#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iue s PRO 4 N 0.00 0.48 0.33 6.28 0.04 -1.26 -5.00 135.00 135.87 3iue s PRO 4 Ca 0.00 0.04 -0.29 0.00 0.04 0.00 0.00 61.00 60.80 3iue s PRO 4 Cb 0.00 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.65 3iue s PRO 4 CO 0.00 -2.59 1.31 0.00 0.04 0.00 0.00 177.00 175.75 3iue s ALA 5 N -3.36 3.50 -0.13 8.56 0.00 -1.26 -4.95 121.76 124.12 3iue s ALA 5 Ca 0.68 1.26 -0.01 0.00 0.00 0.00 0.00 51.96 53.88 3iue s ALA 5 Cb -0.11 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.57 3iue s ALA 5 CO 0.54 -0.64 -0.02 0.12 0.00 0.00 0.00 175.76 175.76 3iue s PHE 6 N -1.11 1.19 -0.39 0.00 5.36 -1.26 -5.05 117.98 116.72 3iue s PHE 6 Ca 0.49 -0.67 -0.13 0.00 -0.96 0.00 0.00 56.93 55.67 3iue s PHE 6 Cb -0.40 -1.07 0.03 0.00 -0.34 0.00 0.00 43.02 41.24 3iue s PHE 6 CO 0.52 -0.50 0.25 -1.01 -1.46 0.00 0.00 175.22 173.02 3iue s HIS 7 N 1.80 3.24 0.69 10.12 3.76 -1.26 -5.08 115.29 128.57 3iue s HIS 7 Ca 0.03 -0.83 -0.16 0.00 -0.15 0.00 0.00 55.06 53.95 3iue s HIS 7 Cb -0.14 -2.51 0.02 0.00 1.11 0.00 0.00 32.58 31.06 3iue s HIS 7 CO -0.07 -0.63 1.20 -2.14 -0.85 0.00 0.00 174.74 172.25 3iue s PRO 8 N 1.60 2.38 0.00 8.40 0.02 -1.26 -2.73 135.00 143.42 3iue s PRO 8 Ca 0.03 1.74 0.00 0.00 0.02 0.00 0.00 61.00 62.79 3iue s PRO 8 Cb -0.19 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.46 3iue s PRO 8 CO 0.08 -1.64 0.00 0.41 -0.33 0.00 0.00 177.00 175.52 3iue n GLY 9 N 0.31 0.99 3.52 0.52 0.00 -1.26 -4.98 105.19 104.30 3iue n GLY 9 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.26 1.77 -0.35 1.61 2.02 -1.10 -5.03 118.70 117.35 3iue s GLU 10 Ca 0.00 -1.92 -0.23 0.00 0.02 0.00 0.00 54.97 52.84 3iue s GLU 10 Cb 0.00 -1.54 0.01 0.00 0.10 0.00 0.00 34.13 32.70 3iue s GLU 10 CO 0.00 0.08 0.79 -1.17 0.02 0.00 0.00 175.26 174.98 3iue s LEU 11 N -3.58 4.12 -0.27 1.80 2.96 -1.25 -4.20 118.68 118.26 3iue s LEU 11 Ca 0.32 0.41 -0.10 0.00 -0.22 0.00 0.00 54.13 54.54 3iue s LEU 11 Cb 0.04 -3.04 -0.05 0.00 0.50 0.00 0.00 46.19 43.64 3iue s LEU 11 CO 0.16 -0.72 0.17 0.20 -1.32 0.00 0.00 176.35 174.84 3iue s ASN 12 N 1.81 5.89 -0.24 3.68 0.01 -0.21 -4.99 114.94 120.89 3iue s ASN 12 Ca 0.32 -0.03 -0.07 0.00 -0.71 0.00 0.00 52.86 52.37 3iue s ASN 12 Cb -0.13 -2.09 -0.03 0.00 0.41 0.00 0.00 41.25 39.41 3iue s ASN 12 CO 0.16 -0.04 0.05 -0.69 -1.51 0.00 0.00 177.10 175.07 3iue s VAL 13 N 1.67 4.16 -0.04 1.60 1.01 -1.26 -1.08 120.40 126.47 3iue s VAL 13 Ca 0.07 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 61.89 3iue s VAL 13 Cb -0.16 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 3iue s VAL 13 CO 0.09 0.36 -0.24 -0.31 0.00 0.00 0.00 175.10 175.00 3iue s TYR 14 N 1.49 2.42 -0.19 5.22 2.02 -0.34 -4.99 117.35 122.98 3iue s TYR 14 Ca 0.06 -0.55 0.13 0.00 -0.37 0.00 0.00 57.07 56.34 3iue s TYR 14 Cb -0.15 -1.56 -0.21 0.00 -0.40 0.00 0.00 41.96 39.64 3iue s TYR 14 CO 0.02 -0.11 0.01 -1.13 -1.57 0.00 0.00 175.55 172.78 3iue n SER 15 N 2.69 0.85 -4.69 2.29 3.41 -1.26 -0.58 113.62 116.33 3iue n SER 15 Ca -0.17 -0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 3iue n SER 15 Cb 0.52 0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 65.14 3iue n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3iue s ALA 16 N -2.44 3.38 0.28 7.33 0.00 -1.26 -3.94 121.76 125.11 3iue s ALA 16 Ca -0.13 0.31 0.02 0.00 0.00 0.00 0.00 51.96 52.17 3iue s ALA 16 Cb 0.06 -3.33 0.63 0.00 0.00 0.00 0.00 23.12 20.49 3iue s ALA 16 CO 0.70 -0.50 1.77 -1.35 0.00 0.00 0.00 175.76 176.39 3iue h PRO 17 N 7.06 0.70 -0.84 0.00 0.11 -1.92 -1.75 132.00 135.35 3iue h PRO 17 Ca -0.33 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.75 3iue h PRO 17 Cb 1.16 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 3iue h PRO 17 CO 0.82 0.46 0.55 0.78 -0.21 0.00 0.00 178.00 180.41 3iue h GLY 18 N 0.72 1.19 0.97 -0.55 0.00 -1.96 -1.13 103.07 102.30 3iue h GLY 18 Ca 0.52 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 3iue h GLY 18 CO -0.37 0.40 -0.03 -0.55 0.00 0.00 0.00 176.54 175.99 3iue h ASP 19 N 1.09 -0.07 0.07 0.19 5.19 -1.72 -1.19 116.42 119.98 3iue h ASP 19 Ca 0.32 -0.03 -0.12 0.00 -0.62 0.00 0.00 57.03 56.59 3iue h ASP 19 Cb -0.05 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 3iue h ASP 19 CO -0.08 -0.02 -0.39 1.62 -3.12 0.00 0.00 179.24 177.25 3iue h VAL 20 N -0.11 1.30 -0.34 -1.35 3.04 -1.34 -1.91 116.25 115.54 3iue h VAL 20 Ca -0.01 -1.51 -0.01 0.00 -1.01 0.00 0.00 66.70 64.16 3iue h VAL 20 Cb 0.09 1.58 -0.02 0.00 -2.01 0.00 0.00 31.29 30.93 3iue h VAL 20 CO 0.01 0.47 0.17 0.00 -1.01 0.00 0.00 177.57 177.20 3iue h ALA 21 N 1.24 0.44 -0.11 3.17 0.00 -1.07 0.11 119.26 123.03 3iue h ALA 21 Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3iue h ALA 21 Cb 0.84 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3iue h ALA 21 CO 0.07 0.00 0.04 -0.44 0.00 0.00 0.00 179.25 178.93 3iue h ASP 22 N 0.42 0.16 -0.44 0.00 3.32 -1.10 -1.17 116.42 117.61 3iue h ASP 22 Ca 0.12 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3iue h ASP 22 Cb 0.12 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 3iue h ASP 22 CO -0.01 0.28 0.20 0.58 -1.72 0.00 0.00 179.24 178.57 3iue h VAL 23 N 0.02 1.19 -0.23 -1.35 2.07 -1.19 -0.82 116.25 115.93 3iue h VAL 23 Ca 0.04 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.04 3iue h VAL 23 Cb 0.17 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3iue h VAL 23 CO -0.00 0.20 0.10 -1.28 0.02 0.00 0.00 177.57 176.62 3iue h SER 24 N 0.56 0.15 -0.59 0.57 0.87 -0.71 -0.01 113.55 114.38 3iue h SER 24 Ca 0.15 0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.62 3iue h SER 24 Cb 0.14 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 3iue h SER 24 CO -0.02 0.12 -0.02 0.03 -0.53 0.00 0.00 176.83 176.41 3iue h ARG 25 N 0.23 1.06 -0.52 2.24 3.08 -1.01 -0.42 114.38 119.04 3iue h ARG 25 Ca 0.10 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 3iue h ARG 25 Cb 0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3iue h ARG 25 CO -0.08 1.05 0.29 0.00 -1.07 0.00 0.00 179.97 180.16 3iue h ALA 26 N 1.00 0.67 -0.40 0.04 0.00 -0.93 -1.67 119.26 117.96 3iue h ALA 26 Ca 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3iue h ALA 26 Cb 0.58 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3iue h ALA 26 CO 0.03 0.18 0.20 -0.07 0.00 0.00 0.00 179.25 179.59 3iue h LEU 27 N 0.70 0.53 -1.11 0.00 3.38 -0.58 -2.61 115.31 115.61 3iue h LEU 27 Ca 0.18 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3iue h LEU 27 Cb 0.03 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 3iue h LEU 27 CO -0.03 0.50 0.42 -0.09 0.09 0.00 0.00 178.44 179.33 3iue h ARG 28 N 0.51 1.03 0.00 1.13 2.43 -0.89 -1.93 114.38 116.67 3iue h ARG 28 Ca 0.14 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3iue h ARG 28 Cb 0.12 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3iue h ARG 28 CO -0.02 0.75 0.00 -0.07 -1.51 0.00 0.00 179.97 179.12 3iue h LEU 29 N 1.04 0.00 -2.43 3.80 3.38 -1.09 -1.90 115.31 118.12 3iue h LEU 29 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3iue h LEU 29 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3iue h LEU 29 CO -0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.84 3iue n THR 30 N -2.58 0.87 -0.16 0.22 -2.24 -0.76 -4.96 114.28 104.67 3iue n THR 30 Ca 0.02 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 3iue n THR 30 Cb 0.27 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 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 1.55 0.69 3.76 3.38 0.00 -0.71 -5.06 105.19 108.80 3iue n GLY 31 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 3iue n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iue s ARG 32 N -0.74 4.70 -0.09 1.61 1.81 -0.99 -5.00 118.95 120.26 3iue s ARG 32 Ca 0.00 1.67 -0.13 0.00 -1.72 0.00 0.00 55.73 55.54 3iue s ARG 32 Cb 0.00 -3.18 -0.05 0.00 -0.45 0.00 0.00 34.95 31.27 3iue s ARG 32 CO 0.00 0.31 0.33 1.03 -0.68 0.00 0.00 175.30 176.29 3iue s ARG 33 N -1.41 4.00 -0.23 3.54 0.52 -1.04 -3.89 118.95 120.43 3iue s ARG 33 Ca 0.44 0.21 -0.12 0.00 -0.52 0.00 0.00 55.73 55.74 3iue s ARG 33 Cb -0.29 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.82 3iue s ARG 33 CO 0.37 0.49 0.25 0.08 0.02 0.00 0.00 175.30 176.51 3iue s VAL 34 N -0.36 5.30 -0.14 3.52 1.01 -1.26 -0.68 120.40 127.78 3iue s VAL 34 Ca 0.20 0.37 -0.03 0.00 0.00 0.00 0.00 61.98 62.52 3iue s VAL 34 Cb -0.14 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 3iue s VAL 34 CO 0.08 0.31 -0.06 -0.04 0.00 0.00 0.00 175.10 175.39 3iue s MET 35 N 1.19 3.56 -0.16 2.72 1.00 -0.10 -0.23 119.30 127.28 3iue s MET 35 Ca 0.12 -0.55 -0.04 0.00 0.00 0.00 0.00 55.69 55.22 3iue s MET 35 Cb -0.14 -2.84 -0.03 0.00 0.00 0.00 0.00 34.83 31.82 3iue s MET 35 CO 0.06 0.27 -0.03 -1.17 0.00 0.00 0.00 175.02 174.14 3iue s LEU 36 N 0.28 3.26 -0.43 -0.03 2.96 -0.46 0.13 118.68 124.39 3iue s LEU 36 Ca -0.04 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.74 3iue s LEU 36 Cb -0.14 -1.79 0.12 0.00 0.50 0.00 0.00 46.19 44.87 3iue s LEU 36 CO 0.03 0.16 0.19 -0.69 -1.32 0.00 0.00 176.35 174.73 3iue s VAL 37 N 0.40 2.91 -0.13 1.68 1.01 -0.23 -0.89 120.40 125.14 3iue s VAL 37 Ca -0.04 -2.46 -0.21 0.00 0.00 0.00 0.00 61.98 59.27 3iue s VAL 37 Cb -0.14 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3iue s VAL 37 CO 0.03 -0.70 0.60 -2.16 0.00 0.00 0.00 175.10 172.87 3iue s PRO 38 N 0.69 4.33 0.22 2.72 0.05 -1.26 -1.71 135.00 140.04 3iue s PRO 38 Ca 0.12 0.65 0.02 0.00 0.05 0.00 0.00 61.00 61.84 3iue s PRO 38 Cb -0.22 -3.49 -0.05 0.00 0.05 0.00 0.00 34.50 30.80 3iue s PRO 38 CO -0.05 -0.01 0.03 0.95 0.05 0.00 0.00 177.00 177.98 3iue s THR 39 N 1.12 0.73 -0.25 1.26 -4.23 0.20 -4.94 115.64 109.53 3iue s THR 39 Ca 0.31 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.95 3iue s THR 39 Cb -0.16 -2.36 0.63 0.00 1.34 0.00 0.00 72.50 71.95 3iue s THR 39 CO 0.13 -0.28 1.59 0.23 -0.54 0.00 0.00 174.62 175.75 3iue n MET 40 N -0.37 3.26 0.00 3.99 2.81 -1.26 -2.00 117.12 123.55 3iue n MET 40 Ca -0.04 -3.01 0.00 0.00 -1.81 0.00 0.00 57.70 52.84 3iue n MET 40 Cb 0.64 -2.01 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 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 -0.36 -1.56 3.63 3.03 0.00 -1.26 -4.54 105.19 104.14 3iue n GLY 41 Ca 0.30 -1.32 -0.24 0.00 0.00 0.00 0.00 46.02 44.76 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 1.60 -2.28 -1.77 4.61 0.00 -1.26 -4.87 120.51 116.55 3iue n ALA 42 Ca 0.00 -0.15 -0.39 0.00 0.00 0.00 0.00 53.44 52.90 3iue n ALA 42 Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 19.45 16.11 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 -6.40 4.39 0.00 0.00 1.43 -1.26 -4.66 118.68 112.18 3iue s LEU 43 Ca 0.24 2.32 0.05 0.00 -1.03 0.00 0.00 54.13 55.71 3iue s LEU 43 Cb -0.07 -3.80 -0.02 0.00 0.03 0.00 0.00 46.19 42.33 3iue s LEU 43 CO 0.82 -0.38 0.19 0.00 0.23 0.00 0.00 176.35 177.21 3iue n HIS 44 N 0.69 -0.12 0.29 0.29 1.44 -1.26 -4.91 115.22 111.64 3iue n HIS 44 Ca 0.01 -2.73 0.16 0.00 -2.01 0.00 0.00 57.72 53.15 3iue n HIS 44 Cb 0.45 0.08 0.94 0.00 0.12 0.00 0.00 29.99 31.58 3iue n HIS 44 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3iue h GLU 45 N 0.00 0.00 -0.33 -1.40 4.57 -1.98 -0.58 114.58 114.86 3iue h GLU 45 Ca -0.30 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 57.84 3iue h GLU 45 Cb 1.24 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.82 3iue h GLU 45 CO 0.47 0.00 0.07 0.78 -1.18 0.00 0.00 179.01 179.15 3iue h GLY 46 N 0.00 0.58 1.01 1.92 0.00 -1.96 0.62 103.07 105.25 3iue h GLY 46 Ca 0.01 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 46.97 3iue h GLY 46 CO -0.00 0.35 0.58 0.45 0.00 0.00 0.00 176.54 177.92 3iue h HIS 47 N 0.38 1.11 -0.23 5.60 3.86 -1.54 -2.64 115.15 121.69 3iue h HIS 47 Ca 0.10 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.30 3iue h HIS 47 Cb 0.33 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 3iue h HIS 47 CO 0.02 0.70 -0.03 -0.07 0.86 0.00 0.00 177.93 179.41 3iue h LEU 48 N 1.20 0.31 -1.02 2.43 3.38 -0.80 -1.00 115.31 119.81 3iue h LEU 48 Ca 0.32 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 3iue h LEU 48 Cb -0.14 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3iue h LEU 48 CO -0.07 0.39 0.57 0.00 0.09 0.00 0.00 178.44 179.42 3iue h ALA 49 N 1.65 1.27 -0.25 1.53 0.00 -0.54 0.61 119.26 123.53 3iue h ALA 49 Ca 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3iue h ALA 49 Cb 0.27 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3iue h ALA 49 CO 0.01 0.64 0.11 -0.07 0.00 0.00 0.00 179.25 179.94 3iue h LEU 50 N 1.27 0.33 -0.34 0.00 3.38 -0.92 -1.41 115.31 117.62 3iue h LEU 50 Ca 0.33 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.18 3iue h LEU 50 Cb -0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3iue h LEU 50 CO -0.07 0.39 0.16 0.58 0.09 0.00 0.00 178.44 179.59 3iue h VAL 51 N 0.26 0.97 -0.62 1.22 2.07 -0.96 -0.88 116.25 118.32 3iue h VAL 51 Ca 0.08 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3iue h VAL 51 Cb 0.15 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3iue h VAL 51 CO -0.01 0.06 0.30 0.03 0.02 0.00 0.00 177.57 177.97 3iue h ARG 52 N 0.33 0.87 -0.39 1.57 3.08 -0.74 0.16 114.38 119.27 3iue h ARG 52 Ca 0.15 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3iue h ARG 52 Cb 0.07 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3iue h ARG 52 CO -0.11 0.68 0.16 0.00 -1.07 0.00 0.00 179.97 179.63 3iue h ALA 53 N 1.46 0.50 -0.43 0.04 0.00 -0.83 -2.09 119.26 117.91 3iue h ALA 53 Ca 0.22 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3iue h ALA 53 Cb 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3iue h ALA 53 CO -0.03 0.09 0.26 0.00 0.00 0.00 0.00 179.25 179.58 3iue h ALA 54 N 1.01 0.55 -0.19 0.00 0.00 -0.56 -2.78 119.26 117.28 3iue h ALA 54 Ca 0.13 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3iue h ALA 54 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iue h ALA 54 CO -0.01 0.04 0.13 0.87 0.00 0.00 0.00 179.25 180.28 3iue h LYS 55 N 0.57 0.12 0.00 0.00 1.79 -0.43 -2.47 116.57 116.15 3iue h LYS 55 Ca 0.15 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.62 3iue h LYS 55 Cb -0.01 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.62 3iue h LYS 55 CO -0.03 0.08 -0.01 0.00 -1.08 0.00 0.00 179.45 178.41 3iue h ARG 56 N 0.12 0.00 -6.26 3.15 3.08 -1.09 -3.44 114.38 109.95 3iue h ARG 56 Ca 0.08 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.58 3iue h ARG 56 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3iue h ARG 56 CO -0.01 0.01 0.94 0.08 -1.07 0.00 0.00 179.97 179.92 3iue s VAL 57 N -3.73 3.85 0.01 2.04 1.01 -0.93 -4.92 120.40 117.73 3iue s VAL 57 Ca 0.00 1.11 -0.35 0.00 0.00 0.00 0.00 61.98 62.74 3iue s VAL 57 Cb 0.09 -3.71 -0.14 0.00 0.00 0.00 0.00 36.38 32.62 3iue s VAL 57 CO 0.53 -0.07 1.64 -2.65 0.00 0.00 0.00 175.10 174.55 3iue n PRO 58 N 6.37 1.80 -1.04 2.72 -0.02 -1.26 -1.47 135.00 142.10 3iue n PRO 58 Ca 0.15 0.65 -0.01 0.00 -2.02 0.00 0.00 63.50 62.27 3iue n PRO 58 Cb 0.44 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 3iue n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iue n GLY 59 N 3.62 0.49 3.76 -1.23 0.00 -1.26 -4.74 105.19 105.83 3iue n GLY 59 Ca 0.20 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.30 5.89 -0.10 1.61 1.04 -0.54 -2.51 113.70 116.79 3iue s SER 60 Ca 0.00 2.59 0.01 0.00 0.48 0.00 0.00 55.95 59.03 3iue s SER 60 Cb 0.00 -2.63 -0.02 0.00 0.10 0.00 0.00 66.02 63.48 3iue s SER 60 CO 0.00 -1.13 -0.14 0.54 0.98 0.00 0.00 173.24 173.49 3iue s VAL 61 N -1.37 3.03 -0.21 5.02 0.11 0.14 -4.86 120.40 122.26 3iue s VAL 61 Ca 0.64 -0.69 -0.07 0.00 -2.93 0.00 0.00 61.98 58.93 3iue s VAL 61 Cb -0.36 -2.24 -0.04 0.00 -1.53 0.00 0.00 36.38 32.22 3iue s VAL 61 CO 0.44 0.55 0.06 -0.69 -3.33 0.00 0.00 175.10 172.13 3iue s VAL 62 N -0.03 4.55 -0.25 2.04 1.01 -1.26 -0.93 120.40 125.53 3iue s VAL 62 Ca -0.03 -0.11 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 3iue s VAL 62 Cb -0.14 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 3iue s VAL 62 CO 0.04 0.41 0.08 -0.69 0.00 0.00 0.00 175.10 174.93 3iue s VAL 63 N 0.89 4.34 -0.23 2.92 1.01 0.12 -2.49 120.40 126.97 3iue s VAL 63 Ca 0.03 -0.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 3iue s VAL 63 Cb -0.14 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 3iue s VAL 63 CO 0.03 0.32 0.07 -0.69 0.00 0.00 0.00 175.10 174.82 3iue s VAL 64 N 1.62 4.47 -0.09 2.92 1.01 0.04 -1.07 120.40 129.30 3iue s VAL 64 Ca 0.06 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 3iue s VAL 64 Cb -0.15 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3iue s VAL 64 CO 0.04 0.38 0.22 -0.94 0.00 0.00 0.00 175.10 174.79 3iue s SER 65 N 1.20 6.51 -0.18 3.32 1.04 -0.69 -0.56 113.70 124.34 3iue s SER 65 Ca 0.05 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.09 3iue s SER 65 Cb -0.14 -2.12 0.04 0.00 0.10 0.00 0.00 66.02 63.89 3iue s SER 65 CO 0.03 0.38 -0.08 -0.63 0.98 0.00 0.00 173.24 173.92 3iue s ILE 66 N -1.02 1.39 -0.29 -1.02 1.01 -0.28 -0.63 121.20 120.36 3iue s ILE 66 Ca 0.17 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 3iue s ILE 66 Cb -0.13 -1.49 0.14 0.00 0.01 0.00 0.00 42.46 40.98 3iue s ILE 66 CO 0.07 0.18 0.60 0.12 0.00 0.00 0.00 174.94 175.91 3iue s PHE 67 N 1.51 -1.34 -0.60 3.97 5.36 -0.85 -4.21 117.98 121.84 3iue s PHE 67 Ca 0.00 2.05 -0.26 0.00 -0.96 0.00 0.00 56.93 57.77 3iue s PHE 67 Cb -0.15 0.67 0.04 0.00 -0.34 0.00 0.00 43.02 43.24 3iue s PHE 67 CO -0.08 -0.70 1.09 0.08 -1.46 0.00 0.00 175.22 174.15 3iue s VAL 68 N 2.85 4.14 -0.47 3.12 1.01 -1.26 -4.34 120.40 125.44 3iue s VAL 68 Ca 0.02 0.49 -0.29 0.00 0.00 0.00 0.00 61.98 62.20 3iue s VAL 68 Cb -0.13 -4.68 0.03 0.00 0.00 0.00 0.00 36.38 31.60 3iue s VAL 68 CO -0.19 -1.34 1.12 0.21 0.00 0.00 0.00 175.10 174.90 3iue s ASN 69 N 3.08 6.63 0.58 3.32 2.47 -1.26 -4.91 114.94 124.86 3iue s ASN 69 Ca 0.35 0.46 0.30 0.00 0.42 0.00 0.00 52.86 54.39 3iue s ASN 69 Cb -0.10 -2.54 1.78 0.00 -1.45 0.00 0.00 41.25 38.94 3iue s ASN 69 CO 0.20 -1.22 2.23 -0.65 -3.72 0.00 0.00 177.10 173.94 3iue h PRO 70 N 9.17 0.00 0.00 0.43 0.11 -1.96 -3.07 132.00 136.68 3iue h PRO 70 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3iue h PRO 70 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3iue h PRO 70 CO 1.12 0.02 0.00 -1.33 -0.21 0.00 0.00 178.00 177.60 3iue n MET 71 N -3.77 0.01 -0.19 1.05 2.81 -1.26 -2.37 117.12 113.41 3iue n MET 71 Ca -0.03 0.03 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 3iue n MET 71 Cb 0.11 -1.51 0.24 0.00 -0.71 0.00 0.00 33.22 31.35 3iue n MET 71 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3iue n GLN 72 N -1.53 2.41 -4.19 0.03 10.64 -1.16 -4.17 117.38 119.41 3iue n GLN 72 Ca 0.07 -2.14 -0.25 0.00 -1.83 0.00 0.00 57.00 52.85 3iue n GLN 72 Cb 0.33 -1.50 -0.07 0.00 -0.86 0.00 0.00 30.24 28.14 3iue n GLN 72 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3iue s PHE 73 N -1.51 2.90 0.46 2.61 0.40 -1.00 -4.69 117.98 117.15 3iue s PHE 73 Ca 0.38 -0.14 0.04 0.00 -0.60 0.00 0.00 56.93 56.62 3iue s PHE 73 Cb 0.22 -1.36 -0.05 0.00 0.51 0.00 0.00 43.02 42.35 3iue s PHE 73 CO 0.31 0.54 0.01 0.20 0.70 0.00 0.00 175.22 176.98 3iue s GLY 74 N -3.29 2.77 0.65 4.36 0.00 -1.26 -5.03 107.32 105.51 3iue s GLY 74 Ca 0.30 -1.34 -0.17 0.00 0.00 0.00 0.00 44.72 43.50 3iue s GLY 74 CO 0.21 -2.15 0.53 0.00 0.00 0.00 0.00 173.10 171.68 3iue n ALA 75 N -1.12 -1.32 0.00 3.20 0.00 -1.26 -4.42 120.51 115.59 3iue n ALA 75 Ca -0.12 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3iue n ALA 75 Cb 0.67 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.28 3iue n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iue n GLY 76 N 1.73 0.38 0.00 0.00 0.00 -1.26 -4.82 105.19 101.22 3iue n GLY 76 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3iue n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iue n GLY 77 N 0.00 0.39 0.37 -0.02 0.00 -1.26 -4.97 105.19 99.70 3iue n GLY 77 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3iue n GLY 77 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3iue h ASP 78 N 0.00 1.04 -0.19 1.61 5.19 -1.88 -1.33 116.42 120.86 3iue h ASP 78 Ca 0.00 -0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.37 3iue h ASP 78 Cb 0.00 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.27 3iue h ASP 78 CO 0.00 0.71 -0.01 0.25 -3.12 0.00 0.00 179.24 177.06 3iue h LEU 79 N 1.20 0.33 -1.26 1.55 5.85 -1.93 -2.10 115.31 118.95 3iue h LEU 79 Ca 0.38 -0.33 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 3iue h LEU 79 Cb 0.02 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 3iue h LEU 79 CO -0.12 0.58 -0.32 0.44 -0.34 0.00 0.00 178.44 178.69 3iue h ASP 80 N 0.08 0.09 1.74 1.25 3.32 -1.90 -2.95 116.42 118.05 3iue h ASP 80 Ca 0.05 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3iue h ASP 80 Cb 0.42 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3iue h ASP 80 CO 0.01 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 177.94 3iue h ALA 81 N 1.60 1.00 -2.30 3.45 0.00 -1.09 -3.47 119.26 118.45 3iue h ALA 81 Ca 0.01 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.34 3iue h ALA 81 Cb 0.60 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.47 3iue h ALA 81 CO 0.04 0.00 0.69 0.98 0.00 0.00 0.00 179.25 180.96 3iue n TYR 82 N -2.86 2.21 -1.92 0.00 9.36 -0.81 -4.86 117.16 118.28 3iue n TYR 82 Ca 0.04 0.37 -0.41 0.00 3.32 0.00 0.00 57.90 61.22 3iue n TYR 82 Cb 0.48 -2.49 -0.02 0.00 -0.63 0.00 0.00 39.34 36.67 3iue n TYR 82 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3iue s PRO 83 N 0.12 4.21 -0.14 2.98 0.04 -1.26 -4.99 135.00 135.95 3iue s PRO 83 Ca 0.72 2.41 -0.01 0.00 0.04 0.00 0.00 61.00 64.17 3iue s PRO 83 Cb -0.66 -3.07 0.04 0.00 0.04 0.00 0.00 34.50 30.84 3iue s PRO 83 CO 0.45 -0.50 -0.05 1.03 0.04 0.00 0.00 177.00 177.97 3iue s ARG 84 N -0.49 1.31 -0.43 4.56 0.52 -1.26 -4.46 118.95 118.70 3iue s ARG 84 Ca 0.61 -0.37 0.09 0.00 -0.52 0.00 0.00 55.73 55.54 3iue s ARG 84 Cb -0.44 -1.78 0.32 0.00 0.52 0.00 0.00 34.95 33.56 3iue s ARG 84 CO 0.46 -0.39 0.71 0.25 0.02 0.00 0.00 175.30 176.35 3iue n THR 85 N 4.94 0.39 -0.28 0.02 -2.24 -1.26 -5.00 114.28 110.86 3iue n THR 85 Ca -0.11 -4.65 0.01 0.00 -2.27 0.00 0.00 64.05 57.03 3iue n THR 85 Cb 0.49 -0.99 0.14 0.00 -2.10 0.00 0.00 70.33 67.87 3iue n THR 85 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3iue h PRO 86 N 3.33 0.78 -0.15 -0.78 0.11 -1.99 -0.48 132.00 132.82 3iue h PRO 86 Ca 0.10 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3iue h PRO 86 Cb 0.85 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 3iue h PRO 86 CO 0.56 0.52 0.00 -0.44 -0.21 0.00 0.00 178.00 178.43 3iue h ASP 87 N 0.80 0.25 -0.64 -2.05 3.32 -2.00 -2.00 116.42 114.10 3iue h ASP 87 Ca 0.36 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 3iue h ASP 87 Cb 0.26 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 3iue h ASP 87 CO -0.21 0.49 0.32 0.44 -1.72 0.00 0.00 179.24 178.56 3iue h ASP 88 N 0.00 0.83 0.18 6.45 3.32 -1.91 -2.26 116.42 123.02 3iue h ASP 88 Ca 0.04 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 56.99 3iue h ASP 88 Cb 0.36 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 3iue h ASP 88 CO 0.01 0.71 -0.41 0.44 -1.72 0.00 0.00 179.24 178.27 3iue h ASP 89 N 0.88 -1.18 -0.35 6.45 3.32 -0.88 -0.88 116.42 123.78 3iue h ASP 89 Ca 0.22 0.12 -0.06 0.00 0.02 0.00 0.00 57.03 57.33 3iue h ASP 89 Cb 0.09 0.43 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 3iue h ASP 89 CO -0.03 -0.49 0.01 -0.07 -1.72 0.00 0.00 179.24 176.94 3iue h LEU 90 N -0.68 0.68 -0.36 1.55 3.38 -1.38 -2.09 115.31 116.41 3iue h LEU 90 Ca 0.01 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.87 3iue h LEU 90 Cb 0.68 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3iue h LEU 90 CO -0.20 0.74 0.13 0.00 0.09 0.00 0.00 178.44 179.20 3iue h ALA 91 N 1.34 0.43 -0.96 1.53 0.00 -1.08 -1.59 119.26 118.92 3iue h ALA 91 Ca 0.14 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.11 3iue h ALA 91 Cb 0.40 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 3iue h ALA 91 CO 0.01 -0.26 0.63 1.96 0.00 0.00 0.00 179.25 181.60 3iue h GLN 92 N 0.29 1.23 -0.39 0.00 4.20 -0.75 -1.77 115.11 117.92 3iue h GLN 92 Ca 0.17 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.71 3iue h GLN 92 Cb 0.14 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 3iue h GLN 92 CO -0.17 0.82 -0.10 -0.07 -0.67 0.00 0.00 178.83 178.64 3iue h LEU 93 N 1.27 0.75 -0.29 1.46 3.38 -0.97 -1.73 115.31 119.18 3iue h LEU 93 Ca 0.36 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 58.00 3iue h LEU 93 Cb -0.10 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 3iue h LEU 93 CO -0.09 0.94 0.09 0.03 0.09 0.00 0.00 178.44 179.50 3iue h ARG 94 N 0.55 0.20 -0.89 1.13 3.08 -1.15 -1.91 114.38 115.41 3iue h ARG 94 Ca 0.10 -0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.24 3iue h ARG 94 Cb 0.61 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.55 3iue h ARG 94 CO 0.04 0.14 0.57 0.00 -1.07 0.00 0.00 179.97 179.65 3iue h ALA 95 N 1.20 1.68 -0.00 0.04 0.00 -1.11 -1.95 119.26 119.11 3iue h ALA 95 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3iue h ALA 95 Cb 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3iue h ALA 95 CO -0.15 0.13 -0.03 0.39 0.00 0.00 0.00 179.25 179.59 3iue n GLU 96 N -4.54 1.05 -1.08 0.00 -0.58 -0.67 -4.91 120.64 109.91 3iue n GLU 96 Ca 0.16 -0.32 -0.03 0.00 -0.42 0.00 0.00 57.16 56.55 3iue n GLU 96 Cb 0.34 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.70 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 1.14 0.59 3.73 0.62 0.00 -0.73 -5.00 105.19 105.55 3iue n GLY 97 Ca 0.19 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.07 2.39 -0.20 1.61 1.01 -0.76 -4.93 120.40 117.44 3iue s VAL 98 Ca 0.00 0.29 0.22 0.00 0.00 0.00 0.00 61.98 62.50 3iue s VAL 98 Cb 0.00 -3.19 -0.14 0.00 0.00 0.00 0.00 36.38 33.05 3iue s VAL 98 CO 0.00 0.03 0.83 -0.62 0.00 0.00 0.00 175.10 175.34 3iue n GLU 99 N 3.28 0.59 -3.94 2.72 1.02 -1.25 -3.88 120.64 119.18 3iue n GLU 99 Ca 0.12 -0.01 -0.21 0.00 -0.02 0.00 0.00 57.16 57.04 3iue n GLU 99 Cb 0.38 -1.69 -0.17 0.00 -0.02 0.00 0.00 31.44 29.94 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 -3.41 0.39 -0.09 -3.67 1.01 -1.04 -1.04 121.20 113.35 3iue s ILE 100 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.66 3iue s ILE 100 Cb 0.12 -0.49 -0.03 0.00 0.01 0.00 0.00 42.46 42.07 3iue s ILE 100 CO 0.84 0.23 -0.09 0.00 0.00 0.00 0.00 174.94 175.91 3iue s ALA 101 N 1.42 2.87 -0.24 9.38 0.00 -0.24 -0.78 121.76 134.17 3iue s ALA 101 Ca -0.03 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.04 3iue s ALA 101 Cb -0.13 -1.24 0.04 0.00 0.00 0.00 0.00 23.12 21.79 3iue s ALA 101 CO -0.03 0.44 -0.11 0.12 0.00 0.00 0.00 175.76 176.19 3iue s PHE 102 N -0.37 3.11 -0.57 0.00 5.36 0.27 -1.20 117.98 124.59 3iue s PHE 102 Ca 0.05 -1.96 0.07 0.00 -0.96 0.00 0.00 56.93 54.12 3iue s PHE 102 Cb -0.12 -1.97 0.25 0.00 -0.34 0.00 0.00 43.02 40.83 3iue s PHE 102 CO 0.02 -0.82 0.69 0.25 -1.46 0.00 0.00 175.22 173.90 3iue n THR 103 N 4.54 1.50 -1.65 0.12 -2.24 0.25 -1.12 114.28 115.68 3iue n THR 103 Ca -0.16 -4.88 -0.32 0.00 -2.27 0.00 0.00 64.05 56.41 3iue n THR 103 Cb 0.45 -2.05 0.05 0.00 -2.10 0.00 0.00 70.33 66.68 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 -2.12 2.73 0.50 -0.78 0.04 -1.25 -4.42 135.00 129.69 3iue s PRO 104 Ca 0.39 1.28 -0.09 0.00 0.04 0.00 0.00 61.00 62.62 3iue s PRO 104 Cb 0.16 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.70 3iue s PRO 104 CO -0.04 -1.29 0.85 0.95 0.04 0.00 0.00 177.00 177.52 3iue s THR 105 N -2.54 4.80 0.23 1.26 -4.23 -1.26 -4.91 115.64 108.98 3iue s THR 105 Ca 0.64 0.55 -0.08 0.00 -1.18 0.00 0.00 61.69 61.63 3iue s THR 105 Cb -0.19 -3.82 0.19 0.00 1.34 0.00 0.00 72.50 70.03 3iue s THR 105 CO 0.45 -0.82 1.87 0.74 -0.54 0.00 0.00 174.62 176.33 3iue h THR 106 N 0.38 1.14 -0.41 3.99 2.02 -1.96 -2.02 112.91 116.05 3iue h THR 106 Ca -0.46 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 3iue h THR 106 Cb 1.20 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 3iue h THR 106 CO 0.62 0.19 0.12 0.00 0.37 0.00 0.00 175.52 176.83 3iue h ALA 107 N 1.34 1.45 -0.09 6.16 0.00 -1.94 0.34 119.26 126.52 3iue h ALA 107 Ca 0.33 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 3iue h ALA 107 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3iue h ALA 107 CO -0.11 0.41 -0.63 0.00 0.00 0.00 0.00 179.25 178.91 3iue h ALA 108 N 1.55 0.74 0.15 0.00 0.00 -1.81 -2.33 119.26 117.57 3iue h ALA 108 Ca 0.14 -0.56 -0.31 0.00 0.00 0.00 0.00 54.91 54.18 3iue h ALA 108 Cb 0.18 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.90 3iue h ALA 108 CO -0.01 0.73 -1.46 0.52 0.00 0.00 0.00 179.25 179.03 3iue h MET 109 N 0.25 0.32 -1.95 0.00 2.86 -0.86 -3.40 114.93 112.15 3iue h MET 109 Ca -0.01 -0.54 -0.54 0.00 -2.06 0.00 0.00 59.70 56.54 3iue h MET 109 Cb 1.17 0.20 -0.41 0.00 0.06 0.00 0.00 31.60 32.62 3iue h MET 109 CO 0.11 1.22 -0.84 0.66 1.06 0.00 0.00 176.91 179.11 3iue n TYR 110 N -3.53 2.79 0.28 -0.22 4.01 0.11 -4.89 117.16 115.71 3iue n TYR 110 Ca -0.15 -3.67 0.15 0.00 -0.16 0.00 0.00 57.90 54.07 3iue n TYR 110 Cb 1.05 -0.38 0.83 0.00 -0.31 0.00 0.00 39.34 40.52 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 2.91 0.00 -0.40 -0.72 0.13 -1.62 -1.79 132.00 130.50 3iue h PRO 111 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3iue h PRO 111 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3iue h PRO 111 CO 0.72 0.07 0.00 -0.25 -0.23 0.00 0.00 178.00 178.32 3iue n ASP 112 N -3.58 3.96 0.00 1.44 8.00 -1.26 -5.09 116.55 120.02 3iue n ASP 112 Ca -0.02 -2.58 0.00 0.00 0.71 0.00 0.00 54.79 52.90 3iue n ASP 112 Cb 0.19 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 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 0.26 0.81 3.65 0.44 0.00 -0.68 -4.57 105.19 105.11 3iue n GLY 113 Ca 0.20 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 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 4.08 0.00 0.99 1.43 -1.26 -4.89 118.68 119.03 3iue s LEU 114 Ca 0.00 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 3iue s LEU 114 Cb 0.00 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.78 3iue s LEU 114 CO 0.00 -0.65 0.00 -1.14 0.23 0.00 0.00 176.35 174.79 3iue n ARG 115 N 6.28 0.00 -2.48 1.70 0.63 -1.26 -5.06 116.66 116.47 3iue n ARG 115 Ca 0.10 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.62 3iue n ARG 115 Cb 0.47 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.34 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 0.94 3.81 0.22 5.15 2.01 -1.26 -5.02 115.64 121.49 3iue s THR 116 Ca 0.00 1.53 -0.00 0.00 0.31 0.00 0.00 61.69 63.53 3iue s THR 116 Cb 0.00 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 3iue s THR 116 CO 0.00 0.25 0.12 0.42 -0.69 0.00 0.00 174.62 174.72 3iue s THR 117 N -0.11 0.23 -0.15 -0.82 -4.23 -1.26 -5.11 115.64 104.19 3iue s THR 117 Ca 0.51 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.84 3iue s THR 117 Cb -0.30 -2.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.94 3iue s THR 117 CO 0.35 -0.00 0.45 -0.69 -0.54 0.00 0.00 174.62 174.18 3iue s VAL 118 N -3.99 5.20 -0.47 2.29 1.01 -1.26 -5.05 120.40 118.12 3iue s VAL 118 Ca 0.39 0.86 -0.16 0.00 0.00 0.00 0.00 61.98 63.07 3iue s VAL 118 Cb 0.07 -3.78 0.07 0.00 0.00 0.00 0.00 36.38 32.74 3iue s VAL 118 CO 0.13 0.30 0.42 -1.58 0.00 0.00 0.00 175.10 174.37 3iue s GLN 119 N 0.84 3.00 0.90 2.72 2.00 -1.26 -4.54 119.66 123.32 3iue s GLN 119 Ca 0.23 -1.26 -0.12 0.00 -2.00 0.00 0.00 55.36 52.21 3iue s GLN 119 Cb -0.15 -4.12 0.13 0.00 0.80 0.00 0.00 33.01 29.68 3iue s GLN 119 CO 0.09 -1.03 1.09 -2.14 -0.50 0.00 0.00 175.29 172.80 3iue s PRO 120 N 1.78 1.19 1.02 1.67 0.02 -1.26 -5.05 135.00 134.36 3iue s PRO 120 Ca 0.06 0.79 -0.17 0.00 0.02 0.00 0.00 61.00 61.70 3iue s PRO 120 Cb -0.23 -1.80 0.26 0.00 0.02 0.00 0.00 34.50 32.74 3iue s PRO 120 CO 0.08 -2.28 0.85 0.41 -0.33 0.00 0.00 177.00 175.72 3iue n GLY 121 N -1.12 -2.91 0.32 0.52 0.00 -1.26 -4.86 105.19 95.88 3iue n GLY 121 Ca 0.07 -1.45 0.17 0.00 0.00 0.00 0.00 46.02 44.81 3iue n GLY 121 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iue h PRO 122 N 0.00 0.00 -0.37 1.61 0.11 -2.03 -1.60 132.00 129.72 3iue h PRO 122 Ca -0.33 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.89 3iue h PRO 122 Cb 1.02 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3iue h PRO 122 CO 0.21 0.00 0.27 1.25 -0.21 0.00 0.00 178.00 179.52 3iue h LEU 123 N 0.00 0.00 -0.63 2.35 5.85 -1.94 -1.77 115.31 119.17 3iue h LEU 123 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3iue h LEU 123 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3iue h LEU 123 CO -0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 3iue n ALA 124 N -2.61 1.55 0.76 1.25 0.00 -0.60 -1.98 120.51 118.87 3iue n ALA 124 Ca 0.06 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.69 3iue n ALA 124 Cb 0.46 -1.33 0.25 0.00 0.00 0.00 0.00 19.45 18.82 3iue n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iue n ALA 125 N -1.71 2.46 -2.54 0.00 0.00 -0.66 -4.02 120.51 114.04 3iue n ALA 125 Ca 0.02 -0.78 -0.24 0.00 0.00 0.00 0.00 53.44 52.43 3iue n ALA 125 Cb 0.18 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.62 3iue n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3iue s GLU 126 N -1.71 2.11 5.19 0.00 2.02 -0.84 -2.91 118.70 122.57 3iue s GLU 126 Ca 0.35 -1.71 0.00 0.00 0.02 0.00 0.00 54.97 53.63 3iue s GLU 126 Cb 0.21 -1.96 0.00 0.00 0.10 0.00 0.00 34.13 32.48 3iue s GLU 126 CO 0.30 0.15 0.00 1.28 0.02 0.00 0.00 175.26 177.01 3iue n LEU 127 N -0.96 0.00 0.19 1.80 4.77 -1.26 -0.97 117.00 120.56 3iue n LEU 127 Ca -0.04 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.99 3iue n LEU 127 Cb 0.62 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.22 3iue n LEU 127 CO 0.43 0.00 0.98 -0.33 -1.33 0.00 0.00 177.39 177.13 3iue h GLU 128 N 0.00 0.11 0.00 3.23 4.39 -1.93 -2.58 114.58 117.80 3iue h GLU 128 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3iue h GLU 128 Cb 0.00 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 3iue h GLU 128 CO 0.00 0.19 -0.14 0.41 -1.16 0.00 0.00 179.01 178.31 3iue n GLY 129 N -1.19 -1.62 0.32 -3.84 0.00 -0.15 -4.07 105.19 94.64 3iue n GLY 129 Ca -0.02 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 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 4.57 -1.28 0.53 -0.02 0.00 -1.33 -2.25 103.07 103.29 3iue h GLY 130 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 47.33 48.08 3iue h GLY 130 CO 0.00 -0.30 -0.02 -1.05 0.00 0.00 0.00 176.54 175.17 3iue n PRO 131 N -4.60 1.14 -3.28 4.80 -0.02 -1.26 -4.45 135.00 127.33 3iue n PRO 131 Ca -0.03 -0.35 -0.25 0.00 -2.02 0.00 0.00 63.50 60.86 3iue n PRO 131 Cb 0.24 -1.49 -0.07 0.00 -0.02 0.00 0.00 33.50 32.16 3iue n PRO 131 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3iue n ARG 132 N -0.62 1.34 0.20 -0.52 1.74 -0.85 -5.01 116.66 112.94 3iue n ARG 132 Ca 0.20 -3.73 0.14 0.00 -0.77 0.00 0.00 57.85 53.69 3iue n ARG 132 Cb 0.22 -1.59 0.73 0.00 -1.02 0.00 0.00 32.46 30.80 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 4.09 0.00 -0.13 5.56 0.13 -1.77 -2.09 132.00 137.80 3iue h PRO 133 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3iue h PRO 133 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3iue h PRO 133 CO 0.59 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.61 3iue n THR 134 N -4.25 0.19 0.12 1.56 -2.24 -1.26 -4.68 114.28 103.72 3iue n THR 134 Ca 0.01 -0.59 -0.13 0.00 -2.27 0.00 0.00 64.05 61.06 3iue n THR 134 Cb 0.25 1.23 -0.07 0.00 -2.10 0.00 0.00 70.33 69.65 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 3.68 -0.37 0.00 4.78 6.17 -1.65 -1.68 115.15 126.08 3iue h HIS 135 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 60.37 60.96 3iue h HIS 135 Cb 0.81 0.14 -0.02 0.00 2.52 0.00 0.00 27.41 30.87 3iue h HIS 135 CO 0.07 -0.22 -0.57 0.74 0.71 0.00 0.00 177.93 178.67 3iue h PHE 136 N -0.32 0.00 -0.90 5.26 0.04 -1.83 -1.68 116.94 117.51 3iue h PHE 136 Ca -0.00 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.80 3iue h PHE 136 Cb 0.30 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.40 3iue h PHE 136 CO -0.12 0.57 0.58 0.00 -0.60 0.00 0.00 178.31 178.74 3iue h ALA 137 N 1.43 1.17 -0.49 2.45 0.00 -1.75 0.13 119.26 122.21 3iue h ALA 137 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3iue h ALA 137 Cb 1.06 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3iue h ALA 137 CO 0.07 0.47 0.21 0.78 0.00 0.00 0.00 179.25 180.78 3iue h GLY 138 N 1.15 0.77 0.80 0.00 0.00 -0.57 -1.58 103.07 103.64 3iue h GLY 138 Ca 0.35 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3iue h GLY 138 CO -0.10 0.38 -0.06 -2.08 0.00 0.00 0.00 176.54 174.68 3iue h VAL 139 N 0.65 0.98 -0.31 4.60 2.07 -0.93 -2.15 116.25 121.16 3iue h VAL 139 Ca 0.16 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 3iue h VAL 139 Cb 0.16 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 3iue h VAL 139 CO -0.02 0.10 -0.05 -0.07 0.02 0.00 0.00 177.57 177.56 3iue h LEU 140 N -0.38 0.46 -0.07 2.57 3.38 -0.73 -0.86 115.31 119.70 3iue h LEU 140 Ca -0.02 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3iue h LEU 140 Cb 0.30 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3iue h LEU 140 CO 0.03 0.57 0.02 0.74 0.09 0.00 0.00 178.44 179.89 3iue h THR 141 N 0.47 1.17 -0.36 0.22 2.02 -1.21 0.26 112.91 115.47 3iue h THR 141 Ca 0.10 -0.50 -0.12 0.00 0.77 0.00 0.00 66.41 66.66 3iue h THR 141 Cb 0.38 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 3iue h THR 141 CO 0.02 0.14 -0.27 1.62 0.37 0.00 0.00 175.52 177.39 3iue h VAL 142 N -0.07 1.28 -0.66 3.16 3.04 -1.09 -2.04 116.25 119.86 3iue h VAL 142 Ca 0.02 -1.40 -0.08 0.00 -1.01 0.00 0.00 66.70 64.23 3iue h VAL 142 Cb 0.20 1.29 -0.03 0.00 -2.01 0.00 0.00 31.29 30.75 3iue h VAL 142 CO -0.00 0.46 0.08 0.58 -1.01 0.00 0.00 177.57 177.68 3iue h VAL 143 N 0.64 1.27 -0.40 1.51 2.07 -1.05 -0.70 116.25 119.60 3iue h VAL 143 Ca 0.08 -1.07 0.03 0.00 0.82 0.00 0.00 66.70 66.55 3iue h VAL 143 Cb 0.79 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3iue h VAL 143 CO 0.07 0.40 0.21 0.25 0.02 0.00 0.00 177.57 178.52 3iue h LEU 144 N 1.04 0.32 -0.43 2.57 5.85 -0.75 -0.73 115.31 123.17 3iue h LEU 144 Ca 0.20 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3iue h LEU 144 Cb 0.47 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3iue h LEU 144 CO 0.02 0.23 0.28 0.11 -0.34 0.00 0.00 178.44 178.74 3iue h LYS 145 N 0.43 0.57 -0.55 1.25 1.57 -0.97 -1.36 116.57 117.50 3iue h LYS 145 Ca 0.16 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 3iue h LYS 145 Cb 0.05 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3iue h LYS 145 CO -0.10 0.40 0.01 -0.07 -0.57 0.00 0.00 179.45 179.12 3iue h LEU 146 N 0.58 0.91 -0.99 2.94 3.38 -0.79 0.04 115.31 121.38 3iue h LEU 146 Ca 0.16 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 3iue h LEU 146 Cb -0.05 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 3iue h LEU 146 CO -0.03 0.96 0.24 -0.07 0.09 0.00 0.00 178.44 179.63 3iue h LEU 147 N 0.87 0.89 -0.26 1.67 3.38 -0.85 -0.99 115.31 120.02 3iue h LEU 147 Ca 0.16 -0.13 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 3iue h LEU 147 Cb 0.50 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3iue h LEU 147 CO 0.02 0.81 -0.88 1.56 0.09 0.00 0.00 178.44 180.04 3iue h GLN 148 N 0.94 0.28 -0.04 1.13 1.08 -0.60 0.28 115.11 118.19 3iue h GLN 148 Ca 0.22 -0.30 -0.02 0.00 -1.45 0.00 0.00 58.65 57.10 3iue h GLN 148 Cb 0.21 0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3iue h GLN 148 CO -0.02 1.00 -0.03 0.82 -0.95 0.00 0.00 178.83 179.65 3iue h ILE 149 N 0.16 1.35 0.01 2.54 2.04 -0.81 -3.34 117.51 119.47 3iue h ILE 149 Ca -0.05 -1.11 -0.29 0.00 1.00 0.00 0.00 64.86 64.41 3iue h ILE 149 Cb 1.51 2.01 -0.04 0.00 -0.74 0.00 0.00 36.82 39.55 3iue h ILE 149 CO 0.14 0.30 -1.62 0.58 0.00 0.00 0.00 178.15 177.55 3iue h VAL 150 N -0.33 0.97 -6.44 1.67 2.07 -1.24 -3.36 116.25 109.59 3iue h VAL 150 Ca 0.01 -2.78 -0.48 0.00 0.82 0.00 0.00 66.70 64.26 3iue h VAL 150 Cb 0.50 2.50 0.04 0.00 -1.52 0.00 0.00 31.29 32.81 3iue h VAL 150 CO 0.01 0.60 -0.95 0.54 0.02 0.00 0.00 177.57 177.78 3iue n ARG 151 N -3.14 -1.32 -1.84 1.57 1.74 0.99 -4.77 116.66 109.89 3iue n ARG 151 Ca -0.15 0.36 -0.32 0.00 -0.77 0.00 0.00 57.85 56.96 3iue n ARG 151 Cb 1.04 -3.82 0.03 0.00 -1.02 0.00 0.00 32.46 28.69 3iue n ARG 151 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3iue s PRO 152 N -6.42 3.05 0.16 5.56 0.04 -1.26 -4.89 135.00 131.24 3iue s PRO 152 Ca 0.40 1.20 -0.09 0.00 0.04 0.00 0.00 61.00 62.55 3iue s PRO 152 Cb -0.16 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.39 3iue s PRO 152 CO 0.89 -1.03 1.50 -0.44 0.04 0.00 0.00 177.00 177.97 3iue h ASP 153 N 0.03 0.92 -4.73 6.66 3.32 -0.92 -3.43 116.42 118.27 3iue h ASP 153 Ca -0.46 -0.42 -0.23 0.00 0.02 0.00 0.00 57.03 55.93 3iue h ASP 153 Cb 1.23 -0.26 -0.22 0.00 0.22 0.00 0.00 39.33 40.30 3iue h ASP 153 CO 0.56 1.20 -0.72 -0.13 -1.72 0.00 0.00 179.24 178.43 3iue s ARG 154 N -4.35 0.40 -0.02 3.56 0.52 -1.22 -1.22 118.95 116.63 3iue s ARG 154 Ca -0.10 -0.62 0.06 0.00 -0.52 0.00 0.00 55.73 54.55 3iue s ARG 154 Cb 0.11 -0.12 -0.01 0.00 0.52 0.00 0.00 34.95 35.45 3iue s ARG 154 CO 0.87 0.01 -0.18 0.54 0.02 0.00 0.00 175.30 176.56 3iue s VAL 155 N -1.25 1.45 -0.10 3.52 0.11 -0.06 -1.36 120.40 122.73 3iue s VAL 155 Ca -0.11 -0.78 0.03 0.00 -2.93 0.00 0.00 61.98 58.18 3iue s VAL 155 Cb -0.09 -1.21 -0.01 0.00 -1.53 0.00 0.00 36.38 33.54 3iue s VAL 155 CO -0.00 0.41 -0.18 -0.36 -3.33 0.00 0.00 175.10 171.64 3iue s PHE 156 N -0.40 2.67 0.03 1.54 0.40 -0.07 -0.71 117.98 121.43 3iue s PHE 156 Ca 0.06 -0.69 0.02 0.00 -0.60 0.00 0.00 56.93 55.73 3iue s PHE 156 Cb -0.07 -1.74 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 3iue s PHE 156 CO -0.01 -0.21 -0.08 -0.06 0.70 0.00 0.00 175.22 175.57 3iue s PHE 157 N 0.10 0.67 0.62 0.36 0.08 -0.71 -4.20 117.98 114.90 3iue s PHE 157 Ca -0.08 -0.38 -0.16 0.00 0.12 0.00 0.00 56.93 56.43 3iue s PHE 157 Cb -0.15 -0.40 -0.02 0.00 -0.57 0.00 0.00 43.02 41.87 3iue s PHE 157 CO 0.05 -0.05 1.08 0.20 -0.10 0.00 0.00 175.22 176.40 3iue s GLY 158 N -1.18 2.15 0.00 4.36 0.00 -1.26 -0.50 107.32 110.89 3iue s GLY 158 Ca -0.06 0.46 0.29 0.00 0.00 0.00 0.00 44.72 45.41 3iue s GLY 158 CO 0.00 0.80 1.93 1.18 0.00 0.00 0.00 173.10 177.01 3iue n GLU 159 N -2.16 0.07 -0.11 2.90 1.02 -0.22 -4.17 120.64 117.96 3iue n GLU 159 Ca 0.09 -0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.15 3iue n GLU 159 Cb 0.52 -1.50 0.00 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 0.01 0.44 -4.09 3.49 3.64 -1.94 -2.67 116.57 115.45 3iue h LYS 160 Ca 0.00 -0.03 -0.75 0.00 -1.27 0.00 0.00 60.65 58.60 3iue h LYS 160 Cb 0.47 -0.10 -0.17 0.00 -0.41 0.00 0.00 32.23 32.02 3iue h LYS 160 CO 0.00 0.29 1.66 -0.25 -2.27 0.00 0.00 179.45 178.88 3iue n ASP 161 N -4.87 5.19 -0.08 4.20 8.00 -1.26 -4.62 116.55 123.11 3iue n ASP 161 Ca 0.00 -3.05 -0.15 0.00 0.71 0.00 0.00 54.79 52.30 3iue n ASP 161 Cb 0.05 -1.52 -0.04 0.00 -0.02 0.00 0.00 41.12 39.59 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 6.41 1.08 -0.66 1.24 3.20 -1.76 -1.96 116.97 124.52 3iue h TYR 162 Ca 0.35 -0.38 0.05 0.00 3.14 0.00 0.00 58.73 61.89 3iue h TYR 162 Cb 0.75 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 3iue h TYR 162 CO 1.17 1.21 0.38 0.37 -1.64 0.00 0.00 178.16 179.64 3iue h GLN 163 N 0.65 0.69 -0.72 1.82 4.15 -1.88 -0.01 115.11 119.81 3iue h GLN 163 Ca 0.02 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.43 3iue h GLN 163 Cb 1.13 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.61 3iue h GLN 163 CO 0.12 0.46 0.45 0.37 -1.93 0.00 0.00 178.83 178.30 3iue h GLN 164 N 0.71 0.86 -0.53 1.69 4.15 -1.89 -1.70 115.11 118.40 3iue h GLN 164 Ca 0.29 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.62 3iue h GLN 164 Cb 0.14 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 3iue h GLN 164 CO -0.16 0.57 0.20 1.25 -1.93 0.00 0.00 178.83 178.75 3iue h LEU 165 N 0.88 0.75 -0.49 -2.39 5.85 -0.59 -0.13 115.31 119.18 3iue h LEU 165 Ca 0.29 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3iue h LEU 165 Cb 0.02 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3iue h LEU 165 CO -0.11 0.73 0.27 0.58 -0.34 0.00 0.00 178.44 179.56 3iue h VAL 166 N 0.72 1.17 -0.61 1.05 2.07 -0.79 -1.31 116.25 118.56 3iue h VAL 166 Ca 0.17 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 3iue h VAL 166 Cb 0.23 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 3iue h VAL 166 CO -0.01 0.19 0.14 -0.07 0.02 0.00 0.00 177.57 177.83 3iue h LEU 167 N 0.65 0.90 -0.77 2.57 3.38 -0.94 -0.35 115.31 120.75 3iue h LEU 167 Ca 0.17 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3iue h LEU 167 Cb 0.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3iue h LEU 167 CO -0.03 0.88 0.29 0.40 0.09 0.00 0.00 178.44 180.08 3iue h ILE 168 N 0.92 1.26 -0.73 1.22 2.04 -0.70 0.12 117.51 121.63 3iue h ILE 168 Ca 0.19 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 3iue h ILE 168 Cb 0.34 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 3iue h ILE 168 CO 0.00 0.34 0.42 0.03 0.00 0.00 0.00 178.15 178.95 3iue h ARG 169 N 1.13 1.00 -0.41 2.37 3.08 -0.72 -1.36 114.38 119.46 3iue h ARG 169 Ca 0.26 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 3iue h ARG 169 Cb 0.24 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3iue h ARG 169 CO -0.02 0.72 0.06 1.96 -1.07 0.00 0.00 179.97 181.62 3iue h GLN 170 N 1.01 0.69 -0.28 0.04 4.20 -0.27 -1.31 115.11 119.18 3iue h GLN 170 Ca 0.26 -0.19 0.06 0.00 0.06 0.00 0.00 58.65 58.84 3iue h GLN 170 Cb -0.01 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.63 3iue h GLN 170 CO -0.05 0.74 -0.14 1.25 -0.67 0.00 0.00 178.83 179.97 3iue h LEU 171 N 0.54 -0.46 -0.49 1.46 5.85 -0.49 0.12 115.31 121.85 3iue h LEU 171 Ca 0.12 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 3iue h LEU 171 Cb 0.39 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 3iue h LEU 171 CO 0.01 -0.17 0.13 0.58 -0.34 0.00 0.00 178.44 178.64 3iue h VAL 172 N -0.09 1.24 -0.11 1.05 2.07 -1.09 -1.41 116.25 117.89 3iue h VAL 172 Ca 0.15 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 3iue h VAL 172 Cb 0.32 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3iue h VAL 172 CO -0.35 0.30 -0.02 0.00 0.02 0.00 0.00 177.57 177.52 3iue h ALA 173 N 0.99 0.15 0.00 1.67 0.00 -1.05 -0.57 119.26 120.46 3iue h ALA 173 Ca 0.15 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 3iue h ALA 173 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3iue h ALA 173 CO 0.00 -0.12 -0.46 -0.44 0.00 0.00 0.00 179.25 178.23 3iue h ASP 174 N -0.10 0.00 -0.57 0.00 3.32 -0.64 -2.60 116.42 115.83 3iue h ASP 174 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3iue h ASP 174 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3iue h ASP 174 CO 0.01 0.46 0.00 0.49 -1.72 0.00 0.00 179.24 178.48 3iue n PHE 175 N -3.67 0.92 -3.46 4.55 3.72 -0.54 -4.98 117.46 114.01 3iue n PHE 175 Ca -0.01 -0.54 -0.25 0.00 -0.05 0.00 0.00 57.45 56.60 3iue n PHE 175 Cb 0.54 -0.08 0.03 0.00 -0.94 0.00 0.00 39.48 39.03 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 1.07 -5.24 -4.76 4.37 4.13 -0.97 -4.93 115.26 108.94 3iue n ASN 176 Ca 0.21 -0.49 -0.41 0.00 1.68 0.00 0.00 54.58 55.56 3iue n ASN 176 Cb 0.63 -4.21 -0.03 0.00 -1.54 0.00 0.00 39.78 34.63 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 -6.92 4.47 -1.16 3.41 1.43 -0.26 -4.94 118.68 114.71 3iue s LEU 177 Ca 0.48 2.47 -0.05 0.00 -1.03 0.00 0.00 54.13 55.99 3iue s LEU 177 Cb -0.23 -3.63 0.25 0.00 0.03 0.00 0.00 46.19 42.61 3iue s LEU 177 CO 0.59 -0.39 1.73 -0.67 0.23 0.00 0.00 176.35 177.84 3iue n ASP 178 N 1.39 6.25 -3.85 2.29 2.03 -1.26 -4.87 116.55 118.52 3iue n ASP 178 Ca 0.01 -3.33 -0.12 0.00 0.52 0.00 0.00 54.79 51.88 3iue n ASP 178 Cb 0.43 -1.33 -0.11 0.00 -0.72 0.00 0.00 41.12 39.39 3iue n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3iue s VAL 179 N -1.82 0.05 -0.17 5.18 0.11 -1.26 -4.81 120.40 117.68 3iue s VAL 179 Ca 0.37 -0.42 -0.14 0.00 -2.93 0.00 0.00 61.98 58.85 3iue s VAL 179 Cb 0.09 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 3iue s VAL 179 CO 0.03 -0.23 0.31 0.00 -3.33 0.00 0.00 175.10 171.88 3iue s ALA 180 N -0.81 3.58 -0.19 1.54 0.00 -0.36 -4.97 121.76 120.55 3iue s ALA 180 Ca -0.09 -0.47 -0.17 0.00 0.00 0.00 0.00 51.96 51.23 3iue s ALA 180 Cb -0.05 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 3iue s ALA 180 CO 0.01 0.01 0.45 0.08 0.00 0.00 0.00 175.76 176.30 3iue s VAL 181 N 0.65 5.17 -0.22 0.00 1.01 -1.26 -0.88 120.40 124.86 3iue s VAL 181 Ca 0.17 0.81 -0.01 0.00 0.00 0.00 0.00 61.98 62.96 3iue s VAL 181 Cb -0.13 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.49 3iue s VAL 181 CO 0.05 0.23 -0.11 -0.69 0.00 0.00 0.00 175.10 174.58 3iue s VAL 182 N 1.35 2.60 -0.10 2.92 1.01 0.11 -4.96 120.40 123.34 3iue s VAL 182 Ca 0.21 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 61.05 3iue s VAL 182 Cb -0.15 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 3iue s VAL 182 CO 0.09 0.32 0.39 -0.83 0.00 0.00 0.00 175.10 175.07 3iue s GLY 183 N 1.31 2.35 -0.15 4.51 0.00 -1.26 -1.73 107.32 112.35 3iue s GLY 183 Ca 0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 44.72 44.42 3iue s GLY 183 CO -0.07 0.46 -0.08 0.14 0.00 0.00 0.00 173.10 173.55 3iue s VAL 184 N 0.06 3.43 0.45 1.40 1.01 0.34 -4.93 120.40 122.15 3iue s VAL 184 Ca 0.22 -0.52 -0.25 0.00 0.00 0.00 0.00 61.98 61.43 3iue s VAL 184 Cb -0.15 -2.48 -0.08 0.00 0.00 0.00 0.00 36.38 33.66 3iue s VAL 184 CO 0.09 0.50 1.44 -2.65 0.00 0.00 0.00 175.10 174.48 3iue n PRO 185 N 3.73 2.28 -1.68 2.72 -0.02 -1.26 -1.06 135.00 139.71 3iue n PRO 185 Ca -0.18 0.81 -0.48 0.00 -2.02 0.00 0.00 63.50 61.64 3iue n PRO 185 Cb 0.52 -2.64 -0.05 0.00 -0.02 0.00 0.00 33.50 31.32 3iue n PRO 185 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3iue n THR 186 N -0.18 0.43 -2.58 3.45 -1.04 -1.26 -4.77 114.28 108.34 3iue n THR 186 Ca 0.05 -0.08 -0.40 0.00 -2.04 0.00 0.00 64.05 61.58 3iue n THR 186 Cb 0.41 -1.79 -0.05 0.00 -1.82 0.00 0.00 70.33 67.08 3iue n THR 186 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3iue s VAL 187 N 3.26 3.74 0.09 12.58 1.01 -1.26 -4.97 120.40 134.85 3iue s VAL 187 Ca 0.89 1.73 0.07 0.00 0.00 0.00 0.00 61.98 64.67 3iue s VAL 187 Cb -0.69 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 31.56 3iue s VAL 187 CO 0.48 0.40 -0.18 -0.13 0.00 0.00 0.00 175.10 175.67 3iue s ARG 188 N -1.25 1.00 1.12 2.72 0.52 -1.26 -1.59 118.95 120.20 3iue s ARG 188 Ca 0.44 -1.08 -0.13 0.00 -0.52 0.00 0.00 55.73 54.44 3iue s ARG 188 Cb -0.30 -1.14 0.26 0.00 0.52 0.00 0.00 34.95 34.30 3iue s ARG 188 CO 0.37 0.26 1.05 -1.21 0.02 0.00 0.00 175.30 175.79 3iue s GLU 189 N -1.88 -0.56 0.45 3.54 0.41 0.31 -4.86 118.70 116.11 3iue s GLU 189 Ca 0.03 0.82 0.13 0.00 -0.41 0.00 0.00 54.97 55.54 3iue s GLU 189 Cb -0.10 -1.60 1.06 0.00 -1.78 0.00 0.00 34.13 31.71 3iue s GLU 189 CO 0.03 -3.48 2.03 0.00 -0.49 0.00 0.00 175.26 173.35 3iue h ALA 190 N -2.45 1.98 -0.00 5.21 0.00 -2.01 -0.46 119.26 121.53 3iue h ALA 190 Ca -0.59 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3iue h ALA 190 Cb 1.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3iue h ALA 190 CO 0.51 -0.06 -0.17 -0.40 0.00 0.00 0.00 179.25 179.13 3iue n ASP 191 N -4.47 0.37 0.00 0.00 5.75 -1.26 -4.92 116.55 112.01 3iue n ASP 191 Ca 0.06 -0.23 0.00 0.00 -0.01 0.00 0.00 54.79 54.61 3iue n ASP 191 Cb 0.27 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 3iue n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iue n GLY 192 N 1.39 1.06 3.68 6.12 0.00 -0.18 -4.89 105.19 112.36 3iue n GLY 192 Ca 0.10 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.66 3iue n GLY 192 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3iue n LEU 193 N 0.00 3.41 -4.71 0.99 7.94 -1.26 -4.63 117.00 118.75 3iue n LEU 193 Ca 0.00 1.01 -0.43 0.00 -1.11 0.00 0.00 56.01 55.47 3iue n LEU 193 Cb 0.00 -1.41 -0.03 0.00 0.53 0.00 0.00 43.42 42.51 3iue n LEU 193 CO 0.00 -0.10 1.24 0.00 -1.11 0.00 0.00 177.39 177.42 3iue n ALA 194 N 5.54 2.15 -1.76 1.96 0.00 -1.26 -0.53 120.51 126.61 3iue n ALA 194 Ca 0.20 0.41 -0.40 0.00 0.00 0.00 0.00 53.44 53.64 3iue n ALA 194 Cb 0.30 -2.43 0.01 0.00 0.00 0.00 0.00 19.45 17.34 3iue n ALA 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3iue n MET 195 N 3.03 2.34 -3.60 0.00 2.81 -0.62 -4.83 117.12 116.25 3iue n MET 195 Ca 0.13 0.83 -0.15 0.00 -1.81 0.00 0.00 57.70 56.70 3iue n MET 195 Cb 0.33 -2.60 -0.07 0.00 -0.71 0.00 0.00 33.22 30.17 3iue n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3iue s SER 196 N -0.37 -0.71 0.06 7.83 0.15 -1.26 -4.98 113.70 114.42 3iue s SER 196 Ca 0.59 1.22 0.10 0.00 0.70 0.00 0.00 55.95 58.55 3iue s SER 196 Cb -0.47 1.18 0.45 0.00 -1.71 0.00 0.00 66.02 65.47 3iue s SER 196 CO 0.60 -0.35 1.31 -1.20 1.20 0.00 0.00 173.24 174.79 3iue n SER 197 N 2.16 0.13 0.01 5.45 7.64 -1.26 -2.01 113.62 125.74 3iue n SER 197 Ca -0.15 0.55 0.11 0.00 1.01 0.00 0.00 58.87 60.39 3iue n SER 197 Cb 0.56 -0.57 0.11 0.00 -1.01 0.00 0.00 64.21 63.30 3iue n SER 197 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3iue n ARG 198 N -1.66 0.12 0.27 1.43 1.74 -1.26 -4.26 116.66 113.04 3iue n ARG 198 Ca 0.01 0.01 0.13 0.00 -0.77 0.00 0.00 57.85 57.23 3iue n ARG 198 Cb 0.08 -1.55 0.77 0.00 -1.02 0.00 0.00 32.46 30.74 3iue n ARG 198 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3iue h ASN 199 N 0.00 0.00 0.04 0.55 2.35 -1.78 -2.29 115.58 114.44 3iue h ASN 199 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iue h ASN 199 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 3iue h ASN 199 CO 0.00 0.09 0.00 0.08 -1.65 0.00 0.00 177.43 175.95 3iue h ARG 200 N 0.00 0.00 -0.30 0.81 0.11 -1.78 -1.92 114.38 111.30 3iue h ARG 200 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3iue h ARG 200 Cb 0.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.32 3iue h ARG 200 CO 0.01 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.74 3iue n TYR 201 N -2.94 0.39 -3.29 4.08 4.01 -0.86 -4.84 117.16 113.71 3iue n TYR 201 Ca -0.03 -0.20 -0.39 0.00 -0.16 0.00 0.00 57.90 57.13 3iue n TYR 201 Cb 0.07 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.03 3iue n TYR 201 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3iue s LEU 202 N -1.28 4.16 0.91 7.72 1.43 -0.72 -4.84 118.68 126.05 3iue s LEU 202 Ca 0.30 0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 53.92 3iue s LEU 202 Cb 0.16 -2.66 0.14 0.00 0.03 0.00 0.00 46.19 43.86 3iue s LEU 202 CO 0.23 -0.14 1.15 1.51 0.23 0.00 0.00 176.35 179.33 3iue s ASP 203 N 1.09 3.50 0.28 2.29 1.47 -1.26 -4.59 116.67 119.45 3iue s ASP 203 Ca 0.23 0.87 0.02 0.00 1.18 0.00 0.00 52.55 54.85 3iue s ASP 203 Cb -0.15 -1.38 0.62 0.00 -0.34 0.00 0.00 42.92 41.66 3iue s ASP 203 CO 0.09 -2.55 1.78 -0.65 0.68 0.00 0.00 175.17 174.52 3iue h PRO 204 N -1.50 0.71 -0.30 2.11 0.11 -1.99 0.28 132.00 131.42 3iue h PRO 204 Ca -0.49 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 3iue h PRO 204 Cb 1.32 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3iue h PRO 204 CO 0.60 0.47 0.11 0.00 -0.21 0.00 0.00 178.00 178.96 3iue h ALA 205 N 1.59 0.40 -0.36 -0.75 0.00 -2.00 -1.71 119.26 116.43 3iue h ALA 205 Ca 0.51 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 3iue h ALA 205 Cb 0.73 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3iue h ALA 205 CO -0.36 0.01 -0.27 1.96 0.00 0.00 0.00 179.25 180.59 3iue h GLN 206 N 0.34 0.75 -0.56 0.00 4.20 -1.65 -1.52 115.11 116.67 3iue h GLN 206 Ca 0.10 -0.32 0.00 0.00 0.06 0.00 0.00 58.65 58.49 3iue h GLN 206 Cb 0.22 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 3iue h GLN 206 CO -0.01 0.94 0.36 -0.09 -0.67 0.00 0.00 178.83 179.36 3iue h ARG 207 N 0.64 0.74 -0.30 1.46 9.65 -0.39 0.94 114.38 127.13 3iue h ARG 207 Ca 0.08 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 58.93 3iue h ARG 207 Cb 0.79 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.18 3iue h ARG 207 CO 0.07 0.50 0.15 0.00 2.80 0.00 0.00 179.97 183.49 3iue h ALA 208 N 1.19 0.36 -0.02 2.80 0.00 -1.00 -2.93 119.26 119.66 3iue h ALA 208 Ca 0.20 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 3iue h ALA 208 Cb -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3iue h ALA 208 CO -0.04 -0.23 -0.46 0.00 0.00 0.00 0.00 179.25 178.52 3iue h ALA 209 N 1.15 1.21 0.00 0.00 0.00 -0.95 -3.23 119.26 117.44 3iue h ALA 209 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3iue h ALA 209 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3iue h ALA 209 CO -0.08 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.75 3iue h ALA 210 N 1.51 1.00 0.00 0.00 0.00 -0.62 -1.35 119.26 119.80 3iue h ALA 210 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3iue h ALA 210 Cb 0.82 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3iue h ALA 210 CO 0.06 0.00 -0.04 -0.24 0.00 0.00 0.00 179.25 179.03 3iue h VAL 211 N 0.00 0.33 -0.28 0.00 3.04 -1.66 -2.71 116.25 114.97 3iue h VAL 211 Ca 0.00 -0.23 0.08 0.00 -1.01 0.00 0.00 66.70 65.54 3iue h VAL 211 Cb 0.08 1.17 -0.01 0.00 -2.01 0.00 0.00 31.29 30.52 3iue h VAL 211 CO 0.00 0.04 0.21 0.00 -1.01 0.00 0.00 177.57 176.81 3iue h ALA 212 N 1.96 2.23 0.21 3.17 0.00 -1.50 -1.23 119.26 124.10 3iue h ALA 212 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3iue h ALA 212 Cb 0.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3iue h ALA 212 CO 0.01 -0.36 -0.10 -0.07 0.00 0.00 0.00 179.25 178.73 3iue h LEU 213 N 0.00 -0.24 -0.71 0.00 4.07 -1.72 0.12 115.31 116.83 3iue h LEU 213 Ca 0.14 -0.17 -0.12 0.00 0.08 0.00 0.00 57.88 57.81 3iue h LEU 213 Cb 0.56 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 3iue h LEU 213 CO -0.00 0.04 -0.30 0.77 -1.08 0.00 0.00 178.44 177.87 3iue h SER 214 N -0.52 0.68 -0.38 -0.43 4.64 -1.72 -1.71 113.55 114.12 3iue h SER 214 Ca -0.03 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 3iue h SER 214 Cb 0.39 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 3iue h SER 214 CO 0.05 0.94 0.20 0.00 -0.87 0.00 0.00 176.83 177.14 3iue h ALA 215 N 1.11 0.48 -0.30 5.18 0.00 -1.21 -1.10 119.26 123.42 3iue h ALA 215 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3iue h ALA 215 Cb 0.79 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3iue h ALA 215 CO 0.06 0.02 0.19 0.00 0.00 0.00 0.00 179.25 179.52 3iue h ALA 216 N 1.06 0.38 -0.33 0.00 0.00 -0.79 -0.63 119.26 118.96 3iue h ALA 216 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3iue h ALA 216 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3iue h ALA 216 CO -0.02 -0.14 0.15 -0.07 0.00 0.00 0.00 179.25 179.17 3iue h LEU 217 N 0.40 0.43 -0.52 0.00 3.38 -1.11 -0.57 115.31 117.33 3iue h LEU 217 Ca 0.11 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 3iue h LEU 217 Cb -0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3iue h LEU 217 CO -0.02 0.45 -0.52 0.00 0.09 0.00 0.00 178.44 178.44 3iue h THR 218 N 0.39 1.31 -0.17 0.22 1.03 -1.16 -0.31 112.91 114.21 3iue h THR 218 Ca 0.11 -1.74 0.04 0.00 -0.01 0.00 0.00 66.41 64.81 3iue h THR 218 Cb 0.14 1.70 -0.03 0.00 -1.07 0.00 0.00 68.15 68.89 3iue h THR 218 CO -0.01 0.55 -0.05 0.00 -0.01 0.00 0.00 175.52 175.99 3iue h ALA 219 N 0.96 0.10 -0.79 0.00 0.00 -1.02 -2.12 119.26 116.38 3iue h ALA 219 Ca 0.02 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.05 3iue h ALA 219 Cb 1.06 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 3iue h ALA 219 CO 0.10 -0.49 0.48 0.00 0.00 0.00 0.00 179.25 179.35 3iue h ALA 220 N 1.16 1.08 -0.19 0.00 0.00 -0.78 0.96 119.26 121.48 3iue h ALA 220 Ca 0.08 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3iue h ALA 220 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3iue h ALA 220 CO -0.18 0.21 -0.00 0.00 0.00 0.00 0.00 179.25 179.27 3iue h ALA 221 N 1.38 1.64 0.09 0.00 0.00 -0.59 -0.75 119.26 121.03 3iue h ALA 221 Ca 0.35 -0.12 -0.31 0.00 0.00 0.00 0.00 54.91 54.82 3iue h ALA 221 Cb 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3iue h ALA 221 CO -0.17 0.27 -1.67 0.45 0.00 0.00 0.00 179.25 178.13 3iue h HIS 222 N 0.28 0.34 0.00 0.00 3.86 -0.82 -3.28 115.15 115.53 3iue h HIS 222 Ca 0.07 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 3iue h HIS 222 Cb 0.20 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.65 3iue h HIS 222 CO 0.00 1.37 -0.02 0.00 0.86 0.00 0.00 177.93 180.14 3iue h ALA 223 N 0.53 1.27 0.00 2.45 0.00 -0.49 -3.29 119.26 119.73 3iue h ALA 223 Ca -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3iue h ALA 223 Cb 2.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.80 3iue h ALA 223 CO 0.12 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.40 3iue n ALA 224 N -2.22 1.22 0.24 0.00 0.00 -0.32 -1.21 120.51 118.23 3iue n ALA 224 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.54 3iue n ALA 224 Cb 0.12 -1.16 0.60 0.00 0.00 0.00 0.00 19.45 19.01 3iue n ALA 224 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3iue h THR 225 N 0.00 0.94 -0.22 0.00 1.35 -1.80 -0.23 112.91 112.95 3iue h THR 225 Ca 0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3iue h THR 225 Cb 0.09 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3iue h THR 225 CO 0.00 0.14 0.00 0.00 -0.25 0.00 0.00 175.52 175.41 3iue n ALA 226 N -2.44 2.50 0.00 6.62 0.00 -0.35 -4.23 120.51 122.62 3iue n ALA 226 Ca -0.02 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.83 3iue n ALA 226 Cb 0.22 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 1.16 1.43 0.26 0.00 0.00 -0.72 -4.50 105.19 102.82 3iue n GLY 227 Ca 0.16 -2.12 -0.08 0.00 0.00 0.00 0.00 46.02 43.97 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 0.73 -0.59 4.61 0.00 -1.93 -1.99 119.26 120.08 3iue h ALA 228 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3iue h ALA 228 Cb 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3iue h ALA 228 CO 0.00 0.41 0.20 0.37 0.00 0.00 0.00 179.25 180.23 3iue h GLN 229 N 0.78 0.90 -0.45 0.00 5.75 -1.98 -0.42 115.11 119.69 3iue h GLN 229 Ca 0.18 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 3iue h GLN 229 Cb 0.31 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 3iue h GLN 229 CO -0.00 0.79 0.19 0.00 -2.65 0.00 0.00 178.83 177.17 3iue h ALA 230 N 1.06 0.58 0.11 3.38 0.00 -1.75 0.69 119.26 123.33 3iue h ALA 230 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3iue h ALA 230 Cb 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3iue h ALA 230 CO -0.01 0.17 -0.11 0.00 0.00 0.00 0.00 179.25 179.29 3iue h ALA 231 N 1.04 -0.22 -0.46 0.00 0.00 -1.02 -0.17 119.26 118.43 3iue h ALA 231 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3iue h ALA 231 Cb 0.16 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3iue h ALA 231 CO -0.02 -0.64 0.30 -0.07 0.00 0.00 0.00 179.25 178.82 3iue h LEU 232 N -0.25 0.54 -0.91 0.00 3.38 -0.96 -1.82 115.31 115.30 3iue h LEU 232 Ca 0.01 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 3iue h LEU 232 Cb 0.24 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3iue h LEU 232 CO -0.04 0.41 -0.33 0.44 0.09 0.00 0.00 178.44 179.01 3iue h ASP 233 N 0.63 0.41 -0.23 -0.43 3.32 -0.72 -0.29 116.42 119.11 3iue h ASP 233 Ca 0.17 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 3iue h ASP 233 Cb -0.05 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3iue h ASP 233 CO -0.03 0.72 0.14 0.00 -1.72 0.00 0.00 179.24 178.34 3iue h ALA 234 N 1.31 0.29 -0.46 3.45 0.00 -0.76 -1.33 119.26 121.76 3iue h ALA 234 Ca 0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3iue h ALA 234 Cb 0.75 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3iue h ALA 234 CO 0.06 -0.20 0.19 0.00 0.00 0.00 0.00 179.25 179.30 3iue h ALA 235 N 1.04 0.59 -0.91 0.00 0.00 -1.09 -2.54 119.26 116.34 3iue h ALA 235 Ca 0.08 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3iue h ALA 235 Cb 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3iue h ALA 235 CO -0.01 0.19 0.59 -0.09 0.00 0.00 0.00 179.25 179.93 3iue h ARG 236 N 0.59 1.20 -0.48 0.00 9.65 -0.88 -1.63 114.38 122.84 3iue h ARG 236 Ca 0.15 -0.08 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 3iue h ARG 236 Cb 0.18 -0.27 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 3iue h ARG 236 CO -0.01 0.80 0.30 0.00 2.80 0.00 0.00 179.97 183.86 3iue h ALA 237 N 1.33 0.61 -0.23 2.80 0.00 -0.94 0.16 119.26 122.99 3iue h ALA 237 Ca 0.33 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 3iue h ALA 237 Cb -0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3iue h ALA 237 CO -0.07 0.02 0.01 0.28 0.00 0.00 0.00 179.25 179.49 3iue h VAL 238 N 0.61 1.25 -0.63 0.00 2.07 -1.06 -1.67 116.25 116.82 3iue h VAL 238 Ca 0.18 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.85 3iue h VAL 238 Cb -0.04 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3iue h VAL 238 CO -0.06 0.27 0.41 -0.07 0.02 0.00 0.00 177.57 178.13 3iue h LEU 239 N 0.18 0.74 -1.69 2.57 3.38 -1.07 -2.53 115.31 116.88 3iue h LEU 239 Ca 0.07 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3iue h LEU 239 Cb 0.38 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3iue h LEU 239 CO 0.01 0.55 -0.09 0.44 0.09 0.00 0.00 178.44 179.43 3iue h ASP 240 N 0.86 0.07 0.67 -0.43 3.32 -0.60 -1.98 116.42 118.32 3iue h ASP 240 Ca 0.23 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3iue h ASP 240 Cb -0.08 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3iue h ASP 240 CO -0.05 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.65 3iue n ALA 241 N -2.51 2.22 -2.72 3.45 0.00 -0.64 -4.86 120.51 115.46 3iue n ALA 241 Ca -0.02 -0.10 -0.36 0.00 0.00 0.00 0.00 53.44 52.95 3iue n ALA 241 Cb 0.20 -1.41 -0.07 0.00 0.00 0.00 0.00 19.45 18.16 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 -2.79 3.64 -0.05 0.00 0.00 -0.75 -5.02 121.76 116.79 3iue s ALA 242 Ca 0.18 -0.48 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 3iue s ALA 242 Cb 0.17 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 3iue s ALA 242 CO 0.42 0.19 1.37 -1.25 0.00 0.00 0.00 175.76 176.50 3iue s PRO 243 N 0.16 4.27 -0.21 0.00 0.04 -1.26 -3.50 135.00 134.50 3iue s PRO 243 Ca 0.16 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.09 3iue s PRO 243 Cb -0.13 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.74 3iue s PRO 243 CO 0.04 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.87 3iue n GLY 244 N 3.66 0.55 3.59 0.56 0.00 -1.26 -4.81 105.19 107.48 3iue n GLY 244 Ca 0.13 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.99 5.07 -0.36 1.61 1.01 -1.23 -4.34 120.40 120.17 3iue s VAL 245 Ca 0.00 0.62 -0.08 0.00 0.00 0.00 0.00 61.98 62.52 3iue s VAL 245 Cb 0.00 -3.85 0.04 0.00 0.00 0.00 0.00 36.38 32.58 3iue s VAL 245 CO 0.00 -0.00 0.15 0.00 0.00 0.00 0.00 175.10 175.25 3iue s ALA 246 N 2.28 3.14 -0.02 5.51 0.00 -0.34 -4.95 121.76 127.38 3iue s ALA 246 Ca 0.19 -1.83 -0.30 0.00 0.00 0.00 0.00 51.96 50.02 3iue s ALA 246 Cb -0.16 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 3iue s ALA 246 CO 0.11 -1.41 1.15 0.08 0.00 0.00 0.00 175.76 175.69 3iue s VAL 247 N 1.43 4.33 0.00 0.00 1.01 -1.26 -0.32 120.40 125.59 3iue s VAL 247 Ca 0.00 1.66 0.00 0.00 0.00 0.00 0.00 61.98 63.64 3iue s VAL 247 Cb -0.20 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.11 3iue s VAL 247 CO 0.03 0.05 0.27 -0.67 0.00 0.00 0.00 175.10 174.78 3iue n ASP 248 N 4.64 0.00 -4.07 3.32 -0.08 0.34 -4.93 116.55 115.77 3iue n ASP 248 Ca 0.09 0.59 -0.07 0.00 -1.51 0.00 0.00 54.79 53.89 3iue n ASP 248 Cb 0.47 -0.45 -0.10 0.00 2.34 0.00 0.00 41.12 43.38 3iue n ASP 248 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 3iue s TYR 249 N -1.43 0.48 -0.18 -0.67 -0.85 -1.08 -5.01 117.35 108.61 3iue s TYR 249 Ca 0.00 -0.99 -0.04 0.00 -0.52 0.00 0.00 57.07 55.52 3iue s TYR 249 Cb 0.00 -0.36 0.08 0.00 0.38 0.00 0.00 41.96 42.06 3iue s TYR 249 CO 0.00 -0.36 0.21 -1.17 -1.52 0.00 0.00 175.55 172.72 3iue s LEU 250 N -2.73 -0.11 -0.01 -3.49 2.96 -1.26 -1.70 118.68 112.34 3iue s LEU 250 Ca 0.04 -0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.86 3iue s LEU 250 Cb 0.06 0.38 0.01 0.00 0.50 0.00 0.00 46.19 47.14 3iue s LEU 250 CO -0.09 -0.31 0.03 -1.61 -1.32 0.00 0.00 176.35 173.05 3iue s GLU 251 N 2.33 0.00 -0.25 1.98 2.02 -0.36 -4.99 118.70 119.43 3iue s GLU 251 Ca 0.06 0.09 -0.07 0.00 0.02 0.00 0.00 54.97 55.07 3iue s GLU 251 Cb -0.15 -0.09 -0.03 0.00 0.10 0.00 0.00 34.13 33.97 3iue s GLU 251 CO -0.11 -0.06 0.07 -1.17 0.02 0.00 0.00 175.26 174.01 3iue s LEU 252 N 0.41 3.48 0.25 1.80 2.96 -1.26 -0.82 118.68 125.50 3iue s LEU 252 Ca -0.03 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 3iue s LEU 252 Cb -0.05 -1.93 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 3iue s LEU 252 CO -0.01 -0.02 -0.02 -0.13 -1.32 0.00 0.00 176.35 174.85 3iue s ARG 253 N 1.54 1.41 0.86 1.98 0.52 -0.39 -4.93 118.95 119.94 3iue s ARG 253 Ca 0.06 -1.72 -0.14 0.00 -0.52 0.00 0.00 55.73 53.42 3iue s ARG 253 Cb -0.15 -0.79 0.03 0.00 0.52 0.00 0.00 34.95 34.56 3iue s ARG 253 CO 0.04 -0.06 0.64 -3.47 0.02 0.00 0.00 175.30 172.46 3iue n ASP 254 N -0.48 -1.10 0.18 0.23 2.03 -1.26 -0.59 116.55 115.56 3iue n ASP 254 Ca -0.05 0.46 0.06 0.00 0.52 0.00 0.00 54.79 55.77 3iue n ASP 254 Cb 0.64 -1.28 0.52 0.00 -0.72 0.00 0.00 41.12 40.28 3iue n ASP 254 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3iue h ILE 255 N -1.12 1.08 -0.19 5.18 3.07 -1.85 -0.78 117.51 122.91 3iue h ILE 255 Ca -0.44 -0.33 0.00 0.00 1.55 0.00 0.00 64.86 65.63 3iue h ILE 255 Cb 1.30 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.89 3iue h ILE 255 CO 0.39 0.11 0.00 0.61 -1.05 0.00 0.00 178.15 178.21 3iue n GLY 256 N -1.28 0.23 3.01 0.16 0.00 -1.26 -4.91 105.19 101.15 3iue n GLY 256 Ca -0.01 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.26 0.83 0.00 0.99 4.77 -0.30 -4.90 117.00 118.65 3iue n LEU 257 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3iue n LEU 257 Cb 0.29 -1.96 0.00 0.00 -2.33 0.00 0.00 43.42 39.42 3iue n LEU 257 CO 0.11 -0.74 0.00 0.61 -1.33 0.00 0.00 177.39 176.04 3iue n GLY 258 N 0.33 0.07 2.13 -0.72 0.00 -1.26 -4.91 105.19 100.82 3iue n GLY 258 Ca 0.00 -1.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.04 3iue n GLY 258 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3iue n PRO 259 N -0.66 2.12 -3.96 1.61 -0.04 -1.26 -4.81 135.00 128.00 3iue n PRO 259 Ca 0.00 -1.14 -0.10 0.00 -0.04 0.00 0.00 63.50 62.22 3iue n PRO 259 Cb 0.00 -2.12 -0.12 0.00 -0.04 0.00 0.00 33.50 31.23 3iue n PRO 259 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iue s MET 260 N 1.49 0.26 0.73 0.54 0.23 -1.26 -5.15 119.30 116.14 3iue s MET 260 Ca 0.60 -0.48 -0.11 0.00 -1.03 0.00 0.00 55.69 54.67 3iue s MET 260 Cb 0.26 0.06 0.03 0.00 -1.53 0.00 0.00 34.83 33.66 3iue s MET 260 CO -0.01 -0.03 1.08 -1.25 -2.03 0.00 0.00 175.02 172.78 3iue s PRO 261 N -1.14 2.54 0.12 3.16 0.04 -1.26 -4.43 135.00 134.04 3iue s PRO 261 Ca -0.12 1.12 -0.33 0.00 0.04 0.00 0.00 61.00 61.71 3iue s PRO 261 Cb -0.08 -1.93 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 3iue s PRO 261 CO -0.01 -1.42 1.70 -0.11 0.04 0.00 0.00 177.00 177.20 3iue n LEU 262 N -3.27 3.49 0.00 -3.56 7.94 -1.26 -4.68 117.00 115.66 3iue n LEU 262 Ca 0.09 1.04 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 3iue n LEU 262 Cb 0.53 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 43.01 3iue n LEU 262 CO 0.53 -0.08 0.00 -0.46 -1.11 0.00 0.00 177.39 176.27 3iue n ASN 263 N 4.44 0.00 0.07 1.96 0.23 -1.26 -5.00 115.26 115.70 3iue n ASN 263 Ca 0.18 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 54.10 3iue n ASN 263 Cb 0.32 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.97 3iue n ASN 263 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3iue h GLY 264 N 0.00 0.42 -6.10 4.83 0.00 -1.95 -3.44 103.07 96.84 3iue h GLY 264 Ca 0.00 -0.75 -0.64 0.00 0.00 0.00 0.00 47.33 45.94 3iue h GLY 264 CO 0.00 0.66 -0.68 -0.56 0.00 0.00 0.00 176.54 175.97 3iue s SER 265 N -7.06 4.72 0.30 0.19 0.01 -1.26 0.17 113.70 110.77 3iue s SER 265 Ca -0.05 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.07 3iue s SER 265 Cb 0.09 -1.78 -0.03 0.00 0.21 0.00 0.00 66.02 64.51 3iue s SER 265 CO 0.86 0.13 0.21 -0.83 0.41 0.00 0.00 173.24 174.02 3iue s GLY 266 N 0.61 2.08 -0.05 3.44 0.00 0.73 -3.85 107.32 110.29 3iue s GLY 266 Ca -0.02 -1.89 0.02 0.00 0.00 0.00 0.00 44.72 42.83 3iue s GLY 266 CO 0.02 -1.49 -0.09 -1.60 0.00 0.00 0.00 173.10 169.94 3iue s ARG 267 N -3.70 1.23 -0.23 2.90 6.06 0.24 -1.37 118.95 124.09 3iue s ARG 267 Ca 0.39 -0.28 -0.08 0.00 -2.50 0.00 0.00 55.73 53.25 3iue s ARG 267 Cb 0.04 -1.09 -0.04 0.00 0.06 0.00 0.00 34.95 33.92 3iue s ARG 267 CO 0.21 0.01 0.10 -1.17 -2.50 0.00 0.00 175.30 171.96 3iue s LEU 268 N 0.64 3.75 -0.04 -0.88 2.96 -0.21 -1.26 118.68 123.65 3iue s LEU 268 Ca -0.11 -0.04 0.06 0.00 -0.22 0.00 0.00 54.13 53.82 3iue s LEU 268 Cb -0.14 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 3iue s LEU 268 CO 0.02 0.04 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.12 3iue s LEU 269 N 1.18 2.36 0.03 -0.68 1.02 0.00 -1.32 118.68 121.26 3iue s LEU 269 Ca 0.05 -0.35 0.04 0.00 0.02 0.00 0.00 54.13 53.90 3iue s LEU 269 Cb -0.14 -1.44 -0.02 0.00 0.02 0.00 0.00 46.19 44.61 3iue s LEU 269 CO 0.04 0.33 -0.13 0.54 0.02 0.00 0.00 176.35 177.15 3iue s VAL 270 N -0.63 1.01 -0.02 -1.59 0.11 0.15 -1.22 120.40 118.21 3iue s VAL 270 Ca 0.10 -0.88 0.01 0.00 -2.93 0.00 0.00 61.98 58.28 3iue s VAL 270 Cb -0.10 -0.91 0.01 0.00 -1.53 0.00 0.00 36.38 33.84 3iue s VAL 270 CO -0.00 0.03 -0.04 0.00 -3.33 0.00 0.00 175.10 171.76 3iue s ALA 271 N -0.75 0.44 0.03 1.54 0.00 -0.69 -1.83 121.76 120.50 3iue s ALA 271 Ca 0.01 -0.10 -0.10 0.00 0.00 0.00 0.00 51.96 51.77 3iue s ALA 271 Cb -0.07 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.85 3iue s ALA 271 CO 0.01 0.05 0.20 0.00 0.00 0.00 0.00 175.76 176.01 3iue s ALA 272 N 0.30 -0.38 -0.14 0.00 0.00 -0.53 -0.50 121.76 120.51 3iue s ALA 272 Ca -0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 3iue s ALA 272 Cb -0.07 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 3iue s ALA 272 CO -0.00 -0.34 0.06 1.03 0.00 0.00 0.00 175.76 176.51 3iue s ARG 273 N -2.34 3.53 -0.33 0.00 0.52 0.56 -0.37 118.95 120.53 3iue s ARG 273 Ca -0.07 -0.32 0.02 0.00 -0.52 0.00 0.00 55.73 54.84 3iue s ARG 273 Cb -0.02 -3.06 0.09 0.00 0.52 0.00 0.00 34.95 32.47 3iue s ARG 273 CO -0.03 0.52 0.03 -0.51 0.02 0.00 0.00 175.30 175.33 3iue s LEU 274 N -0.34 4.44 0.00 2.53 1.02 0.07 -1.20 118.68 125.20 3iue s LEU 274 Ca 0.09 -1.87 0.00 0.00 0.02 0.00 0.00 54.13 52.37 3iue s LEU 274 Cb -0.12 -1.65 0.00 0.00 0.02 0.00 0.00 46.19 44.44 3iue s LEU 274 CO 0.02 -0.35 0.00 0.61 0.02 0.00 0.00 176.35 176.65 3iue n GLY 275 N 4.38 3.40 0.74 -3.19 0.00 -1.26 -1.87 105.19 107.38 3iue n GLY 275 Ca -0.03 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 -3.21 2.61 -2.24 -1.26 -4.91 114.28 105.27 3iue n THR 276 Ca 0.00 -0.38 -0.40 0.00 -2.27 0.00 0.00 64.05 61.00 3iue n THR 276 Cb 0.00 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.33 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 -2.11 5.06 -0.22 4.28 2.01 -0.78 -5.05 115.64 118.83 3iue s THR 277 Ca 0.28 0.94 -0.15 0.00 0.31 0.00 0.00 61.69 63.08 3iue s THR 277 Cb 0.20 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 3iue s THR 277 CO 0.37 0.09 0.35 -0.60 -0.69 0.00 0.00 174.62 174.13 3iue s ARG 278 N 2.25 4.12 0.03 4.92 3.52 -1.26 -0.75 118.95 131.78 3iue s ARG 278 Ca 0.23 0.09 0.04 0.00 -0.13 0.00 0.00 55.73 55.96 3iue s ARG 278 Cb -0.16 -3.56 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 3iue s ARG 278 CO 0.09 -0.07 -0.09 -0.51 -0.81 0.00 0.00 175.30 173.91 3iue s LEU 279 N 1.42 3.07 0.16 -0.88 1.43 0.50 -4.97 118.68 119.41 3iue s LEU 279 Ca 0.16 -0.22 0.11 0.00 -1.03 0.00 0.00 54.13 53.14 3iue s LEU 279 Cb -0.15 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 3iue s LEU 279 CO 0.08 0.26 -0.24 -0.76 0.23 0.00 0.00 176.35 175.92 3iue s LEU 280 N -1.55 2.39 0.20 1.79 1.43 -1.26 -1.46 118.68 120.22 3iue s LEU 280 Ca 0.17 -0.82 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 3iue s LEU 280 Cb -0.11 -1.12 0.05 0.00 0.03 0.00 0.00 46.19 45.04 3iue s LEU 280 CO 0.08 0.11 0.62 -0.62 0.23 0.00 0.00 176.35 176.78 3iue s ASP 281 N -2.42 -0.43 0.17 2.29 -1.08 -0.76 -4.91 116.67 109.53 3iue s ASP 281 Ca 0.17 -0.24 -0.19 0.00 -0.52 0.00 0.00 52.55 51.76 3iue s ASP 281 Cb -0.08 0.63 0.04 0.00 -1.46 0.00 0.00 42.92 42.05 3iue s ASP 281 CO 0.08 -1.08 0.54 0.54 0.52 0.00 0.00 175.17 175.76 3iue s ASN 282 N -2.81 -0.36 -0.01 -0.34 2.20 -1.26 -0.68 114.94 111.68 3iue s ASN 282 Ca 0.05 -0.29 -0.18 0.00 -0.94 0.00 0.00 52.86 51.51 3iue s ASN 282 Cb -0.02 0.57 0.03 0.00 -2.00 0.00 0.00 41.25 39.83 3iue s ASN 282 CO -0.06 -1.00 0.38 -0.51 -2.94 0.00 0.00 177.10 172.96 3iue s ILE 283 N -3.82 0.05 0.32 0.54 2.07 -0.43 -4.98 121.20 114.95 3iue s ILE 283 Ca 0.05 -0.42 -0.29 0.00 -1.41 0.00 0.00 60.65 58.59 3iue s ILE 283 Cb -0.01 -0.73 -0.10 0.00 0.13 0.00 0.00 42.46 41.75 3iue s ILE 283 CO -0.08 -0.23 1.27 0.00 -1.91 0.00 0.00 174.94 174.00 3iue s ALA 284 N -1.50 3.48 -0.07 1.50 0.00 -1.26 -1.04 121.76 122.87 3iue s ALA 284 Ca -0.12 1.20 0.02 0.00 0.00 0.00 0.00 51.96 53.06 3iue s ALA 284 Cb -0.04 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.64 3iue s ALA 284 CO 0.04 -0.56 -0.12 0.42 0.00 0.00 0.00 175.76 175.54 3iue s ILE 285 N -1.11 1.14 -0.19 0.00 -1.09 -0.47 -4.86 121.20 114.62 3iue s ILE 285 Ca 0.48 -0.48 -0.05 0.00 -2.23 0.00 0.00 60.65 58.38 3iue s ILE 285 Cb -0.38 -1.05 -0.03 0.00 -1.58 0.00 0.00 42.46 39.42 3iue s ILE 285 CO 0.51 0.36 -0.01 -1.61 -1.23 0.00 0.00 174.94 172.96 3iue s GLU 286 N 0.70 3.64 -0.19 2.79 8.01 -1.26 -0.19 118.70 132.20 3iue s GLU 286 Ca -0.14 -0.52 -0.19 0.00 0.01 0.00 0.00 54.97 54.13 3iue s GLU 286 Cb -0.16 -3.04 -0.03 0.00 -4.31 0.00 0.00 34.13 26.59 3iue s GLU 286 CO 0.03 0.07 0.55 0.42 0.01 0.00 0.00 175.26 176.34 3iue s ILE 287 N 0.83 5.09 -0.58 -1.63 -1.09 0.13 -3.82 121.20 120.13 3iue s ILE 287 Ca 0.00 1.02 -0.02 0.00 -2.23 0.00 0.00 60.65 59.43 3iue s ILE 287 Cb -0.14 -3.87 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 3iue s ILE 287 CO 0.02 0.18 0.22 0.61 -1.23 0.00 0.00 174.94 174.74 3iue n GLY 288 N 3.78 0.23 2.67 6.18 0.00 -0.18 -4.04 105.19 113.83 3iue n GLY 288 Ca -0.04 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 3iue n GLY 288 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3iue s THR 289 N -2.76 0.55 0.00 2.61 -1.32 -1.26 -4.96 115.64 108.50 3iue s THR 289 Ca 0.11 -1.18 0.00 0.00 -1.21 0.00 0.00 61.69 59.41 3iue s THR 289 Cb -0.05 -1.43 0.00 0.00 -1.51 0.00 0.00 72.50 69.51 3iue s THR 289 CO 0.14 -0.70 0.00 0.33 -2.21 0.00 0.00 174.62 172.18