#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qul s ASN 2 N 0.00 5.52 -0.12 7.83 0.01 -1.26 -4.65 114.94 122.27 2qul s ASN 2 Ca 0.00 0.04 -0.29 0.00 -0.71 0.00 0.00 52.86 51.90 2qul s ASN 2 Cb 0.00 -1.95 -0.01 0.00 0.41 0.00 0.00 41.25 39.70 2qul s ASN 2 CO 0.00 0.16 1.04 -0.54 -1.51 0.00 0.00 177.10 176.25 2qul s LYS 3 N 0.47 4.38 -0.20 -0.60 1.02 -1.25 -4.94 119.74 118.63 2qul s LYS 3 Ca 0.03 1.43 -0.07 0.00 0.02 0.00 0.00 55.97 57.37 2qul s LYS 3 Cb -0.13 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 33.58 2qul s LYS 3 CO 0.01 -0.39 0.07 0.08 -0.92 0.00 0.00 175.35 174.20 2qul s VAL 4 N 2.25 4.71 0.45 3.17 1.01 -1.26 -1.63 120.40 129.10 2qul s VAL 4 Ca 0.49 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.44 2qul s VAL 4 Cb -0.19 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 2qul s VAL 4 CO 0.17 0.43 0.11 -0.83 0.00 0.00 0.00 175.10 174.98 2qul s GLY 5 N 0.64 2.81 -0.02 4.51 0.00 0.91 -1.30 107.32 114.87 2qul s GLY 5 Ca 0.03 -0.89 0.05 0.00 0.00 0.00 0.00 44.72 43.92 2qul s GLY 5 CO 0.02 -1.93 -0.19 -0.29 0.00 0.00 0.00 173.10 170.71 2qul s MET 6 N -3.72 1.60 0.19 2.90 -2.45 -0.85 -1.37 119.30 115.60 2qul s MET 6 Ca 0.17 -0.66 -0.30 0.00 -1.25 0.00 0.00 55.69 53.65 2qul s MET 6 Cb 0.01 -1.50 -0.08 0.00 1.25 0.00 0.00 34.83 34.50 2qul s MET 6 CO 0.12 0.37 1.26 0.12 1.05 0.00 0.00 175.02 177.94 2qul s PHE 7 N -0.34 3.33 0.47 4.11 5.36 -0.71 -2.45 117.98 127.74 2qul s PHE 7 Ca 0.05 1.31 0.38 0.00 -0.96 0.00 0.00 56.93 57.70 2qul s PHE 7 Cb -0.08 -3.53 2.05 0.00 -0.34 0.00 0.00 43.02 41.12 2qul s PHE 7 CO -0.00 -1.59 2.15 0.10 -1.46 0.00 0.00 175.22 174.42 2qul h TYR 8 N 5.31 0.00 -0.45 10.12 -0.00 -1.49 -2.68 116.97 127.79 2qul h TYR 8 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 2qul h TYR 8 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.94 2qul h TYR 8 CO 0.62 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 179.03 2qul n THR 9 N -2.86 1.42 -0.31 -0.90 -2.24 -1.26 -4.55 114.28 103.58 2qul n THR 9 Ca -0.03 -0.86 0.14 0.00 -2.27 0.00 0.00 64.05 61.04 2qul n THR 9 Cb 0.10 -0.06 0.32 0.00 -2.10 0.00 0.00 70.33 68.59 2qul n THR 9 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2qul h TYR 10 N 2.89 0.72 0.00 4.78 -0.00 -1.74 -2.29 116.97 121.33 2qul h TYR 10 Ca 0.00 0.04 -0.09 0.00 -0.00 0.00 0.00 58.73 58.68 2qul h TYR 10 Cb 1.19 -0.17 -0.02 0.00 -0.00 0.00 0.00 36.73 37.73 2qul h TYR 10 CO 0.59 -0.03 -1.92 0.91 -0.00 0.00 0.00 178.16 177.72 2qul n TRP 11 N -5.02 0.20 -3.51 -3.82 8.01 -1.26 -4.82 117.44 107.21 2qul n TRP 11 Ca 0.23 0.06 -0.24 0.00 -1.31 0.00 0.00 57.50 56.24 2qul n TRP 11 Cb 0.68 -0.71 -0.02 0.00 -2.01 0.00 0.00 31.31 29.25 2qul n TRP 11 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2qul s SER 12 N -4.93 6.32 0.00 -0.99 0.15 -0.86 -5.01 113.70 108.38 2qul s SER 12 Ca -0.07 0.40 0.05 0.00 0.70 0.00 0.00 55.95 57.03 2qul s SER 12 Cb 0.11 -2.01 0.07 0.00 -1.71 0.00 0.00 66.02 62.49 2qul s SER 12 CO 0.87 -0.22 0.82 0.35 1.20 0.00 0.00 173.24 176.26 2qul n THR 13 N -1.53 0.36 -4.35 6.45 -2.24 -1.26 -4.86 114.28 106.85 2qul n THR 13 Ca -0.05 -0.68 -0.24 0.00 -2.27 0.00 0.00 64.05 60.81 2qul n THR 13 Cb 0.56 0.88 -0.12 0.00 -2.10 0.00 0.00 70.33 69.56 2qul n THR 13 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qul s GLU 14 N -0.62 1.32 0.43 -0.78 0.41 -1.26 -0.93 118.70 117.26 2qul s GLU 14 Ca 0.07 -1.40 0.22 0.00 -0.41 0.00 0.00 54.97 53.45 2qul s GLU 14 Cb 0.05 -1.49 0.90 0.00 -1.78 0.00 0.00 34.13 31.81 2qul s GLU 14 CO 0.06 0.32 1.83 -1.49 -0.49 0.00 0.00 175.26 175.49 2qul h TRP 15 N 3.37 0.00 -3.27 1.61 4.06 -1.95 -3.43 115.95 116.35 2qul h TRP 15 Ca -0.44 0.00 -0.58 0.00 2.06 0.00 0.00 58.89 59.93 2qul h TRP 15 Cb 1.20 0.00 -0.08 0.00 -1.00 0.00 0.00 29.16 29.28 2qul h TRP 15 CO 0.67 0.27 -0.18 1.41 -3.56 0.00 0.00 178.44 177.05 2qul s MET 16 N -3.74 4.25 0.32 0.49 1.75 -1.26 -4.77 119.30 116.34 2qul s MET 16 Ca -0.00 0.38 0.05 0.00 -1.25 0.00 0.00 55.69 54.87 2qul s MET 16 Cb 0.11 -3.39 -0.03 0.00 2.84 0.00 0.00 34.83 34.36 2qul s MET 16 CO 0.65 0.27 0.30 0.14 -0.65 0.00 0.00 175.02 175.73 2qul s VAL 17 N 0.28 0.00 -0.72 10.11 -7.23 -1.26 -5.01 120.40 116.57 2qul s VAL 17 Ca 0.24 -1.93 -0.22 0.00 -1.81 0.00 0.00 61.98 58.26 2qul s VAL 17 Cb -0.15 -2.52 0.08 0.00 0.56 0.00 0.00 36.38 34.35 2qul s VAL 17 CO 0.10 0.00 1.01 -0.62 -0.31 0.00 0.00 175.10 175.27 2qul s ASP 18 N -3.34 6.27 0.17 4.85 3.68 -1.26 -4.92 116.67 122.13 2qul s ASP 18 Ca 0.39 -1.21 -0.14 0.00 2.13 0.00 0.00 52.55 53.72 2qul s ASP 18 Cb 0.02 -2.42 0.08 0.00 -1.45 0.00 0.00 42.92 39.16 2qul s ASP 18 CO 0.25 -1.37 1.81 -0.26 0.13 0.00 0.00 175.17 175.74 2qul h PHE 19 N 9.44 0.56 -0.64 -5.34 -1.00 -1.98 0.22 116.94 118.19 2qul h PHE 19 Ca -0.19 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.59 2qul h PHE 19 Cb 1.06 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 40.41 2qul h PHE 19 CO 1.01 0.32 0.33 -1.35 -1.61 0.00 0.00 178.31 177.01 2qul h PRO 20 N 0.60 0.91 -0.62 1.51 0.11 -1.95 -0.63 132.00 131.93 2qul h PRO 20 Ca 0.20 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 66.14 2qul h PRO 20 Cb 0.01 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 30.92 2qul h PRO 20 CO -0.08 0.72 0.21 0.00 -0.21 0.00 0.00 178.00 178.64 2qul h ALA 21 N 1.15 0.81 -0.65 -0.75 0.00 -1.91 -1.74 119.26 116.17 2qul h ALA 21 Ca 0.22 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2qul h ALA 21 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2qul h ALA 21 CO -0.03 0.46 0.06 1.15 0.00 0.00 0.00 179.25 180.89 2qul h THR 22 N 0.88 1.27 -0.44 0.00 2.02 -0.69 -1.58 112.91 114.37 2qul h THR 22 Ca 0.20 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 2qul h THR 22 Cb 0.26 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2qul h THR 22 CO -0.01 0.41 0.23 0.00 0.37 0.00 0.00 175.52 176.52 2qul h ALA 23 N 1.03 0.57 -0.93 6.16 0.00 -0.89 -1.30 119.26 123.90 2qul h ALA 23 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2qul h ALA 23 Cb 0.50 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2qul h ALA 23 CO 0.02 0.11 0.55 0.87 0.00 0.00 0.00 179.25 180.79 2qul h LYS 24 N 0.58 1.28 -0.28 0.00 1.57 -1.07 -0.57 116.57 118.07 2qul h LYS 24 Ca 0.16 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 2qul h LYS 24 Cb 0.08 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 2qul h LYS 24 CO -0.02 0.91 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.53 2qul h ARG 25 N 1.29 0.59 -0.46 3.15 2.43 -0.94 -1.28 114.38 119.15 2qul h ARG 25 Ca 0.33 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 2qul h ARG 25 Cb -0.03 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2qul h ARG 25 CO -0.06 0.83 0.05 0.82 -1.51 0.00 0.00 179.97 180.10 2qul h ILE 26 N 0.33 1.25 -0.52 1.20 2.04 -1.08 -2.76 117.51 117.98 2qul h ILE 26 Ca 0.06 -0.97 -0.06 0.00 1.00 0.00 0.00 64.86 64.90 2qul h ILE 26 Cb 0.66 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2qul h ILE 26 CO 0.04 0.34 0.08 0.00 0.00 0.00 0.00 178.15 178.61 2qul h ALA 27 N 0.94 1.17 0.00 1.87 0.00 -1.09 -2.42 119.26 119.73 2qul h ALA 27 Ca 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2qul h ALA 27 Cb 0.43 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qul h ALA 27 CO 0.01 0.55 -0.09 0.78 0.00 0.00 0.00 179.25 180.51 2qul h GLY 28 N 0.97 0.00 1.53 0.00 0.00 -0.96 -1.70 103.07 102.92 2qul h GLY 28 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2qul h GLY 28 CO 0.01 0.00 -0.16 1.04 0.00 0.00 0.00 176.54 177.43 2qul n LEU 29 N -3.62 0.21 0.00 3.11 4.77 -0.92 -4.93 117.00 115.63 2qul n LEU 29 Ca -0.02 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2qul n LEU 29 Cb 0.20 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2qul n LEU 29 CO 0.29 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2qul n GLY 30 N 1.46 0.67 3.77 -0.72 0.00 -0.64 -4.80 105.19 104.93 2qul n GLY 30 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2qul n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qul s PHE 31 N -2.00 2.92 -0.28 1.61 0.08 -1.18 -4.94 117.98 114.19 2qul s PHE 31 Ca 0.00 1.54 0.23 0.00 0.12 0.00 0.00 56.93 58.81 2qul s PHE 31 Cb 0.00 -3.39 0.07 0.00 -0.57 0.00 0.00 43.02 39.12 2qul s PHE 31 CO 0.00 -1.48 1.15 -0.44 -0.10 0.00 0.00 175.22 174.35 2qul h ASP 32 N 2.21 0.00 -5.09 1.36 3.32 -1.54 -3.42 116.42 113.26 2qul h ASP 32 Ca -0.49 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.42 2qul h ASP 32 Cb 1.24 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.62 2qul h ASP 32 CO 0.61 0.00 -0.58 -0.22 -1.72 0.00 0.00 179.24 177.33 2qul s LEU 33 N -5.50 1.98 -0.05 1.55 2.96 -1.03 -1.61 118.68 116.98 2qul s LEU 33 Ca 0.01 -0.59 0.02 0.00 -0.22 0.00 0.00 54.13 53.34 2qul s LEU 33 Cb 0.09 0.46 0.02 0.00 0.50 0.00 0.00 46.19 47.25 2qul s LEU 33 CO 0.77 -0.49 -0.07 -0.32 -1.32 0.00 0.00 176.35 174.92 2qul s MET 34 N -2.60 1.07 -0.23 1.98 -2.45 -0.39 -2.00 119.30 114.68 2qul s MET 34 Ca -0.05 -0.22 -0.06 0.00 -1.25 0.00 0.00 55.69 54.10 2qul s MET 34 Cb -0.01 -0.98 -0.03 0.00 1.25 0.00 0.00 34.83 35.06 2qul s MET 34 CO -0.05 -0.02 0.04 -2.00 1.05 0.00 0.00 175.02 174.05 2qul s GLU 35 N 0.70 3.64 0.11 4.11 2.12 -1.02 -1.31 118.70 127.06 2qul s GLU 35 Ca -0.11 -0.49 0.09 0.00 0.36 0.00 0.00 54.97 54.82 2qul s GLU 35 Cb -0.14 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 2qul s GLU 35 CO 0.01 -0.11 -0.18 0.96 -0.54 0.00 0.00 175.26 175.40 2qul s ILE 36 N 1.36 2.81 0.30 -3.70 -0.00 -0.63 -1.12 121.20 120.22 2qul s ILE 36 Ca 0.05 -1.49 -0.21 0.00 -0.00 0.00 0.00 60.65 59.00 2qul s ILE 36 Cb -0.15 -2.28 -0.09 0.00 -0.00 0.00 0.00 42.46 39.94 2qul s ILE 36 CO 0.02 0.12 0.83 -0.55 -0.00 0.00 0.00 174.94 175.37 2qul s SER 37 N -2.08 7.09 0.00 4.36 0.15 -1.26 -1.30 113.70 120.66 2qul s SER 37 Ca 0.17 1.58 0.26 0.00 0.70 0.00 0.00 55.95 58.66 2qul s SER 37 Cb -0.11 -2.48 0.55 0.00 -1.71 0.00 0.00 66.02 62.28 2qul s SER 37 CO 0.09 -0.10 1.47 0.18 1.20 0.00 0.00 173.24 176.08 2qul n LEU 38 N 0.29 2.37 -0.02 3.45 4.77 -0.54 -4.31 117.00 123.02 2qul n LEU 38 Ca 0.01 -0.79 -0.13 0.00 -0.03 0.00 0.00 56.01 55.08 2qul n LEU 38 Cb 0.51 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 2qul n LEU 38 CO 0.42 0.39 0.56 1.23 -1.33 0.00 0.00 177.39 178.67 2qul h GLY 39 N 4.77 -0.78 0.65 -0.72 0.00 -1.93 -0.31 103.07 104.75 2qul h GLY 39 Ca 0.00 0.56 -0.35 0.00 0.00 0.00 0.00 47.33 47.55 2qul h GLY 39 CO 0.00 -0.21 -1.83 0.83 0.00 0.00 0.00 176.54 175.33 2qul h GLU 40 N -0.50 0.29 -1.00 4.80 4.39 -1.86 -3.38 114.58 117.31 2qul h GLU 40 Ca 0.07 -0.49 0.18 0.00 0.34 0.00 0.00 59.36 59.47 2qul h GLU 40 Cb 0.64 0.18 -0.10 0.00 -0.10 0.00 0.00 28.75 29.36 2qul h GLU 40 CO -0.43 1.23 0.61 0.35 -1.16 0.00 0.00 179.01 179.62 2qul h PHE 41 N -0.02 1.08 -0.51 4.33 3.57 -1.74 -1.51 116.94 122.15 2qul h PHE 41 Ca -0.39 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.26 2qul h PHE 41 Cb 1.98 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 40.37 2qul h PHE 41 CO 0.09 0.26 0.35 1.25 -2.23 0.00 0.00 178.31 178.03 2qul h HIS 42 N 0.79 0.23 -0.01 0.41 2.76 -1.22 -1.64 115.15 116.47 2qul h HIS 42 Ca 0.57 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.75 2qul h HIS 42 Cb 0.86 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.74 2qul h HIS 42 CO -0.01 0.11 -0.02 0.09 -1.30 0.00 0.00 177.93 176.80 2qul n ASN 43 N -4.45 0.67 -4.82 3.26 3.02 -0.57 -4.89 115.26 107.48 2qul n ASN 43 Ca 0.08 -1.13 -0.31 0.00 -0.03 0.00 0.00 54.58 53.19 2qul n ASN 43 Cb 0.43 -0.01 0.05 0.00 -0.61 0.00 0.00 39.78 39.64 2qul n ASN 43 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2qul s LEU 44 N -2.07 3.12 0.71 3.41 1.43 -0.62 -5.01 118.68 119.65 2qul s LEU 44 Ca 0.41 1.59 -0.14 0.00 -1.03 0.00 0.00 54.13 54.96 2qul s LEU 44 Cb 0.21 -4.47 0.03 0.00 0.03 0.00 0.00 46.19 41.99 2qul s LEU 44 CO 0.37 -1.42 1.15 -0.94 0.23 0.00 0.00 176.35 175.74 2qul s SER 45 N -3.83 4.60 0.53 2.29 1.04 -1.26 -4.81 113.70 112.26 2qul s SER 45 Ca 0.58 2.14 0.23 0.00 0.48 0.00 0.00 55.95 59.37 2qul s SER 45 Cb -0.14 -2.56 1.38 0.00 0.10 0.00 0.00 66.02 64.79 2qul s SER 45 CO 0.55 -1.98 2.05 0.44 0.98 0.00 0.00 173.24 175.28 2qul h ASP 46 N -0.27 0.00 -0.15 7.02 3.32 -1.96 -1.47 116.42 122.91 2qul h ASP 46 Ca -0.47 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 2qul h ASP 46 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.81 2qul h ASP 46 CO 0.51 0.00 -0.14 0.00 -1.72 0.00 0.00 179.24 177.90 2qul h ALA 47 N 1.81 0.21 -0.39 3.45 0.00 -1.99 -2.50 119.26 119.85 2qul h ALA 47 Ca 0.17 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 2qul h ALA 47 Cb 0.68 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2qul h ALA 47 CO -0.00 0.09 -0.03 0.87 0.00 0.00 0.00 179.25 180.17 2qul h LYS 48 N -0.02 0.64 -0.41 0.00 1.57 -1.66 -1.44 116.57 115.24 2qul h LYS 48 Ca 0.02 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.58 2qul h LYS 48 Cb 0.66 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2qul h LYS 48 CO 0.03 0.68 0.03 0.87 -0.57 0.00 0.00 179.45 180.50 2qul h LYS 49 N 0.60 0.71 0.00 3.15 1.57 -1.31 -2.56 116.57 118.73 2qul h LYS 49 Ca 0.12 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 2qul h LYS 49 Cb 0.42 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 2qul h LYS 49 CO 0.02 0.77 -0.25 0.00 -0.57 0.00 0.00 179.45 179.42 2qul h ARG 50 N 0.55 0.00 -0.34 3.15 3.08 -1.19 -2.86 114.38 116.77 2qul h ARG 50 Ca 0.12 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 2qul h ARG 50 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2qul h ARG 50 CO 0.01 0.25 0.04 1.49 -1.07 0.00 0.00 179.97 180.70 2qul h GLU 51 N 0.00 0.57 -0.59 0.04 4.81 -0.87 -1.11 114.58 117.43 2qul h GLU 51 Ca -0.00 -0.16 0.02 0.00 -0.13 0.00 0.00 59.36 59.09 2qul h GLU 51 Cb 0.65 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 2qul h GLU 51 CO 0.03 0.66 0.37 1.25 -0.73 0.00 0.00 179.01 180.59 2qul h LEU 52 N 0.40 0.62 -0.63 1.64 5.85 -1.27 0.24 115.31 122.16 2qul h LEU 52 Ca 0.10 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2qul h LEU 52 Cb 0.38 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2qul h LEU 52 CO 0.01 0.44 0.41 0.50 -0.34 0.00 0.00 178.44 179.46 2qul h LYS 53 N 0.74 0.82 -0.04 1.25 1.63 -1.37 0.28 116.57 119.87 2qul h LYS 53 Ca 0.23 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.98 2qul h LYS 53 Cb -0.02 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.42 2qul h LYS 53 CO -0.08 0.54 0.02 0.00 -3.45 0.00 0.00 179.45 176.48 2qul h ALA 54 N 1.23 0.06 0.07 5.00 0.00 -0.50 0.75 119.26 125.86 2qul h ALA 54 Ca 0.23 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2qul h ALA 54 Cb -0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2qul h ALA 54 CO -0.05 -0.37 -0.09 0.28 0.00 0.00 0.00 179.25 179.02 2qul h VAL 55 N -0.08 0.80 -0.38 0.00 2.07 -0.21 -0.63 116.25 117.81 2qul h VAL 55 Ca 0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.58 2qul h VAL 55 Cb 0.15 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2qul h VAL 55 CO -0.00 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.72 2qul h ALA 56 N 0.73 0.45 -0.80 1.67 0.00 -0.36 -1.75 119.26 119.21 2qul h ALA 56 Ca 0.01 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2qul h ALA 56 Cb 0.19 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2qul h ALA 56 CO -0.04 -0.26 0.51 -0.44 0.00 0.00 0.00 179.25 179.02 2qul h ASP 57 N 0.28 0.85 -0.38 0.00 3.45 -0.57 0.39 116.42 120.44 2qul h ASP 57 Ca 0.18 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.61 2qul h ASP 57 Cb 0.16 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 2qul h ASP 57 CO -0.19 0.59 0.19 -0.78 -1.57 0.00 0.00 179.24 177.48 2qul h ASP 58 N 1.00 0.53 1.02 6.45 -0.00 -0.54 -2.14 116.42 122.74 2qul h ASP 58 Ca 0.31 -0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.30 2qul h ASP 58 Cb -0.01 -0.13 0.00 0.00 -0.00 0.00 0.00 39.33 39.19 2qul h ASP 58 CO -0.11 0.47 -0.30 0.18 -0.00 0.00 0.00 179.24 179.48 2qul n LEU 59 N -4.39 0.58 -0.21 2.28 4.77 -0.69 -4.91 117.00 114.42 2qul n LEU 59 Ca 0.03 0.35 -0.02 0.00 -0.03 0.00 0.00 56.01 56.33 2qul n LEU 59 Cb 0.13 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2qul n LEU 59 CO 0.37 -0.06 -0.03 0.61 -1.33 0.00 0.00 177.39 176.96 2qul n GLY 60 N 1.38 0.49 3.72 -0.72 0.00 -0.29 -5.01 105.19 104.75 2qul n GLY 60 Ca 0.05 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.78 2qul n GLY 60 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qul s LEU 61 N -0.60 4.22 0.09 0.99 2.96 -0.03 -4.95 118.68 121.36 2qul s LEU 61 Ca 0.00 0.43 -0.19 0.00 -0.22 0.00 0.00 54.13 54.15 2qul s LEU 61 Cb 0.00 -2.32 -0.07 0.00 0.50 0.00 0.00 46.19 44.30 2qul s LEU 61 CO 0.00 0.10 0.58 -0.89 -1.32 0.00 0.00 176.35 174.81 2qul s THR 62 N 0.56 4.73 -0.12 3.68 2.01 -0.64 -4.28 115.64 121.59 2qul s THR 62 Ca 0.15 1.20 0.02 0.00 0.31 0.00 0.00 61.69 63.36 2qul s THR 62 Cb -0.13 -3.89 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2qul s THR 62 CO 0.03 0.52 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.61 2qul s VAL 63 N -1.15 2.61 0.36 3.82 1.01 -1.26 -1.27 120.40 124.51 2qul s VAL 63 Ca 0.30 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.54 2qul s VAL 63 Cb -0.19 -2.06 -0.07 0.00 0.00 0.00 0.00 36.38 34.06 2qul s VAL 63 CO 0.19 0.54 -0.04 0.00 0.00 0.00 0.00 175.10 175.79 2qul s MET 64 N 0.38 1.82 0.22 2.72 0.23 -0.42 -3.60 119.30 120.64 2qul s MET 64 Ca -0.14 -1.98 0.06 0.00 -1.03 0.00 0.00 55.69 52.60 2qul s MET 64 Cb -0.17 -1.56 -0.05 0.00 -1.53 0.00 0.00 34.83 31.52 2qul s MET 64 CO 0.07 0.04 -0.08 0.00 -2.03 0.00 0.00 175.02 173.02 2qul s ILE 67 N -3.45 0.00 -0.29 0.00 1.10 -0.64 -1.46 121.20 116.46 2qul s ILE 67 Ca 0.25 0.00 -0.02 0.00 -0.51 0.00 0.00 60.65 60.37 2qul s ILE 67 Cb -0.01 -1.00 0.09 0.00 0.15 0.00 0.00 42.46 41.69 2qul s ILE 67 CO 0.14 0.00 0.09 -0.83 -2.11 0.00 0.00 174.94 172.23 2qul s GLY 68 N -2.55 0.91 0.33 1.50 0.00 -1.26 -0.88 107.32 105.37 2qul s GLY 68 Ca 0.02 -1.43 -0.28 0.00 0.00 0.00 0.00 44.72 43.03 2qul s GLY 68 CO -0.10 1.67 1.26 1.04 0.00 0.00 0.00 173.10 176.96 2qul n LEU 69 N 4.95 3.30 -4.88 0.66 4.77 -1.13 -4.57 117.00 120.10 2qul n LEU 69 Ca -0.04 1.20 -0.30 0.00 -0.03 0.00 0.00 56.01 56.84 2qul n LEU 69 Cb 0.43 -1.46 0.03 0.00 -2.33 0.00 0.00 43.42 40.09 2qul n LEU 69 CO 0.10 -0.61 0.71 -0.54 -1.33 0.00 0.00 177.39 175.73 2qul s LYS 70 N -1.79 3.23 0.36 3.23 1.02 -1.26 -1.33 119.74 123.20 2qul s LYS 70 Ca 0.56 0.55 0.11 0.00 0.02 0.00 0.00 55.97 57.21 2qul s LYS 70 Cb -0.59 -2.08 0.88 0.00 -0.52 0.00 0.00 37.83 35.52 2qul s LYS 70 CO 0.62 -0.77 1.85 0.77 -0.92 0.00 0.00 175.35 176.90 2qul h SER 71 N -0.43 0.61 0.48 2.83 0.02 -1.94 -0.13 113.55 114.99 2qul h SER 71 Ca -0.45 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 2qul h SER 71 Cb 1.22 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2qul h SER 71 CO 0.63 0.28 0.00 -1.84 -1.14 0.00 0.00 176.83 174.75 2qul n GLU 72 N -4.58 0.08 -0.06 3.45 0.28 -1.26 -2.46 120.64 116.10 2qul n GLU 72 Ca 0.19 0.37 0.02 0.00 -0.16 0.00 0.00 57.16 57.58 2qul n GLU 72 Cb 0.55 -1.66 0.05 0.00 1.43 0.00 0.00 31.44 31.81 2qul n GLU 72 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2qul n TYR 73 N -1.81 0.12 -1.45 -1.84 0.53 -0.08 -4.42 117.16 108.21 2qul n TYR 73 Ca 0.02 -0.56 -0.47 0.00 -1.02 0.00 0.00 57.90 55.87 2qul n TYR 73 Cb 0.16 -0.06 -0.08 0.00 -1.03 0.00 0.00 39.34 38.32 2qul n TYR 73 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 2qul n ASP 74 N -0.38 1.65 0.27 7.72 -0.08 -1.03 -4.26 116.55 120.44 2qul n ASP 74 Ca 0.04 0.23 0.16 0.00 -1.51 0.00 0.00 54.79 53.71 2qul n ASP 74 Cb 0.34 -1.21 0.89 0.00 2.34 0.00 0.00 41.12 43.47 2qul n ASP 74 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 2qul h PHE 75 N 13.24 0.00 -0.02 -0.67 -1.00 -1.88 -2.19 116.94 124.42 2qul h PHE 75 Ca -0.20 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.58 2qul h PHE 75 Cb 1.32 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.88 2qul h PHE 75 CO 0.99 0.00 -0.23 0.00 -1.61 0.00 0.00 178.31 177.46 2qul n ALA 76 N -2.33 3.02 -1.74 2.45 0.00 -1.26 -3.34 120.51 117.30 2qul n ALA 76 Ca -0.02 -0.54 -0.42 0.00 0.00 0.00 0.00 53.44 52.46 2qul n ALA 76 Cb 0.15 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.62 2qul n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qul n SER 77 N 0.09 3.66 0.00 0.00 2.88 -0.82 -4.71 113.62 114.72 2qul n SER 77 Ca 0.13 1.17 0.09 0.00 -1.33 0.00 0.00 58.87 58.93 2qul n SER 77 Cb 0.44 -1.58 0.42 0.00 -0.75 0.00 0.00 64.21 62.74 2qul n SER 77 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2qul n PRO 78 N 1.60 0.09 -2.89 -1.46 -0.04 -1.26 -4.59 135.00 126.46 2qul n PRO 78 Ca 0.07 0.16 -0.43 0.00 -0.04 0.00 0.00 63.50 63.26 2qul n PRO 78 Cb 0.37 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 2qul n PRO 78 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2qul s ASP 79 N -2.85 6.57 0.30 3.54 -1.08 -1.26 -4.94 116.67 116.94 2qul s ASP 79 Ca 0.12 0.33 0.04 0.00 -0.52 0.00 0.00 52.55 52.52 2qul s ASP 79 Cb 0.12 -2.43 0.64 0.00 -1.46 0.00 0.00 42.92 39.79 2qul s ASP 79 CO 0.32 -0.85 1.83 0.50 0.52 0.00 0.00 175.17 177.49 2qul h LYS 80 N 8.64 0.88 -0.17 4.34 3.11 -2.00 -1.59 116.57 129.78 2qul h LYS 80 Ca -0.24 -0.05 -0.07 0.00 -2.81 0.00 0.00 60.65 57.48 2qul h LYS 80 Cb 1.08 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 32.10 2qul h LYS 80 CO 0.96 0.58 -0.20 0.66 -2.81 0.00 0.00 179.45 178.64 2qul h SER 81 N 0.90 0.29 -0.15 4.20 4.64 -1.95 -0.20 113.55 121.28 2qul h SER 81 Ca 0.50 -0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.65 2qul h SER 81 Cb 0.60 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2qul h SER 81 CO -0.27 0.51 -0.28 0.58 -0.87 0.00 0.00 176.83 176.50 2qul h VAL 82 N 0.28 1.36 -0.58 0.95 2.07 -1.59 -0.75 116.25 117.98 2qul h VAL 82 Ca 0.05 -1.53 -0.03 0.00 0.82 0.00 0.00 66.70 66.01 2qul h VAL 82 Cb 0.51 1.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 2qul h VAL 82 CO 0.03 0.46 0.25 0.03 0.02 0.00 0.00 177.57 178.36 2qul h ARG 83 N 0.07 0.86 -0.58 1.57 3.08 -1.24 0.21 114.38 118.35 2qul h ARG 83 Ca 0.01 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2qul h ARG 83 Cb 0.87 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.75 2qul h ARG 83 CO 0.06 0.72 0.23 -0.44 -1.07 0.00 0.00 179.97 179.47 2qul h ASP 84 N 0.80 0.80 -0.80 7.04 3.45 -1.02 -0.20 116.42 126.49 2qul h ASP 84 Ca 0.20 -0.17 -0.04 0.00 0.43 0.00 0.00 57.03 57.45 2qul h ASP 84 Cb 0.17 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.69 2qul h ASP 84 CO -0.02 0.75 0.36 0.00 -1.57 0.00 0.00 179.24 178.77 2qul h ALA 85 N 1.08 1.12 -0.23 3.45 0.00 -0.78 -2.15 119.26 121.75 2qul h ALA 85 Ca 0.19 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2qul h ALA 85 Cb 0.20 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2qul h ALA 85 CO -0.02 0.65 -0.15 0.78 0.00 0.00 0.00 179.25 180.51 2qul h GLY 86 N 1.17 0.55 1.78 0.00 0.00 -0.50 -2.09 103.07 103.98 2qul h GLY 86 Ca 0.27 -0.52 -0.10 0.00 0.00 0.00 0.00 47.33 46.99 2qul h GLY 86 CO -0.03 0.47 -0.35 -0.91 0.00 0.00 0.00 176.54 175.72 2qul h THR 87 N 0.21 1.28 -0.13 4.70 1.35 -0.96 -0.23 112.91 119.13 2qul h THR 87 Ca 0.05 -1.37 -0.17 0.00 -0.55 0.00 0.00 66.41 64.36 2qul h THR 87 Cb 0.67 1.57 -0.00 0.00 -1.73 0.00 0.00 68.15 68.66 2qul h THR 87 CO 0.04 0.41 -0.64 -0.33 -0.25 0.00 0.00 175.52 174.75 2qul h GLU 88 N 0.22 0.49 -0.15 4.72 4.39 -1.40 -2.31 114.58 120.55 2qul h GLU 88 Ca 0.03 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.35 2qul h GLU 88 Cb 0.72 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 2qul h GLU 88 CO 0.05 0.97 -0.01 -0.92 -1.16 0.00 0.00 179.01 177.95 2qul h TYR 89 N 0.36 0.30 -0.21 4.33 5.03 -1.06 -2.94 116.97 122.79 2qul h TYR 89 Ca -0.01 -0.05 -0.03 0.00 2.58 0.00 0.00 58.73 61.22 2qul h TYR 89 Cb 1.20 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 39.39 2qul h TYR 89 CO 0.05 0.51 0.01 0.28 -1.32 0.00 0.00 178.16 177.69 2qul h VAL 90 N 0.00 1.13 -0.62 1.81 2.07 -1.01 -0.97 116.25 118.66 2qul h VAL 90 Ca 0.04 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 67.01 2qul h VAL 90 Cb 0.39 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 2qul h VAL 90 CO 0.01 0.16 0.10 0.11 0.02 0.00 0.00 177.57 177.97 2qul h LYS 91 N 0.29 1.01 0.00 1.57 1.57 -1.32 -0.74 116.57 118.95 2qul h LYS 91 Ca 0.07 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 2qul h LYS 91 Cb 0.18 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2qul h LYS 91 CO 0.00 0.93 -0.52 0.00 -0.57 0.00 0.00 179.45 179.29 2qul h ARG 92 N 0.95 0.00 -0.26 3.15 3.08 -1.12 -1.78 114.38 118.40 2qul h ARG 92 Ca 0.19 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.11 2qul h ARG 92 Cb 0.41 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2qul h ARG 92 CO 0.01 0.52 -0.39 -0.07 -1.07 0.00 0.00 179.97 178.97 2qul h LEU 93 N 0.00 0.64 -1.13 3.04 3.38 -0.58 -2.29 115.31 118.36 2qul h LEU 93 Ca -0.01 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2qul h LEU 93 Cb 0.93 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2qul h LEU 93 CO 0.07 0.96 -0.24 -0.07 0.09 0.00 0.00 178.44 179.25 2qul h LEU 94 N 0.50 0.31 -0.90 1.67 3.38 -0.70 -0.59 115.31 118.98 2qul h LEU 94 Ca 0.05 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 2qul h LEU 94 Cb 0.89 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2qul h LEU 94 CO 0.08 0.56 0.28 0.44 0.09 0.00 0.00 178.44 179.88 2qul h ASP 95 N 0.28 0.99 -0.58 -0.43 3.45 -0.88 -0.02 116.42 119.24 2qul h ASP 95 Ca 0.05 -0.15 -0.10 0.00 0.43 0.00 0.00 57.03 57.25 2qul h ASP 95 Cb 0.58 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.07 2qul h ASP 95 CO 0.04 0.89 -0.03 0.44 -1.57 0.00 0.00 179.24 179.01 2qul h ASP 96 N 1.05 1.04 -0.44 6.45 3.32 -0.77 -2.45 116.42 124.63 2qul h ASP 96 Ca 0.24 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 57.01 2qul h ASP 96 Cb 0.22 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 2qul h ASP 96 CO -0.02 1.11 0.25 0.00 -1.72 0.00 0.00 179.24 178.86 2qul h HIS 98 N 0.50 0.62 -0.82 0.00 -0.00 -0.84 -1.00 115.15 113.61 2qul h HIS 98 Ca 0.18 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.59 2qul h HIS 98 Cb 0.04 -0.20 -0.04 0.00 -0.00 0.00 0.00 27.41 27.20 2qul h HIS 98 CO -0.08 0.34 0.54 1.25 -0.00 0.00 0.00 177.93 179.98 2qul h LEU 99 N 0.65 0.91 0.00 0.26 6.46 -1.02 -1.63 115.31 120.94 2qul h LEU 99 Ca 0.23 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 2qul h LEU 99 Cb 0.05 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 39.76 2qul h LEU 99 CO -0.11 0.64 0.00 0.18 -0.62 0.00 0.00 178.44 178.53 2qul n LEU 100 N -4.54 0.00 -1.15 2.25 4.77 -0.76 -4.88 117.00 112.69 2qul n LEU 100 Ca 0.09 0.34 -0.12 0.00 -0.03 0.00 0.00 56.01 56.29 2qul n LEU 100 Cb 0.05 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.77 2qul n LEU 100 CO 0.35 -0.04 -0.14 0.61 -1.33 0.00 0.00 177.39 176.85 2qul n GLY 101 N 1.06 0.67 3.72 -0.72 0.00 -0.61 -4.59 105.19 104.71 2qul n GLY 101 Ca 0.11 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2qul n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qul s ALA 102 N -2.53 3.80 -0.50 4.61 0.00 -0.47 -4.82 121.76 121.84 2qul s ALA 102 Ca 0.00 1.40 0.24 0.00 0.00 0.00 0.00 51.96 53.60 2qul s ALA 102 Cb 0.00 -3.63 0.38 0.00 0.00 0.00 0.00 23.12 19.87 2qul s ALA 102 CO 0.00 -0.80 1.48 -1.00 0.00 0.00 0.00 175.76 175.44 2qul h PRO 103 N 6.75 0.00 -3.56 0.00 0.13 -1.90 -3.45 132.00 129.97 2qul h PRO 103 Ca -0.43 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.51 2qul h PRO 103 Cb 1.20 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.08 2qul h PRO 103 CO 0.92 0.00 -0.60 0.08 -0.23 0.00 0.00 178.00 178.17 2qul s VAL 104 N -3.21 0.03 -0.26 1.56 1.01 -1.26 -1.47 120.40 116.80 2qul s VAL 104 Ca 0.06 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.84 2qul s VAL 104 Cb 0.09 -0.21 0.06 0.00 0.00 0.00 0.00 36.38 36.32 2qul s VAL 104 CO 0.69 -0.13 -0.11 0.12 0.00 0.00 0.00 175.10 175.67 2qul s PHE 105 N -0.38 3.26 0.05 5.22 5.36 0.60 -1.97 117.98 130.12 2qul s PHE 105 Ca -0.05 -2.32 0.00 0.00 -0.96 0.00 0.00 56.93 53.61 2qul s PHE 105 Cb -0.03 -1.93 -0.00 0.00 -0.34 0.00 0.00 43.02 40.72 2qul s PHE 105 CO 0.00 -0.88 0.01 0.00 -1.46 0.00 0.00 175.22 172.89 2qul n ALA 106 N 4.43 0.06 0.00 11.12 0.00 0.53 -0.79 120.51 135.85 2qul n ALA 106 Ca -0.14 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2qul n ALA 106 Cb 0.42 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.02 2qul n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qul n GLY 107 N 3.09 -0.31 3.12 0.00 0.00 -1.25 -1.62 105.19 108.21 2qul n GLY 107 Ca -0.01 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 2qul n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qul n LEU 108 N 0.00 6.05 -0.39 0.99 7.99 -0.06 -1.20 117.00 130.38 2qul n LEU 108 Ca 0.00 -4.51 0.11 0.00 -0.01 0.00 0.00 56.01 51.60 2qul n LEU 108 Cb 0.00 -1.56 0.48 0.00 -0.11 0.00 0.00 43.42 42.24 2qul n LEU 108 CO 0.00 1.06 0.84 0.35 -1.51 0.00 0.00 177.39 178.12 2qul n THR 109 N 4.06 0.11 -0.64 -5.08 -2.24 -1.26 -2.83 114.28 106.40 2qul n THR 109 Ca 0.40 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2qul n THR 109 Cb 0.39 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2qul n THR 109 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2qul n PHE 110 N -0.02 0.00 -3.81 4.78 -1.74 -1.26 -4.98 117.46 110.44 2qul n PHE 110 Ca 0.17 -0.14 -0.05 0.00 -0.56 0.00 0.00 57.45 56.88 2qul n PHE 110 Cb 0.27 -0.01 -0.00 0.00 1.52 0.00 0.00 39.48 41.25 2qul n PHE 110 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2qul s ALA 112 N -2.97 3.38 -0.06 0.00 0.00 -1.26 -3.27 121.76 117.58 2qul s ALA 112 Ca 0.15 0.21 -0.03 0.00 0.00 0.00 0.00 51.96 52.28 2qul s ALA 112 Cb -0.03 -2.86 0.03 0.00 0.00 0.00 0.00 23.12 20.25 2qul s ALA 112 CO 0.05 0.31 0.13 -0.46 0.00 0.00 0.00 175.76 175.79 2qul s TRP 113 N -1.55 -0.15 0.53 0.00 -0.00 -0.44 -4.01 118.94 113.32 2qul s TRP 113 Ca 0.44 0.40 -0.14 0.00 -0.00 0.00 0.00 56.10 56.81 2qul s TRP 113 Cb -0.17 -0.03 -0.06 0.00 -0.00 0.00 0.00 33.47 33.21 2qul s TRP 113 CO 0.21 -0.12 0.96 -2.14 -0.00 0.00 0.00 176.95 175.86 2qul s PRO 114 N 0.64 3.81 -0.18 5.86 0.02 -1.26 -4.70 135.00 139.18 2qul s PRO 114 Ca -0.05 0.79 -0.22 0.00 0.02 0.00 0.00 61.00 61.54 2qul s PRO 114 Cb -0.06 -2.17 0.06 0.00 0.02 0.00 0.00 34.50 32.35 2qul s PRO 114 CO -0.03 -0.32 0.60 -1.14 -0.33 0.00 0.00 177.00 175.78 2qul s GLN 115 N -4.37 0.77 0.17 5.54 0.74 0.31 -5.01 119.66 117.81 2qul s GLN 115 Ca 0.56 0.67 0.07 0.00 0.05 0.00 0.00 55.36 56.71 2qul s GLN 115 Cb -0.10 0.37 -0.04 0.00 1.10 0.00 0.00 33.01 34.34 2qul s GLN 115 CO 0.38 -0.13 0.05 -1.12 -0.55 0.00 0.00 175.29 173.91 2qul s SER 116 N -0.06 5.02 0.73 6.67 0.01 -1.26 -3.39 113.70 121.43 2qul s SER 116 Ca -0.03 -0.31 -0.15 0.00 1.31 0.00 0.00 55.95 56.77 2qul s SER 116 Cb -0.04 -1.16 0.04 0.00 0.21 0.00 0.00 66.02 65.08 2qul s SER 116 CO 0.03 0.08 1.20 -2.84 0.41 0.00 0.00 173.24 172.11 2qul s PRO 117 N -3.03 2.13 0.43 12.44 0.02 -1.26 -4.93 135.00 140.81 2qul s PRO 117 Ca 0.29 1.72 -0.26 0.00 0.02 0.00 0.00 61.00 62.77 2qul s PRO 117 Cb -0.09 -1.84 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 2qul s PRO 117 CO 0.20 -1.83 1.41 -2.30 -0.33 0.00 0.00 177.00 174.15 2qul n PRO 118 N -2.77 2.26 0.17 5.54 -0.02 -1.26 -4.83 135.00 134.10 2qul n PRO 118 Ca 0.13 0.80 0.19 0.00 -2.02 0.00 0.00 63.50 62.60 2qul n PRO 118 Cb 0.50 -2.58 0.77 0.00 -0.02 0.00 0.00 33.50 32.17 2qul n PRO 118 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2qul h LEU 119 N 2.37 0.00 -2.44 2.45 3.38 -2.07 0.40 115.31 119.39 2qul h LEU 119 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2qul h LEU 119 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2qul h LEU 119 CO 0.61 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.24 2qul n ASP 120 N -3.45 3.56 -4.64 -0.43 3.85 -1.26 -4.95 116.55 109.23 2qul n ASP 120 Ca 0.04 -1.99 -0.42 0.00 -0.71 0.00 0.00 54.79 51.71 2qul n ASP 120 Cb 0.53 -0.31 -0.03 0.00 -1.35 0.00 0.00 41.12 39.97 2qul n ASP 120 CO 0.00 0.00 0.00 -0.32 -1.01 0.00 0.00 177.20 175.87 2qul s MET 121 N -1.34 3.84 -0.24 0.11 1.75 0.14 -4.84 119.30 118.72 2qul s MET 121 Ca 0.40 2.20 -0.10 0.00 -1.25 0.00 0.00 55.69 56.95 2qul s MET 121 Cb 0.23 -4.15 -0.11 0.00 2.84 0.00 0.00 34.83 33.64 2qul s MET 121 CO 0.31 -1.27 -0.29 0.36 -0.65 0.00 0.00 175.02 173.48 2qul n LYS 122 N 7.78 0.51 -4.20 4.11 0.00 -1.26 -4.95 118.16 120.15 2qul n LYS 122 Ca 0.21 0.21 -0.26 0.00 -0.00 0.00 0.00 58.31 58.47 2qul n LYS 122 Cb 0.43 -1.36 -0.17 0.00 -0.00 0.00 0.00 35.03 33.93 2qul n LYS 122 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2qul s ASP 123 N -6.97 2.04 0.00 -5.58 3.68 -1.26 -5.03 116.67 103.55 2qul s ASP 123 Ca -0.33 -0.31 0.27 0.00 2.13 0.00 0.00 52.55 54.31 2qul s ASP 123 Cb 0.12 -0.86 0.88 0.00 -1.45 0.00 0.00 42.92 41.61 2qul s ASP 123 CO 0.44 -0.05 1.66 2.29 0.13 0.00 0.00 175.17 179.64 2qul n LYS 124 N 4.45 0.32 -0.24 4.34 2.85 -1.26 -4.24 118.16 124.39 2qul n LYS 124 Ca -0.17 -0.14 0.04 0.00 -1.05 0.00 0.00 58.31 56.98 2qul n LYS 124 Cb 0.51 -1.50 0.17 0.00 -0.65 0.00 0.00 35.03 33.56 2qul n LYS 124 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2qul h ARG 125 N 0.35 0.33 -0.81 -1.58 3.08 -1.99 -0.75 114.38 113.01 2qul h ARG 125 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qul h ARG 125 Cb 0.46 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 2qul h ARG 125 CO 0.00 0.22 0.48 -1.35 -1.07 0.00 0.00 179.97 178.25 2qul h PRO 126 N 0.34 1.10 -0.25 0.04 0.11 -2.00 -0.24 132.00 131.10 2qul h PRO 126 Ca 0.39 -0.10 -0.09 0.00 0.11 0.00 0.00 66.00 66.31 2qul h PRO 126 Cb 0.61 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 2qul h PRO 126 CO -0.44 0.78 -0.18 1.88 -0.21 0.00 0.00 178.00 179.83 2qul h TYR 127 N 1.12 0.66 -0.50 0.65 -1.99 -1.54 -1.57 116.97 113.79 2qul h TYR 127 Ca 0.29 -0.18 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 2qul h TYR 127 Cb -0.03 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 38.53 2qul h TYR 127 CO 0.00 0.86 0.28 0.28 -0.00 0.00 0.00 178.16 179.58 2qul h VAL 128 N 0.28 1.17 -0.82 -2.88 2.07 -0.93 -0.83 116.25 114.31 2qul h VAL 128 Ca 0.05 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2qul h VAL 128 Cb 0.71 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 2qul h VAL 128 CO 0.05 0.18 0.41 0.44 0.02 0.00 0.00 177.57 178.66 2qul h ASP 129 N 0.67 1.06 -0.53 0.57 3.45 -1.00 0.29 116.42 120.93 2qul h ASP 129 Ca 0.18 -0.12 -0.07 0.00 0.43 0.00 0.00 57.03 57.45 2qul h ASP 129 Cb 0.04 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.51 2qul h ASP 129 CO -0.03 0.89 0.06 0.03 -1.57 0.00 0.00 179.24 178.61 2qul h ARG 130 N 1.17 0.90 -0.77 3.56 3.08 -0.89 -1.70 114.38 119.72 2qul h ARG 130 Ca 0.29 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 2qul h ARG 130 Cb 0.10 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2qul h ARG 130 CO -0.04 0.89 0.29 0.00 -1.07 0.00 0.00 179.97 180.05 2qul h ALA 131 N 0.97 1.05 -0.47 0.04 0.00 -0.68 -0.98 119.26 119.20 2qul h ALA 131 Ca 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2qul h ALA 131 Cb 0.45 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2qul h ALA 131 CO 0.02 0.66 0.26 0.82 0.00 0.00 0.00 179.25 181.01 2qul h ILE 132 N 1.13 1.17 -0.36 0.00 2.04 -0.66 -1.23 117.51 119.60 2qul h ILE 132 Ca 0.26 -0.43 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 2qul h ILE 132 Cb 0.24 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2qul h ILE 132 CO -0.02 0.18 -0.09 -0.33 0.00 0.00 0.00 178.15 177.88 2qul h GLU 133 N 0.63 0.61 -0.49 2.37 4.39 -0.98 -1.76 114.58 119.35 2qul h GLU 133 Ca 0.17 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 2qul h GLU 133 Cb 0.05 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 2qul h GLU 133 CO -0.03 0.70 0.09 0.77 -1.16 0.00 0.00 179.01 179.38 2qul h SER 134 N 0.56 0.77 -0.76 1.42 0.02 -0.76 -1.95 113.55 112.85 2qul h SER 134 Ca 0.10 -0.25 -0.05 0.00 -0.84 0.00 0.00 61.79 60.75 2qul h SER 134 Cb 0.50 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 2qul h SER 134 CO 0.03 0.82 0.27 0.58 -1.14 0.00 0.00 176.83 177.39 2qul h VAL 135 N 0.68 1.26 0.00 2.27 2.07 -1.02 -1.66 116.25 119.86 2qul h VAL 135 Ca 0.15 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2qul h VAL 135 Cb 0.37 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2qul h VAL 135 CO 0.01 0.34 -0.04 0.03 0.02 0.00 0.00 177.57 177.93 2qul h ARG 136 N 1.11 0.00 0.00 1.57 3.08 -0.94 0.27 114.38 119.47 2qul h ARG 136 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 2qul h ARG 136 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2qul h ARG 136 CO -0.01 0.04 0.00 0.54 -1.07 0.00 0.00 179.97 179.47 2qul n ARG 137 N -3.57 0.17 0.00 0.04 1.74 -0.63 -3.96 116.66 110.45 2qul n ARG 137 Ca -0.02 0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 2qul n ARG 137 Cb 0.15 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 2qul n ARG 137 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2qul n VAL 138 N -2.02 0.00 -0.22 1.55 0.24 -0.55 -4.81 118.33 112.52 2qul n VAL 138 Ca 0.06 -0.05 0.20 0.00 -2.04 0.00 0.00 64.34 62.50 2qul n VAL 138 Cb 0.38 0.48 0.54 0.00 -1.47 0.00 0.00 33.84 33.78 2qul n VAL 138 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 2qul h ILE 139 N 0.00 0.68 -0.28 1.34 6.09 -0.63 -1.23 117.51 123.47 2qul h ILE 139 Ca 0.00 -0.12 -0.02 0.00 -1.37 0.00 0.00 64.86 63.35 2qul h ILE 139 Cb 0.00 0.30 -0.02 0.00 0.47 0.00 0.00 36.82 37.58 2qul h ILE 139 CO 0.00 0.06 0.09 0.11 -3.07 0.00 0.00 178.15 175.34 2qul h LYS 140 N 0.35 0.40 -0.88 2.19 6.56 -1.85 -1.36 116.57 121.97 2qul h LYS 140 Ca 0.45 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 59.96 2qul h LYS 140 Cb 1.19 -0.08 -0.04 0.00 -0.57 0.00 0.00 32.23 32.73 2qul h LYS 140 CO -0.15 0.36 0.46 0.28 -2.06 0.00 0.00 179.45 178.34 2qul h VAL 141 N 0.40 1.26 -0.23 0.50 2.07 -1.58 -2.12 116.25 116.55 2qul h VAL 141 Ca 0.10 -0.68 -0.11 0.00 0.82 0.00 0.00 66.70 66.82 2qul h VAL 141 Cb 0.13 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.99 2qul h VAL 141 CO -0.01 0.30 -0.29 0.00 0.02 0.00 0.00 177.57 177.60 2qul h ALA 142 N 1.25 0.35 -0.06 1.67 0.00 -1.40 -2.49 119.26 118.58 2qul h ALA 142 Ca 0.31 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.86 2qul h ALA 142 Cb 0.07 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2qul h ALA 142 CO -0.04 0.36 -0.23 0.93 0.00 0.00 0.00 179.25 180.26 2qul h GLU 143 N 0.30 -0.32 -0.54 0.00 5.08 -0.97 0.62 114.58 118.74 2qul h GLU 143 Ca 0.03 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 2qul h GLU 143 Cb 0.86 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2qul h GLU 143 CO 0.07 -0.21 0.01 -0.44 -1.00 0.00 0.00 179.01 177.43 2qul h ASP 144 N -0.33 0.89 0.71 1.42 3.32 -1.46 -1.69 116.42 119.28 2qul h ASP 144 Ca 0.08 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2qul h ASP 144 Cb 0.45 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2qul h ASP 144 CO -0.25 0.94 0.00 1.88 -1.72 0.00 0.00 179.24 180.09 2qul h TYR 145 N 0.85 0.00 -1.10 4.55 0.99 -1.04 -3.46 116.97 117.76 2qul h TYR 145 Ca 0.16 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.80 2qul h TYR 145 Cb 0.49 0.00 0.01 0.00 1.00 0.00 0.00 36.73 38.23 2qul h TYR 145 CO 0.03 0.00 -0.12 0.41 -0.00 0.00 0.00 178.16 178.48 2qul n GLY 146 N -0.20 0.34 3.54 3.88 0.00 -0.10 -5.04 105.19 107.62 2qul n GLY 146 Ca 0.01 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 2qul n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qul s ILE 147 N -2.50 3.67 -0.05 -0.61 -1.09 0.02 -4.92 121.20 115.71 2qul s ILE 147 Ca 0.04 -0.48 -0.29 0.00 -2.23 0.00 0.00 60.65 57.69 2qul s ILE 147 Cb -0.02 -2.52 -0.02 0.00 -1.58 0.00 0.00 42.46 38.32 2qul s ILE 147 CO 0.05 0.57 0.95 -0.63 -1.23 0.00 0.00 174.94 174.65 2qul s ILE 148 N -0.48 4.86 -0.55 2.92 1.01 -0.54 -4.32 121.20 124.10 2qul s ILE 148 Ca 0.07 1.97 -0.12 0.00 0.00 0.00 0.00 60.65 62.56 2qul s ILE 148 Cb -0.12 -4.28 0.14 0.00 0.01 0.00 0.00 42.46 38.21 2qul s ILE 148 CO 0.02 0.11 0.46 -0.47 0.00 0.00 0.00 174.94 175.06 2qul s TYR 149 N 1.39 3.38 0.01 3.97 6.14 1.00 -0.30 117.35 132.95 2qul s TYR 149 Ca 0.48 -1.66 -0.14 0.00 0.64 0.00 0.00 57.07 56.39 2qul s TYR 149 Cb -0.19 -3.66 -0.06 0.00 0.42 0.00 0.00 41.96 38.47 2qul s TYR 149 CO 0.23 -1.00 0.41 0.00 0.64 0.00 0.00 175.55 175.83 2qul s ALA 150 N 1.29 3.70 -0.36 3.97 0.00 0.03 -1.29 121.76 129.08 2qul s ALA 150 Ca 0.06 -0.22 -0.08 0.00 0.00 0.00 0.00 51.96 51.72 2qul s ALA 150 Cb -0.26 -2.38 0.04 0.00 0.00 0.00 0.00 23.12 20.52 2qul s ALA 150 CO -0.00 0.49 0.16 -0.51 0.00 0.00 0.00 175.76 175.89 2qul s LEU 151 N -1.15 4.58 0.15 0.00 1.43 -0.11 -3.94 118.68 119.65 2qul s LEU 151 Ca 0.25 -1.19 -0.30 0.00 -1.03 0.00 0.00 54.13 51.86 2qul s LEU 151 Cb -0.17 -1.92 -0.07 0.00 0.03 0.00 0.00 46.19 44.06 2qul s LEU 151 CO 0.14 -0.38 0.98 -0.70 0.23 0.00 0.00 176.35 176.62 2qul s GLU 152 N 1.43 4.72 -0.41 1.70 2.12 -0.34 -0.98 118.70 126.94 2qul s GLU 152 Ca 0.00 1.50 -0.18 0.00 0.36 0.00 0.00 54.97 56.66 2qul s GLU 152 Cb -0.20 -3.34 0.02 0.00 0.26 0.00 0.00 34.13 30.87 2qul s GLU 152 CO 0.03 0.26 0.48 0.08 -0.54 0.00 0.00 175.26 175.57 2qul s VAL 153 N -0.29 5.03 0.36 3.70 1.01 -0.27 -4.79 120.40 125.16 2qul s VAL 153 Ca 0.46 -0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2qul s VAL 153 Cb -0.25 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2qul s VAL 153 CO 0.31 -0.41 0.09 0.68 0.00 0.00 0.00 175.10 175.77 2qul s VAL 154 N 2.29 2.63 0.85 2.92 -7.23 -1.25 -4.39 120.40 116.22 2qul s VAL 154 Ca 0.15 -1.83 -0.11 0.00 -1.81 0.00 0.00 61.98 58.39 2qul s VAL 154 Cb -0.16 -2.91 0.11 0.00 0.56 0.00 0.00 36.38 33.98 2qul s VAL 154 CO 0.14 -0.14 1.11 0.54 -0.31 0.00 0.00 175.10 176.45 2qul s ASN 155 N -3.80 3.67 0.64 4.85 2.20 -1.26 -4.32 114.94 116.92 2qul s ASN 155 Ca 0.37 1.90 0.30 0.00 -0.94 0.00 0.00 52.86 54.48 2qul s ASN 155 Cb 0.01 -2.48 1.59 0.00 -2.00 0.00 0.00 41.25 38.36 2qul s ASN 155 CO 0.21 -2.58 1.93 0.08 -2.94 0.00 0.00 177.10 173.80 2qul h ARG 156 N -1.50 0.00 0.00 3.55 0.11 -1.89 -1.76 114.38 112.88 2qul h ARG 156 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2qul h ARG 156 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2qul h ARG 156 CO 0.48 0.00 -0.61 0.74 0.10 0.00 0.00 179.97 180.69 2qul h PHE 157 N 0.00 0.00 0.00 4.08 0.04 -1.94 -3.37 116.94 115.75 2qul h PHE 157 Ca 0.06 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.79 2qul h PHE 157 Cb 0.79 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.93 2qul h PHE 157 CO 0.00 0.00 -1.81 0.39 -0.60 0.00 0.00 178.31 176.29 2qul n GLU 158 N -2.61 0.66 -3.82 1.51 1.02 -0.69 -4.75 120.64 111.96 2qul n GLU 158 Ca 0.02 -0.13 -0.08 0.00 -0.02 0.00 0.00 57.16 56.96 2qul n GLU 158 Cb 0.51 -1.40 0.02 0.00 -0.02 0.00 0.00 31.44 30.55 2qul n GLU 158 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2qul s GLN 159 N -3.04 2.04 0.00 3.49 -0.44 -1.05 -0.53 119.66 120.14 2qul s GLN 159 Ca -0.06 -1.30 0.00 0.00 -2.50 0.00 0.00 55.36 51.49 2qul s GLN 159 Cb 0.10 0.58 0.00 0.00 -1.64 0.00 0.00 33.01 32.04 2qul s GLN 159 CO 0.69 -0.95 0.00 -2.67 0.50 0.00 0.00 175.29 172.85 2qul n TRP 160 N -0.56 0.00 0.02 1.67 4.27 -1.26 -4.17 117.44 117.41 2qul n TRP 160 Ca -0.07 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.41 2qul n TRP 160 Cb 0.60 0.00 -0.09 0.00 -1.36 0.00 0.00 31.31 30.46 2qul n TRP 160 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 2qul h LEU 161 N 0.00 -0.10 -7.16 5.67 3.38 -1.96 -3.42 115.31 111.72 2qul h LEU 161 Ca 0.00 -0.44 -0.58 0.00 0.09 0.00 0.00 57.88 56.95 2qul h LEU 161 Cb 0.00 0.03 -0.40 0.00 0.09 0.00 0.00 40.66 40.38 2qul h LEU 161 CO 0.00 0.42 -0.76 0.00 0.09 0.00 0.00 178.44 178.20 2qul n ASN 163 N 4.84 0.80 -4.25 0.00 5.03 -1.26 -3.79 115.26 116.62 2qul n ASN 163 Ca -0.02 -0.77 -0.14 0.00 0.87 0.00 0.00 54.58 54.52 2qul n ASN 163 Cb 0.42 1.12 -0.10 0.00 -1.02 0.00 0.00 39.78 40.20 2qul n ASN 163 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 2qul s ASP 164 N -3.29 0.86 0.23 6.41 3.84 -1.26 -4.67 116.67 118.78 2qul s ASP 164 Ca 0.05 -1.32 -0.07 0.00 -0.00 0.00 0.00 52.55 51.22 2qul s ASP 164 Cb 0.16 0.22 0.32 0.00 -1.38 0.00 0.00 42.92 42.24 2qul s ASP 164 CO 0.87 -0.72 1.80 0.00 -0.00 0.00 0.00 175.17 177.12 2qul h ALA 165 N 2.57 1.03 -0.55 2.11 0.00 -1.94 -2.46 119.26 120.02 2qul h ALA 165 Ca -0.37 0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.65 2qul h ALA 165 Cb 1.23 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 2qul h ALA 165 CO 0.59 0.05 0.21 -0.22 0.00 0.00 0.00 179.25 179.88 2qul h LYS 166 N 0.72 0.38 -0.60 0.00 3.64 -1.97 -0.32 116.57 118.41 2qul h LYS 166 Ca 0.35 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.63 2qul h LYS 166 Cb 0.29 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2qul h LYS 166 CO -0.23 0.25 0.06 0.93 -2.27 0.00 0.00 179.45 178.19 2qul h GLU 167 N 0.39 1.02 -0.32 1.90 5.08 -1.85 -2.24 114.58 118.56 2qul h GLU 167 Ca 0.27 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 2qul h GLU 167 Cb 0.31 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2qul h GLU 167 CO -0.27 0.98 -0.26 0.00 -1.00 0.00 0.00 179.01 178.46 2qul h ALA 168 N 1.00 0.94 -0.67 3.43 0.00 -1.10 -1.74 119.26 121.12 2qul h ALA 168 Ca 0.18 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2qul h ALA 168 Cb 0.48 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2qul h ALA 168 CO 0.02 0.61 0.15 0.82 0.00 0.00 0.00 179.25 180.85 2qul h ILE 169 N 0.56 1.26 -0.73 0.00 2.04 -0.92 0.14 117.51 119.86 2qul h ILE 169 Ca 0.08 -0.97 -0.06 0.00 1.00 0.00 0.00 64.86 64.91 2qul h ILE 169 Cb 0.74 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2qul h ILE 169 CO 0.06 0.37 0.22 0.00 0.00 0.00 0.00 178.15 178.79 2qul h ALA 170 N 1.14 1.01 0.15 1.87 0.00 -1.12 0.11 119.26 122.42 2qul h ALA 170 Ca 0.21 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2qul h ALA 170 Cb 0.38 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2qul h ALA 170 CO 0.00 0.66 -0.07 0.35 0.00 0.00 0.00 179.25 180.19 2qul h PHE 171 N 1.08 -0.19 -0.64 0.00 3.04 -0.80 -1.90 116.94 117.53 2qul h PHE 171 Ca 0.23 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.22 2qul h PHE 171 Cb 0.31 0.06 -0.05 0.00 2.56 0.00 0.00 35.95 38.84 2qul h PHE 171 CO 0.03 0.05 0.38 0.00 -2.02 0.00 0.00 178.31 176.74 2qul h ALA 172 N 0.40 0.84 -0.82 2.41 0.00 -0.50 -1.22 119.26 120.37 2qul h ALA 172 Ca -0.02 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qul h ALA 172 Cb 0.33 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2qul h ALA 172 CO 0.03 0.09 0.53 -0.44 0.00 0.00 0.00 179.25 179.47 2qul h ASP 173 N 0.72 0.95 -0.49 0.00 3.32 -0.72 -1.31 116.42 118.88 2qul h ASP 173 Ca 0.27 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 2qul h ASP 173 Cb 0.09 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2qul h ASP 173 CO -0.14 0.69 -0.07 0.00 -1.72 0.00 0.00 179.24 178.01 2qul h ALA 174 N 1.48 0.67 -0.71 3.45 0.00 -0.47 -2.57 119.26 121.11 2qul h ALA 174 Ca 0.30 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2qul h ALA 174 Cb -0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2qul h ALA 174 CO -0.06 0.53 0.40 0.28 0.00 0.00 0.00 179.25 180.40 2qul h VAL 175 N 0.76 1.21 -6.14 0.00 2.07 -0.76 -3.47 116.25 109.92 2qul h VAL 175 Ca 0.13 -0.50 -0.36 0.00 0.82 0.00 0.00 66.70 66.79 2qul h VAL 175 Cb 0.61 0.24 0.06 0.00 -1.52 0.00 0.00 31.29 30.68 2qul h VAL 175 CO 0.04 0.23 -0.80 -0.67 0.02 0.00 0.00 177.57 176.38 2qul n ASP 176 N -4.37 -5.74 -3.95 0.57 2.03 -0.54 -4.91 116.55 99.63 2qul n ASP 176 Ca 0.07 -0.84 -0.13 0.00 0.52 0.00 0.00 54.79 54.42 2qul n ASP 176 Cb 0.09 -3.50 -0.13 0.00 -0.72 0.00 0.00 41.12 36.86 2qul n ASP 176 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2qul s SER 177 N -3.30 0.37 0.62 1.67 0.15 -1.26 -5.03 113.70 106.91 2qul s SER 177 Ca 0.32 -0.21 0.39 0.00 0.70 0.00 0.00 55.95 57.14 2qul s SER 177 Cb -0.11 0.00 2.02 0.00 -1.71 0.00 0.00 66.02 66.22 2qul s SER 177 CO 0.84 -0.07 2.24 -0.65 1.20 0.00 0.00 173.24 176.80 2qul h PRO 178 N 5.56 0.00 0.00 5.44 0.11 -1.97 -2.40 132.00 138.74 2qul h PRO 178 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2qul h PRO 178 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2qul h PRO 178 CO 0.47 0.02 -1.03 0.00 -0.21 0.00 0.00 178.00 177.24 2qul n ALA 179 N -2.13 3.35 -2.60 -0.75 0.00 -1.26 -4.87 120.51 112.25 2qul n ALA 179 Ca -0.02 -0.40 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 2qul n ALA 179 Cb 0.15 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 2qul n ALA 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qul s LYS 181 N 3.04 1.61 0.07 0.00 -0.14 -0.42 -4.80 119.74 119.11 2qul s LYS 181 Ca 0.32 -1.89 0.00 0.00 -1.36 0.00 0.00 55.97 53.04 2qul s LYS 181 Cb -0.14 -0.81 -0.04 0.00 -1.68 0.00 0.00 37.83 35.16 2qul s LYS 181 CO 0.15 -0.19 0.22 0.08 -0.76 0.00 0.00 175.35 174.85 2qul s VAL 182 N -3.33 5.38 -0.10 3.17 1.01 0.12 -0.93 120.40 125.72 2qul s VAL 182 Ca 0.36 -0.42 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 2qul s VAL 182 Cb 0.08 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2qul s VAL 182 CO 0.15 0.12 -0.07 -1.58 0.00 0.00 0.00 175.10 173.72 2qul s GLN 183 N -2.58 1.40 0.28 2.72 0.74 -0.16 0.10 119.66 122.16 2qul s GLN 183 Ca 0.35 -0.22 0.07 0.00 0.05 0.00 0.00 55.36 55.60 2qul s GLN 183 Cb -0.13 -1.45 -0.03 0.00 1.10 0.00 0.00 33.01 32.50 2qul s GLN 183 CO 0.28 -0.23 0.29 -0.51 -0.55 0.00 0.00 175.29 174.58 2qul s LEU 184 N 1.58 3.93 -0.04 3.68 1.43 -1.20 -1.11 118.68 126.95 2qul s LEU 184 Ca 0.02 -0.20 -0.02 0.00 -1.03 0.00 0.00 54.13 52.89 2qul s LEU 184 Cb -0.13 -2.51 0.03 0.00 0.03 0.00 0.00 46.19 43.61 2qul s LEU 184 CO -0.06 -0.16 0.06 -0.62 0.23 0.00 0.00 176.35 175.80 2qul s ASP 185 N -3.95 1.14 0.44 2.29 -1.08 -1.26 -0.92 116.67 113.33 2qul s ASP 185 Ca 0.36 0.08 0.16 0.00 -0.52 0.00 0.00 52.55 52.63 2qul s ASP 185 Cb -0.08 -0.15 1.07 0.00 -1.46 0.00 0.00 42.92 42.31 2qul s ASP 185 CO 0.27 -0.25 1.94 0.71 0.52 0.00 0.00 175.17 178.36 2qul h THR 186 N 6.44 0.81 -0.17 1.71 1.35 -1.56 0.29 112.91 121.77 2qul h THR 186 Ca -0.13 -0.13 -0.02 0.00 -0.55 0.00 0.00 66.41 65.59 2qul h THR 186 Cb 1.12 0.40 -0.01 0.00 -1.73 0.00 0.00 68.15 67.93 2qul h THR 186 CO 0.16 0.07 0.04 0.15 -0.25 0.00 0.00 175.52 175.69 2qul h PHE 187 N 0.38 0.29 -0.20 4.73 3.57 -1.80 -1.02 116.94 122.89 2qul h PHE 187 Ca 0.34 -0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.66 2qul h PHE 187 Cb 0.80 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 2qul h PHE 187 CO -0.00 0.40 -0.50 0.45 -2.23 0.00 0.00 178.31 176.43 2qul h HIS 188 N 0.09 0.67 -0.70 0.41 3.86 -1.58 -2.95 115.15 114.95 2qul h HIS 188 Ca 0.05 -0.22 -0.03 0.00 -1.16 0.00 0.00 60.37 59.01 2qul h HIS 188 Cb 0.26 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 2qul h HIS 188 CO 0.01 0.94 0.32 0.52 0.86 0.00 0.00 177.93 180.58 2qul h MET 189 N 0.43 1.00 -0.05 2.45 2.86 -0.38 -2.11 114.93 119.14 2qul h MET 189 Ca 0.02 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2qul h MET 189 Cb 1.03 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 32.51 2qul h MET 189 CO 0.09 0.79 0.06 -0.97 1.06 0.00 0.00 176.91 177.94 2qul h ASN 190 N 0.99 0.00 0.15 1.22 -1.24 -1.00 0.18 115.58 115.89 2qul h ASN 190 Ca 0.24 0.00 -0.36 0.00 0.71 0.00 0.00 56.30 56.89 2qul h ASN 190 Cb 0.13 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.14 2qul h ASN 190 CO -0.03 0.00 -2.09 -0.38 -1.29 0.00 0.00 177.43 173.64 2qul n ILE 191 N -3.80 1.65 -0.07 2.57 2.08 -0.85 -4.72 119.36 116.23 2qul n ILE 191 Ca -0.02 -0.68 -0.05 0.00 0.56 0.00 0.00 62.75 62.56 2qul n ILE 191 Cb 0.15 -1.43 -0.14 0.00 -0.75 0.00 0.00 39.64 37.47 2qul n ILE 191 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2qul n GLU 192 N -3.29 1.02 -3.28 0.38 -0.58 -0.88 -4.99 120.64 109.01 2qul n GLU 192 Ca -0.32 -0.04 -0.38 0.00 -0.42 0.00 0.00 57.16 55.99 2qul n GLU 192 Cb 1.05 -1.45 -0.06 0.00 -0.57 0.00 0.00 31.44 30.40 2qul n GLU 192 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2qul s GLU 193 N -2.59 4.27 0.29 3.49 0.41 0.02 -4.96 118.70 119.64 2qul s GLU 193 Ca -0.08 0.59 0.06 0.00 -0.41 0.00 0.00 54.97 55.13 2qul s GLU 193 Cb 0.06 -3.36 0.44 0.00 -1.78 0.00 0.00 34.13 29.50 2qul s GLU 193 CO 0.74 0.33 1.69 1.15 -0.49 0.00 0.00 175.26 178.68 2qul h THR 194 N 4.30 1.32 -3.30 3.63 2.02 -1.94 -3.43 112.91 115.51 2qul h THR 194 Ca -0.44 -1.56 -0.33 0.00 0.77 0.00 0.00 66.41 64.85 2qul h THR 194 Cb 1.20 1.71 -0.37 0.00 -1.74 0.00 0.00 68.15 68.95 2qul h THR 194 CO 0.71 0.46 -0.71 -0.55 0.37 0.00 0.00 175.52 175.81 2qul s SER 195 N -6.88 0.77 0.10 4.18 0.15 -1.26 -5.04 113.70 105.72 2qul s SER 195 Ca -0.04 0.14 -0.21 0.00 0.70 0.00 0.00 55.95 56.53 2qul s SER 195 Cb 0.13 -0.01 -0.11 0.00 -1.71 0.00 0.00 66.02 64.31 2qul s SER 195 CO 0.77 -0.22 1.71 -0.26 1.20 0.00 0.00 173.24 176.45 2qul h PHE 196 N 8.13 0.14 -0.01 3.44 -1.00 -1.93 -2.09 116.94 123.61 2qul h PHE 196 Ca -0.21 -0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.59 2qul h PHE 196 Cb 1.12 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.62 2qul h PHE 196 CO 0.47 0.13 -0.08 -0.09 -1.61 0.00 0.00 178.31 177.13 2qul h ARG 197 N 0.10 -0.14 -0.81 1.51 2.43 -1.95 -1.98 114.38 113.54 2qul h ARG 197 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2qul h ARG 197 Cb 0.04 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 2qul h ARG 197 CO -0.01 -0.09 0.52 -0.44 -1.51 0.00 0.00 179.97 178.44 2qul h ASP 198 N -0.14 0.94 -0.29 -3.80 3.32 -1.97 0.51 116.42 115.00 2qul h ASP 198 Ca 0.04 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2qul h ASP 198 Cb 0.19 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2qul h ASP 198 CO -0.09 0.70 0.06 0.00 -1.72 0.00 0.00 179.24 178.18 2qul h ALA 199 N 1.47 0.38 -0.41 3.45 0.00 -1.15 -1.42 119.26 121.58 2qul h ALA 199 Ca 0.29 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2qul h ALA 199 Cb -0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qul h ALA 199 CO -0.06 0.05 0.08 0.82 0.00 0.00 0.00 179.25 180.14 2qul h ILE 200 N 0.29 1.24 -0.40 0.00 1.08 -1.00 -2.67 117.51 116.06 2qul h ILE 200 Ca 0.09 -0.84 -0.00 0.00 -0.39 0.00 0.00 64.86 63.72 2qul h ILE 200 Cb 0.31 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 2qul h ILE 200 CO 0.00 0.29 0.23 -0.07 -0.69 0.00 0.00 178.15 177.91 2qul h LEU 201 N 0.52 0.47 -2.01 1.44 3.38 -0.80 -0.64 115.31 117.68 2qul h LEU 201 Ca 0.13 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2qul h LEU 201 Cb 0.35 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qul h LEU 201 CO 0.01 0.37 -0.10 0.00 0.09 0.00 0.00 178.44 178.81 2qul h ALA 202 N 1.71 1.39 -0.38 1.53 0.00 -0.91 -2.27 119.26 120.33 2qul h ALA 202 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qul h ALA 202 Cb -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2qul h ALA 202 CO -0.03 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.35 2qul n LYS 204 N 0.61 1.45 -0.94 0.00 4.81 -0.85 -0.05 118.16 123.18 2qul n LYS 204 Ca 0.13 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 2qul n LYS 204 Cb 0.36 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 33.17 2qul n LYS 204 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qul n GLY 205 N 3.59 0.41 0.00 3.14 0.00 -1.26 -4.79 105.19 106.28 2qul n GLY 205 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2qul n GLY 205 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qul n LYS 206 N -1.66 0.50 -2.89 1.61 5.02 0.93 -5.05 118.16 116.61 2qul n LYS 206 Ca 0.00 -0.60 -0.41 0.00 -2.02 0.00 0.00 58.31 55.27 2qul n LYS 206 Cb 0.13 -0.72 -0.04 0.00 -0.02 0.00 0.00 35.03 34.38 2qul n LYS 206 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2qul s MET 207 N -0.23 4.27 -0.03 1.97 1.75 -0.92 0.15 119.30 126.26 2qul s MET 207 Ca 0.00 1.00 0.15 0.00 -1.25 0.00 0.00 55.69 55.59 2qul s MET 207 Cb 0.00 -3.59 -0.23 0.00 2.84 0.00 0.00 34.83 33.85 2qul s MET 207 CO 0.00 -0.38 0.31 0.41 -0.65 0.00 0.00 175.02 174.71 2qul n GLY 208 N 3.53 -0.68 3.53 2.11 0.00 0.11 -4.83 105.19 108.96 2qul n GLY 208 Ca 0.05 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 2qul n GLY 208 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qul s HIS 209 N -3.00 -0.41 -0.15 1.61 5.65 -1.23 -4.53 115.29 113.23 2qul s HIS 209 Ca -0.06 0.18 -0.09 0.00 0.25 0.00 0.00 55.06 55.34 2qul s HIS 209 Cb 0.09 0.58 0.05 0.00 -1.18 0.00 0.00 32.58 32.13 2qul s HIS 209 CO 0.62 -0.84 0.38 0.12 -0.65 0.00 0.00 174.74 174.36 2qul s PHE 210 N -3.60 -0.53 -0.03 3.88 2.19 -1.12 -3.23 117.98 115.53 2qul s PHE 210 Ca 0.04 1.17 0.00 0.00 0.33 0.00 0.00 56.93 58.47 2qul s PHE 210 Cb -0.02 0.21 -0.03 0.00 -1.31 0.00 0.00 43.02 41.87 2qul s PHE 210 CO -0.08 -0.31 0.01 -1.01 1.83 0.00 0.00 175.22 175.66 2qul s HIS 211 N 1.26 3.13 -0.09 10.12 3.76 -0.09 -1.50 115.29 131.87 2qul s HIS 211 Ca -0.09 0.13 0.03 0.00 -0.15 0.00 0.00 55.06 54.99 2qul s HIS 211 Cb -0.08 -1.72 -0.01 0.00 1.11 0.00 0.00 32.58 31.88 2qul s HIS 211 CO -0.11 0.47 -0.20 -0.51 -0.85 0.00 0.00 174.74 173.54 2qul s LEU 212 N -1.31 2.33 -0.23 0.89 1.43 -0.12 -1.55 118.68 120.13 2qul s LEU 212 Ca 0.17 -0.44 -0.27 0.00 -1.03 0.00 0.00 54.13 52.56 2qul s LEU 212 Cb -0.11 -1.47 0.13 0.00 0.03 0.00 0.00 46.19 44.77 2qul s LEU 212 CO 0.07 0.21 1.05 -0.83 0.23 0.00 0.00 176.35 177.09 2qul s GLY 213 N 0.06 -0.16 1.19 -3.19 0.00 -1.26 -1.11 107.32 102.85 2qul s GLY 213 Ca -0.08 2.48 -0.19 0.00 0.00 0.00 0.00 44.72 46.92 2qul s GLY 213 CO 0.05 1.50 1.12 -0.54 0.00 0.00 0.00 173.10 175.23 2qul s GLU 214 N -0.36 -1.10 0.39 2.90 0.41 -0.23 -3.61 118.70 117.10 2qul s GLU 214 Ca 0.02 -0.06 0.12 0.00 -0.41 0.00 0.00 54.97 54.63 2qul s GLU 214 Cb -0.03 -1.61 0.92 0.00 -1.78 0.00 0.00 34.13 31.63 2qul s GLU 214 CO -0.04 -3.63 1.89 0.00 -0.49 0.00 0.00 175.26 173.00 2qul h ALA 215 N -2.52 1.95 -0.43 5.21 0.00 -1.91 -0.84 119.26 120.71 2qul h ALA 215 Ca -0.45 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2qul h ALA 215 Cb 1.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2qul h ALA 215 CO 0.35 -0.17 0.01 0.27 0.00 0.00 0.00 179.25 179.71 2qul n ASN 216 N -4.52 4.83 -0.45 0.00 6.94 -1.26 -4.95 115.26 115.84 2qul n ASN 216 Ca 0.16 -3.00 -0.05 0.00 -0.02 0.00 0.00 54.58 51.66 2qul n ASN 216 Cb 0.48 -0.62 -0.02 0.00 -2.36 0.00 0.00 39.78 37.26 2qul n ASN 216 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2qul n ARG 217 N 0.04 -0.39 -2.41 -3.83 1.74 -0.32 -4.90 116.66 106.59 2qul n ARG 217 Ca 0.25 0.62 -0.24 0.00 -0.77 0.00 0.00 57.85 57.72 2qul n ARG 217 Cb 1.07 -4.36 0.07 0.00 -1.02 0.00 0.00 32.46 28.21 2qul n ARG 217 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qul s LEU 218 N -1.30 3.01 0.29 0.55 1.02 -1.26 -1.22 118.68 119.77 2qul s LEU 218 Ca 0.00 0.15 -0.30 0.00 0.02 0.00 0.00 54.13 54.00 2qul s LEU 218 Cb 0.00 -2.81 -0.12 0.00 0.02 0.00 0.00 46.19 43.27 2qul s LEU 218 CO 0.00 -1.51 1.44 -2.65 0.02 0.00 0.00 176.35 173.65 2qul n PRO 219 N -2.73 2.31 -1.73 1.29 -0.02 -1.26 -1.07 135.00 131.80 2qul n PRO 219 Ca 0.09 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.97 2qul n PRO 219 Cb 0.60 -2.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 2qul n PRO 219 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2qul n PRO 220 N 1.56 2.52 0.00 0.52 -0.04 -1.26 -2.15 135.00 136.14 2qul n PRO 220 Ca 0.08 0.89 0.00 0.00 -0.04 0.00 0.00 63.50 64.43 2qul n PRO 220 Cb 0.35 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 2qul n PRO 220 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qul n GLY 221 N 1.80 2.25 0.06 0.55 0.00 -1.26 -4.59 105.19 104.01 2qul n GLY 221 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 2qul n GLY 221 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qul n GLU 222 N -1.50 0.36 0.00 1.61 1.02 -0.91 -4.98 120.64 116.23 2qul n GLU 222 Ca 0.00 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2qul n GLU 222 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 2qul n GLU 222 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qul n GLY 223 N 1.32 4.35 0.48 0.62 0.00 -1.26 -5.08 105.19 105.61 2qul n GLY 223 Ca 0.02 -1.84 0.04 0.00 0.00 0.00 0.00 46.02 44.24 2qul n GLY 223 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qul n ARG 224 N 0.00 2.71 -1.59 1.61 1.85 -1.26 -5.05 116.66 114.94 2qul n ARG 224 Ca 0.00 -1.86 -0.35 0.00 -1.00 0.00 0.00 57.85 54.64 2qul n ARG 224 Cb 0.00 -1.20 0.08 0.00 -1.05 0.00 0.00 32.46 30.28 2qul n ARG 224 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2qul s LEU 225 N -0.98 3.41 -1.28 2.89 1.43 -1.26 -4.85 118.68 118.04 2qul s LEU 225 Ca 0.17 2.36 -0.17 0.00 -1.03 0.00 0.00 54.13 55.46 2qul s LEU 225 Cb 0.09 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.72 2qul s LEU 225 CO 0.12 -2.07 2.01 -0.81 0.23 0.00 0.00 176.35 175.83 2qul n PRO 226 N -2.41 2.62 -0.19 1.29 -0.04 -1.26 -4.79 135.00 130.22 2qul n PRO 226 Ca 0.13 -2.67 0.03 0.00 -0.04 0.00 0.00 63.50 60.96 2qul n PRO 226 Cb 0.50 -3.34 0.30 0.00 -0.04 0.00 0.00 33.50 30.93 2qul n PRO 226 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2qul h TRP 227 N 7.12 0.84 -0.73 0.54 4.06 -1.99 -1.31 115.95 124.49 2qul h TRP 227 Ca 0.48 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 61.40 2qul h TRP 227 Cb 0.74 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 28.59 2qul h TRP 227 CO 1.39 0.49 0.27 -0.44 -3.56 0.00 0.00 178.44 176.59 2qul h ASP 228 N 0.87 1.01 -0.27 -3.49 3.32 -1.99 0.42 116.42 116.29 2qul h ASP 228 Ca 0.28 -0.16 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 2qul h ASP 228 Cb 0.05 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 2qul h ASP 228 CO -0.08 0.91 -0.12 -0.08 -1.72 0.00 0.00 179.24 178.15 2qul h GLU 229 N 1.06 0.57 0.33 3.56 4.81 -1.80 -0.62 114.58 122.48 2qul h GLU 229 Ca 0.24 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2qul h GLU 229 Cb 0.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.60 2qul h GLU 229 CO -0.02 0.81 -0.16 0.82 -0.73 0.00 0.00 179.01 179.73 2qul h ILE 230 N 0.30 0.70 0.00 2.32 5.03 -0.98 -1.48 117.51 123.40 2qul h ILE 230 Ca 0.06 -0.33 -0.08 0.00 -0.12 0.00 0.00 64.86 64.39 2qul h ILE 230 Cb 0.63 0.87 -0.01 0.00 -3.03 0.00 0.00 36.82 35.29 2qul h ILE 230 CO 0.04 0.07 -0.40 -0.26 -0.68 0.00 0.00 178.15 176.91 2qul h PHE 231 N -0.62 0.00 -0.50 1.37 -1.00 -1.00 -2.37 116.94 112.81 2qul h PHE 231 Ca -0.04 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.67 2qul h PHE 231 Cb 0.45 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.99 2qul h PHE 231 CO -0.01 0.40 0.08 0.78 -1.61 0.00 0.00 178.31 177.95 2qul h GLY 232 N 1.45 0.90 1.37 -1.45 0.00 -1.00 -1.91 103.07 102.42 2qul h GLY 232 Ca -0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 47.33 46.62 2qul h GLY 232 CO 0.05 0.56 -0.18 0.00 0.00 0.00 0.00 176.54 176.97 2qul h ALA 233 N 0.97 0.96 -0.73 3.60 0.00 -1.02 -0.21 119.26 122.83 2qul h ALA 233 Ca 0.15 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2qul h ALA 233 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2qul h ALA 233 CO 0.01 0.61 0.32 -0.07 0.00 0.00 0.00 179.25 180.12 2qul h LEU 234 N 0.66 0.98 -0.73 0.00 3.38 -1.23 -1.69 115.31 116.68 2qul h LEU 234 Ca 0.10 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 2qul h LEU 234 Cb 0.66 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2qul h LEU 234 CO 0.05 0.86 -0.21 0.11 0.09 0.00 0.00 178.44 179.34 2qul h LYS 235 N 1.04 0.75 -0.31 1.13 1.57 -1.04 -1.29 116.57 118.42 2qul h LYS 235 Ca 0.25 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2qul h LYS 235 Cb 0.17 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2qul h LYS 235 CO -0.03 0.89 0.10 1.49 -0.57 0.00 0.00 179.45 181.34 2qul h GLU 236 N 0.66 0.43 -0.41 3.15 4.81 -0.32 -0.80 114.58 122.09 2qul h GLU 236 Ca 0.09 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2qul h GLU 236 Cb 0.71 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2qul h GLU 236 CO 0.05 0.38 0.00 0.44 -0.73 0.00 0.00 179.01 179.15 2qul n ILE 237 N -4.39 0.55 -3.12 2.32 -5.35 -0.70 -4.93 119.36 103.74 2qul n ILE 237 Ca 0.01 -0.59 -0.22 0.00 -0.27 0.00 0.00 62.75 61.68 2qul n ILE 237 Cb 0.15 0.38 0.04 0.00 -1.74 0.00 0.00 39.64 38.47 2qul n ILE 237 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qul n GLY 238 N 1.25 -0.48 3.64 3.28 0.00 -0.31 -4.49 105.19 108.09 2qul n GLY 238 Ca 0.16 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 2qul n GLY 238 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2qul s TYR 239 N -3.19 2.39 -0.19 1.61 6.14 -0.51 -4.84 117.35 118.75 2qul s TYR 239 Ca 0.35 0.68 0.15 0.00 0.64 0.00 0.00 57.07 58.90 2qul s TYR 239 Cb -0.16 -3.86 0.34 0.00 0.42 0.00 0.00 41.96 38.70 2qul s TYR 239 CO 0.44 -2.48 1.23 -0.40 0.64 0.00 0.00 175.55 174.98 2qul n ASP 240 N 7.71 2.85 -2.06 4.32 5.68 -1.26 -4.82 116.55 128.98 2qul n ASP 240 Ca 0.17 -2.86 -0.01 0.00 -0.50 0.00 0.00 54.79 51.59 2qul n ASP 240 Cb 0.45 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 2qul n ASP 240 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qul n GLY 241 N -0.89 -0.69 3.77 6.12 0.00 -1.26 -4.47 105.19 107.78 2qul n GLY 241 Ca 0.16 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 44.06 2qul n GLY 241 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qul s THR 242 N -0.78 3.29 -0.07 2.61 -4.23 -1.26 -3.97 115.64 111.23 2qul s THR 242 Ca 0.02 1.02 -0.02 0.00 -1.18 0.00 0.00 61.69 61.53 2qul s THR 242 Cb -0.00 -3.54 0.03 0.00 1.34 0.00 0.00 72.50 70.33 2qul s THR 242 CO 0.01 0.03 0.02 -0.63 -0.54 0.00 0.00 174.62 173.52 2qul s ILE 243 N -1.53 0.23 -0.06 2.99 1.01 -0.65 -2.79 121.20 120.41 2qul s ILE 243 Ca 0.60 0.17 0.04 0.00 0.00 0.00 0.00 60.65 61.46 2qul s ILE 243 Cb -0.28 -0.45 -0.00 0.00 0.01 0.00 0.00 42.46 41.74 2qul s ILE 243 CO 0.34 0.20 -0.19 -0.69 0.00 0.00 0.00 174.94 174.60 2qul s VAL 244 N 2.03 1.61 0.02 2.92 1.01 -0.56 -0.06 120.40 127.37 2qul s VAL 244 Ca 0.05 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 61.03 2qul s VAL 244 Cb -0.13 -1.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 2qul s VAL 244 CO -0.05 0.46 0.56 0.00 0.00 0.00 0.00 175.10 176.07 2qul s MET 245 N 0.12 4.23 -0.56 2.72 0.23 -0.47 -0.94 119.30 124.63 2qul s MET 245 Ca -0.07 0.69 0.05 0.00 -1.03 0.00 0.00 55.69 55.32 2qul s MET 245 Cb -0.13 -3.29 0.19 0.00 -1.53 0.00 0.00 34.83 30.06 2qul s MET 245 CO 0.04 0.50 0.47 -1.91 -2.03 0.00 0.00 175.02 172.09 2qul n GLU 246 N 2.28 1.23 -3.02 3.16 2.13 -0.26 -1.75 120.64 124.40 2qul n GLU 246 Ca -0.09 -3.92 -0.39 0.00 0.66 0.00 0.00 57.16 53.41 2qul n GLU 246 Cb 0.51 -1.96 -0.06 0.00 0.27 0.00 0.00 31.44 30.20 2qul n GLU 246 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2qul s PRO 247 N -1.03 4.49 -0.29 5.31 0.02 -1.26 -4.79 135.00 137.45 2qul s PRO 247 Ca 0.31 1.07 0.01 0.00 0.02 0.00 0.00 61.00 62.40 2qul s PRO 247 Cb 0.03 -3.29 0.09 0.00 0.02 0.00 0.00 34.50 31.35 2qul s PRO 247 CO -0.16 0.48 0.05 -0.06 -0.33 0.00 0.00 177.00 176.99 2qul s PHE 248 N -0.78 2.38 -0.03 6.54 0.08 -0.36 -4.65 117.98 121.18 2qul s PHE 248 Ca 0.36 -2.03 0.01 0.00 0.12 0.00 0.00 56.93 55.38 2qul s PHE 248 Cb -0.22 -1.97 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 2qul s PHE 248 CO 0.24 -0.86 0.03 -1.33 -0.10 0.00 0.00 175.22 173.20 2qul n MET 249 N 4.66 5.38 -4.44 0.44 2.81 -1.26 -4.71 117.12 119.99 2qul n MET 249 Ca -0.03 -0.00 -0.32 0.00 -1.81 0.00 0.00 57.70 55.54 2qul n MET 249 Cb 0.43 -0.63 -0.10 0.00 -0.71 0.00 0.00 33.22 32.20 2qul n MET 249 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2qul s ARG 250 N -1.27 2.59 0.55 0.03 0.52 -1.26 -0.55 118.95 119.56 2qul s ARG 250 Ca 0.00 -0.70 0.09 0.00 -0.52 0.00 0.00 55.73 54.60 2qul s ARG 250 Cb 0.01 -2.53 0.07 0.00 0.52 0.00 0.00 34.95 33.02 2qul s ARG 250 CO 0.03 0.61 0.73 -1.59 0.02 0.00 0.00 175.30 175.09 2qul s LYS 251 N -1.42 2.37 0.00 3.54 -2.85 -1.26 -4.53 119.74 115.60 2qul s LYS 251 Ca 0.17 -1.62 0.00 0.00 -1.00 0.00 0.00 55.97 53.52 2qul s LYS 251 Cb -0.11 -2.61 0.00 0.00 -2.06 0.00 0.00 37.83 33.05 2qul s LYS 251 CO 0.08 -0.76 0.00 0.41 0.10 0.00 0.00 175.35 175.18 2qul n GLY 252 N -2.14 2.93 3.59 0.59 0.00 -1.26 -4.96 105.19 103.94 2qul n GLY 252 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2qul n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qul n GLY 253 N -2.00 2.87 0.29 -0.02 0.00 -1.26 -5.00 105.19 100.08 2qul n GLY 253 Ca 0.00 -2.30 -0.04 0.00 0.00 0.00 0.00 46.02 43.68 2qul n GLY 253 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2qul h SER 254 N 0.70 0.77 -0.05 1.61 0.02 -1.71 -1.75 113.55 113.14 2qul h SER 254 Ca -0.34 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.44 2qul h SER 254 Cb 1.21 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.54 2qul h SER 254 CO 0.54 0.80 0.02 0.58 -1.14 0.00 0.00 176.83 177.63 2qul h VAL 255 N 0.77 1.11 -0.62 2.27 2.07 -1.38 -2.02 116.25 118.45 2qul h VAL 255 Ca 0.16 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.47 2qul h VAL 255 Cb 0.39 1.25 -0.09 0.00 -1.52 0.00 0.00 31.29 31.32 2qul h VAL 255 CO 0.01 0.09 0.17 0.28 0.02 0.00 0.00 177.57 178.14 2qul h SER 256 N -0.05 0.08 -0.13 0.57 0.02 -1.58 -1.68 113.55 110.77 2qul h SER 256 Ca 0.02 0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.96 2qul h SER 256 Cb 0.13 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 2qul h SER 256 CO -0.00 0.04 -0.29 0.03 -1.14 0.00 0.00 176.83 175.47 2qul h ARG 257 N 0.31 0.60 -0.16 3.45 3.08 -1.18 0.42 114.38 120.89 2qul h ARG 257 Ca 0.33 -0.25 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 2qul h ARG 257 Cb 0.48 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2qul h ARG 257 CO -0.39 0.82 -0.25 0.00 -1.07 0.00 0.00 179.97 179.08 2qul h ALA 258 N 1.17 1.28 -0.41 0.04 0.00 -0.57 -2.99 119.26 117.78 2qul h ALA 258 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2qul h ALA 258 Cb 0.76 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2qul h ALA 258 CO 0.06 0.48 0.00 1.33 0.00 0.00 0.00 179.25 181.12 2qul n VAL 259 N -4.15 0.54 -2.09 0.00 0.24 -0.82 -4.93 118.33 107.11 2qul n VAL 259 Ca -0.01 -0.77 -0.05 0.00 -2.04 0.00 0.00 64.34 61.48 2qul n VAL 259 Cb 0.37 0.96 -0.00 0.00 -1.47 0.00 0.00 33.84 33.70 2qul n VAL 259 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qul n GLY 260 N 1.52 0.18 3.38 7.63 0.00 -0.72 -5.01 105.19 112.16 2qul n GLY 260 Ca 0.20 -0.69 -0.45 0.00 0.00 0.00 0.00 46.02 45.08 2qul n GLY 260 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qul s VAL 261 N -2.23 5.06 -0.64 1.61 1.01 0.06 -4.88 120.40 120.39 2qul s VAL 261 Ca 0.00 -1.05 0.22 0.00 0.00 0.00 0.00 61.98 61.14 2qul s VAL 261 Cb 0.00 -4.30 -0.24 0.00 0.00 0.00 0.00 36.38 31.84 2qul s VAL 261 CO 0.00 -0.82 0.80 0.79 0.00 0.00 0.00 175.10 175.86 2qul n TRP 262 N 5.66 0.04 -4.10 5.22 5.03 -1.26 -4.46 117.44 123.56 2qul n TRP 262 Ca -0.11 0.01 -0.07 0.00 3.03 0.00 0.00 57.50 60.36 2qul n TRP 262 Cb 0.43 -0.22 -0.10 0.00 -1.03 0.00 0.00 31.31 30.39 2qul n TRP 262 CO 0.00 0.00 0.00 -0.98 -0.03 0.00 0.00 177.69 176.68 2qul s ARG 263 N -3.19 0.64 0.26 -0.99 1.70 -1.26 -4.90 118.95 111.22 2qul s ARG 263 Ca 0.02 -1.24 -0.30 0.00 -0.47 0.00 0.00 55.73 53.74 2qul s ARG 263 Cb 0.15 0.21 -0.11 0.00 -0.57 0.00 0.00 34.95 34.63 2qul s ARG 263 CO 0.87 -0.12 1.56 0.34 -1.08 0.00 0.00 175.30 176.87 2qul s ASP 264 N -2.93 6.47 0.00 -2.89 2.15 -1.26 -4.46 116.67 113.74 2qul s ASP 264 Ca 0.09 2.84 0.00 0.00 0.43 0.00 0.00 52.55 55.91 2qul s ASP 264 Cb 0.08 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 2qul s ASP 264 CO -0.09 -0.85 0.76 0.23 -0.17 0.00 0.00 175.17 175.05 2qul n MET 265 N 2.48 1.36 -0.04 4.34 2.81 0.29 -4.66 117.12 123.70 2qul n MET 265 Ca 0.09 -1.04 0.12 0.00 -1.81 0.00 0.00 57.70 55.06 2qul n MET 265 Cb 0.38 -0.95 0.22 0.00 -0.71 0.00 0.00 33.22 32.16 2qul n MET 265 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2qul n SER 266 N -0.28 2.72 -3.12 7.83 3.41 -0.93 -4.89 113.62 118.36 2qul n SER 266 Ca 0.00 -1.89 -0.23 0.00 -0.26 0.00 0.00 58.87 56.49 2qul n SER 266 Cb 0.18 -0.05 0.04 0.00 -0.26 0.00 0.00 64.21 64.12 2qul n SER 266 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2qul n ASN 267 N 1.09 -6.13 -1.16 4.04 4.05 -1.26 -1.59 115.26 114.30 2qul n ASN 267 Ca 0.16 -0.33 -0.13 0.00 0.45 0.00 0.00 54.58 54.73 2qul n ASN 267 Cb 0.54 -4.93 -0.04 0.00 1.23 0.00 0.00 39.78 36.57 2qul n ASN 267 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qul n GLY 268 N -1.59 1.00 3.73 8.20 0.00 -1.26 -4.96 105.19 110.30 2qul n GLY 268 Ca -0.09 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2qul n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qul n ALA 269 N 0.49 1.80 -2.07 4.61 0.00 -0.62 -5.00 120.51 119.72 2qul n ALA 269 Ca -0.14 0.36 -0.26 0.00 0.00 0.00 0.00 53.44 53.40 2qul n ALA 269 Cb 0.49 -2.34 0.04 0.00 0.00 0.00 0.00 19.45 17.63 2qul n ALA 269 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qul s THR 270 N -0.79 3.39 0.45 0.00 -4.23 -1.26 -4.84 115.64 108.36 2qul s THR 270 Ca 0.58 -0.14 0.17 0.00 -1.18 0.00 0.00 61.69 61.12 2qul s THR 270 Cb -0.54 -3.35 0.35 0.00 1.34 0.00 0.00 72.50 70.30 2qul s THR 270 CO 0.59 -0.34 1.97 0.44 -0.54 0.00 0.00 174.62 176.74 2qul h ASP 271 N -0.17 0.30 0.17 3.99 3.45 -1.99 0.11 116.42 122.27 2qul h ASP 271 Ca -0.45 0.01 -0.18 0.00 0.43 0.00 0.00 57.03 56.84 2qul h ASP 271 Cb 1.27 -0.05 -0.00 0.00 -0.56 0.00 0.00 39.33 39.98 2qul h ASP 271 CO 0.60 0.17 -0.70 -0.33 -1.57 0.00 0.00 179.24 177.41 2qul h GLU 272 N 0.32 0.48 -0.10 3.56 5.08 -1.99 -1.03 114.58 120.90 2qul h GLU 272 Ca 0.29 -0.37 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 2qul h GLU 272 Cb 0.70 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2qul h GLU 272 CO -0.07 1.00 -0.46 0.93 -1.00 0.00 0.00 179.01 179.40 2qul h GLU 273 N 0.33 0.25 -0.48 2.33 5.08 -1.44 -2.31 114.58 118.34 2qul h GLU 273 Ca -0.03 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 2qul h GLU 273 Cb 1.27 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 2qul h GLU 273 CO 0.12 0.66 0.07 0.52 -1.00 0.00 0.00 179.01 179.39 2qul h MET 274 N 0.20 0.80 -0.19 2.33 2.86 -0.61 -2.23 114.93 118.09 2qul h MET 274 Ca 0.01 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.47 2qul h MET 274 Cb 0.89 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.43 2qul h MET 274 CO 0.07 0.81 -0.01 -0.44 1.06 0.00 0.00 176.91 178.40 2qul h ASP 275 N 0.68 -0.10 -0.88 1.22 3.32 -0.79 -1.01 116.42 118.85 2qul h ASP 275 Ca 0.15 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 2qul h ASP 275 Cb 0.40 0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 2qul h ASP 275 CO 0.01 -0.03 0.45 -0.08 -1.72 0.00 0.00 179.24 177.87 2qul h GLU 276 N 0.04 1.24 -0.04 3.56 4.57 -1.31 0.31 114.58 122.96 2qul h GLU 276 Ca 0.09 -0.17 -0.09 0.00 -1.18 0.00 0.00 59.36 58.01 2qul h GLU 276 Cb 0.12 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 2qul h GLU 276 CO -0.16 0.93 -0.38 0.00 -1.18 0.00 0.00 179.01 178.22 2qul h ARG 277 N 1.24 0.08 -0.26 1.92 3.08 -1.10 -1.03 114.38 118.31 2qul h ARG 277 Ca 0.30 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.18 2qul h ARG 277 Cb 0.08 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 2qul h ARG 277 CO -0.04 0.45 -0.39 0.00 -1.07 0.00 0.00 179.97 178.92 2qul h ALA 278 N 1.55 0.40 -0.40 0.04 0.00 -0.44 -1.38 119.26 119.04 2qul h ALA 278 Ca 0.01 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2qul h ALA 278 Cb 0.71 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2qul h ALA 278 CO 0.05 0.49 0.25 0.00 0.00 0.00 0.00 179.25 180.04 2qul h ARG 279 N 0.46 0.53 -0.61 0.00 3.08 -0.54 0.23 114.38 117.53 2qul h ARG 279 Ca 0.03 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2qul h ARG 279 Cb 0.98 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 2qul h ARG 279 CO 0.09 0.37 0.22 0.00 -1.07 0.00 0.00 179.97 179.58 2qul h ARG 280 N 0.53 0.92 -0.62 0.04 3.08 -1.15 -2.00 114.38 115.18 2qul h ARG 280 Ca 0.14 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 2qul h ARG 280 Cb -0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 2qul h ARG 280 CO -0.03 0.80 0.09 1.03 -1.07 0.00 0.00 179.97 180.79 2qul h SER 281 N 0.85 0.99 -0.55 7.04 0.87 -0.96 -1.21 113.55 120.59 2qul h SER 281 Ca 0.20 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2qul h SER 281 Cb 0.24 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 2qul h SER 281 CO -0.01 1.01 0.36 0.25 -0.53 0.00 0.00 176.83 177.91 2qul h LEU 282 N 0.94 0.63 -0.57 2.23 5.85 -0.75 -0.40 115.31 123.24 2qul h LEU 282 Ca 0.19 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2qul h LEU 282 Cb 0.45 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2qul h LEU 282 CO 0.01 0.46 0.26 -0.61 -0.34 0.00 0.00 178.44 178.22 2qul h GLN 283 N 0.74 0.83 -0.43 1.25 5.75 -1.15 -1.02 115.11 121.08 2qul h GLN 283 Ca 0.20 -0.13 0.06 0.00 -0.15 0.00 0.00 58.65 58.62 2qul h GLN 283 Cb -0.08 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 28.28 2qul h GLN 283 CO -0.04 0.69 0.14 0.35 -2.65 0.00 0.00 178.83 177.32 2qul h PHE 284 N 0.77 0.24 -0.15 3.99 3.57 -0.68 -1.33 116.94 123.36 2qul h PHE 284 Ca 0.19 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2qul h PHE 284 Cb 0.15 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 2qul h PHE 284 CO 0.00 0.08 0.03 0.28 -2.23 0.00 0.00 178.31 176.47 2qul h VAL 285 N 0.30 1.20 -0.88 1.41 2.07 -0.73 -2.42 116.25 117.20 2qul h VAL 285 Ca 0.20 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 67.09 2qul h VAL 285 Cb 0.21 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 2qul h VAL 285 CO -0.22 0.19 0.58 0.03 0.02 0.00 0.00 177.57 178.17 2qul h ARG 286 N 0.04 1.13 -0.27 1.57 3.08 -0.98 -0.48 114.38 118.47 2qul h ARG 286 Ca 0.05 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2qul h ARG 286 Cb 0.27 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2qul h ARG 286 CO 0.00 0.75 -0.19 -0.44 -1.07 0.00 0.00 179.97 179.02 2qul h ASP 287 N 1.16 0.47 0.59 7.04 3.45 -1.12 0.92 116.42 128.93 2qul h ASP 287 Ca 0.33 -0.14 -0.16 0.00 0.43 0.00 0.00 57.03 57.49 2qul h ASP 287 Cb -0.10 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 38.53 2qul h ASP 287 CO -0.08 0.67 -0.71 0.11 -1.57 0.00 0.00 179.24 177.66 2qul h LYS 288 N 0.43 0.10 0.00 3.56 1.79 -0.88 -3.10 116.57 118.47 2qul h LYS 288 Ca 0.07 -0.09 -0.12 0.00 -2.18 0.00 0.00 60.65 58.34 2qul h LYS 288 Cb 0.58 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 2qul h LYS 288 CO 0.04 0.77 -0.57 -0.07 -1.08 0.00 0.00 179.45 178.53 2qul h LEU 289 N 0.07 0.00 0.00 2.94 3.38 -0.48 -3.47 115.31 117.75 2qul h LEU 289 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qul h LEU 289 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2qul h LEU 289 CO 0.10 0.57 0.00 0.00 0.09 0.00 0.00 178.44 179.20