#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iop n LYS 76 N 0.00 2.35 -2.27 5.56 4.76 -1.26 -4.98 118.16 122.32 3iop n LYS 76 Ca 0.00 0.84 -0.29 0.00 -2.87 0.00 0.00 58.31 55.99 3iop n LYS 76 Cb 0.00 -2.59 0.01 0.00 -1.84 0.00 0.00 35.03 30.61 3iop n LYS 76 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3iop s LYS 77 N 0.15 3.45 0.24 1.97 1.02 -1.26 -5.10 119.74 120.20 3iop s LYS 77 Ca 0.71 0.40 0.07 0.00 0.02 0.00 0.00 55.97 57.16 3iop s LYS 77 Cb -0.60 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.43 3iop s LYS 77 CO 0.44 -0.45 -0.08 1.03 -0.92 0.00 0.00 175.35 175.36 3iop s ARG 78 N -4.98 1.43 0.55 1.68 0.52 -1.26 -4.79 118.95 112.10 3iop s ARG 78 Ca 0.52 -1.69 0.24 0.00 -0.52 0.00 0.00 55.73 54.27 3iop s ARG 78 Cb -0.11 -1.06 1.46 0.00 0.52 0.00 0.00 34.95 35.77 3iop s ARG 78 CO 0.49 0.07 2.08 -1.35 0.02 0.00 0.00 175.30 176.61 3iop h PRO 79 N 2.41 0.00 0.00 3.54 0.11 -1.96 -2.06 132.00 134.04 3iop h PRO 79 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3iop h PRO 79 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3iop h PRO 79 CO 0.65 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.37 3iop h GLU 80 N 0.00 0.00 0.00 1.05 3.07 -2.03 -2.65 114.58 114.02 3iop h GLU 80 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3iop h GLU 80 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 3iop h GLU 80 CO -0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 3iop n ASP 81 N -2.96 0.00 -4.28 1.42 8.00 -0.77 -4.86 116.55 113.10 3iop n ASP 81 Ca 0.00 0.13 -0.25 0.00 0.71 0.00 0.00 54.79 55.38 3iop n ASP 81 Cb 0.26 -0.36 -0.13 0.00 -0.02 0.00 0.00 41.12 40.87 3iop n ASP 81 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3iop s PHE 82 N -2.72 1.86 -0.46 1.24 0.40 -1.00 -1.12 117.98 116.18 3iop s PHE 82 Ca 0.20 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 56.01 3iop s PHE 82 Cb 0.17 -1.06 0.08 0.00 0.51 0.00 0.00 43.02 42.72 3iop s PHE 82 CO 0.40 0.16 0.34 0.21 0.70 0.00 0.00 175.22 177.04 3iop s LYS 83 N -1.56 2.78 0.42 0.44 2.20 0.39 -4.93 119.74 119.49 3iop s LYS 83 Ca 0.08 -1.46 -0.23 0.00 -0.36 0.00 0.00 55.97 54.00 3iop s LYS 83 Cb -0.09 -3.98 -0.09 0.00 -1.51 0.00 0.00 37.83 32.15 3iop s LYS 83 CO 0.03 -1.04 1.03 -0.06 -0.36 0.00 0.00 175.35 174.95 3iop s PHE 84 N 1.52 3.22 0.00 4.03 0.40 -1.26 -0.99 117.98 124.90 3iop s PHE 84 Ca 0.04 1.63 0.00 0.00 -0.60 0.00 0.00 56.93 58.00 3iop s PHE 84 Cb -0.24 -3.07 0.00 0.00 0.51 0.00 0.00 43.02 40.22 3iop s PHE 84 CO 0.04 -0.58 0.00 0.41 0.70 0.00 0.00 175.22 175.78 3iop n GLY 85 N 0.08 4.24 3.78 4.36 0.00 0.27 -4.94 105.19 112.98 3iop n GLY 85 Ca 0.06 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.76 3iop n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iop s LYS 86 N 4.62 3.82 0.06 1.61 -2.85 -1.26 -4.67 119.74 121.06 3iop s LYS 86 Ca 0.00 1.65 -0.31 0.00 -1.00 0.00 0.00 55.97 56.31 3iop s LYS 86 Cb 0.00 -2.37 -0.07 0.00 -2.06 0.00 0.00 37.83 33.33 3iop s LYS 86 CO 0.00 -0.47 1.50 0.42 0.10 0.00 0.00 175.35 176.91 3iop s ILE 87 N -1.64 3.32 -0.09 3.79 1.01 -1.26 -1.46 121.20 124.87 3iop s ILE 87 Ca 0.63 0.80 0.02 0.00 0.00 0.00 0.00 60.65 62.11 3iop s ILE 87 Cb -0.25 -3.51 -0.25 0.00 0.01 0.00 0.00 42.46 38.46 3iop s ILE 87 CO 0.31 0.01 0.50 0.18 0.00 0.00 0.00 174.94 175.94 3iop n LEU 88 N 5.12 1.81 -3.49 2.97 4.77 0.17 -4.93 117.00 123.43 3iop n LEU 88 Ca 0.14 0.30 -0.16 0.00 -0.03 0.00 0.00 56.01 56.27 3iop n LEU 88 Cb 0.42 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 3iop n LEU 88 CO 0.60 0.64 0.45 -0.83 -1.33 0.00 0.00 177.39 176.92 3iop s GLY 89 N -5.37 -0.57 -0.04 -0.72 0.00 -1.01 -5.00 107.32 94.61 3iop s GLY 89 Ca -0.14 1.11 0.04 0.00 0.00 0.00 0.00 44.72 45.72 3iop s GLY 89 CO 0.80 0.71 -0.15 -0.54 0.00 0.00 0.00 173.10 173.91 3iop s GLU 90 N -1.99 1.60 0.41 2.90 2.02 -1.26 -0.84 118.70 121.54 3iop s GLU 90 Ca -0.07 -0.54 0.05 0.00 0.02 0.00 0.00 54.97 54.43 3iop s GLU 90 Cb -0.00 -1.41 -0.02 0.00 0.10 0.00 0.00 34.13 32.80 3iop s GLU 90 CO 0.02 0.21 0.18 0.41 0.02 0.00 0.00 175.26 176.11 3iop n GLY 91 N 3.18 3.12 0.19 -1.39 0.00 0.56 -5.01 105.19 105.85 3iop n GLY 91 Ca -0.18 -2.07 -0.05 0.00 0.00 0.00 0.00 46.02 43.72 3iop n GLY 91 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3iop h SER 92 N 1.79 0.33 0.00 1.61 4.64 -2.02 -3.32 113.55 116.58 3iop h SER 92 Ca -0.31 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3iop h SER 92 Cb 1.26 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3iop h SER 92 CO 0.48 0.79 -0.87 0.49 -0.87 0.00 0.00 176.83 176.86 3iop n PHE 93 N -3.95 0.00 -4.03 4.77 3.01 -1.26 -5.04 117.46 110.96 3iop n PHE 93 Ca -0.02 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.34 3iop n PHE 93 Cb 0.56 -0.08 -0.07 0.00 -0.01 0.00 0.00 39.48 39.88 3iop n PHE 93 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3iop s SER 94 N -2.52 0.02 -0.03 4.37 1.04 -1.25 -4.04 113.70 111.29 3iop s SER 94 Ca 0.02 -1.01 -0.00 0.00 0.48 0.00 0.00 55.95 55.43 3iop s SER 94 Cb 0.09 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.72 3iop s SER 94 CO 0.50 -0.98 0.02 -0.89 0.98 0.00 0.00 173.24 172.88 3iop s THR 95 N -4.03 0.05 -0.28 2.02 2.01 -0.23 -0.32 115.64 114.85 3iop s THR 95 Ca 0.24 0.18 -0.10 0.00 0.31 0.00 0.00 61.69 62.32 3iop s THR 95 Cb 0.03 -0.18 -0.04 0.00 0.01 0.00 0.00 72.50 72.32 3iop s THR 95 CO 0.06 0.12 0.16 -0.69 -0.69 0.00 0.00 174.62 173.59 3iop s VAL 96 N 1.16 5.02 -0.04 3.82 1.01 -0.02 0.06 120.40 131.41 3iop s VAL 96 Ca -0.08 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.01 3iop s VAL 96 Cb -0.13 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3iop s VAL 96 CO -0.02 0.26 -0.25 -0.69 0.00 0.00 0.00 175.10 174.39 3iop s VAL 97 N 1.72 2.08 0.17 2.92 1.01 -0.31 0.45 120.40 128.44 3iop s VAL 97 Ca 0.07 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 3iop s VAL 97 Cb -0.16 -1.74 -0.08 0.00 0.00 0.00 0.00 36.38 34.40 3iop s VAL 97 CO 0.09 0.57 1.28 -0.22 0.00 0.00 0.00 175.10 176.82 3iop s LEU 98 N -0.34 4.41 0.00 3.92 2.96 -0.54 -0.76 118.68 128.34 3iop s LEU 98 Ca 0.02 2.31 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 3iop s LEU 98 Cb -0.12 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 42.96 3iop s LEU 98 CO 0.02 -0.50 -0.01 0.00 -1.32 0.00 0.00 176.35 174.54 3iop s ALA 99 N 0.28 0.06 -0.24 5.97 0.00 -0.14 0.97 121.76 128.67 3iop s ALA 99 Ca 0.57 -0.11 -0.07 0.00 0.00 0.00 0.00 51.96 52.34 3iop s ALA 99 Cb -0.35 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 3iop s ALA 99 CO 0.36 -0.01 0.07 -0.98 0.00 0.00 0.00 175.76 175.20 3iop s ARG 100 N -0.23 3.71 0.05 0.00 1.70 -0.16 -0.52 118.95 123.50 3iop s ARG 100 Ca -0.02 -0.45 -0.31 0.00 -0.47 0.00 0.00 55.73 54.48 3iop s ARG 100 Cb -0.02 -3.31 -0.07 0.00 -0.57 0.00 0.00 34.95 30.99 3iop s ARG 100 CO -0.00 -0.11 1.39 -2.00 -1.08 0.00 0.00 175.30 173.50 3iop s GLU 101 N 1.41 4.30 0.14 3.89 2.12 0.22 -0.46 118.70 130.33 3iop s GLU 101 Ca 0.05 2.01 -0.12 0.00 0.36 0.00 0.00 54.97 57.28 3iop s GLU 101 Cb -0.15 -3.43 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 3iop s GLU 101 CO 0.04 -0.51 1.52 -0.07 -0.54 0.00 0.00 175.26 175.70 3iop h LEU 102 N 7.65 0.95 -1.55 2.70 3.38 -1.46 0.24 115.31 127.22 3iop h LEU 102 Ca -0.40 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.12 3iop h LEU 102 Cb 1.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 3iop h LEU 102 CO 0.88 1.15 -0.19 0.00 0.09 0.00 0.00 178.44 180.37 3iop h ALA 103 N 0.83 1.19 0.00 1.53 0.00 -1.92 -3.34 119.26 117.54 3iop h ALA 103 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3iop h ALA 103 Cb 0.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3iop h ALA 103 CO 0.07 0.24 -0.68 0.25 0.00 0.00 0.00 179.25 179.13 3iop n THR 104 N -3.59 0.00 -0.90 0.00 -2.24 -1.18 -5.01 114.28 101.37 3iop n THR 104 Ca -0.01 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 3iop n THR 104 Cb 0.33 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 3iop n THR 104 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3iop n SER 105 N -1.20 -1.48 -4.76 3.42 2.88 0.84 -5.00 113.62 108.32 3iop n SER 105 Ca 0.00 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.14 3iop n SER 105 Cb 0.00 -1.07 -0.04 0.00 -0.75 0.00 0.00 64.21 62.35 3iop n SER 105 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3iop s ARG 106 N -0.45 4.59 -0.20 -1.46 0.52 -1.24 -4.72 118.95 115.99 3iop s ARG 106 Ca 0.00 1.87 -0.13 0.00 -0.52 0.00 0.00 55.73 56.95 3iop s ARG 106 Cb 0.00 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.25 3iop s ARG 106 CO 0.00 0.13 0.28 -1.21 0.02 0.00 0.00 175.30 174.52 3iop s GLU 107 N -1.42 4.18 0.14 3.54 2.02 -1.26 -0.61 118.70 125.30 3iop s GLU 107 Ca 0.46 0.01 0.10 0.00 0.02 0.00 0.00 54.97 55.56 3iop s GLU 107 Cb -0.33 -3.49 -0.04 0.00 0.10 0.00 0.00 34.13 30.37 3iop s GLU 107 CO 0.43 0.12 -0.24 0.71 0.02 0.00 0.00 175.26 176.30 3iop s TYR 108 N 0.86 2.12 -0.49 1.61 2.02 0.32 -4.34 117.35 119.45 3iop s TYR 108 Ca 0.14 -0.40 -0.18 0.00 -0.37 0.00 0.00 57.07 56.26 3iop s TYR 108 Cb -0.13 -1.11 0.06 0.00 -0.40 0.00 0.00 41.96 40.37 3iop s TYR 108 CO 0.05 0.35 0.56 0.00 -1.57 0.00 0.00 175.55 174.93 3iop s ALA 109 N -1.37 3.42 -0.28 3.71 0.00 -0.38 -0.96 121.76 125.90 3iop s ALA 109 Ca 0.14 -1.77 -0.16 0.00 0.00 0.00 0.00 51.96 50.18 3iop s ALA 109 Cb -0.09 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 3iop s ALA 109 CO 0.07 -1.90 0.42 0.42 0.00 0.00 0.00 175.76 174.77 3iop s ILE 110 N 2.39 5.13 -0.28 0.00 1.01 0.06 -1.01 121.20 128.50 3iop s ILE 110 Ca 0.13 0.61 -0.24 0.00 0.00 0.00 0.00 60.65 61.15 3iop s ILE 110 Cb -0.20 -3.76 -0.00 0.00 0.01 0.00 0.00 42.46 38.51 3iop s ILE 110 CO 0.11 0.10 0.79 -0.75 0.00 0.00 0.00 174.94 175.19 3iop s LYS 111 N 2.15 4.04 -0.19 2.79 2.20 0.28 -1.17 119.74 129.85 3iop s LYS 111 Ca 0.17 0.69 -0.04 0.00 -0.36 0.00 0.00 55.97 56.43 3iop s LYS 111 Cb -0.16 -3.70 -0.02 0.00 -1.51 0.00 0.00 37.83 32.45 3iop s LYS 111 CO 0.10 -0.61 -0.03 0.42 -0.36 0.00 0.00 175.35 174.87 3iop s ILE 112 N 2.89 3.70 -0.10 5.43 1.01 0.11 -0.56 121.20 133.68 3iop s ILE 112 Ca 0.33 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.59 3iop s ILE 112 Cb -0.15 -2.66 0.02 0.00 0.01 0.00 0.00 42.46 39.68 3iop s ILE 112 CO 0.11 0.44 -0.12 -0.76 0.00 0.00 0.00 174.94 174.61 3iop s LEU 113 N 1.00 1.53 -0.22 2.97 1.02 0.05 -1.07 118.68 123.96 3iop s LEU 113 Ca 0.01 -0.35 -0.29 0.00 0.02 0.00 0.00 54.13 53.52 3iop s LEU 113 Cb -0.15 -0.93 0.00 0.00 0.02 0.00 0.00 46.19 45.14 3iop s LEU 113 CO 0.01 -0.02 1.15 -0.70 0.02 0.00 0.00 176.35 176.81 3iop s GLU 114 N 1.13 4.21 0.25 1.70 2.12 -1.26 0.24 118.70 127.08 3iop s GLU 114 Ca -0.05 1.45 -0.06 0.00 0.36 0.00 0.00 54.97 56.67 3iop s GLU 114 Cb -0.14 -3.71 0.26 0.00 0.26 0.00 0.00 34.13 30.79 3iop s GLU 114 CO -0.02 -0.71 1.92 0.87 -0.54 0.00 0.00 175.26 176.78 3iop h LYS 115 N 7.92 1.29 -0.30 4.30 1.57 -1.30 -2.53 116.57 127.53 3iop h LYS 115 Ca -0.23 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3iop h LYS 115 Cb 1.08 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 3iop h LYS 115 CO 0.98 0.86 0.20 -0.09 -0.57 0.00 0.00 179.45 180.83 3iop h ARG 116 N 1.33 0.39 -0.36 3.15 2.43 -1.93 -1.85 114.38 117.55 3iop h ARG 116 Ca 0.37 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.42 3iop h ARG 116 Cb -0.14 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 3iop h ARG 116 CO -0.08 0.26 -0.18 1.25 -1.51 0.00 0.00 179.97 179.71 3iop h HIS 117 N 0.40 0.74 -0.25 2.20 2.76 -1.90 0.44 115.15 119.54 3iop h HIS 117 Ca 0.11 -0.15 -0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3iop h HIS 117 Cb -0.04 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.72 3iop h HIS 117 CO -0.06 0.80 0.15 0.82 -1.30 0.00 0.00 177.93 178.34 3iop h ILE 118 N 0.59 1.09 -0.17 6.26 2.04 -1.31 -1.88 117.51 124.14 3iop h ILE 118 Ca 0.09 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 3iop h ILE 118 Cb 0.64 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3iop h ILE 118 CO 0.04 0.09 0.02 0.40 0.00 0.00 0.00 178.15 178.71 3iop h ILE 119 N 0.32 1.23 -0.75 -0.67 2.04 -1.05 0.17 117.51 118.79 3iop h ILE 119 Ca 0.09 -0.76 0.06 0.00 1.00 0.00 0.00 64.86 65.26 3iop h ILE 119 Cb 0.02 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 3iop h ILE 119 CO -0.02 0.23 0.44 0.50 0.00 0.00 0.00 178.15 179.30 3iop h LYS 120 N 0.07 0.78 -0.62 2.37 3.64 -0.88 -2.41 116.57 119.52 3iop h LYS 120 Ca 0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3iop h LYS 120 Cb 0.33 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3iop h LYS 120 CO 0.00 0.52 0.00 0.39 -2.27 0.00 0.00 179.45 178.09 3iop n GLU 121 N -4.71 2.90 -3.60 1.90 -0.58 -0.71 -4.96 120.64 110.87 3iop n GLU 121 Ca 0.10 -2.27 -0.22 0.00 -0.42 0.00 0.00 57.16 54.36 3iop n GLU 121 Cb 0.18 -1.65 0.05 0.00 -0.57 0.00 0.00 31.44 29.44 3iop n GLU 121 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3iop n ASN 122 N 1.04 -2.95 -0.62 1.62 3.02 -0.76 -4.94 115.26 111.67 3iop n ASN 122 Ca 0.21 -0.82 0.06 0.00 -0.03 0.00 0.00 54.58 54.00 3iop n ASN 122 Cb 0.65 -4.22 0.13 0.00 -0.61 0.00 0.00 39.78 35.73 3iop n ASN 122 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3iop n LYS 123 N -4.06 2.13 -0.20 3.52 4.76 0.51 -4.67 118.16 120.14 3iop n LYS 123 Ca -0.22 -1.80 0.00 0.00 -2.87 0.00 0.00 58.31 53.42 3iop n LYS 123 Cb 0.65 -1.27 0.11 0.00 -1.84 0.00 0.00 35.03 32.68 3iop n LYS 123 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3iop h VAL 124 N 2.26 0.76 -0.54 -0.18 2.07 -1.92 0.31 116.25 119.01 3iop h VAL 124 Ca 0.00 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 3iop h VAL 124 Cb 0.67 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3iop h VAL 124 CO 0.00 0.07 0.30 -0.65 0.02 0.00 0.00 177.57 177.31 3iop h PRO 125 N 0.40 0.74 -0.16 1.57 0.11 -1.96 -0.89 132.00 131.81 3iop h PRO 125 Ca 0.31 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.30 3iop h PRO 125 Cb 0.39 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 3iop h PRO 125 CO -0.31 0.54 -0.07 1.88 -0.21 0.00 0.00 178.00 179.83 3iop h TYR 126 N 0.75 0.38 -0.39 0.65 -1.99 -1.47 -1.72 116.97 113.18 3iop h TYR 126 Ca 0.19 -0.09 -0.16 0.00 2.00 0.00 0.00 58.73 60.67 3iop h TYR 126 Cb 0.02 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 3iop h TYR 126 CO 0.00 0.65 -0.38 0.28 -0.00 0.00 0.00 178.16 178.71 3iop h VAL 127 N 0.00 1.27 -0.12 -2.88 2.07 -0.93 -0.77 116.25 114.88 3iop h VAL 127 Ca 0.04 -1.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.00 3iop h VAL 127 Cb 0.55 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3iop h VAL 127 CO 0.02 0.52 0.07 0.74 0.02 0.00 0.00 177.57 178.95 3iop h THR 128 N 0.77 1.05 -0.83 2.57 2.02 -1.21 -1.85 112.91 115.44 3iop h THR 128 Ca 0.06 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 3iop h THR 128 Cb 0.98 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 68.27 3iop h THR 128 CO 0.09 0.05 0.39 -0.09 0.37 0.00 0.00 175.52 176.34 3iop h ARG 129 N 0.14 1.20 -0.20 6.66 2.43 -1.27 -1.27 114.38 122.06 3iop h ARG 129 Ca 0.04 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 3iop h ARG 129 Cb 0.01 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 29.31 3iop h ARG 129 CO -0.01 0.92 -0.06 1.49 -1.51 0.00 0.00 179.97 180.80 3iop h GLU 130 N 1.18 -0.02 -0.57 0.20 4.81 -0.90 0.15 114.58 119.43 3iop h GLU 130 Ca 0.28 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 3iop h GLU 130 Cb 0.13 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 3iop h GLU 130 CO -0.03 -0.01 0.18 -0.09 -0.73 0.00 0.00 179.01 178.32 3iop h ARG 131 N -0.02 0.89 -0.65 1.92 2.43 -1.15 -1.82 114.38 115.97 3iop h ARG 131 Ca 0.10 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.04 3iop h ARG 131 Cb 0.18 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 3iop h ARG 131 CO -0.22 0.80 0.25 -0.44 -1.51 0.00 0.00 179.97 178.85 3iop h ASP 132 N 0.80 0.91 -0.23 -3.80 3.32 -0.87 -0.90 116.42 115.65 3iop h ASP 132 Ca 0.18 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 3iop h ASP 132 Cb 0.28 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3iop h ASP 132 CO -0.01 0.84 0.04 0.58 -1.72 0.00 0.00 179.24 178.97 3iop h VAL 133 N 0.92 1.23 -0.21 -1.35 2.07 -0.63 -3.07 116.25 115.21 3iop h VAL 133 Ca 0.22 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 3iop h VAL 133 Cb 0.23 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3iop h VAL 133 CO -0.02 0.24 -0.08 0.24 0.02 0.00 0.00 177.57 177.98 3iop h MET 134 N 0.17 0.32 0.00 1.57 2.86 -1.20 -1.99 114.93 116.67 3iop h MET 134 Ca 0.07 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3iop h MET 134 Cb 0.32 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 3iop h MET 134 CO 0.00 0.41 -0.11 0.77 1.06 0.00 0.00 176.91 179.05 3iop h SER 135 N 0.31 0.00 0.32 1.22 0.02 -1.10 -2.73 113.55 111.59 3iop h SER 135 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3iop h SER 135 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 3iop h SER 135 CO 0.02 0.11 -0.28 0.54 -1.14 0.00 0.00 176.83 176.08 3iop n ARG 136 N -4.41 0.63 -2.94 3.45 1.74 -0.76 -4.86 116.66 109.52 3iop n ARG 136 Ca -0.03 -0.35 -0.42 0.00 -0.77 0.00 0.00 57.85 56.29 3iop n ARG 136 Cb 0.19 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 3iop n ARG 136 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3iop s LEU 137 N -2.61 4.08 -0.38 0.55 1.43 -1.03 -4.96 118.68 115.76 3iop s LEU 137 Ca 0.22 0.95 0.09 0.00 -1.03 0.00 0.00 54.13 54.37 3iop s LEU 137 Cb 0.19 -3.11 0.29 0.00 0.03 0.00 0.00 46.19 43.59 3iop s LEU 137 CO 0.55 -0.49 0.60 -0.67 0.23 0.00 0.00 176.35 176.57 3iop n ASP 138 N 5.95 0.39 -3.78 2.29 2.03 -1.26 -4.79 116.55 117.38 3iop n ASP 138 Ca 0.04 -2.82 -0.13 0.00 0.52 0.00 0.00 54.79 52.41 3iop n ASP 138 Cb 0.48 -0.61 -0.12 0.00 -0.72 0.00 0.00 41.12 40.15 3iop n ASP 138 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3iop s HIS 139 N -1.64 -0.29 0.58 -0.67 2.46 -1.26 -5.06 115.29 109.42 3iop s HIS 139 Ca 0.37 0.70 0.28 0.00 0.47 0.00 0.00 55.06 56.88 3iop s HIS 139 Cb 0.24 0.09 1.71 0.00 -0.13 0.00 0.00 32.58 34.49 3iop s HIS 139 CO -0.10 -0.15 2.18 -1.00 -2.47 0.00 0.00 174.74 173.21 3iop h PRO 140 N 5.91 0.00 -0.19 2.88 0.13 -1.98 -1.91 132.00 136.83 3iop h PRO 140 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3iop h PRO 140 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3iop h PRO 140 CO 0.35 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.31 3iop n PHE 141 N -3.89 0.24 -4.51 1.56 3.72 -1.26 -4.72 117.46 108.60 3iop n PHE 141 Ca -0.01 -0.12 -0.24 0.00 -0.05 0.00 0.00 57.45 57.03 3iop n PHE 141 Cb 0.19 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.59 3iop n PHE 141 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3iop s PHE 142 N -1.76 1.66 0.44 1.38 0.40 -0.72 -1.01 117.98 118.38 3iop s PHE 142 Ca 0.27 -0.38 -0.22 0.00 -0.60 0.00 0.00 56.93 56.01 3iop s PHE 142 Cb 0.14 -0.98 -0.12 0.00 0.51 0.00 0.00 43.02 42.58 3iop s PHE 142 CO 0.21 0.10 0.59 1.55 0.70 0.00 0.00 175.22 178.37 3iop n VAL 143 N 1.72 1.90 -4.84 -0.44 3.14 -0.54 -4.72 118.33 114.55 3iop n VAL 143 Ca -0.18 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.37 3iop n VAL 143 Cb 0.54 -0.62 -0.13 0.00 -1.06 0.00 0.00 33.84 32.56 3iop n VAL 143 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 3iop s LYS 144 N -1.70 2.82 -0.42 1.45 2.20 -1.26 -4.89 119.74 117.95 3iop s LYS 144 Ca 0.64 -0.68 -0.21 0.00 -0.36 0.00 0.00 55.97 55.36 3iop s LYS 144 Cb -0.57 -2.48 0.02 0.00 -1.51 0.00 0.00 37.83 33.29 3iop s LYS 144 CO 0.57 0.49 0.63 -1.17 -0.36 0.00 0.00 175.35 175.51 3iop s LEU 145 N -0.36 4.45 -0.08 5.43 0.20 -1.26 -2.21 118.68 124.85 3iop s LEU 145 Ca 0.04 -0.24 -0.02 0.00 0.69 0.00 0.00 54.13 54.60 3iop s LEU 145 Cb -0.12 -2.73 -0.26 0.00 -0.43 0.00 0.00 46.19 42.64 3iop s LEU 145 CO 0.02 -0.73 0.53 1.88 -0.29 0.00 0.00 176.35 177.76 3iop h TYR 146 N 8.78 0.40 -2.79 5.38 -1.99 -1.06 -3.47 116.97 122.22 3iop h TYR 146 Ca -0.26 -0.29 -0.00 0.00 2.00 0.00 0.00 58.73 60.18 3iop h TYR 146 Cb 1.10 -0.02 -0.13 0.00 2.00 0.00 0.00 36.73 39.68 3iop h TYR 146 CO 0.73 1.55 0.26 -0.59 -0.00 0.00 0.00 178.16 180.11 3iop s PHE 147 N -2.58 -0.52 0.03 4.88 -0.12 -1.23 -5.02 117.98 113.43 3iop s PHE 147 Ca -0.16 0.38 0.03 0.00 -0.05 0.00 0.00 56.93 57.14 3iop s PHE 147 Cb 0.07 0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 42.98 3iop s PHE 147 CO 0.80 -0.78 -0.11 0.95 -0.05 0.00 0.00 175.22 176.04 3iop s THR 148 N -3.41 0.81 0.29 -4.49 -4.23 -1.26 -0.23 115.64 103.12 3iop s THR 148 Ca 0.01 -0.91 -0.10 0.00 -1.18 0.00 0.00 61.69 59.50 3iop s THR 148 Cb -0.01 -0.77 0.00 0.00 1.34 0.00 0.00 72.50 73.06 3iop s THR 148 CO -0.10 -0.12 0.51 0.72 -0.54 0.00 0.00 174.62 175.09 3iop s PHE 149 N -0.92 0.52 -0.02 3.99 -0.71 -0.81 -4.75 117.98 115.27 3iop s PHE 149 Ca -0.02 -0.89 -0.14 0.00 -1.04 0.00 0.00 56.93 54.84 3iop s PHE 149 Cb -0.08 0.19 0.02 0.00 -1.21 0.00 0.00 43.02 41.95 3iop s PHE 149 CO 0.01 -1.10 0.31 1.14 -1.34 0.00 0.00 175.22 174.23 3iop s GLN 150 N -3.56 0.64 0.00 1.99 -2.07 -1.26 -0.50 119.66 114.89 3iop s GLN 150 Ca 0.24 -0.15 0.00 0.00 -1.82 0.00 0.00 55.36 53.63 3iop s GLN 150 Cb -0.01 0.28 0.00 0.00 -1.09 0.00 0.00 33.01 32.19 3iop s GLN 150 CO 0.12 -0.17 0.00 -0.40 -1.32 0.00 0.00 175.29 173.52 3iop n ASP 151 N 1.41 0.25 -0.04 12.60 5.68 -0.98 -5.02 116.55 130.45 3iop n ASP 151 Ca -0.21 0.00 -0.08 0.00 -0.50 0.00 0.00 54.79 54.00 3iop n ASP 151 Cb 0.56 0.00 0.09 0.00 -1.14 0.00 0.00 41.12 40.63 3iop n ASP 151 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3iop h ASP 152 N 0.00 0.69 0.00 -1.12 3.32 -2.04 -3.36 116.42 113.91 3iop h ASP 152 Ca 0.00 -0.29 -0.31 0.00 0.02 0.00 0.00 57.03 56.46 3iop h ASP 152 Cb 0.00 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.30 3iop h ASP 152 CO 0.00 0.98 -2.15 -0.62 -1.72 0.00 0.00 179.24 175.73 3iop n GLU 153 N -4.06 1.22 -4.21 3.56 4.71 -1.26 -4.95 120.64 115.65 3iop n GLU 153 Ca -0.01 0.00 -0.18 0.00 -0.01 0.00 0.00 57.16 56.96 3iop n GLU 153 Cb 0.49 -1.43 -0.12 0.00 -1.01 0.00 0.00 31.44 29.37 3iop n GLU 153 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 3iop s LYS 154 N -2.41 0.81 -0.03 3.49 1.02 -1.26 -0.77 119.74 120.59 3iop s LYS 154 Ca -0.10 -0.86 -0.07 0.00 0.02 0.00 0.00 55.97 54.96 3iop s LYS 154 Cb 0.05 -0.79 -0.05 0.00 -0.52 0.00 0.00 37.83 36.53 3iop s LYS 154 CO 0.67 0.18 0.24 -0.51 -0.92 0.00 0.00 175.35 175.00 3iop s LEU 155 N -1.52 4.39 -0.13 3.17 1.43 0.14 -2.31 118.68 123.85 3iop s LEU 155 Ca -0.02 0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.64 3iop s LEU 155 Cb -0.09 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.67 3iop s LEU 155 CO 0.02 0.31 -0.15 -0.31 0.23 0.00 0.00 176.35 176.44 3iop s TYR 156 N -1.20 2.12 -0.22 0.29 2.02 0.34 -0.77 117.35 119.93 3iop s TYR 156 Ca 0.23 -1.09 -0.04 0.00 -0.37 0.00 0.00 57.07 55.80 3iop s TYR 156 Cb -0.13 -1.53 -0.01 0.00 -0.40 0.00 0.00 41.96 39.88 3iop s TYR 156 CO 0.12 -0.57 -0.02 -0.06 -1.57 0.00 0.00 175.55 173.45 3iop s PHE 157 N 1.19 2.98 -0.55 2.71 0.08 0.27 -1.93 117.98 122.74 3iop s PHE 157 Ca -0.01 -0.83 -0.23 0.00 0.12 0.00 0.00 56.93 55.97 3iop s PHE 157 Cb -0.14 -2.12 0.04 0.00 -0.57 0.00 0.00 43.02 40.23 3iop s PHE 157 CO -0.06 -0.50 0.90 0.20 -0.10 0.00 0.00 175.22 175.66 3iop s GLY 158 N 1.46 1.46 0.28 4.36 0.00 0.68 -0.55 107.32 115.00 3iop s GLY 158 Ca 0.05 -1.32 0.08 0.00 0.00 0.00 0.00 44.72 43.54 3iop s GLY 158 CO -0.02 1.97 0.13 1.08 0.00 0.00 0.00 173.10 176.26 3iop s LEU 159 N 3.77 3.51 0.35 0.66 1.43 -0.18 -0.37 118.68 127.85 3iop s LEU 159 Ca 0.28 -0.48 -0.28 0.00 -1.03 0.00 0.00 54.13 52.63 3iop s LEU 159 Cb -0.14 -2.04 -0.10 0.00 0.03 0.00 0.00 46.19 43.94 3iop s LEU 159 CO 0.18 -0.09 1.33 -0.94 0.23 0.00 0.00 176.35 177.06 3iop s SER 160 N -3.80 6.61 -0.19 2.29 1.04 -0.94 -1.25 113.70 117.47 3iop s SER 160 Ca 0.34 2.73 -0.18 0.00 0.48 0.00 0.00 55.95 59.32 3iop s SER 160 Cb -0.06 -2.65 -0.04 0.00 0.10 0.00 0.00 66.02 63.37 3iop s SER 160 CO 0.23 -0.65 0.48 -0.47 0.98 0.00 0.00 173.24 173.81 3iop s TYR 161 N -1.17 3.40 -0.60 5.02 5.04 -1.26 -4.39 117.35 123.39 3iop s TYR 161 Ca 0.51 0.75 -0.13 0.00 -2.44 0.00 0.00 57.07 55.76 3iop s TYR 161 Cb -0.40 -2.61 0.15 0.00 0.35 0.00 0.00 41.96 39.45 3iop s TYR 161 CO 0.53 -0.03 0.52 0.00 -1.34 0.00 0.00 175.55 175.24 3iop s ALA 162 N 1.36 3.69 0.29 3.97 0.00 -1.26 -4.86 121.76 124.96 3iop s ALA 162 Ca 0.23 -2.77 0.04 0.00 0.00 0.00 0.00 51.96 49.46 3iop s ALA 162 Cb -0.15 -3.18 0.66 0.00 0.00 0.00 0.00 23.12 20.44 3iop s ALA 162 CO 0.09 -2.06 1.80 -0.22 0.00 0.00 0.00 175.76 175.37 3iop h LYS 163 N 8.41 0.84 -0.13 0.00 3.64 -1.83 -2.19 116.57 125.30 3iop h LYS 163 Ca -0.16 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 3iop h LYS 163 Cb 1.07 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 3iop h LYS 163 CO 0.91 0.56 0.00 0.09 -2.27 0.00 0.00 179.45 178.73 3iop n ASN 164 N -4.70 1.44 0.00 4.20 3.02 -0.41 -4.95 115.26 113.85 3iop n ASN 164 Ca 0.21 -1.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 3iop n ASN 164 Cb 0.48 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 3iop n ASN 164 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3iop n GLY 165 N 1.09 -0.19 3.78 7.41 0.00 -0.82 -4.72 105.19 111.73 3iop n GLY 165 Ca 0.16 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 3iop n GLY 165 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iop s GLU 166 N 0.00 4.26 0.35 1.61 2.02 -1.26 -0.29 118.70 125.39 3iop s GLU 166 Ca 0.00 1.47 0.04 0.00 0.02 0.00 0.00 54.97 56.50 3iop s GLU 166 Cb 0.00 -2.59 0.68 0.00 0.10 0.00 0.00 34.13 32.32 3iop s GLU 166 CO 0.00 -0.05 1.97 1.25 0.02 0.00 0.00 175.26 178.45 3iop h LEU 167 N 2.63 0.71 -0.82 1.80 5.85 -0.58 -2.81 115.31 122.10 3iop h LEU 167 Ca -0.48 -0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.38 3iop h LEU 167 Cb 1.21 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.99 3iop h LEU 167 CO 0.63 0.48 0.41 0.25 -0.34 0.00 0.00 178.44 179.87 3iop h LEU 168 N 0.82 0.49 -0.59 2.25 5.85 -1.75 -1.26 115.31 121.11 3iop h LEU 168 Ca 0.29 0.09 0.11 0.00 0.84 0.00 0.00 57.88 59.21 3iop h LEU 168 Cb 0.13 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.09 3iop h LEU 168 CO -0.09 0.21 0.15 0.50 -0.34 0.00 0.00 178.44 178.87 3iop h LYS 169 N 0.60 0.28 -0.01 1.25 3.64 -1.83 -1.99 116.57 118.51 3iop h LYS 169 Ca 0.44 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.69 3iop h LYS 169 Cb 0.62 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 3iop h LYS 169 CO -0.36 0.18 -0.55 1.88 -2.27 0.00 0.00 179.45 178.34 3iop h TYR 170 N 0.29 0.04 -0.38 1.91 -1.99 -1.35 -1.25 116.97 114.24 3iop h TYR 170 Ca 0.31 -0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.95 3iop h TYR 170 Cb 0.44 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.15 3iop h TYR 170 CO -0.23 0.58 -0.04 0.82 -0.00 0.00 0.00 178.16 179.29 3iop h ILE 171 N 0.02 1.27 -0.00 -2.88 2.04 -0.92 -2.23 117.51 114.82 3iop h ILE 171 Ca -0.00 -1.08 -0.14 0.00 1.00 0.00 0.00 64.86 64.64 3iop h ILE 171 Cb 0.98 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 3iop h ILE 171 CO 0.07 0.36 -0.66 0.03 0.00 0.00 0.00 178.15 177.95 3iop h ARG 172 N 0.50 0.01 -0.01 2.37 3.08 -1.28 -1.01 114.38 118.05 3iop h ARG 172 Ca 0.10 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 3iop h ARG 172 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3iop h ARG 172 CO 0.03 0.66 -0.02 -0.22 -1.07 0.00 0.00 179.97 179.35 3iop h LYS 173 N 0.01 0.03 -0.07 0.04 3.64 -1.17 -3.33 116.57 115.72 3iop h LYS 173 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3iop h LYS 173 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 3iop h LYS 173 CO 0.09 0.59 0.00 0.44 -2.27 0.00 0.00 179.45 178.29 3iop n ILE 174 N -4.79 0.06 0.00 2.00 -5.35 -0.84 -5.00 119.36 105.44 3iop n ILE 174 Ca -0.09 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 61.91 3iop n ILE 174 Cb 0.30 1.25 0.00 0.00 -1.74 0.00 0.00 39.64 39.45 3iop n ILE 174 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iop n GLY 175 N 1.33 1.95 3.62 3.28 0.00 -0.38 -4.79 105.19 110.20 3iop n GLY 175 Ca 0.15 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 3iop n GLY 175 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iop s SER 176 N 0.00 -0.60 0.43 1.61 1.04 -1.25 -4.18 113.70 110.75 3iop s SER 176 Ca 0.00 1.08 -0.23 0.00 0.48 0.00 0.00 55.95 57.27 3iop s SER 176 Cb 0.00 1.06 -0.08 0.00 0.10 0.00 0.00 66.02 67.10 3iop s SER 176 CO 0.00 -0.25 1.11 -0.36 0.98 0.00 0.00 173.24 174.72 3iop s PHE 177 N 0.06 3.06 1.05 5.02 0.40 0.20 -5.02 117.98 122.74 3iop s PHE 177 Ca 0.00 1.58 -0.18 0.00 -0.60 0.00 0.00 56.93 57.74 3iop s PHE 177 Cb -0.04 -3.26 0.25 0.00 0.51 0.00 0.00 43.02 40.49 3iop s PHE 177 CO -0.01 -1.09 1.11 -0.40 0.70 0.00 0.00 175.22 175.53 3iop n ASP 178 N -0.31 -1.15 -0.14 1.36 5.68 -1.26 -4.64 116.55 116.08 3iop n ASP 178 Ca 0.06 -1.26 -0.12 0.00 -0.50 0.00 0.00 54.79 52.98 3iop n ASP 178 Cb 0.49 -0.94 -0.01 0.00 -1.14 0.00 0.00 41.12 39.52 3iop n ASP 178 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3iop h GLU 179 N 0.00 0.89 -0.25 0.11 4.81 -1.99 -0.89 114.58 117.26 3iop h GLU 179 Ca -0.39 -0.38 0.01 0.00 -0.13 0.00 0.00 59.36 58.47 3iop h GLU 179 Cb 1.14 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 3iop h GLU 179 CO 0.26 1.03 0.15 1.15 -0.73 0.00 0.00 179.01 180.86 3iop h THR 180 N 0.72 1.03 -0.22 0.32 2.02 -1.99 -0.84 112.91 113.95 3iop h THR 180 Ca 0.10 -0.10 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 3iop h THR 180 Cb 0.75 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 3iop h THR 180 CO 0.06 0.06 -0.52 0.00 0.37 0.00 0.00 175.52 175.49 3iop h THR 182 N 0.49 1.08 -0.10 0.00 2.02 -1.03 -2.40 112.91 112.97 3iop h THR 182 Ca 0.02 -0.24 0.03 0.00 0.77 0.00 0.00 66.41 66.99 3iop h THR 182 Cb 1.07 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 3iop h THR 182 CO 0.10 0.06 -0.05 -0.09 0.37 0.00 0.00 175.52 175.91 3iop h ARG 183 N -0.07 -0.05 -0.14 6.66 2.43 -1.13 -0.56 114.38 121.53 3iop h ARG 183 Ca 0.01 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3iop h ARG 183 Cb 0.10 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3iop h ARG 183 CO -0.00 -0.03 0.07 0.35 -1.51 0.00 0.00 179.97 178.85 3iop h PHE 184 N -0.05 0.20 -0.04 2.20 3.57 -1.40 -0.55 116.94 120.86 3iop h PHE 184 Ca 0.06 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.38 3iop h PHE 184 Cb 0.14 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3iop h PHE 184 CO -0.18 0.22 -0.73 1.88 -2.23 0.00 0.00 178.31 177.27 3iop h TYR 185 N 0.12 0.34 -0.37 0.41 0.05 -1.41 -1.88 116.97 114.23 3iop h TYR 185 Ca 0.05 -0.15 -0.01 0.00 0.05 0.00 0.00 58.73 58.66 3iop h TYR 185 Cb 0.09 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3iop h TYR 185 CO -0.04 0.89 0.18 1.15 -1.05 0.00 0.00 178.16 179.29 3iop h THR 186 N 0.16 1.16 -0.89 -2.88 2.02 -1.06 -2.17 112.91 109.26 3iop h THR 186 Ca -0.03 -0.46 0.05 0.00 0.77 0.00 0.00 66.41 66.74 3iop h THR 186 Cb 1.30 0.80 -0.06 0.00 -1.74 0.00 0.00 68.15 68.44 3iop h THR 186 CO 0.11 0.17 0.56 0.00 0.37 0.00 0.00 175.52 176.74 3iop h ALA 187 N 1.03 1.20 -0.62 6.16 0.00 -0.92 0.62 119.26 126.74 3iop h ALA 187 Ca 0.13 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3iop h ALA 187 Cb 0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3iop h ALA 187 CO -0.02 0.36 0.25 0.93 0.00 0.00 0.00 179.25 180.77 3iop h GLU 188 N 1.05 0.92 -0.55 0.00 5.08 -1.21 -0.25 114.58 119.63 3iop h GLU 188 Ca 0.37 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 3iop h GLU 188 Cb 0.11 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3iop h GLU 188 CO -0.15 0.78 0.10 0.82 -1.00 0.00 0.00 179.01 179.56 3iop h ILE 189 N 0.86 1.25 -0.29 3.13 2.04 -0.73 0.09 117.51 123.87 3iop h ILE 189 Ca 0.21 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 3iop h ILE 189 Cb 0.20 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3iop h ILE 189 CO -0.02 0.34 0.14 0.58 0.00 0.00 0.00 178.15 179.20 3iop h VAL 190 N 0.79 1.15 -0.65 1.67 2.07 -0.72 0.17 116.25 120.73 3iop h VAL 190 Ca 0.17 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 3iop h VAL 190 Cb 0.39 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3iop h VAL 190 CO 0.01 0.15 0.37 0.28 0.02 0.00 0.00 177.57 178.40 3iop h SER 191 N 0.34 0.80 -0.18 0.57 0.02 -0.93 0.21 113.55 114.38 3iop h SER 191 Ca 0.10 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 3iop h SER 191 Cb 0.11 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 3iop h SER 191 CO -0.01 0.65 0.10 0.00 -1.14 0.00 0.00 176.83 176.43 3iop h ALA 192 N 1.18 0.22 -0.53 3.77 0.00 -0.79 -2.43 119.26 120.69 3iop h ALA 192 Ca 0.23 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3iop h ALA 192 Cb 0.02 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3iop h ALA 192 CO -0.04 -0.32 0.08 -0.07 0.00 0.00 0.00 179.25 178.90 3iop h LEU 193 N 0.21 0.79 -0.29 0.00 3.38 -0.65 -0.76 115.31 117.97 3iop h LEU 193 Ca 0.07 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.89 3iop h LEU 193 Cb 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3iop h LEU 193 CO -0.04 0.80 0.17 -0.08 0.09 0.00 0.00 178.44 179.39 3iop h GLU 194 N 0.79 0.34 -0.09 1.13 4.81 -0.82 0.29 114.58 121.03 3iop h GLU 194 Ca 0.17 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.39 3iop h GLU 194 Cb 0.36 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3iop h GLU 194 CO 0.01 0.23 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.57 3iop h TYR 195 N 0.35 -0.05 0.23 0.92 3.20 -1.16 -1.59 116.97 118.86 3iop h TYR 195 Ca 0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 3iop h TYR 195 Cb -0.00 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.31 3iop h TYR 195 CO -0.08 -0.04 -0.11 1.25 -1.64 0.00 0.00 178.16 177.54 3iop h LEU 196 N -0.00 -0.26 -1.44 2.82 7.12 -0.72 -2.75 115.31 120.08 3iop h LEU 196 Ca 0.05 -0.04 -0.06 0.00 0.13 0.00 0.00 57.88 57.96 3iop h LEU 196 Cb 0.07 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.26 3iop h LEU 196 CO -0.10 -0.13 -0.27 0.45 -0.13 0.00 0.00 178.44 178.26 3iop h HIS 197 N -0.36 0.00 0.00 1.25 3.86 -0.48 -2.01 115.15 117.41 3iop h HIS 197 Ca -0.03 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 3iop h HIS 197 Cb 0.28 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.75 3iop h HIS 197 CO -0.05 0.27 -0.05 0.78 0.86 0.00 0.00 177.93 179.75 3iop h GLY 198 N 1.15 0.00 -1.19 2.45 0.00 -1.00 -1.05 103.07 103.43 3iop h GLY 198 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3iop h GLY 198 CO 0.04 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.86 3iop n LYS 199 N -3.33 1.96 -2.59 4.80 5.02 -0.77 -4.95 118.16 118.29 3iop n LYS 199 Ca -0.01 -1.42 -0.09 0.00 -2.02 0.00 0.00 58.31 54.76 3iop n LYS 199 Cb 0.21 -1.45 0.02 0.00 -0.02 0.00 0.00 35.03 33.78 3iop n LYS 199 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3iop n GLY 200 N 1.25 0.18 3.29 0.72 0.00 -0.40 -4.92 105.19 105.32 3iop n GLY 200 Ca 0.17 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 3iop n GLY 200 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iop s ILE 201 N -2.81 2.28 -0.13 -0.61 1.01 -1.11 -0.93 121.20 118.90 3iop s ILE 201 Ca 0.13 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 3iop s ILE 201 Cb -0.06 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 3iop s ILE 201 CO 0.16 0.56 -0.03 -0.63 0.00 0.00 0.00 174.94 175.01 3iop s ILE 202 N 0.00 4.00 -0.04 2.92 1.01 0.37 -3.82 121.20 125.64 3iop s ILE 202 Ca -0.08 -0.34 -0.23 0.00 0.00 0.00 0.00 60.65 60.00 3iop s ILE 202 Cb -0.15 -2.72 -0.18 0.00 0.01 0.00 0.00 42.46 39.43 3iop s ILE 202 CO 0.05 0.54 1.02 -0.74 0.00 0.00 0.00 174.94 175.80 3iop h HIS 203 N 6.10 -0.16 0.00 3.97 -0.00 -1.91 0.63 115.15 123.78 3iop h HIS 203 Ca -0.39 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 3iop h HIS 203 Cb 1.19 0.05 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 3iop h HIS 203 CO 0.56 0.31 0.00 0.54 -0.00 0.00 0.00 177.93 179.34 3iop n ARG 204 N -4.91 0.00 -2.71 5.26 1.74 -1.26 -3.40 116.66 111.37 3iop n ARG 204 Ca -0.08 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.94 3iop n ARG 204 Cb 0.27 -2.11 0.06 0.00 -1.02 0.00 0.00 32.46 29.66 3iop n ARG 204 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3iop n ASP 205 N 0.00 0.54 -4.69 0.55 2.03 -1.26 -4.16 116.55 109.56 3iop n ASP 205 Ca 0.00 -2.45 -0.42 0.00 0.52 0.00 0.00 54.79 52.44 3iop n ASP 205 Cb 0.00 -0.10 -0.03 0.00 -0.72 0.00 0.00 41.12 40.27 3iop n ASP 205 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3iop s LEU 206 N -3.40 4.30 -0.02 -2.67 2.96 -1.26 -4.87 118.68 113.72 3iop s LEU 206 Ca 0.24 1.82 -0.29 0.00 -0.22 0.00 0.00 54.13 55.69 3iop s LEU 206 Cb 0.41 -3.56 0.10 0.00 0.50 0.00 0.00 46.19 43.64 3iop s LEU 206 CO -0.02 -0.52 0.84 -1.59 -1.32 0.00 0.00 176.35 173.74 3iop s LYS 207 N 1.84 0.87 0.52 1.98 -2.85 -1.26 -4.88 119.74 115.96 3iop s LYS 207 Ca 0.56 -0.13 0.28 0.00 -1.00 0.00 0.00 55.97 55.67 3iop s LYS 207 Cb -0.25 0.41 1.40 0.00 -2.06 0.00 0.00 37.83 37.33 3iop s LYS 207 CO 0.24 -0.34 1.90 -1.35 0.10 0.00 0.00 175.35 175.90 3iop h PRO 208 N 2.29 0.07 0.00 1.78 0.11 -1.94 0.52 132.00 134.82 3iop h PRO 208 Ca -0.24 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3iop h PRO 208 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3iop h PRO 208 CO 0.33 0.04 0.00 1.05 -0.21 0.00 0.00 178.00 179.22 3iop h GLU 209 N 0.07 0.00 -0.00 1.05 4.11 -1.95 -2.73 114.58 115.13 3iop h GLU 209 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 3iop h GLU 209 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 3iop h GLU 209 CO -0.03 0.00 -0.60 0.09 0.07 0.00 0.00 179.01 178.53 3iop n ASN 210 N -3.04 0.67 -4.37 3.06 3.02 0.14 -4.73 115.26 110.00 3iop n ASN 210 Ca 0.02 -0.48 -0.44 0.00 -0.03 0.00 0.00 54.58 53.65 3iop n ASN 210 Cb 0.41 0.42 -0.08 0.00 -0.61 0.00 0.00 39.78 39.93 3iop n ASN 210 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3iop s ILE 211 N -2.96 5.12 0.62 2.41 1.01 -1.00 -1.29 121.20 125.10 3iop s ILE 211 Ca 0.11 -1.12 0.01 0.00 0.00 0.00 0.00 60.65 59.65 3iop s ILE 211 Cb 0.17 -4.08 0.07 0.00 0.01 0.00 0.00 42.46 38.64 3iop s ILE 211 CO 0.73 -0.58 0.86 -0.76 0.00 0.00 0.00 174.94 175.18 3iop s LEU 212 N 1.62 3.15 -0.07 2.97 1.43 0.33 -0.63 118.68 127.47 3iop s LEU 212 Ca 0.04 -0.16 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3iop s LEU 212 Cb -0.24 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.48 3iop s LEU 212 CO 0.06 -1.42 -0.08 -0.76 0.23 0.00 0.00 176.35 174.38 3iop s LEU 213 N -4.90 1.41 0.99 1.79 1.43 0.61 -0.55 118.68 119.46 3iop s LEU 213 Ca 0.61 -0.24 -0.16 0.00 -1.03 0.00 0.00 54.13 53.30 3iop s LEU 213 Cb -0.08 -0.70 0.21 0.00 0.03 0.00 0.00 46.19 45.64 3iop s LEU 213 CO 0.41 -0.03 1.29 0.54 0.23 0.00 0.00 176.35 178.79 3iop s ASN 214 N 1.02 2.82 0.45 2.29 4.22 -0.48 -1.29 114.94 123.97 3iop s ASN 214 Ca -0.09 0.32 0.20 0.00 -2.14 0.00 0.00 52.86 51.15 3iop s ASN 214 Cb -0.15 -0.39 1.17 0.00 1.28 0.00 0.00 41.25 43.16 3iop s ASN 214 CO -0.00 -2.92 1.91 -0.08 -2.04 0.00 0.00 177.10 173.97 3iop h GLU 215 N -1.77 0.29 -0.07 3.55 4.81 -1.90 0.82 114.58 120.32 3iop h GLU 215 Ca -0.44 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3iop h GLU 215 Cb 1.24 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.56 3iop h GLU 215 CO 0.38 0.19 0.00 -0.25 -0.73 0.00 0.00 179.01 178.60 3iop n ASP 216 N -4.45 1.00 -1.05 1.04 10.43 -1.26 -4.93 116.55 117.34 3iop n ASP 216 Ca 0.16 -1.49 -0.13 0.00 2.57 0.00 0.00 54.79 55.90 3iop n ASP 216 Cb 0.64 -0.04 -0.04 0.00 1.84 0.00 0.00 41.12 43.52 3iop n ASP 216 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 3iop n MET 217 N -0.16 -0.90 -3.34 -1.24 2.81 0.28 -4.70 117.12 109.88 3iop n MET 217 Ca 0.17 0.88 -0.30 0.00 -1.81 0.00 0.00 57.70 56.64 3iop n MET 217 Cb 0.24 -4.94 -0.04 0.00 -0.71 0.00 0.00 33.22 27.78 3iop n MET 217 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 3iop s HIS 218 N -2.50 3.46 0.52 2.03 3.76 -1.26 -4.82 115.29 116.49 3iop s HIS 218 Ca 0.00 0.72 -0.20 0.00 -0.15 0.00 0.00 55.06 55.43 3iop s HIS 218 Cb 0.00 -2.16 -0.07 0.00 1.11 0.00 0.00 32.58 31.46 3iop s HIS 218 CO 0.00 0.19 1.10 0.96 -0.85 0.00 0.00 174.74 176.14 3iop s ILE 219 N -2.02 3.39 -0.20 0.60 -4.36 -1.26 -1.38 121.20 115.97 3iop s ILE 219 Ca 0.45 0.87 -0.05 0.00 -0.26 0.00 0.00 60.65 61.66 3iop s ILE 219 Cb -0.11 -3.35 0.07 0.00 1.25 0.00 0.00 42.46 40.32 3iop s ILE 219 CO 0.28 -0.19 0.10 -1.10 0.24 0.00 0.00 174.94 174.27 3iop s GLN 220 N -3.26 0.12 -0.05 0.37 -0.21 0.29 -4.28 119.66 112.63 3iop s GLN 220 Ca 0.71 -0.22 -0.26 0.00 0.02 0.00 0.00 55.36 55.61 3iop s GLN 220 Cb -0.21 -1.66 -0.03 0.00 1.00 0.00 0.00 33.01 32.10 3iop s GLN 220 CO 0.24 -0.76 0.83 0.42 -2.12 0.00 0.00 175.29 173.90 3iop s ILE 221 N 2.12 4.96 0.00 1.08 1.01 -0.18 -0.51 121.20 129.67 3iop s ILE 221 Ca 0.04 1.72 0.00 0.00 0.00 0.00 0.00 60.65 62.41 3iop s ILE 221 Cb -0.16 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.14 3iop s ILE 221 CO -0.16 0.19 0.00 1.07 0.00 0.00 0.00 174.94 176.04 3iop n THR 222 N 3.91 0.00 -2.91 2.92 5.66 -0.41 -1.47 114.28 121.98 3iop n THR 222 Ca 0.02 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.91 3iop n THR 222 Cb 0.51 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.30 3iop n THR 222 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3iop n ASP 223 N -0.91 -7.74 -1.55 1.09 2.03 -1.26 -4.88 116.55 103.32 3iop n ASP 223 Ca 0.00 0.48 -0.00 0.00 0.52 0.00 0.00 54.79 55.79 3iop n ASP 223 Cb 0.00 -5.05 0.29 0.00 -0.72 0.00 0.00 41.12 35.64 3iop n ASP 223 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3iop n PHE 224 N -0.28 1.80 0.61 -0.67 3.72 -1.26 -4.60 117.46 116.78 3iop n PHE 224 Ca 0.10 -1.12 0.10 0.00 -0.05 0.00 0.00 57.45 56.48 3iop n PHE 224 Cb 0.48 -0.54 0.43 0.00 -0.94 0.00 0.00 39.48 38.90 3iop n PHE 224 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iop n GLY 225 N -0.33 -1.23 0.26 1.37 0.00 -1.26 -2.83 105.19 101.17 3iop n GLY 225 Ca 0.33 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.37 3iop n GLY 225 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iop n THR 226 N -1.71 1.00 -1.74 2.61 -2.24 -1.26 -4.77 114.28 106.17 3iop n THR 226 Ca 0.04 -1.20 -0.33 0.00 -2.27 0.00 0.00 64.05 60.29 3iop n THR 226 Cb 0.24 0.13 0.05 0.00 -2.10 0.00 0.00 70.33 68.65 3iop n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3iop s ALA 227 N -1.51 2.43 -0.08 6.98 0.00 -1.13 -4.63 121.76 123.81 3iop s ALA 227 Ca 0.17 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.79 3iop s ALA 227 Cb 0.14 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.92 3iop s ALA 227 CO 0.02 -1.34 -0.21 0.21 0.00 0.00 0.00 175.76 174.44 3iop s LYS 228 N -4.01 2.57 -0.28 0.00 2.47 0.21 -4.95 119.74 115.76 3iop s LYS 228 Ca 0.69 -0.76 -0.10 0.00 -1.56 0.00 0.00 55.97 54.24 3iop s LYS 228 Cb -0.22 -2.02 -0.04 0.00 -1.46 0.00 0.00 37.83 34.09 3iop s LYS 228 CO 0.41 0.18 0.16 0.08 0.16 0.00 0.00 175.35 176.34 3iop s VAL 229 N 0.31 5.05 0.14 4.02 1.01 -1.26 -0.48 120.40 129.20 3iop s VAL 229 Ca -0.14 0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.66 3iop s VAL 229 Cb -0.16 -3.41 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 3iop s VAL 229 CO 0.06 0.26 0.73 -0.76 0.00 0.00 0.00 175.10 175.40 3iop s LEU 230 N 1.72 4.57 0.54 3.92 1.43 -0.11 -5.03 118.68 125.72 3iop s LEU 230 Ca 0.07 1.55 0.33 0.00 -1.03 0.00 0.00 54.13 55.05 3iop s LEU 230 Cb -0.16 -3.21 1.25 0.00 0.03 0.00 0.00 46.19 44.10 3iop s LEU 230 CO 0.09 0.21 1.94 -1.28 0.23 0.00 0.00 176.35 177.54 3iop h SER 231 N 4.48 0.00 0.00 2.29 0.87 -1.98 -3.47 113.55 115.73 3iop h SER 231 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 3iop h SER 231 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 3iop h SER 231 CO 0.66 0.00 0.00 0.33 -0.53 0.00 0.00 176.83 177.29 3iop n PHE 242 N -3.09 0.00 -1.76 2.24 7.35 -1.26 -5.11 117.46 115.83 3iop n PHE 242 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 3iop n PHE 242 Cb 0.33 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.16 3iop n PHE 242 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3iop n VAL 243 N 0.00 -9.71 0.00 -2.13 0.31 -1.26 -5.09 118.33 100.45 3iop n VAL 243 Ca 0.00 2.19 0.00 0.00 -0.01 0.00 0.00 64.34 66.52 3iop n VAL 243 Cb 0.00 -4.81 0.00 0.00 -0.91 0.00 0.00 33.84 28.12 3iop n VAL 243 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3iop n GLY 244 N 1.24 -0.22 3.72 2.92 0.00 -1.26 -4.98 105.19 106.61 3iop n GLY 244 Ca 0.00 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 3iop n GLY 244 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iop s THR 245 N 0.00 5.34 0.23 2.61 2.01 -1.26 -5.00 115.64 119.57 3iop s THR 245 Ca 0.00 0.41 -0.13 0.00 0.31 0.00 0.00 61.69 62.28 3iop s THR 245 Cb 0.00 -3.57 0.29 0.00 0.01 0.00 0.00 72.50 69.23 3iop s THR 245 CO 0.00 0.40 1.59 0.00 -0.69 0.00 0.00 174.62 175.92 3iop h ALA 246 N 6.76 0.41 0.00 7.40 0.00 -1.97 0.08 119.26 131.94 3iop h ALA 246 Ca -0.41 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3iop h ALA 246 Cb 1.16 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.61 3iop h ALA 246 CO 0.75 -0.46 0.00 1.96 0.00 0.00 0.00 179.25 181.50 3iop h GLN 247 N -0.03 0.00 -0.03 0.00 7.50 -1.95 -2.84 115.11 117.77 3iop h GLN 247 Ca 0.35 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.50 3iop h GLN 247 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.11 3iop h GLN 247 CO -0.81 0.00 0.00 0.66 -1.50 0.00 0.00 178.83 177.18 3iop n TYR 248 N -2.86 0.03 -2.08 2.96 4.02 -0.04 -4.69 117.16 114.50 3iop n TYR 248 Ca -0.01 -0.13 -0.42 0.00 -0.01 0.00 0.00 57.90 57.33 3iop n TYR 248 Cb 0.14 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.43 3iop n TYR 248 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3iop s VAL 249 N -0.45 2.89 0.44 -0.72 1.01 -0.87 -4.34 120.40 118.37 3iop s VAL 249 Ca 0.04 0.72 -0.14 0.00 0.00 0.00 0.00 61.98 62.60 3iop s VAL 249 Cb 0.03 -3.46 -0.08 0.00 0.00 0.00 0.00 36.38 32.87 3iop s VAL 249 CO 0.04 0.10 0.87 -0.94 0.00 0.00 0.00 175.10 175.17 3iop s SER 250 N 0.53 6.63 0.29 3.32 1.04 -1.26 -5.00 113.70 119.24 3iop s SER 250 Ca 0.60 1.38 -0.02 0.00 0.48 0.00 0.00 55.95 58.39 3iop s SER 250 Cb -0.40 -2.42 0.43 0.00 0.10 0.00 0.00 66.02 63.73 3iop s SER 250 CO 0.39 -0.45 1.95 -0.65 0.98 0.00 0.00 173.24 175.46 3iop h PRO 251 N 1.28 1.11 -0.06 4.02 0.11 -1.88 -2.70 132.00 133.88 3iop h PRO 251 Ca -0.47 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 3iop h PRO 251 Cb 1.18 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3iop h PRO 251 CO 0.63 0.73 -0.06 1.05 -0.21 0.00 0.00 178.00 180.14 3iop h GLU 252 N 1.14 0.09 0.00 1.05 9.09 -1.89 -0.63 114.58 123.43 3iop h GLU 252 Ca 0.33 -0.01 -0.08 0.00 0.05 0.00 0.00 59.36 59.65 3iop h GLU 252 Cb -0.08 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 26.99 3iop h GLU 252 CO -0.08 0.15 -0.39 1.25 0.05 0.00 0.00 179.01 179.99 3iop h LEU 253 N 0.09 0.00 0.00 3.06 5.85 -1.56 0.36 115.31 123.10 3iop h LEU 253 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3iop h LEU 253 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3iop h LEU 253 CO 0.01 0.39 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.93 3iop h LEU 254 N 0.00 0.00 0.00 2.25 3.38 -1.17 -3.18 115.31 116.60 3iop h LEU 254 Ca -0.00 -0.07 -0.31 0.00 0.09 0.00 0.00 57.88 57.58 3iop h LEU 254 Cb 0.75 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 3iop h LEU 254 CO 0.05 0.03 -2.01 0.41 0.09 0.00 0.00 178.44 177.01 3iop n THR 255 N -2.53 1.21 0.52 0.22 -1.04 -0.67 -4.78 114.28 107.22 3iop n THR 255 Ca 0.03 -0.23 0.06 0.00 -2.04 0.00 0.00 64.05 61.86 3iop n THR 255 Cb 0.49 -1.84 0.02 0.00 -1.82 0.00 0.00 70.33 67.18 3iop n THR 255 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3iop n GLU 256 N -4.00 1.49 -1.12 -2.82 1.02 0.12 -4.97 120.64 110.38 3iop n GLU 256 Ca -0.38 -0.88 -0.04 0.00 -0.02 0.00 0.00 57.16 55.83 3iop n GLU 256 Cb 0.75 -1.18 -0.02 0.00 -0.02 0.00 0.00 31.44 30.97 3iop n GLU 256 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3iop n LYS 257 N 0.13 -1.89 -3.92 3.49 4.81 -1.08 -4.96 118.16 114.74 3iop n LYS 257 Ca 0.06 0.64 -0.33 0.00 -0.87 0.00 0.00 58.31 57.81 3iop n LYS 257 Cb 0.27 -5.11 -0.05 0.00 0.02 0.00 0.00 35.03 30.16 3iop n LYS 257 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 3iop s SER 258 N -2.15 6.32 -0.03 3.14 1.04 -1.25 -4.85 113.70 115.93 3iop s SER 258 Ca 0.00 0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.81 3iop s SER 258 Cb 0.00 -1.97 -0.01 0.00 0.10 0.00 0.00 66.02 64.13 3iop s SER 258 CO 0.00 0.25 -0.21 0.00 0.98 0.00 0.00 173.24 174.26 3iop s ALA 259 N -1.34 1.76 0.27 5.32 0.00 -1.26 -3.73 121.76 122.78 3iop s ALA 259 Ca 0.28 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.41 3iop s ALA 259 Cb -0.13 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 3iop s ALA 259 CO 0.20 0.40 0.21 0.00 0.00 0.00 0.00 175.76 176.57 3iop h LYS 261 N 0.00 0.35 0.00 0.00 1.57 -1.99 -1.99 116.57 114.51 3iop h LYS 261 Ca -0.19 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3iop h LYS 261 Cb 0.96 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.19 3iop h LYS 261 CO 0.29 0.26 -0.00 1.03 -0.57 0.00 0.00 179.45 180.45 3iop h SER 262 N 0.36 0.00 -0.33 0.86 0.87 -1.96 -2.44 113.55 110.91 3iop h SER 262 Ca 0.09 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.53 3iop h SER 262 Cb 0.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 3iop h SER 262 CO -0.02 0.00 -0.23 0.28 -0.53 0.00 0.00 176.83 176.34 3iop h SER 263 N 0.00 0.83 -0.13 6.23 0.02 -1.73 -0.90 113.55 117.87 3iop h SER 263 Ca -0.00 -0.31 -0.09 0.00 -0.84 0.00 0.00 61.79 60.56 3iop h SER 263 Cb 0.27 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3iop h SER 263 CO 0.00 1.03 -0.18 0.44 -1.14 0.00 0.00 176.83 176.98 3iop h ASP 264 N 0.71 0.52 0.06 3.07 3.32 -1.57 -2.58 116.42 119.95 3iop h ASP 264 Ca 0.10 -0.16 -0.15 0.00 0.02 0.00 0.00 57.03 56.84 3iop h ASP 264 Cb 0.75 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 3iop h ASP 264 CO 0.06 0.72 -0.50 -0.07 -1.72 0.00 0.00 179.24 177.72 3iop h LEU 265 N 0.48 0.55 -0.18 1.55 3.38 -1.39 0.75 115.31 120.45 3iop h LEU 265 Ca 0.08 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.79 3iop h LEU 265 Cb 0.59 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3iop h LEU 265 CO 0.04 0.96 0.07 -0.25 0.09 0.00 0.00 178.44 179.35 3iop h TRP 266 N 0.40 0.13 -0.80 1.13 2.91 -1.09 -1.86 115.95 116.76 3iop h TRP 266 Ca 0.02 0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.10 3iop h TRP 266 Cb 1.02 -0.03 -0.06 0.00 -0.51 0.00 0.00 29.16 29.58 3iop h TRP 266 CO 0.04 0.07 0.49 0.00 -1.03 0.00 0.00 178.44 178.01 3iop h ALA 267 N 1.10 1.09 -0.61 2.65 0.00 -1.10 -1.54 119.26 120.86 3iop h ALA 267 Ca 0.07 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.07 3iop h ALA 267 Cb 0.04 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.53 3iop h ALA 267 CO -0.07 0.24 0.22 1.25 0.00 0.00 0.00 179.25 180.89 3iop h LEU 268 N 0.91 0.21 -1.19 0.00 5.85 -0.59 -0.65 115.31 119.86 3iop h LEU 268 Ca 0.35 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.15 3iop h LEU 268 Cb 0.14 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3iop h LEU 268 CO -0.16 0.12 0.49 1.23 -0.34 0.00 0.00 178.44 179.78 3iop h GLY 269 N 0.40 1.11 1.18 3.75 0.00 -0.46 -0.19 103.07 108.85 3iop h GLY 269 Ca 0.31 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 47.09 3iop h GLY 269 CO -0.31 0.42 -0.13 0.00 0.00 0.00 0.00 176.54 176.52 3iop h ILE 271 N 0.85 1.29 -0.30 0.00 2.04 -0.51 -0.78 117.51 120.10 3iop h ILE 271 Ca 0.13 -1.09 0.02 0.00 1.00 0.00 0.00 64.86 64.92 3iop h ILE 271 Cb 0.68 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 3iop h ILE 271 CO 0.05 0.34 0.15 0.40 0.00 0.00 0.00 178.15 179.09 3iop h ILE 272 N 0.22 1.00 -0.40 -0.67 2.04 -1.09 0.62 117.51 119.22 3iop h ILE 272 Ca 0.06 -0.11 0.07 0.00 1.00 0.00 0.00 64.86 65.88 3iop h ILE 272 Cb 0.54 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 3iop h ILE 272 CO 0.03 0.06 0.05 0.22 0.00 0.00 0.00 178.15 178.51 3iop h TYR 273 N 0.32 0.08 -0.73 1.37 3.20 -1.39 -2.12 116.97 117.71 3iop h TYR 273 Ca 0.12 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 3iop h TYR 273 Cb 0.03 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 3iop h TYR 273 CO -0.09 -0.02 0.35 0.37 -1.64 0.00 0.00 178.16 177.12 3iop h GLN 274 N 0.17 1.04 -0.74 1.82 4.15 -0.62 0.27 115.11 121.20 3iop h GLN 274 Ca 0.20 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 3iop h GLN 274 Cb 0.25 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.72 3iop h GLN 274 CO -0.28 0.80 0.27 -0.07 -1.93 0.00 0.00 178.83 177.62 3iop h LEU 275 N 1.03 1.04 0.13 -2.39 3.38 -0.47 0.15 115.31 118.19 3iop h LEU 275 Ca 0.25 -0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.83 3iop h LEU 275 Cb 0.11 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.60 3iop h LEU 275 CO -0.03 0.95 -1.02 0.58 0.09 0.00 0.00 178.44 179.01 3iop h VAL 276 N 1.09 1.35 0.00 1.22 2.07 -1.03 0.58 116.25 121.53 3iop h VAL 276 Ca 0.24 -2.49 -0.16 0.00 0.82 0.00 0.00 66.70 65.11 3iop h VAL 276 Cb 0.25 3.04 -0.03 0.00 -1.52 0.00 0.00 31.29 33.03 3iop h VAL 276 CO -0.01 0.71 -1.32 0.00 0.02 0.00 0.00 177.57 176.96 3iop h ALA 277 N 0.03 0.65 0.00 1.67 0.00 -0.52 -3.43 119.26 117.67 3iop h ALA 277 Ca -0.20 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 53.90 3iop h ALA 277 Cb 1.68 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.71 3iop h ALA 277 CO 0.12 0.90 0.00 0.41 0.00 0.00 0.00 179.25 180.68 3iop n GLY 278 N 1.38 2.81 3.06 0.00 0.00 0.53 -4.90 105.19 108.07 3iop n GLY 278 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 3iop n GLY 278 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iop s LEU 279 N 0.00 2.31 0.67 0.99 1.43 -1.23 -4.90 118.68 117.95 3iop s LEU 279 Ca 0.00 -0.64 -0.16 0.00 -1.03 0.00 0.00 54.13 52.29 3iop s LEU 279 Cb 0.00 -0.07 0.01 0.00 0.03 0.00 0.00 46.19 46.15 3iop s LEU 279 CO 0.00 -0.29 1.19 -2.16 0.23 0.00 0.00 176.35 175.32 3iop s PRO 280 N -2.08 2.55 0.21 1.29 0.04 -1.26 -3.62 135.00 132.13 3iop s PRO 280 Ca -0.07 1.73 -0.06 0.00 0.04 0.00 0.00 61.00 62.64 3iop s PRO 280 Cb -0.06 -1.89 0.18 0.00 0.04 0.00 0.00 34.50 32.77 3iop s PRO 280 CO -0.01 -1.51 1.69 -1.00 0.04 0.00 0.00 177.00 176.20 3iop h PRO 281 N 0.19 0.95 -4.52 0.56 0.13 -1.89 -3.41 132.00 124.01 3iop h PRO 281 Ca -0.49 -0.29 -0.72 0.00 -0.87 0.00 0.00 66.00 63.64 3iop h PRO 281 Cb 1.29 -0.09 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 3iop h PRO 281 CO 0.52 0.95 -0.47 -0.06 -0.23 0.00 0.00 178.00 178.72 3iop s PHE 282 N -4.98 3.25 -0.02 1.56 0.08 -1.26 -4.69 117.98 111.92 3iop s PHE 282 Ca -0.11 -0.92 0.03 0.00 0.12 0.00 0.00 56.93 56.05 3iop s PHE 282 Cb 0.14 -2.61 0.00 0.00 -0.57 0.00 0.00 43.02 39.98 3iop s PHE 282 CO 0.84 -0.67 -0.10 1.03 -0.10 0.00 0.00 175.22 176.22 3iop s ARG 283 N 1.58 0.99 0.26 0.44 0.52 -1.26 -4.80 118.95 116.69 3iop s ARG 283 Ca 0.03 -0.34 -0.21 0.00 -0.52 0.00 0.00 55.73 54.68 3iop s ARG 283 Cb -0.20 -0.92 0.03 0.00 0.52 0.00 0.00 34.95 34.38 3iop s ARG 283 CO 0.07 0.15 0.78 0.00 0.02 0.00 0.00 175.30 176.32 3iop s ALA 284 N 0.08 -1.28 0.46 2.13 0.00 -1.26 -4.91 121.76 116.98 3iop s ALA 284 Ca -0.01 -0.26 0.13 0.00 0.00 0.00 0.00 51.96 51.82 3iop s ALA 284 Cb -0.08 0.80 1.05 0.00 0.00 0.00 0.00 23.12 24.89 3iop s ALA 284 CO 0.00 -1.04 2.07 0.78 0.00 0.00 0.00 175.76 177.57 3iop h GLY 285 N 2.00 0.18 -1.88 0.00 0.00 -2.01 -3.46 103.07 97.91 3iop h GLY 285 Ca -0.21 -0.08 -0.29 0.00 0.00 0.00 0.00 47.33 46.75 3iop h GLY 285 CO 0.25 0.08 -0.29 0.54 0.00 0.00 0.00 176.54 177.12 3iop s ASN 286 N -6.94 0.91 0.09 0.19 2.20 -1.26 -5.07 114.94 105.06 3iop s ASN 286 Ca -0.06 -1.48 -0.19 0.00 -0.94 0.00 0.00 52.86 50.19 3iop s ASN 286 Cb 0.17 0.61 -0.07 0.00 -2.00 0.00 0.00 41.25 39.95 3iop s ASN 286 CO 0.70 -1.19 1.58 -0.33 -2.94 0.00 0.00 177.10 174.91 3iop h GLU 287 N 2.18 0.42 -0.61 3.55 5.08 -1.99 -2.25 114.58 120.95 3iop h GLU 287 Ca -0.28 -0.11 0.10 0.00 -1.00 0.00 0.00 59.36 58.07 3iop h GLU 287 Cb 1.24 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.36 3iop h GLU 287 CO 0.39 0.53 0.21 -0.92 -1.00 0.00 0.00 179.01 178.22 3iop h TYR 288 N 0.24 0.35 -0.02 4.33 3.20 -1.99 0.11 116.97 123.20 3iop h TYR 288 Ca 0.08 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.90 3iop h TYR 288 Cb 0.31 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 3iop h TYR 288 CO 0.02 0.07 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.16 3iop h LEU 289 N 0.37 0.04 -0.14 2.82 3.38 -1.94 -0.96 115.31 118.89 3iop h LEU 289 Ca 0.31 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.22 3iop h LEU 289 Cb 0.41 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3iop h LEU 289 CO -0.33 0.42 -0.10 0.40 0.09 0.00 0.00 178.44 178.92 3iop h ILE 290 N 0.04 1.33 -0.73 1.22 2.04 -0.67 -2.75 117.51 117.99 3iop h ILE 290 Ca 0.00 -1.20 -0.00 0.00 1.00 0.00 0.00 64.86 64.66 3iop h ILE 290 Cb 0.69 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.54 3iop h ILE 290 CO 0.05 0.35 0.44 -0.26 0.00 0.00 0.00 178.15 178.73 3iop h PHE 291 N -0.03 0.95 -0.50 1.37 0.05 -0.57 -1.36 116.94 116.85 3iop h PHE 291 Ca 0.03 0.00 0.04 0.00 3.82 0.00 0.00 57.97 61.86 3iop h PHE 291 Cb 0.60 -0.31 -0.04 0.00 2.00 0.00 0.00 35.95 38.19 3iop h PHE 291 CO 0.07 0.63 0.27 1.96 -0.18 0.00 0.00 178.31 181.07 3iop h GLN 292 N 1.00 0.51 -0.26 1.51 4.20 -1.18 -2.72 115.11 118.17 3iop h GLN 292 Ca 0.26 -0.03 -0.12 0.00 0.06 0.00 0.00 58.65 58.83 3iop h GLN 292 Cb -0.04 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 3iop h GLN 292 CO -0.05 0.34 -0.32 0.87 -0.67 0.00 0.00 178.83 179.00 3iop h LYS 293 N 0.53 0.56 0.32 1.46 1.57 -1.07 -2.93 116.57 117.00 3iop h LYS 293 Ca 0.21 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3iop h LYS 293 Cb 0.09 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3iop h LYS 293 CO -0.13 0.81 -0.15 0.82 -0.57 0.00 0.00 179.45 180.22 3iop h ILE 294 N 0.48 0.70 0.00 1.86 2.04 -1.13 0.27 117.51 121.73 3iop h ILE 294 Ca 0.06 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.72 3iop h ILE 294 Cb 0.79 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 3iop h ILE 294 CO 0.06 0.04 0.00 0.16 0.00 0.00 0.00 178.15 178.42 3iop h ILE 295 N -0.54 0.00 -0.01 -0.67 3.07 -1.52 -1.89 117.51 115.95 3iop h ILE 295 Ca -0.04 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 65.99 3iop h ILE 295 Cb 0.40 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 38.31 3iop h ILE 295 CO 0.07 0.00 -0.45 0.29 -1.05 0.00 0.00 178.15 177.01 3iop n LYS 296 N -3.06 0.89 -3.69 0.16 5.02 -1.11 -4.97 118.16 111.40 3iop n LYS 296 Ca -0.00 -0.66 -0.23 0.00 -2.02 0.00 0.00 58.31 55.40 3iop n LYS 296 Cb 0.24 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.81 3iop n LYS 296 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3iop n LEU 297 N -0.48 -3.18 -4.39 -0.35 7.94 -0.59 -4.93 117.00 111.02 3iop n LEU 297 Ca 0.10 -0.75 -0.45 0.00 -1.11 0.00 0.00 56.01 53.79 3iop n LEU 297 Cb 0.40 -2.75 -0.02 0.00 0.53 0.00 0.00 43.42 41.58 3iop n LEU 297 CO 0.29 0.44 0.76 -0.70 -1.11 0.00 0.00 177.39 177.07 3iop s GLU 298 N -6.03 3.67 0.13 1.96 2.12 0.84 -4.96 118.70 116.42 3iop s GLU 298 Ca 0.19 -2.19 -0.19 0.00 0.36 0.00 0.00 54.97 53.13 3iop s GLU 298 Cb -0.09 -4.70 0.05 0.00 0.26 0.00 0.00 34.13 29.65 3iop s GLU 298 CO 0.79 -1.54 0.49 1.52 -0.54 0.00 0.00 175.26 175.98 3iop s TYR 299 N 1.32 -0.35 0.06 5.30 -0.85 -1.26 -4.81 117.35 116.76 3iop s TYR 299 Ca 0.27 0.11 0.05 0.00 -0.52 0.00 0.00 57.07 56.98 3iop s TYR 299 Cb -0.07 0.38 -0.03 0.00 0.38 0.00 0.00 41.96 42.62 3iop s TYR 299 CO -0.09 -0.75 -0.13 -0.51 -1.52 0.00 0.00 175.55 172.55 3iop s ASP 300 N -2.69 1.55 0.05 -0.18 1.01 -1.26 -5.14 116.67 110.00 3iop s ASP 300 Ca 0.01 -0.55 -0.18 0.00 0.71 0.00 0.00 52.55 52.54 3iop s ASP 300 Cb 0.01 -0.06 -0.06 0.00 1.01 0.00 0.00 42.92 43.82 3iop s ASP 300 CO -0.11 -0.05 0.53 -0.36 0.21 0.00 0.00 175.17 175.39 3iop s PHE 301 N -1.12 3.77 0.76 4.23 0.08 -1.26 -5.05 117.98 119.39 3iop s PHE 301 Ca -0.02 1.20 -0.12 0.00 0.12 0.00 0.00 56.93 58.11 3iop s PHE 301 Cb -0.09 -2.46 0.05 0.00 -0.57 0.00 0.00 43.02 39.95 3iop s PHE 301 CO 0.02 0.57 1.12 -2.14 -0.10 0.00 0.00 175.22 174.68 3iop s PRO 302 N -0.97 2.20 0.38 0.24 0.02 -1.26 -4.95 135.00 130.66 3iop s PRO 302 Ca 0.28 1.35 0.15 0.00 0.02 0.00 0.00 61.00 62.80 3iop s PRO 302 Cb -0.19 -1.88 0.76 0.00 0.02 0.00 0.00 34.50 33.22 3iop s PRO 302 CO 0.17 -1.71 1.83 1.49 -0.33 0.00 0.00 177.00 178.45 3iop h GLU 303 N -0.83 0.00 0.00 5.54 4.57 -2.05 -2.93 114.58 118.88 3iop h GLU 303 Ca -0.45 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.72 3iop h GLU 303 Cb 1.25 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3iop h GLU 303 CO 0.50 0.36 -0.07 1.57 -1.18 0.00 0.00 179.01 180.20 3iop h LYS 304 N 0.00 0.00 -6.07 1.92 2.10 -2.01 -3.47 116.57 109.04 3iop h LYS 304 Ca -0.00 0.00 -0.81 0.00 -2.00 0.00 0.00 60.65 57.84 3iop h LYS 304 Cb 0.68 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.03 3iop h LYS 304 CO 0.05 0.07 0.66 0.34 -2.00 0.00 0.00 179.45 178.57 3iop n PHE 305 N -3.14 1.70 -1.70 0.07 7.35 -1.11 -4.77 117.46 115.85 3iop n PHE 305 Ca 0.02 0.91 -0.56 0.00 -0.76 0.00 0.00 57.45 57.06 3iop n PHE 305 Cb 0.45 -2.29 -0.07 0.00 0.35 0.00 0.00 39.48 37.92 3iop n PHE 305 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3iop n PHE 306 N 4.03 2.07 -0.22 -5.13 0.99 -1.26 -4.79 117.46 113.16 3iop n PHE 306 Ca 0.27 0.47 0.03 0.00 -0.00 0.00 0.00 57.45 58.22 3iop n PHE 306 Cb 0.03 -2.48 0.13 0.00 -1.00 0.00 0.00 39.48 36.16 3iop n PHE 306 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 3iop h PRO 307 N 7.38 0.20 -0.10 -1.08 0.11 -1.96 0.10 132.00 136.66 3iop h PRO 307 Ca -0.47 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.47 3iop h PRO 307 Cb 1.31 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 3iop h PRO 307 CO 0.95 0.13 -0.64 0.87 -0.21 0.00 0.00 178.00 179.11 3iop h LYS 308 N 0.21 0.36 -0.56 1.05 1.57 -1.98 -1.82 116.57 115.40 3iop h LYS 308 Ca 0.36 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 3iop h LYS 308 Cb 0.58 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 3iop h LYS 308 CO -0.49 0.88 0.26 0.00 -0.57 0.00 0.00 179.45 179.53 3iop h ALA 309 N 1.05 0.72 -0.42 3.86 0.00 -1.68 -2.19 119.26 120.61 3iop h ALA 309 Ca -0.01 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.79 3iop h ALA 309 Cb 1.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3iop h ALA 309 CO 0.11 0.30 0.22 -0.09 0.00 0.00 0.00 179.25 179.78 3iop h ARG 310 N 0.76 0.42 -0.56 0.00 2.43 -0.62 -1.22 114.38 115.60 3iop h ARG 310 Ca 0.19 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.39 3iop h ARG 310 Cb 0.13 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.54 3iop h ARG 310 CO -0.02 0.28 0.29 0.22 -1.51 0.00 0.00 179.97 179.23 3iop h ASP 311 N 0.44 0.42 -0.23 -3.80 3.58 -1.18 -0.15 116.42 115.49 3iop h ASP 311 Ca 0.18 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.66 3iop h ASP 311 Cb 0.07 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 3iop h ASP 311 CO -0.12 0.28 0.15 0.25 -2.88 0.00 0.00 179.24 176.92 3iop h LEU 312 N 0.55 0.26 -0.55 2.28 5.85 -1.09 -2.45 115.31 120.17 3iop h LEU 312 Ca 0.25 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.97 3iop h LEU 312 Cb 0.15 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3iop h LEU 312 CO -0.17 0.20 0.35 0.58 -0.34 0.00 0.00 178.44 179.06 3iop h VAL 313 N 0.31 1.12 0.00 1.05 2.07 -0.86 -1.70 116.25 118.24 3iop h VAL 313 Ca 0.08 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 3iop h VAL 313 Cb -0.03 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3iop h VAL 313 CO -0.02 0.13 -0.02 -0.33 0.02 0.00 0.00 177.57 177.35 3iop h GLU 314 N 0.72 0.00 -0.01 1.57 5.08 -0.89 0.36 114.58 121.41 3iop h GLU 314 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3iop h GLU 314 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3iop h GLU 314 CO -0.06 0.02 -0.52 1.63 -1.00 0.00 0.00 179.01 179.08 3iop n LYS 315 N -3.72 0.50 -0.09 2.33 5.02 -0.71 -4.26 118.16 117.22 3iop n LYS 315 Ca -0.03 -0.35 -0.12 0.00 -2.02 0.00 0.00 58.31 55.80 3iop n LYS 315 Cb 0.11 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.54 3iop n LYS 315 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3iop n LEU 316 N -0.95 2.64 -4.13 -0.35 4.77 -0.60 -2.02 117.00 116.37 3iop n LEU 316 Ca 0.08 -0.08 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 3iop n LEU 316 Cb 0.36 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3iop n LEU 316 CO 0.33 0.75 2.10 0.18 -1.33 0.00 0.00 177.39 179.42 3iop n LEU 317 N -2.96 5.99 -4.12 2.23 4.77 0.12 -4.40 117.00 118.63 3iop n LEU 317 Ca -0.31 -4.25 -0.29 0.00 -0.03 0.00 0.00 56.01 51.14 3iop n LEU 317 Cb 0.85 -1.64 -0.17 0.00 -2.33 0.00 0.00 43.42 40.13 3iop n LEU 317 CO 0.19 0.83 -0.52 -0.69 -1.33 0.00 0.00 177.39 175.88 3iop s VAL 318 N 2.58 1.65 0.21 4.08 1.01 -1.26 -4.83 120.40 123.83 3iop s VAL 318 Ca 0.47 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.58 3iop s VAL 318 Cb 0.07 -1.47 0.16 0.00 0.00 0.00 0.00 36.38 35.14 3iop s VAL 318 CO -0.01 0.47 1.88 -0.07 0.00 0.00 0.00 175.10 177.38 3iop h LEU 319 N 7.02 0.87 -8.80 3.92 3.38 -1.95 -3.37 115.31 116.38 3iop h LEU 319 Ca -0.27 -0.02 -0.57 0.00 0.09 0.00 0.00 57.88 57.11 3iop h LEU 319 Cb 1.20 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 3iop h LEU 319 CO 0.48 0.63 1.04 -0.62 0.09 0.00 0.00 178.44 180.07 3iop s ASP 320 N -5.89 6.41 0.38 -0.43 -1.08 -1.26 -4.64 116.67 110.16 3iop s ASP 320 Ca -0.13 0.83 0.27 0.00 -0.52 0.00 0.00 52.55 52.99 3iop s ASP 320 Cb 0.15 -2.54 1.37 0.00 -1.46 0.00 0.00 42.92 40.44 3iop s ASP 320 CO 0.78 -1.37 1.82 0.00 0.52 0.00 0.00 175.17 176.92 3iop h ALA 321 N 10.36 1.00 0.00 3.66 0.00 -1.97 -1.51 119.26 130.81 3iop h ALA 321 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3iop h ALA 321 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3iop h ALA 321 CO 1.09 0.00 0.00 1.15 0.00 0.00 0.00 179.25 181.49 3iop h THR 322 N 0.00 0.00 -0.36 0.00 2.02 -1.92 -3.32 112.91 109.33 3iop h THR 322 Ca 0.00 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.66 3iop h THR 322 Cb 0.11 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 3iop h THR 322 CO 0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 3iop n LYS 323 N -2.36 2.92 -3.21 6.66 4.76 -0.57 -4.28 118.16 122.08 3iop n LYS 323 Ca 0.05 -2.26 -0.39 0.00 -2.87 0.00 0.00 58.31 52.85 3iop n LYS 323 Cb 0.43 -1.41 -0.06 0.00 -1.84 0.00 0.00 35.03 32.15 3iop n LYS 323 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3iop s ARG 324 N -1.37 4.32 0.04 1.97 0.52 -1.25 -4.92 118.95 118.26 3iop s ARG 324 Ca 0.29 0.70 -0.35 0.00 -0.52 0.00 0.00 55.73 55.84 3iop s ARG 324 Cb 0.18 -3.37 -0.14 0.00 0.52 0.00 0.00 34.95 32.14 3iop s ARG 324 CO 0.16 0.30 1.63 1.28 0.02 0.00 0.00 175.30 178.69 3iop n LEU 325 N 2.99 2.87 0.00 2.53 4.77 -0.86 -2.12 117.00 127.19 3iop n LEU 325 Ca -0.06 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 3iop n LEU 325 Cb 0.51 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 3iop n LEU 325 CO 0.44 -0.37 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 3iop n GLY 326 N 3.59 2.30 3.82 -0.72 0.00 -1.21 -4.90 105.19 108.06 3iop n GLY 326 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3iop n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iop h GLU 328 N -0.42 1.19 0.00 0.00 5.08 -1.92 -0.40 114.58 118.11 3iop h GLU 328 Ca -0.44 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3iop h GLU 328 Cb 1.21 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.19 3iop h GLU 328 CO 0.57 0.79 0.00 0.93 -1.00 0.00 0.00 179.01 180.30 3iop h GLU 329 N 1.23 0.00 -0.65 2.33 3.07 -1.93 -1.36 114.58 117.28 3iop h GLU 329 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 3iop h GLU 329 Cb -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 3iop h GLU 329 CO -0.12 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.16 3iop n MET 330 N -2.83 3.24 -1.31 2.33 2.81 -0.32 -4.95 117.12 116.08 3iop n MET 330 Ca 0.00 -2.73 -0.05 0.00 -1.81 0.00 0.00 57.70 53.11 3iop n MET 330 Cb 0.23 -1.71 -0.02 0.00 -0.71 0.00 0.00 33.22 31.02 3iop n MET 330 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3iop n GLU 331 N 1.23 -0.36 0.00 0.03 -0.58 -0.51 -4.75 120.64 115.70 3iop n GLU 331 Ca 0.24 0.60 0.00 0.00 -0.42 0.00 0.00 57.16 57.58 3iop n GLU 331 Cb 0.74 -4.32 0.00 0.00 -0.57 0.00 0.00 31.44 27.29 3iop n GLU 331 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iop n GLY 332 N -2.13 -0.68 0.19 0.62 0.00 -0.31 -4.37 105.19 98.51 3iop n GLY 332 Ca -0.05 -1.34 0.08 0.00 0.00 0.00 0.00 46.02 44.71 3iop n GLY 332 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3iop h TYR 333 N 0.00 0.00 -0.07 1.61 -1.99 -1.88 -3.22 116.97 111.43 3iop h TYR 333 Ca 0.00 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.74 3iop h TYR 333 Cb 0.00 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 3iop h TYR 333 CO 0.00 0.20 -0.25 0.78 -0.00 0.00 0.00 178.16 178.89 3iop h GLY 334 N 3.76 -1.36 0.56 3.88 0.00 -1.94 0.13 103.07 108.10 3iop h GLY 334 Ca -0.00 0.68 0.09 0.00 0.00 0.00 0.00 47.33 48.10 3iop h GLY 334 CO 0.03 -0.42 0.53 -2.55 0.00 0.00 0.00 176.54 174.13 3iop h PRO 335 N -0.26 0.87 -0.02 4.80 0.11 -1.82 -0.67 132.00 135.00 3iop h PRO 335 Ca 0.02 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.09 3iop h PRO 335 Cb 0.31 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 3iop h PRO 335 CO -0.20 0.57 -0.06 1.25 -0.21 0.00 0.00 178.00 179.35 3iop h LEU 336 N 0.89 -0.17 -1.82 2.35 5.85 -1.61 -2.44 115.31 118.36 3iop h LEU 336 Ca 0.42 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.14 3iop h LEU 336 Cb 0.34 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 3iop h LEU 336 CO -0.23 -0.09 -0.13 0.11 -0.34 0.00 0.00 178.44 177.76 3iop h LYS 337 N -0.10 0.00 -0.01 1.25 1.57 -0.35 -2.53 116.57 116.41 3iop h LYS 337 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3iop h LYS 337 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3iop h LYS 337 CO -0.08 0.13 -0.06 0.00 -0.57 0.00 0.00 179.45 178.88 3iop n ALA 338 N -2.27 2.70 -1.75 3.86 0.00 -0.29 -4.74 120.51 118.02 3iop n ALA 338 Ca -0.02 -0.30 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 3iop n ALA 338 Cb 0.26 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.37 3iop n ALA 338 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3iop n HIS 339 N -0.67 2.81 -0.30 0.00 -0.00 -0.96 -4.87 115.22 111.23 3iop n HIS 339 Ca 0.18 0.34 0.35 0.00 -0.00 0.00 0.00 57.72 58.58 3iop n HIS 339 Cb 0.26 -2.56 0.73 0.00 -0.00 0.00 0.00 29.99 28.41 3iop n HIS 339 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3iop h PRO 340 N 4.12 0.00 -0.02 1.57 0.11 -1.91 0.15 132.00 136.02 3iop h PRO 340 Ca -0.48 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 3iop h PRO 340 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3iop h PRO 340 CO 0.74 0.00 -0.11 0.35 -0.21 0.00 0.00 178.00 178.77 3iop h PHE 341 N 0.00 0.03 -0.58 0.65 3.04 -1.90 -2.47 116.94 115.71 3iop h PHE 341 Ca 0.55 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.50 3iop h PHE 341 Cb 2.37 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 40.87 3iop h PHE 341 CO 0.00 0.14 0.00 1.19 -2.02 0.00 0.00 178.31 177.62 3iop n PHE 342 N -4.39 1.03 -0.38 0.41 3.72 0.51 -4.70 117.46 113.65 3iop n PHE 342 Ca -0.02 -0.45 -0.05 0.00 -0.05 0.00 0.00 57.45 56.88 3iop n PHE 342 Cb 0.19 -0.10 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 3iop n PHE 342 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3iop n GLU 343 N 1.12 -0.30 -0.02 -1.08 2.13 -0.93 -1.06 120.64 120.50 3iop n GLU 343 Ca 0.21 1.47 0.13 0.00 0.66 0.00 0.00 57.16 59.63 3iop n GLU 343 Cb 0.64 -2.18 0.62 0.00 0.27 0.00 0.00 31.44 30.79 3iop n GLU 343 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3iop n SER 344 N -5.34 0.73 -4.73 4.31 3.41 -1.26 -4.90 113.62 105.84 3iop n SER 344 Ca 0.07 -1.38 -0.41 0.00 -0.26 0.00 0.00 58.87 56.89 3iop n SER 344 Cb 0.33 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 3iop n SER 344 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3iop s VAL 345 N -1.96 4.06 -0.51 -3.33 1.01 -0.22 -5.02 120.40 114.43 3iop s VAL 345 Ca 0.37 1.66 -0.17 0.00 0.00 0.00 0.00 61.98 63.84 3iop s VAL 345 Cb 0.18 -4.06 0.08 0.00 0.00 0.00 0.00 36.38 32.58 3iop s VAL 345 CO 0.30 0.24 0.52 -0.89 0.00 0.00 0.00 175.10 175.27 3iop s THR 346 N 0.18 5.07 0.15 3.92 2.01 -1.26 -4.96 115.64 120.74 3iop s THR 346 Ca 0.51 -0.95 0.17 0.00 0.31 0.00 0.00 61.69 61.73 3iop s THR 346 Cb -0.28 -4.26 0.09 0.00 0.01 0.00 0.00 72.50 68.06 3iop s THR 346 CO 0.32 -0.77 1.67 -0.50 -0.69 0.00 0.00 174.62 174.66 3iop h TRP 347 N 8.91 0.00 0.00 4.92 4.06 -1.96 -3.34 115.95 128.53 3iop h TRP 347 Ca -0.29 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.63 3iop h TRP 347 Cb 1.10 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.26 3iop h TRP 347 CO 0.71 0.45 -0.16 1.05 -3.56 0.00 0.00 178.44 176.93 3iop h GLU 348 N 0.00 0.00 -0.33 0.49 9.09 -2.03 -3.35 114.58 118.45 3iop h GLU 348 Ca -0.00 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.18 3iop h GLU 348 Cb 1.01 0.00 -0.39 0.00 -1.65 0.00 0.00 28.75 27.72 3iop h GLU 348 CO 0.06 0.16 -1.07 0.27 0.05 0.00 0.00 179.01 178.48 3iop n ASN 349 N -3.25 1.33 -0.32 3.06 6.94 -1.25 -4.96 115.26 116.79 3iop n ASN 349 Ca 0.01 -2.02 0.10 0.00 -0.02 0.00 0.00 54.58 52.64 3iop n ASN 349 Cb 0.44 -0.40 0.27 0.00 -2.36 0.00 0.00 39.78 37.74 3iop n ASN 349 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 3iop h LEU 350 N 2.21 0.64 0.00 -4.53 3.38 -1.71 -1.00 115.31 114.29 3iop h LEU 350 Ca -0.17 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3iop h LEU 350 Cb 1.40 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.14 3iop h LEU 350 CO 0.15 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.92 3iop n HIS 351 N -4.83 0.00 0.08 1.13 1.44 -1.26 -2.21 115.22 109.57 3iop n HIS 351 Ca 0.20 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.94 3iop n HIS 351 Cb 0.50 -0.50 -0.03 0.00 0.12 0.00 0.00 29.99 30.08 3iop n HIS 351 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 3iop h GLN 352 N 0.00 0.00 -7.09 -1.40 7.50 -1.60 -3.47 115.11 109.05 3iop h GLN 352 Ca 0.00 0.00 -0.49 0.00 0.50 0.00 0.00 58.65 58.66 3iop h GLN 352 Cb 0.40 0.00 0.06 0.00 0.05 0.00 0.00 27.48 27.99 3iop h GLN 352 CO 0.00 0.29 0.42 -0.65 -1.50 0.00 0.00 178.83 177.39 3iop s GLN 353 N -3.01 3.46 -0.24 1.46 -0.21 -0.94 -5.01 119.66 115.17 3iop s GLN 353 Ca -0.00 1.52 -0.23 0.00 0.02 0.00 0.00 55.36 56.67 3iop s GLN 353 Cb 0.08 -2.03 -0.01 0.00 1.00 0.00 0.00 33.01 32.05 3iop s GLN 353 CO 0.78 -0.74 0.73 -0.08 -2.12 0.00 0.00 175.29 173.86 3iop s THR 354 N -1.87 4.91 0.49 -0.19 -1.32 -1.26 -5.03 115.64 111.37 3iop s THR 354 Ca 0.71 1.36 -0.24 0.00 -1.21 0.00 0.00 61.69 62.31 3iop s THR 354 Cb -0.21 -4.03 -0.07 0.00 -1.51 0.00 0.00 72.50 66.68 3iop s THR 354 CO 0.26 -0.01 1.42 -2.65 -2.21 0.00 0.00 174.62 171.42 3iop n PRO 355 N 5.78 2.07 -2.17 7.08 -0.02 -1.26 -4.98 135.00 141.51 3iop n PRO 355 Ca 0.02 0.75 -0.37 0.00 -2.02 0.00 0.00 63.50 61.88 3iop n PRO 355 Cb 0.48 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3iop n PRO 355 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3iop s PRO 356 N -2.61 3.64 0.19 0.52 0.04 -1.26 -4.98 135.00 130.54 3iop s PRO 356 Ca 0.65 1.86 -0.30 0.00 0.04 0.00 0.00 61.00 63.25 3iop s PRO 356 Cb -0.44 -2.38 -0.08 0.00 0.04 0.00 0.00 34.50 31.64 3iop s PRO 356 CO 0.55 -0.68 1.27 0.15 0.04 0.00 0.00 177.00 178.33 3iop s LYS 357 N -2.74 4.42 -0.56 4.56 1.02 -1.26 -4.96 119.74 120.22 3iop s LYS 357 Ca 0.65 1.99 -0.26 0.00 0.02 0.00 0.00 55.97 58.37 3iop s LYS 357 Cb -0.31 -3.21 0.04 0.00 -0.52 0.00 0.00 37.83 33.82 3iop s LYS 357 CO 0.37 -0.20 1.06 -0.51 -0.92 0.00 0.00 175.35 175.15 3iop s LEU 358 N -0.10 3.79 0.00 3.17 1.43 -1.26 -4.95 118.68 120.76 3iop s LEU 358 Ca 0.56 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.53 3iop s LEU 358 Cb -0.35 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 42.88 3iop s LEU 358 CO 0.37 -1.35 0.39 0.41 0.23 0.00 0.00 176.35 176.41