#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qe5 s PRO 10 N 0.00 4.14 0.48 0.54 0.04 -1.26 -4.85 135.00 134.09 1qe5 s PRO 10 Ca 0.00 2.60 0.26 0.00 0.04 0.00 0.00 61.00 63.89 1qe5 s PRO 10 Cb 0.00 -4.02 1.30 0.00 0.04 0.00 0.00 34.50 31.83 1qe5 s PRO 10 CO 0.00 -0.92 1.84 1.25 0.04 0.00 0.00 177.00 179.21 1qe5 h LEU 11 N 10.11 0.21 -0.00 -3.56 5.85 -1.96 -0.83 115.31 125.12 1qe5 h LEU 11 Ca -0.48 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.30 1qe5 h LEU 11 Cb 1.23 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1qe5 h LEU 11 CO 0.94 0.06 -0.25 0.44 -0.34 0.00 0.00 178.44 179.30 1qe5 h ASP 12 N 0.19 -0.73 -2.32 1.25 5.19 -1.94 -3.43 116.42 114.63 1qe5 h ASP 12 Ca 0.49 0.10 -0.55 0.00 -0.62 0.00 0.00 57.03 56.46 1qe5 h ASP 12 Cb 1.59 0.30 0.02 0.00 0.18 0.00 0.00 39.33 41.42 1qe5 h ASP 12 CO -0.11 -0.31 1.19 -0.67 -3.12 0.00 0.00 179.24 176.22 1qe5 n ASP 13 N -5.37 4.03 -0.11 6.45 -0.08 -0.32 -4.85 116.55 116.31 1qe5 n ASP 13 Ca -0.05 0.93 0.27 0.00 -1.51 0.00 0.00 54.79 54.43 1qe5 n ASP 13 Cb 0.28 -1.50 0.71 0.00 2.34 0.00 0.00 41.12 42.95 1qe5 n ASP 13 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1qe5 h PRO 14 N 10.05 0.00 -0.13 -0.67 0.13 -1.87 0.67 132.00 140.18 1qe5 h PRO 14 Ca -0.49 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1qe5 h PRO 14 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1qe5 h PRO 14 CO 0.94 0.00 -0.36 0.00 -0.23 0.00 0.00 178.00 178.36 1qe5 h ALA 15 N 1.41 1.15 -2.92 -0.56 0.00 -1.93 -3.45 119.26 112.95 1qe5 h ALA 15 Ca 0.37 -0.38 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 1qe5 h ALA 15 Cb 1.70 -0.09 0.09 0.00 0.00 0.00 0.00 17.79 19.49 1qe5 h ALA 15 CO -0.00 0.56 0.71 0.99 0.00 0.00 0.00 179.25 181.51 1qe5 s THR 16 N -4.26 2.29 -0.39 0.00 2.01 0.23 -4.98 115.64 110.54 1qe5 s THR 16 Ca -0.05 0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.03 1qe5 s THR 16 Cb 0.14 -3.18 0.01 0.00 0.01 0.00 0.00 72.50 69.48 1qe5 s THR 16 CO 0.77 0.06 0.63 -0.62 -0.69 0.00 0.00 174.62 174.77 1qe5 s ASP 17 N -0.35 6.37 0.46 3.53 -1.08 -1.26 -4.95 116.67 119.39 1qe5 s ASP 17 Ca 0.53 -0.07 0.14 0.00 -0.52 0.00 0.00 52.55 52.63 1qe5 s ASP 17 Cb -0.43 -2.32 1.09 0.00 -1.46 0.00 0.00 42.92 39.80 1qe5 s ASP 17 CO 0.58 -0.67 2.03 1.55 0.52 0.00 0.00 175.17 179.18 1qe5 h PRO 18 N 8.65 0.30 0.00 4.34 0.13 -1.93 -1.87 132.00 141.62 1qe5 h PRO 18 Ca -0.26 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.77 1qe5 h PRO 18 Cb 1.10 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1qe5 h PRO 18 CO 0.86 0.20 -0.41 0.74 -0.23 0.00 0.00 178.00 179.15 1qe5 h PHE 19 N 0.31 0.00 -0.12 1.56 -1.00 -1.99 -1.48 116.94 114.21 1qe5 h PHE 19 Ca 0.20 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.83 1qe5 h PHE 19 Cb 0.39 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 1qe5 h PHE 19 CO -0.00 0.41 -0.57 1.25 -1.61 0.00 0.00 178.31 177.79 1qe5 h LEU 20 N 0.00 0.42 -0.38 1.54 7.12 -1.76 -0.57 115.31 121.68 1qe5 h LEU 20 Ca -0.00 -0.23 -0.09 0.00 0.13 0.00 0.00 57.88 57.69 1qe5 h LEU 20 Cb 0.81 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.81 1qe5 h LEU 20 CO 0.05 0.90 -0.12 0.58 -0.13 0.00 0.00 178.44 179.73 1qe5 h VAL 21 N 0.28 1.28 -0.30 1.05 2.07 -1.37 -1.21 116.25 118.06 1qe5 h VAL 21 Ca 0.00 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 1qe5 h VAL 21 Cb 1.08 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 1qe5 h VAL 21 CO 0.10 0.40 0.14 0.00 0.02 0.00 0.00 177.57 178.23 1qe5 h ALA 22 N 0.82 1.70 -0.14 1.67 0.00 -1.07 0.21 119.26 122.45 1qe5 h ALA 22 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1qe5 h ALA 22 Cb 0.64 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1qe5 h ALA 22 CO 0.04 0.25 0.04 -0.09 0.00 0.00 0.00 179.25 179.50 1qe5 h ARG 23 N 0.41 0.22 -0.70 0.00 1.12 -0.51 -0.35 114.38 114.57 1qe5 h ARG 23 Ca 0.11 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.91 1qe5 h ARG 23 Cb 0.05 -0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 29.94 1qe5 h ARG 23 CO -0.02 0.36 0.39 0.00 -3.11 0.00 0.00 179.97 177.59 1qe5 h ALA 24 N 0.85 1.36 -0.24 2.80 0.00 -0.57 -1.76 119.26 121.70 1qe5 h ALA 24 Ca 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1qe5 h ALA 24 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1qe5 h ALA 24 CO -0.00 0.53 0.11 0.00 0.00 0.00 0.00 179.25 179.89 1qe5 h ALA 25 N 1.45 0.31 -0.50 0.00 0.00 -0.10 -0.63 119.26 119.79 1qe5 h ALA 25 Ca 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1qe5 h ALA 25 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1qe5 h ALA 25 CO -0.04 -0.12 0.28 0.00 0.00 0.00 0.00 179.25 179.37 1qe5 h ALA 26 N 0.97 0.64 -0.28 0.00 0.00 -0.69 -1.79 119.26 118.10 1qe5 h ALA 26 Ca 0.08 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1qe5 h ALA 26 Cb 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1qe5 h ALA 26 CO -0.01 0.16 0.10 -0.44 0.00 0.00 0.00 179.25 179.06 1qe5 h ASP 27 N 0.67 0.12 -0.57 0.00 3.32 -1.17 -0.46 116.42 118.33 1qe5 h ASP 27 Ca 0.18 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.31 1qe5 h ASP 27 Cb 0.04 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 1qe5 h ASP 27 CO -0.03 0.10 0.29 -0.74 -1.72 0.00 0.00 179.24 177.14 1qe5 h HIS 28 N 0.23 0.53 -0.57 4.55 2.76 -0.80 -1.89 115.15 119.97 1qe5 h HIS 28 Ca 0.12 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1qe5 h HIS 28 Cb 0.09 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 28.87 1qe5 h HIS 28 CO -0.13 0.24 0.37 0.82 -1.30 0.00 0.00 177.93 177.93 1qe5 h ILE 29 N 0.55 1.13 -0.72 6.26 2.04 -0.69 0.79 117.51 126.87 1qe5 h ILE 29 Ca 0.26 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1qe5 h ILE 29 Cb 0.19 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 1qe5 h ILE 29 CO -0.19 0.14 0.37 0.00 0.00 0.00 0.00 178.15 178.47 1qe5 h ALA 30 N 1.22 0.92 -0.11 1.87 0.00 -0.74 -0.21 119.26 122.22 1qe5 h ALA 30 Ca 0.21 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 1qe5 h ALA 30 Cb -0.07 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1qe5 h ALA 30 CO -0.05 0.46 -0.78 0.37 0.00 0.00 0.00 179.25 179.24 1qe5 h GLN 31 N 1.00 0.63 0.00 0.00 -0.00 -1.07 0.10 115.11 115.77 1qe5 h GLN 31 Ca 0.25 -0.53 -0.06 0.00 -0.00 0.00 0.00 58.65 58.31 1qe5 h GLN 31 Cb 0.07 0.11 -0.01 0.00 0.00 0.00 0.00 27.48 27.66 1qe5 h GLN 31 CO -0.04 1.15 -0.28 0.00 0.00 0.00 0.00 178.83 179.66 1qe5 h ALA 32 N 0.70 0.88 0.00 3.38 0.00 -0.61 -3.32 119.26 120.29 1qe5 h ALA 32 Ca -0.05 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1qe5 h ALA 32 Cb 1.39 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1qe5 h ALA 32 CO 0.15 0.35 -1.78 0.25 0.00 0.00 0.00 179.25 178.22 1qe5 n THR 33 N -3.26 0.31 -0.72 0.00 -2.24 -0.11 -4.94 114.28 103.33 1qe5 n THR 33 Ca 0.02 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1qe5 n THR 33 Cb 0.56 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1qe5 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qe5 n GLY 34 N 1.81 0.83 3.33 3.38 0.00 0.35 -4.84 105.19 110.05 1qe5 n GLY 34 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 1qe5 n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qe5 s VAL 35 N -3.25 4.54 0.38 1.61 1.01 -1.18 -4.97 120.40 118.54 1qe5 s VAL 35 Ca 0.00 -1.11 0.09 0.00 0.00 0.00 0.00 61.98 60.96 1qe5 s VAL 35 Cb 0.00 -3.66 0.31 0.00 0.00 0.00 0.00 36.38 33.04 1qe5 s VAL 35 CO 0.00 -0.40 1.93 -0.33 0.00 0.00 0.00 175.10 176.30 1qe5 h GLU 36 N 8.47 0.62 -3.30 2.72 5.08 -1.95 -3.39 114.58 122.84 1qe5 h GLU 36 Ca -0.25 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 57.96 1qe5 h GLU 36 Cb 1.10 -0.14 -0.18 0.00 0.50 0.00 0.00 28.75 30.02 1qe5 h GLU 36 CO 0.74 0.41 -0.32 0.20 -1.00 0.00 0.00 179.01 179.04 1qe5 s GLY 37 N -3.66 -0.07 0.17 -3.84 0.00 -1.26 -4.88 107.32 93.77 1qe5 s GLY 37 Ca -0.09 0.03 0.06 0.00 0.00 0.00 0.00 44.72 44.72 1qe5 s GLY 37 CO 0.77 -0.17 0.07 0.30 0.00 0.00 0.00 173.10 174.08 1qe5 s HIS 38 N -2.00 2.99 -0.17 1.90 3.76 -0.65 -4.84 115.29 116.28 1qe5 s HIS 38 Ca -0.09 -0.08 0.18 0.00 -0.15 0.00 0.00 55.06 54.92 1qe5 s HIS 38 Cb -0.03 -1.44 -0.25 0.00 1.11 0.00 0.00 32.58 31.97 1qe5 s HIS 38 CO -0.00 0.52 0.12 -0.25 -0.85 0.00 0.00 174.74 174.28 1qe5 n ASP 39 N -0.28 0.15 -3.89 1.40 8.00 -0.14 -2.28 116.55 119.51 1qe5 n ASP 39 Ca -0.09 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.31 1qe5 n ASP 39 Cb 0.55 1.12 -0.09 0.00 -0.02 0.00 0.00 41.12 42.68 1qe5 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qe5 s MET 40 N -2.61 0.61 0.03 -1.24 0.23 -0.99 -2.68 119.30 112.64 1qe5 s MET 40 Ca -0.09 -0.64 0.06 0.00 -1.03 0.00 0.00 55.69 53.99 1qe5 s MET 40 Cb 0.07 0.25 -0.02 0.00 -1.53 0.00 0.00 34.83 33.59 1qe5 s MET 40 CO 0.82 -0.16 -0.18 0.00 -2.03 0.00 0.00 175.02 173.46 1qe5 s ALA 41 N -2.34 1.54 -0.07 3.16 0.00 0.12 -0.55 121.76 123.62 1qe5 s ALA 41 Ca -0.07 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.01 1qe5 s ALA 41 Cb -0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.78 1qe5 s ALA 41 CO -0.03 0.34 -0.20 -0.51 0.00 0.00 0.00 175.76 175.36 1qe5 s LEU 42 N -0.98 1.95 -0.29 0.00 1.02 0.13 -0.61 118.68 119.90 1qe5 s LEU 42 Ca 0.06 -0.44 -0.06 0.00 0.02 0.00 0.00 54.13 53.71 1qe5 s LEU 42 Cb -0.08 -1.16 0.01 0.00 0.02 0.00 0.00 46.19 44.98 1qe5 s LEU 42 CO 0.01 0.15 0.07 -0.69 0.02 0.00 0.00 176.35 175.91 1qe5 s VAL 43 N 0.20 3.84 -0.42 -1.59 1.01 0.32 -2.42 120.40 121.34 1qe5 s VAL 43 Ca -0.10 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 60.92 1qe5 s VAL 43 Cb -0.15 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.27 1qe5 s VAL 43 CO 0.05 0.08 0.66 -0.76 0.00 0.00 0.00 175.10 175.14 1qe5 s LEU 44 N 1.48 4.42 0.00 3.92 1.43 -1.26 -1.96 118.68 126.70 1qe5 s LEU 44 Ca 0.02 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1qe5 s LEU 44 Cb -0.17 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 43.27 1qe5 s LEU 44 CO 0.02 -0.77 0.00 0.61 0.23 0.00 0.00 176.35 176.44 1qe5 n GLY 45 N 4.96 -0.41 3.66 -3.19 0.00 -1.17 -4.77 105.19 104.27 1qe5 n GLY 45 Ca -0.01 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 1qe5 n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qe5 s SER 46 N -1.00 6.46 0.00 1.61 0.01 -1.26 -1.00 113.70 118.52 1qe5 s SER 46 Ca 0.00 2.55 0.00 0.00 1.31 0.00 0.00 55.95 59.81 1qe5 s SER 46 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1qe5 s SER 46 CO 0.00 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 173.20 1qe5 n GLY 47 N 4.50 0.72 0.92 3.44 0.00 -1.26 -3.89 105.19 109.63 1qe5 n GLY 47 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1qe5 n GLY 47 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1qe5 n TRP 48 N -2.00 0.18 -0.50 1.61 7.02 -0.17 -4.70 117.44 118.87 1qe5 n TRP 48 Ca 0.00 -0.10 0.42 0.00 -1.02 0.00 0.00 57.50 56.80 1qe5 n TRP 48 Cb 0.00 -0.00 0.70 0.00 -2.42 0.00 0.00 31.31 29.59 1qe5 n TRP 48 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1qe5 h GLY 49 N 4.12 1.21 -0.63 6.99 0.00 -1.86 0.26 103.07 113.15 1qe5 h GLY 49 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1qe5 h GLY 49 CO 0.00 -0.42 0.00 0.61 0.00 0.00 0.00 176.54 176.73 1qe5 n GLY 50 N -1.57 2.85 0.00 4.60 0.00 -1.26 -4.54 105.19 105.27 1qe5 n GLY 50 Ca 0.41 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.31 1qe5 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe5 n ALA 51 N 0.01 2.09 -0.72 4.61 0.00 0.92 -2.26 120.51 125.16 1qe5 n ALA 51 Ca 0.06 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.49 1qe5 n ALA 51 Cb 0.34 -1.22 0.17 0.00 0.00 0.00 0.00 19.45 18.74 1qe5 n ALA 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qe5 n ALA 52 N -0.90 2.48 0.08 0.00 0.00 -1.26 -4.58 120.51 116.33 1qe5 n ALA 52 Ca 0.10 -1.99 -0.06 0.00 0.00 0.00 0.00 53.44 51.49 1qe5 n ALA 52 Cb 0.05 -0.46 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 1qe5 n ALA 52 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1qe5 h GLU 53 N 1.06 0.02 -0.29 0.00 4.39 -1.81 -3.26 114.58 114.69 1qe5 h GLU 53 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1qe5 h GLU 53 Cb 1.04 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1qe5 h GLU 53 CO 0.08 0.89 0.00 1.28 -1.16 0.00 0.00 179.01 180.10 1qe5 n LEU 54 N -3.51 2.56 -0.18 1.33 4.77 -1.26 -4.45 117.00 116.26 1qe5 n LEU 54 Ca -0.01 -1.10 -0.07 0.00 -0.03 0.00 0.00 56.01 54.80 1qe5 n LEU 54 Cb 0.84 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.76 1qe5 n LEU 54 CO 0.46 0.55 1.07 0.25 -1.33 0.00 0.00 177.39 178.39 1qe5 h LEU 55 N 3.30 0.63 0.00 2.23 5.85 -1.86 -3.45 115.31 122.01 1qe5 h LEU 55 Ca 0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1qe5 h LEU 55 Cb 0.73 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1qe5 h LEU 55 CO 0.00 0.50 0.00 0.61 -0.34 0.00 0.00 178.44 179.21 1qe5 n GLY 56 N -1.14 -0.77 3.66 3.75 0.00 -1.26 -4.57 105.19 104.87 1qe5 n GLY 56 Ca 0.03 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 1qe5 n GLY 56 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qe5 s GLU 57 N -1.68 4.27 0.05 1.61 2.12 -1.04 -4.79 118.70 119.23 1qe5 s GLU 57 Ca 0.00 1.17 -0.30 0.00 0.36 0.00 0.00 54.97 56.20 1qe5 s GLU 57 Cb 0.00 -3.62 -0.08 0.00 0.26 0.00 0.00 34.13 30.69 1qe5 s GLU 57 CO 0.00 -0.50 1.70 0.08 -0.54 0.00 0.00 175.26 176.00 1qe5 s VAL 58 N 2.73 3.09 -0.09 3.70 1.01 -1.26 -1.44 120.40 128.13 1qe5 s VAL 58 Ca 0.41 0.44 0.04 0.00 0.00 0.00 0.00 61.98 62.87 1qe5 s VAL 58 Cb -0.16 -3.28 -0.24 0.00 0.00 0.00 0.00 36.38 32.70 1qe5 s VAL 58 CO 0.09 -0.01 0.47 0.52 0.00 0.00 0.00 175.10 176.17 1qe5 n VAL 59 N 4.94 1.67 -3.46 2.92 0.31 0.12 -4.93 118.33 119.91 1qe5 n VAL 59 Ca 0.17 -0.73 -0.12 0.00 -0.01 0.00 0.00 64.34 63.65 1qe5 n VAL 59 Cb 0.41 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.98 1qe5 n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1qe5 s ALA 60 N -2.57 -1.70 -0.04 3.52 0.00 -1.08 -4.99 121.76 114.90 1qe5 s ALA 60 Ca -0.14 0.79 0.04 0.00 0.00 0.00 0.00 51.96 52.65 1qe5 s ALA 60 Cb 0.07 0.57 -0.00 0.00 0.00 0.00 0.00 23.12 23.77 1qe5 s ALA 60 CO 0.79 -0.68 -0.15 -1.21 0.00 0.00 0.00 175.76 174.51 1qe5 s GLU 61 N -3.14 1.57 -0.10 0.00 2.02 -1.26 -1.22 118.70 116.56 1qe5 s GLU 61 Ca 0.01 -0.53 -0.01 0.00 0.02 0.00 0.00 54.97 54.46 1qe5 s GLU 61 Cb -0.01 -1.38 0.03 0.00 0.10 0.00 0.00 34.13 32.86 1qe5 s GLU 61 CO -0.08 0.21 -0.06 0.08 0.02 0.00 0.00 175.26 175.43 1qe5 s VAL 62 N 0.07 0.86 -0.10 2.63 1.01 0.14 -4.91 120.40 120.10 1qe5 s VAL 62 Ca -0.03 -0.19 -0.32 0.00 0.00 0.00 0.00 61.98 61.44 1qe5 s VAL 62 Cb -0.11 -0.92 -0.10 0.00 0.00 0.00 0.00 36.38 35.26 1qe5 s VAL 62 CO 0.02 0.34 2.00 -0.81 0.00 0.00 0.00 175.10 176.65 1qe5 n PRO 63 N 4.99 2.22 -0.35 2.72 -0.04 -1.26 0.21 135.00 143.50 1qe5 n PRO 63 Ca -0.11 0.77 0.09 0.00 -0.04 0.00 0.00 63.50 64.21 1qe5 n PRO 63 Cb 0.50 -2.83 0.28 0.00 -0.04 0.00 0.00 33.50 31.41 1qe5 n PRO 63 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1qe5 h THR 64 N 5.96 0.86 0.00 0.52 2.02 -1.76 -0.20 112.91 120.31 1qe5 h THR 64 Ca -0.46 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1qe5 h THR 64 Cb 1.26 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1qe5 h THR 64 CO 0.96 0.16 0.00 0.00 0.37 0.00 0.00 175.52 177.01 1qe5 n HIS 65 N -4.64 0.28 1.11 3.16 1.44 -1.26 -1.58 115.22 113.73 1qe5 n HIS 65 Ca 0.20 0.12 0.12 0.00 -2.01 0.00 0.00 57.72 56.15 1qe5 n HIS 65 Cb 0.42 -0.69 0.31 0.00 0.12 0.00 0.00 29.99 30.15 1qe5 n HIS 65 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1qe5 n GLU 66 N -1.77 2.02 -3.55 -1.40 1.02 -0.09 -4.77 120.64 112.11 1qe5 n GLU 66 Ca 0.02 -1.50 -0.36 0.00 -0.02 0.00 0.00 57.16 55.29 1qe5 n GLU 66 Cb 0.13 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 30.02 1qe5 n GLU 66 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qe5 s ILE 67 N -1.89 5.31 0.22 -3.67 1.01 -0.61 -5.03 121.20 116.54 1qe5 s ILE 67 Ca 0.34 0.53 -0.29 0.00 0.00 0.00 0.00 60.65 61.23 1qe5 s ILE 67 Cb 0.20 -3.62 -0.16 0.00 0.01 0.00 0.00 42.46 38.89 1qe5 s ILE 67 CO 0.31 0.40 0.80 -2.65 0.00 0.00 0.00 174.94 173.80 1qe5 n PRO 68 N 3.47 0.64 0.00 2.79 -0.02 -1.26 -1.74 135.00 138.88 1qe5 n PRO 68 Ca -0.12 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1qe5 n PRO 68 Cb 0.52 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 1qe5 n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qe5 n GLY 69 N 1.68 2.99 2.44 -1.23 0.00 -1.26 -4.59 105.19 105.22 1qe5 n GLY 69 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 1qe5 n GLY 69 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1qe5 n PHE 70 N -2.00 -3.27 0.00 1.61 3.01 -0.71 -4.94 117.46 111.17 1qe5 n PHE 70 Ca 0.00 -1.04 0.00 0.00 1.01 0.00 0.00 57.45 57.42 1qe5 n PHE 70 Cb 0.00 -0.49 0.00 0.00 -0.01 0.00 0.00 39.48 38.98 1qe5 n PHE 70 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1qe5 n SER 71 N -3.05 0.00 0.00 4.37 3.41 -1.26 -4.94 113.62 112.15 1qe5 n SER 71 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1qe5 n SER 71 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1qe5 n SER 71 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1qe5 n SER 80 N 0.00 0.00 -4.08 4.04 2.88 -1.26 -5.03 113.62 110.17 1qe5 n SER 80 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 1qe5 n SER 80 Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.30 1qe5 n SER 80 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1qe5 s VAL 81 N 0.00 1.13 -0.12 2.46 0.11 -1.26 -2.18 120.40 120.54 1qe5 s VAL 81 Ca 0.00 -0.56 -0.13 0.00 -2.93 0.00 0.00 61.98 58.37 1qe5 s VAL 81 Cb 0.00 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.82 1qe5 s VAL 81 CO 0.00 0.33 0.28 -0.89 -3.33 0.00 0.00 175.10 171.50 1qe5 s THR 82 N 0.07 5.29 0.04 5.04 2.01 0.13 -3.84 115.64 124.38 1qe5 s THR 82 Ca -0.03 0.53 0.07 0.00 0.31 0.00 0.00 61.69 62.58 1qe5 s THR 82 Cb -0.10 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1qe5 s THR 82 CO 0.01 0.47 -0.20 -0.13 -0.69 0.00 0.00 174.62 174.08 1qe5 s ARG 83 N -0.14 2.02 -0.32 4.92 0.52 0.00 0.26 118.95 126.22 1qe5 s ARG 83 Ca 0.17 -1.00 -0.06 0.00 -0.52 0.00 0.00 55.73 54.32 1qe5 s ARG 83 Cb -0.13 -2.14 0.03 0.00 0.52 0.00 0.00 34.95 33.22 1qe5 s ARG 83 CO 0.06 0.54 0.09 0.45 0.02 0.00 0.00 175.30 176.45 1qe5 s SER 84 N -1.33 5.22 -0.07 0.23 0.15 -0.36 -0.12 113.70 117.42 1qe5 s SER 84 Ca 0.14 -0.98 0.03 0.00 0.70 0.00 0.00 55.95 55.84 1qe5 s SER 84 Cb -0.10 -1.87 -0.02 0.00 -1.71 0.00 0.00 66.02 62.31 1qe5 s SER 84 CO 0.04 -0.27 -0.13 -0.63 1.20 0.00 0.00 173.24 173.45 1qe5 s ILE 85 N 1.44 3.13 -0.34 6.45 1.01 -0.22 0.13 121.20 132.81 1qe5 s ILE 85 Ca -0.00 -0.68 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 1qe5 s ILE 85 Cb -0.19 -2.25 0.00 0.00 0.01 0.00 0.00 42.46 40.04 1qe5 s ILE 85 CO 0.02 0.58 0.70 -0.60 0.00 0.00 0.00 174.94 175.64 1qe5 s ARG 86 N -0.52 3.80 -0.21 2.79 3.52 -0.52 -0.68 118.95 127.12 1qe5 s ARG 86 Ca 0.07 0.27 -0.12 0.00 -0.13 0.00 0.00 55.73 55.82 1qe5 s ARG 86 Cb -0.12 -3.77 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 1qe5 s ARG 86 CO 0.02 -0.71 0.24 0.08 -0.81 0.00 0.00 175.30 174.11 1qe5 s VAL 87 N 2.82 5.32 -0.26 7.11 1.01 0.11 -2.51 120.40 134.00 1qe5 s VAL 87 Ca 0.28 0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.53 1qe5 s VAL 87 Cb -0.14 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1qe5 s VAL 87 CO 0.14 0.34 0.17 -0.70 0.00 0.00 0.00 175.10 175.06 1qe5 s GLU 88 N 0.91 3.99 0.65 2.72 2.12 -1.26 -1.46 118.70 126.36 1qe5 s GLU 88 Ca 0.12 -0.30 -0.02 0.00 0.36 0.00 0.00 54.97 55.13 1qe5 s GLU 88 Cb -0.13 -3.59 0.07 0.00 0.26 0.00 0.00 34.13 30.74 1qe5 s GLU 88 CO 0.04 -0.06 0.91 1.03 -0.54 0.00 0.00 175.26 176.64 1qe5 s ARG 89 N 1.42 2.18 0.14 4.30 0.52 0.23 -4.92 118.95 122.82 1qe5 s ARG 89 Ca 0.07 -0.71 -0.26 0.00 -0.52 0.00 0.00 55.73 54.32 1qe5 s ARG 89 Cb -0.15 -2.34 -0.01 0.00 0.52 0.00 0.00 34.95 32.97 1qe5 s ARG 89 CO 0.08 -1.09 1.60 0.00 0.02 0.00 0.00 175.30 175.91 1qe5 h ALA 90 N -0.31 -0.37 -0.02 2.13 0.00 -1.86 -1.87 119.26 116.96 1qe5 h ALA 90 Ca -0.41 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1qe5 h ALA 90 Cb 1.29 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 19.74 1qe5 h ALA 90 CO 0.51 -0.81 0.01 -0.40 0.00 0.00 0.00 179.25 178.57 1qe5 n ASP 91 N -5.41 4.26 0.00 0.00 5.68 -1.26 -4.82 116.55 115.00 1qe5 n ASP 91 Ca -0.02 -2.24 0.00 0.00 -0.50 0.00 0.00 54.79 52.03 1qe5 n ASP 91 Cb 0.33 -0.83 0.00 0.00 -1.14 0.00 0.00 41.12 39.48 1qe5 n ASP 91 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qe5 n GLY 92 N 1.00 0.20 3.77 6.12 0.00 -0.70 -4.95 105.19 110.62 1qe5 n GLY 92 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1qe5 n GLY 92 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qe5 s SER 93 N -2.14 4.55 0.18 1.61 1.04 -1.26 -4.68 113.70 113.01 1qe5 s SER 93 Ca 0.00 1.85 0.08 0.00 0.48 0.00 0.00 55.95 58.36 1qe5 s SER 93 Cb 0.00 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 1qe5 s SER 93 CO 0.00 -2.00 -0.17 0.68 0.98 0.00 0.00 173.24 172.73 1qe5 s VAL 94 N -2.83 1.81 0.09 5.02 -7.23 -1.26 -0.60 120.40 115.40 1qe5 s VAL 94 Ca 0.62 -2.05 0.03 0.00 -1.81 0.00 0.00 61.98 58.77 1qe5 s VAL 94 Cb -0.18 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 1qe5 s VAL 94 CO 0.54 -0.43 -0.08 -0.13 -0.31 0.00 0.00 175.10 174.69 1qe5 s ARG 95 N -3.14 0.77 -0.15 4.82 1.81 -0.54 -4.98 118.95 117.54 1qe5 s ARG 95 Ca 0.19 -1.13 -0.01 0.00 -1.72 0.00 0.00 55.73 53.05 1qe5 s ARG 95 Cb -0.04 -0.36 -0.02 0.00 -0.45 0.00 0.00 34.95 34.09 1qe5 s ARG 95 CO 0.07 0.04 -0.10 -1.01 -0.68 0.00 0.00 175.30 173.62 1qe5 s HIS 96 N -2.64 2.88 -0.13 -0.53 3.76 -1.26 0.07 115.29 117.44 1qe5 s HIS 96 Ca 0.04 -0.62 -0.03 0.00 -0.15 0.00 0.00 55.06 54.30 1qe5 s HIS 96 Cb -0.01 -1.90 -0.03 0.00 1.11 0.00 0.00 32.58 31.74 1qe5 s HIS 96 CO -0.02 -0.23 -0.03 0.00 -0.85 0.00 0.00 174.74 173.62 1qe5 s ALA 97 N 0.52 3.08 -0.27 -1.40 0.00 0.14 -0.97 121.76 122.87 1qe5 s ALA 97 Ca -0.07 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 50.97 1qe5 s ALA 97 Cb -0.15 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.40 1qe5 s ALA 97 CO 0.04 0.34 0.16 -1.17 0.00 0.00 0.00 175.76 175.12 1qe5 s LEU 98 N -0.04 3.91 -0.39 0.00 0.20 0.29 -1.05 118.68 121.58 1qe5 s LEU 98 Ca 0.02 -0.04 -0.08 0.00 0.69 0.00 0.00 54.13 54.72 1qe5 s LEU 98 Cb -0.13 -2.08 0.07 0.00 -0.43 0.00 0.00 46.19 43.62 1qe5 s LEU 98 CO 0.02 -0.03 0.21 -0.69 -0.29 0.00 0.00 176.35 175.57 1qe5 s VAL 99 N 1.63 4.08 0.31 1.68 1.01 0.83 0.22 120.40 130.16 1qe5 s VAL 99 Ca 0.07 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 1qe5 s VAL 99 Cb -0.15 -3.45 -0.10 0.00 0.00 0.00 0.00 36.38 32.68 1qe5 s VAL 99 CO 0.09 -0.41 1.31 -0.76 0.00 0.00 0.00 175.10 175.33 1qe5 s LEU 100 N 1.41 4.43 0.03 3.92 1.02 -1.02 -0.82 118.68 127.66 1qe5 s LEU 100 Ca 0.02 2.63 -0.30 0.00 0.02 0.00 0.00 54.13 56.50 1qe5 s LEU 100 Cb -0.22 -3.64 -0.17 0.00 0.02 0.00 0.00 46.19 42.18 1qe5 s LEU 100 CO 0.02 -0.52 1.31 1.23 0.02 0.00 0.00 176.35 178.41 1qe5 h GLY 101 N 3.78 -1.03 -0.04 -3.19 0.00 -1.92 -3.44 103.07 97.23 1qe5 h GLY 101 Ca -0.48 0.38 -0.20 0.00 0.00 0.00 0.00 47.33 47.03 1qe5 h GLY 101 CO 0.68 -0.37 -0.15 1.44 0.00 0.00 0.00 176.54 178.14 1qe5 n SER 102 N -5.45 2.40 -3.78 0.19 7.64 -1.26 -4.69 113.62 108.66 1qe5 n SER 102 Ca -0.13 -1.69 -0.13 0.00 1.01 0.00 0.00 58.87 57.93 1qe5 n SER 102 Cb 0.40 0.12 -0.13 0.00 -1.01 0.00 0.00 64.21 63.59 1qe5 n SER 102 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1qe5 s ARG 103 N -2.57 0.18 -0.21 1.43 3.52 -1.26 -5.01 118.95 115.03 1qe5 s ARG 103 Ca 0.00 0.32 -0.04 0.00 -0.13 0.00 0.00 55.73 55.88 1qe5 s ARG 103 Cb 0.00 -0.00 -0.01 0.00 -1.56 0.00 0.00 34.95 33.37 1qe5 s ARG 103 CO 0.00 -0.08 -0.03 0.99 -0.81 0.00 0.00 175.30 175.37 1qe5 s THR 104 N 0.54 3.57 0.43 4.11 2.01 -1.26 -5.10 115.64 119.93 1qe5 s THR 104 Ca -0.04 -0.43 -0.09 0.00 0.31 0.00 0.00 61.69 61.44 1qe5 s THR 104 Cb -0.05 -2.62 -0.06 0.00 0.01 0.00 0.00 72.50 69.78 1qe5 s THR 104 CO -0.03 0.43 0.78 -1.00 -0.69 0.00 0.00 174.62 174.11 1qe5 s HIS 105 N 1.25 3.49 0.25 4.92 3.76 -1.26 -4.44 115.29 123.26 1qe5 s HIS 105 Ca 0.03 1.00 -0.06 0.00 -0.15 0.00 0.00 55.06 55.89 1qe5 s HIS 105 Cb -0.14 -2.42 0.26 0.00 1.11 0.00 0.00 32.58 31.39 1qe5 s HIS 105 CO -0.01 -0.16 1.89 1.25 -0.85 0.00 0.00 174.74 176.87 1qe5 h LEU 106 N 1.00 1.11 0.00 0.89 6.46 -1.87 -2.72 115.31 120.18 1qe5 h LEU 106 Ca -0.47 -0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.22 1qe5 h LEU 106 Cb 1.19 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 1qe5 h LEU 106 CO 0.63 0.86 0.00 0.00 -0.62 0.00 0.00 178.44 179.31 1qe5 n TYR 107 N -4.35 0.00 1.06 1.25 0.18 -1.26 -1.69 117.16 112.35 1qe5 n TYR 107 Ca 0.10 0.00 0.14 0.00 1.88 0.00 0.00 57.90 60.02 1qe5 n TYR 107 Cb 0.07 -0.33 0.63 0.00 -0.38 0.00 0.00 39.34 39.33 1qe5 n TYR 107 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1qe5 n GLU 108 N -1.33 0.06 -1.31 -3.48 1.02 -1.02 -4.88 120.64 109.70 1qe5 n GLU 108 Ca 0.04 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.07 1qe5 n GLU 108 Cb 0.08 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.96 1qe5 n GLU 108 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qe5 n GLY 109 N 1.47 1.17 0.46 0.62 0.00 -0.68 -4.89 105.19 103.33 1qe5 n GLY 109 Ca 0.08 -0.40 0.04 0.00 0.00 0.00 0.00 46.02 45.75 1qe5 n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qe5 n LYS 110 N -2.38 1.58 0.00 1.61 5.02 -1.26 -5.02 118.16 117.70 1qe5 n LYS 110 Ca -0.11 -0.89 0.00 0.00 -2.02 0.00 0.00 58.31 55.29 1qe5 n LYS 110 Cb 0.39 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.19 1qe5 n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qe5 n GLY 111 N 0.90 0.03 0.28 0.72 0.00 -1.26 -4.37 105.19 101.50 1qe5 n GLY 111 Ca 0.09 -1.62 0.17 0.00 0.00 0.00 0.00 46.02 44.66 1qe5 n GLY 111 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1qe5 h VAL 112 N 0.00 0.14 -0.37 1.61 3.04 -1.94 -3.08 116.25 115.64 1qe5 h VAL 112 Ca 0.00 -0.49 -0.03 0.00 -1.01 0.00 0.00 66.70 65.17 1qe5 h VAL 112 Cb 0.00 1.42 -0.02 0.00 -2.01 0.00 0.00 31.29 30.69 1qe5 h VAL 112 CO 0.00 0.04 0.11 0.03 -1.01 0.00 0.00 177.57 176.74 1qe5 h ARG 113 N 0.00 0.59 -0.18 4.17 3.08 -1.92 -2.43 114.38 117.68 1qe5 h ARG 113 Ca -0.00 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1qe5 h ARG 113 Cb 0.42 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1qe5 h ARG 113 CO 0.01 0.61 -0.19 0.00 -1.07 0.00 0.00 179.97 179.32 1qe5 h ALA 114 N 0.95 1.33 -0.67 0.04 0.00 -1.74 -1.47 119.26 117.71 1qe5 h ALA 114 Ca 0.12 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1qe5 h ALA 114 Cb 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1qe5 h ALA 114 CO -0.00 0.45 0.27 0.28 0.00 0.00 0.00 179.25 180.25 1qe5 h VAL 115 N 0.29 1.23 -0.13 0.00 2.07 -1.44 -3.30 116.25 114.97 1qe5 h VAL 115 Ca 0.05 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1qe5 h VAL 115 Cb 0.51 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1qe5 h VAL 115 CO 0.03 0.29 0.00 1.33 0.02 0.00 0.00 177.57 179.24 1qe5 n VAL 116 N -4.31 0.19 -0.36 2.57 0.24 -0.95 -4.55 118.33 111.16 1qe5 n VAL 116 Ca 0.06 -0.60 0.07 0.00 -2.04 0.00 0.00 64.34 61.83 1qe5 n VAL 116 Cb 0.17 1.21 0.24 0.00 -1.47 0.00 0.00 33.84 33.99 1qe5 n VAL 116 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1qe5 h HIS 117 N 3.53 1.15 -0.72 6.34 2.76 -1.37 -0.04 115.15 126.81 1qe5 h HIS 117 Ca 0.00 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.15 1qe5 h HIS 117 Cb 0.78 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 1qe5 h HIS 117 CO 0.07 0.47 0.24 0.78 -1.30 0.00 0.00 177.93 178.19 1qe5 h GLY 118 N 1.01 1.18 0.87 5.26 0.00 -1.82 -0.02 103.07 109.56 1qe5 h GLY 118 Ca 0.49 -0.69 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 1qe5 h GLY 118 CO -0.25 0.64 -0.01 -2.08 0.00 0.00 0.00 176.54 174.84 1qe5 h VAL 119 N 1.05 1.26 -0.22 4.60 2.07 -1.36 -1.47 116.25 122.17 1qe5 h VAL 119 Ca 0.23 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 1qe5 h VAL 119 Cb 0.28 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1qe5 h VAL 119 CO -0.01 0.30 -0.07 0.03 0.02 0.00 0.00 177.57 177.84 1qe5 h ARG 120 N 0.28 0.35 -0.15 1.57 3.08 -1.16 -1.88 114.38 116.47 1qe5 h ARG 120 Ca 0.08 -0.07 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 1qe5 h ARG 120 Cb 0.44 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1qe5 h ARG 120 CO 0.02 0.43 -0.58 1.15 -1.07 0.00 0.00 179.97 179.92 1qe5 h THR 121 N 0.33 1.34 -0.42 2.04 2.02 -0.80 -1.95 112.91 115.47 1qe5 h THR 121 Ca 0.07 -1.86 -0.15 0.00 0.77 0.00 0.00 66.41 65.24 1qe5 h THR 121 Cb 0.34 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1qe5 h THR 121 CO 0.02 0.57 -0.32 0.00 0.37 0.00 0.00 175.52 176.16 1qe5 h ALA 122 N 1.01 0.61 -0.66 6.16 0.00 -0.62 -2.54 119.26 123.21 1qe5 h ALA 122 Ca 0.00 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.51 1qe5 h ALA 122 Cb 1.11 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1qe5 h ALA 122 CO 0.10 0.67 0.41 0.00 0.00 0.00 0.00 179.25 180.43 1qe5 h ALA 123 N 0.81 0.87 0.00 0.00 0.00 -1.25 -1.86 119.26 117.82 1qe5 h ALA 123 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1qe5 h ALA 123 Cb 0.91 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1qe5 h ALA 123 CO 0.08 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1qe5 h ALA 124 N 1.29 1.00 -0.00 0.00 0.00 -0.94 0.50 119.26 121.11 1qe5 h ALA 124 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1qe5 h ALA 124 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1qe5 h ALA 124 CO -0.11 0.00 -0.17 0.25 0.00 0.00 0.00 179.25 179.21 1qe5 n THR 125 N -3.03 0.00 -0.79 0.00 -2.24 -0.76 -4.90 114.28 102.55 1qe5 n THR 125 Ca -0.01 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1qe5 n THR 125 Cb 0.21 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 1qe5 n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qe5 n GLY 126 N 1.36 0.70 3.59 3.38 0.00 0.18 -1.64 105.19 112.76 1qe5 n GLY 126 Ca 0.12 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 1qe5 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe5 s ALA 127 N -2.00 3.26 -0.62 4.61 0.00 -0.84 -4.57 121.76 121.61 1qe5 s ALA 127 Ca 0.00 -0.55 0.25 0.00 0.00 0.00 0.00 51.96 51.66 1qe5 s ALA 127 Cb 0.00 -3.73 0.57 0.00 0.00 0.00 0.00 23.12 19.96 1qe5 s ALA 127 CO 0.00 -2.01 1.61 1.05 0.00 0.00 0.00 175.76 176.41 1qe5 h GLU 128 N 8.95 0.00 -5.25 0.00 9.09 -1.74 -3.41 114.58 122.22 1qe5 h GLU 128 Ca -0.23 0.00 -0.62 0.00 0.05 0.00 0.00 59.36 58.56 1qe5 h GLU 128 Cb 1.07 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 28.00 1qe5 h GLU 128 CO 1.06 0.00 -0.57 0.99 0.05 0.00 0.00 179.01 180.54 1qe5 s THR 129 N -3.15 4.70 -0.12 -1.06 2.01 -1.20 -0.66 115.64 116.16 1qe5 s THR 129 Ca 0.08 -0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.05 1qe5 s THR 129 Cb 0.11 -3.12 0.01 0.00 0.01 0.00 0.00 72.50 69.50 1qe5 s THR 129 CO 0.65 0.45 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.58 1qe5 s LEU 130 N 0.49 2.07 -0.34 4.42 0.20 -0.01 -0.70 118.68 124.81 1qe5 s LEU 130 Ca 0.03 -0.57 -0.07 0.00 0.69 0.00 0.00 54.13 54.21 1qe5 s LEU 130 Cb -0.13 -1.40 0.03 0.00 -0.43 0.00 0.00 46.19 44.26 1qe5 s LEU 130 CO 0.01 0.11 0.11 -0.63 -0.29 0.00 0.00 176.35 175.66 1qe5 s ILE 131 N 0.63 3.90 -0.19 6.68 1.01 0.22 -0.81 121.20 132.63 1qe5 s ILE 131 Ca -0.12 -1.05 -0.06 0.00 0.00 0.00 0.00 60.65 59.42 1qe5 s ILE 131 Cb -0.16 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 1qe5 s ILE 131 CO 0.03 -0.16 0.03 -0.76 0.00 0.00 0.00 174.94 174.08 1qe5 s LEU 132 N 1.43 3.51 0.15 2.97 1.43 0.15 -0.52 118.68 127.81 1qe5 s LEU 132 Ca -0.01 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 1qe5 s LEU 132 Cb -0.19 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1qe5 s LEU 132 CO 0.03 0.11 -0.17 0.42 0.23 0.00 0.00 176.35 176.97 1qe5 s THR 133 N 0.77 1.68 0.33 5.49 -4.23 -0.83 -0.47 115.64 118.38 1qe5 s THR 133 Ca 0.02 -1.86 -0.14 0.00 -1.18 0.00 0.00 61.69 58.53 1qe5 s THR 133 Cb -0.14 -1.76 0.03 0.00 1.34 0.00 0.00 72.50 71.97 1qe5 s THR 133 CO 0.02 -0.34 0.67 0.54 -0.54 0.00 0.00 174.62 174.97 1qe5 s ASN 134 N -2.60 0.09 -0.04 3.99 6.03 -0.91 -3.03 114.94 118.46 1qe5 s ASN 134 Ca 0.14 -1.04 0.04 0.00 -1.03 0.00 0.00 52.86 50.97 1qe5 s ASN 134 Cb -0.05 0.75 -0.03 0.00 -3.03 0.00 0.00 41.25 38.89 1qe5 s ASN 134 CO 0.05 -1.46 -0.16 -0.83 -2.03 0.00 0.00 177.10 172.68 1qe5 s GLY 135 N -3.06 1.49 0.33 0.45 0.00 -1.25 -0.68 107.32 104.61 1qe5 s GLY 135 Ca 0.18 -1.01 -0.11 0.00 0.00 0.00 0.00 44.72 43.78 1qe5 s GLY 135 CO 0.12 -0.81 0.60 0.00 0.00 0.00 0.00 173.10 173.01 1qe5 s GLY 137 N -3.09 2.31 0.06 0.00 0.00 -0.14 0.40 107.32 106.85 1qe5 s GLY 137 Ca 0.22 -0.40 0.00 0.00 0.00 0.00 0.00 44.72 44.54 1qe5 s GLY 137 CO 0.13 0.11 0.21 -0.32 0.00 0.00 0.00 173.10 173.23 1qe5 s GLY 138 N -0.56 2.19 0.00 0.20 0.00 -0.19 -0.82 107.32 108.14 1qe5 s GLY 138 Ca 0.19 -0.84 0.10 0.00 0.00 0.00 0.00 44.72 44.17 1qe5 s GLY 138 CO 0.08 -0.82 0.59 1.04 0.00 0.00 0.00 173.10 173.98 1qe5 n LEU 139 N 0.30 1.02 -4.59 0.66 4.32 -0.58 -0.91 117.00 117.21 1qe5 n LEU 139 Ca -0.05 -0.69 -0.38 0.00 -0.02 0.00 0.00 56.01 54.87 1qe5 n LEU 139 Cb 0.51 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 42.20 1qe5 n LEU 139 CO 0.52 0.21 -0.16 0.21 -1.22 0.00 0.00 177.39 176.95 1qe5 s ASN 140 N -1.57 6.04 0.63 -1.43 3.84 -1.26 -4.95 114.94 116.23 1qe5 s ASN 140 Ca 0.07 0.01 0.40 0.00 0.21 0.00 0.00 52.86 53.55 1qe5 s ASN 140 Cb 0.08 -2.13 2.10 0.00 -0.55 0.00 0.00 41.25 40.75 1qe5 s ASN 140 CO 0.31 -0.06 2.27 1.56 -2.79 0.00 0.00 177.10 178.39 1qe5 h GLN 141 N 8.34 0.00 0.00 0.43 4.20 -1.93 -1.42 115.11 124.72 1qe5 h GLN 141 Ca -0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.36 1qe5 h GLN 141 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1qe5 h GLN 141 CO 0.56 0.01 0.00 0.39 -0.67 0.00 0.00 178.83 179.12 1qe5 n GLU 142 N -3.20 0.13 -3.69 1.46 1.02 -1.26 -4.30 120.64 110.80 1qe5 n GLU 142 Ca -0.02 0.29 -0.37 0.00 -0.02 0.00 0.00 57.16 57.04 1qe5 n GLU 142 Cb 0.13 -1.71 -0.09 0.00 -0.02 0.00 0.00 31.44 29.75 1qe5 n GLU 142 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1qe5 s TRP 143 N -3.15 3.52 0.92 -0.32 0.51 -0.54 -5.08 118.94 114.79 1qe5 s TRP 143 Ca 0.07 -2.78 -0.14 0.00 -2.12 0.00 0.00 56.10 51.14 1qe5 s TRP 143 Cb 0.11 -3.22 0.15 0.00 -0.81 0.00 0.00 33.47 29.70 1qe5 s TRP 143 CO 0.41 -0.81 1.18 0.20 -0.51 0.00 0.00 176.95 177.42 1qe5 s GLY 144 N 0.48 1.62 0.16 0.98 0.00 -1.26 -4.74 107.32 104.56 1qe5 s GLY 144 Ca 0.20 -0.73 -0.31 0.00 0.00 0.00 0.00 44.72 43.88 1qe5 s GLY 144 CO -0.06 -0.12 0.70 0.00 0.00 0.00 0.00 173.10 173.62 1qe5 n ALA 145 N -3.73 -2.74 -0.12 3.20 0.00 -1.26 -1.92 120.51 113.94 1qe5 n ALA 145 Ca 0.09 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1qe5 n ALA 145 Cb 0.60 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1qe5 n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qe5 n GLY 146 N 1.85 0.93 3.66 0.00 0.00 0.73 -4.94 105.19 107.42 1qe5 n GLY 146 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1qe5 n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qe5 s THR 147 N -2.48 4.85 0.01 2.61 2.01 -0.81 -4.85 115.64 116.98 1qe5 s THR 147 Ca 0.00 1.66 -0.26 0.00 0.31 0.00 0.00 61.69 63.40 1qe5 s THR 147 Cb 0.00 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 1qe5 s THR 147 CO 0.00 -0.02 0.80 -2.16 -0.69 0.00 0.00 174.62 172.55 1qe5 s PRO 148 N 2.45 4.51 -0.05 4.92 0.04 -1.26 -1.20 135.00 144.40 1qe5 s PRO 148 Ca 0.38 1.11 0.04 0.00 0.04 0.00 0.00 61.00 62.57 1qe5 s PRO 148 Cb -0.16 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 30.97 1qe5 s PRO 148 CO 0.10 0.16 -0.17 0.08 0.04 0.00 0.00 177.00 177.21 1qe5 s VAL 149 N 0.38 1.46 0.09 -0.36 1.01 0.31 -4.37 120.40 118.91 1qe5 s VAL 149 Ca 0.41 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.41 1qe5 s VAL 149 Cb -0.20 -1.27 -0.06 0.00 0.00 0.00 0.00 36.38 34.86 1qe5 s VAL 149 CO 0.23 0.42 0.83 -0.76 0.00 0.00 0.00 175.10 175.82 1qe5 s LEU 150 N 0.18 4.49 -0.10 3.92 1.43 -0.11 0.14 118.68 128.63 1qe5 s LEU 150 Ca -0.07 1.59 -0.30 0.00 -1.03 0.00 0.00 54.13 54.32 1qe5 s LEU 150 Cb -0.13 -3.36 -0.01 0.00 0.03 0.00 0.00 46.19 42.71 1qe5 s LEU 150 CO 0.03 0.02 1.05 -0.76 0.23 0.00 0.00 176.35 176.92 1qe5 s LEU 151 N -0.20 4.24 -0.10 1.79 1.02 -0.12 -0.88 118.68 124.43 1qe5 s LEU 151 Ca 0.41 1.58 0.20 0.00 0.02 0.00 0.00 54.13 56.34 1qe5 s LEU 151 Cb -0.22 -3.56 -0.28 0.00 0.02 0.00 0.00 46.19 42.16 1qe5 s LEU 151 CO 0.26 -0.49 0.33 -1.54 0.02 0.00 0.00 176.35 174.92 1qe5 n SER 152 N 5.14 0.07 -3.45 2.29 3.41 0.27 -4.68 113.62 116.68 1qe5 n SER 152 Ca 0.09 0.03 -0.02 0.00 -0.26 0.00 0.00 58.87 58.71 1qe5 n SER 152 Cb 0.48 1.39 0.01 0.00 -0.26 0.00 0.00 64.21 65.84 1qe5 n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1qe5 s ASP 153 N -5.06 -0.01 0.17 4.04 -1.08 -1.25 -4.63 116.67 108.85 1qe5 s ASP 153 Ca -0.08 -0.59 -0.11 0.00 -0.52 0.00 0.00 52.55 51.24 1qe5 s ASP 153 Cb 0.10 0.46 0.00 0.00 -1.46 0.00 0.00 42.92 42.02 1qe5 s ASP 153 CO 0.86 -0.90 0.35 -1.38 0.52 0.00 0.00 175.17 174.63 1qe5 s HIS 154 N -2.27 0.25 -0.11 -5.34 -3.43 -1.26 -1.89 115.29 101.24 1qe5 s HIS 154 Ca 0.21 -0.61 -0.01 0.00 -0.80 0.00 0.00 55.06 53.85 1qe5 s HIS 154 Cb -0.02 0.08 0.03 0.00 -1.43 0.00 0.00 32.58 31.24 1qe5 s HIS 154 CO 0.04 -0.78 -0.01 0.42 -2.00 0.00 0.00 174.74 172.41 1qe5 s ILE 155 N -3.94 0.60 -0.42 -5.38 1.01 0.38 -4.91 121.20 108.53 1qe5 s ILE 155 Ca 0.15 -0.15 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 1qe5 s ILE 155 Cb 0.02 -0.80 0.02 0.00 0.01 0.00 0.00 42.46 41.71 1qe5 s ILE 155 CO -0.01 0.18 0.60 0.21 0.00 0.00 0.00 174.94 175.92 1qe5 s ASN 156 N 1.87 6.31 -0.11 3.58 2.47 -1.26 -1.36 114.94 126.43 1qe5 s ASN 156 Ca 0.03 -0.35 0.16 0.00 0.42 0.00 0.00 52.86 53.12 1qe5 s ASN 156 Cb -0.13 -2.30 0.56 0.00 -1.45 0.00 0.00 41.25 37.92 1qe5 s ASN 156 CO -0.07 -0.71 1.47 0.18 -3.72 0.00 0.00 177.10 174.25 1qe5 n LEU 157 N 6.10 4.05 0.04 3.21 4.77 -0.23 -4.56 117.00 130.38 1qe5 n LEU 157 Ca -0.03 -2.54 0.14 0.00 -0.03 0.00 0.00 56.01 53.55 1qe5 n LEU 157 Cb 0.48 -0.48 0.54 0.00 -2.33 0.00 0.00 43.42 41.62 1qe5 n LEU 157 CO 0.51 0.74 0.93 0.35 -1.33 0.00 0.00 177.39 178.59 1qe5 n THR 158 N 0.41 0.24 -1.81 -5.08 -2.24 -1.21 -4.62 114.28 99.96 1qe5 n THR 158 Ca 0.21 -0.11 -0.20 0.00 -2.27 0.00 0.00 64.05 61.68 1qe5 n THR 158 Cb 0.79 -0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 1qe5 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qe5 n ALA 159 N -1.61 -0.40 -2.50 6.98 0.00 -1.26 -4.92 120.51 116.80 1qe5 n ALA 159 Ca 0.06 0.28 -0.24 0.00 0.00 0.00 0.00 53.44 53.54 1qe5 n ALA 159 Cb 0.37 -2.03 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 1qe5 n ALA 159 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1qe5 s ARG 160 N -4.07 1.72 -0.04 0.00 1.81 -1.26 -5.16 118.95 111.94 1qe5 s ARG 160 Ca 0.00 -1.86 -0.07 0.00 -1.72 0.00 0.00 55.73 52.08 1qe5 s ARG 160 Cb 0.00 -1.58 0.01 0.00 -0.45 0.00 0.00 34.95 32.93 1qe5 s ARG 160 CO 0.00 0.15 0.18 0.45 -0.68 0.00 0.00 175.30 175.40 1qe5 s SER 161 N -3.55 -0.12 0.00 0.23 0.15 -1.26 -5.02 113.70 104.13 1qe5 s SER 161 Ca 0.31 0.18 0.30 0.00 0.70 0.00 0.00 55.95 57.44 1qe5 s SER 161 Cb 0.01 0.32 1.53 0.00 -1.71 0.00 0.00 66.02 66.18 1qe5 s SER 161 CO 0.15 -0.18 2.06 -0.81 1.20 0.00 0.00 173.24 175.66 1qe5 n PRO 162 N 2.42 0.49 -3.48 5.44 -0.04 -1.26 -4.82 135.00 133.75 1qe5 n PRO 162 Ca -0.16 -0.02 -0.38 0.00 -0.04 0.00 0.00 63.50 62.91 1qe5 n PRO 162 Cb 0.58 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 1qe5 n PRO 162 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1qe5 s LEU 163 N -2.52 4.37 -0.03 1.53 1.43 -1.26 -4.93 118.68 117.27 1qe5 s LEU 163 Ca 0.30 0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 54.19 1qe5 s LEU 163 Cb 0.20 -2.54 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 1qe5 s LEU 163 CO 0.46 0.20 0.04 -1.61 0.23 0.00 0.00 176.35 175.67 1qe5 s GLU 164 N -0.30 3.00 0.19 1.70 2.02 -1.26 -5.00 118.70 119.05 1qe5 s GLU 164 Ca 0.22 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.74 1qe5 s GLU 164 Cb -0.15 -2.82 0.00 0.00 0.10 0.00 0.00 34.13 31.26 1qe5 s GLU 164 CO 0.10 0.67 0.00 0.41 0.02 0.00 0.00 175.26 176.46 1qe5 n GLY 165 N 1.56 -1.92 3.07 -1.39 0.00 -1.26 -4.42 105.19 100.83 1qe5 n GLY 165 Ca -0.15 -1.34 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 1qe5 n GLY 165 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qe5 n PRO 166 N -2.94 0.22 -3.58 1.61 -0.02 -1.26 -4.81 135.00 124.24 1qe5 n PRO 166 Ca -0.01 -0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 60.35 1qe5 n PRO 166 Cb 0.31 -2.17 -0.08 0.00 -0.02 0.00 0.00 33.50 31.54 1qe5 n PRO 166 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1qe5 s THR 167 N 5.27 4.20 -1.08 3.45 2.01 -1.26 -5.01 115.64 123.22 1qe5 s THR 167 Ca 0.19 -2.08 -0.12 0.00 0.31 0.00 0.00 61.69 59.99 1qe5 s THR 167 Cb 0.04 -3.75 0.22 0.00 0.01 0.00 0.00 72.50 69.03 1qe5 s THR 167 CO 0.07 -0.81 1.16 -0.36 -0.69 0.00 0.00 174.62 173.99 1qe5 s PHE 168 N 0.98 3.85 0.12 4.92 0.08 -1.26 -5.01 117.98 121.66 1qe5 s PHE 168 Ca 0.09 -2.30 -0.29 0.00 0.12 0.00 0.00 56.93 54.56 1qe5 s PHE 168 Cb -0.23 -4.02 -0.06 0.00 -0.57 0.00 0.00 43.02 38.13 1qe5 s PHE 168 CO -0.02 -1.14 0.90 0.08 -0.10 0.00 0.00 175.22 174.94 1qe5 s VAL 169 N 0.19 4.49 -0.11 -0.44 1.01 -1.26 -5.04 120.40 119.24 1qe5 s VAL 169 Ca 0.33 1.96 -0.24 0.00 0.00 0.00 0.00 61.98 64.02 1qe5 s VAL 169 Cb -0.07 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 1qe5 s VAL 169 CO -0.06 0.36 0.75 -0.62 0.00 0.00 0.00 175.10 175.53 1qe5 s ASP 170 N -0.23 6.96 -0.39 3.32 2.15 -1.26 -4.95 116.67 122.28 1qe5 s ASP 170 Ca 0.44 1.17 0.05 0.00 0.43 0.00 0.00 52.55 54.63 1qe5 s ASP 170 Cb -0.23 -2.43 0.46 0.00 -0.30 0.00 0.00 42.92 40.43 1qe5 s ASP 170 CO 0.28 -0.23 1.45 0.18 -0.17 0.00 0.00 175.17 176.69 1qe5 n LEU 171 N 4.36 5.55 0.01 -1.34 4.77 -1.26 -4.71 117.00 124.38 1qe5 n LEU 171 Ca 0.01 -4.51 -0.10 0.00 -0.03 0.00 0.00 56.01 51.38 1qe5 n LEU 171 Cb 0.50 -0.55 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 1qe5 n LEU 171 CO 0.47 1.84 0.44 0.74 -1.33 0.00 0.00 177.39 179.55 1qe5 h THR 172 N 1.71 1.33 -2.04 -5.08 2.02 -2.04 -3.35 112.91 105.46 1qe5 h THR 172 Ca 0.41 -1.87 -0.54 0.00 0.77 0.00 0.00 66.41 65.18 1qe5 h THR 172 Cb 1.35 1.84 -0.40 0.00 -1.74 0.00 0.00 68.15 69.20 1qe5 h THR 172 CO 0.93 0.58 -1.06 0.47 0.37 0.00 0.00 175.52 176.82 1qe5 n ASP 173 N -3.94 1.04 -0.35 4.18 8.00 -1.26 -4.95 116.55 119.27 1qe5 n ASP 173 Ca -0.04 -2.94 0.13 0.00 0.71 0.00 0.00 54.79 52.65 1qe5 n ASP 173 Cb 0.64 -0.63 0.32 0.00 -0.02 0.00 0.00 41.12 41.43 1qe5 n ASP 173 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1qe5 h VAL 174 N 1.86 0.74 -3.55 2.53 2.07 -1.90 -3.35 116.25 114.65 1qe5 h VAL 174 Ca 0.10 -0.27 -0.71 0.00 0.82 0.00 0.00 66.70 66.65 1qe5 h VAL 174 Cb 0.86 -0.10 -0.29 0.00 -1.52 0.00 0.00 31.29 30.24 1qe5 h VAL 174 CO 0.54 0.14 -0.53 -0.31 0.02 0.00 0.00 177.57 177.42 1qe5 s TYR 175 N -5.84 3.32 -0.21 1.57 2.02 -1.26 -4.24 117.35 112.72 1qe5 s TYR 175 Ca -0.11 -1.52 -0.36 0.00 -0.37 0.00 0.00 57.07 54.71 1qe5 s TYR 175 Cb 0.24 -2.68 -0.12 0.00 -0.40 0.00 0.00 41.96 39.00 1qe5 s TYR 175 CO 0.80 -0.80 1.94 0.45 -1.57 0.00 0.00 175.55 176.37 1qe5 n SER 176 N 4.85 2.86 -0.25 2.29 2.88 -1.02 -4.86 113.62 120.37 1qe5 n SER 176 Ca -0.10 0.82 0.11 0.00 -1.33 0.00 0.00 58.87 58.36 1qe5 n SER 176 Cb 0.44 -1.30 0.37 0.00 -0.75 0.00 0.00 64.21 62.97 1qe5 n SER 176 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1qe5 h PRO 177 N 9.80 0.70 -0.68 -1.46 0.11 -1.92 -0.70 132.00 137.85 1qe5 h PRO 177 Ca -0.42 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.73 1qe5 h PRO 177 Cb 1.29 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 32.18 1qe5 h PRO 177 CO 0.97 0.46 0.33 -0.09 -0.21 0.00 0.00 178.00 179.46 1qe5 h ARG 178 N 0.72 0.55 -0.06 1.05 1.12 -1.98 -0.87 114.38 114.91 1qe5 h ARG 178 Ca 0.42 -0.03 -0.17 0.00 -1.11 0.00 0.00 59.98 59.08 1qe5 h ARG 178 Cb 0.61 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.44 1qe5 h ARG 178 CO -0.18 0.36 -0.71 -0.07 -3.11 0.00 0.00 179.97 176.26 1qe5 h LEU 179 N 0.56 0.37 -1.08 3.80 3.38 -1.50 -2.48 115.31 118.36 1qe5 h LEU 179 Ca 0.33 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1qe5 h LEU 179 Cb 0.34 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1qe5 h LEU 179 CO -0.26 0.96 0.04 0.03 0.09 0.00 0.00 178.44 179.30 1qe5 h ARG 180 N 0.21 0.69 -0.66 1.13 3.08 -0.62 -0.91 114.38 117.31 1qe5 h ARG 180 Ca -0.02 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 59.79 1qe5 h ARG 180 Cb 1.27 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 1qe5 h ARG 180 CO 0.12 0.68 0.07 1.49 -1.07 0.00 0.00 179.97 181.26 1qe5 h GLU 181 N 0.66 1.11 -0.61 0.04 4.22 -1.01 0.58 114.58 119.57 1qe5 h GLU 181 Ca 0.14 -0.32 -0.10 0.00 0.08 0.00 0.00 59.36 59.17 1qe5 h GLU 181 Cb 0.35 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1qe5 h GLU 181 CO 0.01 1.04 0.00 -0.07 -2.18 0.00 0.00 179.01 177.81 1qe5 h LEU 182 N 1.03 1.06 -0.34 1.64 3.38 -0.94 -2.26 115.31 118.87 1qe5 h LEU 182 Ca 0.20 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1qe5 h LEU 182 Cb 0.49 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1qe5 h LEU 182 CO 0.02 1.10 0.16 0.00 0.09 0.00 0.00 178.44 179.81 1qe5 h ALA 183 N 1.00 0.41 0.00 1.53 0.00 -0.79 0.73 119.26 122.14 1qe5 h ALA 183 Ca 0.17 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1qe5 h ALA 183 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1qe5 h ALA 183 CO 0.03 -0.22 0.00 0.72 0.00 0.00 0.00 179.25 179.78 1qe5 n HIS 184 N -4.96 0.72 0.09 0.00 8.25 0.16 -1.20 115.22 118.28 1qe5 n HIS 184 Ca 0.00 0.35 -0.13 0.00 -0.26 0.00 0.00 57.72 57.69 1qe5 n HIS 184 Cb 0.09 -1.07 -0.08 0.00 1.12 0.00 0.00 29.99 30.06 1qe5 n HIS 184 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1qe5 h ARG 185 N 0.00 0.28 0.02 -0.41 3.08 -0.28 -1.77 114.38 115.30 1qe5 h ARG 185 Ca 0.00 -0.38 -0.21 0.00 0.07 0.00 0.00 59.98 59.46 1qe5 h ARG 185 Cb 0.08 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1qe5 h ARG 185 CO 0.00 1.12 -0.92 0.28 -1.07 0.00 0.00 179.97 179.37 1qe5 h VAL 186 N 0.13 1.51 -1.72 2.04 2.07 -0.88 -3.41 116.25 115.98 1qe5 h VAL 186 Ca -0.09 -2.73 -0.28 0.00 0.82 0.00 0.00 66.70 64.42 1qe5 h VAL 186 Cb 1.74 2.54 -0.28 0.00 -1.52 0.00 0.00 31.29 33.77 1qe5 h VAL 186 CO 0.17 0.79 -0.62 -0.62 0.02 0.00 0.00 177.57 177.32 1qe5 s ASP 187 N -6.93 0.51 0.38 0.57 -1.08 -0.78 -5.01 116.67 104.32 1qe5 s ASP 187 Ca -0.03 -1.24 0.23 0.00 -0.52 0.00 0.00 52.55 50.99 1qe5 s ASP 187 Cb 0.10 0.93 1.24 0.00 -1.46 0.00 0.00 42.92 43.73 1qe5 s ASP 187 CO 0.83 -0.26 1.68 1.55 0.52 0.00 0.00 175.17 179.50 1qe5 h PRO 188 N 7.21 0.00 0.00 4.34 0.13 -1.57 -2.76 132.00 139.35 1qe5 h PRO 188 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1qe5 h PRO 188 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1qe5 h PRO 188 CO 0.19 0.00 -0.21 0.25 -0.23 0.00 0.00 178.00 178.00 1qe5 n THR 189 N -2.34 0.15 -1.66 1.56 -2.24 -1.26 -4.92 114.28 103.57 1qe5 n THR 189 Ca -0.02 -0.08 -0.48 0.00 -2.27 0.00 0.00 64.05 61.20 1qe5 n THR 189 Cb 0.11 -0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.03 1qe5 n THR 189 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1qe5 n LEU 190 N -1.71 2.83 -4.88 3.22 4.77 -1.04 -4.98 117.00 115.22 1qe5 n LEU 190 Ca 0.06 1.07 -0.29 0.00 -0.03 0.00 0.00 56.01 56.82 1qe5 n LEU 190 Cb 0.37 -1.36 0.15 0.00 -2.33 0.00 0.00 43.42 40.25 1qe5 n LEU 190 CO 0.31 -0.41 0.81 -2.16 -1.33 0.00 0.00 177.39 174.61 1qe5 s PRO 191 N 1.46 1.08 0.02 3.23 0.04 -1.26 -4.87 135.00 134.70 1qe5 s PRO 191 Ca 0.83 -0.10 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1qe5 s PRO 191 Cb -0.75 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 1qe5 s PRO 191 CO 0.43 -2.17 -0.09 -1.21 0.04 0.00 0.00 177.00 174.00 1qe5 s GLU 192 N -5.66 0.67 0.17 4.56 2.02 -1.26 -0.93 118.70 118.27 1qe5 s GLU 192 Ca 0.68 -0.55 -0.17 0.00 0.02 0.00 0.00 54.97 54.95 1qe5 s GLU 192 Cb -0.08 -0.60 0.03 0.00 0.10 0.00 0.00 34.13 33.58 1qe5 s GLU 192 CO 0.52 0.15 0.47 0.20 0.02 0.00 0.00 175.26 176.62 1qe5 s GLY 193 N -0.85 -0.15 -0.24 -1.39 0.00 -0.06 -4.91 107.32 99.72 1qe5 s GLY 193 Ca -0.01 -0.16 -0.18 0.00 0.00 0.00 0.00 44.72 44.37 1qe5 s GLY 193 CO 0.00 -0.28 0.54 0.14 0.00 0.00 0.00 173.10 173.50 1qe5 s VAL 194 N -3.85 5.07 -0.17 1.40 1.01 -1.26 -0.57 120.40 122.04 1qe5 s VAL 194 Ca 0.07 0.95 -0.09 0.00 0.00 0.00 0.00 61.98 62.91 1qe5 s VAL 194 Cb 0.00 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 1qe5 s VAL 194 CO -0.06 0.11 0.15 -0.47 0.00 0.00 0.00 175.10 174.83 1qe5 s TYR 195 N 2.07 3.48 -0.13 5.22 6.14 -0.79 -0.26 117.35 133.08 1qe5 s TYR 195 Ca 0.23 0.42 -0.04 0.00 0.64 0.00 0.00 57.07 58.32 1qe5 s TYR 195 Cb -0.16 -2.10 -0.03 0.00 0.42 0.00 0.00 41.96 40.09 1qe5 s TYR 195 CO 0.09 0.44 -0.00 0.00 0.64 0.00 0.00 175.55 176.72 1qe5 s ALA 196 N -0.11 3.20 -0.21 3.97 0.00 -0.59 -0.47 121.76 127.55 1qe5 s ALA 196 Ca 0.11 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.24 1qe5 s ALA 196 Cb -0.12 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.40 1qe5 s ALA 196 CO 0.00 0.37 -0.05 -1.14 0.00 0.00 0.00 175.76 174.94 1qe5 s GLN 197 N -0.16 3.37 0.18 0.00 0.74 -0.47 -1.61 119.66 121.71 1qe5 s GLN 197 Ca 0.05 -0.63 0.04 0.00 0.05 0.00 0.00 55.36 54.87 1qe5 s GLN 197 Cb -0.13 -2.97 -0.04 0.00 1.10 0.00 0.00 33.01 30.98 1qe5 s GLN 197 CO 0.02 -0.16 0.21 -0.06 -0.55 0.00 0.00 175.29 174.75 1qe5 s PHE 198 N 1.38 3.28 0.52 1.67 0.40 -0.29 -1.07 117.98 123.87 1qe5 s PHE 198 Ca 0.05 0.01 0.22 0.00 -0.60 0.00 0.00 56.93 56.61 1qe5 s PHE 198 Cb -0.14 -1.55 1.45 0.00 0.51 0.00 0.00 43.02 43.28 1qe5 s PHE 198 CO -0.03 0.51 2.16 -1.00 0.70 0.00 0.00 175.22 177.56 1qe5 h PRO 199 N 2.11 0.00 0.00 0.24 0.13 -1.87 -3.39 132.00 129.22 1qe5 h PRO 199 Ca -0.48 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.69 1qe5 h PRO 199 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1qe5 h PRO 199 CO 0.64 0.04 -0.05 0.41 -0.23 0.00 0.00 178.00 178.81 1qe5 n GLY 200 N -1.29 -1.70 0.16 1.56 0.00 -1.26 -4.10 105.19 98.55 1qe5 n GLY 200 Ca -0.03 -1.27 0.13 0.00 0.00 0.00 0.00 46.02 44.86 1qe5 n GLY 200 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qe5 h PRO 201 N 0.00 0.00 -7.27 1.61 0.13 -1.94 -3.45 132.00 121.08 1qe5 h PRO 201 Ca 0.00 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.65 1qe5 h PRO 201 Cb 0.14 0.00 0.18 0.00 0.13 0.00 0.00 31.00 31.44 1qe5 h PRO 201 CO 0.00 0.00 0.18 -3.38 -0.23 0.00 0.00 178.00 174.58 1qe5 s HIS 202 N -3.19 1.88 0.62 1.56 -3.43 -1.26 -5.04 115.29 106.42 1qe5 s HIS 202 Ca 0.08 1.41 0.01 0.00 -0.80 0.00 0.00 55.06 55.76 1qe5 s HIS 202 Cb 0.09 -3.19 0.07 0.00 -1.43 0.00 0.00 32.58 28.13 1qe5 s HIS 202 CO 0.60 -2.87 0.86 0.71 -2.00 0.00 0.00 174.74 172.04 1qe5 s TYR 203 N -2.73 2.34 0.28 0.38 1.51 -1.26 -5.03 117.35 112.85 1qe5 s TYR 203 Ca 0.66 -0.13 -0.24 0.00 -1.01 0.00 0.00 57.07 56.35 1qe5 s TYR 203 Cb -0.21 -2.82 -0.09 0.00 -0.11 0.00 0.00 41.96 38.72 1qe5 s TYR 203 CO 0.59 -1.20 0.87 -1.21 -1.11 0.00 0.00 175.55 173.50 1qe5 s GLU 204 N -4.90 4.49 0.71 -0.62 8.01 -1.26 -5.07 118.70 120.05 1qe5 s GLU 204 Ca 0.61 1.18 -0.11 0.00 0.01 0.00 0.00 54.97 56.66 1qe5 s GLU 204 Cb -0.08 -2.86 0.02 0.00 -4.31 0.00 0.00 34.13 26.89 1qe5 s GLU 204 CO 0.41 0.34 1.08 0.95 0.01 0.00 0.00 175.26 178.05 1qe5 s THR 205 N -1.55 3.63 0.44 3.63 -4.23 -1.26 -4.58 115.64 111.72 1qe5 s THR 205 Ca 0.47 0.53 0.18 0.00 -1.18 0.00 0.00 61.69 61.69 1qe5 s THR 205 Cb -0.18 -3.46 0.38 0.00 1.34 0.00 0.00 72.50 70.58 1qe5 s THR 205 CO 0.23 -0.69 1.91 -0.65 -0.54 0.00 0.00 174.62 174.88 1qe5 h PRO 206 N -0.69 0.33 -0.22 3.99 0.11 -1.98 -0.22 132.00 133.32 1qe5 h PRO 206 Ca -0.45 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 1qe5 h PRO 206 Cb 1.24 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1qe5 h PRO 206 CO 0.62 0.22 -0.42 0.00 -0.21 0.00 0.00 178.00 178.21 1qe5 h ALA 207 N 1.64 0.86 -0.06 -0.75 0.00 -1.91 -1.69 119.26 117.35 1qe5 h ALA 207 Ca 0.39 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1qe5 h ALA 207 Cb 1.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1qe5 h ALA 207 CO -0.12 0.64 -0.45 0.93 0.00 0.00 0.00 179.25 180.25 1qe5 h GLU 208 N 0.44 0.13 -0.28 0.00 5.08 -1.42 -1.11 114.58 117.41 1qe5 h GLU 208 Ca 0.04 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1qe5 h GLU 208 Cb 0.91 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 1qe5 h GLU 208 CO 0.08 0.56 -0.27 0.28 -1.00 0.00 0.00 179.01 178.66 1qe5 h VAL 209 N 0.11 1.30 -0.67 3.13 2.07 -1.10 0.47 116.25 121.57 1qe5 h VAL 209 Ca 0.01 -1.43 -0.05 0.00 0.82 0.00 0.00 66.70 66.04 1qe5 h VAL 209 Cb 0.85 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 1qe5 h VAL 209 CO 0.07 0.46 0.21 0.03 0.02 0.00 0.00 177.57 178.35 1qe5 h ARG 210 N 0.41 1.03 -0.31 1.57 3.08 -1.02 -2.01 114.38 117.14 1qe5 h ARG 210 Ca 0.05 -0.22 0.03 0.00 0.07 0.00 0.00 59.98 59.90 1qe5 h ARG 210 Cb 0.83 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 1qe5 h ARG 210 CO 0.07 0.90 0.12 1.98 -1.07 0.00 0.00 179.97 181.97 1qe5 h MET 211 N 0.97 0.26 -0.82 0.04 4.05 -0.94 -1.16 114.93 117.33 1qe5 h MET 211 Ca 0.22 -0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.72 1qe5 h MET 211 Cb 0.29 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.97 1qe5 h MET 211 CO -0.01 0.17 0.54 0.00 0.23 0.00 0.00 176.91 177.84 1qe5 h ALA 212 N 1.19 1.74 -0.26 0.39 0.00 -0.46 -1.04 119.26 120.82 1qe5 h ALA 212 Ca 0.14 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1qe5 h ALA 212 Cb 0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1qe5 h ALA 212 CO -0.13 0.09 -0.19 0.78 0.00 0.00 0.00 179.25 179.81 1qe5 h GLY 213 N 0.76 0.63 1.31 0.00 0.00 -0.57 -1.09 103.07 104.12 1qe5 h GLY 213 Ca 0.38 -0.61 0.04 0.00 0.00 0.00 0.00 47.33 47.14 1qe5 h GLY 213 CO -0.15 0.55 0.37 -2.22 0.00 0.00 0.00 176.54 175.09 1qe5 h ILE 214 N 0.30 1.04 0.00 2.60 2.04 -0.09 0.57 117.51 123.98 1qe5 h ILE 214 Ca 0.05 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1qe5 h ILE 214 Cb 0.72 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1qe5 h ILE 214 CO 0.05 0.11 0.00 0.18 0.00 0.00 0.00 178.15 178.49 1qe5 n LEU 215 N -4.47 0.02 0.00 1.44 4.77 -0.53 -4.91 117.00 113.32 1qe5 n LEU 215 Ca 0.07 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1qe5 n LEU 215 Cb 0.17 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1qe5 n LEU 215 CO 0.35 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1qe5 n GLY 216 N 0.95 0.99 3.86 -0.72 0.00 0.19 -5.09 105.19 105.38 1qe5 n GLY 216 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1qe5 n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe5 s ALA 217 N -2.00 3.23 -0.11 4.61 0.00 -0.44 -4.75 121.76 122.29 1qe5 s ALA 217 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 51.96 51.96 1qe5 s ALA 217 Cb 0.00 -2.88 -0.07 0.00 0.00 0.00 0.00 23.12 20.16 1qe5 s ALA 217 CO 0.00 -0.14 0.17 -0.25 0.00 0.00 0.00 175.76 175.54 1qe5 n ASP 218 N -1.50 2.25 -3.97 0.00 8.00 0.64 -4.39 116.55 117.58 1qe5 n ASP 218 Ca 0.04 -0.27 -0.09 0.00 0.71 0.00 0.00 54.79 55.18 1qe5 n ASP 218 Cb 0.54 1.14 -0.11 0.00 -0.02 0.00 0.00 41.12 42.68 1qe5 n ASP 218 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qe5 s LEU 219 N -2.90 2.13 -0.02 0.64 1.43 -1.01 -1.53 118.68 117.43 1qe5 s LEU 219 Ca -0.00 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1qe5 s LEU 219 Cb 0.04 0.22 0.01 0.00 0.03 0.00 0.00 46.19 46.48 1qe5 s LEU 219 CO 0.22 -0.34 -0.04 0.68 0.23 0.00 0.00 176.35 177.10 1qe5 s VAL 220 N -1.68 0.41 0.00 -1.59 -7.23 0.00 -1.54 120.40 108.76 1qe5 s VAL 220 Ca -0.14 -0.16 0.00 0.00 -1.81 0.00 0.00 61.98 59.87 1qe5 s VAL 220 Cb -0.08 -0.39 0.00 0.00 0.56 0.00 0.00 36.38 36.48 1qe5 s VAL 220 CO -0.01 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.53 1qe5 n GLY 221 N 3.33 2.87 0.84 2.32 0.00 -0.63 -0.97 105.19 112.94 1qe5 n GLY 221 Ca -0.17 -0.86 0.03 0.00 0.00 0.00 0.00 46.02 45.02 1qe5 n GLY 221 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1qe5 n MET 222 N 0.00 0.30 0.00 1.61 0.00 -1.26 -1.14 117.12 116.63 1qe5 n MET 222 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 57.70 55.93 1qe5 n MET 222 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 33.22 32.69 1qe5 n MET 222 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1qe5 n SER 223 N -0.08 0.00 0.00 3.17 3.41 -1.26 -4.66 113.62 114.20 1qe5 n SER 223 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1qe5 n SER 223 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1qe5 n SER 223 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1qe5 n THR 224 N 0.00 0.00 -0.08 6.66 -1.04 -1.26 -4.70 114.28 113.86 1qe5 n THR 224 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 1qe5 n THR 224 Cb 0.00 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.56 1qe5 n THR 224 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1qe5 h THR 225 N 0.00 1.28 -0.82 12.58 1.35 -1.96 -0.25 112.91 125.09 1qe5 h THR 225 Ca 0.00 -1.48 -0.01 0.00 -0.55 0.00 0.00 66.41 64.36 1qe5 h THR 225 Cb 0.00 1.35 -0.04 0.00 -1.73 0.00 0.00 68.15 67.74 1qe5 h THR 225 CO 0.00 0.49 0.46 -0.07 -0.25 0.00 0.00 175.52 176.15 1qe5 h LEU 226 N 0.67 1.02 -0.70 3.87 3.38 -1.96 -1.42 115.31 120.17 1qe5 h LEU 226 Ca 0.07 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1qe5 h LEU 226 Cb 0.87 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1qe5 h LEU 226 CO 0.08 0.82 0.08 -0.33 0.09 0.00 0.00 178.44 179.18 1qe5 h GLU 227 N 1.14 1.08 -0.20 1.13 3.07 -1.84 -1.86 114.58 117.11 1qe5 h GLU 227 Ca 0.29 -0.30 -0.13 0.00 -0.50 0.00 0.00 59.36 58.73 1qe5 h GLU 227 Cb 0.02 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1qe5 h GLU 227 CO -0.05 1.00 -0.41 0.00 -1.40 0.00 0.00 179.01 178.16 1qe5 h ALA 228 N 1.07 0.92 -0.15 3.43 0.00 -0.71 -1.71 119.26 122.11 1qe5 h ALA 228 Ca 0.20 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 1qe5 h ALA 228 Cb 0.46 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1qe5 h ALA 228 CO 0.02 0.63 -0.56 0.82 0.00 0.00 0.00 179.25 180.16 1qe5 h ILE 229 N 0.38 1.34 0.00 0.00 2.04 -1.08 -2.49 117.51 117.70 1qe5 h ILE 229 Ca 0.03 -1.83 -0.14 0.00 1.00 0.00 0.00 64.86 63.92 1qe5 h ILE 229 Cb 0.88 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1qe5 h ILE 229 CO 0.07 0.56 -0.67 0.00 0.00 0.00 0.00 178.15 178.12 1qe5 h ALA 230 N 1.03 0.81 -0.39 1.87 0.00 -1.18 -2.69 119.26 118.71 1qe5 h ALA 230 Ca 0.00 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 1qe5 h ALA 230 Cb 1.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1qe5 h ALA 230 CO 0.10 0.84 0.03 0.00 0.00 0.00 0.00 179.25 180.22 1qe5 h ALA 231 N 1.33 0.52 -0.20 0.00 0.00 -1.10 -2.24 119.26 117.56 1qe5 h ALA 231 Ca -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1qe5 h ALA 231 Cb 1.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1qe5 h ALA 231 CO 0.09 0.26 0.09 0.00 0.00 0.00 0.00 179.25 179.69 1qe5 h ARG 232 N 0.50 0.29 -0.73 0.00 2.47 -1.40 0.10 114.38 115.61 1qe5 h ARG 232 Ca 0.11 -0.05 0.18 0.00 -1.26 0.00 0.00 59.98 58.97 1qe5 h ARG 232 Cb 0.42 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.65 1qe5 h ARG 232 CO 0.01 0.33 0.51 1.25 0.56 0.00 0.00 179.97 182.63 1qe5 h HIS 233 N 0.19 0.23 -0.09 3.04 2.76 -1.33 1.31 115.15 121.26 1qe5 h HIS 233 Ca 0.07 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1qe5 h HIS 233 Cb 0.13 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.02 1qe5 h HIS 233 CO -0.02 0.08 0.00 0.00 -1.30 0.00 0.00 177.93 176.69 1qe5 n GLY 235 N 1.11 0.43 3.87 0.00 0.00 0.45 -5.04 105.19 106.00 1qe5 n GLY 235 Ca 0.17 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 1qe5 n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qe5 s LEU 236 N -1.15 3.77 -0.21 0.99 1.02 -0.13 -4.99 118.68 117.98 1qe5 s LEU 236 Ca 0.00 1.24 -0.11 0.00 0.02 0.00 0.00 54.13 55.27 1qe5 s LEU 236 Cb 0.00 -4.13 -0.05 0.00 0.02 0.00 0.00 46.19 42.03 1qe5 s LEU 236 CO 0.00 -0.45 0.20 -0.70 0.02 0.00 0.00 176.35 175.42 1qe5 s GLU 237 N -3.93 4.14 -0.12 1.70 2.12 0.16 -4.50 118.70 118.26 1qe5 s GLU 237 Ca 0.53 -0.15 -0.01 0.00 0.36 0.00 0.00 54.97 55.69 1qe5 s GLU 237 Cb -0.10 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.77 1qe5 s GLU 237 CO 0.32 0.14 -0.08 0.08 -0.54 0.00 0.00 175.26 175.18 1qe5 s VAL 238 N 0.82 3.57 -0.19 3.70 1.01 -1.26 -0.83 120.40 127.22 1qe5 s VAL 238 Ca 0.10 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 1qe5 s VAL 238 Cb -0.13 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1qe5 s VAL 238 CO 0.03 0.53 -0.09 -0.22 0.00 0.00 0.00 175.10 175.35 1qe5 s LEU 239 N 0.06 2.75 -0.18 3.92 2.96 0.01 -2.43 118.68 125.77 1qe5 s LEU 239 Ca -0.02 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.44 1qe5 s LEU 239 Cb -0.14 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.86 1qe5 s LEU 239 CO 0.03 0.03 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.22 1qe5 s GLY 240 N 1.17 1.67 -0.19 7.98 0.00 -1.26 -0.67 107.32 116.02 1qe5 s GLY 240 Ca 0.02 -0.97 0.00 0.00 0.00 0.00 0.00 44.72 43.77 1qe5 s GLY 240 CO -0.03 0.13 -0.07 0.14 0.00 0.00 0.00 173.10 173.28 1qe5 s VAL 241 N 0.84 1.35 -0.01 1.40 1.01 0.38 -0.95 120.40 124.43 1qe5 s VAL 241 Ca -0.01 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 1qe5 s VAL 241 Cb -0.15 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.68 1qe5 s VAL 241 CO 0.02 0.11 0.30 -0.44 0.00 0.00 0.00 175.10 175.09 1qe5 s SER 242 N 1.52 6.58 -0.29 3.32 0.01 0.12 -2.15 113.70 122.81 1qe5 s SER 242 Ca -0.01 0.69 -0.05 0.00 1.31 0.00 0.00 55.95 57.88 1qe5 s SER 242 Cb -0.16 -2.14 0.02 0.00 0.21 0.00 0.00 66.02 63.95 1qe5 s SER 242 CO -0.08 0.29 0.05 -0.22 0.41 0.00 0.00 173.24 173.69 1qe5 s LEU 243 N -1.45 3.80 -0.31 2.44 0.20 0.15 0.11 118.68 123.62 1qe5 s LEU 243 Ca 0.25 -0.85 -0.28 0.00 0.69 0.00 0.00 54.13 53.94 1qe5 s LEU 243 Cb -0.14 -1.82 -0.02 0.00 -0.43 0.00 0.00 46.19 43.77 1qe5 s LEU 243 CO 0.13 -0.21 1.81 -0.69 -0.29 0.00 0.00 176.35 177.10 1qe5 s VAL 244 N 1.43 3.46 0.09 1.68 1.01 -0.34 -0.92 120.40 126.82 1qe5 s VAL 244 Ca 0.01 0.48 -0.16 0.00 0.00 0.00 0.00 61.98 62.31 1qe5 s VAL 244 Cb -0.18 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 1qe5 s VAL 244 CO 0.01 -0.37 1.43 0.74 0.00 0.00 0.00 175.10 176.91 1qe5 h THR 245 N 6.77 1.30 -1.79 3.92 2.02 -0.40 0.21 112.91 124.93 1qe5 h THR 245 Ca -0.34 -1.37 0.38 0.00 0.77 0.00 0.00 66.41 65.84 1qe5 h THR 245 Cb 1.17 1.56 -0.09 0.00 -1.74 0.00 0.00 68.15 69.05 1qe5 h THR 245 CO 1.02 0.44 0.96 0.54 0.37 0.00 0.00 175.52 178.85 1qe5 s ASN 246 N -6.44 -0.00 0.38 4.18 4.22 -1.24 -4.39 114.94 111.64 1qe5 s ASN 246 Ca -0.13 -0.08 -0.27 0.00 -2.14 0.00 0.00 52.86 50.24 1qe5 s ASN 246 Cb 0.08 0.07 -0.09 0.00 1.28 0.00 0.00 41.25 42.59 1qe5 s ASN 246 CO 0.81 -0.13 1.28 -0.76 -2.04 0.00 0.00 177.10 176.26 1qe5 s LEU 247 N -3.63 4.28 0.86 3.54 1.43 -1.26 -1.03 118.68 122.87 1qe5 s LEU 247 Ca 0.26 2.61 -0.12 0.00 -1.03 0.00 0.00 54.13 55.85 1qe5 s LEU 247 Cb 0.02 -3.85 0.11 0.00 0.03 0.00 0.00 46.19 42.50 1qe5 s LEU 247 CO -0.03 -0.72 1.11 0.00 0.23 0.00 0.00 176.35 176.94 1qe5 s ALA 248 N -1.25 1.91 -0.00 4.21 0.00 -0.09 -4.73 121.76 121.82 1qe5 s ALA 248 Ca 0.54 -0.31 -0.37 0.00 0.00 0.00 0.00 51.96 51.83 1qe5 s ALA 248 Cb -0.37 -3.09 -0.16 0.00 0.00 0.00 0.00 23.12 19.50 1qe5 s ALA 248 CO 0.48 -2.07 1.50 0.00 0.00 0.00 0.00 175.76 175.68 1qe5 n ALA 249 N -3.65 -0.35 -0.96 0.00 0.00 -1.26 -1.72 120.51 112.56 1qe5 n ALA 249 Ca 0.07 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1qe5 n ALA 249 Cb 0.57 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1qe5 n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qe5 n GLY 250 N 3.16 0.80 0.12 0.00 0.00 -1.26 -4.44 105.19 103.57 1qe5 n GLY 250 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 1qe5 n GLY 250 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1qe5 h ILE 251 N 0.00 0.97 -3.31 -0.61 1.08 -1.68 -3.45 117.51 110.52 1qe5 h ILE 251 Ca 0.00 -2.65 -0.67 0.00 -0.39 0.00 0.00 64.86 61.15 1qe5 h ILE 251 Cb 0.00 2.67 -0.14 0.00 -3.07 0.00 0.00 36.82 36.28 1qe5 h ILE 251 CO 0.00 0.80 -0.62 -0.55 -0.69 0.00 0.00 178.15 177.09 1qe5 s SER 252 N -6.94 5.26 0.28 1.72 0.15 -1.26 -4.96 113.70 107.94 1qe5 s SER 252 Ca -0.12 0.10 0.15 0.00 0.70 0.00 0.00 55.95 56.78 1qe5 s SER 252 Cb 0.07 -1.45 0.15 0.00 -1.71 0.00 0.00 66.02 63.07 1qe5 s SER 252 CO 0.83 0.34 1.48 -0.65 1.20 0.00 0.00 173.24 176.44 1qe5 h PRO 253 N 4.81 0.00 -2.41 5.44 0.11 -1.99 -3.36 132.00 134.59 1qe5 h PRO 253 Ca -0.50 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 64.92 1qe5 h PRO 253 Cb 1.19 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.94 1qe5 h PRO 253 CO 0.56 0.53 0.00 2.41 -0.21 0.00 0.00 178.00 181.29 1qe5 n THR 254 N -3.29 3.85 -1.75 -1.15 -1.04 -1.26 -5.08 114.28 104.55 1qe5 n THR 254 Ca 0.01 -5.60 -0.42 0.00 -2.04 0.00 0.00 64.05 56.00 1qe5 n THR 254 Cb 0.72 -1.88 -0.01 0.00 -1.82 0.00 0.00 70.33 67.34 1qe5 n THR 254 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1qe5 n PRO 255 N 0.63 2.59 -2.40 -2.82 -0.02 -1.26 -4.98 135.00 126.74 1qe5 n PRO 255 Ca 0.31 0.92 -0.34 0.00 -2.02 0.00 0.00 63.50 62.37 1qe5 n PRO 255 Cb 0.36 -2.65 -0.02 0.00 -0.02 0.00 0.00 33.50 31.18 1qe5 n PRO 255 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1qe5 s LEU 256 N -1.13 3.77 0.60 2.45 1.43 -1.26 -5.04 118.68 119.51 1qe5 s LEU 256 Ca 0.59 1.96 -0.10 0.00 -1.03 0.00 0.00 54.13 55.56 1qe5 s LEU 256 Cb -0.50 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.12 1qe5 s LEU 256 CO 0.56 -0.94 0.99 -0.94 0.23 0.00 0.00 176.35 176.25 1qe5 s SER 257 N -2.07 6.12 0.27 2.29 1.04 -1.26 -4.83 113.70 115.26 1qe5 s SER 257 Ca 0.68 1.28 -0.00 0.00 0.48 0.00 0.00 55.95 58.38 1qe5 s SER 257 Cb -0.18 -2.34 0.54 0.00 0.10 0.00 0.00 66.02 64.14 1qe5 s SER 257 CO 0.24 -0.88 1.78 -0.74 0.98 0.00 0.00 173.24 174.62 1qe5 h HIS 258 N -0.26 0.88 -0.64 5.02 2.76 -1.99 0.98 115.15 121.90 1qe5 h HIS 258 Ca -0.45 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 57.75 1qe5 h HIS 258 Cb 1.20 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.87 1qe5 h HIS 258 CO 0.62 0.26 0.38 0.00 -1.30 0.00 0.00 177.93 177.89 1qe5 h ALA 259 N 1.55 0.82 -0.48 5.26 0.00 -2.00 -1.41 119.26 123.01 1qe5 h ALA 259 Ca 0.47 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1qe5 h ALA 259 Cb 0.61 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1qe5 h ALA 259 CO -0.33 0.31 0.14 0.93 0.00 0.00 0.00 179.25 180.29 1qe5 h GLU 260 N 0.87 0.75 -0.26 0.00 5.08 -1.24 -1.38 114.58 118.41 1qe5 h GLU 260 Ca 0.23 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1qe5 h GLU 260 Cb -0.01 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1qe5 h GLU 260 CO -0.04 0.72 0.03 0.28 -1.00 0.00 0.00 179.01 178.99 1qe5 h VAL 261 N 0.64 0.85 -0.90 3.13 2.07 -0.94 0.18 116.25 121.28 1qe5 h VAL 261 Ca 0.15 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.67 1qe5 h VAL 261 Cb 0.29 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 1qe5 h VAL 261 CO -0.00 0.02 0.59 0.40 0.02 0.00 0.00 177.57 178.60 1qe5 h ILE 262 N 0.11 1.13 -0.23 4.57 2.04 -0.94 -0.04 117.51 124.16 1qe5 h ILE 262 Ca 0.12 -0.38 -0.11 0.00 1.00 0.00 0.00 64.86 65.50 1qe5 h ILE 262 Cb 0.14 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.15 1qe5 h ILE 262 CO -0.18 0.20 -0.27 -0.08 0.00 0.00 0.00 178.15 177.82 1qe5 h GLU 263 N 1.10 0.59 -0.91 2.37 4.81 -0.12 -2.01 114.58 120.41 1qe5 h GLU 263 Ca 0.37 -0.33 0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1qe5 h GLU 263 Cb 0.06 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.40 1qe5 h GLU 263 CO -0.12 0.92 0.59 0.00 -0.73 0.00 0.00 179.01 179.68 1qe5 h ALA 264 N 0.66 1.48 -0.69 2.92 0.00 -0.16 -1.75 119.26 121.71 1qe5 h ALA 264 Ca 0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1qe5 h ALA 264 Cb 0.83 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1qe5 h ALA 264 CO 0.06 0.40 0.27 0.78 0.00 0.00 0.00 179.25 180.77 1qe5 h GLY 265 N 1.07 1.11 1.05 0.00 0.00 -0.68 -2.90 103.07 102.72 1qe5 h GLY 265 Ca 0.38 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 1qe5 h GLY 265 CO -0.13 0.57 0.25 1.46 0.00 0.00 0.00 176.54 178.68 1qe5 h GLN 266 N 0.98 1.14 0.00 4.80 4.20 -0.60 -3.04 115.11 122.59 1qe5 h GLN 266 Ca 0.23 -0.24 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1qe5 h GLN 266 Cb 0.22 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1qe5 h GLN 266 CO -0.02 0.96 -0.31 0.00 -0.67 0.00 0.00 178.83 178.80 1qe5 h ALA 267 N 1.12 1.33 0.00 3.87 0.00 -1.32 -2.62 119.26 121.64 1qe5 h ALA 267 Ca 0.24 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1qe5 h ALA 267 Cb 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1qe5 h ALA 267 CO -0.01 0.39 -0.20 0.00 0.00 0.00 0.00 179.25 179.42 1qe5 h ALA 268 N 1.69 0.92 -0.72 0.00 0.00 -1.39 -3.36 119.26 116.40 1qe5 h ALA 268 Ca -0.00 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1qe5 h ALA 268 Cb 0.61 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 1qe5 h ALA 268 CO 0.04 0.25 -0.39 0.41 0.00 0.00 0.00 179.25 179.56 1qe5 n GLY 269 N 0.66 -1.77 0.10 0.00 0.00 -0.99 -1.40 105.19 101.80 1qe5 n GLY 269 Ca 0.02 0.84 -0.13 0.00 0.00 0.00 0.00 46.02 46.75 1qe5 n GLY 269 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qe5 h PRO 270 N 0.00 -0.14 0.16 1.61 0.13 -1.79 -1.53 132.00 130.44 1qe5 h PRO 270 Ca 0.15 0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.30 1qe5 h PRO 270 Cb 0.33 0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.45 1qe5 h PRO 270 CO -0.68 -0.09 -0.35 -0.09 -0.23 0.00 0.00 178.00 176.56 1qe5 h ARG 271 N -0.14 -0.58 -0.77 0.86 2.43 -1.49 -1.93 114.38 112.76 1qe5 h ARG 271 Ca -0.01 0.04 0.17 0.00 -0.81 0.00 0.00 59.98 59.37 1qe5 h ARG 271 Cb 0.12 0.13 -0.11 0.00 -0.42 0.00 0.00 29.97 29.69 1qe5 h ARG 271 CO 0.00 -0.39 0.22 0.82 -1.51 0.00 0.00 179.97 179.11 1qe5 h ILE 272 N -0.60 0.51 0.00 1.20 5.03 -1.19 0.61 117.51 123.07 1qe5 h ILE 272 Ca 0.02 -0.10 -0.04 0.00 -0.12 0.00 0.00 64.86 64.62 1qe5 h ILE 272 Cb 0.61 0.19 -0.01 0.00 -3.03 0.00 0.00 36.82 34.58 1qe5 h ILE 272 CO -0.18 0.05 -0.20 0.77 -0.68 0.00 0.00 178.15 177.91 1qe5 h SER 273 N 0.30 0.00 0.02 1.72 4.64 -1.05 -2.67 113.55 116.51 1qe5 h SER 273 Ca 0.44 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.54 1qe5 h SER 273 Cb 0.76 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1qe5 h SER 273 CO -0.51 0.20 -0.84 0.00 -0.87 0.00 0.00 176.83 174.81 1qe5 h ALA 274 N 1.80 0.35 0.01 5.18 0.00 -0.17 -2.80 119.26 123.62 1qe5 h ALA 274 Ca -0.00 -0.63 0.02 0.00 0.00 0.00 0.00 54.91 54.30 1qe5 h ALA 274 Cb 1.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1qe5 h ALA 274 CO 0.03 0.72 -0.13 1.25 0.00 0.00 0.00 179.25 181.11 1qe5 h LEU 275 N 0.42 -0.37 -0.44 0.00 5.85 -0.72 -1.14 115.31 118.91 1qe5 h LEU 275 Ca -0.06 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1qe5 h LEU 275 Cb 1.46 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.63 1qe5 h LEU 275 CO 0.16 -0.18 0.16 -0.07 -0.34 0.00 0.00 178.44 178.17 1qe5 h LEU 276 N -0.22 0.62 -0.88 2.25 3.38 -1.56 -0.29 115.31 118.60 1qe5 h LEU 276 Ca 0.04 -0.18 0.11 0.00 0.09 0.00 0.00 57.88 57.94 1qe5 h LEU 276 Cb 0.28 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 1qe5 h LEU 276 CO -0.12 0.63 0.52 0.00 0.09 0.00 0.00 178.44 179.56 1qe5 h ALA 277 N 1.01 1.29 -0.23 1.53 0.00 -1.26 0.22 119.26 121.83 1qe5 h ALA 277 Ca 0.14 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 1qe5 h ALA 277 Cb 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1qe5 h ALA 277 CO -0.01 0.13 -0.59 -0.44 0.00 0.00 0.00 179.25 178.34 1qe5 h ASP 278 N 0.85 0.92 -0.63 0.00 3.32 -0.81 -3.10 116.42 116.96 1qe5 h ASP 278 Ca 0.43 -0.57 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 1qe5 h ASP 278 Cb 0.42 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 1qe5 h ASP 278 CO -0.26 1.32 0.35 0.40 -1.72 0.00 0.00 179.24 179.33 1qe5 h ILE 279 N 0.56 1.20 -0.62 0.35 2.04 -0.35 -2.59 117.51 118.09 1qe5 h ILE 279 Ca -0.01 -0.50 0.13 0.00 1.00 0.00 0.00 64.86 65.48 1qe5 h ILE 279 Cb 1.21 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 1qe5 h ILE 279 CO 0.13 0.22 0.43 0.00 0.00 0.00 0.00 178.15 178.92 1qe5 h ALA 280 N 1.17 2.21 0.00 1.87 0.00 -0.51 0.24 119.26 124.24 1qe5 h ALA 280 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1qe5 h ALA 280 Cb 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1qe5 h ALA 280 CO -0.04 -0.38 -0.16 1.63 0.00 0.00 0.00 179.25 180.31 1qe5 n LYS 281 N -4.44 0.23 -0.62 0.00 5.02 -0.99 -5.04 118.16 112.31 1qe5 n LYS 281 Ca 0.11 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 1qe5 n LYS 281 Cb 0.50 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1qe5 n LYS 281 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42