 0.00 -1.26 -5.02 105.19 112.31 1qk5 n GLY 69 Ca 0.13 0.00 -0.27 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 -0.13 1.41 0.07 1.61 0.41 -0.04 -4.92 118.70 117.10 1qk5 s GLU 70 Ca 0.00 -1.40 -0.31 0.00 -0.41 0.00 0.00 54.97 52.85 1qk5 s GLU 70 Cb 0.00 -1.79 -0.07 0.00 -1.78 0.00 0.00 34.13 30.48 1qk5 s GLU 70 CO 0.00 0.41 1.47 -2.00 -0.49 0.00 0.00 175.26 174.65 1qk5 s GLU 71 N -2.31 4.27 -0.11 1.61 2.12 -1.26 -4.96 118.70 118.05 1qk5 s GLU 71 Ca 0.16 2.13 0.00 0.00 0.36 0.00 0.00 54.97 57.62 1qk5 s GLU 71 Cb -0.09 -3.43 0.02 0.00 0.26 0.00 0.00 34.13 30.89 1qk5 s GLU 71 CO 0.07 -0.57 -0.11 -1.17 -0.54 0.00 0.00 175.26 172.94 1qk5 s LEU 72 N 1.89 1.45 -0.30 2.70 2.96 -1.26 -4.23 118.68 121.89 1qk5 s LEU 72 Ca 0.67 -0.36 -0.09 0.00 -0.22 0.00 0.00 54.13 54.12 1qk5 s LEU 72 Cb -0.36 -0.96 -0.02 0.00 0.50 0.00 0.00 46.19 45.35 1qk5 s LEU 72 CO 0.30 -0.06 0.14 -1.00 -1.32 0.00 0.00 176.35 174.41 1qk5 s HIS 73 N 1.40 3.17 -0.20 5.38 3.76 -0.12 -0.48 115.29 128.20 1qk5 s HIS 73 Ca 0.00 -0.45 -0.06 0.00 -0.15 0.00 0.00 55.06 54.41 1qk5 s HIS 73 Cb -0.13 -2.34 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 1qk5 s HIS 73 CO -0.06 -0.40 0.02 0.42 -0.85 0.00 0.00 174.74 173.87 1qk5 s ILE 74 N 1.63 4.23 -0.26 0.60 1.01 -0.03 -1.01 121.20 127.38 1qk5 s ILE 74 Ca 0.05 -0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.40 1qk5 s ILE 74 Cb -0.17 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 1qk5 s ILE 74 CO 0.06 0.43 0.11 -0.63 0.00 0.00 0.00 174.94 174.91 1qk5 s ILE 75 N 0.82 4.62 -0.09 2.92 1.01 0.22 -0.92 121.20 129.79 1qk5 s ILE 75 Ca 0.02 -0.07 -0.24 0.00 0.00 0.00 0.00 60.65 60.35 1qk5 s ILE 75 Cb -0.14 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 1qk5 s ILE 75 CO 0.02 0.31 0.75 0.00 0.00 0.00 0.00 174.94 176.02 1qk5 s ILE 77 N 1.18 4.70 0.45 0.00 -1.09 -0.80 -1.17 121.20 124.48 1qk5 s ILE 77 Ca 0.39 -0.11 -0.10 0.00 -2.23 0.00 0.00 60.65 58.60 1qk5 s ILE 77 Cb -0.18 -4.36 -0.06 0.00 -1.58 0.00 0.00 42.46 36.28 1qk5 s ILE 77 CO 0.17 -0.87 0.82 -0.76 -1.23 0.00 0.00 174.94 173.08 1qk5 s LEU 78 N 3.11 3.70 0.21 2.97 1.43 0.56 -1.83 118.68 128.83 1qk5 s LEU 78 Ca 0.22 1.17 0.22 0.00 -1.03 0.00 0.00 54.13 54.70 1qk5 s LEU 78 Cb -0.16 -4.09 0.02 0.00 0.03 0.00 0.00 46.19 41.99 1qk5 s LEU 78 CO 0.16 -0.51 1.08 0.11 0.23 0.00 0.00 176.35 177.42 1qk5 h LYS 79 N 0.84 0.00 -0.51 1.70 1.57 -1.89 -3.03 116.57 115.26 1qk5 h LYS 79 Ca -0.47 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.43 1qk5 h LYS 79 Cb 1.19 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 1qk5 h LYS 79 CO 0.63 0.05 0.35 0.78 -0.57 0.00 0.00 179.45 180.69 1qk5 h GLY 80 N 3.95 0.26 -1.48 3.86 0.00 -1.83 -2.15 103.07 105.68 1qk5 h GLY 80 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1qk5 h GLY 80 CO 0.01 0.04 0.00 -1.14 0.00 0.00 0.00 176.54 175.45 1qk5 n SER 81 N -4.44 2.30 -0.20 0.19 3.41 -0.76 -4.40 113.62 109.72 1qk5 n SER 81 Ca 0.09 -1.91 0.01 0.00 -0.26 0.00 0.00 58.87 56.79 1qk5 n SER 81 Cb 0.46 -0.24 0.10 0.00 -0.26 0.00 0.00 64.21 64.27 1qk5 n SER 81 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1qk5 h ARG 82 N 2.70 0.18 -0.19 4.33 1.12 -1.61 0.29 114.38 121.21 1qk5 h ARG 82 Ca 0.00 -0.01 -0.06 0.00 -1.11 0.00 0.00 59.98 58.80 1qk5 h ARG 82 Cb 0.61 -0.04 -0.00 0.00 -0.01 0.00 0.00 29.97 30.52 1qk5 h ARG 82 CO 0.00 0.12 -0.13 0.78 -3.11 0.00 0.00 179.97 177.63 1qk5 h GLY 83 N 0.19 0.46 0.84 2.80 0.00 -1.84 -0.28 103.07 105.24 1qk5 h GLY 83 Ca 0.31 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1qk5 h GLY 83 CO -0.45 0.40 0.04 -2.75 0.00 0.00 0.00 176.54 173.77 1qk5 h PHE 84 N 0.11 0.30 -0.55 5.60 3.57 -1.71 -2.09 116.94 122.17 1qk5 h PHE 84 Ca 0.04 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1qk5 h PHE 84 Cb 0.64 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 1qk5 h PHE 84 CO 0.07 0.42 0.28 0.35 -2.23 0.00 0.00 178.31 177.20 1qk5 h PHE 85 N 0.09 0.50 -0.43 0.41 3.57 -0.39 0.11 116.94 120.80 1qk5 h PHE 85 Ca 0.06 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 1qk5 h PHE 85 Cb 0.28 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 1qk5 h PHE 85 CO 0.01 0.24 -0.05 -0.91 -2.23 0.00 0.00 178.31 175.37 1qk5 h ASN 86 N 0.53 0.71 -0.27 0.41 2.35 -0.94 -0.56 115.58 117.81 1qk5 h ASN 86 Ca 0.25 -0.18 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 1qk5 h ASN 86 Cb 0.17 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1qk5 h ASN 86 CO -0.18 0.81 -0.10 -0.07 -1.65 0.00 0.00 177.43 176.24 1qk5 h LEU 87 N 0.68 0.55 -0.45 1.61 3.38 -1.03 -2.44 115.31 117.61 1qk5 h LEU 87 Ca 0.13 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1qk5 h LEU 87 Cb 0.49 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1qk5 h LEU 87 CO 0.03 0.81 0.22 0.25 0.09 0.00 0.00 178.44 179.84 1qk5 h LEU 88 N 0.28 0.58 -1.06 1.67 5.85 -0.36 -1.85 115.31 120.42 1qk5 h LEU 88 Ca 0.06 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 1qk5 h LEU 88 Cb 0.59 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1qk5 h LEU 88 CO 0.03 0.54 -0.47 0.16 -0.34 0.00 0.00 178.44 178.37 1qk5 h ILE 89 N 0.58 1.33 -0.14 4.05 3.07 -1.09 0.24 117.51 125.55 1qk5 h ILE 89 Ca 0.15 -1.62 -0.04 0.00 1.55 0.00 0.00 64.86 64.90 1qk5 h ILE 89 Cb 0.11 1.87 -0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1qk5 h ILE 89 CO -0.02 0.46 -0.08 -0.78 -1.05 0.00 0.00 178.15 176.68 1qk5 h ASP 90 N 0.00 0.32 -0.55 2.16 1.82 -1.17 -1.98 116.42 117.02 1qk5 h ASP 90 Ca -0.00 -0.43 -0.08 0.00 -0.39 0.00 0.00 57.03 56.13 1qk5 h ASP 90 Cb 0.84 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.74 1qk5 h ASP 90 CO 0.06 0.68 0.04 1.88 -1.61 0.00 0.00 179.24 180.29 1qk5 h TYR 91 N -0.04 1.02 -0.91 0.28 -1.99 -1.00 -1.20 116.97 113.13 1qk5 h TYR 91 Ca 0.03 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.59 1qk5 h TYR 91 Cb 0.56 -0.27 -0.04 0.00 2.00 0.00 0.00 36.73 38.98 1qk5 h TYR 91 CO 0.07 0.92 0.53 -0.07 -0.00 0.00 0.00 178.16 179.60 1qk5 h LEU 92 N 0.83 1.11 -0.01 3.88 3.38 -0.46 -0.10 115.31 123.92 1qk5 h LEU 92 Ca 0.16 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1qk5 h LEU 92 Cb 0.48 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1qk5 h LEU 92 CO 0.02 0.87 0.00 0.00 0.09 0.00 0.00 178.44 179.42 1qk5 h ALA 93 N 1.29 0.02 -0.50 1.53 0.00 -1.20 -1.55 119.26 118.84 1qk5 h ALA 93 Ca 0.32 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1qk5 h ALA 93 Cb -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1qk5 h ALA 93 CO -0.06 -0.37 0.30 1.15 0.00 0.00 0.00 179.25 180.28 1qk5 h THR 94 N -0.21 1.06 -0.08 0.00 2.02 -0.95 0.26 112.91 115.01 1qk5 h THR 94 Ca 0.00 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1qk5 h THR 94 Cb 0.23 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1qk5 h THR 94 CO 0.00 0.11 0.05 0.40 0.37 0.00 0.00 175.52 176.45 1qk5 h ILE 95 N 0.61 1.03 -0.50 3.11 2.04 -0.94 -0.81 117.51 122.04 1qk5 h ILE 95 Ca 0.20 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 1qk5 h ILE 95 Cb 0.01 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1qk5 h ILE 95 CO -0.08 0.02 0.27 -0.61 0.00 0.00 0.00 178.15 177.75 1qk5 h GLN 96 N 0.10 0.70 -0.86 2.37 4.15 -1.05 -0.43 115.11 120.09 1qk5 h GLN 96 Ca 0.03 -0.09 0.06 0.00 0.77 0.00 0.00 58.65 59.42 1qk5 h GLN 96 Cb -0.00 -0.13 -0.06 0.00 0.21 0.00 0.00 27.48 27.49 1qk5 h GLN 96 CO -0.01 0.56 0.53 -0.22 -1.93 0.00 0.00 178.83 177.76 1qk5 h LYS 97 N 0.66 0.95 -0.01 1.69 3.64 -0.56 -2.69 116.57 120.24 1qk5 h LYS 97 Ca 0.17 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1qk5 h LYS 97 Cb 0.07 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1qk5 h LYS 97 CO -0.03 0.63 -0.28 0.66 -2.27 0.00 0.00 179.45 178.16 1qk5 n TYR 98 N -4.62 0.00 0.19 1.91 0.53 -0.34 -4.47 117.16 110.36 1qk5 n TYR 98 Ca 0.12 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 57.07 1qk5 n TYR 98 Cb 0.18 -0.07 0.56 0.00 -1.03 0.00 0.00 39.34 38.98 1qk5 n TYR 98 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 1qk5 h SER 99 N 1.89 0.12 -0.01 7.72 4.64 -0.72 -3.46 113.55 123.73 1qk5 h SER 99 Ca 0.00 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1qk5 h SER 99 Cb 0.61 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1qk5 h SER 99 CO 0.00 0.12 -0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1qk5 n GLY 100 N -1.42 0.47 3.85 -0.77 0.00 -1.26 -5.02 105.19 101.04 1qk5 n GLY 100 Ca -0.01 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 1qk5 n GLY 100 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qk5 s ARG 101 N -0.56 3.18 -0.20 1.61 0.52 -1.26 -5.09 118.95 117.15 1qk5 s ARG 101 Ca 0.00 -0.53 -0.06 0.00 -0.52 0.00 0.00 55.73 54.62 1qk5 s ARG 101 Cb 0.00 -2.91 -0.03 0.00 0.52 0.00 0.00 34.95 32.54 1qk5 s ARG 101 CO 0.00 0.60 0.02 -1.21 0.02 0.00 0.00 175.30 174.73 1qk5 s GLU 102 N -2.33 3.71 0.02 3.54 0.41 -1.26 -5.02 118.70 117.77 1qk5 s GLU 102 Ca 0.31 -0.48 0.01 0.00 -0.41 0.00 0.00 54.97 54.40 1qk5 s GLU 102 Cb -0.13 -3.12 -0.01 0.00 -1.78 0.00 0.00 34.13 29.10 1qk5 s GLU 102 CO 0.23 0.08 -0.05 0.45 -0.49 0.00 0.00 175.26 175.49 1qk5 s SER 103 N 0.84 0.52 0.00 -0.19 0.15 -1.26 -5.01 113.70 108.74 1qk5 s SER 103 Ca 0.01 -0.31 0.25 0.00 0.70 0.00 0.00 55.95 56.60 1qk5 s SER 103 Cb -0.14 0.01 0.49 0.00 -1.71 0.00 0.00 66.02 64.67 1qk5 s SER 103 CO 0.02 -0.11 1.43 -1.20 1.20 0.00 0.00 173.24 174.59 1qk5 n SER 104 N 2.21 2.55 -4.59 5.45 7.64 -1.26 -4.89 113.62 120.73 1qk5 n SER 104 Ca -0.18 -1.84 -0.34 0.00 1.01 0.00 0.00 58.87 57.52 1qk5 n SER 104 Cb 0.57 -0.04 -0.11 0.00 -1.01 0.00 0.00 64.21 63.62 1qk5 n SER 104 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1qk5 s VAL 105 N -1.93 4.09 1.00 0.44 0.11 -1.26 -5.10 120.40 117.75 1qk5 s VAL 105 Ca 0.32 -0.31 -0.13 0.00 -2.93 0.00 0.00 61.98 58.93 1qk5 s VAL 105 Cb 0.20 -2.75 0.12 0.00 -1.53 0.00 0.00 36.38 32.43 1qk5 s VAL 105 CO 0.31 0.55 0.67 -2.65 -3.33 0.00 0.00 175.10 170.66 1qk5 n PRO 106 N 2.76 -0.90 0.27 1.54 -0.02 -1.26 -4.91 135.00 132.48 1qk5 n PRO 106 Ca -0.18 -0.22 0.16 0.00 -2.02 0.00 0.00 63.50 61.25 1qk5 n PRO 106 Cb 0.53 -2.05 0.70 0.00 -0.02 0.00 0.00 33.50 32.66 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 -1.93 0.00 -2.05 0.52 0.13 -1.94 -3.44 132.00 123.28 1qk5 h PRO 107 Ca -0.48 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.85 1qk5 h PRO 107 Cb 1.30 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.31 1qk5 h PRO 107 CO 0.39 0.04 0.59 -0.59 -0.23 0.00 0.00 178.00 178.21 1qk5 s PHE 108 N -3.74 -0.17 -0.11 1.56 -0.12 -1.26 -4.75 117.98 109.39 1qk5 s PHE 108 Ca 0.00 -0.03 0.03 0.00 -0.05 0.00 0.00 56.93 56.88 1qk5 s PHE 108 Cb 0.10 0.58 0.01 0.00 -0.63 0.00 0.00 43.02 43.08 1qk5 s PHE 108 CO 0.55 -0.58 -0.20 -0.06 -0.05 0.00 0.00 175.22 174.88 1qk5 s PHE 109 N -2.98 2.34 0.18 3.49 0.40 0.37 -4.95 117.98 116.83 1qk5 s PHE 109 Ca 0.11 -1.06 -0.06 0.00 -0.60 0.00 0.00 56.93 55.31 1qk5 s PHE 109 Cb 0.00 -1.61 -0.06 0.00 0.51 0.00 0.00 43.02 41.86 1qk5 s PHE 109 CO -0.02 -0.48 0.44 -1.83 0.70 0.00 0.00 175.22 174.03 1qk5 s GLU 110 N 0.68 3.68 0.12 0.44 -1.05 -1.26 -0.85 118.70 120.46 1qk5 s GLU 110 Ca -0.12 0.03 -0.09 0.00 -0.15 0.00 0.00 54.97 54.64 1qk5 s GLU 110 Cb -0.16 -2.77 -0.00 0.00 -0.44 0.00 0.00 34.13 30.76 1qk5 s GLU 110 CO 0.03 0.40 0.24 -1.01 0.95 0.00 0.00 175.26 175.87 1qk5 s HIS 111 N -1.74 0.25 -0.01 4.83 3.76 -0.10 -4.91 115.29 117.37 1qk5 s HIS 111 Ca 0.43 -0.64 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1qk5 s HIS 111 Cb -0.12 -0.05 0.01 0.00 1.11 0.00 0.00 32.58 33.53 1qk5 s HIS 111 CO 0.24 -0.63 -0.03 0.71 -0.85 0.00 0.00 174.74 174.18 1qk5 s TYR 112 N -3.91 0.39 0.03 1.40 1.51 -1.26 -0.39 117.35 115.12 1qk5 s TYR 112 Ca 0.10 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 56.11 1qk5 s TYR 112 Cb 0.04 -0.32 -0.02 0.00 -0.11 0.00 0.00 41.96 41.55 1qk5 s TYR 112 CO -0.06 -0.06 -0.06 0.14 -1.11 0.00 0.00 175.55 174.40 1qk5 s VAL 113 N 0.31 0.38 -0.17 0.71 -7.23 -0.31 -4.51 120.40 109.57 1qk5 s VAL 113 Ca -0.03 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.20 1qk5 s VAL 113 Cb -0.06 -0.46 0.00 0.00 0.56 0.00 0.00 36.38 36.42 1qk5 s VAL 113 CO -0.01 -0.38 -0.16 -0.60 -0.31 0.00 0.00 175.10 173.64 1qk5 s ARG 114 N -1.42 3.15 0.14 4.82 6.06 0.08 -0.32 118.95 131.45 1qk5 s ARG 114 Ca -0.11 -0.77 0.11 0.00 -2.50 0.00 0.00 55.73 52.45 1qk5 s ARG 114 Cb -0.09 -2.62 -0.04 0.00 0.06 0.00 0.00 34.95 32.25 1qk5 s ARG 114 CO -0.00 -0.07 -0.25 -0.51 -2.50 0.00 0.00 175.30 171.97 1qk5 s LEU 115 N 1.00 2.41 0.00 -0.88 1.43 -1.14 -1.46 118.68 120.04 1qk5 s LEU 115 Ca -0.02 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1qk5 s LEU 115 Cb -0.15 -1.27 0.00 0.00 0.03 0.00 0.00 46.19 44.80 1qk5 s LEU 115 CO -0.04 0.17 0.00 1.17 0.23 0.00 0.00 176.35 177.88 1qk5 n LYS 116 N 0.79 0.00 0.00 1.70 4.81 -1.26 -4.68 118.16 119.51 1qk5 n LYS 116 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 1qk5 n LYS 116 Cb 0.53 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.58 1qk5 n LYS 116 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1qk5 n THR 128 N -0.28 0.00 -3.98 3.15 5.66 -1.26 -5.13 114.28 112.44 1qk5 n THR 128 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 1qk5 n THR 128 Cb 0.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 1qk5 n THR 128 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1qk5 s VAL 129 N 0.00 5.00 -0.21 1.08 1.01 -1.26 -4.96 120.40 121.06 1qk5 s VAL 129 Ca 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 1qk5 s VAL 129 Cb 0.00 -3.44 0.10 0.00 0.00 0.00 0.00 36.38 33.04 1qk5 s VAL 129 CO 0.00 0.11 0.27 -0.22 0.00 0.00 0.00 175.10 175.26 1qk5 s LEU 130 N -2.53 -0.28 0.26 3.92 2.96 -0.54 -4.99 118.68 117.48 1qk5 s LEU 130 Ca 0.32 0.00 -0.21 0.00 -0.22 0.00 0.00 54.13 54.03 1qk5 s LEU 130 Cb -0.12 0.64 0.05 0.00 0.50 0.00 0.00 46.19 47.25 1qk5 s LEU 130 CO 0.25 -0.31 0.84 -0.94 -1.32 0.00 0.00 176.35 174.88 1qk5 s SER 131 N 2.40 -0.14 1.18 3.68 1.04 -1.26 -0.74 113.70 119.86 1qk5 s SER 131 Ca 0.08 -0.69 -0.19 0.00 0.48 0.00 0.00 55.95 55.63 1qk5 s SER 131 Cb -0.15 0.66 0.28 0.00 0.10 0.00 0.00 66.02 66.91 1qk5 s SER 131 CO -0.13 -1.26 1.13 -1.81 0.98 0.00 0.00 173.24 172.15 1qk5 s ASP 132 N -3.02 1.09 0.09 7.02 1.11 -1.26 -4.91 116.67 116.79 1qk5 s ASP 132 Ca 0.14 0.59 -0.32 0.00 0.18 0.00 0.00 52.55 53.14 1qk5 s ASP 132 Cb -0.04 -0.81 -0.11 0.00 1.07 0.00 0.00 42.92 43.03 1qk5 s ASP 132 CO 0.07 -4.01 1.84 -0.67 1.18 0.00 0.00 175.17 173.57 1qk5 n ASP 133 N -4.68 3.90 -0.01 0.27 -0.08 -1.26 -4.88 116.55 109.82 1qk5 n ASP 133 Ca 0.13 0.98 0.14 0.00 -1.51 0.00 0.00 54.79 54.54 1qk5 n ASP 133 Cb 0.59 -1.51 0.61 0.00 2.34 0.00 0.00 41.12 43.15 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 5.82 0.08 0.08 -2.67 4.77 -1.26 -3.85 117.00 119.96 1qk5 n LEU 134 Ca 0.19 0.38 0.07 0.00 -0.03 0.00 0.00 56.01 56.62 1qk5 n LEU 134 Cb 0.36 -0.42 0.35 0.00 -2.33 0.00 0.00 43.42 41.38 1qk5 n LEU 134 CO 0.67 0.02 0.72 -1.54 -1.33 0.00 0.00 177.39 175.93 1qk5 n SER 135 N -1.43 0.32 0.00 -1.43 3.41 -1.26 -2.12 113.62 111.11 1qk5 n SER 135 Ca 0.09 0.62 0.11 0.00 -0.26 0.00 0.00 58.87 59.42 1qk5 n SER 135 Cb 0.32 -0.67 0.52 0.00 -0.26 0.00 0.00 64.21 64.12 1qk5 n SER 135 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1qk5 n ILE 136 N -1.90 0.38 1.76 -1.33 -5.35 -1.25 -1.38 119.36 110.30 1qk5 n ILE 136 Ca 0.01 0.10 0.15 0.00 -0.27 0.00 0.00 62.75 62.74 1qk5 n ILE 136 Cb 0.09 -0.71 0.82 0.00 -1.74 0.00 0.00 39.64 38.10 1qk5 n ILE 136 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1qk5 n PHE 137 N -1.42 0.00 -1.71 4.28 3.01 -0.90 -4.83 117.46 115.89 1qk5 n PHE 137 Ca 0.07 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.10 1qk5 n PHE 137 Cb 0.24 -0.07 -0.03 0.00 -0.01 0.00 0.00 39.48 39.61 1qk5 n PHE 137 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1qk5 n ARG 138 N -0.88 2.43 -2.25 -1.08 0.63 -0.48 -1.62 116.66 113.40 1qk5 n ARG 138 Ca 0.21 0.87 -0.20 0.00 -0.92 0.00 0.00 57.85 57.81 1qk5 n ARG 138 Cb 0.19 -2.62 -0.02 0.00 0.45 0.00 0.00 32.46 30.45 1qk5 n ARG 138 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1qk5 n ASP 139 N 2.69 -5.55 -4.66 6.15 8.00 -0.25 -4.87 116.55 118.06 1qk5 n ASP 139 Ca 0.12 0.10 -0.25 0.00 0.71 0.00 0.00 54.79 55.48 1qk5 n ASP 139 Cb 0.33 -4.68 -0.07 0.00 -0.02 0.00 0.00 41.12 36.68 1qk5 n ASP 139 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1qk5 s LYS 140 N -4.79 2.36 -0.32 -1.24 -0.14 -0.64 -4.41 119.74 110.56 1qk5 s LYS 140 Ca 0.00 -1.26 -0.25 0.00 -1.36 0.00 0.00 55.97 53.10 1qk5 s LYS 140 Cb 0.00 -2.26 0.01 0.00 -1.68 0.00 0.00 37.83 33.89 1qk5 s LYS 140 CO 0.00 0.41 0.87 -1.01 -0.76 0.00 0.00 175.35 174.86 1qk5 s HIS 141 N -2.02 3.17 -0.05 3.18 3.76 -1.26 -0.24 115.29 121.83 1qk5 s HIS 141 Ca 0.29 0.89 0.04 0.00 -0.15 0.00 0.00 55.06 56.13 1qk5 s HIS 141 Cb -0.08 -3.38 -0.02 0.00 1.11 0.00 0.00 32.58 30.21 1qk5 s HIS 141 CO 0.19 -0.65 -0.16 0.08 -0.85 0.00 0.00 174.74 173.35 1qk5 s VAL 142 N 3.18 2.88 -0.16 -0.90 1.01 -0.46 -0.94 120.40 125.01 1qk5 s VAL 142 Ca 0.36 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1qk5 s VAL 142 Cb -0.13 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.16 1qk5 s VAL 142 CO 0.14 0.58 -0.14 -0.22 0.00 0.00 0.00 175.10 175.47 1qk5 s LEU 143 N -0.61 1.81 -0.20 3.92 2.96 -0.18 -1.38 118.68 125.01 1qk5 s LEU 143 Ca 0.09 -0.57 -0.17 0.00 -0.22 0.00 0.00 54.13 53.26 1qk5 s LEU 143 Cb -0.11 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 1qk5 s LEU 143 CO 0.01 -0.07 0.44 -0.63 -1.32 0.00 0.00 176.35 174.78 1qk5 s ILE 144 N 1.46 5.17 -0.21 6.68 1.01 0.18 -0.61 121.20 134.88 1qk5 s ILE 144 Ca 0.04 0.80 -0.05 0.00 0.00 0.00 0.00 60.65 61.44 1qk5 s ILE 144 Cb -0.13 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1qk5 s ILE 144 CO -0.10 0.23 0.00 -0.69 0.00 0.00 0.00 174.94 174.38 1qk5 s VAL 145 N 1.38 3.88 0.10 2.92 1.01 0.34 -0.23 120.40 129.79 1qk5 s VAL 145 Ca 0.21 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1qk5 s VAL 145 Cb -0.15 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 1qk5 s VAL 145 CO 0.09 0.41 -0.11 -0.70 0.00 0.00 0.00 175.10 174.78 1qk5 s GLU 146 N 1.23 0.86 -0.02 2.72 2.56 -0.06 -1.90 118.70 124.10 1qk5 s GLU 146 Ca 0.03 -1.12 -0.21 0.00 0.00 0.00 0.00 54.97 53.67 1qk5 s GLU 146 Cb -0.15 -0.64 -0.24 0.00 2.00 0.00 0.00 34.13 35.10 1qk5 s GLU 146 CO 0.01 0.11 1.06 0.38 -0.56 0.00 0.00 175.26 176.26 1qk5 h ASP 147 N 3.72 0.44 -4.79 -1.70 2.03 -1.86 -2.36 116.42 111.90 1qk5 h ASP 147 Ca -0.38 -0.78 -0.09 0.00 -0.73 0.00 0.00 57.03 55.04 1qk5 h ASP 147 Cb 1.19 -0.13 -0.20 0.00 -0.83 0.00 0.00 39.33 39.36 1qk5 h ASP 147 CO 0.50 1.16 -0.07 -0.51 -1.03 0.00 0.00 179.24 179.29 1qk5 s ILE 148 N -3.11 0.02 -0.10 4.15 2.07 -1.26 -2.22 121.20 120.75 1qk5 s ILE 148 Ca -0.14 -0.20 0.03 0.00 -1.41 0.00 0.00 60.65 58.93 1qk5 s ILE 148 Cb 0.02 -0.78 -0.01 0.00 0.13 0.00 0.00 42.46 41.82 1qk5 s ILE 148 CO 0.80 -0.11 -0.19 -0.69 -1.91 0.00 0.00 174.94 172.84 1qk5 s VAL 149 N -0.96 2.58 0.00 4.00 1.01 -0.68 -4.99 120.40 121.36 1qk5 s VAL 149 Ca -0.10 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1qk5 s VAL 149 Cb -0.03 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1qk5 s VAL 149 CO 0.06 0.55 0.00 0.00 0.00 0.00 0.00 175.10 175.71 1qk5 n ALA 150 N 3.25 1.30 0.11 5.51 0.00 -1.26 -1.60 120.51 127.81 1qk5 n ALA 150 Ca -0.18 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.22 1qk5 n ALA 150 Cb 0.53 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.10 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 1.43 0.00 0.00 1.35 -1.96 -3.45 112.91 110.29 1qk5 h THR 151 Ca 0.00 -2.15 0.00 0.00 -0.55 0.00 0.00 66.41 63.71 1qk5 h THR 151 Cb 0.00 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1qk5 h THR 151 CO 0.00 0.62 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1qk5 n GLY 152 N 0.35 0.62 0.11 5.82 0.00 -1.26 -4.44 105.19 106.40 1qk5 n GLY 152 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 0.28 -0.07 1.61 3.57 -1.97 -1.14 116.94 119.22 1qk5 h PHE 153 Ca 0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1qk5 h PHE 153 Cb 0.00 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 1qk5 h PHE 153 CO 0.00 0.26 -0.08 1.15 -2.23 0.00 0.00 178.31 177.42 1qk5 h THR 154 N 0.21 0.78 0.00 4.41 2.02 -1.99 -1.34 112.91 117.00 1qk5 h THR 154 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1qk5 h THR 154 Cb 0.08 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1qk5 h THR 154 CO -0.01 0.00 0.00 -0.07 0.37 0.00 0.00 175.52 175.81 1qk5 h LEU 155 N -0.10 0.00 -0.12 2.58 3.38 -1.97 -1.19 115.31 117.90 1qk5 h LEU 155 Ca 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1qk5 h LEU 155 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1qk5 h LEU 155 CO -0.13 0.00 -0.28 0.74 0.09 0.00 0.00 178.44 178.86 1qk5 h THR 156 N 0.00 1.38 -0.14 0.22 2.02 -0.65 -1.73 112.91 114.02 1qk5 h THR 156 Ca 0.00 -1.58 -0.03 0.00 0.77 0.00 0.00 66.41 65.56 1qk5 h THR 156 Cb 0.81 2.10 -0.00 0.00 -1.74 0.00 0.00 68.15 69.32 1qk5 h THR 156 CO 0.00 0.46 -0.05 -0.08 0.37 0.00 0.00 175.52 176.23 1qk5 h GLU 157 N -0.02 0.28 -0.43 6.66 4.57 -1.27 -1.70 114.58 122.67 1qk5 h GLU 157 Ca -0.00 -0.11 -0.09 0.00 -1.18 0.00 0.00 59.36 57.98 1qk5 h GLU 157 Cb 0.89 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 1qk5 h GLU 157 CO 0.06 0.58 -0.09 0.35 -1.18 0.00 0.00 179.01 178.73 1qk5 h PHE 158 N -0.04 0.83 -0.40 0.92 3.57 -1.29 -2.77 116.94 117.76 1qk5 h PHE 158 Ca 0.03 -0.14 0.06 0.00 3.53 0.00 0.00 57.97 61.45 1qk5 h PHE 158 Cb 0.49 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 1qk5 h PHE 158 CO 0.06 0.82 0.07 0.78 -2.23 0.00 0.00 178.31 177.81 1qk5 h GLY 159 N 0.97 0.46 1.02 2.40 0.00 -1.08 -1.24 103.07 105.60 1qk5 h GLY 159 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 1qk5 h GLY 159 CO 0.03 -0.04 0.52 0.83 0.00 0.00 0.00 176.54 177.88 1qk5 h GLU 160 N 0.20 1.24 -0.48 4.80 4.39 -1.05 -0.63 114.58 123.04 1qk5 h GLU 160 Ca 0.19 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.79 1qk5 h GLU 160 Cb 0.24 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1qk5 h GLU 160 CO -0.26 0.89 0.28 0.00 -1.16 0.00 0.00 179.01 178.76 1qk5 h ARG 161 N 1.25 0.55 -0.24 2.33 3.08 -1.13 -2.92 114.38 117.29 1qk5 h ARG 161 Ca 0.32 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.17 1qk5 h ARG 161 Cb -0.01 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 1qk5 h ARG 161 CO -0.06 0.36 -0.53 1.25 -1.07 0.00 0.00 179.97 179.93 1qk5 h LEU 162 N 0.57 0.77 -1.93 3.04 5.85 -0.97 -3.13 115.31 119.50 1qk5 h LEU 162 Ca 0.20 -0.40 0.17 0.00 0.84 0.00 0.00 57.88 58.69 1qk5 h LEU 162 Cb 0.03 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1qk5 h LEU 162 CO -0.09 1.15 0.45 0.11 -0.34 0.00 0.00 178.44 179.72 1qk5 h LYS 163 N 0.54 0.07 0.00 1.25 1.57 -0.93 -1.75 116.57 117.31 1qk5 h LYS 163 Ca 0.02 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1qk5 h LYS 163 Cb 1.09 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.39 1qk5 h LYS 163 CO 0.11 0.04 -0.06 0.00 -0.57 0.00 0.00 179.45 178.97 1qk5 h ALA 164 N 1.68 1.22 -0.01 3.86 0.00 -1.47 -1.80 119.26 122.75 1qk5 h ALA 164 Ca 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1qk5 h ALA 164 Cb 1.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1qk5 h ALA 164 CO -0.02 0.07 -0.07 1.33 0.00 0.00 0.00 179.25 180.56 1qk5 n VAL 165 N -3.48 0.00 -2.75 0.00 0.24 -0.66 -4.97 118.33 106.72 1qk5 n VAL 165 Ca -0.02 -0.17 -0.10 0.00 -2.04 0.00 0.00 64.34 62.00 1qk5 n VAL 165 Cb 0.19 0.29 0.05 0.00 -1.47 0.00 0.00 33.84 32.90 1qk5 n VAL 165 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qk5 n GLY 166 N 1.20 -0.40 3.61 7.63 0.00 -0.68 -4.07 105.19 112.49 1qk5 n GLY 166 Ca 0.17 0.21 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 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 -4.17 0.27 0.07 1.61 0.04 -1.26 -1.09 135.00 130.48 1qk5 s PRO 167 Ca 0.24 0.97 -0.09 0.00 0.04 0.00 0.00 61.00 62.16 1qk5 s PRO 167 Cb -0.03 -1.68 -0.26 0.00 0.04 0.00 0.00 34.50 32.57 1qk5 s PRO 167 CO 0.50 -2.96 1.14 -0.22 0.04 0.00 0.00 177.00 175.50 1qk5 h LYS 168 N -2.08 0.44 -2.60 4.56 3.64 -0.82 -3.42 116.57 116.29 1qk5 h LYS 168 Ca -0.53 -0.64 -0.05 0.00 -1.27 0.00 0.00 60.65 58.15 1qk5 h LYS 168 Cb 1.30 0.22 -0.16 0.00 -0.41 0.00 0.00 32.23 33.18 1qk5 h LYS 168 CO 0.50 1.28 0.11 -1.54 -2.27 0.00 0.00 179.45 177.53 1qk5 s SER 169 N -7.29 -0.52 -0.05 4.20 1.04 -1.12 -4.60 113.70 105.35 1qk5 s SER 169 Ca -0.07 0.29 -0.00 0.00 0.48 0.00 0.00 55.95 56.65 1qk5 s SER 169 Cb 0.06 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.73 1qk5 s SER 169 CO 0.91 -0.73 -0.01 -0.04 0.98 0.00 0.00 173.24 174.34 1qk5 s MET 170 N -2.32 0.59 0.18 4.02 -1.94 -1.26 -1.36 119.30 117.22 1qk5 s MET 170 Ca -0.06 0.05 0.03 0.00 -1.71 0.00 0.00 55.69 54.00 1qk5 s MET 170 Cb -0.01 -0.83 -0.05 0.00 2.01 0.00 0.00 34.83 35.96 1qk5 s MET 170 CO -0.00 -0.21 -0.03 1.03 -0.01 0.00 0.00 175.02 175.80 1qk5 s ARG 171 N 1.49 1.14 -0.04 2.03 0.52 -0.48 -4.57 118.95 119.04 1qk5 s ARG 171 Ca -0.03 -1.54 0.05 0.00 -0.52 0.00 0.00 55.73 53.70 1qk5 s ARG 171 Cb -0.13 -0.45 -0.01 0.00 0.52 0.00 0.00 34.95 34.88 1qk5 s ARG 171 CO -0.03 -0.06 -0.20 0.42 0.02 0.00 0.00 175.30 175.45 1qk5 s ILE 172 N -3.50 1.66 -0.20 1.52 1.01 -1.26 -0.65 121.20 119.78 1qk5 s ILE 172 Ca 0.22 -0.86 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 1qk5 s ILE 172 Cb 0.05 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 41.12 1qk5 s ILE 172 CO 0.04 0.47 -0.10 0.00 0.00 0.00 0.00 174.94 175.34 1qk5 s ALA 173 N -0.17 2.64 -0.04 9.38 0.00 0.68 -1.24 121.76 133.01 1qk5 s ALA 173 Ca -0.00 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 50.83 1qk5 s ALA 173 Cb -0.11 -1.49 -0.00 0.00 0.00 0.00 0.00 23.12 21.52 1qk5 s ALA 173 CO 0.02 -0.35 -0.14 -0.08 0.00 0.00 0.00 175.76 175.21 1qk5 s THR 174 N 1.32 1.20 0.20 0.00 -1.32 -0.24 -0.88 115.64 115.93 1qk5 s THR 174 Ca 0.04 -0.59 -0.06 0.00 -1.21 0.00 0.00 61.69 59.87 1qk5 s THR 174 Cb -0.14 -1.04 0.05 0.00 -1.51 0.00 0.00 72.50 69.86 1qk5 s THR 174 CO -0.06 0.35 1.64 0.25 -2.21 0.00 0.00 174.62 174.60 1qk5 h LEU 175 N 6.31 0.90 -8.12 9.08 5.85 -1.21 -2.00 115.31 126.13 1qk5 h LEU 175 Ca -0.33 -0.29 -0.38 0.00 0.84 0.00 0.00 57.88 57.73 1qk5 h LEU 175 Cb 1.17 -0.24 -0.26 0.00 0.37 0.00 0.00 40.66 41.70 1qk5 h LEU 175 CO 0.48 1.03 -0.77 -0.69 -0.34 0.00 0.00 178.44 178.15 1qk5 s VAL 176 N -4.81 0.75 -0.04 1.05 1.01 -0.94 -0.88 120.40 116.53 1qk5 s VAL 176 Ca -0.10 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1qk5 s VAL 176 Cb 0.13 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.83 1qk5 s VAL 176 CO 0.84 0.03 -0.20 -1.83 0.00 0.00 0.00 175.10 173.95 1qk5 s GLU 177 N -0.68 1.96 0.03 2.72 -1.05 0.39 -1.68 118.70 120.38 1qk5 s GLU 177 Ca 0.00 -0.71 -0.09 0.00 -0.15 0.00 0.00 54.97 54.02 1qk5 s GLU 177 Cb -0.06 -1.72 -0.05 0.00 -0.44 0.00 0.00 34.13 31.86 1qk5 s GLU 177 CO 0.00 0.32 0.34 0.15 0.95 0.00 0.00 175.26 177.02 1qk5 s LYS 178 N -0.12 3.71 -0.71 -4.83 1.02 -0.63 -1.85 119.74 116.33 1qk5 s LYS 178 Ca -0.01 0.12 -0.24 0.00 0.02 0.00 0.00 55.97 55.86 1qk5 s LYS 178 Cb -0.11 -3.08 0.06 0.00 -0.52 0.00 0.00 37.83 34.18 1qk5 s LYS 178 CO 0.02 0.63 1.07 1.03 -0.92 0.00 0.00 175.35 177.18 1qk5 s ARG 179 N -1.64 3.17 -0.04 1.68 0.52 0.43 -4.84 118.95 118.23 1qk5 s ARG 179 Ca 0.28 -0.73 -0.05 0.00 -0.52 0.00 0.00 55.73 54.71 1qk5 s ARG 179 Cb -0.14 -4.29 -0.02 0.00 0.52 0.00 0.00 34.95 31.03 1qk5 s ARG 179 CO 0.15 -1.92 -0.09 0.25 0.02 0.00 0.00 175.30 173.72 1qk5 n THR 180 N 6.05 0.44 0.00 0.02 -2.24 -1.26 -3.42 114.28 113.87 1qk5 n THR 180 Ca 0.00 0.34 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1qk5 n THR 180 Cb 0.47 -1.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1qk5 n THR 180 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1qk5 n SER 185 N -3.04 0.00 -4.76 3.42 2.88 -1.26 -5.04 113.62 105.81 1qk5 n SER 185 Ca -0.04 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.11 1qk5 n SER 185 Cb 0.13 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.61 1qk5 n SER 185 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1qk5 s LEU 186 N 0.00 4.08 0.05 2.46 0.20 -1.26 -4.94 118.68 119.26 1qk5 s LEU 186 Ca 0.00 2.90 0.00 0.00 0.69 0.00 0.00 54.13 57.72 1qk5 s LEU 186 Cb 0.00 -3.98 -0.03 0.00 -0.43 0.00 0.00 46.19 41.75 1qk5 s LEU 186 CO 0.00 -1.23 -0.05 -1.59 -0.29 0.00 0.00 176.35 173.20 1qk5 s LYS 187 N -2.51 0.54 0.67 1.98 -2.85 -0.19 -4.78 119.74 112.60 1qk5 s LYS 187 Ca 0.62 -0.95 -0.07 0.00 -1.00 0.00 0.00 55.97 54.57 1qk5 s LYS 187 Cb -0.43 0.00 0.05 0.00 -2.06 0.00 0.00 37.83 35.39 1qk5 s LYS 187 CO 0.55 -0.04 0.99 0.20 0.10 0.00 0.00 175.35 177.14 1qk5 s GLY 188 N -2.21 1.67 -0.07 0.59 0.00 -1.26 -3.92 107.32 102.12 1qk5 s GLY 188 Ca -0.03 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1qk5 s GLY 188 CO -0.04 -0.48 0.57 -0.55 0.00 0.00 0.00 173.10 172.60 1qk5 h ASP 189 N -0.49 0.28 -3.38 1.64 3.32 -1.53 -3.39 116.42 112.86 1qk5 h ASP 189 Ca -0.45 -0.56 -0.62 0.00 0.02 0.00 0.00 57.03 55.43 1qk5 h ASP 189 Cb 1.30 -0.09 -0.40 0.00 0.22 0.00 0.00 39.33 40.36 1qk5 h ASP 189 CO 0.60 1.49 -0.74 -0.36 -1.72 0.00 0.00 179.24 178.52 1qk5 s PHE 190 N -2.58 2.59 -0.06 4.55 0.40 -0.63 -4.38 117.98 117.86 1qk5 s PHE 190 Ca -0.14 -2.28 0.06 0.00 -0.60 0.00 0.00 56.93 53.97 1qk5 s PHE 190 Cb 0.07 -2.23 -0.01 0.00 0.51 0.00 0.00 43.02 41.36 1qk5 s PHE 190 CO 0.81 -0.91 -0.25 0.08 0.70 0.00 0.00 175.22 175.65 1qk5 s VAL 191 N 1.31 2.07 -0.10 -0.44 1.01 -1.26 -1.08 120.40 121.91 1qk5 s VAL 191 Ca 0.10 -1.06 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 1qk5 s VAL 191 Cb -0.18 -1.74 -0.12 0.00 0.00 0.00 0.00 36.38 34.34 1qk5 s VAL 191 CO -0.18 0.57 0.45 1.23 0.00 0.00 0.00 175.10 177.17 1qk5 h GLY 192 N 6.05 -0.07 -5.08 4.51 0.00 -0.56 -3.38 103.07 104.54 1qk5 h GLY 192 Ca -0.32 0.03 -0.29 0.00 0.00 0.00 0.00 47.33 46.74 1qk5 h GLY 192 CO 0.47 -0.03 -0.74 -1.36 0.00 0.00 0.00 176.54 174.88 1qk5 s PHE 193 N -2.21 0.54 -0.24 5.60 0.40 -0.06 -1.88 117.98 120.14 1qk5 s PHE 193 Ca -0.09 -0.29 -0.07 0.00 -0.60 0.00 0.00 56.93 55.88 1qk5 s PHE 193 Cb -0.01 -0.34 -0.03 0.00 0.51 0.00 0.00 43.02 43.15 1qk5 s PHE 193 CO 0.33 -0.05 0.07 0.45 0.70 0.00 0.00 175.22 176.72 1qk5 s SER 194 N -0.83 5.19 0.40 1.36 0.15 -0.20 -0.46 113.70 119.31 1qk5 s SER 194 Ca -0.04 -0.17 0.06 0.00 0.70 0.00 0.00 55.95 56.50 1qk5 s SER 194 Cb -0.06 -1.92 -0.07 0.00 -1.71 0.00 0.00 66.02 62.26 1qk5 s SER 194 CO 0.00 -0.00 0.02 0.27 1.20 0.00 0.00 173.24 174.73 1qk5 s ILE 195 N 1.41 1.72 0.85 6.45 -4.36 -0.77 -1.20 121.20 125.30 1qk5 s ILE 195 Ca 0.05 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.32 1qk5 s ILE 195 Cb -0.15 -2.87 0.10 0.00 1.25 0.00 0.00 42.46 40.79 1qk5 s ILE 195 CO 0.03 0.00 1.14 -1.83 0.24 0.00 0.00 174.94 174.52 1qk5 s GLU 196 N -3.76 1.68 -1.08 0.37 -1.05 -1.26 -0.43 118.70 113.17 1qk5 s GLU 196 Ca 0.32 0.33 -0.22 0.00 -0.15 0.00 0.00 54.97 55.25 1qk5 s GLU 196 Cb 0.09 -1.90 0.02 0.00 -0.44 0.00 0.00 34.13 31.90 1qk5 s GLU 196 CO 0.16 -1.83 1.68 0.34 0.95 0.00 0.00 175.26 176.56 1qk5 s ASP 197 N -4.17 6.12 0.04 0.83 -1.08 -1.22 -4.51 116.67 112.69 1qk5 s ASP 197 Ca 0.62 -1.56 -0.00 0.00 -0.52 0.00 0.00 52.55 51.09 1qk5 s ASP 197 Cb -0.13 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.72 1qk5 s ASP 197 CO 0.52 -1.87 -0.03 0.68 0.52 0.00 0.00 175.17 174.98 1qk5 s VAL 198 N 6.59 0.23 -0.23 1.11 -7.23 -1.26 -5.08 120.40 114.53 1qk5 s VAL 198 Ca 0.56 -1.48 -0.25 0.00 -1.81 0.00 0.00 61.98 59.00 1qk5 s VAL 198 Cb -0.00 -1.07 -0.01 0.00 0.56 0.00 0.00 36.38 35.86 1qk5 s VAL 198 CO -0.01 -0.80 0.83 0.86 -0.31 0.00 0.00 175.10 175.67 1qk5 s TRP 199 N -2.96 3.33 0.12 2.82 -0.11 -1.26 -5.04 118.94 115.83 1qk5 s TRP 199 Ca -0.01 1.15 0.04 0.00 1.22 0.00 0.00 56.10 58.50 1qk5 s TRP 199 Cb 0.01 -3.04 -0.04 0.00 -1.50 0.00 0.00 33.47 28.90 1qk5 s TRP 199 CO -0.06 -0.37 0.08 0.96 -4.62 0.00 0.00 176.95 172.94 1qk5 s ILE 200 N 2.73 4.37 0.11 5.86 -4.36 -1.26 -1.74 121.20 126.90 1qk5 s ILE 200 Ca 0.35 -0.97 0.00 0.00 -0.26 0.00 0.00 60.65 59.77 1qk5 s ILE 200 Cb -0.15 -3.16 -0.04 0.00 1.25 0.00 0.00 42.46 40.36 1qk5 s ILE 200 CO 0.08 0.02 -0.02 0.68 0.24 0.00 0.00 174.94 175.94 1qk5 s VAL 201 N -1.54 0.43 0.00 8.37 -7.23 0.32 -4.39 120.40 116.36 1qk5 s VAL 201 Ca 0.29 -1.90 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1qk5 s VAL 201 Cb -0.11 -1.81 0.00 0.00 0.56 0.00 0.00 36.38 35.02 1qk5 s VAL 201 CO 0.22 -0.74 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 1qk5 n GLY 202 N -0.05 1.57 4.03 2.32 0.00 0.17 0.13 105.19 113.36 1qk5 n GLY 202 Ca -0.10 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 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 -3.02 3.63 0.34 0.00 1.51 0.06 -4.68 117.35 115.18 1qk5 s TYR 205 Ca 0.00 1.63 0.04 0.00 -1.01 0.00 0.00 57.07 57.73 1qk5 s TYR 205 Cb 0.00 -3.24 -0.07 0.00 -0.11 0.00 0.00 41.96 38.54 1qk5 s TYR 205 CO 0.00 -0.49 0.05 0.16 -1.11 0.00 0.00 175.55 174.16 1qk5 s ASP 206 N -0.16 2.60 -0.23 2.29 -4.77 -1.26 -0.65 116.67 114.49 1qk5 s ASP 206 Ca 0.49 -1.38 0.00 0.00 -3.30 0.00 0.00 52.55 48.36 1qk5 s ASP 206 Cb -0.29 -0.13 0.06 0.00 -1.09 0.00 0.00 42.92 41.48 1qk5 s ASP 206 CO 0.34 -0.59 -0.03 0.12 0.70 0.00 0.00 175.17 175.72 1qk5 s PHE 207 N -3.21 2.17 -1.47 2.11 5.36 -0.22 -4.81 117.98 117.91 1qk5 s PHE 207 Ca 0.36 -1.64 -0.01 0.00 -0.96 0.00 0.00 56.93 54.68 1qk5 s PHE 207 Cb 0.09 -1.53 0.01 0.00 -0.34 0.00 0.00 43.02 41.25 1qk5 s PHE 207 CO 0.16 -0.76 0.31 0.09 -1.46 0.00 0.00 175.22 173.56 1qk5 n ASN 208 N 4.73 -0.11 0.00 6.13 3.02 -1.26 -1.27 115.26 126.50 1qk5 n ASN 208 Ca -0.10 -1.09 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 1qk5 n ASN 208 Cb 0.44 -2.57 0.00 0.00 -0.61 0.00 0.00 39.78 37.04 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 -4.45 0.00 -3.45 3.52 -0.58 -1.26 -5.01 120.64 109.41 1qk5 n GLU 209 Ca -0.29 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.15 1qk5 n GLU 209 Cb 0.68 -2.55 -0.04 0.00 -0.57 0.00 0.00 31.44 28.96 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 -0.11 3.68 0.00 3.49 1.75 -0.40 -4.46 119.30 123.24 1qk5 s MET 210 Ca 0.00 0.05 0.00 0.00 -1.25 0.00 0.00 55.69 54.49 1qk5 s MET 210 Cb 0.00 -2.70 0.00 0.00 2.84 0.00 0.00 34.83 34.97 1qk5 s MET 210 CO 0.00 0.31 0.00 1.19 -0.65 0.00 0.00 175.02 175.87 1qk5 n PHE 211 N -0.45 0.00 -0.28 4.11 3.72 -1.26 -1.05 117.46 122.25 1qk5 n PHE 211 Ca -0.01 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.40 1qk5 n PHE 211 Cb 0.53 -0.11 0.23 0.00 -0.94 0.00 0.00 39.48 39.19 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 1.30 1.04 0.00 -1.08 3.08 -1.78 -2.71 114.38 114.22 1qk5 h ARG 212 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1qk5 h ARG 212 Cb 0.05 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1qk5 h ARG 212 CO 0.00 0.69 0.00 -0.40 -1.07 0.00 0.00 179.97 179.19 1qk5 n ASP 213 N -4.44 0.00 -4.77 7.04 5.75 -1.26 -1.19 116.55 117.67 1qk5 n ASP 213 Ca 0.11 0.03 -0.40 0.00 -0.01 0.00 0.00 54.79 54.52 1qk5 n ASP 213 Cb 0.10 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 39.86 1qk5 n ASP 213 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1qk5 s PHE 214 N -2.67 2.69 -0.91 2.11 5.36 -1.03 -4.84 117.98 118.69 1qk5 s PHE 214 Ca 0.23 1.32 0.27 0.00 -0.96 0.00 0.00 56.93 57.79 1qk5 s PHE 214 Cb 0.18 -3.81 1.07 0.00 -0.34 0.00 0.00 43.02 40.12 1qk5 s PHE 214 CO 0.43 -2.49 1.85 -0.25 -1.46 0.00 0.00 175.22 173.30 1qk5 n ASP 215 N 0.17 0.23 -4.43 6.13 8.00 -1.26 -0.65 116.55 124.73 1qk5 n ASP 215 Ca 0.03 0.52 -0.22 0.00 0.71 0.00 0.00 54.79 55.83 1qk5 n ASP 215 Cb 0.42 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 40.83 1qk5 n ASP 215 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1qk5 s HIS 216 N -3.04 2.09 -0.24 1.24 3.76 -1.26 -3.48 115.29 114.37 1qk5 s HIS 216 Ca 0.12 -0.45 -0.22 0.00 -0.15 0.00 0.00 55.06 54.36 1qk5 s HIS 216 Cb 0.16 -0.97 -0.01 0.00 1.11 0.00 0.00 32.58 32.87 1qk5 s HIS 216 CO 0.52 0.56 0.73 0.08 -0.85 0.00 0.00 174.74 175.78 1qk5 s VAL 217 N -2.70 4.92 0.31 -0.90 1.01 -0.15 -3.37 120.40 119.51 1qk5 s VAL 217 Ca 0.28 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.65 1qk5 s VAL 217 Cb -0.02 -4.03 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 1qk5 s VAL 217 CO 0.12 -0.01 0.05 0.00 0.00 0.00 0.00 175.10 175.26 1qk5 s ALA 218 N 2.58 2.25 0.19 5.51 0.00 0.12 -0.17 121.76 132.24 1qk5 s ALA 218 Ca 0.31 -2.01 -0.11 0.00 0.00 0.00 0.00 51.96 50.15 1qk5 s ALA 218 Cb -0.15 0.66 -0.07 0.00 0.00 0.00 0.00 23.12 23.56 1qk5 s ALA 218 CO 0.08 -0.31 0.54 0.14 0.00 0.00 0.00 175.76 176.22 1qk5 s VAL 219 N -3.34 4.91 -0.25 0.00 -7.23 -0.93 -0.52 120.40 113.04 1qk5 s VAL 219 Ca 0.36 0.61 -0.29 0.00 -1.81 0.00 0.00 61.98 60.85 1qk5 s VAL 219 Cb 0.08 -3.66 -0.00 0.00 0.56 0.00 0.00 36.38 33.36 1qk5 s VAL 219 CO 0.15 0.07 1.25 -0.22 -0.31 0.00 0.00 175.10 176.04 1qk5 s LEU 220 N -2.44 4.00 0.87 1.32 2.96 -0.71 -4.72 118.68 119.97 1qk5 s LEU 220 Ca 0.43 1.37 -0.11 0.00 -0.22 0.00 0.00 54.13 55.60 1qk5 s LEU 220 Cb -0.13 -3.54 0.16 0.00 0.50 0.00 0.00 46.19 43.18 1qk5 s LEU 220 CO 0.20 -0.93 1.21 -0.94 -1.32 0.00 0.00 176.35 174.57 1qk5 s SER 221 N 2.32 3.67 0.06 3.68 1.04 -1.26 -4.88 113.70 118.32 1qk5 s SER 221 Ca 0.54 0.20 -0.21 0.00 0.48 0.00 0.00 55.95 56.96 1qk5 s SER 221 Cb -0.18 -0.41 -0.13 0.00 0.10 0.00 0.00 66.02 65.40 1qk5 s SER 221 CO 0.18 -2.36 1.47 0.44 0.98 0.00 0.00 173.24 173.95 1qk5 h ASP 222 N -1.25 0.26 -0.62 7.02 3.45 -1.95 -0.66 116.42 122.67 1qk5 h ASP 222 Ca -0.43 -0.32 0.09 0.00 0.43 0.00 0.00 57.03 56.80 1qk5 h ASP 222 Cb 1.26 -0.07 -0.07 0.00 -0.56 0.00 0.00 39.33 39.89 1qk5 h ASP 222 CO 0.43 0.52 0.25 0.00 -1.57 0.00 0.00 179.24 178.88 1qk5 h ALA 223 N 0.75 0.82 -0.33 3.45 0.00 -1.90 -0.19 119.26 121.85 1qk5 h ALA 223 Ca 0.04 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1qk5 h ALA 223 Cb 0.39 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1qk5 h ALA 223 CO 0.01 -0.17 0.08 0.00 0.00 0.00 0.00 179.25 179.17 1qk5 h ALA 224 N 1.42 0.43 -0.26 0.00 0.00 -1.75 -2.62 119.26 116.49 1qk5 h ALA 224 Ca 0.31 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1qk5 h ALA 224 Cb 0.37 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1qk5 h ALA 224 CO -0.30 0.10 0.09 -0.09 0.00 0.00 0.00 179.25 179.05 1qk5 h ARG 225 N 0.37 0.20 0.74 0.00 2.43 -0.15 -2.44 114.38 115.53 1qk5 h ARG 225 Ca 0.10 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1qk5 h ARG 225 Cb 0.29 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1qk5 h ARG 225 CO 0.00 0.13 -0.47 0.87 -1.51 0.00 0.00 179.97 178.99 1qk5 h LYS 226 N 0.20 -1.10 -0.42 0.20 1.57 -1.03 -0.44 116.57 115.56 1qk5 h LYS 226 Ca 0.11 0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1qk5 h LYS 226 Cb 0.08 0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1qk5 h LYS 226 CO -0.12 -0.73 0.23 -0.22 -0.57 0.00 0.00 179.45 178.04 1qk5 h LYS 227 N -1.14 0.57 -0.32 3.15 3.64 -1.46 -3.09 116.57 117.91 1qk5 h LYS 227 Ca -0.10 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1qk5 h LYS 227 Cb 0.92 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1qk5 h LYS 227 CO 0.09 0.42 0.00 1.19 -2.27 0.00 0.00 179.45 178.88 1qk5 n PHE 228 N -4.43 0.88 -1.58 1.91 3.01 -0.92 -5.05 117.46 111.28 1qk5 n PHE 228 Ca 0.03 -0.74 -0.44 0.00 1.01 0.00 0.00 57.45 57.31 1qk5 n PHE 228 Cb 0.10 -0.23 -0.01 0.00 -0.01 0.00 0.00 39.48 39.32 1qk5 n PHE 228 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1qk5 n GLU 229 N -0.04 1.26 0.00 -1.08 4.07 -0.18 -4.80 120.64 119.86 1qk5 n GLU 229 Ca 0.19 0.44 0.00 0.00 -0.06 0.00 0.00 57.16 57.73 1qk5 n GLU 229 Cb 0.76 -1.80 0.00 0.00 -0.06 0.00 0.00 31.44 30.34 1qk5 n GLU 229 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43