#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iue s ALA 2 N 0.00 3.50 0.29 -5.12 0.00 -1.26 -4.99 121.76 114.18 3iue s ALA 2 Ca 0.00 1.20 -0.29 0.00 0.00 0.00 0.00 51.96 52.87 3iue s ALA 2 Cb 0.00 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 3iue s ALA 2 CO 0.00 -0.57 1.24 0.42 0.00 0.00 0.00 175.76 176.85 3iue s ILE 3 N -0.90 3.05 0.70 0.00 1.01 -1.26 -4.98 121.20 118.81 3iue s ILE 3 Ca 0.50 1.01 -0.16 0.00 0.00 0.00 0.00 60.65 62.00 3iue s ILE 3 Cb -0.38 -3.65 -0.01 0.00 0.01 0.00 0.00 42.46 38.43 3iue s ILE 3 CO 0.49 0.23 0.95 -2.65 0.00 0.00 0.00 174.94 173.95 3iue n PRO 4 N 1.27 0.57 -1.65 2.79 -0.02 -1.26 -4.89 135.00 131.82 3iue n PRO 4 Ca 0.01 0.25 -0.47 0.00 -2.02 0.00 0.00 63.50 61.26 3iue n PRO 4 Cb 0.43 -2.20 -0.04 0.00 -0.02 0.00 0.00 33.50 31.67 3iue n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iue n ALA 5 N -2.36 0.65 -3.71 3.55 0.00 -1.26 -4.90 120.51 112.48 3iue n ALA 5 Ca 0.13 0.46 -0.21 0.00 0.00 0.00 0.00 53.44 53.82 3iue n ALA 5 Cb 0.49 -2.26 -0.18 0.00 0.00 0.00 0.00 19.45 17.51 3iue n ALA 5 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3iue s PHE 6 N 0.60 0.28 -0.39 0.00 5.36 -1.26 -5.03 117.98 117.53 3iue s PHE 6 Ca 0.78 0.10 -0.08 0.00 -0.96 0.00 0.00 56.93 56.77 3iue s PHE 6 Cb -0.75 -0.58 0.06 0.00 -0.34 0.00 0.00 43.02 41.41 3iue s PHE 6 CO 0.43 -0.23 0.21 -1.01 -1.46 0.00 0.00 175.22 173.16 3iue s HIS 7 N 2.03 3.32 0.36 10.12 3.76 -1.26 -5.08 115.29 128.54 3iue s HIS 7 Ca 0.04 -1.48 -0.27 0.00 -0.15 0.00 0.00 55.06 53.20 3iue s HIS 7 Cb -0.12 -2.74 -0.12 0.00 1.11 0.00 0.00 32.58 30.71 3iue s HIS 7 CO -0.04 -0.80 1.24 -2.30 -0.85 0.00 0.00 174.74 171.99 3iue n PRO 8 N 4.89 1.96 -0.96 8.40 -0.02 -1.26 -2.31 135.00 145.70 3iue n PRO 8 Ca -0.10 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3iue n PRO 8 Cb 0.44 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 3iue n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iue n GLY 9 N 0.85 0.48 3.49 -1.23 0.00 -1.26 -5.02 105.19 102.50 3iue n GLY 9 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 3iue n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iue s GLU 10 N -0.45 1.70 -0.42 1.61 2.02 -0.98 -5.04 118.70 117.15 3iue s GLU 10 Ca 0.00 -1.84 -0.28 0.00 0.02 0.00 0.00 54.97 52.87 3iue s GLU 10 Cb 0.00 -1.61 0.02 0.00 0.10 0.00 0.00 34.13 32.65 3iue s GLU 10 CO 0.00 0.19 1.07 -1.17 0.02 0.00 0.00 175.26 175.37 3iue s LEU 11 N -3.53 3.81 -0.26 1.80 2.96 -1.26 -4.30 118.68 117.90 3iue s LEU 11 Ca 0.30 0.61 -0.09 0.00 -0.22 0.00 0.00 54.13 54.74 3iue s LEU 11 Cb -0.00 -3.47 -0.04 0.00 0.50 0.00 0.00 46.19 43.18 3iue s LEU 11 CO 0.15 -1.07 0.11 0.20 -1.32 0.00 0.00 176.35 174.42 3iue s ASN 12 N 2.13 5.45 -0.18 3.68 0.01 0.27 -4.98 114.94 121.32 3iue s ASN 12 Ca 0.45 -0.13 -0.06 0.00 -0.71 0.00 0.00 52.86 52.40 3iue s ASN 12 Cb -0.09 -1.99 -0.03 0.00 0.41 0.00 0.00 41.25 39.54 3iue s ASN 12 CO 0.25 -0.04 0.02 -0.69 -1.51 0.00 0.00 177.10 175.13 3iue s VAL 13 N 1.66 4.31 -0.06 1.60 1.01 -1.26 -1.41 120.40 126.25 3iue s VAL 13 Ca 0.07 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3iue s VAL 13 Cb -0.15 -2.94 0.02 0.00 0.00 0.00 0.00 36.38 33.31 3iue s VAL 13 CO 0.06 0.45 -0.08 -0.31 0.00 0.00 0.00 175.10 175.22 3iue s TYR 14 N 0.62 1.12 -0.25 5.22 2.02 -0.49 -4.99 117.35 120.59 3iue s TYR 14 Ca 0.01 -0.40 0.22 0.00 -0.37 0.00 0.00 57.07 56.53 3iue s TYR 14 Cb -0.14 -0.89 -0.29 0.00 -0.40 0.00 0.00 41.96 40.24 3iue s TYR 14 CO 0.02 -0.26 0.61 0.43 -1.57 0.00 0.00 175.55 174.78 3iue n SER 15 N 4.06 0.25 -4.66 2.29 7.64 -1.26 -0.97 113.62 120.97 3iue n SER 15 Ca -0.22 -0.19 -0.40 0.00 1.01 0.00 0.00 58.87 59.08 3iue n SER 15 Cb 0.51 1.69 -0.06 0.00 -1.01 0.00 0.00 64.21 65.34 3iue n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iue s ALA 16 N -3.40 3.55 0.27 -0.43 0.00 -1.26 -3.90 121.76 116.59 3iue s ALA 16 Ca -0.04 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.55 3iue s ALA 16 Cb 0.14 -2.87 0.62 0.00 0.00 0.00 0.00 23.12 21.01 3iue s ALA 16 CO 0.89 -0.50 1.71 -1.35 0.00 0.00 0.00 175.76 176.51 3iue h PRO 17 N 7.51 0.41 -0.23 0.00 0.11 -1.91 -1.33 132.00 136.55 3iue h PRO 17 Ca -0.33 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 3iue h PRO 17 Cb 1.15 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3iue h PRO 17 CO 0.75 0.27 -0.08 0.78 -0.21 0.00 0.00 178.00 179.52 3iue h GLY 18 N 0.42 0.39 0.59 -0.55 0.00 -1.96 -0.92 103.07 101.04 3iue h GLY 18 Ca 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 3iue h GLY 18 CO -0.48 0.22 -0.01 -0.55 0.00 0.00 0.00 176.54 175.71 3iue h ASP 19 N 0.35 -0.03 -0.57 0.19 3.32 -1.67 -1.55 116.42 116.45 3iue h ASP 19 Ca 0.07 -0.40 -0.02 0.00 0.02 0.00 0.00 57.03 56.71 3iue h ASP 19 Cb 0.36 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 3iue h ASP 19 CO 0.02 0.39 0.29 1.62 -1.72 0.00 0.00 179.24 179.84 3iue h VAL 20 N -0.45 1.20 -0.24 -1.35 3.04 -1.23 -1.33 116.25 115.90 3iue h VAL 20 Ca -0.00 -0.54 -0.00 0.00 -1.01 0.00 0.00 66.70 65.14 3iue h VAL 20 Cb 0.42 0.42 -0.01 0.00 -2.01 0.00 0.00 31.29 30.11 3iue h VAL 20 CO 0.01 0.23 0.13 0.00 -1.01 0.00 0.00 177.57 176.92 3iue h ALA 21 N 1.48 0.30 -0.47 3.17 0.00 -1.10 0.37 119.26 123.00 3iue h ALA 21 Ca 0.21 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3iue h ALA 21 Cb 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3iue h ALA 21 CO -0.03 -0.17 0.19 -0.44 0.00 0.00 0.00 179.25 178.81 3iue h ASP 22 N 0.27 0.65 -0.30 0.00 3.32 -0.93 -0.65 116.42 118.79 3iue h ASP 22 Ca 0.08 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.90 3iue h ASP 22 Cb 0.07 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 3iue h ASP 22 CO -0.01 0.64 -0.09 0.58 -1.72 0.00 0.00 179.24 178.64 3iue h VAL 23 N 0.63 1.28 -0.67 -1.35 2.07 -1.08 -0.64 116.25 116.49 3iue h VAL 23 Ca 0.16 -1.14 0.02 0.00 0.82 0.00 0.00 66.70 66.57 3iue h VAL 23 Cb 0.19 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 3iue h VAL 23 CO -0.01 0.36 0.42 -1.28 0.02 0.00 0.00 177.57 177.08 3iue h SER 24 N 0.35 0.70 -0.26 0.57 0.87 -0.84 0.42 113.55 115.37 3iue h SER 24 Ca 0.07 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 3iue h SER 24 Cb 0.58 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3iue h SER 24 CO 0.03 0.49 0.08 -0.09 -0.53 0.00 0.00 176.83 176.81 3iue h ARG 25 N 0.83 0.42 -0.76 2.24 2.43 -1.00 0.05 114.38 118.58 3iue h ARG 25 Ca 0.26 -0.09 0.08 0.00 -0.81 0.00 0.00 59.98 59.42 3iue h ARG 25 Cb -0.01 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.41 3iue h ARG 25 CO -0.09 0.49 0.43 0.00 -1.51 0.00 0.00 179.97 179.29 3iue h ALA 26 N 0.91 1.06 -0.42 2.80 0.00 -0.75 -0.93 119.26 121.93 3iue h ALA 26 Ca 0.08 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3iue h ALA 26 Cb 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3iue h ALA 26 CO -0.00 0.08 0.04 -0.07 0.00 0.00 0.00 179.25 179.30 3iue h LEU 27 N 0.75 0.68 -0.60 0.00 3.38 -0.63 -2.43 115.31 116.46 3iue h LEU 27 Ca 0.36 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 58.14 3iue h LEU 27 Cb 0.29 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 3iue h LEU 27 CO -0.22 0.79 0.23 -0.09 0.09 0.00 0.00 178.44 179.24 3iue h ARG 28 N 0.55 0.41 0.00 1.13 2.43 -0.67 -1.86 114.38 116.37 3iue h ARG 28 Ca 0.12 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3iue h ARG 28 Cb 0.42 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3iue h ARG 28 CO 0.01 0.27 -0.13 -0.07 -1.51 0.00 0.00 179.97 178.54 3iue h LEU 29 N 0.42 0.00 -1.04 3.80 3.38 -0.82 -2.35 115.31 118.70 3iue h LEU 29 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3iue h LEU 29 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3iue h LEU 29 CO -0.30 0.13 0.00 0.35 0.09 0.00 0.00 178.44 178.71 3iue n THR 30 N -3.46 0.02 0.00 0.22 -2.24 -0.74 -4.95 114.28 103.12 3iue n THR 30 Ca -0.01 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 3iue n THR 30 Cb 0.29 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 3iue n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iue n GLY 31 N 1.18 1.65 3.77 3.38 0.00 -0.88 -5.08 105.19 109.20 3iue n GLY 31 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3iue n GLY 31 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iue s ARG 32 N -0.59 4.01 -0.24 1.61 6.06 -0.96 -4.99 118.95 123.84 3iue s ARG 32 Ca 0.00 2.18 -0.16 0.00 -2.50 0.00 0.00 55.73 55.25 3iue s ARG 32 Cb 0.00 -2.79 -0.04 0.00 0.06 0.00 0.00 34.95 32.18 3iue s ARG 32 CO 0.00 -0.47 0.41 1.03 -2.50 0.00 0.00 175.30 173.77 3iue s ARG 33 N -2.19 4.08 -0.22 5.12 1.81 0.18 -4.23 118.95 123.49 3iue s ARG 33 Ca 0.56 0.15 -0.20 0.00 -1.72 0.00 0.00 55.73 54.52 3iue s ARG 33 Cb -0.38 -3.61 -0.02 0.00 -0.45 0.00 0.00 34.95 30.48 3iue s ARG 33 CO 0.50 -0.20 0.60 0.08 -0.68 0.00 0.00 175.30 175.60 3iue s VAL 34 N 1.83 5.03 -0.09 3.52 1.01 -1.26 -1.05 120.40 129.39 3iue s VAL 34 Ca 0.18 1.10 0.01 0.00 0.00 0.00 0.00 61.98 63.27 3iue s VAL 34 Cb -0.15 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 3iue s VAL 34 CO 0.09 0.10 -0.11 -0.04 0.00 0.00 0.00 175.10 175.14 3iue s MET 35 N 2.07 2.95 -0.11 2.72 1.00 -0.10 0.05 119.30 127.88 3iue s MET 35 Ca 0.26 -0.63 0.01 0.00 0.00 0.00 0.00 55.69 55.33 3iue s MET 35 Cb -0.16 -2.57 -0.01 0.00 0.00 0.00 0.00 34.83 32.09 3iue s MET 35 CO 0.10 0.48 -0.15 -1.17 0.00 0.00 0.00 175.02 174.27 3iue s LEU 36 N -0.33 2.62 -0.38 -0.03 2.96 -0.06 -0.38 118.68 123.08 3iue s LEU 36 Ca 0.04 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3iue s LEU 36 Cb -0.13 -1.57 0.11 0.00 0.50 0.00 0.00 46.19 45.11 3iue s LEU 36 CO 0.02 0.20 0.11 -0.69 -1.32 0.00 0.00 176.35 174.67 3iue s VAL 37 N 0.14 2.08 0.14 1.68 1.01 0.46 -1.30 120.40 124.61 3iue s VAL 37 Ca -0.08 -2.42 -0.30 0.00 0.00 0.00 0.00 61.98 59.18 3iue s VAL 37 Cb -0.15 -2.51 -0.06 0.00 0.00 0.00 0.00 36.38 33.65 3iue s VAL 37 CO 0.05 -0.67 0.97 -2.84 0.00 0.00 0.00 175.10 172.61 3iue s PRO 38 N 0.73 4.72 0.19 2.72 0.02 -1.26 -1.86 135.00 140.26 3iue s PRO 38 Ca 0.12 1.48 -0.04 0.00 0.02 0.00 0.00 61.00 62.58 3iue s PRO 38 Cb -0.21 -3.35 -0.03 0.00 0.02 0.00 0.00 34.50 30.93 3iue s PRO 38 CO -0.08 0.26 0.19 0.95 -0.33 0.00 0.00 177.00 177.99 3iue s THR 39 N -0.24 0.03 -0.26 0.99 -4.23 -0.25 -4.93 115.64 106.75 3iue s THR 39 Ca 0.46 -1.81 0.11 0.00 -1.18 0.00 0.00 61.69 59.27 3iue s THR 39 Cb -0.24 -2.28 0.51 0.00 1.34 0.00 0.00 72.50 71.83 3iue s THR 39 CO 0.31 -0.13 1.45 0.23 -0.54 0.00 0.00 174.62 175.94 3iue n MET 40 N -0.24 2.08 0.00 3.99 2.81 -1.26 -1.81 117.12 122.69 3iue n MET 40 Ca -0.01 -3.08 0.00 0.00 -1.81 0.00 0.00 57.70 52.80 3iue n MET 40 Cb 0.64 -1.82 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3iue n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iue n GLY 41 N -0.99 -1.73 3.64 3.03 0.00 -1.26 -4.65 105.19 103.22 3iue n GLY 41 Ca 0.30 -1.29 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 3iue n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iue n ALA 42 N 0.01 -2.57 -1.76 4.61 0.00 -1.26 -4.86 120.51 114.67 3iue n ALA 42 Ca 0.00 -0.22 -0.40 0.00 0.00 0.00 0.00 53.44 52.82 3iue n ALA 42 Cb 0.00 -3.61 -0.03 0.00 0.00 0.00 0.00 19.45 15.81 3iue n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iue s LEU 43 N -6.11 4.45 0.00 0.00 1.43 -1.26 -5.01 118.68 112.19 3iue s LEU 43 Ca 0.39 2.48 0.03 0.00 -1.03 0.00 0.00 54.13 56.00 3iue s LEU 43 Cb -0.14 -3.68 -0.01 0.00 0.03 0.00 0.00 46.19 42.39 3iue s LEU 43 CO 0.85 -0.39 0.12 0.00 0.23 0.00 0.00 176.35 177.17 3iue n HIS 44 N 0.88 0.13 0.21 0.29 1.44 -1.26 -5.02 115.22 111.89 3iue n HIS 44 Ca -0.00 -2.16 0.14 0.00 -2.01 0.00 0.00 57.72 53.69 3iue n HIS 44 Cb 0.44 -0.01 0.75 0.00 0.12 0.00 0.00 29.99 31.28 3iue n HIS 44 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 3iue h GLU 45 N 0.00 0.00 -0.14 -1.40 4.39 -1.99 -0.40 114.58 115.04 3iue h GLU 45 Ca -0.26 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 3iue h GLU 45 Cb 1.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 3iue h GLU 45 CO 0.42 0.00 0.06 0.78 -1.16 0.00 0.00 179.01 179.11 3iue h GLY 46 N 0.00 0.22 1.00 -3.84 0.00 -1.96 -0.35 103.07 98.14 3iue h GLY 46 Ca 0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3iue h GLY 46 CO -0.00 0.11 0.40 0.45 0.00 0.00 0.00 176.54 177.50 3iue h HIS 47 N 0.08 0.94 -0.85 5.60 3.86 -1.51 -2.03 115.15 121.24 3iue h HIS 47 Ca 0.05 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3iue h HIS 47 Cb 0.15 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 28.27 3iue h HIS 47 CO -0.02 0.65 0.55 -0.07 0.86 0.00 0.00 177.93 179.89 3iue h LEU 48 N 0.95 0.99 -1.32 2.43 3.38 -1.11 -0.87 115.31 119.76 3iue h LEU 48 Ca 0.25 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3iue h LEU 48 Cb 0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3iue h LEU 48 CO -0.04 0.73 0.42 0.00 0.09 0.00 0.00 178.44 179.64 3iue h ALA 49 N 1.45 1.50 -0.34 1.53 0.00 -0.45 0.80 119.26 123.75 3iue h ALA 49 Ca 0.31 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3iue h ALA 49 Cb -0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 3iue h ALA 49 CO -0.06 0.45 0.01 -0.07 0.00 0.00 0.00 179.25 179.58 3iue h LEU 50 N 0.90 0.58 -0.32 0.00 3.38 -0.57 -1.67 115.31 117.62 3iue h LEU 50 Ca 0.24 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3iue h LEU 50 Cb -0.08 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3iue h LEU 50 CO -0.05 0.73 0.13 0.58 0.09 0.00 0.00 178.44 179.92 3iue h VAL 51 N 0.41 0.94 -0.33 1.22 2.07 -0.87 -1.11 116.25 118.58 3iue h VAL 51 Ca 0.10 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.44 3iue h VAL 51 Cb 0.43 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3iue h VAL 51 CO 0.01 0.05 -0.17 0.03 0.02 0.00 0.00 177.57 177.52 3iue h ARG 52 N 0.28 0.59 -0.32 1.57 3.08 -0.72 0.89 114.38 119.75 3iue h ARG 52 Ca 0.14 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3iue h ARG 52 Cb 0.09 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3iue h ARG 52 CO -0.12 0.74 0.16 0.00 -1.07 0.00 0.00 179.97 179.67 3iue h ALA 53 N 1.29 0.42 -0.68 0.04 0.00 -0.97 -2.53 119.26 116.83 3iue h ALA 53 Ca 0.09 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3iue h ALA 53 Cb 0.60 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3iue h ALA 53 CO 0.04 -0.03 0.21 0.00 0.00 0.00 0.00 179.25 179.47 3iue h ALA 54 N 1.02 0.89 -0.34 0.00 0.00 -0.55 -3.09 119.26 117.19 3iue h ALA 54 Ca 0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3iue h ALA 54 Cb 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3iue h ALA 54 CO -0.01 0.57 0.11 0.87 0.00 0.00 0.00 179.25 180.79 3iue h LYS 55 N 0.99 0.49 0.00 0.00 1.57 -0.58 -2.83 116.57 116.21 3iue h LYS 55 Ca 0.22 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3iue h LYS 55 Cb 0.31 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3iue h LYS 55 CO -0.01 0.43 0.00 2.89 -0.57 0.00 0.00 179.45 182.20 3iue n ARG 56 N -4.38 0.37 -2.08 3.15 1.85 -0.98 -4.68 116.66 109.92 3iue n ARG 56 Ca 0.02 0.03 -0.42 0.00 -1.00 0.00 0.00 57.85 56.48 3iue n ARG 56 Cb 0.16 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.04 3iue n ARG 56 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3iue s VAL 57 N -2.59 3.57 0.34 8.89 1.01 -1.07 -4.95 120.40 125.60 3iue s VAL 57 Ca 0.25 0.83 -0.29 0.00 0.00 0.00 0.00 61.98 62.77 3iue s VAL 57 Cb 0.18 -3.53 -0.11 0.00 0.00 0.00 0.00 36.38 32.92 3iue s VAL 57 CO 0.42 -0.04 1.53 -2.84 0.00 0.00 0.00 175.10 174.17 3iue s PRO 58 N 3.31 4.11 -0.31 2.72 0.02 -1.26 -1.83 135.00 141.76 3iue s PRO 58 Ca 0.70 2.58 0.00 0.00 0.02 0.00 0.00 61.00 64.30 3iue s PRO 58 Cb -0.33 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.20 3iue s PRO 58 CO 0.28 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.78 3iue n GLY 59 N 1.15 0.57 3.77 0.52 0.00 -1.26 -4.76 105.19 105.18 3iue n GLY 59 Ca 0.04 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 3iue n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iue s SER 60 N -2.36 6.40 -0.08 1.61 1.04 -0.76 -0.65 113.70 118.90 3iue s SER 60 Ca 0.00 2.41 0.03 0.00 0.48 0.00 0.00 55.95 58.87 3iue s SER 60 Cb 0.00 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.49 3iue s SER 60 CO 0.00 -0.77 -0.17 0.54 0.98 0.00 0.00 173.24 173.82 3iue s VAL 61 N -1.40 2.73 -0.23 5.02 0.11 -0.21 -4.81 120.40 121.60 3iue s VAL 61 Ca 0.58 -0.81 -0.09 0.00 -2.93 0.00 0.00 61.98 58.73 3iue s VAL 61 Cb -0.32 -2.08 -0.04 0.00 -1.53 0.00 0.00 36.38 32.41 3iue s VAL 61 CO 0.40 0.56 0.11 -0.69 -3.33 0.00 0.00 175.10 172.15 3iue s VAL 62 N -0.14 4.87 -0.24 2.04 1.01 -1.26 -0.92 120.40 125.75 3iue s VAL 62 Ca -0.02 0.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 3iue s VAL 62 Cb -0.14 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 3iue s VAL 62 CO 0.04 0.37 0.07 -0.69 0.00 0.00 0.00 175.10 174.88 3iue s VAL 63 N 1.07 4.36 -0.24 2.92 1.01 0.49 -2.11 120.40 127.90 3iue s VAL 63 Ca 0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 3iue s VAL 63 Cb -0.14 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 3iue s VAL 63 CO 0.04 0.36 -0.00 -0.69 0.00 0.00 0.00 175.10 174.80 3iue s VAL 64 N 1.41 3.58 0.11 2.92 1.01 -0.42 -0.40 120.40 128.61 3iue s VAL 64 Ca 0.05 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 3iue s VAL 64 Cb -0.15 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.47 3iue s VAL 64 CO 0.03 0.33 0.49 -0.94 0.00 0.00 0.00 175.10 175.01 3iue s SER 65 N 1.49 6.76 -0.25 3.32 1.04 -0.78 -1.06 113.70 124.22 3iue s SER 65 Ca 0.05 0.97 -0.01 0.00 0.48 0.00 0.00 55.95 57.44 3iue s SER 65 Cb -0.15 -2.25 0.08 0.00 0.10 0.00 0.00 66.02 63.80 3iue s SER 65 CO -0.01 0.14 0.04 -0.63 0.98 0.00 0.00 173.24 173.76 3iue s ILE 66 N -1.42 0.92 -0.19 -1.02 1.01 0.05 -1.09 121.20 119.47 3iue s ILE 66 Ca 0.35 -1.08 -0.08 0.00 0.00 0.00 0.00 60.65 59.85 3iue s ILE 66 Cb -0.15 -1.49 0.08 0.00 0.01 0.00 0.00 42.46 40.91 3iue s ILE 66 CO 0.18 -0.38 0.42 0.12 0.00 0.00 0.00 174.94 175.28 3iue s PHE 67 N 1.64 -0.72 -0.46 3.97 5.36 -0.75 -4.10 117.98 122.92 3iue s PHE 67 Ca 0.03 1.43 -0.24 0.00 -0.96 0.00 0.00 56.93 57.19 3iue s PHE 67 Cb -0.18 0.29 0.03 0.00 -0.34 0.00 0.00 43.02 42.82 3iue s PHE 67 CO -0.14 -0.43 0.83 0.08 -1.46 0.00 0.00 175.22 174.09 3iue s VAL 68 N 2.17 4.59 -0.48 3.12 1.01 -1.26 -4.36 120.40 125.19 3iue s VAL 68 Ca -0.04 0.48 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 3iue s VAL 68 Cb -0.11 -4.36 0.03 0.00 0.00 0.00 0.00 36.38 31.94 3iue s VAL 68 CO -0.13 -0.77 1.08 0.21 0.00 0.00 0.00 175.10 175.49 3iue s ASN 69 N 2.22 6.58 0.47 3.32 2.47 -1.26 -4.88 114.94 123.86 3iue s ASN 69 Ca 0.31 0.33 0.32 0.00 0.42 0.00 0.00 52.86 54.24 3iue s ASN 69 Cb -0.12 -2.52 1.53 0.00 -1.45 0.00 0.00 41.25 38.69 3iue s ASN 69 CO 0.23 -1.21 1.96 1.55 -3.72 0.00 0.00 177.10 175.91 3iue h PRO 70 N 9.21 0.00 0.00 0.43 0.13 -1.99 -2.68 132.00 137.10 3iue h PRO 70 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3iue h PRO 70 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3iue h PRO 70 CO 1.10 0.00 -0.04 1.98 -0.23 0.00 0.00 178.00 180.82 3iue h MET 71 N 0.00 0.00 0.00 0.86 4.05 -1.92 -3.53 114.93 114.39 3iue h MET 71 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3iue h MET 71 Cb 0.23 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.03 3iue h MET 71 CO 0.00 0.00 -0.08 1.04 0.23 0.00 0.00 176.91 178.10 3iue n GLN 72 N -2.63 0.04 -1.86 0.39 3.00 -1.01 -4.14 117.38 111.17 3iue n GLN 72 Ca 0.05 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 3iue n GLN 72 Cb 0.48 -0.39 0.00 0.00 0.00 0.00 0.00 30.24 30.33 3iue n GLN 72 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 3iue n PRO 83 N -2.71 -4.78 -3.70 -1.09 -0.02 -1.26 -4.80 135.00 116.63 3iue n PRO 83 Ca -0.01 3.47 -0.13 0.00 -2.02 0.00 0.00 63.50 64.81 3iue n PRO 83 Cb 0.04 -3.89 -0.09 0.00 -0.02 0.00 0.00 33.50 29.54 3iue n PRO 83 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3iue s ARG 84 N -2.20 0.54 -0.50 -0.52 1.70 -1.26 -4.64 118.95 112.08 3iue s ARG 84 Ca 0.00 0.72 0.04 0.00 -0.47 0.00 0.00 55.73 56.01 3iue s ARG 84 Cb 0.00 0.22 0.16 0.00 -0.57 0.00 0.00 34.95 34.76 3iue s ARG 84 CO 0.00 -0.09 0.36 0.95 -1.08 0.00 0.00 175.30 175.45 3iue s THR 85 N 0.50 1.30 0.09 4.99 -4.23 -1.26 -4.95 115.64 112.07 3iue s THR 85 Ca -0.02 -3.09 -0.31 0.00 -1.18 0.00 0.00 61.69 57.09 3iue s THR 85 Cb -0.04 -1.88 -0.15 0.00 1.34 0.00 0.00 72.50 71.77 3iue s THR 85 CO -0.02 -1.10 1.63 -0.65 -0.54 0.00 0.00 174.62 173.94 3iue h PRO 86 N 5.81 -0.70 -0.49 3.99 0.11 -1.99 0.12 132.00 138.86 3iue h PRO 86 Ca 0.17 0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.20 3iue h PRO 86 Cb 0.87 0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3iue h PRO 86 CO 0.49 -0.46 -0.20 -0.44 -0.21 0.00 0.00 178.00 177.18 3iue h ASP 87 N -0.72 1.00 -0.49 -2.05 3.32 -1.99 -2.12 116.42 113.37 3iue h ASP 87 Ca -0.04 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 3iue h ASP 87 Cb 0.62 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3iue h ASP 87 CO 0.01 1.16 0.10 -0.78 -1.72 0.00 0.00 179.24 178.00 3iue h ASP 88 N 0.85 0.76 -0.21 6.45 3.58 -1.97 -0.94 116.42 124.93 3iue h ASP 88 Ca 0.11 -0.25 0.05 0.00 0.42 0.00 0.00 57.03 57.37 3iue h ASP 88 Cb 0.77 -0.20 -0.05 0.00 1.72 0.00 0.00 39.33 41.56 3iue h ASP 88 CO 0.06 0.81 -0.13 0.44 -2.88 0.00 0.00 179.24 177.54 3iue h ASP 89 N 0.67 -0.42 -0.53 2.28 3.32 -0.60 -0.15 116.42 121.00 3iue h ASP 89 Ca 0.15 0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 3iue h ASP 89 Cb 0.36 0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 3iue h ASP 89 CO 0.01 -0.16 0.01 -0.07 -1.72 0.00 0.00 179.24 177.31 3iue h LEU 90 N -0.11 0.93 -0.85 1.55 3.38 -1.27 -1.18 115.31 117.75 3iue h LEU 90 Ca 0.12 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.87 3iue h LEU 90 Cb 0.29 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 3iue h LEU 90 CO -0.28 0.98 0.56 0.00 0.09 0.00 0.00 178.44 179.78 3iue h ALA 91 N 1.12 1.10 -0.33 1.53 0.00 -0.87 0.10 119.26 121.90 3iue h ALA 91 Ca 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3iue h ALA 91 Cb 0.50 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3iue h ALA 91 CO 0.02 0.44 0.16 1.96 0.00 0.00 0.00 179.25 181.83 3iue h GLN 92 N 1.11 0.48 -0.64 0.00 4.20 -0.18 -1.10 115.11 118.98 3iue h GLN 92 Ca 0.32 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.92 3iue h GLN 92 Cb -0.07 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 3iue h GLN 92 CO -0.09 0.44 0.25 -0.07 -0.67 0.00 0.00 178.83 178.69 3iue h LEU 93 N 0.40 0.88 -0.71 1.46 3.38 -0.94 -1.63 115.31 118.15 3iue h LEU 93 Ca 0.12 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 57.99 3iue h LEU 93 Cb 0.12 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 3iue h LEU 93 CO -0.01 0.82 0.38 -0.09 0.09 0.00 0.00 178.44 179.62 3iue h ARG 94 N 0.90 0.65 0.00 1.13 2.43 -0.86 -1.70 114.38 116.93 3iue h ARG 94 Ca 0.21 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 3iue h ARG 94 Cb 0.21 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 3iue h ARG 94 CO -0.02 0.43 -0.17 0.00 -1.51 0.00 0.00 179.97 178.70 3iue h ALA 95 N 1.40 1.60 -0.01 2.80 0.00 -0.52 -2.36 119.26 122.17 3iue h ALA 95 Ca 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3iue h ALA 95 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3iue h ALA 95 CO -0.23 0.22 -0.11 0.39 0.00 0.00 0.00 179.25 179.53 3iue n GLU 96 N -4.17 1.08 -1.57 0.00 -0.58 -0.68 -4.93 120.64 109.78 3iue n GLU 96 Ca -0.02 -0.52 -0.04 0.00 -0.42 0.00 0.00 57.16 56.15 3iue n GLU 96 Cb 0.25 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.62 3iue n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iue n GLY 97 N 1.24 0.47 3.72 0.62 0.00 -0.89 -5.02 105.19 105.33 3iue n GLY 97 Ca 0.16 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 3iue n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iue s VAL 98 N -2.19 3.54 -0.17 1.61 1.01 -0.76 -4.93 120.40 118.50 3iue s VAL 98 Ca 0.00 1.13 0.22 0.00 0.00 0.00 0.00 61.98 63.33 3iue s VAL 98 Cb 0.00 -3.72 -0.20 0.00 0.00 0.00 0.00 36.38 32.46 3iue s VAL 98 CO 0.00 0.10 0.74 -0.62 0.00 0.00 0.00 175.10 175.32 3iue n GLU 99 N 3.70 0.60 -4.13 2.72 1.02 -1.23 -4.04 120.64 119.28 3iue n GLU 99 Ca 0.10 -0.06 -0.20 0.00 -0.02 0.00 0.00 57.16 56.97 3iue n GLU 99 Cb 0.44 -1.64 -0.16 0.00 -0.02 0.00 0.00 31.44 30.05 3iue n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3iue s ILE 100 N -3.43 0.53 -0.10 -3.67 1.01 -0.90 -0.56 121.20 114.08 3iue s ILE 100 Ca -0.04 -0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.53 3iue s ILE 100 Cb 0.12 -0.56 -0.01 0.00 0.01 0.00 0.00 42.46 42.02 3iue s ILE 100 CO 0.86 0.23 -0.18 0.00 0.00 0.00 0.00 174.94 175.85 3iue s ALA 101 N 1.00 2.44 -0.28 9.38 0.00 -0.50 -1.30 121.76 132.51 3iue s ALA 101 Ca -0.10 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 3iue s ALA 101 Cb -0.14 -1.01 0.03 0.00 0.00 0.00 0.00 23.12 22.00 3iue s ALA 101 CO -0.00 0.32 -0.01 0.12 0.00 0.00 0.00 175.76 176.18 3iue s PHE 102 N 0.16 3.15 -0.57 0.00 5.36 -0.23 -1.40 117.98 124.45 3iue s PHE 102 Ca -0.10 -1.55 0.06 0.00 -0.96 0.00 0.00 56.93 54.39 3iue s PHE 102 Cb -0.16 -2.11 0.27 0.00 -0.34 0.00 0.00 43.02 40.68 3iue s PHE 102 CO 0.06 -0.73 0.75 0.25 -1.46 0.00 0.00 175.22 174.09 3iue n THR 103 N 4.69 1.84 -1.85 0.12 -2.24 -0.14 -0.77 114.28 115.93 3iue n THR 103 Ca -0.15 -5.05 -0.31 0.00 -2.27 0.00 0.00 64.05 56.27 3iue n THR 103 Cb 0.46 -1.85 0.02 0.00 -2.10 0.00 0.00 70.33 66.86 3iue n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3iue s PRO 104 N -2.44 3.36 0.64 -0.78 0.04 -1.25 -4.46 135.00 130.11 3iue s PRO 104 Ca 0.41 0.69 -0.10 0.00 0.04 0.00 0.00 61.00 62.03 3iue s PRO 104 Cb 0.19 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 3iue s PRO 104 CO -0.05 -0.73 1.02 0.95 0.04 0.00 0.00 177.00 178.22 3iue s THR 105 N -3.22 4.07 0.22 1.26 -4.23 -1.26 -4.87 115.64 107.61 3iue s THR 105 Ca 0.56 0.52 -0.08 0.00 -1.18 0.00 0.00 61.69 61.52 3iue s THR 105 Cb -0.11 -3.65 0.16 0.00 1.34 0.00 0.00 72.50 70.24 3iue s THR 105 CO 0.53 -0.81 1.79 0.74 -0.54 0.00 0.00 174.62 176.34 3iue h THR 106 N -0.39 0.90 -0.71 3.99 2.02 -1.97 -2.37 112.91 114.38 3iue h THR 106 Ca -0.45 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 3iue h THR 106 Cb 1.23 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3iue h THR 106 CO 0.63 0.12 0.39 0.00 0.37 0.00 0.00 175.52 177.02 3iue h ALA 107 N 1.40 1.34 -0.27 6.16 0.00 -1.94 0.64 119.26 126.58 3iue h ALA 107 Ca 0.33 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3iue h ALA 107 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iue h ALA 107 CO -0.23 0.54 -0.33 0.00 0.00 0.00 0.00 179.25 179.22 3iue h ALA 108 N 1.43 0.91 0.00 0.00 0.00 -1.86 -1.05 119.26 118.70 3iue h ALA 108 Ca 0.25 -0.40 -0.21 0.00 0.00 0.00 0.00 54.91 54.55 3iue h ALA 108 Cb 0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3iue h ALA 108 CO -0.04 0.62 -0.98 0.52 0.00 0.00 0.00 179.25 179.37 3iue h MET 109 N 0.50 0.00 -2.15 0.00 2.86 -1.08 -3.38 114.93 111.68 3iue h MET 109 Ca 0.06 -0.01 -0.54 0.00 -2.06 0.00 0.00 59.70 57.15 3iue h MET 109 Cb 0.82 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 32.07 3iue h MET 109 CO 0.07 0.98 -0.89 0.66 1.06 0.00 0.00 176.91 178.79 3iue n TYR 110 N -3.38 2.25 0.25 -0.22 4.01 0.19 -4.91 117.16 115.35 3iue n TYR 110 Ca -0.00 -3.91 0.10 0.00 -0.16 0.00 0.00 57.90 53.92 3iue n TYR 110 Cb 0.92 -0.46 0.66 0.00 -0.31 0.00 0.00 39.34 40.16 3iue n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3iue h PRO 111 N 3.08 0.00 -0.50 -0.72 0.13 -1.37 -1.75 132.00 130.87 3iue h PRO 111 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3iue h PRO 111 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 3iue h PRO 111 CO 0.67 0.13 0.00 -0.25 -0.23 0.00 0.00 178.00 178.32 3iue n ASP 112 N -3.96 4.56 -0.32 1.44 8.00 -1.26 -5.07 116.55 119.94 3iue n ASP 112 Ca -0.02 -2.66 0.00 0.00 0.71 0.00 0.00 54.79 52.82 3iue n ASP 112 Cb 0.22 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 3iue n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iue n GLY 113 N 0.51 -0.74 3.66 0.44 0.00 -0.66 -4.68 105.19 103.72 3iue n GLY 113 Ca 0.24 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 3iue n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iue s LEU 114 N 0.00 4.15 0.00 0.99 1.43 -1.26 -4.87 118.68 119.12 3iue s LEU 114 Ca 0.00 1.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 3iue s LEU 114 Cb 0.00 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.68 3iue s LEU 114 CO 0.00 -0.73 0.00 -1.14 0.23 0.00 0.00 176.35 174.71 3iue n ARG 115 N 6.49 0.00 -2.47 1.70 0.63 -1.26 -5.07 116.66 116.67 3iue n ARG 115 Ca 0.13 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.65 3iue n ARG 115 Cb 0.45 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.33 3iue n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3iue s THR 116 N 0.64 3.95 0.26 5.15 2.01 -1.26 -5.03 115.64 121.36 3iue s THR 116 Ca 0.00 1.55 0.02 0.00 0.31 0.00 0.00 61.69 63.56 3iue s THR 116 Cb 0.00 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 3iue s THR 116 CO 0.00 0.20 0.15 0.42 -0.69 0.00 0.00 174.62 174.70 3iue s THR 117 N 0.34 0.19 -0.11 -0.82 -4.23 -1.26 -5.12 115.64 104.63 3iue s THR 117 Ca 0.53 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.87 3iue s THR 117 Cb -0.29 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 3iue s THR 117 CO 0.33 0.00 0.45 -0.69 -0.54 0.00 0.00 174.62 174.17 3iue s VAL 118 N -3.85 5.19 -0.38 2.29 1.01 -1.26 -5.06 120.40 118.35 3iue s VAL 118 Ca 0.38 0.90 -0.11 0.00 0.00 0.00 0.00 61.98 63.16 3iue s VAL 118 Cb 0.06 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.69 3iue s VAL 118 CO 0.16 0.35 0.21 -1.58 0.00 0.00 0.00 175.10 174.24 3iue s GLN 119 N 0.49 2.78 0.93 2.72 0.74 -1.26 -4.63 119.66 121.43 3iue s GLN 119 Ca 0.25 -1.14 -0.11 0.00 0.05 0.00 0.00 55.36 54.41 3iue s GLN 119 Cb -0.15 -3.73 0.15 0.00 1.10 0.00 0.00 33.01 30.38 3iue s GLN 119 CO 0.10 -0.74 1.10 -2.14 -0.55 0.00 0.00 175.29 173.06 3iue s PRO 120 N 1.53 0.94 1.07 1.67 0.02 -1.26 -5.04 135.00 133.93 3iue s PRO 120 Ca 0.02 1.09 -0.18 0.00 0.02 0.00 0.00 61.00 61.94 3iue s PRO 120 Cb -0.20 -1.75 0.26 0.00 0.02 0.00 0.00 34.50 32.83 3iue s PRO 120 CO 0.06 -2.53 1.12 0.41 -0.33 0.00 0.00 177.00 175.72 3iue n GLY 121 N -0.41 -2.27 0.31 0.52 0.00 -1.26 -4.87 105.19 97.21 3iue n GLY 121 Ca 0.08 -1.57 0.21 0.00 0.00 0.00 0.00 46.02 44.74 3iue n GLY 121 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iue h PRO 122 N 0.00 0.00 -0.67 1.61 0.13 -2.03 -1.63 132.00 129.41 3iue h PRO 122 Ca -0.40 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.86 3iue h PRO 122 Cb 1.16 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3iue h PRO 122 CO 0.27 0.00 0.45 1.25 -0.23 0.00 0.00 178.00 179.73 3iue h LEU 123 N 0.00 0.37 -1.40 1.56 5.85 -1.96 -2.18 115.31 117.55 3iue h LEU 123 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3iue h LEU 123 Cb 0.04 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3iue h LEU 123 CO 0.00 0.21 0.00 0.00 -0.34 0.00 0.00 178.44 178.31 3iue h ALA 124 N 1.67 1.00 0.00 1.25 0.00 -1.63 -1.78 119.26 119.77 3iue h ALA 124 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3iue h ALA 124 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3iue h ALA 124 CO -0.09 0.00 -0.71 0.00 0.00 0.00 0.00 179.25 178.45 3iue h ALA 125 N 2.10 0.58 -2.09 0.00 0.00 -1.60 -3.32 119.26 114.92 3iue h ALA 125 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 3iue h ALA 125 Cb 0.21 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.04 3iue h ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 179.25 178.04 3iue s GLU 126 N -3.23 2.87 4.36 0.00 2.02 -0.67 -3.18 118.70 120.87 3iue s GLU 126 Ca 0.04 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.62 3iue s GLU 126 Cb 0.12 -2.45 0.00 0.00 0.10 0.00 0.00 34.13 31.90 3iue s GLU 126 CO 0.74 -0.52 0.00 1.28 0.02 0.00 0.00 175.26 176.78 3iue n LEU 127 N -2.30 0.00 0.30 1.80 4.77 -1.26 0.03 117.00 120.34 3iue n LEU 127 Ca 0.04 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.21 3iue n LEU 127 Cb 0.58 0.00 0.93 0.00 -2.33 0.00 0.00 43.42 42.61 3iue n LEU 127 CO 0.49 0.00 1.08 -0.33 -1.33 0.00 0.00 177.39 177.29 3iue h GLU 128 N 0.00 0.00 0.00 3.23 4.39 -1.91 -1.82 114.58 118.48 3iue h GLU 128 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3iue h GLU 128 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3iue h GLU 128 CO 0.00 0.02 0.00 0.41 -1.16 0.00 0.00 179.01 178.28 3iue n GLY 129 N -0.58 -1.38 0.16 -3.84 0.00 0.10 -2.44 105.19 97.22 3iue n GLY 129 Ca -0.01 0.04 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 3iue n GLY 129 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3iue h GLY 130 N 3.00 -0.48 2.00 -0.02 0.00 -1.28 -2.56 103.07 103.73 3iue h GLY 130 Ca 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 3iue h GLY 130 CO 0.00 -0.17 -0.22 -2.55 0.00 0.00 0.00 176.54 173.60 3iue h PRO 131 N -0.40 0.00 -2.48 4.80 0.11 -1.77 -3.38 132.00 128.88 3iue h PRO 131 Ca -0.04 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.48 3iue h PRO 131 Cb 0.31 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.03 3iue h PRO 131 CO 0.06 0.22 -0.87 0.54 -0.21 0.00 0.00 178.00 177.74 3iue n ARG 132 N -3.88 0.83 0.31 1.05 1.74 -1.02 -4.99 116.66 110.69 3iue n ARG 132 Ca -0.02 -3.61 0.20 0.00 -0.77 0.00 0.00 57.85 53.65 3iue n ARG 132 Cb 0.31 -1.80 0.95 0.00 -1.02 0.00 0.00 32.46 30.90 3iue n ARG 132 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3iue h PRO 133 N 5.23 0.00 -0.05 5.56 0.13 -1.65 -2.61 132.00 138.60 3iue h PRO 133 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 3iue h PRO 133 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3iue h PRO 133 CO 0.50 0.01 0.00 0.25 -0.23 0.00 0.00 178.00 178.53 3iue n THR 134 N -3.14 0.09 -0.03 1.56 -2.24 -1.26 -4.69 114.28 104.56 3iue n THR 134 Ca -0.01 -0.54 -0.09 0.00 -2.27 0.00 0.00 64.05 61.13 3iue n THR 134 Cb 0.19 1.21 -0.03 0.00 -2.10 0.00 0.00 70.33 69.59 3iue n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3iue h HIS 135 N 2.56 0.13 -0.03 4.78 6.17 -1.77 -2.96 115.15 124.02 3iue h HIS 135 Ca 0.00 0.01 -0.13 0.00 0.71 0.00 0.00 60.37 60.96 3iue h HIS 135 Cb 0.57 -0.03 -0.02 0.00 2.52 0.00 0.00 27.41 30.45 3iue h HIS 135 CO 0.02 0.07 -0.59 0.74 0.71 0.00 0.00 177.93 178.88 3iue h PHE 136 N 0.16 0.12 -0.71 5.26 0.04 -1.84 -2.09 116.94 117.89 3iue h PHE 136 Ca 0.08 -0.05 0.07 0.00 2.80 0.00 0.00 57.97 60.88 3iue h PHE 136 Cb 0.04 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.11 3iue h PHE 136 CO -0.11 0.66 0.39 0.00 -0.60 0.00 0.00 178.31 178.65 3iue h ALA 137 N 1.33 0.97 -0.11 2.45 0.00 -1.80 0.40 119.26 122.50 3iue h ALA 137 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3iue h ALA 137 Cb 1.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3iue h ALA 137 CO 0.08 0.04 0.07 0.78 0.00 0.00 0.00 179.25 180.22 3iue h GLY 138 N 0.69 0.16 0.94 0.00 0.00 -1.24 -1.31 103.07 102.32 3iue h GLY 138 Ca 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 3iue h GLY 138 CO -0.22 0.06 0.11 -2.08 0.00 0.00 0.00 176.54 174.41 3iue h VAL 139 N 0.15 1.10 -0.37 4.60 2.07 -1.11 -2.13 116.25 120.56 3iue h VAL 139 Ca 0.04 -0.28 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 3iue h VAL 139 Cb -0.00 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3iue h VAL 139 CO -0.01 0.10 -0.19 -0.07 0.02 0.00 0.00 177.57 177.42 3iue h LEU 140 N 0.21 0.70 0.17 2.57 3.38 -0.83 -0.14 115.31 121.37 3iue h LEU 140 Ca 0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3iue h LEU 140 Cb 0.07 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3iue h LEU 140 CO -0.01 0.88 -0.08 0.74 0.09 0.00 0.00 178.44 180.06 3iue h THR 141 N 0.62 0.85 -0.34 0.22 2.02 -1.14 0.05 112.91 115.19 3iue h THR 141 Ca 0.09 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3iue h THR 141 Cb 0.66 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 3iue h THR 141 CO 0.05 0.02 0.07 0.58 0.37 0.00 0.00 175.52 176.61 3iue h VAL 142 N -0.28 1.23 -0.79 3.16 2.07 -1.16 -2.25 116.25 118.23 3iue h VAL 142 Ca -0.02 -0.78 0.02 0.00 0.82 0.00 0.00 66.70 66.74 3iue h VAL 142 Cb 0.22 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3iue h VAL 142 CO 0.04 0.26 0.51 0.58 0.02 0.00 0.00 177.57 178.98 3iue h VAL 143 N 0.40 1.15 -0.34 2.57 2.07 -0.97 0.85 116.25 121.98 3iue h VAL 143 Ca 0.11 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.28 3iue h VAL 143 Cb 0.32 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 3iue h VAL 143 CO 0.00 0.18 0.22 0.25 0.02 0.00 0.00 177.57 178.25 3iue h LEU 144 N 1.01 0.37 -0.59 2.57 5.85 -0.80 -0.63 115.31 123.09 3iue h LEU 144 Ca 0.31 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3iue h LEU 144 Cb -0.04 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 3iue h LEU 144 CO -0.09 0.27 0.39 0.11 -0.34 0.00 0.00 178.44 178.77 3iue h LYS 145 N 0.44 0.78 -0.72 1.25 1.57 -0.99 -1.12 116.57 117.78 3iue h LYS 145 Ca 0.13 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 3iue h LYS 145 Cb -0.04 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 3iue h LYS 145 CO -0.04 0.52 0.22 -0.07 -0.57 0.00 0.00 179.45 179.51 3iue h LEU 146 N 0.80 1.07 -1.13 2.94 3.38 -0.40 -0.30 115.31 121.66 3iue h LEU 146 Ca 0.22 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3iue h LEU 146 Cb -0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.36 3iue h LEU 146 CO -0.05 1.00 0.14 -0.07 0.09 0.00 0.00 178.44 179.55 3iue h LEU 147 N 1.08 0.70 -0.30 1.67 3.38 -0.76 -1.48 115.31 119.59 3iue h LEU 147 Ca 0.23 -0.11 -0.19 0.00 0.09 0.00 0.00 57.88 57.90 3iue h LEU 147 Cb 0.32 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3iue h LEU 147 CO -0.01 0.68 -0.86 1.56 0.09 0.00 0.00 178.44 179.90 3iue h GLN 148 N 0.73 0.15 -0.03 1.13 1.08 -0.59 0.87 115.11 118.45 3iue h GLN 148 Ca 0.17 -0.16 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 3iue h GLN 148 Cb 0.25 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3iue h GLN 148 CO -0.01 0.92 -0.10 0.82 -0.95 0.00 0.00 178.83 179.51 3iue h ILE 149 N 0.08 1.46 0.02 2.54 2.04 -0.92 -3.37 117.51 119.36 3iue h ILE 149 Ca -0.04 -1.52 -0.28 0.00 1.00 0.00 0.00 64.86 64.03 3iue h ILE 149 Cb 1.49 2.38 -0.04 0.00 -0.74 0.00 0.00 36.82 39.91 3iue h ILE 149 CO 0.13 0.41 -1.55 0.58 0.00 0.00 0.00 178.15 177.72 3iue h VAL 150 N -0.43 1.05 -6.39 1.67 2.07 -1.35 -3.35 116.25 109.53 3iue h VAL 150 Ca -0.00 -2.85 -0.47 0.00 0.82 0.00 0.00 66.70 64.20 3iue h VAL 150 Cb 0.72 2.55 0.04 0.00 -1.52 0.00 0.00 31.29 33.09 3iue h VAL 150 CO 0.02 0.65 -0.94 -1.14 0.02 0.00 0.00 177.57 176.18 3iue n ARG 151 N -3.18 -1.52 -1.99 1.57 0.63 0.30 -4.79 116.66 107.68 3iue n ARG 151 Ca -0.14 0.39 -0.32 0.00 -0.92 0.00 0.00 57.85 56.86 3iue n ARG 151 Cb 1.03 -3.97 0.01 0.00 0.45 0.00 0.00 32.46 29.97 3iue n ARG 151 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 3iue s PRO 152 N -6.32 3.38 0.19 -0.14 0.04 -1.26 -4.88 135.00 126.01 3iue s PRO 152 Ca 0.38 1.05 0.05 0.00 0.04 0.00 0.00 61.00 62.52 3iue s PRO 152 Cb -0.15 -2.05 0.07 0.00 0.04 0.00 0.00 34.50 32.42 3iue s PRO 152 CO 0.88 -0.75 1.44 -0.44 0.04 0.00 0.00 177.00 178.17 3iue h ASP 153 N 0.20 0.16 -4.33 6.66 3.32 -0.75 -3.43 116.42 118.25 3iue h ASP 153 Ca -0.46 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.29 3iue h ASP 153 Cb 1.21 -0.05 -0.24 0.00 0.22 0.00 0.00 39.33 40.47 3iue h ASP 153 CO 0.58 0.90 -0.57 -0.13 -1.72 0.00 0.00 179.24 178.30 3iue s ARG 154 N -3.29 0.27 -0.02 3.56 0.52 -1.19 -1.64 118.95 117.17 3iue s ARG 154 Ca -0.02 -0.12 0.05 0.00 -0.52 0.00 0.00 55.73 55.11 3iue s ARG 154 Cb 0.11 0.12 -0.01 0.00 0.52 0.00 0.00 34.95 35.69 3iue s ARG 154 CO 0.81 -0.05 -0.17 0.54 0.02 0.00 0.00 175.30 176.45 3iue s VAL 155 N -0.61 1.33 -0.10 3.52 0.11 -0.31 -0.89 120.40 123.44 3iue s VAL 155 Ca -0.07 -0.70 0.03 0.00 -2.93 0.00 0.00 61.98 58.31 3iue s VAL 155 Cb -0.04 -1.12 -0.01 0.00 -1.53 0.00 0.00 36.38 33.68 3iue s VAL 155 CO 0.00 0.38 -0.20 -0.36 -3.33 0.00 0.00 175.10 171.59 3iue s PHE 156 N -0.25 2.64 0.04 1.54 0.40 -0.42 -0.70 117.98 121.23 3iue s PHE 156 Ca 0.03 -0.85 0.02 0.00 -0.60 0.00 0.00 56.93 55.53 3iue s PHE 156 Cb -0.08 -1.74 -0.02 0.00 0.51 0.00 0.00 43.02 41.68 3iue s PHE 156 CO 0.00 -0.31 -0.08 -0.06 0.70 0.00 0.00 175.22 175.47 3iue s PHE 157 N 0.26 0.67 0.60 0.36 0.08 -0.20 -4.27 117.98 115.48 3iue s PHE 157 Ca -0.14 -0.51 -0.17 0.00 0.12 0.00 0.00 56.93 56.23 3iue s PHE 157 Cb -0.17 -0.40 -0.03 0.00 -0.57 0.00 0.00 43.02 41.85 3iue s PHE 157 CO 0.07 -0.09 1.09 0.20 -0.10 0.00 0.00 175.22 176.39 3iue s GLY 158 N -1.62 2.27 0.02 4.36 0.00 -1.26 -0.80 107.32 110.28 3iue s GLY 158 Ca -0.09 0.55 0.24 0.00 0.00 0.00 0.00 44.72 45.42 3iue s GLY 158 CO 0.00 0.89 1.75 1.18 0.00 0.00 0.00 173.10 176.93 3iue n GLU 159 N -1.95 0.02 -0.13 2.90 1.02 0.03 -4.05 120.64 118.47 3iue n GLU 159 Ca 0.10 0.11 -0.04 0.00 -0.02 0.00 0.00 57.16 57.31 3iue n GLU 159 Cb 0.52 -1.53 0.04 0.00 -0.02 0.00 0.00 31.44 30.45 3iue n GLU 159 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3iue h LYS 160 N 0.00 0.22 -3.82 3.49 3.64 -1.93 -2.48 116.57 115.70 3iue h LYS 160 Ca 0.00 -0.01 -0.77 0.00 -1.27 0.00 0.00 60.65 58.60 3iue h LYS 160 Cb 0.42 -0.05 -0.21 0.00 -0.41 0.00 0.00 32.23 31.98 3iue h LYS 160 CO 0.00 0.15 1.29 -0.25 -2.27 0.00 0.00 179.45 178.37 3iue n ASP 161 N -5.09 5.46 -0.12 4.20 8.00 -1.26 -4.69 116.55 123.06 3iue n ASP 161 Ca 0.03 -3.11 -0.10 0.00 0.71 0.00 0.00 54.79 52.32 3iue n ASP 161 Cb 0.19 -1.45 -0.02 0.00 -0.02 0.00 0.00 41.12 39.82 3iue n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3iue h TYR 162 N 6.31 0.63 -0.96 1.24 3.20 -1.72 -0.74 116.97 124.93 3iue h TYR 162 Ca 0.29 -0.10 0.03 0.00 3.14 0.00 0.00 58.73 62.10 3iue h TYR 162 Cb 0.75 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.80 3iue h TYR 162 CO 1.06 0.67 0.63 0.37 -1.64 0.00 0.00 178.16 179.25 3iue h GLN 163 N 0.41 1.19 -0.25 1.82 4.15 -1.88 0.13 115.11 120.68 3iue h GLN 163 Ca 0.10 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.48 3iue h GLN 163 Cb 0.39 -0.27 -0.03 0.00 0.21 0.00 0.00 27.48 27.79 3iue h GLN 163 CO 0.01 0.79 0.08 0.37 -1.93 0.00 0.00 178.83 178.15 3iue h GLN 164 N 1.23 0.19 -0.41 1.69 4.15 -1.89 -0.91 115.11 119.15 3iue h GLN 164 Ca 0.38 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.82 3iue h GLN 164 Cb -0.02 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.59 3iue h GLN 164 CO -0.11 0.12 0.19 1.25 -1.93 0.00 0.00 178.83 178.35 3iue h LEU 165 N 0.19 0.26 -0.65 -2.39 5.85 -0.17 -1.28 115.31 117.13 3iue h LEU 165 Ca 0.11 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3iue h LEU 165 Cb 0.08 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 3iue h LEU 165 CO -0.12 0.19 0.42 0.58 -0.34 0.00 0.00 178.44 179.17 3iue h VAL 166 N 0.39 1.18 -0.74 1.05 2.07 -0.82 -1.25 116.25 118.12 3iue h VAL 166 Ca 0.18 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 3iue h VAL 166 Cb 0.11 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3iue h VAL 166 CO -0.14 0.18 0.37 -0.07 0.02 0.00 0.00 177.57 177.93 3iue h LEU 167 N 0.88 0.94 -0.71 2.57 3.38 -0.71 -0.99 115.31 120.67 3iue h LEU 167 Ca 0.24 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 3iue h LEU 167 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3iue h LEU 167 CO -0.05 0.78 -0.15 0.40 0.09 0.00 0.00 178.44 179.51 3iue h ILE 168 N 1.05 1.26 -0.89 1.22 2.04 -0.72 0.12 117.51 121.59 3iue h ILE 168 Ca 0.26 -1.26 0.02 0.00 1.00 0.00 0.00 64.86 64.88 3iue h ILE 168 Cb 0.08 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 3iue h ILE 168 CO -0.04 0.43 0.59 0.03 0.00 0.00 0.00 178.15 179.16 3iue h ARG 169 N 0.74 1.15 -0.17 2.37 3.08 -0.86 -0.46 114.38 120.22 3iue h ARG 169 Ca 0.11 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 3iue h ARG 169 Cb 0.67 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 3iue h ARG 169 CO 0.05 0.76 0.01 1.96 -1.07 0.00 0.00 179.97 181.68 3iue h GLN 170 N 1.18 0.30 -0.54 0.04 4.20 -0.62 -1.01 115.11 118.66 3iue h GLN 170 Ca 0.33 -0.09 0.11 0.00 0.06 0.00 0.00 58.65 59.06 3iue h GLN 170 Cb -0.10 -0.03 -0.11 0.00 0.30 0.00 0.00 27.48 27.54 3iue h GLN 170 CO -0.08 0.50 -0.21 1.25 -0.67 0.00 0.00 178.83 179.62 3iue h LEU 171 N 0.06 -0.75 -0.21 1.46 5.85 -0.47 0.14 115.31 121.39 3iue h LEU 171 Ca 0.05 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 3iue h LEU 171 Cb 0.36 0.42 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 3iue h LEU 171 CO 0.01 -0.24 0.07 0.58 -0.34 0.00 0.00 178.44 178.51 3iue h VAL 172 N -0.08 1.19 0.05 1.05 2.07 -0.95 -1.73 116.25 117.86 3iue h VAL 172 Ca 0.25 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 3iue h VAL 172 Cb 0.48 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3iue h VAL 172 CO -0.60 0.19 -0.02 0.00 0.02 0.00 0.00 177.57 177.16 3iue h ALA 173 N 0.89 -0.07 -0.20 1.67 0.00 -0.96 -0.81 119.26 119.78 3iue h ALA 173 Ca 0.07 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3iue h ALA 173 Cb 0.24 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3iue h ALA 173 CO -0.00 -0.49 -0.25 -0.44 0.00 0.00 0.00 179.25 178.07 3iue h ASP 174 N -0.17 0.38 -0.55 0.00 3.32 -0.66 -2.82 116.42 115.92 3iue h ASP 174 Ca -0.01 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3iue h ASP 174 Cb 0.15 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3iue h ASP 174 CO 0.01 0.63 0.00 0.49 -1.72 0.00 0.00 179.24 178.65 3iue n PHE 175 N -4.14 0.73 -3.62 4.55 3.72 -0.66 -4.97 117.46 113.07 3iue n PHE 175 Ca -0.01 -0.49 -0.26 0.00 -0.05 0.00 0.00 57.45 56.65 3iue n PHE 175 Cb 0.38 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.96 3iue n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3iue n ASN 176 N 1.14 -5.74 -4.77 4.37 4.13 -0.88 -4.96 115.26 108.56 3iue n ASN 176 Ca 0.19 -0.58 -0.40 0.00 1.68 0.00 0.00 54.58 55.46 3iue n ASN 176 Cb 0.53 -4.55 -0.03 0.00 -1.54 0.00 0.00 39.78 34.19 3iue n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3iue s LEU 177 N -7.19 4.43 0.00 3.41 1.43 -0.36 -4.95 118.68 115.45 3iue s LEU 177 Ca 0.57 2.46 0.30 0.00 -1.03 0.00 0.00 54.13 56.44 3iue s LEU 177 Cb -0.27 -3.71 1.55 0.00 0.03 0.00 0.00 46.19 43.79 3iue s LEU 177 CO 0.71 -0.40 2.05 -0.90 0.23 0.00 0.00 176.35 178.04 3iue n ASP 178 N 0.82 0.14 -4.81 2.29 5.68 -1.26 -4.86 116.55 114.55 3iue n ASP 178 Ca 0.00 -0.51 -0.34 0.00 -0.50 0.00 0.00 54.79 53.45 3iue n ASP 178 Cb 0.44 -0.15 -0.06 0.00 -1.14 0.00 0.00 41.12 40.20 3iue n ASP 178 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3iue s VAL 179 N -2.38 4.24 -0.18 2.12 0.11 -1.26 -5.02 120.40 118.02 3iue s VAL 179 Ca 0.34 1.44 -0.19 0.00 -2.93 0.00 0.00 61.98 60.65 3iue s VAL 179 Cb 0.21 -3.61 -0.03 0.00 -1.53 0.00 0.00 36.38 31.41 3iue s VAL 179 CO 0.44 -0.26 0.52 0.00 -3.33 0.00 0.00 175.10 172.47 3iue s ALA 180 N -2.08 3.53 -0.24 1.54 0.00 -0.65 -4.99 121.76 118.87 3iue s ALA 180 Ca 0.62 -0.35 -0.18 0.00 0.00 0.00 0.00 51.96 52.05 3iue s ALA 180 Cb -0.12 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 3iue s ALA 180 CO 0.16 -0.37 0.50 0.08 0.00 0.00 0.00 175.76 176.13 3iue s VAL 181 N 1.47 5.09 -0.23 0.00 1.01 -1.26 -1.16 120.40 125.31 3iue s VAL 181 Ca 0.25 0.87 -0.04 0.00 0.00 0.00 0.00 61.98 63.06 3iue s VAL 181 Cb -0.15 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.41 3iue s VAL 181 CO 0.10 0.12 -0.04 -0.69 0.00 0.00 0.00 175.10 174.59 3iue s VAL 182 N 2.06 3.29 -0.14 2.92 1.01 0.12 -4.97 120.40 124.70 3iue s VAL 182 Ca 0.21 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.39 3iue s VAL 182 Cb -0.16 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3iue s VAL 182 CO 0.09 0.36 0.47 -0.83 0.00 0.00 0.00 175.10 175.18 3iue s GLY 183 N 1.45 2.32 -0.15 4.51 0.00 -1.26 -1.04 107.32 113.15 3iue s GLY 183 Ca 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 44.72 44.48 3iue s GLY 183 CO -0.03 0.79 -0.05 0.14 0.00 0.00 0.00 173.10 173.95 3iue s VAL 184 N 0.80 3.74 0.39 1.40 1.01 0.02 -4.91 120.40 122.85 3iue s VAL 184 Ca 0.25 -0.41 -0.26 0.00 0.00 0.00 0.00 61.98 61.56 3iue s VAL 184 Cb -0.15 -2.63 -0.11 0.00 0.00 0.00 0.00 36.38 33.49 3iue s VAL 184 CO 0.10 0.50 1.13 -2.65 0.00 0.00 0.00 175.10 174.18 3iue n PRO 185 N 3.55 1.66 -1.74 2.72 -0.02 -1.26 -0.79 135.00 139.11 3iue n PRO 185 Ca -0.17 0.59 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 3iue n PRO 185 Cb 0.52 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 3iue n PRO 185 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3iue s THR 186 N -1.19 2.73 0.27 3.45 2.01 -1.26 -4.73 115.64 116.92 3iue s THR 186 Ca 0.60 0.11 -0.29 0.00 0.31 0.00 0.00 61.69 62.42 3iue s THR 186 Cb -0.57 -3.07 -0.09 0.00 0.01 0.00 0.00 72.50 68.78 3iue s THR 186 CO 0.59 -0.00 1.20 -0.69 -0.69 0.00 0.00 174.62 175.03 3iue s VAL 187 N 3.15 3.22 0.09 3.82 1.01 -1.26 -4.96 120.40 125.47 3iue s VAL 187 Ca 0.82 1.17 0.06 0.00 0.00 0.00 0.00 61.98 64.03 3iue s VAL 187 Cb -0.44 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 3iue s VAL 187 CO 0.37 0.26 -0.16 -0.13 0.00 0.00 0.00 175.10 175.44 3iue s ARG 188 N -1.24 0.93 1.06 2.72 0.52 -1.26 -1.40 118.95 120.28 3iue s ARG 188 Ca 0.48 -1.05 -0.13 0.00 -0.52 0.00 0.00 55.73 54.51 3iue s ARG 188 Cb -0.35 -0.97 0.23 0.00 0.52 0.00 0.00 34.95 34.38 3iue s ARG 188 CO 0.44 0.21 1.07 -1.21 0.02 0.00 0.00 175.30 175.83 3iue s GLU 189 N -1.95 -0.10 0.50 3.54 0.41 0.09 -4.85 118.70 116.33 3iue s GLU 189 Ca 0.02 0.61 0.17 0.00 -0.41 0.00 0.00 54.97 55.36 3iue s GLU 189 Cb -0.09 -1.67 1.24 0.00 -1.78 0.00 0.00 34.13 31.83 3iue s GLU 189 CO 0.03 -3.12 2.08 0.00 -0.49 0.00 0.00 175.26 173.76 3iue h ALA 190 N -2.17 2.12 -0.07 5.21 0.00 -2.01 0.40 119.26 122.72 3iue h ALA 190 Ca -0.57 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3iue h ALA 190 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3iue h ALA 190 CO 0.55 -0.18 0.00 -0.40 0.00 0.00 0.00 179.25 179.22 3iue n ASP 191 N -4.48 1.56 0.00 0.00 5.68 -1.26 -4.93 116.55 113.12 3iue n ASP 191 Ca 0.03 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.75 3iue n ASP 191 Cb 0.27 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 3iue n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3iue n GLY 192 N 1.16 0.72 3.69 6.12 0.00 0.13 -4.87 105.19 112.14 3iue n GLY 192 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3iue n GLY 192 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3iue s LEU 193 N 0.00 4.40 0.30 0.99 2.96 -1.26 -4.61 118.68 121.47 3iue s LEU 193 Ca 0.00 2.77 -0.30 0.00 -0.22 0.00 0.00 54.13 56.39 3iue s LEU 193 Cb 0.00 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 43.01 3iue s LEU 193 CO 0.00 -1.01 1.54 0.00 -1.32 0.00 0.00 176.35 175.56 3iue s ALA 194 N 2.81 3.69 0.34 5.97 0.00 -1.26 -0.73 121.76 132.58 3iue s ALA 194 Ca 0.82 1.52 -0.29 0.00 0.00 0.00 0.00 51.96 54.01 3iue s ALA 194 Cb -0.46 -3.62 -0.12 0.00 0.00 0.00 0.00 23.12 18.92 3iue s ALA 194 CO 0.37 -0.95 1.44 -0.12 0.00 0.00 0.00 175.76 176.50 3iue n MET 195 N 1.85 2.47 -3.63 0.00 1.56 -0.49 -4.84 117.12 114.04 3iue n MET 195 Ca 0.06 0.87 -0.09 0.00 -0.27 0.00 0.00 57.70 58.27 3iue n MET 195 Cb 0.38 -2.56 -0.07 0.00 2.15 0.00 0.00 33.22 33.13 3iue n MET 195 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 3iue s SER 196 N -0.06 -0.41 0.54 6.12 0.15 -1.26 -4.99 113.70 113.79 3iue s SER 196 Ca 0.57 0.72 0.25 0.00 0.70 0.00 0.00 55.95 58.19 3iue s SER 196 Cb -0.52 0.71 1.43 0.00 -1.71 0.00 0.00 66.02 65.93 3iue s SER 196 CO 0.60 -0.18 2.02 0.77 1.20 0.00 0.00 173.24 177.65 3iue h SER 197 N 3.78 0.00 1.13 5.45 4.64 -1.94 -2.23 113.55 124.38 3iue h SER 197 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3iue h SER 197 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3iue h SER 197 CO 0.15 0.00 0.00 0.03 -0.87 0.00 0.00 176.83 176.14 3iue h ARG 198 N 0.00 0.00 -0.66 4.77 3.08 -1.95 -3.33 114.38 116.29 3iue h ARG 198 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3iue h ARG 198 Cb 0.83 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.85 3iue h ARG 198 CO -0.00 0.00 0.43 -0.91 -1.07 0.00 0.00 179.97 178.42 3iue h ASN 199 N 0.00 0.77 0.55 7.04 2.35 -1.77 -2.47 115.58 122.04 3iue h ASN 199 Ca 0.00 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3iue h ASN 199 Cb 0.57 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 3iue h ASN 199 CO 0.00 0.56 -0.01 0.08 -1.65 0.00 0.00 177.43 176.41 3iue h ARG 200 N 0.90 0.00 0.00 0.81 0.11 -1.79 -2.16 114.38 112.24 3iue h ARG 200 Ca 0.24 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.32 3iue h ARG 200 Cb -0.09 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 30.99 3iue h ARG 200 CO -0.05 0.01 -0.01 1.88 0.10 0.00 0.00 179.97 181.89 3iue h TYR 201 N 0.00 0.00 -2.86 4.08 0.05 -1.71 -3.45 116.97 113.08 3iue h TYR 201 Ca -0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 3iue h TYR 201 Cb 0.29 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.05 3iue h TYR 201 CO 0.00 0.01 0.85 -0.51 -1.05 0.00 0.00 178.16 177.46 3iue s LEU 202 N -6.22 4.36 1.00 3.88 1.43 -0.82 -5.02 118.68 117.30 3iue s LEU 202 Ca 0.04 2.41 -0.13 0.00 -1.03 0.00 0.00 54.13 55.41 3iue s LEU 202 Cb 0.07 -3.58 0.19 0.00 0.03 0.00 0.00 46.19 42.90 3iue s LEU 202 CO 0.61 -0.77 1.12 1.51 0.23 0.00 0.00 176.35 179.05 3iue s ASP 203 N 1.56 2.66 0.31 2.29 1.47 -1.26 -4.62 116.67 119.06 3iue s ASP 203 Ca 0.68 1.00 -0.00 0.00 1.18 0.00 0.00 52.55 55.40 3iue s ASP 203 Cb -0.38 -1.56 0.50 0.00 -0.34 0.00 0.00 42.92 41.14 3iue s ASP 203 CO 0.30 -3.09 1.95 -0.65 0.68 0.00 0.00 175.17 174.36 3iue h PRO 204 N -1.87 1.02 -0.50 2.11 0.11 -1.98 0.40 132.00 131.30 3iue h PRO 204 Ca -0.52 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.44 3iue h PRO 204 Cb 1.33 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3iue h PRO 204 CO 0.56 0.68 -0.04 0.00 -0.21 0.00 0.00 178.00 178.98 3iue h ALA 205 N 1.51 0.68 -0.38 -0.75 0.00 -1.99 -0.93 119.26 117.39 3iue h ALA 205 Ca 0.33 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3iue h ALA 205 Cb 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3iue h ALA 205 CO -0.10 0.52 -0.32 1.96 0.00 0.00 0.00 179.25 181.32 3iue h GLN 206 N 0.77 0.89 -0.83 0.00 4.20 -1.70 -0.69 115.11 117.75 3iue h GLN 206 Ca 0.14 -0.45 -0.03 0.00 0.06 0.00 0.00 58.65 58.37 3iue h GLN 206 Cb 0.58 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 3iue h GLN 206 CO 0.03 1.09 0.39 -0.09 -0.67 0.00 0.00 178.83 179.58 3iue h ARG 207 N 0.70 1.20 -0.35 1.46 9.65 -0.08 0.23 114.38 127.19 3iue h ARG 207 Ca 0.07 -0.18 -0.07 0.00 -1.10 0.00 0.00 59.98 58.70 3iue h ARG 207 Cb 0.90 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 29.26 3iue h ARG 207 CO 0.08 0.93 -0.04 0.00 2.80 0.00 0.00 179.97 183.75 3iue h ALA 208 N 1.21 0.47 -0.27 2.80 0.00 -1.08 -3.00 119.26 119.39 3iue h ALA 208 Ca 0.28 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3iue h ALA 208 Cb 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3iue h ALA 208 CO -0.03 0.27 -0.03 0.00 0.00 0.00 0.00 179.25 179.46 3iue h ALA 209 N 0.84 1.44 0.00 0.00 0.00 -0.60 -3.05 119.26 117.89 3iue h ALA 209 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3iue h ALA 209 Cb 0.51 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3iue h ALA 209 CO 0.03 0.39 -0.02 0.00 0.00 0.00 0.00 179.25 179.65 3iue h ALA 210 N 1.57 1.41 -0.29 0.00 0.00 -0.40 -1.30 119.26 120.25 3iue h ALA 210 Ca 0.09 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.06 3iue h ALA 210 Cb 0.32 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3iue h ALA 210 CO 0.01 0.03 0.31 0.28 0.00 0.00 0.00 179.25 179.88 3iue h VAL 211 N 0.00 0.44 0.00 0.00 2.07 -1.61 -2.49 116.25 114.67 3iue h VAL 211 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3iue h VAL 211 Cb 0.07 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3iue h VAL 211 CO 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.58 3iue h ALA 212 N 1.65 1.96 0.42 1.67 0.00 -1.45 -1.44 119.26 122.07 3iue h ALA 212 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3iue h ALA 212 Cb 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3iue h ALA 212 CO -0.00 0.02 -0.20 -0.07 0.00 0.00 0.00 179.25 178.99 3iue h LEU 213 N 0.00 -0.48 -0.45 0.00 4.07 -1.67 0.11 115.31 116.90 3iue h LEU 213 Ca -0.00 -0.06 -0.15 0.00 0.08 0.00 0.00 57.88 57.75 3iue h LEU 213 Cb 0.03 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 3iue h LEU 213 CO 0.00 -0.23 -0.31 0.77 -1.08 0.00 0.00 178.44 177.59 3iue h SER 214 N -0.71 1.01 -0.69 -0.43 4.64 -1.72 -2.25 113.55 113.40 3iue h SER 214 Ca -0.06 -0.42 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 3iue h SER 214 Cb 0.51 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 62.28 3iue h SER 214 CO 0.09 1.23 0.45 0.00 -0.87 0.00 0.00 176.83 177.73 3iue h ALA 215 N 0.83 0.89 -0.70 5.18 0.00 -1.26 -0.59 119.26 123.61 3iue h ALA 215 Ca 0.08 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3iue h ALA 215 Cb 0.89 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3iue h ALA 215 CO 0.08 0.28 0.33 0.00 0.00 0.00 0.00 179.25 179.94 3iue h ALA 216 N 1.26 0.90 -0.15 0.00 0.00 -0.63 -0.79 119.26 119.87 3iue h ALA 216 Ca 0.26 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 3iue h ALA 216 Cb -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.44 3iue h ALA 216 CO -0.07 0.48 -0.50 -0.07 0.00 0.00 0.00 179.25 179.09 3iue h LEU 217 N 0.98 0.69 -0.66 0.00 3.38 -0.79 -1.10 115.31 117.81 3iue h LEU 217 Ca 0.24 -0.61 -0.10 0.00 0.09 0.00 0.00 57.88 57.50 3iue h LEU 217 Cb 0.14 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3iue h LEU 217 CO -0.03 1.18 -0.06 0.00 0.09 0.00 0.00 178.44 179.62 3iue h THR 218 N 0.24 1.26 -0.32 0.22 1.03 -1.13 0.50 112.91 114.72 3iue h THR 218 Ca -0.02 -1.19 0.02 0.00 -0.01 0.00 0.00 66.41 65.20 3iue h THR 218 Cb 1.12 0.90 -0.02 0.00 -1.07 0.00 0.00 68.15 69.08 3iue h THR 218 CO 0.11 0.42 0.18 0.00 -0.01 0.00 0.00 175.52 176.21 3iue h ALA 219 N 1.03 0.39 -0.46 0.00 0.00 -1.07 -2.17 119.26 116.98 3iue h ALA 219 Ca 0.15 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.11 3iue h ALA 219 Cb 0.60 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3iue h ALA 219 CO 0.04 -0.19 0.18 0.00 0.00 0.00 0.00 179.25 179.28 3iue h ALA 220 N 1.15 0.56 -0.84 0.00 0.00 -0.74 0.71 119.26 120.11 3iue h ALA 220 Ca 0.13 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.19 3iue h ALA 220 Cb 0.02 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 3iue h ALA 220 CO -0.07 -0.20 0.54 0.00 0.00 0.00 0.00 179.25 179.52 3iue h ALA 221 N 1.29 1.73 0.04 0.00 0.00 -0.54 -1.93 119.26 119.85 3iue h ALA 221 Ca 0.21 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.85 3iue h ALA 221 Cb 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3iue h ALA 221 CO -0.20 0.10 -1.44 0.45 0.00 0.00 0.00 179.25 178.16 3iue h HIS 222 N 0.78 0.17 0.00 0.00 3.86 -0.80 -3.22 115.15 115.94 3iue h HIS 222 Ca 0.39 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 3iue h HIS 222 Cb 0.46 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.92 3iue h HIS 222 CO -0.00 1.15 0.00 0.00 0.86 0.00 0.00 177.93 179.94 3iue h ALA 223 N 0.80 1.00 0.00 2.45 0.00 -0.56 -3.31 119.26 119.63 3iue h ALA 223 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3iue h ALA 223 Cb 1.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.73 3iue h ALA 223 CO 0.12 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.37 3iue h ALA 224 N 2.01 1.00 -0.06 0.00 0.00 -1.37 -0.01 119.26 120.83 3iue h ALA 224 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3iue h ALA 224 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3iue h ALA 224 CO 0.00 0.00 0.06 1.79 0.00 0.00 0.00 179.25 181.10 3iue h THR 225 N 0.00 0.61 -0.25 0.00 1.35 -1.81 -1.21 112.91 111.59 3iue h THR 225 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3iue h THR 225 Cb 0.25 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 3iue h THR 225 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 3iue n ALA 226 N -2.38 2.49 0.00 6.62 0.00 -0.02 -4.94 120.51 122.28 3iue n ALA 226 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.78 3iue n ALA 226 Cb 0.16 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3iue n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iue n GLY 227 N 1.21 1.83 0.19 0.00 0.00 -0.46 -4.52 105.19 103.44 3iue n GLY 227 Ca 0.16 -2.03 -0.07 0.00 0.00 0.00 0.00 46.02 44.08 3iue n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iue h ALA 228 N 0.00 0.58 -0.54 4.61 0.00 -1.93 -1.46 119.26 120.51 3iue h ALA 228 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3iue h ALA 228 Cb 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3iue h ALA 228 CO 0.00 0.02 0.22 0.37 0.00 0.00 0.00 179.25 179.86 3iue h GLN 229 N 0.61 0.81 -1.00 0.00 5.75 -1.98 -1.42 115.11 117.90 3iue h GLN 229 Ca 0.17 -0.15 0.01 0.00 -0.15 0.00 0.00 58.65 58.53 3iue h GLN 229 Cb -0.07 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.30 3iue h GLN 229 CO -0.04 0.71 0.66 0.00 -2.65 0.00 0.00 178.83 177.51 3iue h ALA 230 N 1.06 1.30 0.20 3.38 0.00 -1.74 0.11 119.26 123.57 3iue h ALA 230 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3iue h ALA 230 Cb 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3iue h ALA 230 CO -0.01 0.64 -0.10 0.00 0.00 0.00 0.00 179.25 179.78 3iue h ALA 231 N 1.39 -0.27 -0.75 0.00 0.00 -0.74 0.23 119.26 119.12 3iue h ALA 231 Ca 0.37 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 3iue h ALA 231 Cb -0.13 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3iue h ALA 231 CO -0.09 -0.62 0.25 -0.07 0.00 0.00 0.00 179.25 178.72 3iue h LEU 232 N -0.33 1.08 -0.44 0.00 3.38 -1.05 -1.96 115.31 116.00 3iue h LEU 232 Ca -0.03 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 3iue h LEU 232 Cb 0.25 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3iue h LEU 232 CO 0.05 0.98 -0.08 0.44 0.09 0.00 0.00 178.44 179.92 3iue h ASP 233 N 1.11 0.83 -0.23 -0.43 3.32 -0.67 0.33 116.42 120.69 3iue h ASP 233 Ca 0.25 -0.35 0.03 0.00 0.02 0.00 0.00 57.03 56.98 3iue h ASP 233 Cb 0.28 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3iue h ASP 233 CO -0.01 0.99 0.03 0.00 -1.72 0.00 0.00 179.24 178.53 3iue h ALA 234 N 0.87 0.22 -0.33 3.45 0.00 -0.81 -0.69 119.26 121.98 3iue h ALA 234 Ca 0.11 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3iue h ALA 234 Cb 0.61 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3iue h ALA 234 CO 0.04 -0.39 0.18 0.00 0.00 0.00 0.00 179.25 179.08 3iue h ALA 235 N 1.17 0.40 -0.89 0.00 0.00 -1.14 -2.03 119.26 116.78 3iue h ALA 235 Ca 0.10 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3iue h ALA 235 Cb 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3iue h ALA 235 CO -0.15 -0.18 0.50 -0.09 0.00 0.00 0.00 179.25 179.33 3iue h ARG 236 N 0.37 1.23 -0.37 0.00 9.65 -0.73 -1.47 114.38 123.06 3iue h ARG 236 Ca 0.13 -0.14 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3iue h ARG 236 Cb 0.02 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 28.33 3iue h ARG 236 CO -0.07 0.89 0.23 0.00 2.80 0.00 0.00 179.97 183.82 3iue h ALA 237 N 1.27 0.47 -0.17 2.80 0.00 -0.67 0.15 119.26 123.11 3iue h ALA 237 Ca 0.31 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3iue h ALA 237 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3iue h ALA 237 CO -0.05 -0.04 0.10 0.28 0.00 0.00 0.00 179.25 179.54 3iue h VAL 238 N 0.49 1.08 -0.99 0.00 2.07 -1.01 -1.75 116.25 116.14 3iue h VAL 238 Ca 0.13 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.48 3iue h VAL 238 Cb -0.01 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 3iue h VAL 238 CO -0.03 0.08 0.65 -0.07 0.02 0.00 0.00 177.57 178.22 3iue h LEU 239 N 0.20 1.10 -2.40 2.57 3.38 -1.06 -2.15 115.31 116.95 3iue h LEU 239 Ca 0.06 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3iue h LEU 239 Cb 0.03 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 3iue h LEU 239 CO -0.01 0.77 -0.02 0.44 0.09 0.00 0.00 178.44 179.71 3iue h ASP 240 N 1.29 0.00 0.76 -0.43 3.32 -0.32 -1.88 116.42 119.16 3iue h ASP 240 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 3iue h ASP 240 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3iue h ASP 240 CO -0.11 0.02 -0.00 0.00 -1.72 0.00 0.00 179.24 177.43 3iue n ALA 241 N -2.15 2.42 -2.80 3.45 0.00 -0.69 -4.86 120.51 115.89 3iue n ALA 241 Ca -0.02 -0.13 -0.35 0.00 0.00 0.00 0.00 53.44 52.94 3iue n ALA 241 Cb 0.15 -1.48 -0.08 0.00 0.00 0.00 0.00 19.45 18.04 3iue n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iue s ALA 242 N -2.77 3.57 0.39 0.00 0.00 -0.71 -5.10 121.76 117.15 3iue s ALA 242 Ca 0.22 -0.71 -0.16 0.00 0.00 0.00 0.00 51.96 51.31 3iue s ALA 242 Cb 0.20 -1.89 -0.09 0.00 0.00 0.00 0.00 23.12 21.33 3iue s ALA 242 CO 0.49 0.39 0.83 -1.25 0.00 0.00 0.00 175.76 176.22 3iue s PRO 243 N -0.29 4.01 -1.62 0.00 0.04 -1.26 -4.21 135.00 131.66 3iue s PRO 243 Ca 0.09 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 61.90 3iue s PRO 243 Cb -0.12 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.11 3iue s PRO 243 CO 0.01 0.01 0.14 0.41 0.04 0.00 0.00 177.00 177.61 3iue n GLY 244 N -0.79 -0.50 3.11 0.56 0.00 -1.26 -4.87 105.19 101.44 3iue n GLY 244 Ca 0.05 0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 3iue n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iue s VAL 245 N -3.01 3.06 -0.61 1.61 1.01 -1.26 -4.36 120.40 116.84 3iue s VAL 245 Ca 0.07 -2.02 -0.20 0.00 0.00 0.00 0.00 61.98 59.83 3iue s VAL 245 Cb -0.03 -3.08 0.09 0.00 0.00 0.00 0.00 36.38 33.36 3iue s VAL 245 CO 0.09 -0.59 0.79 0.00 0.00 0.00 0.00 175.10 175.39 3iue s ALA 246 N 1.11 3.31 -0.12 5.51 0.00 -0.47 -4.93 121.76 126.18 3iue s ALA 246 Ca 0.07 -2.07 -0.30 0.00 0.00 0.00 0.00 51.96 49.66 3iue s ALA 246 Cb -0.22 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.24 3iue s ALA 246 CO -0.04 -2.48 1.29 0.08 0.00 0.00 0.00 175.76 174.60 3iue s VAL 247 N 3.17 4.17 -0.09 0.00 1.01 -1.26 -1.13 120.40 126.26 3iue s VAL 247 Ca 0.15 1.45 -0.12 0.00 0.00 0.00 0.00 61.98 63.46 3iue s VAL 247 Cb -0.21 -3.94 -0.28 0.00 0.00 0.00 0.00 36.38 31.95 3iue s VAL 247 CO 0.08 -0.09 0.53 0.44 0.00 0.00 0.00 175.10 176.06 3iue h ASP 248 N 8.09 0.45 -5.05 3.32 5.19 -1.02 -3.48 116.42 123.92 3iue h ASP 248 Ca -0.30 -0.89 -0.06 0.00 -0.62 0.00 0.00 57.03 55.15 3iue h ASP 248 Cb 1.13 -0.15 -0.15 0.00 0.18 0.00 0.00 39.33 40.34 3iue h ASP 248 CO 0.94 1.74 -0.06 -0.72 -3.12 0.00 0.00 179.24 178.02 3iue s TYR 249 N -2.53 -0.27 -0.25 4.55 -0.85 -1.16 -5.00 117.35 111.84 3iue s TYR 249 Ca -0.20 0.12 -0.03 0.00 -0.52 0.00 0.00 57.07 56.45 3iue s TYR 249 Cb 0.05 0.26 0.11 0.00 0.38 0.00 0.00 41.96 42.76 3iue s TYR 249 CO 0.79 -0.65 0.21 -1.17 -1.52 0.00 0.00 175.55 173.21 3iue s LEU 250 N -2.36 0.06 -0.05 -3.49 2.96 -1.26 -1.95 118.68 112.59 3iue s LEU 250 Ca -0.02 -0.71 0.02 0.00 -0.22 0.00 0.00 54.13 53.21 3iue s LEU 250 Cb 0.00 0.18 0.01 0.00 0.50 0.00 0.00 46.19 46.88 3iue s LEU 250 CO -0.07 -0.38 -0.10 -1.61 -1.32 0.00 0.00 176.35 172.88 3iue s GLU 251 N 2.26 1.31 -0.27 1.98 0.41 -0.26 -4.98 118.70 119.15 3iue s GLU 251 Ca 0.08 -0.33 -0.10 0.00 -0.41 0.00 0.00 54.97 54.21 3iue s GLU 251 Cb -0.15 -1.15 -0.05 0.00 -1.78 0.00 0.00 34.13 31.00 3iue s GLU 251 CO -0.25 0.04 0.16 -1.17 -0.49 0.00 0.00 175.26 173.55 3iue s LEU 252 N 0.56 3.90 0.31 1.80 2.96 -1.26 -0.49 118.68 126.47 3iue s LEU 252 Ca -0.10 -0.04 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 3iue s LEU 252 Cb -0.13 -2.08 -0.06 0.00 0.50 0.00 0.00 46.19 44.42 3iue s LEU 252 CO 0.02 -0.03 0.07 -0.13 -1.32 0.00 0.00 176.35 174.95 3iue s ARG 253 N 1.66 1.61 1.04 1.98 1.81 -0.33 -4.25 118.95 122.47 3iue s ARG 253 Ca 0.07 -1.89 -0.15 0.00 -1.72 0.00 0.00 55.73 52.03 3iue s ARG 253 Cb -0.16 -0.75 0.21 0.00 -0.45 0.00 0.00 34.95 33.80 3iue s ARG 253 CO 0.09 -0.21 1.14 0.16 -0.68 0.00 0.00 175.30 175.80 3iue s ASP 254 N -3.46 2.32 0.53 0.23 1.47 -0.20 -0.95 116.67 116.61 3iue s ASP 254 Ca 0.37 0.80 0.28 0.00 1.18 0.00 0.00 52.55 55.18 3iue s ASP 254 Cb 0.09 -1.21 1.51 0.00 -0.34 0.00 0.00 42.92 42.97 3iue s ASP 254 CO 0.15 -3.27 2.10 0.16 0.68 0.00 0.00 175.17 174.99 3iue h ILE 255 N -2.00 0.56 -0.43 2.11 3.07 -1.84 0.82 117.51 119.81 3iue h ILE 255 Ca -0.49 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 65.48 3iue h ILE 255 Cb 1.31 1.28 0.00 0.00 -0.27 0.00 0.00 36.82 39.14 3iue h ILE 255 CO 0.48 0.10 0.00 0.61 -1.05 0.00 0.00 178.15 178.29 3iue n GLY 256 N -0.80 1.18 2.29 0.16 0.00 -1.26 -4.94 105.19 101.82 3iue n GLY 256 Ca -0.02 -0.54 -0.01 0.00 0.00 0.00 0.00 46.02 45.45 3iue n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iue n LEU 257 N 0.90 0.20 0.00 0.99 4.77 0.28 -5.04 117.00 119.10 3iue n LEU 257 Ca 0.17 0.02 -0.04 0.00 -0.03 0.00 0.00 56.01 56.13 3iue n LEU 257 Cb 0.42 -1.13 0.03 0.00 -2.33 0.00 0.00 43.42 40.41 3iue n LEU 257 CO 0.12 -0.31 0.10 0.61 -1.33 0.00 0.00 177.39 176.58 3iue n GLY 258 N -1.83 -1.92 3.78 -0.72 0.00 -1.26 -4.74 105.19 98.49 3iue n GLY 258 Ca -0.01 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 3iue n GLY 258 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3iue s PRO 259 N -3.37 4.18 0.11 1.61 0.02 -1.26 -1.04 135.00 135.26 3iue s PRO 259 Ca 0.10 2.47 -0.31 0.00 0.02 0.00 0.00 61.00 63.28 3iue s PRO 259 Cb -0.01 -3.00 -0.09 0.00 0.02 0.00 0.00 34.50 31.42 3iue s PRO 259 CO 0.07 -0.44 1.66 1.41 -0.33 0.00 0.00 177.00 179.37 3iue s MET 260 N -1.94 4.19 0.59 5.54 1.75 -1.26 -3.77 119.30 124.39 3iue s MET 260 Ca 0.52 2.40 -0.17 0.00 -1.25 0.00 0.00 55.69 57.19 3iue s MET 260 Cb -0.45 -3.43 -0.04 0.00 2.84 0.00 0.00 34.83 33.75 3iue s MET 260 CO 0.60 -0.71 1.07 -1.25 -0.65 0.00 0.00 175.02 174.08 3iue s PRO 261 N 2.12 3.28 0.35 4.11 0.04 -1.26 -4.90 135.00 138.73 3iue s PRO 261 Ca 0.74 1.31 0.13 0.00 0.04 0.00 0.00 61.00 63.22 3iue s PRO 261 Cb -0.42 -2.02 0.96 0.00 0.04 0.00 0.00 34.50 33.05 3iue s PRO 261 CO 0.33 -0.86 1.76 -0.07 0.04 0.00 0.00 177.00 178.20 3iue h LEU 262 N 0.59 0.59 -8.71 -3.56 3.38 -1.96 -3.41 115.31 102.23 3iue h LEU 262 Ca -0.48 0.11 -0.29 0.00 0.09 0.00 0.00 57.88 57.31 3iue h LEU 262 Cb 1.23 0.01 -0.15 0.00 0.09 0.00 0.00 40.66 41.84 3iue h LEU 262 CO 0.57 0.12 -0.64 0.54 0.09 0.00 0.00 178.44 179.13 3iue s ASN 263 N -5.27 0.94 0.00 -0.43 4.22 -1.26 -4.88 114.94 108.26 3iue s ASN 263 Ca -0.10 -1.29 0.00 0.00 -2.14 0.00 0.00 52.86 49.33 3iue s ASN 263 Cb 0.26 0.20 0.00 0.00 1.28 0.00 0.00 41.25 42.99 3iue s ASN 263 CO 0.80 -0.69 0.00 0.61 -2.04 0.00 0.00 177.10 175.77 3iue n GLY 264 N -0.32 -0.52 3.83 0.45 0.00 0.70 -4.94 105.19 104.39 3iue n GLY 264 Ca -0.02 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 3iue n GLY 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iue s SER 265 N -4.00 6.92 0.15 1.61 0.01 -1.26 -0.90 113.70 116.22 3iue s SER 265 Ca 0.00 1.39 -0.02 0.00 1.31 0.00 0.00 55.95 58.63 3iue s SER 265 Cb 0.00 -2.41 0.01 0.00 0.21 0.00 0.00 66.02 63.82 3iue s SER 265 CO 0.00 -0.13 0.23 0.61 0.41 0.00 0.00 173.24 174.36 3iue n GLY 266 N 0.03 2.44 2.86 3.44 0.00 0.64 -4.08 105.19 110.52 3iue n GLY 266 Ca 0.02 -1.39 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 3iue n GLY 266 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iue s ARG 267 N -2.26 0.16 -0.22 1.61 6.06 -0.13 -1.61 118.95 122.56 3iue s ARG 267 Ca 0.11 0.01 -0.07 0.00 -2.50 0.00 0.00 55.73 53.28 3iue s ARG 267 Cb -0.01 -0.25 -0.03 0.00 0.06 0.00 0.00 34.95 34.72 3iue s ARG 267 CO 0.08 -0.04 0.05 -1.17 -2.50 0.00 0.00 175.30 171.72 3iue s LEU 268 N 0.40 3.47 -0.03 -0.88 2.96 -0.02 -1.18 118.68 123.40 3iue s LEU 268 Ca -0.04 -0.14 0.06 0.00 -0.22 0.00 0.00 54.13 53.79 3iue s LEU 268 Cb -0.06 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 3iue s LEU 268 CO -0.01 0.04 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.11 3iue s LEU 269 N 1.17 2.46 0.05 -0.68 1.02 0.36 -1.15 118.68 121.90 3iue s LEU 269 Ca 0.04 -0.33 0.03 0.00 0.02 0.00 0.00 54.13 53.90 3iue s LEU 269 Cb -0.14 -1.47 -0.02 0.00 0.02 0.00 0.00 46.19 44.58 3iue s LEU 269 CO 0.03 0.33 -0.10 0.54 0.02 0.00 0.00 176.35 177.16 3iue s VAL 270 N -0.71 0.79 -0.00 -1.59 0.11 -0.41 -1.10 120.40 117.48 3iue s VAL 270 Ca 0.11 -1.04 -0.01 0.00 -2.93 0.00 0.00 61.98 58.11 3iue s VAL 270 Cb -0.10 -0.78 -0.00 0.00 -1.53 0.00 0.00 36.38 33.96 3iue s VAL 270 CO 0.00 -0.22 0.03 0.00 -3.33 0.00 0.00 175.10 171.58 3iue s ALA 271 N -1.13 -0.05 0.02 1.54 0.00 -0.82 -1.85 121.76 119.46 3iue s ALA 271 Ca -0.04 -0.08 -0.18 0.00 0.00 0.00 0.00 51.96 51.66 3iue s ALA 271 Cb -0.09 0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.07 3iue s ALA 271 CO 0.01 -0.06 0.39 0.00 0.00 0.00 0.00 175.76 176.10 3iue s ALA 272 N -0.42 -0.96 -0.19 0.00 0.00 -0.52 -0.30 121.76 119.38 3iue s ALA 272 Ca -0.05 0.37 -0.08 0.00 0.00 0.00 0.00 51.96 52.20 3iue s ALA 272 Cb -0.03 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 3iue s ALA 272 CO -0.00 -0.38 0.07 1.03 0.00 0.00 0.00 175.76 176.49 3iue s ARG 273 N -1.98 3.99 -0.31 0.00 0.52 -0.28 -0.16 118.95 120.72 3iue s ARG 273 Ca -0.09 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 54.80 3iue s ARG 273 Cb -0.02 -3.26 0.07 0.00 0.52 0.00 0.00 34.95 32.26 3iue s ARG 273 CO 0.01 0.24 0.01 -0.51 0.02 0.00 0.00 175.30 175.07 3iue s LEU 274 N 0.46 4.17 0.00 2.53 1.02 0.76 -1.37 118.68 126.26 3iue s LEU 274 Ca 0.04 -1.63 0.00 0.00 0.02 0.00 0.00 54.13 52.56 3iue s LEU 274 Cb -0.12 -1.66 0.00 0.00 0.02 0.00 0.00 46.19 44.42 3iue s LEU 274 CO 0.00 -0.31 0.00 0.61 0.02 0.00 0.00 176.35 176.67 3iue n GLY 275 N 4.48 3.60 1.01 -3.19 0.00 -1.26 -1.48 105.19 108.35 3iue n GLY 275 Ca -0.08 0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3iue n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iue n THR 276 N 0.00 0.68 -3.78 2.61 -2.24 -1.26 -4.93 114.28 105.36 3iue n THR 276 Ca 0.00 -0.84 -0.36 0.00 -2.27 0.00 0.00 64.05 60.58 3iue n THR 276 Cb 0.00 0.79 -0.11 0.00 -2.10 0.00 0.00 70.33 68.91 3iue n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3iue s THR 277 N -1.20 4.86 -0.16 4.28 2.01 -0.55 -5.07 115.64 119.81 3iue s THR 277 Ca 0.35 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 62.19 3iue s THR 277 Cb 0.20 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 3iue s THR 277 CO 0.27 0.36 0.44 -0.60 -0.69 0.00 0.00 174.62 174.39 3iue s ARG 278 N 1.16 4.25 0.13 4.92 3.52 -1.26 -0.17 118.95 131.51 3iue s ARG 278 Ca 0.06 0.33 0.10 0.00 -0.13 0.00 0.00 55.73 56.08 3iue s ARG 278 Cb -0.14 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 3iue s ARG 278 CO 0.04 0.05 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.88 3iue s LEU 279 N 0.99 2.62 0.07 -0.88 1.43 0.77 -4.98 118.68 118.69 3iue s LEU 279 Ca 0.22 -0.63 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 3iue s LEU 279 Cb -0.15 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 3iue s LEU 279 CO 0.09 0.17 -0.10 -0.76 0.23 0.00 0.00 176.35 175.97 3iue s LEU 280 N -2.23 2.30 0.17 1.79 1.43 -1.26 -1.43 118.68 119.45 3iue s LEU 280 Ca 0.18 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.49 3iue s LEU 280 Cb -0.10 -0.31 0.02 0.00 0.03 0.00 0.00 46.19 45.83 3iue s LEU 280 CO 0.10 -0.18 0.42 -0.62 0.23 0.00 0.00 176.35 176.29 3iue s ASP 281 N -1.87 -0.15 0.17 2.29 -1.08 -0.77 -4.86 116.67 110.39 3iue s ASP 281 Ca -0.03 -0.57 -0.19 0.00 -0.52 0.00 0.00 52.55 51.24 3iue s ASP 281 Cb -0.08 0.51 0.04 0.00 -1.46 0.00 0.00 42.92 41.93 3iue s ASP 281 CO 0.01 -0.95 0.52 0.54 0.52 0.00 0.00 175.17 175.80 3iue s ASN 282 N -2.89 -0.35 -0.05 -0.34 2.20 -1.26 -1.29 114.94 110.96 3iue s ASN 282 Ca 0.10 -0.28 -0.17 0.00 -0.94 0.00 0.00 52.86 51.57 3iue s ASN 282 Cb 0.01 0.56 0.03 0.00 -2.00 0.00 0.00 41.25 39.85 3iue s ASN 282 CO -0.04 -0.98 0.39 -0.51 -2.94 0.00 0.00 177.10 173.02 3iue s ILE 283 N -3.81 0.04 0.31 0.54 2.07 -0.30 -4.98 121.20 115.06 3iue s ILE 283 Ca 0.05 -0.31 -0.30 0.00 -1.41 0.00 0.00 60.65 58.68 3iue s ILE 283 Cb -0.00 -0.67 -0.12 0.00 0.13 0.00 0.00 42.46 41.80 3iue s ILE 283 CO -0.09 -0.17 1.58 0.00 -1.91 0.00 0.00 174.94 174.36 3iue n ALA 284 N 1.51 2.53 -3.09 1.50 0.00 -1.26 -0.84 120.51 120.86 3iue n ALA 284 Ca -0.20 0.37 -0.21 0.00 0.00 0.00 0.00 53.44 53.40 3iue n ALA 284 Cb 0.56 -2.46 -0.16 0.00 0.00 0.00 0.00 19.45 17.40 3iue n ALA 284 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3iue s ILE 285 N -0.16 0.84 -0.16 0.00 -1.09 -0.63 -4.80 121.20 115.21 3iue s ILE 285 Ca 0.62 -0.38 0.01 0.00 -2.23 0.00 0.00 60.65 58.68 3iue s ILE 285 Cb -0.49 -0.75 0.01 0.00 -1.58 0.00 0.00 42.46 39.64 3iue s ILE 285 CO 0.51 0.26 -0.20 -1.61 -1.23 0.00 0.00 174.94 172.68 3iue s GLU 286 N 0.26 3.07 -0.29 2.79 0.41 -1.26 -0.26 118.70 123.41 3iue s GLU 286 Ca -0.05 -0.82 -0.03 0.00 -0.41 0.00 0.00 54.97 53.67 3iue s GLU 286 Cb -0.10 -2.53 0.04 0.00 -1.78 0.00 0.00 34.13 29.77 3iue s GLU 286 CO 0.01 -0.06 0.00 0.42 -0.49 0.00 0.00 175.26 175.14 3iue s ILE 287 N 0.95 3.14 -2.00 -1.63 -1.09 -0.08 -4.59 121.20 115.90 3iue s ILE 287 Ca -0.03 -1.22 0.29 0.00 -2.23 0.00 0.00 60.65 57.46 3iue s ILE 287 Cb -0.15 -2.74 0.83 0.00 -1.58 0.00 0.00 42.46 38.82 3iue s ILE 287 CO -0.04 -0.03 2.07 0.61 -1.23 0.00 0.00 174.94 176.32