#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qxw n ALA 1 N 0.00 0.85 0.19 3.04 0.00 -1.26 -4.93 120.51 118.39 2qxw n ALA 1 Ca 0.00 0.23 0.10 0.00 0.00 0.00 0.00 53.44 53.77 2qxw n ALA 1 Cb 0.00 -2.20 0.12 0.00 0.00 0.00 0.00 19.45 17.37 2qxw n ALA 1 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qxw h SER 2 N 1.75 0.00 -3.82 0.00 4.64 -2.00 -3.47 113.55 110.65 2qxw h SER 2 Ca -0.47 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.39 2qxw h SER 2 Cb 1.31 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.23 2qxw h SER 2 CO 0.58 0.10 -0.77 -0.13 -0.87 0.00 0.00 176.83 175.75 2qxw s ARG 3 N -3.18 1.14 -0.02 4.77 0.52 -1.26 -0.94 118.95 119.98 2qxw s ARG 3 Ca 0.05 -1.32 0.07 0.00 -0.52 0.00 0.00 55.73 54.01 2qxw s ARG 3 Cb 0.06 -1.08 -0.02 0.00 0.52 0.00 0.00 34.95 34.42 2qxw s ARG 3 CO 0.70 0.21 -0.22 -1.50 0.02 0.00 0.00 175.30 174.52 2qxw s ILE 4 N -2.14 2.43 -0.03 1.52 2.07 0.04 -4.88 121.20 120.21 2qxw s ILE 4 Ca 0.12 -1.01 -0.30 0.00 -1.41 0.00 0.00 60.65 58.05 2qxw s ILE 4 Cb -0.05 -1.90 -0.03 0.00 0.13 0.00 0.00 42.46 40.62 2qxw s ILE 4 CO 0.05 0.55 0.98 -0.22 -1.91 0.00 0.00 174.94 174.39 2qxw s LEU 5 N -0.75 4.34 0.41 8.50 2.96 -1.26 -0.70 118.68 132.17 2qxw s LEU 5 Ca 0.11 1.61 -0.01 0.00 -0.22 0.00 0.00 54.13 55.62 2qxw s LEU 5 Cb -0.10 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 2qxw s LEU 5 CO 0.00 -0.31 0.65 -0.76 -1.32 0.00 0.00 176.35 174.61 2qxw s LEU 6 N 1.28 3.80 0.00 -0.68 1.43 0.19 -4.96 118.68 119.73 2qxw s LEU 6 Ca 0.51 0.51 0.06 0.00 -1.03 0.00 0.00 54.13 54.18 2qxw s LEU 6 Cb -0.20 -3.39 0.39 0.00 0.03 0.00 0.00 46.19 43.01 2qxw s LEU 6 CO 0.25 -0.50 1.11 -0.46 0.23 0.00 0.00 176.35 176.98 2qxw n ASN 7 N -2.00 0.00 -1.03 2.29 0.23 -1.26 -1.05 115.26 112.43 2qxw n ASN 7 Ca -0.02 -1.49 0.12 0.00 -0.53 0.00 0.00 54.58 52.66 2qxw n ASN 7 Cb 0.56 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.49 2qxw n ASN 7 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2qxw n ASN 8 N -0.62 3.11 0.00 0.53 6.94 -1.26 -4.97 115.26 118.98 2qxw n ASN 8 Ca 0.05 -1.95 0.00 0.00 -0.02 0.00 0.00 54.58 52.66 2qxw n ASN 8 Cb 0.02 -0.18 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 2qxw n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qxw n GLY 9 N 1.43 1.27 3.94 4.83 0.00 -0.22 -5.05 105.19 111.39 2qxw n GLY 9 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 2qxw n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qxw s ALA 10 N -3.16 3.68 -0.11 4.61 0.00 -1.26 -4.86 121.76 120.66 2qxw s ALA 10 Ca 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.03 2qxw s ALA 10 Cb 0.00 -2.13 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 2qxw s ALA 10 CO 0.00 -0.04 0.01 0.15 0.00 0.00 0.00 175.76 175.89 2qxw s LYS 11 N -4.33 3.27 -0.14 0.00 1.02 -1.26 -0.64 119.74 117.66 2qxw s LYS 11 Ca 0.40 -0.40 0.01 0.00 0.02 0.00 0.00 55.97 56.01 2qxw s LYS 11 Cb -0.10 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.31 2qxw s LYS 11 CO 0.36 0.57 -0.16 1.41 -0.92 0.00 0.00 175.35 176.61 2qxw s MET 12 N -0.51 3.23 0.22 1.68 -2.45 0.12 -4.89 119.30 116.69 2qxw s MET 12 Ca 0.09 -0.76 -0.31 0.00 -1.25 0.00 0.00 55.69 53.46 2qxw s MET 12 Cb -0.12 -2.56 -0.11 0.00 1.25 0.00 0.00 34.83 33.29 2qxw s MET 12 CO 0.02 0.11 1.61 -2.14 1.05 0.00 0.00 175.02 175.67 2qxw s PRO 13 N 0.58 4.17 0.48 4.11 0.02 -1.26 -0.78 135.00 142.32 2qxw s PRO 13 Ca -0.10 2.49 0.27 0.00 0.02 0.00 0.00 61.00 63.68 2qxw s PRO 13 Cb -0.16 -3.09 0.83 0.00 0.02 0.00 0.00 34.50 32.10 2qxw s PRO 13 CO 0.03 -0.64 1.79 -0.84 -0.33 0.00 0.00 177.00 177.01 2qxw h ILE 14 N 3.75 0.12 -3.48 2.83 3.07 -1.38 -3.41 117.51 119.01 2qxw h ILE 14 Ca -0.44 -0.88 -0.61 0.00 1.55 0.00 0.00 64.86 64.47 2qxw h ILE 14 Cb 1.21 1.79 -0.13 0.00 -0.27 0.00 0.00 36.82 39.41 2qxw h ILE 14 CO 0.89 0.06 -0.47 -0.76 -1.05 0.00 0.00 178.15 176.81 2qxw s LEU 15 N -6.28 4.15 0.20 0.16 2.01 -1.26 -0.87 118.68 116.78 2qxw s LEU 15 Ca 0.04 0.19 0.02 0.00 0.01 0.00 0.00 54.13 54.39 2qxw s LEU 15 Cb 0.07 -2.14 -0.05 0.00 0.01 0.00 0.00 46.19 44.09 2qxw s LEU 15 CO 0.62 0.09 0.00 -0.83 1.01 0.00 0.00 176.35 177.24 2qxw s GLY 16 N 0.84 1.37 -0.24 -3.19 0.00 -0.40 -4.18 107.32 101.52 2qxw s GLY 16 Ca 0.09 -1.67 -0.16 0.00 0.00 0.00 0.00 44.72 42.98 2qxw s GLY 16 CO 0.03 -1.58 0.41 -2.27 0.00 0.00 0.00 173.10 169.69 2qxw s LEU 17 N -3.23 4.09 0.50 0.66 2.96 -0.23 -3.29 118.68 120.15 2qxw s LEU 17 Ca 0.26 0.44 -0.19 0.00 -0.22 0.00 0.00 54.13 54.43 2qxw s LEU 17 Cb 0.06 -2.51 -0.08 0.00 0.50 0.00 0.00 46.19 44.16 2qxw s LEU 17 CO 0.06 -0.15 1.01 -0.83 -1.32 0.00 0.00 176.35 175.12 2qxw s GLY 18 N 1.34 2.29 0.00 7.98 0.00 -0.42 -0.88 107.32 117.63 2qxw s GLY 18 Ca 0.18 0.41 0.00 0.00 0.00 0.00 0.00 44.72 45.31 2qxw s GLY 18 CO 0.09 0.71 0.26 -1.30 0.00 0.00 0.00 173.10 172.86 2qxw n THR 19 N -1.28 0.03 -2.12 0.90 -2.24 -1.16 -4.14 114.28 104.28 2qxw n THR 19 Ca 0.08 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 2qxw n THR 19 Cb 0.53 1.50 -0.03 0.00 -2.10 0.00 0.00 70.33 70.23 2qxw n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2qxw s TRP 20 N -0.03 3.10 0.00 4.78 -0.00 -1.26 -2.19 118.94 123.33 2qxw s TRP 20 Ca 0.00 0.83 0.00 0.00 -0.00 0.00 0.00 56.10 56.93 2qxw s TRP 20 Cb 0.00 -3.74 0.00 0.00 -0.00 0.00 0.00 33.47 29.73 2qxw s TRP 20 CO 0.00 -2.68 0.00 1.63 -0.00 0.00 0.00 176.95 175.90 2qxw n LYS 21 N 4.27 0.00 -2.22 5.86 5.02 -1.26 -5.01 118.16 124.82 2qxw n LYS 21 Ca 0.12 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 2qxw n LYS 21 Cb 0.42 -2.04 -0.02 0.00 -0.02 0.00 0.00 35.03 33.36 2qxw n LYS 21 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qxw s SER 22 N -3.20 6.64 0.55 4.39 0.01 -0.93 -4.95 113.70 116.20 2qxw s SER 22 Ca 0.00 1.72 -0.21 0.00 1.31 0.00 0.00 55.95 58.77 2qxw s SER 22 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 2qxw s SER 22 CO 0.00 -1.03 1.31 -2.84 0.41 0.00 0.00 173.24 171.10 2qxw s PRO 23 N 4.15 3.14 0.44 12.44 0.02 -1.26 -4.66 135.00 149.26 2qxw s PRO 23 Ca 0.65 2.12 0.11 0.00 0.02 0.00 0.00 61.00 63.91 2qxw s PRO 23 Cb -0.25 -2.20 1.00 0.00 0.02 0.00 0.00 34.50 33.08 2qxw s PRO 23 CO 0.24 -1.15 2.05 -1.35 -0.33 0.00 0.00 177.00 176.46 2qxw h PRO 24 N 1.38 0.38 0.00 5.54 0.11 -1.92 0.49 132.00 137.99 2qxw h PRO 24 Ca -0.51 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2qxw h PRO 24 Cb 1.30 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qxw h PRO 24 CO 0.57 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 179.02 2qxw n GLY 25 N -1.51 -1.13 0.00 -0.55 0.00 -1.26 -3.75 105.19 97.00 2qxw n GLY 25 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2qxw n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qxw n GLN 26 N -1.20 1.89 0.17 1.61 6.02 -0.07 -4.81 117.38 120.99 2qxw n GLN 26 Ca 0.16 -0.01 0.03 0.00 -0.01 0.00 0.00 57.00 57.18 2qxw n GLN 26 Cb 0.19 -1.03 0.26 0.00 1.02 0.00 0.00 30.24 30.68 2qxw n GLN 26 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 2qxw h VAL 27 N 0.00 1.04 -0.03 5.09 3.04 -1.08 -1.78 116.25 122.52 2qxw h VAL 27 Ca -0.02 -1.76 -0.00 0.00 -1.01 0.00 0.00 66.70 63.91 2qxw h VAL 27 Cb 0.56 2.04 -0.00 0.00 -2.01 0.00 0.00 31.29 31.88 2qxw h VAL 27 CO 0.00 0.45 0.02 0.74 -1.01 0.00 0.00 177.57 177.77 2qxw h THR 28 N 0.00 1.08 -0.82 3.17 2.02 -1.75 -0.77 112.91 115.84 2qxw h THR 28 Ca -0.00 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.90 2qxw h THR 28 Cb 1.00 1.19 -0.04 0.00 -1.74 0.00 0.00 68.15 68.57 2qxw h THR 28 CO 0.06 0.07 0.42 -0.08 0.37 0.00 0.00 175.52 176.35 2qxw h GLU 29 N -0.05 1.17 -0.37 6.66 4.81 -1.86 -1.25 114.58 123.69 2qxw h GLU 29 Ca 0.01 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 2qxw h GLU 29 Cb 0.10 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2qxw h GLU 29 CO -0.00 0.88 0.23 0.00 -0.73 0.00 0.00 179.01 179.39 2qxw h ALA 30 N 1.29 0.47 -0.43 2.92 0.00 -0.99 -0.29 119.26 122.23 2qxw h ALA 30 Ca 0.29 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 2qxw h ALA 30 Cb 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2qxw h ALA 30 CO -0.04 -0.11 -0.25 0.28 0.00 0.00 0.00 179.25 179.14 2qxw h VAL 31 N 0.46 1.27 -0.17 0.00 2.07 -0.96 -0.10 116.25 118.83 2qxw h VAL 31 Ca 0.14 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.28 2qxw h VAL 31 Cb -0.02 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 2qxw h VAL 31 CO -0.05 0.47 0.03 0.11 0.02 0.00 0.00 177.57 178.16 2qxw h LYS 32 N 0.77 0.10 -0.40 1.57 1.57 -0.92 -0.52 116.57 118.75 2qxw h LYS 32 Ca 0.10 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2qxw h LYS 32 Cb 0.80 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 2qxw h LYS 32 CO 0.07 0.07 0.26 0.28 -0.57 0.00 0.00 179.45 179.55 2qxw h VAL 33 N 0.10 1.11 -0.15 0.50 2.07 -0.95 -0.79 116.25 118.14 2qxw h VAL 33 Ca 0.08 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.41 2qxw h VAL 33 Cb 0.07 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 2qxw h VAL 33 CO -0.10 0.11 -0.08 0.00 0.02 0.00 0.00 177.57 177.52 2qxw h ALA 34 N 1.13 0.05 -0.73 1.67 0.00 -0.73 -0.76 119.26 119.90 2qxw h ALA 34 Ca 0.15 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2qxw h ALA 34 Cb -0.04 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2qxw h ALA 34 CO -0.03 -0.52 0.41 0.82 0.00 0.00 0.00 179.25 179.93 2qxw h ILE 35 N -0.06 1.22 -0.30 0.00 2.04 -0.91 0.05 117.51 119.53 2qxw h ILE 35 Ca 0.09 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.43 2qxw h ILE 35 Cb 0.19 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 2qxw h ILE 35 CO -0.20 0.24 0.20 0.44 0.00 0.00 0.00 178.15 178.83 2qxw h ASP 36 N 1.00 0.33 -0.22 1.72 3.32 -0.35 -2.53 116.42 119.69 2qxw h ASP 36 Ca 0.26 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2qxw h ASP 36 Cb 0.02 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.49 2qxw h ASP 36 CO -0.04 0.24 0.00 1.33 -1.72 0.00 0.00 179.24 179.05 2qxw n VAL 37 N -4.49 0.27 0.00 -1.35 0.24 -0.37 -4.94 118.33 107.69 2qxw n VAL 37 Ca 0.02 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 2qxw n VAL 37 Cb 0.08 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.30 2qxw n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qxw n GLY 38 N 1.33 1.29 3.77 7.63 0.00 -0.80 -5.04 105.19 113.38 2qxw n GLY 38 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2qxw n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qxw s TYR 39 N -1.53 2.82 -0.02 1.61 1.51 -0.06 -4.90 117.35 116.79 2qxw s TYR 39 Ca 0.00 1.32 0.01 0.00 -1.01 0.00 0.00 57.07 57.39 2qxw s TYR 39 Cb 0.00 -3.82 -0.01 0.00 -0.11 0.00 0.00 41.96 38.02 2qxw s TYR 39 CO 0.00 -2.36 0.03 0.54 -1.11 0.00 0.00 175.55 172.65 2qxw n ARG 40 N 0.55 2.60 -4.90 -0.62 5.12 -1.26 -4.19 116.66 113.96 2qxw n ARG 40 Ca 0.01 -0.01 -0.32 0.00 -1.93 0.00 0.00 57.85 55.60 2qxw n ARG 40 Cb 0.41 -0.84 -0.17 0.00 -1.16 0.00 0.00 32.46 30.70 2qxw n ARG 40 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2qxw s HIS 41 N -1.70 2.59 -0.09 -1.55 2.46 -1.26 -0.46 115.29 115.29 2qxw s HIS 41 Ca -0.00 -1.20 0.03 0.00 0.47 0.00 0.00 55.06 54.36 2qxw s HIS 41 Cb 0.01 -1.75 0.01 0.00 -0.13 0.00 0.00 32.58 30.71 2qxw s HIS 41 CO 0.04 -0.52 -0.19 -1.50 -2.47 0.00 0.00 174.74 170.10 2qxw s ILE 42 N 0.62 1.70 -0.26 0.89 2.07 -0.94 -1.06 121.20 124.21 2qxw s ILE 42 Ca -0.12 -0.81 -0.11 0.00 -1.41 0.00 0.00 60.65 58.20 2qxw s ILE 42 Cb -0.17 -1.49 -0.05 0.00 0.13 0.00 0.00 42.46 40.88 2qxw s ILE 42 CO 0.03 0.48 0.20 -0.62 -1.91 0.00 0.00 174.94 173.11 2qxw s ASP 43 N 0.48 6.10 0.34 4.50 2.15 -0.06 -1.75 116.67 128.43 2qxw s ASP 43 Ca -0.17 0.09 0.04 0.00 0.43 0.00 0.00 52.55 52.94 2qxw s ASP 43 Cb -0.17 -2.12 -0.06 0.00 -0.30 0.00 0.00 42.92 40.26 2qxw s ASP 43 CO 0.07 -0.01 0.06 0.00 -0.17 0.00 0.00 175.17 175.12 2qxw s ALA 45 N -3.21 -1.85 0.25 0.00 0.00 -1.26 -3.78 121.76 111.90 2qxw s ALA 45 Ca 0.35 1.62 -0.05 0.00 0.00 0.00 0.00 51.96 53.89 2qxw s ALA 45 Cb 0.08 -0.67 0.34 0.00 0.00 0.00 0.00 23.12 22.88 2qxw s ALA 45 CO 0.16 -0.32 1.88 1.25 0.00 0.00 0.00 175.76 178.72 2qxw h HIS 46 N 3.43 1.12 0.00 0.00 -0.00 -1.98 -1.66 115.15 116.06 2qxw h HIS 46 Ca -0.25 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.15 2qxw h HIS 46 Cb 1.16 -0.37 0.00 0.00 -0.00 0.00 0.00 27.41 28.20 2qxw h HIS 46 CO 0.35 0.60 0.00 -0.24 -0.00 0.00 0.00 177.93 178.64 2qxw h VAL 47 N 1.12 0.00 0.00 5.26 3.04 -1.96 -2.05 116.25 121.67 2qxw h VAL 47 Ca 0.39 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.86 2qxw h VAL 47 Cb 0.10 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.53 2qxw h VAL 47 CO -0.15 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.19 2qxw n TYR 48 N -2.93 0.88 -1.51 3.17 4.01 -0.62 -4.91 117.16 115.25 2qxw n TYR 48 Ca -0.01 0.32 -0.13 0.00 -0.16 0.00 0.00 57.90 57.93 2qxw n TYR 48 Cb 0.18 -1.02 -0.05 0.00 -0.31 0.00 0.00 39.34 38.14 2qxw n TYR 48 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2qxw n GLN 49 N -2.28 -0.90 -0.25 -0.72 6.02 -0.77 -4.79 117.38 113.68 2qxw n GLN 49 Ca 0.03 0.89 0.02 0.00 -0.01 0.00 0.00 57.00 57.92 2qxw n GLN 49 Cb 0.28 -4.95 0.02 0.00 1.02 0.00 0.00 30.24 26.61 2qxw n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2qxw n ASN 50 N -0.09 0.55 0.10 1.08 0.23 -1.26 -4.84 115.26 111.02 2qxw n ASN 50 Ca -0.13 -1.90 0.00 0.00 -0.53 0.00 0.00 54.58 52.02 2qxw n ASN 50 Cb 0.45 -0.17 0.32 0.00 -2.08 0.00 0.00 39.78 38.30 2qxw n ASN 50 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2qxw h GLU 51 N 0.00 0.27 -0.53 -3.83 5.08 -1.88 -1.35 114.58 112.33 2qxw h GLU 51 Ca 0.00 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2qxw h GLU 51 Cb 1.15 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.34 2qxw h GLU 51 CO 0.00 0.49 0.31 -0.97 -1.00 0.00 0.00 179.01 177.83 2qxw h ASN 52 N 0.24 0.49 -0.02 1.42 -1.24 -1.89 0.67 115.58 115.26 2qxw h ASN 52 Ca 0.04 0.01 -0.17 0.00 0.71 0.00 0.00 56.30 56.89 2qxw h ASN 52 Cb 0.54 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 39.49 2qxw h ASN 52 CO 0.04 0.34 -0.57 -0.33 -1.29 0.00 0.00 177.43 175.62 2qxw h GLU 53 N 0.61 0.61 -0.43 6.67 3.07 -1.74 -1.00 114.58 122.38 2qxw h GLU 53 Ca 0.22 -0.40 0.03 0.00 -0.50 0.00 0.00 59.36 58.71 2qxw h GLU 53 Cb 0.05 0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 27.97 2qxw h GLU 53 CO -0.11 1.02 0.22 0.28 -1.40 0.00 0.00 179.01 179.02 2qxw h VAL 54 N 0.47 0.98 -0.79 3.13 2.07 -1.05 -2.85 116.25 118.21 2qxw h VAL 54 Ca 0.00 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2qxw h VAL 54 Cb 1.13 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 2qxw h VAL 54 CO 0.11 0.08 0.49 1.23 0.02 0.00 0.00 177.57 179.50 2qxw h GLY 55 N 0.45 1.13 0.68 2.17 0.00 -0.45 -1.55 103.07 105.50 2qxw h GLY 55 Ca 0.19 -0.46 0.06 0.00 0.00 0.00 0.00 47.33 47.12 2qxw h GLY 55 CO -0.13 0.44 0.40 -2.08 0.00 0.00 0.00 176.54 175.18 2qxw h VAL 56 N 1.08 0.98 -0.08 4.60 2.07 -0.96 0.01 116.25 123.95 2qxw h VAL 56 Ca 0.29 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 2qxw h VAL 56 Cb -0.07 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 29.88 2qxw h VAL 56 CO -0.06 0.14 0.02 0.00 0.02 0.00 0.00 177.57 177.69 2qxw h ALA 57 N 1.36 0.11 -0.18 1.67 0.00 -1.25 -1.00 119.26 119.96 2qxw h ALA 57 Ca 0.32 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2qxw h ALA 57 Cb 0.19 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2qxw h ALA 57 CO -0.18 -0.27 -0.09 0.82 0.00 0.00 0.00 179.25 179.52 2qxw h ILE 58 N -0.08 0.71 -0.81 0.00 2.04 -0.99 -1.25 117.51 117.13 2qxw h ILE 58 Ca 0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 2qxw h ILE 58 Cb 0.24 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2qxw h ILE 58 CO -0.00 0.00 0.43 1.56 0.00 0.00 0.00 178.15 180.14 2qxw h GLN 59 N -0.08 1.13 -0.55 2.37 1.08 -0.94 -0.65 115.11 117.47 2qxw h GLN 59 Ca 0.10 -0.14 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 2qxw h GLN 59 Cb 0.23 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 2qxw h GLN 59 CO -0.23 0.85 0.23 1.49 -0.95 0.00 0.00 178.83 180.21 2qxw h GLU 60 N 1.12 0.82 -0.10 1.46 4.57 -0.88 0.69 114.58 122.27 2qxw h GLU 60 Ca 0.28 -0.14 -0.13 0.00 -1.18 0.00 0.00 59.36 58.19 2qxw h GLU 60 Cb 0.05 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 2qxw h GLU 60 CO -0.04 0.71 -0.50 0.87 -1.18 0.00 0.00 179.01 178.87 2qxw h LYS 61 N 0.75 0.27 -0.36 1.92 1.79 -0.84 0.21 116.57 120.31 2qxw h LYS 61 Ca 0.18 -0.15 -0.05 0.00 -2.18 0.00 0.00 60.65 58.45 2qxw h LYS 61 Cb 0.19 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 2qxw h LYS 61 CO -0.02 0.71 0.02 -0.07 -1.08 0.00 0.00 179.45 179.01 2qxw h LEU 62 N 0.22 0.62 -0.63 2.94 3.38 -0.94 -1.49 115.31 119.40 2qxw h LEU 62 Ca 0.01 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 2qxw h LEU 62 Cb 0.96 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2qxw h LEU 62 CO 0.08 0.76 0.21 -0.09 0.09 0.00 0.00 178.44 179.49 2qxw h ARG 63 N 0.45 0.98 0.00 1.13 2.43 -0.58 -1.24 114.38 117.55 2qxw h ARG 63 Ca 0.11 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2qxw h ARG 63 Cb 0.43 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2qxw h ARG 63 CO 0.02 0.86 0.00 0.39 -1.51 0.00 0.00 179.97 179.72 2qxw n GLU 64 N -4.38 0.17 -2.96 0.20 1.02 0.04 -4.89 120.64 109.84 2qxw n GLU 64 Ca 0.04 0.46 -0.21 0.00 -0.02 0.00 0.00 57.16 57.43 2qxw n GLU 64 Cb 0.21 -1.87 0.03 0.00 -0.02 0.00 0.00 31.44 29.79 2qxw n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2qxw n GLN 65 N -2.20 -4.56 0.03 3.49 6.02 -0.47 -4.88 117.38 114.80 2qxw n GLN 65 Ca 0.01 0.85 -0.06 0.00 -0.01 0.00 0.00 57.00 57.80 2qxw n GLN 65 Cb 0.18 -5.59 0.14 0.00 1.02 0.00 0.00 30.24 25.99 2qxw n GLN 65 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2qxw h VAL 66 N -1.29 1.31 -3.92 5.09 2.07 -1.54 -3.46 116.25 114.51 2qxw h VAL 66 Ca -0.50 -1.58 -0.11 0.00 0.82 0.00 0.00 66.70 65.33 2qxw h VAL 66 Cb 1.34 1.62 -0.16 0.00 -1.52 0.00 0.00 31.29 32.58 2qxw h VAL 66 CO 0.53 0.49 -0.52 0.54 0.02 0.00 0.00 177.57 178.64 2qxw s VAL 67 N -4.18 0.16 0.17 2.57 0.11 -1.23 -5.07 120.40 112.92 2qxw s VAL 67 Ca -0.06 -1.32 0.02 0.00 -2.93 0.00 0.00 61.98 57.69 2qxw s VAL 67 Cb 0.13 -1.21 -0.04 0.00 -1.53 0.00 0.00 36.38 33.73 2qxw s VAL 67 CO 0.81 -0.73 0.32 -0.54 -3.33 0.00 0.00 175.10 171.63 2qxw s LYS 68 N -3.38 3.46 0.32 1.54 1.02 -1.26 -4.39 119.74 117.05 2qxw s LYS 68 Ca 0.02 -0.56 0.02 0.00 0.02 0.00 0.00 55.97 55.47 2qxw s LYS 68 Cb 0.03 -2.93 0.59 0.00 -0.52 0.00 0.00 37.83 35.00 2qxw s LYS 68 CO -0.08 0.48 1.94 -0.09 -0.92 0.00 0.00 175.35 176.68 2qxw h ARG 69 N 1.99 0.92 0.00 1.68 9.65 -1.95 -0.80 114.38 125.87 2qxw h ARG 69 Ca -0.49 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.33 2qxw h ARG 69 Cb 1.20 -0.21 -0.00 0.00 -1.39 0.00 0.00 29.97 29.57 2qxw h ARG 69 CO 0.68 0.61 -0.05 1.05 2.80 0.00 0.00 179.97 185.05 2qxw h GLU 70 N 0.95 0.00 0.00 0.20 4.11 -2.04 -1.69 114.58 116.12 2qxw h GLU 70 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.78 2qxw h GLU 70 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2qxw h GLU 70 CO -0.12 0.05 -0.30 0.39 0.07 0.00 0.00 179.01 179.10 2qxw n GLU 71 N -3.59 0.20 -3.42 1.06 1.02 -0.31 -4.87 120.64 110.72 2qxw n GLU 71 Ca -0.02 0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.92 2qxw n GLU 71 Cb 0.16 -1.67 -0.04 0.00 -0.02 0.00 0.00 31.44 29.86 2qxw n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qxw s LEU 72 N -3.98 4.14 -0.30 -4.62 1.43 -0.64 -4.83 118.68 109.88 2qxw s LEU 72 Ca 0.10 0.80 -0.00 0.00 -1.03 0.00 0.00 54.13 53.99 2qxw s LEU 72 Cb 0.14 -3.58 0.10 0.00 0.03 0.00 0.00 46.19 42.88 2qxw s LEU 72 CO 0.65 -0.10 0.08 0.12 0.23 0.00 0.00 176.35 177.33 2qxw s PHE 73 N -1.89 1.91 -0.18 0.29 2.19 0.40 -4.94 117.98 115.74 2qxw s PHE 73 Ca 0.45 -1.82 -0.04 0.00 0.33 0.00 0.00 56.93 55.85 2qxw s PHE 73 Cb -0.11 -1.80 -0.02 0.00 -1.31 0.00 0.00 43.02 39.78 2qxw s PHE 73 CO 0.25 -0.87 -0.02 0.42 1.83 0.00 0.00 175.22 176.83 2qxw s ILE 74 N 1.55 3.83 -0.10 3.12 1.09 -1.26 -2.22 121.20 127.21 2qxw s ILE 74 Ca 0.09 -0.36 0.01 0.00 -1.10 0.00 0.00 60.65 59.28 2qxw s ILE 74 Cb -0.17 -2.71 -0.02 0.00 -1.06 0.00 0.00 42.46 38.49 2qxw s ILE 74 CO -0.22 0.45 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.27 2qxw s VAL 75 N 0.82 3.24 0.20 2.92 1.01 -0.72 -1.20 120.40 126.67 2qxw s VAL 75 Ca -0.00 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.40 2qxw s VAL 75 Cb -0.14 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 2qxw s VAL 75 CO 0.02 0.55 0.15 -0.24 0.00 0.00 0.00 175.10 175.58 2qxw n SER 76 N 2.97 -0.14 -3.80 3.32 2.88 -0.74 -0.71 113.62 117.39 2qxw n SER 76 Ca -0.18 -2.28 -0.13 0.00 -1.33 0.00 0.00 58.87 54.95 2qxw n SER 76 Cb 0.53 0.91 -0.12 0.00 -0.75 0.00 0.00 64.21 64.78 2qxw n SER 76 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2qxw s LYS 77 N -2.82 0.22 -0.19 -1.46 1.02 -1.25 -1.15 119.74 114.12 2qxw s LYS 77 Ca 0.21 0.28 -0.29 0.00 0.02 0.00 0.00 55.97 56.19 2qxw s LYS 77 Cb 0.01 0.09 -0.00 0.00 -0.52 0.00 0.00 37.83 37.41 2qxw s LYS 77 CO 0.15 -0.04 1.16 -1.17 -0.92 0.00 0.00 175.35 174.53 2qxw s LEU 78 N 0.18 4.15 0.66 3.17 2.96 0.49 -3.80 118.68 126.50 2qxw s LEU 78 Ca -0.01 1.56 -0.11 0.00 -0.22 0.00 0.00 54.13 55.36 2qxw s LEU 78 Cb -0.02 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.12 2qxw s LEU 78 CO -0.00 -0.70 1.05 0.86 -1.32 0.00 0.00 176.35 176.23 2qxw s TRP 79 N 3.26 3.33 0.51 5.38 -0.11 -1.26 -2.07 118.94 127.98 2qxw s TRP 79 Ca 0.50 1.37 0.20 0.00 1.22 0.00 0.00 56.10 59.39 2qxw s TRP 79 Cb -0.19 -2.81 1.36 0.00 -1.50 0.00 0.00 33.47 30.33 2qxw s TRP 79 CO 0.11 -1.00 2.13 0.00 -4.62 0.00 0.00 176.95 173.57 2qxw n THR 81 N -4.21 0.06 -1.41 0.00 -2.24 -1.26 -0.54 114.28 104.68 2qxw n THR 81 Ca -0.03 -0.07 0.07 0.00 -2.27 0.00 0.00 64.05 61.75 2qxw n THR 81 Cb 0.14 -0.03 0.12 0.00 -2.10 0.00 0.00 70.33 68.46 2qxw n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2qxw n TYR 82 N -0.42 0.00 0.25 4.78 4.01 -0.67 -4.19 117.16 120.92 2qxw n TYR 82 Ca 0.06 -0.84 0.14 0.00 -0.16 0.00 0.00 57.90 57.10 2qxw n TYR 82 Cb 0.07 -0.14 0.50 0.00 -0.31 0.00 0.00 39.34 39.45 2qxw n TYR 82 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2qxw h HIS 83 N 0.19 0.00 -4.22 -0.72 3.86 -1.70 -3.33 115.15 109.24 2qxw h HIS 83 Ca -0.01 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.67 2qxw h HIS 83 Cb 1.13 0.00 0.19 0.00 1.06 0.00 0.00 27.41 29.78 2qxw h HIS 83 CO 0.14 0.05 0.32 -1.21 0.86 0.00 0.00 177.93 178.08 2qxw s GLU 84 N -3.52 1.51 0.21 2.45 8.01 -1.26 -4.61 118.70 121.48 2qxw s GLU 84 Ca 0.03 1.73 -0.11 0.00 0.01 0.00 0.00 54.97 56.63 2qxw s GLU 84 Cb 0.08 -1.76 0.28 0.00 -4.31 0.00 0.00 34.13 28.42 2qxw s GLU 84 CO 0.60 -2.31 1.69 -0.22 0.01 0.00 0.00 175.26 175.02 2qxw h LYS 85 N -1.08 0.18 -0.00 1.61 3.64 -1.89 -2.54 116.57 116.47 2qxw h LYS 85 Ca -0.46 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2qxw h LYS 85 Cb 1.29 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2qxw h LYS 85 CO 0.45 0.12 -0.01 0.41 -2.27 0.00 0.00 179.45 178.15 2qxw n GLY 86 N -1.33 -0.81 0.00 5.01 0.00 -1.26 -3.65 105.19 103.14 2qxw n GLY 86 Ca 0.09 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.90 2qxw n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qxw n LEU 87 N -0.78 0.05 -0.05 0.99 4.77 -0.97 -4.75 117.00 116.26 2qxw n LEU 87 Ca 0.21 -0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 56.04 2qxw n LEU 87 Cb 0.19 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.23 2qxw n LEU 87 CO 0.19 0.01 0.86 0.58 -1.33 0.00 0.00 177.39 177.70 2qxw h VAL 88 N 0.00 1.15 -0.27 4.08 2.07 -1.60 -1.72 116.25 119.96 2qxw h VAL 88 Ca 0.00 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.07 2qxw h VAL 88 Cb 0.45 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2qxw h VAL 88 CO 0.00 0.15 0.17 0.50 0.02 0.00 0.00 177.57 178.40 2qxw h LYS 89 N 0.15 0.33 -0.41 1.57 3.64 -1.86 -1.09 116.57 118.91 2qxw h LYS 89 Ca 0.06 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2qxw h LYS 89 Cb 0.16 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2qxw h LYS 89 CO -0.01 0.22 0.03 0.78 -2.27 0.00 0.00 179.45 178.20 2qxw h GLY 90 N 0.34 0.68 0.94 5.01 0.00 -1.83 0.29 103.07 108.52 2qxw h GLY 90 Ca 0.10 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2qxw h GLY 90 CO -0.04 0.38 0.16 0.00 0.00 0.00 0.00 176.54 177.05 2qxw h ALA 91 N 1.43 0.51 -0.42 3.60 0.00 -0.96 0.05 119.26 123.47 2qxw h ALA 91 Ca 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qxw h ALA 91 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2qxw h ALA 91 CO 0.01 0.10 0.22 0.00 0.00 0.00 0.00 179.25 179.58 2qxw h GLN 93 N 0.54 0.39 -0.34 0.00 4.20 -0.20 0.70 115.11 120.40 2qxw h GLN 93 Ca 0.15 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2qxw h GLN 93 Cb 0.08 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 2qxw h GLN 93 CO -0.02 0.54 0.14 -0.22 -0.67 0.00 0.00 178.83 178.60 2qxw h LYS 94 N 0.36 0.51 -0.53 1.46 1.63 -0.81 0.51 116.57 119.70 2qxw h LYS 94 Ca 0.07 -0.09 0.02 0.00 -0.85 0.00 0.00 60.65 59.79 2qxw h LYS 94 Cb 0.49 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.00 2qxw h LYS 94 CO 0.03 0.50 0.34 1.15 -3.45 0.00 0.00 179.45 178.02 2qxw h THR 95 N 0.41 1.10 -0.55 1.00 2.02 -0.89 0.28 112.91 116.27 2qxw h THR 95 Ca 0.11 -0.23 0.01 0.00 0.77 0.00 0.00 66.41 67.07 2qxw h THR 95 Cb 0.18 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 2qxw h THR 95 CO -0.01 0.12 0.36 -0.07 0.37 0.00 0.00 175.52 176.29 2qxw h LEU 96 N 0.68 0.61 -0.47 2.58 3.38 -0.60 0.19 115.31 121.68 2qxw h LEU 96 Ca 0.21 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2qxw h LEU 96 Cb -0.03 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2qxw h LEU 96 CO -0.07 0.44 0.23 0.28 0.09 0.00 0.00 178.44 179.41 2qxw h SER 97 N 0.72 0.61 -0.41 -0.43 0.02 -0.61 1.10 113.55 114.56 2qxw h SER 97 Ca 0.21 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2qxw h SER 97 Cb -0.06 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 2qxw h SER 97 CO -0.06 0.56 0.12 0.44 -1.14 0.00 0.00 176.83 176.75 2qxw h ASP 98 N 0.62 0.60 0.92 3.07 3.32 -0.67 -0.69 116.42 123.59 2qxw h ASP 98 Ca 0.16 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2qxw h ASP 98 Cb 0.11 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2qxw h ASP 98 CO -0.02 0.66 0.00 0.18 -1.72 0.00 0.00 179.24 178.34 2qxw n LEU 99 N -4.58 0.43 -3.26 1.55 4.77 0.65 -4.00 117.00 112.56 2qxw n LEU 99 Ca -0.00 0.57 -0.23 0.00 -0.03 0.00 0.00 56.01 56.32 2qxw n LEU 99 Cb 0.19 -0.48 0.06 0.00 -2.33 0.00 0.00 43.42 40.86 2qxw n LEU 99 CO 0.38 -0.29 0.12 0.29 -1.33 0.00 0.00 177.39 176.56 2qxw n LYS 100 N -1.94 -6.38 -3.88 3.23 5.02 0.35 -4.49 118.16 110.08 2qxw n LYS 100 Ca 0.04 0.86 -0.22 0.00 -2.02 0.00 0.00 58.31 56.97 2qxw n LYS 100 Cb 0.29 -5.79 -0.05 0.00 -0.02 0.00 0.00 35.03 29.47 2qxw n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qxw s LEU 101 N -6.90 3.44 -0.02 -0.35 1.43 0.39 -4.96 118.68 111.70 2qxw s LEU 101 Ca 0.44 -0.65 0.20 0.00 -1.03 0.00 0.00 54.13 53.09 2qxw s LEU 101 Cb -0.19 -2.00 -0.23 0.00 0.03 0.00 0.00 46.19 43.79 2qxw s LEU 101 CO 0.55 -0.40 0.53 0.47 0.23 0.00 0.00 176.35 177.73 2qxw n ASP 102 N -1.33 0.29 -3.80 2.29 8.00 -1.26 -4.51 116.55 116.23 2qxw n ASP 102 Ca -0.01 0.12 -0.10 0.00 0.71 0.00 0.00 54.79 55.50 2qxw n ASP 102 Cb 0.61 1.19 -0.07 0.00 -0.02 0.00 0.00 41.12 42.82 2qxw n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2qxw s TYR 103 N -3.14 -0.01 -0.00 1.24 1.13 -1.26 -4.77 117.35 110.54 2qxw s TYR 103 Ca -0.06 -0.23 -0.04 0.00 -1.41 0.00 0.00 57.07 55.32 2qxw s TYR 103 Cb 0.10 0.03 -0.04 0.00 -1.10 0.00 0.00 41.96 40.96 2qxw s TYR 103 CO 0.86 -0.50 0.21 -0.51 -2.51 0.00 0.00 175.55 173.10 2qxw s LEU 104 N -2.30 4.37 0.24 -3.49 1.43 -0.39 -4.98 118.68 113.56 2qxw s LEU 104 Ca -0.02 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.56 2qxw s LEU 104 Cb 0.01 -2.65 0.27 0.00 0.03 0.00 0.00 46.19 43.85 2qxw s LEU 104 CO -0.06 0.25 1.57 0.44 0.23 0.00 0.00 176.35 178.79 2qxw h ASP 105 N 3.85 0.20 -3.43 2.29 3.32 -1.50 0.56 116.42 121.71 2qxw h ASP 105 Ca -0.49 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 56.35 2qxw h ASP 105 Cb 1.19 -0.06 -0.25 0.00 0.22 0.00 0.00 39.33 40.43 2qxw h ASP 105 CO 0.68 0.76 -0.21 -0.22 -1.72 0.00 0.00 179.24 178.53 2qxw s LEU 106 N -7.83 -0.09 -0.09 1.55 2.96 -1.07 -2.02 118.68 112.09 2qxw s LEU 106 Ca -0.03 0.99 0.02 0.00 -0.22 0.00 0.00 54.13 54.88 2qxw s LEU 106 Cb 0.12 1.56 0.01 0.00 0.50 0.00 0.00 46.19 48.39 2qxw s LEU 106 CO 0.79 -0.19 -0.13 -0.47 -1.32 0.00 0.00 176.35 175.03 2qxw s TYR 107 N 1.04 1.72 0.03 5.38 5.04 -0.49 -1.80 117.35 128.27 2qxw s TYR 107 Ca -0.06 -0.75 0.05 0.00 -2.44 0.00 0.00 57.07 53.86 2qxw s TYR 107 Cb -0.06 -1.26 -0.03 0.00 0.35 0.00 0.00 41.96 40.95 2qxw s TYR 107 CO -0.09 -0.40 -0.09 -0.51 -1.34 0.00 0.00 175.55 173.12 2qxw s LEU 108 N 0.94 3.03 -0.28 6.97 1.43 -0.30 -1.19 118.68 129.28 2qxw s LEU 108 Ca -0.09 -0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 52.49 2qxw s LEU 108 Cb -0.15 -1.76 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 2qxw s LEU 108 CO 0.00 0.26 1.54 -0.63 0.23 0.00 0.00 176.35 177.75 2qxw s ILE 109 N -1.01 3.80 0.12 -0.59 1.01 -0.30 -0.38 121.20 123.84 2qxw s ILE 109 Ca 0.17 0.88 -0.18 0.00 0.00 0.00 0.00 60.65 61.52 2qxw s ILE 109 Cb -0.11 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2qxw s ILE 109 CO 0.08 -0.43 1.68 -0.74 0.00 0.00 0.00 174.94 175.53 2qxw h HIS 110 N 10.68 0.46 -3.98 3.97 2.76 -1.70 -1.12 115.15 126.21 2qxw h HIS 110 Ca -0.31 -0.03 -0.21 0.00 -2.20 0.00 0.00 60.37 57.62 2qxw h HIS 110 Cb 1.13 -0.14 -0.18 0.00 1.55 0.00 0.00 27.41 29.77 2qxw h HIS 110 CO 0.92 0.42 -0.71 -1.58 -1.30 0.00 0.00 177.93 175.69 2qxw s TRP 111 N -5.64 0.61 -2.00 5.26 0.52 -1.25 -4.31 118.94 112.13 2qxw s TRP 111 Ca -0.13 -0.72 0.24 0.00 0.02 0.00 0.00 56.10 55.52 2qxw s TRP 111 Cb 0.09 -0.38 1.46 0.00 -1.15 0.00 0.00 33.47 33.49 2qxw s TRP 111 CO 0.73 -0.18 1.87 -0.35 0.02 0.00 0.00 176.95 179.04 2qxw n PRO 112 N 0.86 0.86 -3.58 4.98 -0.04 -1.26 -4.73 135.00 132.09 2qxw n PRO 112 Ca -0.19 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.91 2qxw n PRO 112 Cb 0.57 -1.44 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 2qxw n PRO 112 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2qxw s THR 113 N -2.00 5.32 0.04 0.52 -4.23 -1.26 -4.77 115.64 109.26 2qxw s THR 113 Ca 0.37 0.40 -0.18 0.00 -1.18 0.00 0.00 61.69 61.10 2qxw s THR 113 Cb 0.17 -3.58 -0.06 0.00 1.34 0.00 0.00 72.50 70.37 2qxw s THR 113 CO 0.28 0.36 0.51 -0.83 -0.54 0.00 0.00 174.62 174.40 2qxw s GLY 114 N 0.72 2.59 0.25 3.99 0.00 -1.26 -4.60 107.32 109.01 2qxw s GLY 114 Ca 0.13 -0.07 0.10 0.00 0.00 0.00 0.00 44.72 44.88 2qxw s GLY 114 CO 0.04 0.37 -0.10 -1.36 0.00 0.00 0.00 173.10 172.04 2qxw s PHE 115 N -1.01 2.53 0.17 1.90 0.08 0.29 -1.16 117.98 120.78 2qxw s PHE 115 Ca 0.27 -0.27 -0.33 0.00 0.12 0.00 0.00 56.93 56.72 2qxw s PHE 115 Cb -0.18 -1.14 -0.15 0.00 -0.57 0.00 0.00 43.02 40.98 2qxw s PHE 115 CO 0.17 0.62 1.41 1.17 -0.10 0.00 0.00 175.22 178.48 2qxw n LYS 116 N -0.54 1.75 -1.68 0.44 4.81 0.16 -4.21 118.16 118.88 2qxw n LYS 116 Ca -0.07 0.63 -0.32 0.00 -0.87 0.00 0.00 58.31 57.68 2qxw n LYS 116 Cb 0.58 -2.29 0.05 0.00 0.02 0.00 0.00 35.03 33.39 2qxw n LYS 116 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2qxw s PRO 117 N 0.18 2.89 0.00 1.64 0.04 -1.26 -4.76 135.00 133.74 2qxw s PRO 117 Ca 0.75 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2qxw s PRO 117 Cb -0.75 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 31.81 2qxw s PRO 117 CO 0.46 -1.15 0.00 0.41 0.04 0.00 0.00 177.00 176.76 2qxw n GLY 118 N -1.31 -0.54 0.25 0.56 0.00 -1.26 -4.96 105.19 97.93 2qxw n GLY 118 Ca 0.09 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.44 2qxw n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qxw h LYS 119 N 3.54 0.68 -6.58 1.61 1.57 -1.99 -3.43 116.57 111.97 2qxw h LYS 119 Ca 0.00 -0.29 -0.52 0.00 -1.87 0.00 0.00 60.65 57.97 2qxw h LYS 119 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2qxw h LYS 119 CO 0.00 0.88 0.48 -1.21 -0.57 0.00 0.00 179.45 179.03 2qxw s GLU 120 N -4.52 4.55 0.41 3.15 2.02 -1.26 -4.94 118.70 118.11 2qxw s GLU 120 Ca -0.09 1.68 0.21 0.00 0.02 0.00 0.00 54.97 56.80 2qxw s GLU 120 Cb 0.13 -3.32 0.78 0.00 0.10 0.00 0.00 34.13 31.82 2qxw s GLU 120 CO 0.83 -0.02 1.77 0.74 0.02 0.00 0.00 175.26 178.60 2qxw h PHE 121 N 5.77 0.00 -2.71 1.61 0.04 -1.96 -3.34 116.94 116.35 2qxw h PHE 121 Ca -0.43 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.73 2qxw h PHE 121 Cb 1.21 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.96 2qxw h PHE 121 CO 0.64 0.30 -0.78 1.19 -0.60 0.00 0.00 178.31 179.06 2qxw n PHE 122 N -3.44 1.13 -2.10 -0.55 3.01 -1.26 -4.69 117.46 109.57 2qxw n PHE 122 Ca 0.00 -3.80 -0.42 0.00 1.01 0.00 0.00 57.45 54.24 2qxw n PHE 122 Cb 0.48 -0.17 -0.03 0.00 -0.01 0.00 0.00 39.48 39.74 2qxw n PHE 122 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2qxw s PRO 123 N -0.71 4.30 0.13 -1.08 0.04 -1.26 -4.95 135.00 131.48 2qxw s PRO 123 Ca 0.29 2.17 0.11 0.00 0.04 0.00 0.00 61.00 63.61 2qxw s PRO 123 Cb 0.00 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 2qxw s PRO 123 CO -0.18 -0.43 -0.25 -0.51 0.04 0.00 0.00 177.00 175.66 2qxw s LEU 124 N 0.57 2.39 0.92 -3.56 1.43 -1.26 -0.68 118.68 118.49 2qxw s LEU 124 Ca 0.63 -0.73 -0.13 0.00 -1.03 0.00 0.00 54.13 52.86 2qxw s LEU 124 Cb -0.39 -1.26 0.19 0.00 0.03 0.00 0.00 46.19 44.75 2qxw s LEU 124 CO 0.35 0.17 1.27 1.51 0.23 0.00 0.00 176.35 179.88 2qxw s ASP 125 N -2.13 3.31 0.32 2.29 1.47 0.13 -4.85 116.67 117.21 2qxw s ASP 125 Ca 0.15 0.16 0.25 0.00 1.18 0.00 0.00 52.55 54.29 2qxw s ASP 125 Cb -0.10 -0.25 1.12 0.00 -0.34 0.00 0.00 42.92 43.35 2qxw s ASP 125 CO 0.07 -2.60 1.75 -0.33 0.68 0.00 0.00 175.17 174.74 2qxw h GLU 126 N -1.46 0.00 -0.68 2.11 4.39 -2.01 -1.31 114.58 115.62 2qxw h GLU 126 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2qxw h GLU 126 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2qxw h GLU 126 CO 0.38 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 177.10 2qxw n SER 127 N -2.36 3.85 0.00 1.42 3.41 -1.26 -4.97 113.62 113.71 2qxw n SER 127 Ca 0.01 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 2qxw n SER 127 Cb 0.18 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 2qxw n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qxw n GLY 128 N 1.57 0.75 3.76 5.00 0.00 -0.49 -5.05 105.19 110.72 2qxw n GLY 128 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 2qxw n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qxw s ASN 129 N -2.73 7.51 0.54 1.61 0.01 -1.26 -4.68 114.94 115.94 2qxw s ASN 129 Ca 0.00 1.96 -0.22 0.00 -0.71 0.00 0.00 52.86 53.89 2qxw s ASN 129 Cb 0.00 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 2qxw s ASN 129 CO 0.00 0.06 1.32 0.54 -1.51 0.00 0.00 177.10 177.50 2qxw s VAL 130 N -1.30 2.28 -0.41 1.60 0.11 -0.35 -0.69 120.40 121.64 2qxw s VAL 130 Ca 0.44 0.21 -0.20 0.00 -2.93 0.00 0.00 61.98 59.50 2qxw s VAL 130 Cb -0.25 -3.10 0.02 0.00 -1.53 0.00 0.00 36.38 31.52 2qxw s VAL 130 CO 0.31 -0.01 0.60 -0.69 -3.33 0.00 0.00 175.10 171.98 2qxw s VAL 131 N -1.36 4.89 0.72 2.04 1.01 0.14 -4.77 120.40 123.07 2qxw s VAL 131 Ca 0.71 0.17 -0.13 0.00 0.00 0.00 0.00 61.98 62.73 2qxw s VAL 131 Cb -0.38 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 31.90 2qxw s VAL 131 CO 0.45 -0.48 1.10 -2.84 0.00 0.00 0.00 175.10 173.32 2qxw s PRO 132 N 2.67 2.52 0.08 2.72 0.02 -1.26 -0.67 135.00 141.08 2qxw s PRO 132 Ca 0.21 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.51 2qxw s PRO 132 Cb -0.15 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 2qxw s PRO 132 CO 0.17 -1.45 0.23 -1.54 -0.33 0.00 0.00 177.00 174.07 2qxw s SER 133 N -3.00 6.36 0.00 2.53 1.04 -0.31 -3.88 113.70 116.43 2qxw s SER 133 Ca 0.64 0.25 -0.05 0.00 0.48 0.00 0.00 55.95 57.27 2qxw s SER 133 Cb -0.19 -1.95 -0.23 0.00 0.10 0.00 0.00 66.02 63.75 2qxw s SER 133 CO 0.49 0.15 3.35 -0.90 0.98 0.00 0.00 173.24 177.31 2qxw n ASP 134 N 0.13 5.15 -4.92 7.02 5.68 -1.26 -4.69 116.55 123.66 2qxw n ASP 134 Ca -0.05 -2.45 -0.31 0.00 -0.50 0.00 0.00 54.79 51.48 2qxw n ASP 134 Cb 0.52 -1.35 -0.04 0.00 -1.14 0.00 0.00 41.12 39.10 2qxw n ASP 134 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2qxw s THR 135 N 0.90 5.32 0.26 2.12 -4.23 -1.26 -5.10 115.64 113.65 2qxw s THR 135 Ca 0.57 -0.31 0.11 0.00 -1.18 0.00 0.00 61.69 60.87 2qxw s THR 135 Cb 0.27 -3.64 -0.05 0.00 1.34 0.00 0.00 72.50 70.42 2qxw s THR 135 CO 0.00 0.08 -0.18 0.54 -0.54 0.00 0.00 174.62 174.52 2qxw s ASN 136 N -2.59 3.31 0.16 3.99 2.20 -1.26 -4.74 114.94 116.02 2qxw s ASN 136 Ca 0.37 -1.04 -0.15 0.00 -0.94 0.00 0.00 52.86 51.10 2qxw s ASN 136 Cb -0.13 -0.26 0.09 0.00 -2.00 0.00 0.00 41.25 38.96 2qxw s ASN 136 CO 0.27 -0.03 1.75 0.40 -2.94 0.00 0.00 177.10 176.55 2qxw h ILE 137 N 2.34 0.88 -0.62 0.54 2.04 -1.99 -1.34 117.51 119.35 2qxw h ILE 137 Ca -0.40 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 2qxw h ILE 137 Cb 1.25 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 2qxw h ILE 137 CO 0.61 0.06 0.22 -0.07 0.00 0.00 0.00 178.15 178.97 2qxw h LEU 138 N 0.30 0.84 -0.59 1.44 3.38 -1.96 0.63 115.31 119.35 2qxw h LEU 138 Ca 0.19 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 2qxw h LEU 138 Cb 0.17 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2qxw h LEU 138 CO -0.19 0.77 -0.39 0.44 0.09 0.00 0.00 178.44 179.16 2qxw h ASP 139 N 0.89 0.73 -0.50 -0.43 3.32 -1.83 -1.12 116.42 117.48 2qxw h ASP 139 Ca 0.21 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 56.81 2qxw h ASP 139 Cb 0.21 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2qxw h ASP 139 CO -0.01 1.04 -0.18 0.74 -1.72 0.00 0.00 179.24 179.10 2qxw h THR 140 N 0.56 1.27 -0.63 0.35 2.02 -0.54 -2.59 112.91 113.35 2qxw h THR 140 Ca 0.05 -1.34 0.01 0.00 0.77 0.00 0.00 66.41 65.90 2qxw h THR 140 Cb 0.92 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2qxw h THR 140 CO 0.08 0.47 0.42 -0.25 0.37 0.00 0.00 175.52 176.61 2qxw h TRP 141 N 0.86 0.79 -0.90 3.16 2.91 -0.54 -1.12 115.95 121.12 2qxw h TRP 141 Ca 0.12 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.23 2qxw h TRP 141 Cb 0.75 -0.27 -0.06 0.00 -0.51 0.00 0.00 29.16 29.08 2qxw h TRP 141 CO 0.05 0.49 0.58 0.00 -1.03 0.00 0.00 178.44 178.54 2qxw h ALA 142 N 1.23 1.54 -0.59 2.65 0.00 -1.07 0.27 119.26 123.29 2qxw h ALA 142 Ca 0.23 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2qxw h ALA 142 Cb -0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2qxw h ALA 142 CO -0.05 0.32 0.10 0.00 0.00 0.00 0.00 179.25 179.62 2qxw h ALA 143 N 1.52 1.07 -0.62 0.00 0.00 -0.96 -2.01 119.26 118.26 2qxw h ALA 143 Ca 0.39 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2qxw h ALA 143 Cb 0.23 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2qxw h ALA 143 CO -0.15 0.60 0.29 0.52 0.00 0.00 0.00 179.25 180.51 2qxw h MET 144 N 0.90 0.91 -0.85 0.00 2.07 -0.06 -2.75 114.93 115.14 2qxw h MET 144 Ca 0.19 -0.14 0.04 0.00 -2.07 0.00 0.00 59.70 57.71 2qxw h MET 144 Cb 0.38 -0.16 -0.05 0.00 -1.87 0.00 0.00 31.60 29.90 2qxw h MET 144 CO 0.01 0.74 0.56 0.93 1.07 0.00 0.00 176.91 180.21 2qxw h GLU 145 N 0.86 1.03 -0.51 1.72 5.08 -0.60 -1.58 114.58 120.57 2qxw h GLU 145 Ca 0.21 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2qxw h GLU 145 Cb 0.14 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2qxw h GLU 145 CO -0.02 0.68 0.30 1.49 -1.00 0.00 0.00 179.01 180.45 2qxw h GLU 146 N 1.06 0.69 -0.74 2.33 4.81 -1.08 -2.23 114.58 119.42 2qxw h GLU 146 Ca 0.34 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2qxw h GLU 146 Cb 0.03 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2qxw h GLU 146 CO -0.10 0.49 0.35 -0.07 -0.73 0.00 0.00 179.01 178.95 2qxw h LEU 147 N 0.70 0.96 -0.34 1.64 3.38 -1.16 -1.01 115.31 119.48 2qxw h LEU 147 Ca 0.18 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qxw h LEU 147 Cb -0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2qxw h LEU 147 CO -0.03 0.81 0.22 0.58 0.09 0.00 0.00 178.44 180.11 2qxw h VAL 148 N 1.05 1.10 0.00 1.22 2.07 -1.33 -2.01 116.25 118.36 2qxw h VAL 148 Ca 0.26 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2qxw h VAL 148 Cb 0.11 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2qxw h VAL 148 CO -0.03 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.13 2qxw n ASP 149 N -4.83 0.00 -0.65 0.57 8.00 -0.75 -1.82 116.55 117.07 2qxw n ASP 149 Ca -0.01 0.22 0.10 0.00 0.71 0.00 0.00 54.79 55.81 2qxw n ASP 149 Cb 0.04 -0.38 0.05 0.00 -0.02 0.00 0.00 41.12 40.81 2qxw n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qxw n GLU 150 N -1.38 1.66 -1.00 -1.24 1.02 -0.46 -4.99 120.64 114.26 2qxw n GLU 150 Ca 0.07 -1.37 0.00 0.00 -0.02 0.00 0.00 57.16 55.84 2qxw n GLU 150 Cb 0.18 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 2qxw n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qxw n GLY 151 N 1.18 0.51 0.16 0.62 0.00 -0.76 -4.91 105.19 102.00 2qxw n GLY 151 Ca 0.10 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.17 2qxw n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qxw h LEU 152 N 0.00 0.00 -7.44 0.99 3.38 -1.61 -3.44 115.31 107.19 2qxw h LEU 152 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 2qxw h LEU 152 Cb 0.03 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.47 2qxw h LEU 152 CO 0.00 0.40 -0.56 -0.69 0.09 0.00 0.00 178.44 177.67 2qxw s VAL 153 N -3.05 -0.04 0.12 1.22 1.01 -1.21 -1.26 120.40 117.18 2qxw s VAL 153 Ca 0.04 0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.24 2qxw s VAL 153 Cb 0.07 -0.27 -0.21 0.00 0.00 0.00 0.00 36.38 35.97 2qxw s VAL 153 CO 0.72 0.06 1.27 0.11 0.00 0.00 0.00 175.10 177.26 2qxw h LYS 154 N 7.01 0.00 -3.73 2.72 1.79 -1.01 -3.37 116.57 120.00 2qxw h LYS 154 Ca -0.40 -0.01 -0.15 0.00 -2.18 0.00 0.00 60.65 57.92 2qxw h LYS 154 Cb 1.15 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.61 2qxw h LYS 154 CO 0.41 1.00 -0.56 0.00 -1.08 0.00 0.00 179.45 179.22 2qxw s ALA 155 N -2.71 -0.12 0.12 3.86 0.00 -0.86 -5.00 121.76 117.06 2qxw s ALA 155 Ca 0.01 -0.39 0.08 0.00 0.00 0.00 0.00 51.96 51.66 2qxw s ALA 155 Cb 0.10 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 2qxw s ALA 155 CO 0.82 -0.23 -0.19 0.96 0.00 0.00 0.00 175.76 177.12 2qxw s ILE 156 N -1.78 1.69 0.00 0.00 -4.36 -1.26 -1.39 121.20 114.09 2qxw s ILE 156 Ca -0.12 -1.68 0.00 0.00 -0.26 0.00 0.00 60.65 58.59 2qxw s ILE 156 Cb -0.06 -1.63 0.00 0.00 1.25 0.00 0.00 42.46 42.02 2qxw s ILE 156 CO -0.01 -0.19 0.00 0.61 0.24 0.00 0.00 174.94 175.59 2qxw n GLY 157 N 0.76 2.43 3.26 6.27 0.00 -0.33 -0.70 105.19 116.88 2qxw n GLY 157 Ca -0.17 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 2qxw n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qxw s ILE 158 N -2.97 0.76 -0.14 -0.61 -4.36 -0.12 -1.15 121.20 112.61 2qxw s ILE 158 Ca 0.00 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.29 2qxw s ILE 158 Cb 0.00 -2.19 0.04 0.00 1.25 0.00 0.00 42.46 41.56 2qxw s ILE 158 CO 0.00 -0.42 0.35 -0.55 0.24 0.00 0.00 174.94 174.56 2qxw s SER 159 N -3.21 -0.39 -1.60 4.36 0.15 -0.43 -1.19 113.70 111.39 2qxw s SER 159 Ca 0.26 0.73 0.00 0.00 0.70 0.00 0.00 55.95 57.64 2qxw s SER 159 Cb 0.06 0.69 0.00 0.00 -1.71 0.00 0.00 66.02 65.06 2qxw s SER 159 CO 0.05 -0.15 0.00 0.59 1.20 0.00 0.00 173.24 174.94 2qxw n ASN 160 N 3.44 -5.26 -4.74 5.45 3.02 -0.25 -3.92 115.26 113.00 2qxw n ASN 160 Ca -0.17 0.05 -0.38 0.00 -0.03 0.00 0.00 54.58 54.04 2qxw n ASN 160 Cb 0.56 -4.33 -0.06 0.00 -0.61 0.00 0.00 39.78 35.34 2qxw n ASN 160 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2qxw s PHE 161 N -2.87 3.57 0.87 3.10 0.40 -1.26 -4.50 117.98 117.28 2qxw s PHE 161 Ca 0.00 0.98 -0.13 0.00 -0.60 0.00 0.00 56.93 57.18 2qxw s PHE 161 Cb 0.00 -2.56 0.12 0.00 0.51 0.00 0.00 43.02 41.09 2qxw s PHE 161 CO 0.00 0.24 1.21 0.54 0.70 0.00 0.00 175.22 177.91 2qxw s ASN 162 N 0.34 3.96 0.29 1.36 2.20 -1.26 -4.75 114.94 117.07 2qxw s ASN 162 Ca 0.28 0.67 0.07 0.00 -0.94 0.00 0.00 52.86 52.94 2qxw s ASN 162 Cb -0.16 -1.06 0.44 0.00 -2.00 0.00 0.00 41.25 38.47 2qxw s ASN 162 CO 0.12 -2.24 1.68 1.12 -2.94 0.00 0.00 177.10 174.85 2qxw h HIS 163 N -1.29 0.24 -0.27 1.54 2.07 -1.95 0.18 115.15 115.66 2qxw h HIS 163 Ca -0.46 -0.07 0.06 0.00 -2.85 0.00 0.00 60.37 57.05 2qxw h HIS 163 Cb 1.31 -0.05 -0.07 0.00 2.57 0.00 0.00 27.41 31.17 2qxw h HIS 163 CO -0.11 0.62 -0.17 1.25 -3.07 0.00 0.00 177.93 176.45 2qxw h LEU 164 N 0.16 -0.56 -0.63 6.12 6.46 -1.98 0.61 115.31 125.49 2qxw h LEU 164 Ca 0.01 0.12 -0.10 0.00 -0.12 0.00 0.00 57.88 57.80 2qxw h LEU 164 Cb 0.87 0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 41.07 2qxw h LEU 164 CO 0.07 -0.21 0.02 1.56 -0.62 0.00 0.00 178.44 179.26 2qxw h GLN 165 N -0.15 1.09 -0.48 1.25 4.20 -1.67 0.17 115.11 119.52 2qxw h GLN 165 Ca 0.15 -0.34 0.00 0.00 0.06 0.00 0.00 58.65 58.52 2qxw h GLN 165 Cb 0.37 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 2qxw h GLN 165 CO -0.36 1.05 0.31 0.28 -0.67 0.00 0.00 178.83 179.44 2qxw h VAL 166 N 1.00 1.13 -0.83 -0.54 2.07 -0.78 -2.67 116.25 115.64 2qxw h VAL 166 Ca 0.18 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2qxw h VAL 166 Cb 0.54 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2qxw h VAL 166 CO 0.03 0.13 0.50 -0.08 0.02 0.00 0.00 177.57 178.17 2qxw h GLU 167 N 0.65 1.12 -0.77 1.57 4.81 -0.22 -2.04 114.58 119.69 2qxw h GLU 167 Ca 0.18 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2qxw h GLU 167 Cb -0.06 -0.24 -0.04 0.00 0.63 0.00 0.00 28.75 29.05 2qxw h GLU 167 CO -0.04 0.78 0.51 1.98 -0.73 0.00 0.00 179.01 181.51 2qxw h MET 168 N 1.14 1.01 -0.22 1.92 4.05 -0.64 0.37 114.93 122.56 2qxw h MET 168 Ca 0.30 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.62 2qxw h MET 168 Cb -0.06 -0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 30.51 2qxw h MET 168 CO -0.06 0.67 -0.01 0.82 0.23 0.00 0.00 176.91 178.57 2qxw h ILE 169 N 1.04 1.26 0.00 1.77 2.04 -1.33 -1.55 117.51 120.74 2qxw h ILE 169 Ca 0.28 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 2qxw h ILE 169 Cb -0.12 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2qxw h ILE 169 CO -0.06 0.28 -0.01 -0.07 0.00 0.00 0.00 178.15 178.28 2qxw h LEU 170 N 0.15 0.00 -2.55 1.44 4.07 -0.96 0.17 115.31 117.62 2qxw h LEU 170 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 2qxw h LEU 170 Cb 0.41 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.15 2qxw h LEU 170 CO 0.01 0.01 0.00 0.59 -1.08 0.00 0.00 178.44 177.97 2qxw n ASN 171 N -4.04 3.74 -4.71 -0.43 3.02 0.08 -4.98 115.26 107.93 2qxw n ASN 171 Ca -0.03 -2.00 -0.42 0.00 -0.03 0.00 0.00 54.58 52.10 2qxw n ASN 171 Cb 0.09 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 38.83 2qxw n ASN 171 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2qxw s LYS 172 N -1.19 4.12 0.15 3.52 2.20 0.58 -4.89 119.74 124.23 2qxw s LYS 172 Ca 0.45 2.61 -0.34 0.00 -0.36 0.00 0.00 55.97 58.34 2qxw s LYS 172 Cb 0.24 -3.18 -0.14 0.00 -1.51 0.00 0.00 37.83 33.24 2qxw s LYS 172 CO 0.33 -0.78 1.59 -2.30 -0.36 0.00 0.00 175.35 173.83 2qxw n PRO 173 N 4.35 2.14 -1.09 4.03 -0.02 -1.26 -1.77 135.00 141.39 2qxw n PRO 173 Ca 0.16 0.77 -0.03 0.00 -2.02 0.00 0.00 63.50 62.39 2qxw n PRO 173 Cb 0.36 -2.55 -0.01 0.00 -0.02 0.00 0.00 33.50 31.28 2qxw n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qxw n GLY 174 N 3.45 0.61 3.59 -1.23 0.00 -1.26 -4.94 105.19 105.40 2qxw n GLY 174 Ca 0.17 -0.44 -0.52 0.00 0.00 0.00 0.00 46.02 45.24 2qxw n GLY 174 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qxw n LEU 175 N -0.34 1.59 -0.12 0.99 7.94 -0.73 -4.90 117.00 121.43 2qxw n LEU 175 Ca -0.03 1.12 -0.23 0.00 -1.11 0.00 0.00 56.01 55.77 2qxw n LEU 175 Cb 0.16 -1.18 -0.10 0.00 0.53 0.00 0.00 43.42 42.83 2qxw n LEU 175 CO 0.05 -1.09 -1.31 1.17 -1.11 0.00 0.00 177.39 175.09 2qxw n LYS 176 N 2.44 0.54 -4.46 1.96 4.81 -1.26 -4.95 118.16 117.25 2qxw n LYS 176 Ca 0.18 0.19 -0.26 0.00 -0.87 0.00 0.00 58.31 57.55 2qxw n LYS 176 Cb 0.19 -1.41 -0.17 0.00 0.02 0.00 0.00 35.03 33.67 2qxw n LYS 176 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2qxw s TYR 177 N -2.46 1.61 0.64 5.64 2.02 -1.26 -5.13 117.35 118.41 2qxw s TYR 177 Ca -0.33 -0.68 -0.17 0.00 -0.37 0.00 0.00 57.07 55.52 2qxw s TYR 177 Cb 0.11 -1.20 -0.01 0.00 -0.40 0.00 0.00 41.96 40.46 2qxw s TYR 177 CO 0.47 -0.37 1.16 0.15 -1.57 0.00 0.00 175.55 175.39 2qxw s LYS 178 N 0.91 2.79 0.32 -0.62 1.02 -1.26 -4.97 119.74 117.94 2qxw s LYS 178 Ca -0.10 1.62 -0.29 0.00 0.02 0.00 0.00 55.97 57.22 2qxw s LYS 178 Cb -0.15 -1.93 -0.11 0.00 -0.52 0.00 0.00 37.83 35.12 2qxw s LYS 178 CO 0.01 -1.30 1.54 -2.14 -0.92 0.00 0.00 175.35 172.54 2qxw s PRO 179 N -3.72 4.13 0.07 -1.68 0.02 -1.26 -4.85 135.00 127.71 2qxw s PRO 179 Ca 0.72 2.56 0.06 0.00 0.02 0.00 0.00 61.00 64.36 2qxw s PRO 179 Cb -0.25 -3.01 -0.23 0.00 0.02 0.00 0.00 34.50 31.03 2qxw s PRO 179 CO 0.38 -0.57 1.08 0.00 -0.33 0.00 0.00 177.00 177.56 2qxw h ALA 180 N 4.10 0.41 -3.10 -1.55 0.00 -1.28 -3.43 119.26 114.40 2qxw h ALA 180 Ca -0.49 -1.05 -0.17 0.00 0.00 0.00 0.00 54.91 53.20 2qxw h ALA 180 Cb 1.23 0.05 -0.23 0.00 0.00 0.00 0.00 17.79 18.83 2qxw h ALA 180 CO 0.73 1.29 -0.57 0.08 0.00 0.00 0.00 179.25 180.78 2qxw s VAL 181 N -2.67 0.05 -0.21 0.00 1.01 -1.26 -1.60 120.40 115.72 2qxw s VAL 181 Ca -0.02 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2qxw s VAL 181 Cb 0.09 -0.29 0.04 0.00 0.00 0.00 0.00 36.38 36.22 2qxw s VAL 181 CO 0.83 -0.23 -0.15 0.21 0.00 0.00 0.00 175.10 175.76 2qxw s ASN 182 N -0.75 3.66 -0.28 3.32 2.47 -0.37 -0.94 114.94 122.04 2qxw s ASN 182 Ca -0.08 -0.97 -0.15 0.00 0.42 0.00 0.00 52.86 52.07 2qxw s ASN 182 Cb -0.05 -1.45 -0.03 0.00 -1.45 0.00 0.00 41.25 38.27 2qxw s ASN 182 CO 0.01 -0.10 0.39 -1.58 -3.72 0.00 0.00 177.10 172.10 2qxw s GLN 183 N 1.25 3.95 0.07 0.43 0.74 -0.33 -2.00 119.66 123.77 2qxw s GLN 183 Ca -0.01 0.00 0.01 0.00 0.05 0.00 0.00 55.36 55.40 2qxw s GLN 183 Cb -0.16 -3.68 -0.04 0.00 1.10 0.00 0.00 33.01 30.23 2qxw s GLN 183 CO -0.09 -0.33 -0.05 0.96 -0.55 0.00 0.00 175.29 175.22 2qxw s ILE 184 N 2.11 0.49 0.25 -2.34 -4.36 0.04 -1.09 121.20 116.29 2qxw s ILE 184 Ca 0.15 -1.80 -0.30 0.00 -0.26 0.00 0.00 60.65 58.44 2qxw s ILE 184 Cb -0.16 -1.51 -0.10 0.00 1.25 0.00 0.00 42.46 41.94 2qxw s ILE 184 CO 0.10 -0.88 1.40 -0.70 0.24 0.00 0.00 174.94 175.10 2qxw s GLU 185 N -3.64 4.30 -0.28 0.37 2.12 -1.26 -0.82 118.70 119.49 2qxw s GLU 185 Ca 0.08 2.24 -0.17 0.00 0.36 0.00 0.00 54.97 57.48 2qxw s GLU 185 Cb 0.05 -3.12 0.09 0.00 0.26 0.00 0.00 34.13 31.41 2qxw s GLU 185 CO -0.06 -0.35 0.74 0.00 -0.54 0.00 0.00 175.26 175.04 2qxw s HIS 187 N 1.46 0.02 0.49 0.00 -3.43 -0.89 -4.19 115.29 108.74 2qxw s HIS 187 Ca -0.09 -0.33 0.41 0.00 -0.80 0.00 0.00 55.06 54.25 2qxw s HIS 187 Cb -0.05 0.65 2.15 0.00 -1.43 0.00 0.00 32.58 33.91 2qxw s HIS 187 CO -0.17 -0.74 2.24 -1.35 -2.00 0.00 0.00 174.74 172.72 2qxw h PRO 188 N 2.00 0.00 -0.00 -0.38 0.11 -1.87 -0.77 132.00 131.09 2qxw h PRO 188 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2qxw h PRO 188 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qxw h PRO 188 CO 0.33 0.00 -0.37 0.66 -0.21 0.00 0.00 178.00 178.41 2qxw n TYR 189 N -2.98 0.00 -3.13 0.65 4.01 -1.26 -1.24 117.16 113.21 2qxw n TYR 189 Ca -0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.54 2qxw n TYR 189 Cb 0.10 -0.17 -0.05 0.00 -0.31 0.00 0.00 39.34 38.91 2qxw n TYR 189 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 2qxw n LEU 190 N -0.99 -1.56 0.20 7.72 7.94 -0.31 -1.19 117.00 128.81 2qxw n LEU 190 Ca 0.09 -3.86 0.12 0.00 -1.11 0.00 0.00 56.01 51.26 2qxw n LEU 190 Cb 0.34 0.64 0.16 0.00 0.53 0.00 0.00 43.42 45.10 2qxw n LEU 190 CO 0.30 1.91 0.74 0.71 -1.11 0.00 0.00 177.39 179.93 2qxw h THR 191 N 4.48 0.00 -3.09 1.96 1.35 -1.75 -2.38 112.91 113.48 2qxw h THR 191 Ca 0.16 -0.98 -0.36 0.00 -0.55 0.00 0.00 66.41 64.68 2qxw h THR 191 Cb 0.98 1.93 0.01 0.00 -1.73 0.00 0.00 68.15 69.34 2qxw h THR 191 CO 0.25 0.00 -0.49 0.00 -0.25 0.00 0.00 175.52 175.03 2qxw n GLN 192 N -3.02 -2.48 -0.28 4.72 1.13 -1.26 -4.83 117.38 111.36 2qxw n GLN 192 Ca 0.04 0.86 -0.02 0.00 -1.94 0.00 0.00 57.00 55.93 2qxw n GLN 192 Cb 0.53 -5.42 0.10 0.00 0.11 0.00 0.00 30.24 25.56 2qxw n GLN 192 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2qxw h GLU 193 N -0.43 0.93 -0.07 -1.09 5.08 -1.99 -0.87 114.58 116.14 2qxw h GLU 193 Ca -0.45 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 57.84 2qxw h GLU 193 Cb 1.32 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2qxw h GLU 193 CO 0.51 0.62 -0.01 0.87 -1.00 0.00 0.00 179.01 180.00 2qxw h LYS 194 N 0.96 0.12 -0.53 2.33 1.57 -1.99 -0.68 116.57 118.35 2qxw h LYS 194 Ca 0.32 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.93 2qxw h LYS 194 Cb 0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2qxw h LYS 194 CO -0.12 0.43 -0.14 1.25 -0.57 0.00 0.00 179.45 180.30 2qxw h LEU 195 N -0.19 1.03 -0.50 2.94 5.85 -1.92 -1.63 115.31 120.89 2qxw h LEU 195 Ca 0.02 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2qxw h LEU 195 Cb 0.38 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2qxw h LEU 195 CO 0.01 1.16 0.32 0.40 -0.34 0.00 0.00 178.44 179.98 2qxw h ILE 196 N 0.90 1.14 -0.77 4.05 2.04 -1.15 -0.67 117.51 123.05 2qxw h ILE 196 Ca 0.13 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 2qxw h ILE 196 Cb 0.71 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2qxw h ILE 196 CO 0.05 0.14 0.48 -0.61 0.00 0.00 0.00 178.15 178.21 2qxw h GLN 197 N 0.67 1.04 0.20 2.37 5.75 -0.80 0.51 115.11 124.85 2qxw h GLN 197 Ca 0.18 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 2qxw h GLN 197 Cb -0.05 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.28 2qxw h GLN 197 CO -0.04 0.72 -0.09 -0.92 -2.65 0.00 0.00 178.83 175.85 2qxw h TYR 198 N 1.05 -0.24 -0.28 3.99 3.20 -1.06 -2.31 116.97 121.31 2qxw h TYR 198 Ca 0.28 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 2qxw h TYR 198 Cb -0.06 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 2qxw h TYR 198 CO -0.01 -0.00 0.15 0.00 -1.64 0.00 0.00 178.16 176.65 2qxw h GLN 200 N 0.34 1.26 0.00 0.00 4.20 -0.94 -1.46 115.11 118.50 2qxw h GLN 200 Ca 0.10 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2qxw h GLN 200 Cb 0.08 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.58 2qxw h GLN 200 CO -0.01 0.84 0.00 0.66 -0.67 0.00 0.00 178.83 179.64 2qxw h SER 201 N 1.30 0.00 -0.13 1.46 4.64 -0.98 -1.36 113.55 118.48 2qxw h SER 201 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2qxw h SER 201 Cb -0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2qxw h SER 201 CO -0.09 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.16 2qxw n LYS 202 N -2.42 1.50 -0.88 4.77 4.76 -0.75 -4.95 118.16 120.19 2qxw n LYS 202 Ca -0.01 -1.60 0.00 0.00 -2.87 0.00 0.00 58.31 53.84 2qxw n LYS 202 Cb 0.10 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 2qxw n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qxw n GLY 203 N 0.84 0.50 3.66 0.72 0.00 -0.51 -5.03 105.19 105.37 2qxw n GLY 203 Ca 0.10 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 2qxw n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qxw s ILE 204 N -2.00 5.13 0.18 -0.61 1.01 -0.63 -4.43 121.20 119.86 2qxw s ILE 204 Ca 0.00 0.85 -0.30 0.00 0.00 0.00 0.00 60.65 61.20 2qxw s ILE 204 Cb 0.00 -3.80 -0.08 0.00 0.01 0.00 0.00 42.46 38.60 2qxw s ILE 204 CO 0.00 0.19 1.02 -0.69 0.00 0.00 0.00 174.94 175.46 2qxw s VAL 205 N 1.62 4.07 -0.18 2.92 1.01 -0.63 -3.52 120.40 125.69 2qxw s VAL 205 Ca 0.22 1.85 -0.08 0.00 0.00 0.00 0.00 61.98 63.97 2qxw s VAL 205 Cb -0.15 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 2qxw s VAL 205 CO 0.09 0.35 0.10 -0.69 0.00 0.00 0.00 175.10 174.95 2qxw s VAL 206 N -0.47 5.11 -0.18 2.92 1.01 -1.26 -1.24 120.40 126.28 2qxw s VAL 206 Ca 0.46 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 62.44 2qxw s VAL 206 Cb -0.27 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2qxw s VAL 206 CO 0.33 0.47 0.07 -0.89 0.00 0.00 0.00 175.10 175.08 2qxw s THR 207 N 0.21 4.84 -0.32 3.92 2.01 -0.85 -1.45 115.64 124.00 2qxw s THR 207 Ca 0.07 -0.02 -0.20 0.00 0.31 0.00 0.00 61.69 61.85 2qxw s THR 207 Cb -0.12 -3.18 -0.01 0.00 0.01 0.00 0.00 72.50 69.20 2qxw s THR 207 CO -0.00 0.46 0.62 0.00 -0.69 0.00 0.00 174.62 175.00 2qxw s ALA 208 N 0.38 3.51 0.32 7.40 0.00 0.85 -0.78 121.76 133.44 2qxw s ALA 208 Ca 0.03 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.34 2qxw s ALA 208 Cb -0.12 -3.11 -0.01 0.00 0.00 0.00 0.00 23.12 19.88 2qxw s ALA 208 CO 0.00 -1.13 0.44 1.52 0.00 0.00 0.00 175.76 176.59 2qxw s TYR 209 N 2.61 3.16 -1.45 0.00 -0.85 0.00 -2.88 117.35 117.95 2qxw s TYR 209 Ca 0.24 -0.19 -0.03 0.00 -0.52 0.00 0.00 57.07 56.58 2qxw s TYR 209 Cb -0.15 -1.91 0.02 0.00 0.38 0.00 0.00 41.96 40.30 2qxw s TYR 209 CO 0.13 0.07 0.50 0.43 -1.52 0.00 0.00 175.55 175.16 2qxw n SER 210 N -1.59 -0.93 0.29 -0.18 7.64 -1.26 -2.02 113.62 115.57 2qxw n SER 210 Ca -0.02 -0.99 0.18 0.00 1.01 0.00 0.00 58.87 59.06 2qxw n SER 210 Cb 0.58 -3.10 0.78 0.00 -1.01 0.00 0.00 64.21 61.47 2qxw n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2qxw h PRO 211 N -1.81 0.00 -0.40 1.43 0.13 -1.80 -0.78 132.00 128.78 2qxw h PRO 211 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2qxw h PRO 211 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2qxw h PRO 211 CO 0.64 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 179.70 2qxw n LEU 212 N -3.10 3.02 0.00 1.56 4.77 -1.26 -4.79 117.00 117.20 2qxw n LEU 212 Ca -0.00 -1.36 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 2qxw n LEU 212 Cb 0.26 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2qxw n LEU 212 CO 0.26 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2qxw n GLY 213 N 1.42 0.43 3.87 -0.72 0.00 -0.30 -4.45 105.19 105.45 2qxw n GLY 213 Ca 0.19 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 2qxw n GLY 213 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qxw n SER 214 N 1.31 -4.77 0.31 1.61 3.41 -1.26 -4.81 113.62 109.41 2qxw n SER 214 Ca 0.00 -1.15 0.18 0.00 -0.26 0.00 0.00 58.87 57.63 2qxw n SER 214 Cb 0.00 -2.52 1.00 0.00 -0.26 0.00 0.00 64.21 62.43 2qxw n SER 214 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2qxw h PRO 215 N -2.23 0.00 -0.27 4.33 0.13 -1.98 -0.85 132.00 131.12 2qxw h PRO 215 Ca -0.69 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 2qxw h PRO 215 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2qxw h PRO 215 CO 0.50 0.01 0.00 -0.40 -0.23 0.00 0.00 178.00 177.87 2qxw n ASP 216 N -3.58 2.21 -4.77 1.44 5.75 -1.26 -4.90 116.55 111.44 2qxw n ASP 216 Ca -0.03 -1.84 -0.41 0.00 -0.01 0.00 0.00 54.79 52.51 2qxw n ASP 216 Cb 0.09 -0.18 0.01 0.00 -1.03 0.00 0.00 41.12 40.01 2qxw n ASP 216 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2qxw n ARG 217 N 0.68 2.48 0.24 0.11 1.85 -0.33 -4.84 116.66 116.85 2qxw n ARG 217 Ca 0.16 0.87 0.16 0.00 -1.00 0.00 0.00 57.85 58.05 2qxw n ARG 217 Cb 0.40 -2.64 0.74 0.00 -1.05 0.00 0.00 32.46 29.90 2qxw n ARG 217 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2qxw h PRO 218 N 2.66 0.00 -0.71 2.89 0.13 -1.93 -2.30 132.00 132.74 2qxw h PRO 218 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2qxw h PRO 218 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2qxw h PRO 218 CO 0.63 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.73 2qxw n TRP 219 N -2.75 1.08 -1.70 1.56 2.14 -1.26 -4.99 117.44 111.52 2qxw n TRP 219 Ca -0.00 -0.52 -0.43 0.00 2.07 0.00 0.00 57.50 58.62 2qxw n TRP 219 Cb 0.20 -0.05 -0.01 0.00 -0.81 0.00 0.00 31.31 30.64 2qxw n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2qxw n ALA 220 N 1.52 1.35 -2.48 -1.67 0.00 -0.87 -5.01 120.51 113.35 2qxw n ALA 220 Ca 0.25 0.37 -0.27 0.00 0.00 0.00 0.00 53.44 53.78 2qxw n ALA 220 Cb 0.68 -2.27 -0.11 0.00 0.00 0.00 0.00 19.45 17.75 2qxw n ALA 220 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qxw s LYS 221 N -1.60 1.75 0.45 0.00 -0.14 -1.26 -5.04 119.74 113.89 2qxw s LYS 221 Ca 0.58 -1.37 0.17 0.00 -1.36 0.00 0.00 55.97 53.99 2qxw s LYS 221 Cb -0.58 -2.01 1.10 0.00 -1.68 0.00 0.00 37.83 34.67 2qxw s LYS 221 CO 0.60 0.43 1.95 -1.00 -0.76 0.00 0.00 175.35 176.57 2qxw h PRO 222 N 3.23 0.33 0.00 -1.68 0.13 -2.03 -2.63 132.00 129.35 2qxw h PRO 222 Ca -0.47 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2qxw h PRO 222 Cb 1.20 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 2qxw h PRO 222 CO 0.49 0.22 -0.04 1.05 -0.23 0.00 0.00 178.00 179.50 2qxw h GLU 223 N 0.34 0.00 -6.95 0.86 9.09 -2.02 -3.47 114.58 112.43 2qxw h GLU 223 Ca 0.32 0.00 -0.56 0.00 0.05 0.00 0.00 59.36 59.18 2qxw h GLU 223 Cb 0.79 0.00 0.13 0.00 -1.65 0.00 0.00 28.75 28.02 2qxw h GLU 223 CO -0.09 0.04 0.54 -0.25 0.05 0.00 0.00 179.01 179.31 2qxw n ASP 224 N -3.13 2.59 -4.74 3.06 8.00 -0.99 -4.97 116.55 116.37 2qxw n ASP 224 Ca 0.02 1.03 -0.35 0.00 0.71 0.00 0.00 54.79 56.19 2qxw n ASP 224 Cb 0.39 -1.54 0.07 0.00 -0.02 0.00 0.00 41.12 40.02 2qxw n ASP 224 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2qxw s PRO 225 N -2.59 2.54 -0.27 -0.24 0.04 -1.26 -5.02 135.00 128.20 2qxw s PRO 225 Ca 0.67 1.80 0.01 0.00 0.04 0.00 0.00 61.00 63.52 2qxw s PRO 225 Cb -0.45 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.29 2qxw s PRO 225 CO 0.53 -1.54 0.00 0.45 0.04 0.00 0.00 177.00 176.48 2qxw s SER 226 N -1.82 4.07 0.16 6.66 0.15 -1.26 -5.01 113.70 116.64 2qxw s SER 226 Ca 0.76 -1.48 -0.16 0.00 0.70 0.00 0.00 55.95 55.77 2qxw s SER 226 Cb -0.30 -1.20 0.08 0.00 -1.71 0.00 0.00 66.02 62.89 2qxw s SER 226 CO 0.40 -0.31 1.72 -0.07 1.20 0.00 0.00 173.24 176.19 2qxw h LEU 227 N 7.91 -0.02 -2.04 3.45 3.38 -1.94 -1.70 115.31 124.36 2qxw h LEU 227 Ca -0.14 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2qxw h LEU 227 Cb 1.05 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 2qxw h LEU 227 CO 0.45 0.02 -0.07 -0.07 0.09 0.00 0.00 178.44 178.86 2qxw h LEU 228 N 0.18 0.00 -1.98 1.67 3.38 -1.96 -2.27 115.31 114.33 2qxw h LEU 228 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2qxw h LEU 228 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2qxw h LEU 228 CO -0.25 0.07 0.00 -0.62 0.09 0.00 0.00 178.44 177.73 2qxw n GLU 229 N -3.41 2.04 -2.26 1.13 1.02 -0.94 -4.86 120.64 113.36 2qxw n GLU 229 Ca -0.02 -1.88 -0.42 0.00 -0.02 0.00 0.00 57.16 54.82 2qxw n GLU 229 Cb 0.22 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 2qxw n GLU 229 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2qxw s ASP 230 N -1.60 6.85 0.40 1.62 -1.08 -0.68 -4.87 116.67 117.30 2qxw s ASP 230 Ca 0.28 1.96 0.15 0.00 -0.52 0.00 0.00 52.55 54.42 2qxw s ASP 230 Cb 0.18 -2.54 1.01 0.00 -1.46 0.00 0.00 42.92 40.11 2qxw s ASP 230 CO 0.27 -0.78 1.84 -0.65 0.52 0.00 0.00 175.17 176.37 2qxw h PRO 231 N 8.42 0.47 -0.23 4.34 0.11 -1.91 -0.54 132.00 142.67 2qxw h PRO 231 Ca -0.34 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.58 2qxw h PRO 231 Cb 1.15 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2qxw h PRO 231 CO 0.94 0.31 -0.54 0.00 -0.21 0.00 0.00 178.00 178.50 2qxw h ARG 232 N 0.49 0.68 0.03 1.05 3.08 -1.96 -1.39 114.38 116.35 2qxw h ARG 232 Ca 0.49 -0.43 -0.26 0.00 0.07 0.00 0.00 59.98 59.85 2qxw h ARG 232 Cb 1.09 0.05 0.02 0.00 0.08 0.00 0.00 29.97 31.21 2qxw h ARG 232 CO -0.21 1.04 -1.04 0.82 -1.07 0.00 0.00 179.97 179.52 2qxw h ILE 233 N 0.52 1.29 -0.92 2.04 2.04 -1.64 -3.01 117.51 117.84 2qxw h ILE 233 Ca 0.01 -2.27 0.10 0.00 1.00 0.00 0.00 64.86 63.70 2qxw h ILE 233 Cb 1.11 2.47 -0.07 0.00 -0.74 0.00 0.00 36.82 39.59 2qxw h ILE 233 CO 0.11 0.70 0.59 0.11 0.00 0.00 0.00 178.15 179.66 2qxw h LYS 234 N 0.32 0.89 -0.66 2.37 1.57 -1.08 -1.36 116.57 118.62 2qxw h LYS 234 Ca -0.14 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.52 2qxw h LYS 234 Cb 1.70 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.79 2qxw h LYS 234 CO 0.20 0.59 0.14 0.00 -0.57 0.00 0.00 179.45 179.81 2qxw h ALA 235 N 1.55 0.88 -0.42 3.86 0.00 -1.15 -0.36 119.26 123.61 2qxw h ALA 235 Ca 0.43 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2qxw h ALA 235 Cb 0.42 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2qxw h ALA 235 CO -0.19 0.61 0.17 0.82 0.00 0.00 0.00 179.25 180.65 2qxw h ILE 236 N 1.00 1.20 -0.32 0.00 2.04 -1.29 -1.41 117.51 118.73 2qxw h ILE 236 Ca 0.21 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.47 2qxw h ILE 236 Cb 0.39 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2qxw h ILE 236 CO 0.01 0.22 0.19 0.00 0.00 0.00 0.00 178.15 178.57 2qxw h ALA 237 N 1.01 0.40 -0.68 1.87 0.00 -1.02 -2.39 119.26 118.46 2qxw h ALA 237 Ca 0.14 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2qxw h ALA 237 Cb 0.19 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 2qxw h ALA 237 CO -0.01 -0.17 0.38 0.00 0.00 0.00 0.00 179.25 179.45 2qxw h ALA 238 N 1.14 0.91 -0.67 0.00 0.00 -0.86 -0.90 119.26 118.88 2qxw h ALA 238 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qxw h ALA 238 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2qxw h ALA 238 CO -0.06 0.07 0.44 -0.22 0.00 0.00 0.00 179.25 179.47 2qxw h LYS 239 N 0.71 0.89 -0.14 0.00 3.64 -0.88 -1.85 116.57 118.94 2qxw h LYS 239 Ca 0.30 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 2qxw h LYS 239 Cb 0.18 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2qxw h LYS 239 CO -0.18 0.60 0.00 0.72 -2.27 0.00 0.00 179.45 178.32 2qxw n HIS 240 N -4.42 0.17 -3.81 1.91 8.25 -0.77 -4.94 115.22 111.61 2qxw n HIS 240 Ca 0.07 -0.09 -0.26 0.00 -0.26 0.00 0.00 57.72 57.19 2qxw n HIS 240 Cb 0.05 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.18 2qxw n HIS 240 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2qxw n ASN 241 N 0.47 -3.02 -4.43 0.41 5.15 -0.46 -5.00 115.26 108.38 2qxw n ASN 241 Ca 0.17 -0.80 -0.21 0.00 -0.60 0.00 0.00 54.58 53.14 2qxw n ASN 241 Cb 0.38 -3.97 -0.11 0.00 -0.53 0.00 0.00 39.78 35.55 2qxw n ASN 241 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2qxw s LYS 242 N -6.31 1.60 0.63 1.20 -0.14 -0.52 -5.03 119.74 111.17 2qxw s LYS 242 Ca 0.33 -1.87 -0.10 0.00 -1.36 0.00 0.00 55.97 52.98 2qxw s LYS 242 Cb -0.17 -0.86 -0.01 0.00 -1.68 0.00 0.00 37.83 35.11 2qxw s LYS 242 CO 0.82 -0.15 1.00 0.95 -0.76 0.00 0.00 175.35 177.21 2qxw s THR 243 N -3.28 4.14 0.23 2.17 -4.23 -1.26 -4.15 115.64 109.25 2qxw s THR 243 Ca 0.35 0.51 -0.08 0.00 -1.18 0.00 0.00 61.69 61.29 2qxw s THR 243 Cb 0.08 -3.67 0.20 0.00 1.34 0.00 0.00 72.50 70.45 2qxw s THR 243 CO 0.14 -0.82 1.88 0.00 -0.54 0.00 0.00 174.62 175.29 2qxw h THR 244 N -0.34 1.24 -0.81 3.99 1.03 -1.91 -1.67 112.91 114.43 2qxw h THR 244 Ca -0.45 -0.48 0.02 0.00 -0.01 0.00 0.00 66.41 65.49 2qxw h THR 244 Cb 1.22 -0.01 -0.05 0.00 -1.07 0.00 0.00 68.15 68.25 2qxw h THR 244 CO 0.62 0.24 0.53 0.00 -0.01 0.00 0.00 175.52 176.90 2qxw h ALA 245 N 1.30 1.05 -0.79 0.00 0.00 -1.93 -0.40 119.26 118.49 2qxw h ALA 245 Ca 0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2qxw h ALA 245 Cb -0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.38 2qxw h ALA 245 CO -0.06 0.38 0.42 1.96 0.00 0.00 0.00 179.25 181.95 2qxw h GLN 246 N 1.04 1.12 -0.45 0.00 4.20 -1.74 -0.66 115.11 118.62 2qxw h GLN 246 Ca 0.31 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2qxw h GLN 246 Cb -0.04 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2qxw h GLN 246 CO -0.09 0.84 0.29 0.28 -0.67 0.00 0.00 178.83 179.47 2qxw h VAL 247 N 1.11 1.12 0.00 -0.54 2.07 -0.77 -0.56 116.25 118.68 2qxw h VAL 247 Ca 0.28 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 2qxw h VAL 247 Cb 0.06 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 2qxw h VAL 247 CO -0.04 0.12 -0.12 -0.07 0.02 0.00 0.00 177.57 177.47 2qxw h LEU 248 N 0.60 0.00 0.15 2.57 3.38 -0.48 -0.76 115.31 120.78 2qxw h LEU 248 Ca 0.16 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.85 2qxw h LEU 248 Cb -0.05 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.71 2qxw h LEU 248 CO -0.03 0.12 -1.37 0.40 0.09 0.00 0.00 178.44 177.64 2qxw h ILE 249 N 0.00 1.14 -0.27 1.22 2.04 -0.94 -3.36 117.51 117.35 2qxw h ILE 249 Ca -0.00 -2.49 -0.07 0.00 1.00 0.00 0.00 64.86 63.30 2qxw h ILE 249 Cb 0.29 2.87 -0.02 0.00 -0.74 0.00 0.00 36.82 39.22 2qxw h ILE 249 CO 0.02 0.75 -0.14 -0.09 0.00 0.00 0.00 178.15 178.69 2qxw h ARG 250 N -0.17 0.45 0.06 2.37 9.65 -0.86 -3.18 114.38 122.70 2qxw h ARG 250 Ca -0.27 -0.13 0.02 0.00 -1.10 0.00 0.00 59.98 58.49 2qxw h ARG 250 Cb 1.86 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 30.34 2qxw h ARG 250 CO 0.13 0.59 -0.47 0.35 2.80 0.00 0.00 179.97 183.37 2qxw h PHE 251 N 0.42 -1.36 -0.25 2.20 3.57 -1.28 -1.69 116.94 118.54 2qxw h PHE 251 Ca 0.08 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 2qxw h PHE 251 Cb 0.50 0.59 -0.01 0.00 2.79 0.00 0.00 35.95 39.82 2qxw h PHE 251 CO 0.02 -0.55 -0.06 -1.00 -2.23 0.00 0.00 178.31 174.49 2qxw h PRO 252 N -0.66 0.39 -0.83 6.41 0.13 -1.73 -2.50 132.00 133.21 2qxw h PRO 252 Ca 0.02 -0.08 0.09 0.00 -0.87 0.00 0.00 66.00 65.15 2qxw h PRO 252 Cb 0.71 -0.06 -0.07 0.00 0.13 0.00 0.00 31.00 31.71 2qxw h PRO 252 CO -0.30 0.46 0.49 0.52 -0.23 0.00 0.00 178.00 178.94 2qxw h MET 253 N 0.37 0.81 0.00 0.86 2.86 -1.36 -0.67 114.93 117.80 2qxw h MET 253 Ca 0.08 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2qxw h MET 253 Cb 0.34 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2qxw h MET 253 CO 0.02 0.53 0.00 1.04 1.06 0.00 0.00 176.91 179.56 2qxw n GLN 254 N -4.71 0.36 -0.32 1.72 6.02 -0.70 -2.01 117.38 117.73 2qxw n GLN 254 Ca 0.13 0.05 0.09 0.00 -0.01 0.00 0.00 57.00 57.27 2qxw n GLN 254 Cb 0.25 -1.50 0.27 0.00 1.02 0.00 0.00 30.24 30.28 2qxw n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2qxw n ARG 255 N -1.28 2.45 -2.16 -1.09 1.74 -0.34 -4.92 116.66 111.06 2qxw n ARG 255 Ca 0.12 -2.16 -0.14 0.00 -0.77 0.00 0.00 57.85 54.89 2qxw n ARG 255 Cb 0.19 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.13 2qxw n ARG 255 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2qxw n ASN 256 N 1.22 -4.39 -4.94 0.55 3.02 -0.85 -5.02 115.26 104.83 2qxw n ASN 256 Ca 0.20 0.03 -0.25 0.00 -0.03 0.00 0.00 54.58 54.53 2qxw n ASN 256 Cb 0.52 -3.51 -0.03 0.00 -0.61 0.00 0.00 39.78 36.16 2qxw n ASN 256 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2qxw s LEU 257 N -3.98 4.28 0.30 3.41 1.43 -0.71 -4.68 118.68 118.73 2qxw s LEU 257 Ca 0.00 0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 53.20 2qxw s LEU 257 Cb 0.00 -3.00 -0.08 0.00 0.03 0.00 0.00 46.19 43.13 2qxw s LEU 257 CO 0.00 -0.03 0.69 -0.69 0.23 0.00 0.00 176.35 176.55 2qxw s VAL 258 N -1.88 4.75 -0.01 -1.59 1.01 -0.53 -4.12 120.40 118.04 2qxw s VAL 258 Ca 0.36 0.81 -0.01 0.00 0.00 0.00 0.00 61.98 63.13 2qxw s VAL 258 Cb -0.10 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 2qxw s VAL 258 CO 0.29 -0.17 0.03 0.54 0.00 0.00 0.00 175.10 175.79 2qxw s VAL 259 N -1.96 0.02 -0.45 2.92 0.11 -0.05 -0.10 120.40 120.88 2qxw s VAL 259 Ca 0.52 -0.19 0.09 0.00 -2.93 0.00 0.00 61.98 59.48 2qxw s VAL 259 Cb -0.10 -0.12 0.33 0.00 -1.53 0.00 0.00 36.38 34.96 2qxw s VAL 259 CO 0.19 -0.10 0.77 2.30 -3.33 0.00 0.00 175.10 174.93 2qxw n ILE 260 N 2.73 0.90 -1.83 7.04 -5.35 -1.14 -1.28 119.36 120.44 2qxw n ILE 260 Ca -0.15 -4.86 -0.41 0.00 -0.27 0.00 0.00 62.75 57.07 2qxw n ILE 260 Cb 0.59 -0.93 -0.00 0.00 -1.74 0.00 0.00 39.64 37.56 2qxw n ILE 260 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qxw s PRO 261 N -2.59 4.12 -0.11 6.28 0.04 -1.21 -3.21 135.00 138.32 2qxw s PRO 261 Ca 0.42 2.54 -0.09 0.00 0.04 0.00 0.00 61.00 63.91 2qxw s PRO 261 Cb 0.29 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 2qxw s PRO 261 CO -0.10 -0.51 0.20 0.21 0.04 0.00 0.00 177.00 176.84 2qxw s LYS 262 N -2.08 3.70 -0.04 4.56 2.36 -1.26 -1.30 119.74 125.69 2qxw s LYS 262 Ca 0.53 -0.02 -0.23 0.00 -2.55 0.00 0.00 55.97 53.69 2qxw s LYS 262 Cb -0.46 -3.25 0.05 0.00 -1.05 0.00 0.00 37.83 33.12 2qxw s LYS 262 CO 0.62 0.65 0.51 0.45 1.55 0.00 0.00 175.35 179.13 2qxw s SER 263 N -0.72 -0.44 0.00 1.43 0.15 -1.26 -4.93 113.70 107.93 2qxw s SER 263 Ca 0.16 0.43 0.10 0.00 0.70 0.00 0.00 55.95 57.34 2qxw s SER 263 Cb -0.13 0.44 0.23 0.00 -1.71 0.00 0.00 66.02 64.85 2qxw s SER 263 CO 0.05 -0.53 1.12 1.33 1.20 0.00 0.00 173.24 176.41 2qxw n VAL 264 N 1.10 0.69 -3.34 4.45 0.24 -1.26 -4.88 118.33 115.34 2qxw n VAL 264 Ca -0.20 -0.85 -0.41 0.00 -2.04 0.00 0.00 64.34 60.84 2qxw n VAL 264 Cb 0.57 0.72 -0.09 0.00 -1.47 0.00 0.00 33.84 33.57 2qxw n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2qxw s THR 265 N -0.96 5.11 0.27 3.34 2.01 -1.26 -4.80 115.64 119.34 2qxw s THR 265 Ca 0.19 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.41 2qxw s THR 265 Cb 0.11 -3.87 0.25 0.00 0.01 0.00 0.00 72.50 69.00 2qxw s THR 265 CO 0.15 -0.11 1.77 -0.65 -0.69 0.00 0.00 174.62 175.08 2qxw h PRO 266 N 8.43 0.66 -0.68 4.92 0.11 -1.97 0.05 132.00 143.52 2qxw h PRO 266 Ca -0.29 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.74 2qxw h PRO 266 Cb 1.14 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 2qxw h PRO 266 CO 0.72 0.44 0.25 0.93 -0.21 0.00 0.00 178.00 180.13 2qxw h GLU 267 N 0.68 1.01 -0.08 1.05 3.07 -1.99 -1.68 114.58 116.64 2qxw h GLU 267 Ca 0.48 -0.18 -0.23 0.00 -0.50 0.00 0.00 59.36 58.93 2qxw h GLU 267 Cb 0.67 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.42 2qxw h GLU 267 CO -0.35 0.83 -0.87 0.00 -1.40 0.00 0.00 179.01 177.22 2qxw h ARG 268 N 0.98 0.66 -0.20 2.33 3.08 -1.59 -1.14 114.38 118.51 2qxw h ARG 268 Ca 0.23 -0.61 0.06 0.00 0.07 0.00 0.00 59.98 59.73 2qxw h ARG 268 Cb 0.22 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 2qxw h ARG 268 CO -0.02 1.21 -0.24 0.82 -1.07 0.00 0.00 179.97 180.68 2qxw h ILE 269 N 0.42 0.41 -0.25 2.04 2.04 -0.83 0.10 117.51 121.45 2qxw h ILE 269 Ca -0.07 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2qxw h ILE 269 Cb 1.50 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2qxw h ILE 269 CO 0.17 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.32 2qxw h ALA 270 N 0.74 0.33 -0.50 1.87 0.00 -1.29 -3.02 119.26 117.39 2qxw h ALA 270 Ca 0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2qxw h ALA 270 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2qxw h ALA 270 CO -0.35 0.06 0.01 1.49 0.00 0.00 0.00 179.25 180.46 2qxw h GLU 271 N 0.21 0.84 0.00 0.00 4.81 -1.14 -2.97 114.58 116.33 2qxw h GLU 271 Ca 0.07 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2qxw h GLU 271 Cb 0.41 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 2qxw h GLU 271 CO 0.01 0.84 -0.05 -0.91 -0.73 0.00 0.00 179.01 178.17 2qxw h ASN 272 N 0.78 0.00 1.41 1.04 2.35 -0.70 -0.18 115.58 120.29 2qxw h ASN 272 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2qxw h ASN 272 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 2qxw h ASN 272 CO 0.02 0.05 0.00 0.15 -1.65 0.00 0.00 177.43 176.00 2qxw h PHE 273 N 0.00 0.00 -1.05 1.19 3.57 -1.40 -3.39 116.94 115.86 2qxw h PHE 273 Ca -0.00 0.00 -0.74 0.00 3.53 0.00 0.00 57.97 60.76 2qxw h PHE 273 Cb 0.10 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 38.73 2qxw h PHE 273 CO 0.00 0.00 2.51 1.63 -2.23 0.00 0.00 178.31 180.22 2qxw n LYS 274 N -2.59 4.24 0.00 1.11 5.02 -0.08 -4.30 118.16 121.57 2qxw n LYS 274 Ca 0.04 -3.32 0.00 0.00 -2.02 0.00 0.00 58.31 53.01 2qxw n LYS 274 Cb 0.40 -2.73 0.00 0.00 -0.02 0.00 0.00 35.03 32.68 2qxw n LYS 274 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2qxw n VAL 275 N 2.37 0.06 1.42 -0.18 0.24 -1.26 -4.81 118.33 116.16 2qxw n VAL 275 Ca 0.59 -0.28 0.14 0.00 -2.04 0.00 0.00 64.34 62.74 2qxw n VAL 275 Cb 0.27 1.41 0.47 0.00 -1.47 0.00 0.00 33.84 34.52 2qxw n VAL 275 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2qxw n PHE 276 N -0.03 0.00 -1.67 6.34 3.72 -1.26 -4.37 117.46 120.19 2qxw n PHE 276 Ca 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 2qxw n PHE 276 Cb 0.15 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 38.72 2qxw n PHE 276 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2qxw n ASP 277 N 0.06 0.94 -4.33 4.37 5.68 -1.26 -0.83 116.55 121.17 2qxw n ASP 277 Ca 0.17 -2.44 -0.17 0.00 -0.50 0.00 0.00 54.79 51.85 2qxw n ASP 277 Cb 0.37 -0.30 -0.10 0.00 -1.14 0.00 0.00 41.12 39.95 2qxw n ASP 277 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 2qxw s PHE 278 N -1.13 1.57 -0.05 2.11 -0.71 -1.26 -5.05 117.98 113.47 2qxw s PHE 278 Ca 0.14 -0.96 0.01 0.00 -1.04 0.00 0.00 56.93 55.09 2qxw s PHE 278 Cb 0.13 -0.92 0.02 0.00 -1.21 0.00 0.00 43.02 41.03 2qxw s PHE 278 CO 0.00 -0.07 -0.06 -2.00 -1.34 0.00 0.00 175.22 171.75 2qxw s GLU 279 N -3.88 1.02 0.20 1.99 2.12 -1.26 -4.93 118.70 113.96 2qxw s GLU 279 Ca 0.30 -0.17 -0.30 0.00 0.36 0.00 0.00 54.97 55.15 2qxw s GLU 279 Cb 0.06 -0.96 -0.08 0.00 0.26 0.00 0.00 34.13 33.41 2qxw s GLU 279 CO 0.09 -0.06 1.03 -0.51 -0.54 0.00 0.00 175.26 175.28 2qxw s LEU 280 N 0.85 4.55 0.92 2.70 1.43 -1.26 -5.05 118.68 122.82 2qxw s LEU 280 Ca -0.12 2.03 -0.12 0.00 -1.03 0.00 0.00 54.13 54.89 2qxw s LEU 280 Cb -0.15 -3.61 0.14 0.00 0.03 0.00 0.00 46.19 42.61 2qxw s LEU 280 CO 0.01 -0.07 1.11 -0.94 0.23 0.00 0.00 176.35 176.69 2qxw s SER 281 N -0.54 3.33 0.32 2.29 1.04 -1.26 -4.81 113.70 114.07 2qxw s SER 281 Ca 0.46 1.20 -0.00 0.00 0.48 0.00 0.00 55.95 58.08 2qxw s SER 281 Cb -0.28 -1.85 0.53 0.00 0.10 0.00 0.00 66.02 64.52 2qxw s SER 281 CO 0.34 -2.69 1.99 0.77 0.98 0.00 0.00 173.24 174.63 2qxw h SER 282 N -1.59 0.85 -0.49 7.02 4.64 -1.99 -0.17 113.55 121.82 2qxw h SER 282 Ca -0.51 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 60.75 2qxw h SER 282 Cb 1.31 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 2qxw h SER 282 CO 0.58 0.62 0.18 -0.61 -0.87 0.00 0.00 176.83 176.73 2qxw h GLN 283 N 1.00 0.76 -0.52 4.77 4.15 -1.99 0.13 115.11 123.41 2qxw h GLN 283 Ca 0.27 -0.15 0.04 0.00 0.77 0.00 0.00 58.65 59.58 2qxw h GLN 283 Cb -0.12 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.42 2qxw h GLN 283 CO -0.06 0.69 0.28 -0.44 -1.93 0.00 0.00 178.83 177.38 2qxw h ASP 284 N 0.66 0.43 -0.20 -0.69 3.32 -1.72 0.58 116.42 118.81 2qxw h ASP 284 Ca 0.16 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 2qxw h ASP 284 Cb 0.24 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2qxw h ASP 284 CO -0.01 0.30 0.10 0.24 -1.72 0.00 0.00 179.24 178.15 2qxw h MET 285 N 0.56 0.27 -0.58 3.56 2.86 -0.67 0.39 114.93 121.32 2qxw h MET 285 Ca 0.22 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.76 2qxw h MET 285 Cb 0.09 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 2qxw h MET 285 CO -0.13 0.27 0.12 1.79 1.06 0.00 0.00 176.91 180.02 2qxw h THR 286 N 0.20 1.24 -0.28 2.22 1.35 -0.84 -0.25 112.91 116.56 2qxw h THR 286 Ca 0.07 -0.91 -0.01 0.00 -0.55 0.00 0.00 66.41 65.01 2qxw h THR 286 Cb 0.08 0.67 -0.01 0.00 -1.73 0.00 0.00 68.15 67.16 2qxw h THR 286 CO -0.01 0.34 0.13 0.74 -0.25 0.00 0.00 175.52 176.47 2qxw h THR 287 N 0.88 1.15 -0.79 6.82 2.02 -0.62 -1.24 112.91 121.12 2qxw h THR 287 Ca 0.19 -0.43 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 2qxw h THR 287 Cb 0.36 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2qxw h THR 287 CO 0.00 0.15 0.48 -0.07 0.37 0.00 0.00 175.52 176.46 2qxw h LEU 288 N 0.32 0.95 -1.88 2.58 3.38 -0.64 -1.71 115.31 118.31 2qxw h LEU 288 Ca 0.10 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2qxw h LEU 288 Cb 0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2qxw h LEU 288 CO -0.01 0.73 0.09 -0.07 0.09 0.00 0.00 178.44 179.28 2qxw h LEU 289 N 1.09 0.14 -0.34 1.67 3.38 -0.76 -2.21 115.31 118.28 2qxw h LEU 289 Ca 0.29 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2qxw h LEU 289 Cb -0.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2qxw h LEU 289 CO -0.05 0.10 0.00 -1.54 0.09 0.00 0.00 178.44 177.04 2qxw n SER 290 N -4.52 0.27 -0.17 -0.43 3.41 -0.49 -2.28 113.62 109.40 2qxw n SER 290 Ca -0.01 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.32 2qxw n SER 290 Cb 0.10 -0.63 0.72 0.00 -0.26 0.00 0.00 64.21 64.15 2qxw n SER 290 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2qxw n TYR 291 N -1.81 0.02 -1.69 7.33 4.01 -0.83 -4.91 117.16 119.28 2qxw n TYR 291 Ca 0.02 -0.01 -0.43 0.00 -0.16 0.00 0.00 57.90 57.32 2qxw n TYR 291 Cb 0.17 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.18 2qxw n TYR 291 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2qxw n ASN 292 N -0.55 2.80 -0.10 7.72 5.15 -0.37 -4.32 115.26 125.59 2qxw n ASN 292 Ca 0.20 1.18 0.00 0.00 -0.60 0.00 0.00 54.58 55.36 2qxw n ASN 292 Cb 0.18 -1.47 0.00 0.00 -0.53 0.00 0.00 39.78 37.97 2qxw n ASN 292 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2qxw n ARG 293 N 1.22 0.39 -3.87 1.20 5.12 -0.33 -4.97 116.66 115.42 2qxw n ARG 293 Ca 0.08 -0.79 -0.28 0.00 -1.93 0.00 0.00 57.85 54.93 2qxw n ARG 293 Cb 0.34 -0.59 0.03 0.00 -1.16 0.00 0.00 32.46 31.08 2qxw n ARG 293 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2qxw n ASN 294 N -0.11 -3.99 -4.38 0.55 3.02 -0.44 -4.88 115.26 105.04 2qxw n ASN 294 Ca 0.01 -0.79 -0.45 0.00 -0.03 0.00 0.00 54.58 53.32 2qxw n ASN 294 Cb 0.51 -3.91 -0.06 0.00 -0.61 0.00 0.00 39.78 35.71 2qxw n ASN 294 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2qxw s TRP 295 N -3.39 3.17 -0.34 3.10 -0.00 -0.66 -5.00 118.94 115.82 2qxw s TRP 295 Ca 0.52 -0.91 -0.13 0.00 -0.00 0.00 0.00 56.10 55.58 2qxw s TRP 295 Cb -0.26 -3.48 -0.02 0.00 -0.00 0.00 0.00 33.47 29.71 2qxw s TRP 295 CO 0.83 -0.96 0.24 0.50 -0.00 0.00 0.00 176.95 177.56 2qxw s ARG 296 N 2.00 3.48 0.22 5.86 3.52 -1.26 -4.33 118.95 128.43 2qxw s ARG 296 Ca 0.07 -0.65 0.15 0.00 -0.13 0.00 0.00 55.73 55.17 2qxw s ARG 296 Cb -0.24 -3.80 0.00 0.00 -1.56 0.00 0.00 34.95 29.35 2qxw s ARG 296 CO 0.07 -0.45 1.29 -0.24 -0.81 0.00 0.00 175.30 175.17 2qxw h VAL 297 N 5.50 0.82 -3.50 7.11 3.04 -1.95 -3.42 116.25 123.84 2qxw h VAL 297 Ca -0.31 -2.22 -0.71 0.00 -1.01 0.00 0.00 66.70 62.45 2qxw h VAL 297 Cb 1.16 2.35 -0.33 0.00 -2.01 0.00 0.00 31.29 32.46 2qxw h VAL 297 CO 0.63 0.47 -0.36 0.00 -1.01 0.00 0.00 177.57 177.30 2qxw s ALA 299 N 0.55 -0.51 -0.27 0.00 0.00 -1.26 -5.06 121.76 115.22 2qxw s ALA 299 Ca 0.13 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.57 2qxw s ALA 299 Cb -0.21 0.79 0.15 0.00 0.00 0.00 0.00 23.12 23.86 2qxw s ALA 299 CO -0.04 -0.69 0.50 -1.17 0.00 0.00 0.00 175.76 174.37 2qxw s LEU 300 N -2.90 -1.00 0.25 0.00 2.96 -1.26 -5.04 118.68 111.69 2qxw s LEU 300 Ca 0.11 0.72 -0.03 0.00 -0.22 0.00 0.00 54.13 54.70 2qxw s LEU 300 Cb 0.02 1.70 0.42 0.00 0.50 0.00 0.00 46.19 48.83 2qxw s LEU 300 CO -0.04 -0.27 1.83 0.25 -1.32 0.00 0.00 176.35 176.80 2qxw h LEU 301 N 8.09 0.78 -2.98 -0.68 5.85 -2.01 -1.68 115.31 122.68 2qxw h LEU 301 Ca -0.20 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 2qxw h LEU 301 Cb 1.15 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 2qxw h LEU 301 CO 0.23 0.45 -0.00 0.77 -0.34 0.00 0.00 178.44 179.56 2qxw h SER 302 N 0.89 0.00 -0.01 1.25 4.64 -1.97 -1.98 113.55 116.38 2qxw h SER 302 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2qxw h SER 302 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2qxw h SER 302 CO -0.23 0.00 -0.57 0.00 -0.87 0.00 0.00 176.83 175.16 2qxw h THR 304 N 1.20 0.04 0.00 0.00 1.35 -1.26 -1.13 112.91 113.11 2qxw h THR 304 Ca 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2qxw h THR 304 Cb 0.54 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 2qxw h THR 304 CO 0.00 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.73 2qxw n SER 305 N -3.13 0.00 -4.78 5.36 3.41 -1.26 -4.86 113.62 108.36 2qxw n SER 305 Ca -0.03 0.40 -0.39 0.00 -0.26 0.00 0.00 58.87 58.59 2qxw n SER 305 Cb 0.09 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 63.53 2qxw n SER 305 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2qxw s HIS 306 N -2.91 3.84 0.49 7.33 5.04 -0.43 -4.95 115.29 123.71 2qxw s HIS 306 Ca 0.11 1.63 0.20 0.00 -1.54 0.00 0.00 55.06 55.45 2qxw s HIS 306 Cb 0.12 -2.78 1.23 0.00 0.04 0.00 0.00 32.58 31.20 2qxw s HIS 306 CO 0.32 0.44 2.00 1.57 -2.34 0.00 0.00 174.74 176.74 2qxw h LYS 307 N 4.00 0.16 -0.56 2.88 2.10 -1.89 -1.60 116.57 121.66 2qxw h LYS 307 Ca -0.47 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 2qxw h LYS 307 Cb 1.20 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 2qxw h LYS 307 CO 0.66 0.11 0.00 -0.25 -2.00 0.00 0.00 179.45 177.97 2qxw n ASP 308 N -4.44 4.31 -4.72 7.07 8.00 -1.26 -4.98 116.55 120.53 2qxw n ASP 308 Ca 0.09 -2.41 -0.43 0.00 0.71 0.00 0.00 54.79 52.75 2qxw n ASP 308 Cb 0.46 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 2qxw n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qxw n TYR 309 N 0.87 2.67 0.24 1.24 9.36 -0.60 -4.40 117.16 126.54 2qxw n TYR 309 Ca 0.23 0.16 0.12 0.00 3.32 0.00 0.00 57.90 61.73 2qxw n TYR 309 Cb 0.80 -2.62 0.13 0.00 -0.63 0.00 0.00 39.34 37.02 2qxw n TYR 309 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2qxw h PRO 310 N 5.90 0.00 0.00 2.98 0.13 -1.92 -3.47 132.00 135.63 2qxw h PRO 310 Ca -0.45 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.26 2qxw h PRO 310 Cb 1.22 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.38 2qxw h PRO 310 CO 0.89 0.00 -0.03 1.19 -0.23 0.00 0.00 178.00 179.81 2qxw n PHE 311 N -2.83 -2.48 -1.98 1.56 3.72 -1.26 -4.65 117.46 109.54 2qxw n PHE 311 Ca 0.03 -1.83 0.00 0.00 -0.05 0.00 0.00 57.45 55.60 2qxw n PHE 311 Cb 0.52 -0.52 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 2qxw n PHE 311 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43