#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qjs s MET 25 N 0.00 2.02 0.19 0.54 0.23 -1.25 -4.98 119.30 116.05 2qjs s MET 25 Ca 0.00 -2.20 -0.05 0.00 -1.03 0.00 0.00 55.69 52.41 2qjs s MET 25 Cb 0.00 -1.56 -0.06 0.00 -1.53 0.00 0.00 34.83 31.68 2qjs s MET 25 CO 0.00 -0.16 0.43 0.00 -2.03 0.00 0.00 175.02 173.26 2qjs s ALA 26 N -2.79 3.74 1.02 3.16 0.00 -1.26 -4.94 121.76 120.69 2qjs s ALA 26 Ca 0.25 -0.56 -0.21 0.00 0.00 0.00 0.00 51.96 51.45 2qjs s ALA 26 Cb 0.07 -2.18 -0.08 0.00 0.00 0.00 0.00 23.12 20.93 2qjs s ALA 26 CO 0.13 0.55 -0.73 -2.30 0.00 0.00 0.00 175.76 173.41 2qjs n PRO 27 N -0.21 -0.41 -3.21 0.00 -0.02 -1.26 -4.93 135.00 124.95 2qjs n PRO 27 Ca -0.02 -0.11 -0.01 0.00 -2.02 0.00 0.00 63.50 61.34 2qjs n PRO 27 Cb 0.52 -1.28 -0.02 0.00 -0.02 0.00 0.00 33.50 32.70 2qjs n PRO 27 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2qjs s LEU 28 N 4.57 -1.37 0.25 2.45 2.96 -1.20 -4.92 118.68 121.43 2qjs s LEU 28 Ca 0.45 -0.49 -0.28 0.00 -0.22 0.00 0.00 54.13 53.59 2qjs s LEU 28 Cb -0.06 1.78 -0.15 0.00 0.50 0.00 0.00 46.19 48.25 2qjs s LEU 28 CO 0.71 -0.24 0.81 1.67 -1.32 0.00 0.00 176.35 177.98 2qjs n GLN 47 N 4.83 0.79 0.00 1.98 7.27 -1.26 -1.65 117.38 129.34 2qjs n GLN 47 Ca 0.08 0.28 0.00 0.00 0.07 0.00 0.00 57.00 57.43 2qjs n GLN 47 Cb 0.54 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.69 2qjs n GLN 47 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 2qjs n ILE 48 N 0.16 0.00 -4.11 1.69 2.08 0.23 -4.86 119.36 114.56 2qjs n ILE 48 Ca 0.13 0.00 -0.14 0.00 0.56 0.00 0.00 62.75 63.30 2qjs n ILE 48 Cb 0.29 -0.81 -0.06 0.00 -0.75 0.00 0.00 39.64 38.32 2qjs n ILE 48 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2qjs s ALA 49 N -1.91 0.76 0.35 -1.39 0.00 -1.09 -4.97 121.76 113.51 2qjs s ALA 49 Ca 0.00 -1.49 0.16 0.00 0.00 0.00 0.00 51.96 50.64 2qjs s ALA 49 Cb 0.00 1.21 1.14 0.00 0.00 0.00 0.00 23.12 25.47 2qjs s ALA 49 CO 0.00 -0.76 1.65 -0.44 0.00 0.00 0.00 175.76 176.21 2qjs h ASP 50 N 2.21 0.48 0.00 0.00 5.19 -1.27 -2.69 116.42 120.34 2qjs h ASP 50 Ca -0.29 0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2qjs h ASP 50 Cb 1.24 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.91 2qjs h ASP 50 CO 0.40 -0.19 0.00 1.41 -3.12 0.00 0.00 179.24 177.74 2qjs n HIS 51 N -5.07 0.00 -3.64 4.55 8.25 -1.26 -5.02 115.22 113.02 2qjs n HIS 51 Ca 0.33 -0.12 -0.36 0.00 -0.26 0.00 0.00 57.72 57.31 2qjs n HIS 51 Cb 1.05 -0.01 -0.08 0.00 1.12 0.00 0.00 29.99 32.07 2qjs n HIS 51 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2qjs s THR 52 N -0.24 5.36 0.05 1.59 2.01 -1.02 -1.62 115.64 121.77 2qjs s THR 52 Ca 0.00 0.31 0.04 0.00 0.31 0.00 0.00 61.69 62.35 2qjs s THR 52 Cb 0.00 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 2qjs s THR 52 CO 0.00 0.39 -0.12 0.26 -0.69 0.00 0.00 174.62 174.46 2qjs s TRP 53 N 0.64 1.04 -0.53 4.92 0.52 0.98 0.77 118.94 127.30 2qjs s TRP 53 Ca 0.11 -0.41 -0.17 0.00 0.02 0.00 0.00 56.10 55.65 2qjs s TRP 53 Cb -0.12 -0.61 0.10 0.00 -1.15 0.00 0.00 33.47 31.69 2qjs s TRP 53 CO 0.02 0.01 0.53 -1.14 0.02 0.00 0.00 176.95 176.39 2qjs s GLN 54 N -1.41 3.02 -0.14 4.98 2.00 -0.66 0.15 119.66 127.60 2qjs s GLN 54 Ca -0.03 -1.41 0.17 0.00 -2.00 0.00 0.00 55.36 52.09 2qjs s GLN 54 Cb -0.09 -4.22 0.68 0.00 0.80 0.00 0.00 33.01 30.18 2qjs s GLN 54 CO 0.01 -1.28 1.59 0.44 -0.50 0.00 0.00 175.29 175.56 2qjs n ILE 55 N 5.35 2.00 -0.08 -2.34 -5.35 0.40 -3.20 119.36 116.13 2qjs n ILE 55 Ca -0.12 -1.32 0.00 0.00 -0.27 0.00 0.00 62.75 61.04 2qjs n ILE 55 Cb 0.42 0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 2qjs n ILE 55 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qjs n GLY 56 N 0.74 1.14 0.24 3.28 0.00 -1.24 -4.71 105.19 104.64 2qjs n GLY 56 Ca 0.24 -1.49 -0.01 0.00 0.00 0.00 0.00 46.02 44.76 2qjs n GLY 56 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qjs n THR 57 N 0.00 0.00 0.39 2.61 -2.24 -0.64 -3.97 114.28 110.43 2qjs n THR 57 Ca 0.00 -0.13 0.13 0.00 -2.27 0.00 0.00 64.05 61.78 2qjs n THR 57 Cb 0.00 -0.68 0.51 0.00 -2.10 0.00 0.00 70.33 68.06 2qjs n THR 57 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2qjs h GLU 66 N 0.00 0.00 0.00 -0.78 5.08 -1.97 -3.26 114.58 113.66 2qjs h GLU 66 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2qjs h GLU 66 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2qjs h GLU 66 CO 0.03 0.00 -0.02 -0.25 -1.00 0.00 0.00 179.01 177.77 2qjs n ASP 67 N -2.49 1.21 -3.32 1.42 8.00 -1.26 -4.52 116.55 115.59 2qjs n ASP 67 Ca 0.02 -1.71 -0.07 0.00 0.71 0.00 0.00 54.79 53.74 2qjs n ASP 67 Cb 0.29 -0.04 -0.07 0.00 -0.02 0.00 0.00 41.12 41.29 2qjs n ASP 67 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qjs s LEU 68 N -0.72 -0.77 0.43 0.64 1.43 -1.23 -4.75 118.68 113.72 2qjs s LEU 68 Ca 0.02 0.24 -0.25 0.00 -1.03 0.00 0.00 54.13 53.11 2qjs s LEU 68 Cb 0.02 1.27 -0.08 0.00 0.03 0.00 0.00 46.19 47.43 2qjs s LEU 68 CO 0.00 -0.30 1.27 -0.89 0.23 0.00 0.00 176.35 176.66 2qjs s THR 69 N 2.59 2.70 -0.45 5.49 2.01 -0.72 -1.62 115.64 125.63 2qjs s THR 69 Ca 0.13 0.59 0.06 0.00 0.31 0.00 0.00 61.69 62.78 2qjs s THR 69 Cb -0.15 -3.33 0.18 0.00 0.01 0.00 0.00 72.50 69.21 2qjs s THR 69 CO -0.18 0.06 0.56 0.00 -0.69 0.00 0.00 174.62 174.36 2qjs s ALA 70 N -1.34 -1.09 -0.36 7.40 0.00 -1.26 -3.99 121.76 121.13 2qjs s ALA 70 Ca 0.60 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 51.42 2qjs s ALA 70 Cb -0.36 -2.36 0.02 0.00 0.00 0.00 0.00 23.12 20.43 2qjs s ALA 70 CO 0.45 -2.16 1.12 -0.51 0.00 0.00 0.00 175.76 174.66 2qjs s LEU 71 N 0.98 3.85 -0.18 0.00 1.43 -1.04 -0.46 118.68 123.26 2qjs s LEU 71 Ca 0.26 0.92 -0.11 0.00 -1.03 0.00 0.00 54.13 54.16 2qjs s LEU 71 Cb -0.03 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.60 2qjs s LEU 71 CO -0.08 -1.01 0.20 -0.22 0.23 0.00 0.00 176.35 175.47 2qjs s LEU 72 N 3.96 4.23 -0.15 1.79 2.96 0.12 -1.07 118.68 130.54 2qjs s LEU 72 Ca 0.48 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 2qjs s LEU 72 Cb -0.11 -2.21 0.03 0.00 0.50 0.00 0.00 46.19 44.40 2qjs s LEU 72 CO 0.21 0.16 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.60 2qjs s VAL 73 N 0.32 1.38 -0.44 1.68 1.01 0.58 -0.01 120.40 124.93 2qjs s VAL 73 Ca 0.12 -0.58 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 2qjs s VAL 73 Cb -0.12 -1.36 0.04 0.00 0.00 0.00 0.00 36.38 34.94 2qjs s VAL 73 CO 0.01 0.37 0.40 -1.10 0.00 0.00 0.00 175.10 174.78 2qjs s GLN 74 N 1.55 3.02 0.22 2.72 -0.21 -0.64 -0.11 119.66 126.22 2qjs s GLN 74 Ca 0.04 -1.03 0.07 0.00 0.02 0.00 0.00 55.36 54.46 2qjs s GLN 74 Cb -0.13 -4.03 -0.04 0.00 1.00 0.00 0.00 33.01 29.81 2qjs s GLN 74 CO -0.09 -0.91 0.08 0.95 -2.12 0.00 0.00 175.29 173.20 2qjs s THR 75 N 1.89 4.02 0.21 -0.19 -4.23 0.02 -4.84 115.64 112.51 2qjs s THR 75 Ca 0.08 -1.48 -0.09 0.00 -1.18 0.00 0.00 61.69 59.01 2qjs s THR 75 Cb -0.20 -3.11 0.14 0.00 1.34 0.00 0.00 72.50 70.67 2qjs s THR 75 CO 0.10 -0.25 1.78 1.55 -0.54 0.00 0.00 174.62 177.26 2qjs h PRO 76 N 2.07 0.54 -0.95 3.99 0.13 -1.85 -2.68 132.00 133.25 2qjs h PRO 76 Ca -0.47 -0.03 -0.50 0.00 -0.87 0.00 0.00 66.00 64.13 2qjs h PRO 76 Cb 1.23 -0.12 -0.29 0.00 0.13 0.00 0.00 31.00 31.94 2qjs h PRO 76 CO 0.60 0.36 0.61 -0.25 -0.23 0.00 0.00 178.00 179.09 2qjs n ASP 78 N -4.88 3.82 0.00 1.44 9.92 -1.26 -4.99 116.55 120.59 2qjs n ASP 78 Ca 0.08 -3.63 0.00 0.00 -0.53 0.00 0.00 54.79 50.71 2qjs n ASP 78 Cb 0.22 -0.83 0.00 0.00 -0.64 0.00 0.00 41.12 39.87 2qjs n ASP 78 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qjs n GLY 79 N -1.14 3.57 3.24 0.44 0.00 -1.01 -4.72 105.19 105.57 2qjs n GLY 79 Ca 0.58 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 2qjs n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjs s ALA 80 N -2.00 2.09 0.00 4.61 0.00 -1.09 -0.80 121.76 124.57 2qjs s ALA 80 Ca 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 51.96 50.96 2qjs s ALA 80 Cb 0.00 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2qjs s ALA 80 CO 0.00 0.36 0.18 0.08 0.00 0.00 0.00 175.76 176.37 2qjs s VAL 81 N 0.04 5.37 -0.19 0.00 1.01 0.85 -1.52 120.40 125.95 2qjs s VAL 81 Ca -0.09 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2qjs s VAL 81 Cb -0.15 -3.52 0.04 0.00 0.00 0.00 0.00 36.38 32.74 2qjs s VAL 81 CO 0.05 0.30 -0.13 -0.22 0.00 0.00 0.00 175.10 175.10 2qjs s LEU 82 N -2.01 2.27 -0.49 3.92 2.96 -0.42 -0.31 118.68 124.60 2qjs s LEU 82 Ca 0.28 -0.82 -0.15 0.00 -0.22 0.00 0.00 54.13 53.22 2qjs s LEU 82 Cb -0.13 -1.31 0.09 0.00 0.50 0.00 0.00 46.19 45.34 2qjs s LEU 82 CO 0.20 -0.10 0.42 -0.76 -1.32 0.00 0.00 176.35 174.78 2qjs s LEU 83 N 1.36 5.76 0.32 -0.68 1.02 -0.23 -1.30 118.68 124.93 2qjs s LEU 83 Ca 0.00 -1.46 0.00 0.00 0.02 0.00 0.00 54.13 52.70 2qjs s LEU 83 Cb -0.15 -2.18 0.00 0.00 0.02 0.00 0.00 46.19 43.87 2qjs s LEU 83 CO -0.09 -0.70 0.00 0.47 0.02 0.00 0.00 176.35 176.05 2qjs n ASP 84 N 5.21 -4.25 -0.48 2.29 8.00 0.40 -2.50 116.55 125.22 2qjs n ASP 84 Ca -0.13 0.87 0.00 0.00 0.71 0.00 0.00 54.79 56.25 2qjs n ASP 84 Cb 0.43 -2.39 0.00 0.00 -0.02 0.00 0.00 41.12 39.14 2qjs n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qjs n GLY 85 N -2.66 0.47 7.00 0.44 0.00 -0.95 -4.24 105.19 105.25 2qjs n GLY 85 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2qjs n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjs n GLY 86 N 0.00 2.12 3.78 -0.02 0.00 -1.19 -4.61 105.19 105.26 2qjs n GLY 86 Ca 0.00 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 2qjs n GLY 86 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qjs s MET 87 N 0.00 2.37 0.24 1.61 -1.94 -1.19 -2.19 119.30 118.20 2qjs s MET 87 Ca 0.00 1.02 -0.06 0.00 -1.71 0.00 0.00 55.69 54.94 2qjs s MET 87 Cb 0.00 -1.92 0.25 0.00 2.01 0.00 0.00 34.83 35.17 2qjs s MET 87 CO 0.00 -1.52 1.85 -1.35 -0.01 0.00 0.00 175.02 173.99 2qjs h PRO 89 N -1.03 1.20 0.00 2.03 0.11 -1.76 -2.76 132.00 129.78 2qjs h PRO 89 Ca -0.44 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.51 2qjs h PRO 89 Cb 1.23 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2qjs h PRO 89 CO 0.54 0.89 0.00 0.00 -0.21 0.00 0.00 178.00 179.22 2qjs n GLN 90 N -4.32 0.55 -1.17 1.05 10.64 -1.26 -3.63 117.38 119.24 2qjs n GLN 90 Ca 0.09 0.00 -0.19 0.00 -1.83 0.00 0.00 57.00 55.07 2qjs n GLN 90 Cb 0.11 -1.35 0.22 0.00 -0.86 0.00 0.00 30.24 28.36 2qjs n GLN 90 CO 0.00 0.00 0.00 -1.33 -1.83 0.00 0.00 177.06 173.90 2qjs n MET 91 N -0.85 2.65 -0.02 2.61 2.81 -1.04 -4.56 117.12 118.72 2qjs n MET 91 Ca 0.09 -3.04 -0.16 0.00 -1.81 0.00 0.00 57.70 52.78 2qjs n MET 91 Cb 0.04 -2.18 -0.12 0.00 -0.71 0.00 0.00 33.22 30.25 2qjs n MET 91 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qjs h ALA 92 N 1.46 0.03 0.06 3.04 0.00 -1.82 -2.06 119.26 119.97 2qjs h ALA 92 Ca 0.53 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2qjs h ALA 92 Cb 2.71 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 20.50 2qjs h ALA 92 CO 1.00 0.16 -0.19 0.77 0.00 0.00 0.00 179.25 180.99 2qjs h SER 93 N -0.44 -0.54 -0.95 0.00 0.02 -1.92 -1.36 113.55 108.37 2qjs h SER 93 Ca -0.05 0.07 0.09 0.00 -0.84 0.00 0.00 61.79 61.06 2qjs h SER 93 Cb 1.13 0.21 -0.08 0.00 0.14 0.00 0.00 62.40 63.81 2qjs h SER 93 CO 0.07 -0.26 0.59 -0.74 -1.14 0.00 0.00 176.83 175.35 2qjs h HIS 94 N -0.34 1.08 -0.40 3.45 6.17 -1.87 1.51 115.15 124.75 2qjs h HIS 94 Ca 0.04 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.16 2qjs h HIS 94 Cb 0.38 -0.34 -0.02 0.00 2.52 0.00 0.00 27.41 29.95 2qjs h HIS 94 CO -0.21 0.48 0.27 -0.07 0.71 0.00 0.00 177.93 179.10 2qjs h LEU 95 N 0.99 0.46 -0.01 0.26 3.38 -0.76 0.57 115.31 120.21 2qjs h LEU 95 Ca 0.45 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.39 2qjs h LEU 95 Cb 0.35 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qjs h LEU 95 CO -0.23 0.33 -0.07 -0.07 0.09 0.00 0.00 178.44 178.49 2qjs h LEU 96 N 0.54 0.07 -0.95 1.67 3.38 -0.78 -2.27 115.31 116.97 2qjs h LEU 96 Ca 0.15 -0.73 0.28 0.00 0.09 0.00 0.00 57.88 57.66 2qjs h LEU 96 Cb -0.06 -0.02 -0.18 0.00 0.09 0.00 0.00 40.66 40.49 2qjs h LEU 96 CO -0.03 0.80 0.07 0.47 0.09 0.00 0.00 178.44 179.84 2qjs n ASP 97 N -4.67 -0.06 0.12 -0.43 8.00 0.51 0.16 116.55 120.18 2qjs n ASP 97 Ca -0.09 1.61 -0.02 0.00 0.71 0.00 0.00 54.79 57.00 2qjs n ASP 97 Cb 0.40 -0.61 0.07 0.00 -0.02 0.00 0.00 41.12 40.97 2qjs n ASP 97 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 2qjs h ASN 98 N 0.00 0.00 0.00 -2.24 4.21 0.16 -2.44 115.58 115.27 2qjs h ASN 98 Ca 0.60 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 58.11 2qjs h ASN 98 Cb 1.29 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.49 2qjs h ASN 98 CO -0.87 0.70 -0.00 0.24 -1.29 0.00 0.00 177.43 176.20 2qjs h MET 99 N 0.00 0.00 -0.72 0.81 2.86 0.14 -3.17 114.93 114.86 2qjs h MET 99 Ca -0.01 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.71 2qjs h MET 99 Cb 1.34 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.94 2qjs h MET 99 CO 0.09 0.85 0.38 -0.22 1.06 0.00 0.00 176.91 179.08 2qjs h LYS 100 N -0.85 0.65 -0.90 1.72 3.64 0.23 0.15 116.57 121.20 2qjs h LYS 100 Ca -0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2qjs h LYS 100 Cb 0.85 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2qjs h LYS 100 CO 0.00 0.43 0.00 0.00 -2.27 0.00 0.00 179.45 177.61 2qjs n ALA 101 N -2.38 2.27 -1.10 5.00 0.00 -0.92 -2.75 120.51 120.63 2qjs n ALA 101 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2qjs n ALA 101 Cb 0.24 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2qjs n ALA 101 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2qjs n ARG 102 N 0.18 0.00 -0.64 0.00 0.00 0.44 -5.00 116.66 111.64 2qjs n ARG 102 Ca 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 2qjs n ARG 102 Cb 0.25 -0.45 0.00 0.00 0.00 0.00 0.00 32.46 32.26 2qjs n ARG 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qjs n GLY 103 N 0.00 0.65 3.42 5.14 0.00 -0.83 -5.05 105.19 108.52 2qjs n GLY 103 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2qjs n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjs s VAL 104 N -1.83 -0.79 0.45 1.61 1.01 -0.71 -5.01 120.40 115.12 2qjs s VAL 104 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.11 2qjs s VAL 104 Cb 0.00 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.59 2qjs s VAL 104 CO 0.00 0.04 0.64 0.42 0.00 0.00 0.00 175.10 176.20 2qjs s THR 105 N 2.73 3.45 0.29 3.92 -4.23 -1.26 -1.97 115.64 118.57 2qjs s THR 105 Ca -0.03 -0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 59.69 2qjs s THR 105 Cb -0.12 -3.24 0.42 0.00 1.34 0.00 0.00 72.50 70.90 2qjs s THR 105 CO -0.15 -0.14 1.57 -0.65 -0.54 0.00 0.00 174.62 174.71 2qjs h PRO 106 N 0.46 0.01 -0.12 3.99 0.11 -1.97 1.39 132.00 135.86 2qjs h PRO 106 Ca -0.44 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.71 2qjs h PRO 106 Cb 1.27 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 2qjs h PRO 106 CO 0.53 0.01 0.34 0.00 -0.21 0.00 0.00 178.00 178.66 2qjs h ARG 107 N 0.01 0.00 0.02 1.05 3.08 -1.93 -2.39 114.38 114.23 2qjs h ARG 107 Ca 0.53 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 60.32 2qjs h ARG 107 Cb 0.96 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.98 2qjs h ARG 107 CO -0.94 0.00 -1.34 -0.44 -1.07 0.00 0.00 179.97 176.18 2qjs h ASP 108 N 0.00 0.08 -2.63 7.04 3.32 0.15 -3.44 116.42 120.94 2qjs h ASP 108 Ca 0.06 -0.11 -0.56 0.00 0.02 0.00 0.00 57.03 56.44 2qjs h ASP 108 Cb 0.74 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 2qjs h ASP 108 CO -0.00 1.09 1.27 -0.22 -1.72 0.00 0.00 179.24 179.65 2qjs s LEU 109 N -6.55 3.48 -0.12 1.55 2.96 -0.95 -2.66 118.68 116.39 2qjs s LEU 109 Ca -0.03 1.10 -0.07 0.00 -0.22 0.00 0.00 54.13 54.91 2qjs s LEU 109 Cb 0.09 -3.36 -0.26 0.00 0.50 0.00 0.00 46.19 43.16 2qjs s LEU 109 CO 0.83 -1.79 0.38 0.54 -1.32 0.00 0.00 176.35 174.99 2qjs n ARG 110 N 8.50 0.76 -4.06 1.98 1.74 -0.57 -2.56 116.66 122.46 2qjs n ARG 110 Ca 0.22 0.26 -0.13 0.00 -0.77 0.00 0.00 57.85 57.43 2qjs n ARG 110 Cb 0.48 -1.71 -0.12 0.00 -1.02 0.00 0.00 32.46 30.08 2qjs n ARG 110 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2qjs s LEU 111 N -7.06 2.19 -0.26 0.55 2.96 -1.18 -2.99 118.68 112.89 2qjs s LEU 111 Ca -0.22 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.24 2qjs s LEU 111 Cb 0.07 -0.14 0.08 0.00 0.50 0.00 0.00 46.19 46.70 2qjs s LEU 111 CO 0.77 -0.16 0.09 -0.63 -1.32 0.00 0.00 176.35 175.10 2qjs s ILE 112 N -1.08 0.47 0.24 6.68 1.01 -0.70 -1.31 121.20 126.51 2qjs s ILE 112 Ca -0.08 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 59.72 2qjs s ILE 112 Cb -0.08 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.13 2qjs s ILE 112 CO 0.00 -0.52 0.31 -0.76 0.00 0.00 0.00 174.94 173.97 2qjs s LEU 113 N 1.84 4.17 0.04 2.97 1.43 -0.42 -2.30 118.68 126.41 2qjs s LEU 113 Ca 0.06 -0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 2qjs s LEU 113 Cb -0.17 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.31 2qjs s LEU 113 CO -0.22 -0.05 -0.08 -0.76 0.23 0.00 0.00 176.35 175.47 2qjs s LEU 114 N -3.87 2.24 -0.06 1.79 1.43 -1.26 -0.45 118.68 118.49 2qjs s LEU 114 Ca 0.34 -0.52 -0.23 0.00 -1.03 0.00 0.00 54.13 52.69 2qjs s LEU 114 Cb -0.09 -0.21 -0.18 0.00 0.03 0.00 0.00 46.19 45.75 2qjs s LEU 114 CO 0.28 -0.17 0.92 0.77 0.23 0.00 0.00 176.35 178.37 2qjs h SER 115 N 4.61 -0.12 -5.01 2.29 4.64 -1.90 -3.43 113.55 114.63 2qjs h SER 115 Ca -0.36 -0.46 -0.04 0.00 -0.47 0.00 0.00 61.79 60.46 2qjs h SER 115 Cb 1.20 0.03 -0.14 0.00 -0.31 0.00 0.00 62.40 63.18 2qjs h SER 115 CO 0.41 0.49 0.13 -1.38 -0.87 0.00 0.00 176.83 175.61 2qjs s HIS 116 N -3.37 -0.49 -0.12 4.77 0.00 -1.26 -1.74 115.29 113.08 2qjs s HIS 116 Ca -0.14 0.46 -0.05 0.00 -3.00 0.00 0.00 55.06 52.33 2qjs s HIS 116 Cb 0.00 0.44 -0.15 0.00 -4.00 0.00 0.00 32.58 28.87 2qjs s HIS 116 CO 0.53 -0.74 3.23 0.00 -1.00 0.00 0.00 174.74 176.76 2qjs n ALA 117 N 0.07 6.14 -2.91 -1.38 0.00 -1.26 -4.41 120.51 116.76 2qjs n ALA 117 Ca -0.18 -1.94 -0.21 0.00 0.00 0.00 0.00 53.44 51.11 2qjs n ALA 117 Cb 0.62 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.92 2qjs n ALA 117 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2qjs s HIS 118 N 0.18 3.34 0.27 0.00 3.76 -1.26 -4.56 115.29 117.02 2qjs s HIS 118 Ca 0.58 -0.05 -0.02 0.00 -0.15 0.00 0.00 55.06 55.41 2qjs s HIS 118 Cb 0.30 -1.53 0.42 0.00 1.11 0.00 0.00 32.58 32.88 2qjs s HIS 118 CO -0.05 0.45 1.87 0.00 -0.85 0.00 0.00 174.74 176.16 2qjs h ALA 119 N 1.26 1.38 -0.11 -1.40 0.00 -1.91 0.23 119.26 118.71 2qjs h ALA 119 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2qjs h ALA 119 Cb 1.23 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2qjs h ALA 119 CO 0.61 0.38 0.00 0.09 0.00 0.00 0.00 179.25 180.32 2qjs n ASN 120 N -4.54 0.93 0.00 0.00 4.13 -1.26 -1.83 115.26 112.69 2qjs n ASN 120 Ca 0.16 -1.67 0.00 0.00 1.68 0.00 0.00 54.58 54.74 2qjs n ASN 120 Cb 0.22 -0.07 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 2qjs n ASN 120 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2qjs n HIS 121 N -0.13 0.00 -0.94 3.10 8.25 -0.48 -3.15 115.22 121.88 2qjs n HIS 121 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2qjs n HIS 121 Cb 0.20 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 2qjs n HIS 121 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qjs n ALA 122 N -0.54 1.33 -0.23 -1.41 0.00 0.69 -2.24 120.51 118.11 2qjs n ALA 122 Ca 0.00 -0.71 0.03 0.00 0.00 0.00 0.00 53.44 52.76 2qjs n ALA 122 Cb 0.00 -0.07 0.15 0.00 0.00 0.00 0.00 19.45 19.53 2qjs n ALA 122 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qjs h GLY 123 N 0.00 0.90 -1.15 0.00 0.00 -1.13 -2.98 103.07 98.71 2qjs h GLY 123 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2qjs h GLY 123 CO 0.00 -0.17 0.00 -1.55 0.00 0.00 0.00 176.54 174.82 2qjs n PRO 124 N -5.17 1.88 -0.35 4.80 -0.04 -1.24 -4.36 135.00 130.51 2qjs n PRO 124 Ca 0.12 -1.33 -0.02 0.00 -0.04 0.00 0.00 63.50 62.22 2qjs n PRO 124 Cb 0.40 -1.40 0.11 0.00 -0.04 0.00 0.00 33.50 32.58 2qjs n PRO 124 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qjs h VAL 125 N 2.58 1.26 0.14 0.52 2.07 -1.87 -0.42 116.25 120.52 2qjs h VAL 125 Ca 0.00 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2qjs h VAL 125 Cb 0.57 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2qjs h VAL 125 CO 0.00 0.26 -0.13 0.00 0.02 0.00 0.00 177.57 177.72 2qjs h ALA 126 N 1.35 -0.26 -0.73 1.67 0.00 -1.80 -2.14 119.26 117.34 2qjs h ALA 126 Ca 0.34 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.25 2qjs h ALA 126 Cb -0.09 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 2qjs h ALA 126 CO -0.07 -0.67 0.46 1.49 0.00 0.00 0.00 179.25 180.46 2qjs h GLU 127 N -0.29 0.86 -0.11 0.00 4.81 -1.79 -2.74 114.58 115.32 2qjs h GLU 127 Ca 0.00 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 2qjs h GLU 127 Cb 0.28 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2qjs h GLU 127 CO -0.03 0.57 0.01 -0.07 -0.73 0.00 0.00 179.01 178.76 2qjs h LEU 128 N 0.89 -0.02 -0.74 1.64 3.38 -0.89 -2.53 115.31 117.04 2qjs h LEU 128 Ca 0.30 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.37 2qjs h LEU 128 Cb 0.04 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.75 2qjs h LEU 128 CO -0.12 0.01 0.40 0.11 0.09 0.00 0.00 178.44 178.94 2qjs h LYS 129 N 0.06 0.69 0.00 1.13 1.57 -1.10 0.24 116.57 119.16 2qjs h LYS 129 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qjs h LYS 129 Cb 0.05 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2qjs h LYS 129 CO -0.08 0.45 0.00 0.00 -0.57 0.00 0.00 179.45 179.26 2qjs h ARG 130 N 0.71 0.00 0.00 3.15 3.08 -1.22 -3.12 114.38 116.98 2qjs h ARG 130 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.40 2qjs h ARG 130 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2qjs h ARG 130 CO -0.23 0.00 -0.24 0.54 -1.07 0.00 0.00 179.97 178.98 2qjs n ARG 131 N -2.63 5.45 -4.51 0.04 1.74 -0.00 -5.04 116.66 111.70 2qjs n ARG 131 Ca -0.01 -0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.81 2qjs n ARG 131 Cb 0.13 -0.67 -0.08 0.00 -1.02 0.00 0.00 32.46 30.83 2qjs n ARG 131 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2qjs s THR 132 N -1.34 0.44 -0.40 0.55 -4.23 0.65 -4.67 115.64 106.64 2qjs s THR 132 Ca 0.01 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.57 2qjs s THR 132 Cb 0.02 -2.28 0.42 0.00 1.34 0.00 0.00 72.50 72.00 2qjs s THR 132 CO 0.10 0.00 1.38 0.61 -0.54 0.00 0.00 174.62 176.17 2qjs n GLY 133 N -0.94 2.93 3.74 3.99 0.00 -0.94 -4.70 105.19 109.26 2qjs n GLY 133 Ca -0.05 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2qjs n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjs s ALA 134 N -1.94 3.63 0.23 4.61 0.00 -1.06 -4.71 121.76 122.53 2qjs s ALA 134 Ca 0.32 1.27 0.06 0.00 0.00 0.00 0.00 51.96 53.61 2qjs s ALA 134 Cb 0.26 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2qjs s ALA 134 CO 0.08 -0.70 0.24 0.15 0.00 0.00 0.00 175.76 175.53 2qjs s LYS 135 N 0.05 3.09 -0.21 0.00 3.01 -1.16 -4.71 119.74 119.81 2qjs s LYS 135 Ca 0.61 -0.93 0.01 0.00 -1.01 0.00 0.00 55.97 54.65 2qjs s LYS 135 Cb -0.41 -2.68 0.03 0.00 -1.01 0.00 0.00 37.83 33.76 2qjs s LYS 135 CO 0.39 0.42 -0.15 0.08 0.51 0.00 0.00 175.35 176.60 2qjs s VAL 136 N -2.03 2.23 -0.15 3.17 1.01 -1.26 -1.72 120.40 121.64 2qjs s VAL 136 Ca 0.33 -1.14 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 2qjs s VAL 136 Cb -0.09 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2qjs s VAL 136 CO 0.26 0.33 0.02 0.00 0.00 0.00 0.00 175.10 175.71 2qjs s ALA 137 N 1.24 3.29 0.00 5.51 0.00 -0.97 0.23 121.76 131.06 2qjs s ALA 137 Ca 0.00 -0.77 -0.28 0.00 0.00 0.00 0.00 51.96 50.91 2qjs s ALA 137 Cb -0.16 -1.73 0.09 0.00 0.00 0.00 0.00 23.12 21.32 2qjs s ALA 137 CO -0.09 0.29 0.78 0.00 0.00 0.00 0.00 175.76 176.73 2qjs s ALA 138 N 0.06 -1.77 0.76 0.00 0.00 -0.23 -4.36 121.76 116.23 2qjs s ALA 138 Ca 0.03 1.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.93 2qjs s ALA 138 Cb -0.13 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.30 2qjs s ALA 138 CO 0.01 -0.57 1.08 0.54 0.00 0.00 0.00 175.76 176.83 2qjs s ASN 139 N -2.02 4.68 0.23 0.00 2.20 -1.26 -1.81 114.94 116.96 2qjs s ASN 139 Ca -0.01 1.76 -0.10 0.00 -0.94 0.00 0.00 52.86 53.57 2qjs s ASN 139 Cb -0.01 -2.50 0.35 0.00 -2.00 0.00 0.00 41.25 37.09 2qjs s ASN 139 CO -0.04 -1.92 1.63 0.00 -2.94 0.00 0.00 177.10 173.84 2qjs h ALA 140 N -1.05 0.62 -0.25 3.54 0.00 -1.94 0.35 119.26 120.54 2qjs h ALA 140 Ca -0.44 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2qjs h ALA 140 Cb 1.23 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 2qjs h ALA 140 CO 0.53 -0.42 0.11 0.93 0.00 0.00 0.00 179.25 180.39 2qjs h GLU 141 N 0.06 0.38 -0.50 0.00 4.39 -1.93 -1.11 114.58 115.86 2qjs h GLU 141 Ca 0.37 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.90 2qjs h GLU 141 Cb 0.61 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2qjs h GLU 141 CO -0.66 0.40 -0.08 0.77 -1.16 0.00 0.00 179.01 178.28 2qjs h SER 142 N 0.26 0.89 -0.66 1.42 0.02 -1.63 -2.83 113.55 111.02 2qjs h SER 142 Ca 0.09 -0.27 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 2qjs h SER 142 Cb 0.16 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 2qjs h SER 142 CO -0.01 1.00 0.40 0.00 -1.14 0.00 0.00 176.83 177.08 2qjs h ALA 143 N 1.09 0.86 -0.19 3.77 0.00 0.01 0.60 119.26 125.39 2qjs h ALA 143 Ca 0.14 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 2qjs h ALA 143 Cb 0.60 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2qjs h ALA 143 CO 0.04 0.15 -0.33 -0.39 0.00 0.00 0.00 179.25 178.72 2qjs h VAL 144 N 0.78 1.28 0.05 0.00 -1.51 -1.13 -1.61 116.25 114.11 2qjs h VAL 144 Ca 0.27 -1.39 -0.21 0.00 -1.23 0.00 0.00 66.70 64.14 2qjs h VAL 144 Cb 0.04 1.50 0.02 0.00 -2.13 0.00 0.00 31.29 30.72 2qjs h VAL 144 CO -0.11 0.43 -0.84 0.25 -1.23 0.00 0.00 177.57 176.06 2qjs h LEU 145 N 0.34 0.66 -0.81 4.19 5.85 -1.10 -2.32 115.31 122.13 2qjs h LEU 145 Ca 0.04 -0.80 0.17 0.00 0.84 0.00 0.00 57.88 58.13 2qjs h LEU 145 Cb 0.75 -0.20 -0.11 0.00 0.37 0.00 0.00 40.66 41.47 2qjs h LEU 145 CO 0.06 1.38 0.33 0.25 -0.34 0.00 0.00 178.44 180.12 2qjs h LEU 146 N 0.01 0.30 -0.88 2.25 5.85 0.20 -2.11 115.31 120.93 2qjs h LEU 146 Ca -0.12 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2qjs h LEU 146 Cb 1.56 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.69 2qjs h LEU 146 CO 0.16 0.08 -0.03 0.00 -0.34 0.00 0.00 178.44 178.30 2qjs h ALA 147 N 1.60 0.99 -0.47 1.25 0.00 -1.10 -2.18 119.26 119.37 2qjs h ALA 147 Ca 0.46 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2qjs h ALA 147 Cb 0.76 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2qjs h ALA 147 CO -0.45 0.04 0.00 2.89 0.00 0.00 0.00 179.25 181.74 2qjs n ARG 148 N -3.12 3.43 -1.11 0.00 1.85 -0.85 -4.63 116.66 112.23 2qjs n ARG 148 Ca 0.02 -2.73 -0.03 0.00 -1.00 0.00 0.00 57.85 54.12 2qjs n ARG 148 Cb 0.41 -1.78 -0.01 0.00 -1.05 0.00 0.00 32.46 30.02 2qjs n ARG 148 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2qjs n GLY 149 N 0.48 0.58 2.32 2.89 0.00 -0.95 -2.34 105.19 108.17 2qjs n GLY 149 Ca 0.22 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2qjs n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjs n GLY 150 N -2.62 0.72 3.84 -0.02 0.00 -0.87 -0.22 105.19 106.01 2qjs n GLY 150 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 2qjs n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qjs s SER 151 N -2.43 4.65 -1.33 1.61 1.04 -0.99 -4.18 113.70 112.07 2qjs s SER 151 Ca 0.00 1.12 -0.01 0.00 0.48 0.00 0.00 55.95 57.55 2qjs s SER 151 Cb 0.00 -1.82 -0.00 0.00 0.10 0.00 0.00 66.02 64.30 2qjs s SER 151 CO 0.00 -1.85 0.61 -0.67 0.98 0.00 0.00 173.24 172.31 2qjs n ASP 152 N -3.33 -0.99 -4.74 7.02 2.03 -1.20 -4.90 116.55 110.43 2qjs n ASP 152 Ca 0.07 -0.88 -0.41 0.00 0.52 0.00 0.00 54.79 54.09 2qjs n ASP 152 Cb 0.58 -3.72 -0.05 0.00 -0.72 0.00 0.00 41.12 37.21 2qjs n ASP 152 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2qjs s ASP 153 N -4.34 7.50 0.28 1.67 2.15 -0.65 -4.82 116.67 118.45 2qjs s ASP 153 Ca 0.01 1.92 0.02 0.00 0.43 0.00 0.00 52.55 54.93 2qjs s ASP 153 Cb -0.00 -2.60 0.63 0.00 -0.30 0.00 0.00 42.92 40.65 2qjs s ASP 153 CO 0.84 -0.02 1.75 -0.07 -0.17 0.00 0.00 175.17 177.50 2qjs h LEU 154 N 4.92 0.53 0.00 -1.34 3.38 -1.91 -0.54 115.31 120.34 2qjs h LEU 154 Ca -0.44 0.11 -0.32 0.00 0.09 0.00 0.00 57.88 57.32 2qjs h LEU 154 Cb 1.21 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.93 2qjs h LEU 154 CO 0.70 0.17 -2.22 1.41 0.09 0.00 0.00 178.44 178.59 2qjs n HIS 155 N -4.90 0.00 0.46 1.13 8.25 -1.26 -4.72 115.22 114.18 2qjs n HIS 155 Ca 0.20 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.72 2qjs n HIS 155 Cb 0.53 -0.84 -0.09 0.00 1.12 0.00 0.00 29.99 30.71 2qjs n HIS 155 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2qjs n PHE 156 N -2.97 0.00 -3.84 4.41 3.72 -1.20 -5.01 117.46 112.56 2qjs n PHE 156 Ca -0.35 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.05 2qjs n PHE 156 Cb 0.96 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.41 2qjs n PHE 156 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qjs n GLY 157 N 1.43 1.39 1.65 1.37 0.00 -0.22 -2.86 105.19 107.95 2qjs n GLY 157 Ca 0.01 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2qjs n GLY 157 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qjs n ASP 160 N 3.26 3.61 0.08 1.61 8.00 -1.26 -1.64 116.55 130.21 2qjs n ASP 160 Ca 0.00 -2.85 0.12 0.00 0.71 0.00 0.00 54.79 52.77 2qjs n ASP 160 Cb 0.00 -0.70 0.15 0.00 -0.02 0.00 0.00 41.12 40.55 2qjs n ASP 160 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2qjs h GLY 161 N 2.46 0.00 -6.00 0.44 0.00 -1.83 -3.38 103.07 94.76 2qjs h GLY 161 Ca 0.33 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.17 2qjs h GLY 161 CO 0.59 0.00 -1.18 0.29 0.00 0.00 0.00 176.54 176.23 2qjs n ILE 162 N -2.30 -0.22 -2.85 2.60 -5.35 -1.26 -5.12 119.36 104.86 2qjs n ILE 162 Ca 0.03 -4.51 -0.26 0.00 -0.27 0.00 0.00 62.75 57.73 2qjs n ILE 162 Cb 0.47 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 37.86 2qjs n ILE 162 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2qjs s THR 163 N -2.27 4.76 0.25 7.28 -1.32 -1.26 -4.11 115.64 118.97 2qjs s THR 163 Ca 0.39 -0.07 -0.22 0.00 -1.21 0.00 0.00 61.69 60.59 2qjs s THR 163 Cb 0.32 -3.79 0.04 0.00 -1.51 0.00 0.00 72.50 67.56 2qjs s THR 163 CO -0.08 -0.69 0.82 -0.72 -2.21 0.00 0.00 174.62 171.74 2qjs s TYR 164 N -2.63 -0.13 0.14 9.09 -0.85 0.69 -4.90 117.35 118.76 2qjs s TYR 164 Ca 0.46 -0.31 -0.31 0.00 -0.52 0.00 0.00 57.07 56.39 2qjs s TYR 164 Cb -0.10 0.70 -0.09 0.00 0.38 0.00 0.00 41.96 42.85 2qjs s TYR 164 CO 0.42 -1.13 1.55 -2.14 -1.52 0.00 0.00 175.55 172.73 2qjs s PRO 165 N -3.47 4.23 0.53 -3.49 0.02 -1.26 -4.43 135.00 127.13 2qjs s PRO 165 Ca 0.12 2.32 -0.19 0.00 0.02 0.00 0.00 61.00 63.27 2qjs s PRO 165 Cb -0.04 -3.23 -0.06 0.00 0.02 0.00 0.00 34.50 31.18 2qjs s PRO 165 CO 0.06 -0.60 1.09 -1.25 -0.33 0.00 0.00 177.00 175.97 2qjs s PRO 166 N 1.36 3.49 0.02 5.54 0.04 -1.26 -4.56 135.00 139.63 2qjs s PRO 166 Ca 0.70 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2qjs s PRO 166 Cb -0.42 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 2qjs s PRO 166 CO 0.31 -0.71 -0.04 0.00 0.04 0.00 0.00 177.00 176.60 2qjs s ALA 168 N -1.92 0.18 -0.15 8.56 0.00 -0.84 -4.70 121.76 122.89 2qjs s ALA 168 Ca 0.70 -0.59 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 2qjs s ALA 168 Cb -0.20 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 2qjs s ALA 168 CO 0.26 -0.13 0.18 -0.80 0.00 0.00 0.00 175.76 175.27 2qjs s ASN 169 N -1.42 6.36 0.42 0.00 0.01 -1.26 -2.77 114.94 116.28 2qjs s ASN 169 Ca -0.15 0.41 -0.24 0.00 -0.71 0.00 0.00 52.86 52.18 2qjs s ASN 169 Cb -0.10 -2.11 -0.08 0.00 0.41 0.00 0.00 41.25 39.37 2qjs s ASN 169 CO -0.01 0.25 1.14 0.00 -1.51 0.00 0.00 177.10 176.97 2qjs s ALA 170 N -0.18 3.07 -0.12 0.60 0.00 -1.26 -4.72 121.76 119.15 2qjs s ALA 170 Ca 0.13 0.89 0.17 0.00 0.00 0.00 0.00 51.96 53.15 2qjs s ALA 170 Cb -0.12 -3.36 -0.21 0.00 0.00 0.00 0.00 23.12 19.43 2qjs s ALA 170 CO 0.02 -0.51 0.54 -0.25 0.00 0.00 0.00 175.76 175.56 2qjs n ASP 171 N -0.18 0.53 -3.86 0.00 8.00 0.63 -4.92 116.55 116.74 2qjs n ASP 171 Ca 0.06 0.24 -0.13 0.00 0.71 0.00 0.00 54.79 55.67 2qjs n ASP 171 Cb 0.48 0.56 -0.14 0.00 -0.02 0.00 0.00 41.12 41.99 2qjs n ASP 171 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2qjs s ARG 172 N -2.81 0.01 -0.25 -1.24 3.52 -0.72 -4.96 118.95 112.51 2qjs s ARG 172 Ca -0.06 0.02 -0.09 0.00 -0.13 0.00 0.00 55.73 55.47 2qjs s ARG 172 Cb 0.08 -0.05 -0.04 0.00 -1.56 0.00 0.00 34.95 33.39 2qjs s ARG 172 CO 0.83 -0.02 0.12 0.42 -0.81 0.00 0.00 175.30 175.84 2qjs s ILE 173 N 0.14 4.81 0.21 4.11 -1.09 -1.25 -1.07 121.20 127.06 2qjs s ILE 173 Ca -0.01 -0.01 0.06 0.00 -2.23 0.00 0.00 60.65 58.46 2qjs s ILE 173 Cb -0.02 -3.25 -0.04 0.00 -1.58 0.00 0.00 42.46 37.57 2qjs s ILE 173 CO -0.00 0.33 0.18 0.68 -1.23 0.00 0.00 174.94 174.90 2qjs s VAL 174 N 1.41 4.52 0.23 2.92 -7.23 -0.75 -4.92 120.40 116.58 2qjs s VAL 174 Ca 0.06 -1.24 0.09 0.00 -1.81 0.00 0.00 61.98 59.08 2qjs s VAL 174 Cb -0.15 -3.38 -0.04 0.00 0.56 0.00 0.00 36.38 33.37 2qjs s VAL 174 CO 0.06 -0.24 0.02 -0.04 -0.31 0.00 0.00 175.10 174.58 2qjs s MET 175 N -3.53 2.41 0.19 4.82 -1.94 -1.26 -4.17 119.30 115.81 2qjs s MET 175 Ca 0.32 -1.27 -0.33 0.00 -1.71 0.00 0.00 55.69 52.70 2qjs s MET 175 Cb -0.09 -2.28 -0.15 0.00 2.01 0.00 0.00 34.83 34.33 2qjs s MET 175 CO 0.25 0.40 1.35 -3.47 -0.01 0.00 0.00 175.02 173.53 2qjs n ASP 176 N -0.67 2.23 -0.11 3.03 2.03 -1.26 -1.36 116.55 120.44 2qjs n ASP 176 Ca -0.08 1.13 -0.01 0.00 0.52 0.00 0.00 54.79 56.35 2qjs n ASP 176 Cb 0.58 -1.33 -0.01 0.00 -0.72 0.00 0.00 41.12 39.64 2qjs n ASP 176 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qjs n GLY 177 N 2.35 0.51 3.76 0.27 0.00 0.10 -5.02 105.19 107.16 2qjs n GLY 177 Ca 0.14 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2qjs n GLY 177 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qjs s GLU 178 N -1.11 4.36 -0.05 1.61 2.12 -0.46 -4.64 118.70 120.52 2qjs s GLU 178 Ca 0.00 0.80 -0.09 0.00 0.36 0.00 0.00 54.97 56.04 2qjs s GLU 178 Cb 0.00 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.99 2qjs s GLU 178 CO 0.00 0.33 0.24 0.14 -0.54 0.00 0.00 175.26 175.43 2qjs s VAL 179 N -0.08 5.33 -0.17 3.70 -7.23 -1.26 -1.48 120.40 119.21 2qjs s VAL 179 Ca 0.33 0.34 -0.01 0.00 -1.81 0.00 0.00 61.98 60.82 2qjs s VAL 179 Cb -0.18 -3.53 -0.00 0.00 0.56 0.00 0.00 36.38 33.22 2qjs s VAL 179 CO 0.18 0.52 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.75 2qjs s ILE 180 N -1.13 2.92 -0.23 -0.62 1.01 0.12 -4.93 121.20 118.34 2qjs s ILE 180 Ca 0.21 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 60.14 2qjs s ILE 180 Cb -0.13 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 2qjs s ILE 180 CO 0.10 0.49 -0.01 -0.89 0.00 0.00 0.00 174.94 174.63 2qjs s THR 181 N 0.99 3.64 -0.42 2.92 2.01 -1.25 -0.23 115.64 123.30 2qjs s THR 181 Ca -0.01 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 61.61 2qjs s THR 181 Cb -0.15 -2.68 0.11 0.00 0.01 0.00 0.00 72.50 69.80 2qjs s THR 181 CO -0.02 0.39 0.15 -0.69 -0.69 0.00 0.00 174.62 173.76 2qjs s VAL 182 N 1.52 2.49 -0.83 3.82 1.01 -0.14 -4.76 120.40 123.51 2qjs s VAL 182 Ca 0.06 -2.72 -0.02 0.00 0.00 0.00 0.00 61.98 59.30 2qjs s VAL 182 Cb -0.15 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2qjs s VAL 182 CO -0.01 -0.69 0.70 0.61 0.00 0.00 0.00 175.10 175.71 2qjs n GLY 183 N 3.82 -0.30 3.04 4.51 0.00 -1.26 -3.38 105.19 111.61 2qjs n GLY 183 Ca 0.04 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2qjs n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjs n GLY 184 N -1.17 2.51 3.62 -0.02 0.00 -1.26 -4.55 105.19 104.33 2qjs n GLY 184 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2qjs n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qjs s ILE 185 N -3.17 5.21 -0.31 -0.61 1.01 -1.22 -5.06 121.20 117.05 2qjs s ILE 185 Ca 0.00 0.52 -0.16 0.00 0.00 0.00 0.00 60.65 61.01 2qjs s ILE 185 Cb 0.00 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 2qjs s ILE 185 CO 0.00 0.20 0.40 -0.69 0.00 0.00 0.00 174.94 174.84 2qjs s VAL 186 N 1.84 5.14 -0.31 2.92 1.01 -1.26 -0.97 120.40 128.77 2qjs s VAL 186 Ca 0.14 0.36 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 2qjs s VAL 186 Cb -0.15 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2qjs s VAL 186 CO 0.09 0.00 0.12 -0.36 0.00 0.00 0.00 175.10 174.96 2qjs s PHE 187 N 2.12 3.18 -0.21 5.22 0.40 0.68 -4.38 117.98 124.99 2qjs s PHE 187 Ca 0.15 -0.88 -0.10 0.00 -0.60 0.00 0.00 56.93 55.50 2qjs s PHE 187 Cb -0.16 -2.31 -0.05 0.00 0.51 0.00 0.00 43.02 41.01 2qjs s PHE 187 CO 0.11 -0.56 0.13 0.99 0.70 0.00 0.00 175.22 176.59 2qjs s THR 188 N 1.54 5.30 -0.09 0.64 2.01 -0.65 0.15 115.64 124.54 2qjs s THR 188 Ca 0.03 0.15 -0.24 0.00 0.31 0.00 0.00 61.69 61.94 2qjs s THR 188 Cb -0.18 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 2qjs s THR 188 CO 0.04 0.42 0.73 0.00 -0.69 0.00 0.00 174.62 175.12 2qjs s ALA 189 N 0.53 3.37 -0.33 7.40 0.00 -0.55 -2.48 121.76 129.70 2qjs s ALA 189 Ca 0.07 0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.18 2qjs s ALA 189 Cb -0.12 -3.02 0.10 0.00 0.00 0.00 0.00 23.12 20.08 2qjs s ALA 189 CO -0.00 -0.22 0.04 -1.01 0.00 0.00 0.00 175.76 174.57 2qjs s HIS 190 N 1.08 3.49 0.34 0.00 3.76 -0.29 0.00 115.29 123.67 2qjs s HIS 190 Ca 0.38 -2.79 -0.29 0.00 -0.15 0.00 0.00 55.06 52.21 2qjs s HIS 190 Cb -0.18 -2.69 -0.11 0.00 1.11 0.00 0.00 32.58 30.72 2qjs s HIS 190 CO 0.17 -0.93 1.46 -0.06 -0.85 0.00 0.00 174.74 174.53 2qjs s PHE 191 N 1.00 2.76 -0.42 1.40 0.08 -1.26 0.52 117.98 122.06 2qjs s PHE 191 Ca 0.09 1.15 0.08 0.00 0.12 0.00 0.00 56.93 58.37 2qjs s PHE 191 Cb -0.19 -3.93 0.27 0.00 -0.57 0.00 0.00 43.02 38.60 2qjs s PHE 191 CO -0.09 -2.78 0.70 0.00 -0.10 0.00 0.00 175.22 172.95 2qjs n MET 192 N 0.99 0.79 -1.68 0.44 0.00 0.39 -4.81 117.12 113.24 2qjs n MET 192 Ca 0.02 -2.72 -0.42 0.00 0.00 0.00 0.00 57.70 54.58 2qjs n MET 192 Cb 0.40 -1.34 0.00 0.00 0.00 0.00 0.00 33.22 32.28 2qjs n MET 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2qjs n ALA 194 N 1.22 1.06 0.00 3.17 0.00 -1.21 -4.38 120.51 120.36 2qjs n ALA 194 Ca 0.17 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2qjs n ALA 194 Cb 0.59 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2qjs n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjs n GLY 195 N 0.86 -1.00 0.45 0.00 0.00 -1.26 -3.76 105.19 100.48 2qjs n GLY 195 Ca 0.06 0.35 0.28 0.00 0.00 0.00 0.00 46.02 46.72 2qjs n GLY 195 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2qjs h HIS 196 N 0.00 0.49 -3.79 1.61 -0.00 -1.75 -3.40 115.15 108.31 2qjs h HIS 196 Ca 0.00 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.30 2qjs h HIS 196 Cb 0.00 -0.14 -0.13 0.00 -0.00 0.00 0.00 27.41 27.14 2qjs h HIS 196 CO 0.00 0.00 -0.32 0.95 -0.00 0.00 0.00 177.93 178.56 2qjs s THR 197 N -5.33 0.11 0.48 6.26 -4.23 -1.26 -5.02 115.64 106.65 2qjs s THR 197 Ca -0.08 -1.19 0.13 0.00 -1.18 0.00 0.00 61.69 59.38 2qjs s THR 197 Cb 0.26 -1.49 0.28 0.00 1.34 0.00 0.00 72.50 72.88 2qjs s THR 197 CO 0.80 -0.50 2.11 -0.65 -0.54 0.00 0.00 174.62 175.85 2qjs h PRO 198 N 2.64 0.18 -0.40 3.99 0.11 -1.94 -2.83 132.00 133.76 2qjs h PRO 198 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2qjs h PRO 198 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2qjs h PRO 198 CO 0.53 0.12 0.00 0.41 -0.21 0.00 0.00 178.00 178.85 2qjs n GLY 199 N -1.52 1.71 3.56 -0.55 0.00 -1.26 -4.34 105.19 102.79 2qjs n GLY 199 Ca -0.00 -0.73 -0.55 0.00 0.00 0.00 0.00 46.02 44.74 2qjs n GLY 199 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qjs n SER 200 N 1.46 1.05 -4.26 1.61 7.64 -1.07 -4.70 113.62 115.37 2qjs n SER 200 Ca 0.20 1.13 -0.19 0.00 1.01 0.00 0.00 58.87 61.02 2qjs n SER 200 Cb 0.60 -1.09 -0.11 0.00 -1.01 0.00 0.00 64.21 62.60 2qjs n SER 200 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2qjs s THR 201 N 0.37 1.40 -0.27 0.44 2.01 -0.71 0.15 115.64 119.04 2qjs s THR 201 Ca 0.87 -1.75 -0.04 0.00 0.31 0.00 0.00 61.69 61.08 2qjs s THR 201 Cb -1.08 -1.59 0.02 0.00 0.01 0.00 0.00 72.50 69.87 2qjs s THR 201 CO 0.51 -0.40 0.01 0.00 -0.69 0.00 0.00 174.62 174.04 2qjs s ALA 202 N -2.14 2.88 -0.20 7.40 0.00 0.18 -3.01 121.76 126.87 2qjs s ALA 202 Ca 0.10 -1.45 -0.17 0.00 0.00 0.00 0.00 51.96 50.44 2qjs s ALA 202 Cb -0.05 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 2qjs s ALA 202 CO 0.03 -0.85 0.46 -1.58 0.00 0.00 0.00 175.76 173.82 2qjs s TRP 203 N 1.41 3.37 0.14 0.00 0.52 -1.12 -1.13 118.94 122.13 2qjs s TRP 203 Ca 0.01 0.69 0.11 0.00 0.02 0.00 0.00 56.10 56.93 2qjs s TRP 203 Cb -0.17 -2.60 -0.04 0.00 -1.15 0.00 0.00 33.47 29.51 2qjs s TRP 203 CO -0.01 -0.06 -0.25 0.95 0.02 0.00 0.00 176.95 177.59 2qjs s THR 204 N 1.50 2.35 -0.02 2.01 -4.23 -1.03 0.80 115.64 117.01 2qjs s THR 204 Ca 0.21 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.63 2qjs s THR 204 Cb -0.15 -2.07 0.08 0.00 1.34 0.00 0.00 72.50 71.70 2qjs s THR 204 CO 0.09 0.04 0.71 -1.66 -0.54 0.00 0.00 174.62 173.26 2qjs s TRP 205 N -1.22 -0.59 0.02 3.99 -2.14 -0.62 -1.64 118.94 116.74 2qjs s TRP 205 Ca 0.16 0.88 -0.24 0.00 2.66 0.00 0.00 56.10 59.57 2qjs s TRP 205 Cb -0.10 0.45 -0.05 0.00 -3.10 0.00 0.00 33.47 30.67 2qjs s TRP 205 CO 0.07 -0.62 0.72 0.99 -2.66 0.00 0.00 176.95 175.45 2qjs s THR 206 N -1.75 4.81 0.00 0.66 2.01 -1.26 0.51 115.64 120.62 2qjs s THR 206 Ca -0.07 1.52 0.00 0.00 0.31 0.00 0.00 61.69 63.45 2qjs s THR 206 Cb -0.00 -4.06 0.00 0.00 0.01 0.00 0.00 72.50 68.44 2qjs s THR 206 CO 0.04 0.36 0.00 -0.67 -0.69 0.00 0.00 174.62 173.66 2qjs n ASP 207 N 2.89 1.64 -3.74 3.53 -0.08 0.19 -4.89 116.55 116.09 2qjs n ASP 207 Ca -0.03 0.00 -0.18 0.00 -1.51 0.00 0.00 54.79 53.07 2qjs n ASP 207 Cb 0.50 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.80 2qjs n ASP 207 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2qjs s THR 208 N 1.10 -0.03 -0.16 5.18 -4.23 -1.23 -0.29 115.64 115.98 2qjs s THR 208 Ca 0.00 0.28 -0.01 0.00 -1.18 0.00 0.00 61.69 60.78 2qjs s THR 208 Cb 0.00 -0.15 -0.01 0.00 1.34 0.00 0.00 72.50 73.68 2qjs s THR 208 CO 0.00 0.14 -0.11 -0.60 -0.54 0.00 0.00 174.62 173.51 2qjs s ARG 209 N 1.53 3.35 -0.93 3.99 3.52 1.16 -0.65 118.95 130.92 2qjs s ARG 209 Ca -0.03 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 2qjs s ARG 209 Cb -0.13 -2.73 0.00 0.00 -1.56 0.00 0.00 34.95 30.53 2qjs s ARG 209 CO -0.03 0.06 0.00 0.09 -0.81 0.00 0.00 175.30 174.61 2qjs n ASN 210 N 3.97 -4.57 0.00 -2.12 3.02 -1.26 -1.83 115.26 112.47 2qjs n ASN 210 Ca -0.18 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 2qjs n ASN 210 Cb 0.52 -2.85 0.00 0.00 -0.61 0.00 0.00 39.78 36.84 2qjs n ASN 210 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qjs n GLY 211 N -1.22 0.69 3.63 7.41 0.00 -1.26 -5.08 105.19 109.35 2qjs n GLY 211 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 2qjs n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qjs s LYS 212 N -0.64 2.42 0.05 1.61 -0.14 -0.76 -4.91 119.74 117.38 2qjs s LYS 212 Ca 0.00 -0.86 -0.36 0.00 -1.36 0.00 0.00 55.97 53.39 2qjs s LYS 212 Cb 0.00 -2.46 -0.16 0.00 -1.68 0.00 0.00 37.83 33.53 2qjs s LYS 212 CO 0.00 0.55 1.48 -2.30 -0.76 0.00 0.00 175.35 174.31 2qjs n PRO 213 N 0.89 1.45 -3.79 -1.68 -0.02 -1.25 0.37 135.00 130.97 2qjs n PRO 213 Ca -0.13 0.53 -0.29 0.00 -2.02 0.00 0.00 63.50 61.59 2qjs n PRO 213 Cb 0.52 -2.22 -0.16 0.00 -0.02 0.00 0.00 33.50 31.63 2qjs n PRO 213 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qjs s VAL 214 N 1.14 0.91 -0.30 -1.45 1.01 0.60 -4.69 120.40 117.63 2qjs s VAL 214 Ca 0.85 -1.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 2qjs s VAL 214 Cb -0.89 -1.44 0.01 0.00 0.00 0.00 0.00 36.38 34.07 2qjs s VAL 214 CO 0.47 -0.32 1.13 -0.13 0.00 0.00 0.00 175.10 176.26 2qjs s ARG 215 N 1.65 4.06 -0.21 2.72 0.52 -1.26 0.53 118.95 126.96 2qjs s ARG 215 Ca 0.01 1.17 -0.00 0.00 -0.52 0.00 0.00 55.73 56.39 2qjs s ARG 215 Cb -0.18 -3.76 0.02 0.00 0.52 0.00 0.00 34.95 31.55 2qjs s ARG 215 CO -0.12 -0.92 -0.14 0.42 0.02 0.00 0.00 175.30 174.56 2qjs s ILE 216 N 3.77 2.45 -0.27 1.52 1.01 0.18 -1.41 121.20 128.45 2qjs s ILE 216 Ca 0.48 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 60.11 2qjs s ILE 216 Cb -0.14 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.18 2qjs s ILE 216 CO 0.16 0.41 0.11 0.00 0.00 0.00 0.00 174.94 175.62 2qjs s ALA 217 N 1.31 3.25 -1.07 9.38 0.00 -0.69 -1.59 121.76 132.34 2qjs s ALA 217 Ca 0.03 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 50.75 2qjs s ALA 217 Cb -0.14 -2.22 0.31 0.00 0.00 0.00 0.00 23.12 21.06 2qjs s ALA 217 CO -0.09 -0.62 1.47 0.98 0.00 0.00 0.00 175.76 177.51 2qjs n TYR 218 N 4.96 2.28 -2.17 0.00 9.36 0.24 0.26 117.16 132.09 2qjs n TYR 218 Ca -0.15 -2.61 -0.41 0.00 3.32 0.00 0.00 57.90 58.05 2qjs n TYR 218 Cb 0.51 -1.25 -0.03 0.00 -0.63 0.00 0.00 39.34 37.94 2qjs n TYR 218 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qjs s ALA 219 N -2.79 3.55 0.87 2.98 0.00 -0.41 -2.81 121.76 123.16 2qjs s ALA 219 Ca 0.31 1.16 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 2qjs s ALA 219 Cb 0.05 -3.50 0.12 0.00 0.00 0.00 0.00 23.12 19.79 2qjs s ALA 219 CO 0.11 -0.58 1.11 0.34 0.00 0.00 0.00 175.76 176.73 2qjs s ASP 220 N 0.36 3.79 0.09 0.00 -1.08 -1.16 -3.85 116.67 114.81 2qjs s ASP 220 Ca 0.57 1.19 -0.34 0.00 -0.52 0.00 0.00 52.55 53.46 2qjs s ASP 220 Cb -0.38 -1.86 -0.13 0.00 -1.46 0.00 0.00 42.92 39.09 2qjs s ASP 220 CO 0.39 -2.40 1.65 -1.20 0.52 0.00 0.00 175.17 174.13 2qjs n SER 221 N -3.70 3.12 -1.69 -0.34 7.64 -1.26 -4.89 113.62 112.50 2qjs n SER 221 Ca 0.07 1.05 0.09 0.00 1.01 0.00 0.00 58.87 61.09 2qjs n SER 221 Cb 0.57 -1.40 0.37 0.00 -1.01 0.00 0.00 64.21 62.75 2qjs n SER 221 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qjs n LEU 222 N 4.27 5.04 0.00 -3.43 4.77 -1.26 -4.33 117.00 122.06 2qjs n LEU 222 Ca 0.19 -2.54 -0.26 0.00 -0.03 0.00 0.00 56.01 53.36 2qjs n LEU 222 Cb 0.28 -0.61 0.17 0.00 -2.33 0.00 0.00 43.42 40.93 2qjs n LEU 222 CO 0.66 0.77 0.74 -1.54 -1.33 0.00 0.00 177.39 176.69 2qjs n SER 223 N 1.04 0.46 -2.73 -1.43 3.41 -1.26 -4.88 113.62 108.24 2qjs n SER 223 Ca 0.27 -1.65 -0.08 0.00 -0.26 0.00 0.00 58.87 57.15 2qjs n SER 223 Cb 0.97 -0.85 0.08 0.00 -0.26 0.00 0.00 64.21 64.15 2qjs n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qjs n ALA 224 N -3.53 -1.24 -1.56 7.33 0.00 -1.26 -4.18 120.51 116.07 2qjs n ALA 224 Ca -0.19 -1.31 -0.21 0.00 0.00 0.00 0.00 53.44 51.73 2qjs n ALA 224 Cb 0.55 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 2qjs n ALA 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qjs n PRO 226 N 0.68 0.73 -0.67 0.00 -0.04 -1.26 -2.72 135.00 131.72 2qjs n PRO 226 Ca 0.05 -0.56 0.00 0.00 -0.04 0.00 0.00 63.50 62.95 2qjs n PRO 226 Cb 0.69 -3.62 0.00 0.00 -0.04 0.00 0.00 33.50 30.53 2qjs n PRO 226 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qjs n GLY 227 N 6.54 0.64 3.78 0.55 0.00 -1.26 -5.03 105.19 110.41 2qjs n GLY 227 Ca 0.44 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 2qjs n GLY 227 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qjs s TYR 228 N -2.00 2.80 -0.39 1.61 1.51 -1.10 -5.03 117.35 114.75 2qjs s TYR 228 Ca 0.00 1.55 -0.24 0.00 -1.01 0.00 0.00 57.07 57.37 2qjs s TYR 228 Cb 0.00 -3.25 0.01 0.00 -0.11 0.00 0.00 41.96 38.62 2qjs s TYR 228 CO 0.00 -1.36 0.84 -1.14 -1.11 0.00 0.00 175.55 172.77 2qjs s GLN 229 N -3.15 3.70 -0.11 -0.62 0.74 -1.26 -4.99 119.66 113.96 2qjs s GLN 229 Ca 0.70 0.30 -0.10 0.00 0.05 0.00 0.00 55.36 56.31 2qjs s GLN 229 Cb -0.23 -3.84 -0.09 0.00 1.10 0.00 0.00 33.01 29.95 2qjs s GLN 229 CO 0.26 -0.95 0.27 -0.07 -0.55 0.00 0.00 175.29 174.25 2qjs h LEU 230 N 9.97 0.00 -9.90 3.68 3.38 -1.95 -3.42 115.31 117.07 2qjs h LEU 230 Ca -0.24 -0.35 -0.58 0.00 0.09 0.00 0.00 57.88 56.79 2qjs h LEU 230 Cb 1.09 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 2qjs h LEU 230 CO 0.95 0.68 -0.51 0.00 0.09 0.00 0.00 178.44 179.65 2qjs s GLN 231 N -1.79 3.27 -0.28 1.13 -2.07 -1.26 -4.20 119.66 114.46 2qjs s GLN 231 Ca -0.07 -0.61 0.00 0.00 -1.82 0.00 0.00 55.36 52.86 2qjs s GLN 231 Cb -0.01 -2.90 0.00 0.00 -1.09 0.00 0.00 33.01 29.01 2qjs s GLN 231 CO 0.24 0.55 0.00 0.41 -1.32 0.00 0.00 175.29 175.17 2qjs n GLY 232 N -0.13 0.50 3.57 2.60 0.00 -1.26 -4.94 105.19 105.52 2qjs n GLY 232 Ca -0.07 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2qjs n GLY 232 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2qjs s ASN 233 N -2.24 5.96 0.44 1.61 3.84 -1.26 -4.88 114.94 118.41 2qjs s ASN 233 Ca 0.00 0.37 0.16 0.00 0.21 0.00 0.00 52.86 53.60 2qjs s ASN 233 Cb 0.00 -2.54 0.99 0.00 -0.55 0.00 0.00 41.25 39.15 2qjs s ASN 233 CO 0.00 -1.83 1.96 1.55 -2.79 0.00 0.00 177.10 175.99 2qjs h PRO 234 N 11.87 0.00 0.00 0.43 0.13 -1.95 -1.88 132.00 140.61 2qjs h PRO 234 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2qjs h PRO 234 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2qjs h PRO 234 CO 1.17 0.22 0.00 0.54 -0.23 0.00 0.00 178.00 179.71 2qjs n ARG 235 N -4.15 0.21 -3.06 0.86 5.12 -1.26 -4.04 116.66 110.33 2qjs n ARG 235 Ca -0.02 0.25 -0.18 0.00 -1.93 0.00 0.00 57.85 55.97 2qjs n ARG 235 Cb 0.29 -1.78 -0.04 0.00 -1.16 0.00 0.00 32.46 29.77 2qjs n ARG 235 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2qjs n TYR 236 N -2.15 -1.73 -0.29 -1.55 4.19 -0.76 -5.03 117.16 109.85 2qjs n TYR 236 Ca 0.05 -2.74 0.08 0.00 3.31 0.00 0.00 57.90 58.59 2qjs n TYR 236 Cb 0.35 0.52 0.31 0.00 0.49 0.00 0.00 39.34 41.01 2qjs n TYR 236 CO 0.00 0.00 0.00 -1.35 0.91 0.00 0.00 176.86 176.42 2qjs h PRO 237 N 4.50 0.83 -0.62 2.98 0.11 -1.54 -2.75 132.00 135.51 2qjs h PRO 237 Ca 0.06 -0.05 -0.24 0.00 0.11 0.00 0.00 66.00 65.88 2qjs h PRO 237 Cb 0.96 -0.19 -0.14 0.00 0.11 0.00 0.00 31.00 31.73 2qjs h PRO 237 CO 0.34 0.55 0.23 0.72 -0.21 0.00 0.00 178.00 179.63 2qjs n HIS 238 N -4.54 2.02 -0.06 0.65 8.25 -1.26 -4.77 115.22 115.50 2qjs n HIS 238 Ca 0.16 -1.40 -0.06 0.00 -0.26 0.00 0.00 57.72 56.15 2qjs n HIS 238 Cb 0.34 -0.64 -0.05 0.00 1.12 0.00 0.00 29.99 30.76 2qjs n HIS 238 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2qjs h LEU 239 N 1.75 -0.85 -0.86 2.41 6.46 -1.75 -1.27 115.31 121.19 2qjs h LEU 239 Ca 0.30 0.11 0.18 0.00 -0.12 0.00 0.00 57.88 58.35 2qjs h LEU 239 Cb 2.15 0.35 -0.11 0.00 -0.73 0.00 0.00 40.66 42.32 2qjs h LEU 239 CO 0.65 -0.19 0.40 0.40 -0.62 0.00 0.00 178.44 179.08 2qjs h ILE 240 N -0.19 0.60 -0.94 4.05 2.04 -1.86 0.23 117.51 121.43 2qjs h ILE 240 Ca 0.03 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2qjs h ILE 240 Cb 0.28 0.06 -0.06 0.00 -0.74 0.00 0.00 36.82 36.36 2qjs h ILE 240 CO -0.27 0.09 0.61 -0.08 0.00 0.00 0.00 178.15 178.50 2qjs h GLU 241 N 0.50 1.13 -0.03 2.37 4.81 -1.80 -1.55 114.58 120.00 2qjs h GLU 241 Ca 0.50 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.60 2qjs h GLU 241 Cb 0.85 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2qjs h GLU 241 CO -0.45 0.75 -0.23 -0.44 -0.73 0.00 0.00 179.01 177.91 2qjs h ASP 242 N 1.17 0.26 -0.80 1.04 3.32 0.53 -2.96 116.42 118.99 2qjs h ASP 242 Ca 0.38 -0.69 0.11 0.00 0.02 0.00 0.00 57.03 56.85 2qjs h ASP 242 Cb 0.03 -0.08 -0.08 0.00 0.22 0.00 0.00 39.33 39.43 2qjs h ASP 242 CO -0.13 0.91 0.42 1.88 -1.72 0.00 0.00 179.24 180.60 2qjs h TYR 243 N -0.37 0.75 -0.27 4.55 -1.99 -0.92 -1.09 116.97 117.63 2qjs h TYR 243 Ca -0.02 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 2qjs h TYR 243 Cb 0.91 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.42 2qjs h TYR 243 CO 0.15 0.25 0.11 0.00 -0.00 0.00 0.00 178.16 178.67 2qjs h ARG 244 N 0.67 0.40 -0.20 4.88 2.47 -1.33 -2.41 114.38 118.85 2qjs h ARG 244 Ca 0.40 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 59.03 2qjs h ARG 244 Cb 0.46 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 2qjs h ARG 244 CO -0.29 0.42 0.04 -0.09 0.56 0.00 0.00 179.97 180.61 2qjs h ARG 245 N 0.28 0.28 -0.24 0.04 2.43 -1.23 -2.65 114.38 113.30 2qjs h ARG 245 Ca 0.09 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 2qjs h ARG 245 Cb 0.17 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2qjs h ARG 245 CO -0.01 0.28 -0.15 0.77 -1.51 0.00 0.00 179.97 179.35 2qjs h SER 246 N 0.28 0.55 -0.39 -3.80 0.02 -0.97 -2.33 113.55 106.92 2qjs h SER 246 Ca 0.07 -0.43 0.07 0.00 -0.84 0.00 0.00 61.79 60.66 2qjs h SER 246 Cb 0.13 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.46 2qjs h SER 246 CO -0.00 0.87 -0.02 -0.26 -1.14 0.00 0.00 176.83 176.28 2qjs h PHE 247 N 0.24 -0.05 -0.35 3.45 0.04 -1.09 1.11 116.94 120.28 2qjs h PHE 247 Ca 0.05 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.87 2qjs h PHE 247 Cb 0.68 0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 2qjs h PHE 247 CO 0.07 -0.09 0.23 0.00 -0.60 0.00 0.00 178.31 177.92 2qjs h ALA 248 N 1.35 1.82 0.00 2.45 0.00 -1.44 0.41 119.26 123.85 2qjs h ALA 248 Ca 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2qjs h ALA 248 Cb 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2qjs h ALA 248 CO -0.33 0.15 -0.09 1.15 0.00 0.00 0.00 179.25 180.13 2qjs h THR 249 N 0.41 1.63 -0.19 0.00 2.02 -0.46 -2.69 112.91 113.63 2qjs h THR 249 Ca 0.14 -1.96 0.05 0.00 0.77 0.00 0.00 66.41 65.41 2qjs h THR 249 Cb 0.04 2.93 -0.01 0.00 -1.74 0.00 0.00 68.15 69.38 2qjs h THR 249 CO -0.03 0.52 0.16 0.58 0.37 0.00 0.00 175.52 177.12 2qjs h VAL 250 N -0.72 0.69 0.00 3.16 2.07 0.16 -1.43 116.25 120.17 2qjs h VAL 250 Ca -0.01 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.34 2qjs h VAL 250 Cb 0.90 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 2qjs h VAL 250 CO 0.02 0.00 -1.07 -0.09 0.02 0.00 0.00 177.57 176.45 2qjs h ARG 251 N 0.00 0.00 -0.62 1.57 2.43 -0.97 -3.32 114.38 113.46 2qjs h ARG 251 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2qjs h ARG 251 Cb 0.41 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2qjs h ARG 251 CO -0.00 0.53 0.00 0.00 -1.51 0.00 0.00 179.97 178.99 2qjs n ALA 252 N -2.35 2.72 -1.78 2.80 0.00 -0.59 -4.29 120.51 117.03 2qjs n ALA 252 Ca -0.05 -1.48 -0.41 0.00 0.00 0.00 0.00 53.44 51.51 2qjs n ALA 252 Cb 0.85 -0.89 -0.02 0.00 0.00 0.00 0.00 19.45 19.39 2qjs n ALA 252 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qjs s LEU 254 N -1.49 4.41 -0.82 0.00 1.43 -0.90 -4.84 118.68 116.46 2qjs s LEU 254 Ca 0.47 2.74 -0.22 0.00 -1.03 0.00 0.00 54.13 56.09 2qjs s LEU 254 Cb 0.28 -3.65 -0.19 0.00 0.03 0.00 0.00 46.19 42.66 2qjs s LEU 254 CO 0.26 -0.59 2.36 -0.81 0.23 0.00 0.00 176.35 177.80 2qjs n PRO 255 N 0.82 0.43 -4.05 1.29 -0.04 -1.26 -4.86 135.00 127.32 2qjs n PRO 255 Ca 0.00 -0.45 -0.33 0.00 -0.04 0.00 0.00 63.50 62.69 2qjs n PRO 255 Cb 0.41 -2.76 -0.15 0.00 -0.04 0.00 0.00 33.50 30.96 2qjs n PRO 255 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qjs n ASP 257 N 4.60 2.22 -4.04 0.00 8.00 -0.96 -4.96 116.55 121.41 2qjs n ASP 257 Ca -0.18 0.02 -0.18 0.00 0.71 0.00 0.00 54.79 55.17 2qjs n ASP 257 Cb 0.47 -0.22 -0.14 0.00 -0.02 0.00 0.00 41.12 41.21 2qjs n ASP 257 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qjs s VAL 258 N -2.20 0.70 -0.17 2.53 1.01 -0.50 -4.95 120.40 116.83 2qjs s VAL 258 Ca -0.14 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2qjs s VAL 258 Cb 0.04 -0.63 0.02 0.00 0.00 0.00 0.00 36.38 35.81 2qjs s VAL 258 CO 0.21 0.07 -0.20 -0.22 0.00 0.00 0.00 175.10 174.96 2qjs s LEU 259 N -0.56 2.13 0.06 3.92 2.96 -1.26 -1.70 118.68 124.23 2qjs s LEU 259 Ca 0.01 -0.64 0.08 0.00 -0.22 0.00 0.00 54.13 53.36 2qjs s LEU 259 Cb -0.05 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 2qjs s LEU 259 CO 0.00 0.02 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.08 2qjs s LEU 260 N 1.18 2.48 0.01 -0.68 1.43 0.14 -4.84 118.68 118.41 2qjs s LEU 260 Ca 0.02 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2qjs s LEU 260 Cb -0.14 -1.43 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 2qjs s LEU 260 CO -0.11 0.24 -0.01 0.42 0.23 0.00 0.00 176.35 177.12 2qjs s THR 261 N -0.94 0.09 0.17 5.49 -4.23 -1.26 -1.29 115.64 113.67 2qjs s THR 261 Ca 0.14 -0.72 -0.19 0.00 -1.18 0.00 0.00 61.69 59.74 2qjs s THR 261 Cb -0.10 -0.23 0.10 0.00 1.34 0.00 0.00 72.50 73.60 2qjs s THR 261 CO 0.05 -0.40 1.31 -2.65 -0.54 0.00 0.00 174.62 172.40 2qjs n PRO 262 N 1.87 -0.27 -3.43 3.99 -0.02 -1.25 -3.57 135.00 132.31 2qjs n PRO 262 Ca -0.22 1.29 -0.39 0.00 -2.02 0.00 0.00 63.50 62.17 2qjs n PRO 262 Cb 0.56 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 32.04 2qjs n PRO 262 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2qjs s HIS 263 N -5.65 3.27 0.36 6.00 3.76 -1.26 -1.76 115.29 120.01 2qjs s HIS 263 Ca -0.11 0.40 0.06 0.00 -0.15 0.00 0.00 55.06 55.26 2qjs s HIS 263 Cb 0.14 -2.52 0.74 0.00 1.11 0.00 0.00 32.58 32.05 2qjs s HIS 263 CO 0.57 -0.16 1.95 -1.00 -0.85 0.00 0.00 174.74 175.24 2qjs h PRO 264 N 8.01 0.74 -0.19 8.40 0.13 -1.85 -2.86 132.00 144.37 2qjs h PRO 264 Ca -0.33 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 64.81 2qjs h PRO 264 Cb 1.17 -0.17 -0.06 0.00 0.13 0.00 0.00 31.00 32.07 2qjs h PRO 264 CO 0.65 0.49 -0.23 0.78 -0.23 0.00 0.00 178.00 179.46 2qjs h GLY 265 N 0.76 -0.17 0.95 1.56 0.00 -1.91 0.16 103.07 104.42 2qjs h GLY 265 Ca 0.33 0.28 0.15 0.00 0.00 0.00 0.00 47.33 48.09 2qjs h GLY 265 CO -0.12 -0.19 0.38 0.00 0.00 0.00 0.00 176.54 176.61 2qjs h ALA 266 N 0.77 2.45 0.00 3.60 0.00 -1.89 0.89 119.26 125.09 2qjs h ALA 266 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2qjs h ALA 266 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2qjs h ALA 266 CO -0.34 -0.65 -1.16 -1.13 0.00 0.00 0.00 179.25 175.97 2qjs n SER 267 N -4.31 0.59 -1.27 0.00 3.41 -0.93 -4.86 113.62 106.24 2qjs n SER 267 Ca 0.09 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 2qjs n SER 267 Cb 0.60 0.98 0.00 0.00 -0.26 0.00 0.00 64.21 65.53 2qjs n SER 267 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2qjs n ASN 268 N -1.95 -1.70 -4.08 4.04 4.05 0.31 0.20 115.26 116.13 2qjs n ASN 268 Ca 0.01 0.00 -0.28 0.00 0.45 0.00 0.00 54.58 54.76 2qjs n ASN 268 Cb 0.44 -0.53 -0.17 0.00 1.23 0.00 0.00 39.78 40.76 2qjs n ASN 268 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2qjs s TRP 269 N -2.85 1.94 -0.83 1.20 0.52 -0.09 0.21 118.94 119.05 2qjs s TRP 269 Ca 0.00 -0.84 -0.14 0.00 0.02 0.00 0.00 56.10 55.14 2qjs s TRP 269 Cb 0.00 -1.38 0.22 0.00 -1.15 0.00 0.00 33.47 31.16 2qjs s TRP 269 CO 0.00 -0.41 0.77 0.34 0.02 0.00 0.00 176.95 177.68 2qjs s ASP 270 N 0.76 6.76 0.15 2.95 2.15 -0.78 -4.30 116.67 124.36 2qjs s ASP 270 Ca -0.12 -2.68 -0.16 0.00 0.43 0.00 0.00 52.55 50.02 2qjs s ASP 270 Cb -0.16 -2.21 0.02 0.00 -0.30 0.00 0.00 42.92 40.27 2qjs s ASP 270 CO 0.02 -0.58 1.81 1.88 -0.17 0.00 0.00 175.17 178.13 2qjs h TYR 271 N 7.80 0.52 -0.16 -5.34 0.05 -1.85 -2.40 116.97 115.59 2qjs h TYR 271 Ca 0.11 0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.81 2qjs h TYR 271 Cb 1.04 -0.18 -0.05 0.00 1.01 0.00 0.00 36.73 38.56 2qjs h TYR 271 CO 1.04 0.33 0.11 0.00 -1.05 0.00 0.00 178.16 178.59 2qjs n ALA 272 N -2.21 3.01 -2.52 3.88 0.00 -1.26 -4.18 120.51 117.22 2qjs n ALA 272 Ca 0.01 -0.47 -0.20 0.00 0.00 0.00 0.00 53.44 52.77 2qjs n ALA 272 Cb 0.03 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.42 2qjs n ALA 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qjs n ALA 273 N 0.23 4.47 -0.66 0.00 0.00 -0.90 -5.10 120.51 118.54 2qjs n ALA 273 Ca 0.10 -3.87 0.00 0.00 0.00 0.00 0.00 53.44 49.67 2qjs n ALA 273 Cb 0.69 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2qjs n ALA 273 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjs n GLY 274 N -0.37 2.39 0.22 0.00 0.00 -1.26 -2.35 105.19 103.82 2qjs n GLY 274 Ca 0.29 -0.34 0.15 0.00 0.00 0.00 0.00 46.02 46.12 2qjs n GLY 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjs n ALA 275 N 7.60 2.66 -0.90 4.61 0.00 -1.26 -2.83 120.51 130.38 2qjs n ALA 275 Ca 0.00 -0.31 0.07 0.00 0.00 0.00 0.00 53.44 53.20 2qjs n ALA 275 Cb 0.00 -1.34 0.37 0.00 0.00 0.00 0.00 19.45 18.48 2qjs n ALA 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qjs n ARG 276 N -0.50 4.44 -0.09 0.00 1.74 -1.00 -4.40 116.66 116.86 2qjs n ARG 276 Ca 0.20 -3.08 -0.13 0.00 -0.77 0.00 0.00 57.85 54.07 2qjs n ARG 276 Cb 0.24 -2.16 -0.01 0.00 -1.02 0.00 0.00 32.46 29.51 2qjs n ARG 276 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qjs h ALA 277 N 3.58 0.56 -0.97 7.54 0.00 -1.30 -3.17 119.26 125.50 2qjs h ALA 277 Ca 0.00 -0.48 -0.59 0.00 0.00 0.00 0.00 54.91 53.84 2qjs h ALA 277 Cb 1.84 -0.10 -0.29 0.00 0.00 0.00 0.00 17.79 19.24 2qjs h ALA 277 CO 0.42 0.68 0.76 0.41 0.00 0.00 0.00 179.25 181.52 2qjs n GLY 278 N 0.21 5.16 0.14 0.00 0.00 -1.26 -1.86 105.19 107.57 2qjs n GLY 278 Ca -0.03 -1.70 -0.22 0.00 0.00 0.00 0.00 46.02 44.07 2qjs n GLY 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjs h ALA 285 N 1.54 0.31 -0.63 4.61 0.00 -1.85 -3.36 119.26 119.89 2qjs h ALA 285 Ca 0.60 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2qjs h ALA 285 Cb 1.73 0.61 0.00 0.00 0.00 0.00 0.00 17.79 20.13 2qjs h ALA 285 CO 1.33 1.13 0.00 1.17 0.00 0.00 0.00 179.25 182.89 2qjs n LYS 286 N -3.63 3.20 -2.11 0.00 4.81 -1.26 -4.95 118.16 114.23 2qjs n LYS 286 Ca -0.29 -2.70 -0.41 0.00 -0.87 0.00 0.00 58.31 54.04 2qjs n LYS 286 Cb 1.01 -1.69 -0.03 0.00 0.02 0.00 0.00 35.03 34.35 2qjs n LYS 286 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2qjs s ALA 287 N -1.44 3.57 0.81 3.14 0.00 0.13 -4.59 121.76 123.37 2qjs s ALA 287 Ca 0.47 1.24 -0.07 0.00 0.00 0.00 0.00 51.96 53.59 2qjs s ALA 287 Cb 0.28 -3.51 0.15 0.00 0.00 0.00 0.00 23.12 20.03 2qjs s ALA 287 CO 0.27 -0.65 1.12 -0.51 0.00 0.00 0.00 175.76 175.99 2qjs s LEU 288 N -0.55 2.87 0.71 0.00 1.43 0.53 -4.96 118.68 118.72 2qjs s LEU 288 Ca 0.56 -0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.54 2qjs s LEU 288 Cb -0.39 -2.20 0.07 0.00 0.03 0.00 0.00 46.19 43.70 2qjs s LEU 288 CO 0.43 -2.16 1.02 0.42 0.23 0.00 0.00 176.35 176.29 2qjs s THR 289 N -3.43 2.26 0.06 5.49 -4.23 -1.26 -4.40 115.64 110.14 2qjs s THR 289 Ca 0.69 -0.29 -0.34 0.00 -1.18 0.00 0.00 61.69 60.57 2qjs s THR 289 Cb -0.05 -2.97 -0.19 0.00 1.34 0.00 0.00 72.50 70.62 2qjs s THR 289 CO 0.48 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 176.12 2qjs h LYS 291 N -1.04 0.01 -0.76 0.00 3.64 -1.80 -1.32 116.57 115.30 2qjs h LYS 291 Ca -0.10 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.23 2qjs h LYS 291 Cb 0.78 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 2qjs h LYS 291 CO 0.17 0.01 0.28 0.00 -2.27 0.00 0.00 179.45 177.64 2qjs h ALA 292 N 1.78 0.99 -0.22 5.00 0.00 -1.94 -0.94 119.26 123.93 2qjs h ALA 292 Ca 0.38 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2qjs h ALA 292 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2qjs h ALA 292 CO -0.79 0.64 0.02 -0.92 0.00 0.00 0.00 179.25 178.19 2qjs h TYR 293 N 1.11 0.41 -0.16 0.00 3.20 -0.86 0.25 116.97 120.92 2qjs h TYR 293 Ca 0.25 -0.06 -0.13 0.00 3.14 0.00 0.00 58.73 61.93 2qjs h TYR 293 Cb 0.24 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 2qjs h TYR 293 CO 0.02 0.54 -0.44 0.00 -1.64 0.00 0.00 178.16 176.64 2qjs h ALA 294 N 0.82 0.94 0.04 1.82 0.00 -1.27 -0.65 119.26 120.96 2qjs h ALA 294 Ca 0.07 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 2qjs h ALA 294 Cb 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2qjs h ALA 294 CO 0.01 0.64 -0.02 -0.44 0.00 0.00 0.00 179.25 179.43 2qjs h ASP 295 N 0.33 -0.05 0.65 0.00 5.19 -0.85 0.75 116.42 122.43 2qjs h ASP 295 Ca 0.02 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2qjs h ASP 295 Cb 0.91 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.43 2qjs h ASP 295 CO 0.08 0.03 0.00 0.00 -3.12 0.00 0.00 179.24 176.23 2qjs n ALA 296 N -2.15 1.59 0.03 3.45 0.00 0.05 -1.68 120.51 121.80 2qjs n ALA 296 Ca -0.08 0.10 -0.21 0.00 0.00 0.00 0.00 53.44 53.25 2qjs n ALA 296 Cb 0.08 -1.38 -0.14 0.00 0.00 0.00 0.00 19.45 18.01 2qjs n ALA 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qjs h ALA 297 N 2.24 0.03 -0.25 0.00 0.00 0.67 -3.29 119.26 118.66 2qjs h ALA 297 Ca 0.00 -0.89 -0.15 0.00 0.00 0.00 0.00 54.91 53.86 2qjs h ALA 297 Cb 0.32 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2qjs h ALA 297 CO 0.00 0.60 -0.45 1.49 0.00 0.00 0.00 179.25 180.89 2qjs h GLU 298 N -0.33 0.74 -0.47 0.00 4.81 0.61 -3.09 114.58 116.85 2qjs h GLU 298 Ca -0.22 -0.47 0.09 0.00 -0.13 0.00 0.00 59.36 58.63 2qjs h GLU 298 Cb 1.71 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 31.04 2qjs h GLU 298 CO 0.11 1.09 -0.30 0.37 -0.73 0.00 0.00 179.01 179.55 2qjs h GLN 299 N 0.48 -0.18 -0.05 1.92 4.15 -1.47 0.20 115.11 120.15 2qjs h GLN 299 Ca 0.01 0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 2qjs h GLN 299 Cb 1.05 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.77 2qjs h GLN 299 CO 0.10 -0.12 -0.34 -0.22 -1.93 0.00 0.00 178.83 176.32 2qjs h LYS 300 N -0.19 0.10 0.06 1.69 3.64 -1.63 -2.15 116.57 118.09 2qjs h LYS 300 Ca 0.20 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2qjs h LYS 300 Cb 0.52 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2qjs h LYS 300 CO -0.58 0.43 -0.03 0.35 -2.27 0.00 0.00 179.45 177.35 2qjs h PHE 301 N 0.08 -0.08 -0.04 1.91 3.57 -1.14 -0.26 116.94 120.98 2qjs h PHE 301 Ca 0.01 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.52 2qjs h PHE 301 Cb 0.65 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 2qjs h PHE 301 CO 0.00 0.44 0.04 -0.44 -2.23 0.00 0.00 178.31 176.13 2qjs h ASP 302 N -0.66 0.00 1.24 0.41 3.32 -0.61 1.07 116.42 121.19 2qjs h ASP 302 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2qjs h ASP 302 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2qjs h ASP 302 CO 0.01 0.00 -0.74 1.23 -1.72 0.00 0.00 179.24 178.03 2qjs h GLY 303 N 0.00 0.00 1.36 2.75 0.00 -1.33 -2.44 103.07 103.41 2qjs h GLY 303 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.08 2qjs h GLY 303 CO -0.00 0.00 -1.45 1.46 0.00 0.00 0.00 176.54 176.55 2qjs h GLN 304 N 0.00 0.05 -0.05 4.80 4.20 0.12 -1.92 115.11 122.32 2qjs h GLN 304 Ca 0.00 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.53 2qjs h GLN 304 Cb 0.99 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 2qjs h GLN 304 CO 0.00 0.79 -0.41 1.25 -0.67 0.00 0.00 178.83 179.79 2qjs h LEU 305 N 0.01 0.10 0.22 1.46 5.85 0.97 -2.63 115.31 121.30 2qjs h LEU 305 Ca -0.19 -0.04 -0.33 0.00 0.84 0.00 0.00 57.88 58.16 2qjs h LEU 305 Cb 1.93 -0.03 0.04 0.00 0.37 0.00 0.00 40.66 42.97 2qjs h LEU 305 CO 0.11 0.51 -1.41 0.00 -0.34 0.00 0.00 178.44 177.31 2qjs h ALA 306 N 1.50 -0.12 0.00 1.25 0.00 -1.49 -3.13 119.26 117.26 2qjs h ALA 306 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2qjs h ALA 306 Cb 0.77 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2qjs h ALA 306 CO 0.06 0.68 0.00 1.17 0.00 0.00 0.00 179.25 181.16 2qjs n LYS 307 N -3.75 0.82 -0.01 0.00 4.81 -0.72 -2.99 118.16 116.32 2qjs n LYS 307 Ca -0.16 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.39 2qjs n LYS 307 Cb 1.07 -1.16 -0.16 0.00 0.02 0.00 0.00 35.03 34.80 2qjs n LYS 307 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2qjs n GLU 308 N -0.66 0.58 0.27 1.64 2.13 -1.00 -4.10 120.64 119.51 2qjs n GLU 308 Ca 0.06 -0.17 0.17 0.00 0.66 0.00 0.00 57.16 57.88 2qjs n GLU 308 Cb 0.03 -1.51 0.62 0.00 0.27 0.00 0.00 31.44 30.85 2qjs n GLU 308 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2qjs h THR 309 N 0.00 0.01 0.25 6.31 2.02 -1.66 -2.96 112.91 116.88 2qjs h THR 309 Ca 0.00 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 2qjs h THR 309 Cb 0.93 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 2qjs h THR 309 CO 0.00 0.01 -0.12 0.00 0.37 0.00 0.00 175.52 175.78 2qjs h ALA 310 N 1.99 -0.33 0.00 6.16 0.00 -1.76 -3.53 119.26 121.78 2qjs h ALA 310 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2qjs h ALA 310 Cb 0.57 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2qjs h ALA 310 CO 0.00 -0.41 0.00 0.41 0.00 0.00 0.00 179.25 179.25