#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iob s PRO 4 N 0.00 1.20 0.26 0.38 0.04 -1.26 -5.01 135.00 130.61 3iob s PRO 4 Ca 0.00 -0.16 -0.30 0.00 0.04 0.00 0.00 61.00 60.58 3iob s PRO 4 Cb 0.00 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.55 3iob s PRO 4 CO 0.00 -2.07 1.52 0.00 0.04 0.00 0.00 177.00 176.49 3iob s ALA 5 N -3.73 3.69 -0.24 8.56 0.00 -1.26 -4.92 121.76 123.86 3iob s ALA 5 Ca 0.68 1.44 0.02 0.00 0.00 0.00 0.00 51.96 54.10 3iob s ALA 5 Cb -0.07 -3.60 0.06 0.00 0.00 0.00 0.00 23.12 19.50 3iob s ALA 5 CO 0.51 -0.85 -0.09 0.12 0.00 0.00 0.00 175.76 175.46 3iob s PHE 6 N 0.10 2.80 -0.48 0.00 5.36 -1.26 -5.04 117.98 119.46 3iob s PHE 6 Ca 0.62 -2.00 -0.19 0.00 -0.96 0.00 0.00 56.93 54.40 3iob s PHE 6 Cb -0.45 -1.75 0.05 0.00 -0.34 0.00 0.00 43.02 40.53 3iob s PHE 6 CO 0.44 -0.82 0.61 -1.01 -1.46 0.00 0.00 175.22 172.98 3iob s HIS 7 N 1.26 3.06 0.53 10.12 3.76 -1.26 -5.06 115.29 127.70 3iob s HIS 7 Ca -0.07 -0.41 -0.21 0.00 -0.15 0.00 0.00 55.06 54.23 3iob s HIS 7 Cb -0.19 -3.44 -0.06 0.00 1.11 0.00 0.00 32.58 30.01 3iob s HIS 7 CO -0.06 -0.97 1.17 -1.25 -0.85 0.00 0.00 174.74 172.78 3iob s PRO 8 N 2.65 3.39 0.00 8.40 0.04 -1.26 -2.84 135.00 145.37 3iob s PRO 8 Ca 0.17 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.95 3iob s PRO 8 Cb -0.18 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3iob s PRO 8 CO 0.14 -0.85 0.00 0.41 0.04 0.00 0.00 177.00 176.74 3iob n GLY 9 N 0.36 0.52 3.37 0.56 0.00 -1.26 -5.00 105.19 103.73 3iob n GLY 9 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 3iob n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iob s GLU 10 N -0.46 1.39 -0.21 1.61 2.02 -1.13 -5.06 118.70 116.86 3iob s GLU 10 Ca 0.00 -1.66 -0.27 0.00 0.02 0.00 0.00 54.97 53.06 3iob s GLU 10 Cb 0.00 -1.03 0.00 0.00 0.10 0.00 0.00 34.13 33.20 3iob s GLU 10 CO 0.00 0.09 0.95 -1.17 0.02 0.00 0.00 175.26 175.15 3iob s LEU 11 N -3.35 4.12 -0.23 1.80 2.96 -1.25 -4.35 118.68 118.37 3iob s LEU 11 Ca 0.25 1.28 -0.08 0.00 -0.22 0.00 0.00 54.13 55.35 3iob s LEU 11 Cb 0.02 -3.41 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 3iob s LEU 11 CO 0.08 -0.57 0.10 0.20 -1.32 0.00 0.00 176.35 174.84 3iob s ASN 12 N 1.22 5.53 -0.24 3.68 0.01 0.68 -4.97 114.94 120.85 3iob s ASN 12 Ca 0.41 -0.06 -0.08 0.00 -0.71 0.00 0.00 52.86 52.43 3iob s ASN 12 Cb -0.16 -1.99 -0.03 0.00 0.41 0.00 0.00 41.25 39.48 3iob s ASN 12 CO 0.08 0.03 0.08 -0.69 -1.51 0.00 0.00 177.10 175.10 3iob s VAL 13 N 1.23 4.53 -0.05 1.60 1.01 -1.26 -0.98 120.40 126.48 3iob s VAL 13 Ca 0.05 -0.10 0.05 0.00 0.00 0.00 0.00 61.98 61.98 3iob s VAL 13 Cb -0.14 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 3iob s VAL 13 CO 0.04 0.36 -0.22 -0.31 0.00 0.00 0.00 175.10 174.97 3iob s TYR 14 N 1.34 2.11 -0.21 5.22 2.02 -0.48 -4.99 117.35 122.36 3iob s TYR 14 Ca 0.05 -0.60 0.11 0.00 -0.37 0.00 0.00 57.07 56.27 3iob s TYR 14 Cb -0.15 -1.39 -0.21 0.00 -0.40 0.00 0.00 41.96 39.81 3iob s TYR 14 CO 0.04 -0.18 -0.04 0.43 -1.57 0.00 0.00 175.55 174.24 3iob n SER 15 N 2.98 0.96 -4.69 2.29 7.64 -1.26 -0.97 113.62 120.57 3iob n SER 15 Ca -0.17 -0.05 -0.42 0.00 1.01 0.00 0.00 58.87 59.24 3iob n SER 15 Cb 0.52 0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 64.18 3iob n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iob s ALA 16 N -2.47 3.41 0.26 -0.43 0.00 -1.26 -3.92 121.76 117.35 3iob s ALA 16 Ca -0.18 0.56 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 3iob s ALA 16 Cb 0.07 -3.46 0.50 0.00 0.00 0.00 0.00 23.12 20.23 3iob s ALA 16 CO 0.70 -0.60 1.78 -1.35 0.00 0.00 0.00 175.76 176.29 3iob h PRO 17 N 7.17 0.70 -0.98 0.00 0.11 -1.92 -1.05 132.00 136.02 3iob h PRO 17 Ca -0.35 -0.04 0.13 0.00 0.11 0.00 0.00 66.00 65.85 3iob h PRO 17 Cb 1.17 -0.16 -0.08 0.00 0.11 0.00 0.00 31.00 32.04 3iob h PRO 17 CO 0.85 0.46 0.62 0.78 -0.21 0.00 0.00 178.00 180.49 3iob h GLY 18 N 0.72 1.55 0.71 -0.55 0.00 -1.97 -0.96 103.07 102.57 3iob h GLY 18 Ca 0.45 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3iob h GLY 18 CO -0.32 0.12 -0.11 -0.55 0.00 0.00 0.00 176.54 175.68 3iob h ASP 19 N 0.90 -0.26 -0.20 0.19 3.32 -1.59 -0.98 116.42 117.79 3iob h ASP 19 Ca 0.49 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 3iob h ASP 19 Cb 0.59 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 3iob h ASP 19 CO -0.26 0.06 -0.05 1.62 -1.72 0.00 0.00 179.24 178.89 3iob h VAL 20 N -0.60 1.21 -0.39 -1.35 3.04 -1.32 -1.55 116.25 115.30 3iob h VAL 20 Ca -0.03 -0.88 -0.03 0.00 -1.01 0.00 0.00 66.70 64.75 3iob h VAL 20 Cb 0.43 1.02 -0.02 0.00 -2.01 0.00 0.00 31.29 30.71 3iob h VAL 20 CO 0.05 0.30 0.12 0.00 -1.01 0.00 0.00 177.57 177.03 3iob h ALA 21 N 1.46 0.50 -0.49 3.17 0.00 -1.12 0.48 119.26 123.26 3iob h ALA 21 Ca 0.10 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3iob h ALA 21 Cb 0.40 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3iob h ALA 21 CO 0.02 0.15 0.14 -0.44 0.00 0.00 0.00 179.25 179.11 3iob h ASP 22 N 0.48 0.72 -0.31 0.00 3.32 -0.90 -1.35 116.42 118.38 3iob h ASP 22 Ca 0.12 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.89 3iob h ASP 22 Cb 0.25 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3iob h ASP 22 CO -0.00 0.75 -0.08 0.58 -1.72 0.00 0.00 179.24 178.77 3iob h VAL 23 N 0.66 1.28 -0.15 -1.35 2.07 -1.19 -1.54 116.25 116.04 3iob h VAL 23 Ca 0.16 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.56 3iob h VAL 23 Cb 0.29 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3iob h VAL 23 CO -0.00 0.36 0.09 -1.28 0.02 0.00 0.00 177.57 176.76 3iob h SER 24 N 0.37 0.15 -0.43 0.57 0.87 -0.83 -0.11 113.55 114.14 3iob h SER 24 Ca 0.08 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.66 3iob h SER 24 Cb 0.57 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.46 3iob h SER 24 CO 0.03 0.11 0.24 -0.09 -0.53 0.00 0.00 176.83 176.59 3iob h ARG 25 N 0.19 0.46 -0.62 2.24 2.43 -1.24 -0.58 114.38 117.25 3iob h ARG 25 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3iob h ARG 25 Cb -0.01 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 3iob h ARG 25 CO -0.02 0.31 0.40 0.00 -1.51 0.00 0.00 179.97 179.14 3iob h ALA 26 N 1.21 0.79 -0.31 2.80 0.00 -0.91 -1.82 119.26 121.02 3iob h ALA 26 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3iob h ALA 26 Cb 0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3iob h ALA 26 CO -0.10 0.24 0.15 -0.07 0.00 0.00 0.00 179.25 179.47 3iob h LEU 27 N 0.84 0.40 -1.31 0.00 3.38 -0.72 -2.88 115.31 115.02 3iob h LEU 27 Ca 0.23 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3iob h LEU 27 Cb -0.07 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3iob h LEU 27 CO -0.05 0.40 0.42 -0.09 0.09 0.00 0.00 178.44 179.22 3iob h ARG 28 N 0.36 0.89 0.00 1.13 2.43 -0.87 -2.06 114.38 116.27 3iob h ARG 28 Ca 0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3iob h ARG 28 Cb 0.11 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3iob h ARG 28 CO -0.01 0.60 0.00 1.28 -1.51 0.00 0.00 179.97 180.33 3iob n LEU 29 N -4.42 0.69 -1.14 3.80 4.77 -0.71 -2.04 117.00 117.94 3iob n LEU 29 Ca 0.07 0.65 0.12 0.00 -0.03 0.00 0.00 56.01 56.81 3iob n LEU 29 Cb 0.05 -0.53 0.22 0.00 -2.33 0.00 0.00 43.42 40.83 3iob n LEU 29 CO 0.36 -0.49 0.70 0.35 -1.33 0.00 0.00 177.39 176.99 3iob n THR 30 N -2.23 0.55 0.00 -5.08 -2.24 -0.83 -4.97 114.28 99.48 3iob n THR 30 Ca 0.03 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 3iob n THR 30 Cb 0.27 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 3iob n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iob n GLY 31 N 1.47 0.39 3.77 3.38 0.00 -0.87 -5.08 105.19 108.25 3iob n GLY 31 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3iob n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iob s ARG 32 N -0.87 4.21 -0.23 1.61 1.81 -0.87 -4.99 118.95 119.62 3iob s ARG 32 Ca 0.00 1.68 -0.12 0.00 -1.72 0.00 0.00 55.73 55.56 3iob s ARG 32 Cb 0.00 -2.71 -0.05 0.00 -0.45 0.00 0.00 34.95 31.75 3iob s ARG 32 CO 0.00 -0.14 0.25 1.03 -0.68 0.00 0.00 175.30 175.76 3iob s ARG 33 N -2.23 4.10 -0.13 3.54 0.52 -0.99 -4.01 118.95 119.75 3iob s ARG 33 Ca 0.55 -0.10 -0.21 0.00 -0.52 0.00 0.00 55.73 55.45 3iob s ARG 33 Cb -0.27 -3.55 -0.03 0.00 0.52 0.00 0.00 34.95 31.62 3iob s ARG 33 CO 0.34 0.01 0.60 0.08 0.02 0.00 0.00 175.30 176.35 3iob s VAL 34 N 1.20 5.09 -0.10 3.52 1.01 -1.26 -1.00 120.40 128.86 3iob s VAL 34 Ca 0.12 1.20 -0.00 0.00 0.00 0.00 0.00 61.98 63.29 3iob s VAL 34 Cb -0.14 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 3iob s VAL 34 CO 0.06 0.23 -0.09 -0.04 0.00 0.00 0.00 175.10 175.26 3iob s MET 35 N 1.11 3.12 -0.11 2.72 1.00 -0.24 -0.35 119.30 126.55 3iob s MET 35 Ca 0.31 -0.59 0.02 0.00 0.00 0.00 0.00 55.69 55.42 3iob s MET 35 Cb -0.16 -2.66 -0.01 0.00 0.00 0.00 0.00 34.83 32.00 3iob s MET 35 CO 0.13 0.44 -0.18 -1.17 0.00 0.00 0.00 175.02 174.24 3iob s LEU 36 N -0.20 2.47 -0.43 -0.03 2.96 -0.40 -0.26 118.68 122.80 3iob s LEU 36 Ca 0.02 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.56 3iob s LEU 36 Cb -0.13 -1.52 0.11 0.00 0.50 0.00 0.00 46.19 45.15 3iob s LEU 36 CO 0.03 0.18 0.16 -0.69 -1.32 0.00 0.00 176.35 174.71 3iob s VAL 37 N 0.23 2.53 -0.01 1.68 1.01 0.39 -1.13 120.40 125.10 3iob s VAL 37 Ca -0.11 -2.73 -0.30 0.00 0.00 0.00 0.00 61.98 58.84 3iob s VAL 37 Cb -0.16 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3iob s VAL 37 CO 0.06 -0.69 1.11 -2.84 0.00 0.00 0.00 175.10 172.74 3iob s PRO 38 N 0.42 4.45 0.18 2.72 0.02 -1.26 -1.75 135.00 139.78 3iob s PRO 38 Ca 0.13 1.59 0.01 0.00 0.02 0.00 0.00 61.00 62.75 3iob s PRO 38 Cb -0.22 -3.46 -0.05 0.00 0.02 0.00 0.00 34.50 30.79 3iob s PRO 38 CO -0.05 -0.25 0.05 0.95 -0.33 0.00 0.00 177.00 177.37 3iob s THR 39 N 1.48 0.46 -0.32 0.99 -4.23 0.14 -4.93 115.64 109.23 3iob s THR 39 Ca 0.54 -1.97 0.09 0.00 -1.18 0.00 0.00 61.69 59.18 3iob s THR 39 Cb -0.24 -2.25 0.63 0.00 1.34 0.00 0.00 72.50 71.98 3iob s THR 39 CO 0.25 -0.33 1.67 0.23 -0.54 0.00 0.00 174.62 175.91 3iob n MET 40 N -0.26 2.74 0.00 3.99 2.81 -1.26 -2.06 117.12 123.08 3iob n MET 40 Ca -0.04 -3.06 0.00 0.00 -1.81 0.00 0.00 57.70 52.79 3iob n MET 40 Cb 0.64 -2.04 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 3iob n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iob n GLY 41 N -0.70 -0.46 3.69 3.03 0.00 -1.26 -4.62 105.19 104.85 3iob n GLY 41 Ca 0.40 -1.10 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 3iob n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iob n ALA 42 N 1.77 -2.27 -1.89 4.61 0.00 -1.26 -4.87 120.51 116.60 3iob n ALA 42 Ca 0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 3iob n ALA 42 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 19.45 16.32 3iob n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iob s LEU 43 N -6.51 4.50 0.00 0.00 1.43 -1.26 -4.72 118.68 112.12 3iob s LEU 43 Ca 0.23 2.29 0.02 0.00 -1.03 0.00 0.00 54.13 55.63 3iob s LEU 43 Cb -0.07 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 3iob s LEU 43 CO 0.83 -0.27 0.07 0.00 0.23 0.00 0.00 176.35 177.21 3iob n HIS 44 N 1.74 0.10 0.26 0.29 1.44 -1.26 -4.93 115.22 112.85 3iob n HIS 44 Ca 0.01 -1.33 0.10 0.00 -2.01 0.00 0.00 57.72 54.49 3iob n HIS 44 Cb 0.44 -0.01 0.69 0.00 0.12 0.00 0.00 29.99 31.23 3iob n HIS 44 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3iob h GLU 45 N 0.00 0.00 -0.16 -1.40 4.57 -1.98 -1.91 114.58 113.70 3iob h GLU 45 Ca -0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 3iob h GLU 45 Cb 0.62 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 3iob h GLU 45 CO 0.26 0.10 0.10 0.78 -1.18 0.00 0.00 179.01 179.07 3iob h GLY 46 N 0.45 0.22 1.01 1.92 0.00 -1.92 -0.43 103.07 104.31 3iob h GLY 46 Ca -0.00 -0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.26 3iob h GLY 46 CO 0.01 0.08 0.50 0.45 0.00 0.00 0.00 176.54 177.58 3iob h HIS 47 N 0.21 0.95 0.00 5.60 3.86 -1.77 -2.80 115.15 121.19 3iob h HIS 47 Ca 0.06 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.26 3iob h HIS 47 Cb -0.02 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.12 3iob h HIS 47 CO -0.07 0.60 -0.15 -0.07 0.86 0.00 0.00 177.93 179.10 3iob h LEU 48 N 1.02 0.00 -0.99 2.43 3.38 -0.94 -0.53 115.31 119.68 3iob h LEU 48 Ca 0.28 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.18 3iob h LEU 48 Cb -0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3iob h LEU 48 CO -0.06 0.15 0.00 0.00 0.09 0.00 0.00 178.44 178.63 3iob h ALA 49 N 1.85 1.17 -0.15 1.53 0.00 -0.82 0.21 119.26 123.04 3iob h ALA 49 Ca -0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3iob h ALA 49 Cb 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3iob h ALA 49 CO 0.02 0.54 0.03 -0.07 0.00 0.00 0.00 179.25 179.77 3iob h LEU 50 N 0.69 0.24 -0.36 0.00 3.38 -1.02 -1.40 115.31 116.83 3iob h LEU 50 Ca 0.14 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 57.92 3iob h LEU 50 Cb 0.42 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 3iob h LEU 50 CO 0.02 0.42 0.07 0.58 0.09 0.00 0.00 178.44 179.61 3iob h VAL 51 N 0.05 0.82 -0.69 1.22 2.07 -1.11 -1.16 116.25 117.44 3iob h VAL 51 Ca 0.05 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 3iob h VAL 51 Cb 0.28 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3iob h VAL 51 CO 0.00 0.03 0.22 0.03 0.02 0.00 0.00 177.57 177.88 3iob h ARG 52 N 0.19 1.06 -0.88 1.57 3.08 -0.89 0.20 114.38 118.71 3iob h ARG 52 Ca 0.17 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3iob h ARG 52 Cb 0.20 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 3iob h ARG 52 CO -0.23 0.90 0.55 0.00 -1.07 0.00 0.00 179.97 180.13 3iob h ALA 53 N 1.22 1.11 -0.35 0.04 0.00 -1.00 -2.40 119.26 117.88 3iob h ALA 53 Ca 0.23 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3iob h ALA 53 Cb 0.28 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3iob h ALA 53 CO -0.01 0.55 -0.10 0.00 0.00 0.00 0.00 179.25 179.69 3iob h ALA 54 N 1.30 0.48 -0.30 0.00 0.00 -0.65 -3.25 119.26 116.85 3iob h ALA 54 Ca 0.32 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3iob h ALA 54 Cb -0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3iob h ALA 54 CO -0.06 0.34 0.02 -0.22 0.00 0.00 0.00 179.25 179.33 3iob h LYS 55 N 0.47 0.45 0.00 0.00 3.64 -0.25 -2.40 116.57 118.47 3iob h LYS 55 Ca 0.09 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3iob h LYS 55 Cb 0.62 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3iob h LYS 55 CO 0.04 0.46 0.00 2.89 -2.27 0.00 0.00 179.45 180.56 3iob n ARG 56 N -4.33 0.44 -2.19 1.90 1.85 -0.94 -4.70 116.66 108.69 3iob n ARG 56 Ca 0.01 0.03 -0.42 0.00 -1.00 0.00 0.00 57.85 56.47 3iob n ARG 56 Cb 0.21 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.09 3iob n ARG 56 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3iob s VAL 57 N -2.50 3.73 0.25 8.89 1.01 -0.91 -4.92 120.40 125.95 3iob s VAL 57 Ca 0.27 1.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.98 3iob s VAL 57 Cb 0.18 -3.67 -0.12 0.00 0.00 0.00 0.00 36.38 32.77 3iob s VAL 57 CO 0.39 -0.04 1.66 -2.65 0.00 0.00 0.00 175.10 174.47 3iob n PRO 58 N 6.01 2.74 -0.99 2.72 -0.02 -1.26 -1.36 135.00 142.84 3iob n PRO 58 Ca 0.14 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 3iob n PRO 58 Cb 0.43 -2.80 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 3iob n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iob n GLY 59 N 3.07 0.43 3.76 -1.23 0.00 -1.26 -4.77 105.19 105.19 3iob n GLY 59 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3iob n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iob s SER 60 N -2.08 5.84 -0.11 1.61 1.04 -0.47 -2.35 113.70 117.18 3iob s SER 60 Ca 0.00 2.63 0.02 0.00 0.48 0.00 0.00 55.95 59.08 3iob s SER 60 Cb 0.00 -2.63 -0.01 0.00 0.10 0.00 0.00 66.02 63.48 3iob s SER 60 CO 0.00 -1.17 -0.16 0.54 0.98 0.00 0.00 173.24 173.43 3iob s VAL 61 N -1.35 2.80 -0.23 5.02 0.11 -0.17 -4.83 120.40 121.75 3iob s VAL 61 Ca 0.65 -0.77 -0.10 0.00 -2.93 0.00 0.00 61.98 58.83 3iob s VAL 61 Cb -0.37 -2.14 -0.05 0.00 -1.53 0.00 0.00 36.38 32.30 3iob s VAL 61 CO 0.45 0.54 0.14 -0.69 -3.33 0.00 0.00 175.10 172.22 3iob s VAL 62 N 0.16 5.23 -0.24 2.04 1.01 -1.26 -1.08 120.40 126.26 3iob s VAL 62 Ca -0.09 0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.98 3iob s VAL 62 Cb -0.15 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 3iob s VAL 62 CO 0.05 0.37 0.00 -0.69 0.00 0.00 0.00 175.10 174.84 3iob s VAL 63 N 0.93 3.67 -0.23 2.92 1.01 0.64 -2.52 120.40 126.82 3iob s VAL 63 Ca 0.07 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 3iob s VAL 63 Cb -0.13 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3iob s VAL 63 CO 0.03 0.33 0.02 -0.69 0.00 0.00 0.00 175.10 174.80 3iob s VAL 64 N 1.51 3.94 0.01 2.92 1.01 -0.52 -0.46 120.40 128.80 3iob s VAL 64 Ca 0.05 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 61.63 3iob s VAL 64 Cb -0.15 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 3iob s VAL 64 CO -0.01 0.38 0.32 -0.94 0.00 0.00 0.00 175.10 174.86 3iob s SER 65 N 1.46 6.61 -0.19 3.32 1.04 -0.72 -0.78 113.70 124.44 3iob s SER 65 Ca 0.05 0.72 -0.00 0.00 0.48 0.00 0.00 55.95 57.21 3iob s SER 65 Cb -0.15 -2.16 0.05 0.00 0.10 0.00 0.00 66.02 63.86 3iob s SER 65 CO 0.01 0.28 -0.05 -0.63 0.98 0.00 0.00 173.24 173.82 3iob s ILE 66 N -1.22 1.20 -0.29 -1.02 1.01 -0.19 -0.69 121.20 120.00 3iob s ILE 66 Ca 0.26 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 3iob s ILE 66 Cb -0.14 -1.41 0.14 0.00 0.01 0.00 0.00 42.46 41.05 3iob s ILE 66 CO 0.14 0.06 0.61 0.12 0.00 0.00 0.00 174.94 175.87 3iob s PHE 67 N 1.58 -1.34 -0.70 3.97 5.36 -0.87 -4.15 117.98 121.83 3iob s PHE 67 Ca -0.01 2.09 -0.22 0.00 -0.96 0.00 0.00 56.93 57.82 3iob s PHE 67 Cb -0.16 0.69 0.07 0.00 -0.34 0.00 0.00 43.02 43.28 3iob s PHE 67 CO -0.07 -0.70 1.01 0.08 -1.46 0.00 0.00 175.22 174.07 3iob s VAL 68 N 2.86 4.32 -0.51 3.12 1.01 -1.26 -4.26 120.40 125.68 3iob s VAL 68 Ca 0.01 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.26 3iob s VAL 68 Cb -0.13 -4.71 0.03 0.00 0.00 0.00 0.00 36.38 31.57 3iob s VAL 68 CO -0.19 -1.49 1.20 0.21 0.00 0.00 0.00 175.10 174.83 3iob s ASN 69 N 3.71 6.52 0.55 3.32 2.47 -1.26 -4.89 114.94 125.35 3iob s ASN 69 Ca 0.24 0.39 0.23 0.00 0.42 0.00 0.00 52.86 54.14 3iob s ASN 69 Cb -0.15 -2.55 1.47 0.00 -1.45 0.00 0.00 41.25 38.57 3iob s ASN 69 CO 0.08 -1.37 2.13 -0.65 -3.72 0.00 0.00 177.10 173.57 3iob h PRO 70 N 9.59 0.00 0.00 0.43 0.11 -1.95 -2.78 132.00 137.40 3iob h PRO 70 Ca -0.24 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.85 3iob h PRO 70 Cb 1.07 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3iob h PRO 70 CO 1.14 0.00 -0.08 1.98 -0.21 0.00 0.00 178.00 180.83 3iob h MET 71 N 0.00 0.00 -0.28 1.05 4.05 -1.90 -2.58 114.93 115.26 3iob h MET 71 Ca 0.07 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 3iob h MET 71 Cb 0.30 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 3iob h MET 71 CO -0.00 0.08 0.00 0.00 0.23 0.00 0.00 176.91 177.22 3iob n GLN 72 N -3.21 2.05 -4.19 0.39 10.64 -1.05 -4.20 117.38 117.82 3iob n GLN 72 Ca 0.00 -1.59 -0.32 0.00 -1.83 0.00 0.00 57.00 53.26 3iob n GLN 72 Cb 0.35 -1.43 -0.08 0.00 -0.86 0.00 0.00 30.24 28.22 3iob n GLN 72 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3iob s PHE 73 N -1.64 3.10 0.20 2.61 0.40 -0.97 -4.72 117.98 116.96 3iob s PHE 73 Ca 0.34 0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.79 3iob s PHE 73 Cb 0.19 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 42.05 3iob s PHE 73 CO 0.27 0.49 0.23 0.20 0.70 0.00 0.00 175.22 177.11 3iob s GLY 74 N -1.89 1.54 0.78 4.36 0.00 -1.26 -5.02 107.32 105.83 3iob s GLY 74 Ca 0.23 -1.23 -0.15 0.00 0.00 0.00 0.00 44.72 43.57 3iob s GLY 74 CO 0.14 -1.25 0.59 0.00 0.00 0.00 0.00 173.10 172.58 3iob n ALA 75 N -0.82 -1.54 -1.00 3.20 0.00 -1.26 -4.31 120.51 114.79 3iob n ALA 75 Ca -0.08 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.03 3iob n ALA 75 Cb 0.56 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.12 3iob n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iob n GLY 76 N 1.49 -0.69 0.00 0.00 0.00 -1.26 -4.78 105.19 99.95 3iob n GLY 76 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3iob n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iob n GLY 77 N 0.99 1.05 0.30 -0.02 0.00 -1.26 -4.73 105.19 101.51 3iob n GLY 77 Ca 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 46.02 45.75 3iob n GLY 77 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3iob h ASP 78 N 0.00 0.82 -0.25 1.61 3.32 -1.87 -2.74 116.42 117.32 3iob h ASP 78 Ca 0.00 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 3iob h ASP 78 Cb 0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 3iob h ASP 78 CO 0.00 0.84 0.11 0.25 -1.72 0.00 0.00 179.24 178.72 3iob h LEU 79 N 0.82 0.33 -1.42 1.55 5.85 -1.85 -2.02 115.31 118.57 3iob h LEU 79 Ca 0.17 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 3iob h LEU 79 Cb 0.39 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3iob h LEU 79 CO 0.01 0.39 -0.29 0.44 -0.34 0.00 0.00 178.44 178.66 3iob h ASP 80 N 0.26 0.00 0.93 1.25 3.32 -1.88 -2.93 116.42 117.37 3iob h ASP 80 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3iob h ASP 80 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3iob h ASP 80 CO -0.01 0.29 -0.22 0.00 -1.72 0.00 0.00 179.24 177.57 3iob n ALA 81 N -2.41 2.73 -1.92 3.45 0.00 -0.96 -4.89 120.51 116.50 3iob n ALA 81 Ca -0.02 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.83 3iob n ALA 81 Cb 0.36 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 3iob n ALA 81 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3iob s TYR 82 N -3.04 3.06 0.21 0.00 5.04 -0.80 -4.91 117.35 116.90 3iob s TYR 82 Ca 0.11 0.88 -0.31 0.00 -2.44 0.00 0.00 57.07 55.32 3iob s TYR 82 Cb 0.17 -3.84 -0.10 0.00 0.35 0.00 0.00 41.96 38.53 3iob s TYR 82 CO 0.62 -2.89 1.55 -1.25 -1.34 0.00 0.00 175.55 172.23 3iob s PRO 83 N 0.28 4.21 -0.19 4.97 0.04 -1.26 -5.00 135.00 138.05 3iob s PRO 83 Ca 0.63 2.39 0.01 0.00 0.04 0.00 0.00 61.00 64.08 3iob s PRO 83 Cb -0.42 -3.12 0.03 0.00 0.04 0.00 0.00 34.50 31.04 3iob s PRO 83 CO 0.38 -0.57 -0.13 1.03 0.04 0.00 0.00 177.00 177.75 3iob s ARG 84 N 0.47 2.29 -0.45 4.56 0.52 -1.26 -4.40 118.95 120.68 3iob s ARG 84 Ca 0.66 -0.80 0.09 0.00 -0.52 0.00 0.00 55.73 55.16 3iob s ARG 84 Cb -0.44 -2.40 0.32 0.00 0.52 0.00 0.00 34.95 32.95 3iob s ARG 84 CO 0.37 -0.35 0.74 0.25 0.02 0.00 0.00 175.30 176.33 3iob n THR 85 N 4.68 0.68 0.10 0.02 -2.24 -1.26 -4.99 114.28 111.27 3iob n THR 85 Ca -0.16 -4.75 -0.01 0.00 -2.27 0.00 0.00 64.05 56.86 3iob n THR 85 Cb 0.48 -1.03 0.27 0.00 -2.10 0.00 0.00 70.33 67.94 3iob n THR 85 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3iob h PRO 86 N 3.31 0.24 -0.33 -0.78 0.13 -1.99 -1.12 132.00 131.46 3iob h PRO 86 Ca 0.11 -0.10 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 3iob h PRO 86 Cb 0.82 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 3iob h PRO 86 CO 0.59 0.55 0.08 -0.44 -0.23 0.00 0.00 178.00 178.55 3iob h ASP 87 N 0.21 0.50 -0.54 1.44 3.32 -2.00 -1.45 116.42 117.90 3iob h ASP 87 Ca 0.03 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3iob h ASP 87 Cb 0.69 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 3iob h ASP 87 CO 0.05 0.60 0.25 0.44 -1.72 0.00 0.00 179.24 178.86 3iob h ASP 88 N 0.38 0.72 0.06 6.45 3.32 -1.94 -2.65 116.42 122.76 3iob h ASP 88 Ca 0.10 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3iob h ASP 88 Cb 0.30 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 3iob h ASP 88 CO 0.00 0.67 -0.25 0.44 -1.72 0.00 0.00 179.24 178.38 3iob h ASP 89 N 0.73 -0.72 -0.43 6.45 3.32 -0.86 -0.44 116.42 124.46 3iob h ASP 89 Ca 0.18 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.27 3iob h ASP 89 Cb 0.15 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3iob h ASP 89 CO -0.02 -0.33 0.08 -0.07 -1.72 0.00 0.00 179.24 177.19 3iob h LEU 90 N -0.42 0.74 -0.44 1.55 3.38 -1.31 -1.78 115.31 117.03 3iob h LEU 90 Ca 0.05 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3iob h LEU 90 Cb 0.47 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3iob h LEU 90 CO -0.18 0.75 0.27 0.00 0.09 0.00 0.00 178.44 179.37 3iob h ALA 91 N 1.34 0.56 -0.80 1.53 0.00 -1.16 -0.95 119.26 119.78 3iob h ALA 91 Ca 0.16 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3iob h ALA 91 Cb 0.34 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3iob h ALA 91 CO 0.00 0.04 0.41 1.96 0.00 0.00 0.00 179.25 181.67 3iob h GLN 92 N 0.58 1.12 -0.48 0.00 4.20 -0.67 -1.68 115.11 118.18 3iob h GLN 92 Ca 0.16 -0.14 -0.12 0.00 0.06 0.00 0.00 58.65 58.61 3iob h GLN 92 Cb -0.02 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 3iob h GLN 92 CO -0.03 0.84 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.75 3iob h LEU 93 N 1.12 0.97 -0.47 1.46 3.38 -0.97 -2.26 115.31 118.55 3iob h LEU 93 Ca 0.28 -0.38 0.06 0.00 0.09 0.00 0.00 57.88 57.93 3iob h LEU 93 Cb 0.07 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 3iob h LEU 93 CO -0.04 1.13 0.18 0.03 0.09 0.00 0.00 178.44 179.83 3iob h ARG 94 N 0.81 0.35 0.00 1.13 3.08 -0.97 -2.08 114.38 116.70 3iob h ARG 94 Ca 0.12 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 3iob h ARG 94 Cb 0.73 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 3iob h ARG 94 CO 0.06 0.23 -0.10 0.00 -1.07 0.00 0.00 179.97 179.09 3iob h ALA 95 N 1.31 1.55 -0.01 0.04 0.00 -1.06 -2.43 119.26 118.66 3iob h ALA 95 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3iob h ALA 95 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3iob h ALA 95 CO -0.22 0.13 -0.21 0.39 0.00 0.00 0.00 179.25 179.34 3iob n GLU 96 N -4.01 1.08 -1.61 0.00 -0.58 -0.87 -4.94 120.64 109.70 3iob n GLU 96 Ca -0.02 -0.66 -0.07 0.00 -0.42 0.00 0.00 57.16 55.98 3iob n GLU 96 Cb 0.19 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.55 3iob n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iob n GLY 97 N 1.31 0.57 3.75 0.62 0.00 -0.92 -5.00 105.19 105.52 3iob n GLY 97 Ca 0.13 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 3iob n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iob s VAL 98 N -2.31 3.00 -0.05 1.61 1.01 -0.83 -4.95 120.40 117.87 3iob s VAL 98 Ca 0.00 0.91 0.22 0.00 0.00 0.00 0.00 61.98 63.11 3iob s VAL 98 Cb 0.00 -3.58 -0.31 0.00 0.00 0.00 0.00 36.38 32.49 3iob s VAL 98 CO 0.00 0.18 0.52 -0.62 0.00 0.00 0.00 175.10 175.18 3iob n GLU 99 N 1.74 0.66 -3.98 2.72 1.02 -1.25 -3.96 120.64 117.59 3iob n GLU 99 Ca 0.03 -0.17 -0.21 0.00 -0.02 0.00 0.00 57.16 56.80 3iob n GLU 99 Cb 0.42 -1.55 -0.17 0.00 -0.02 0.00 0.00 31.44 30.13 3iob n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3iob s ILE 100 N -3.48 0.42 -0.13 -3.67 1.01 -1.05 -0.23 121.20 114.07 3iob s ILE 100 Ca -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 60.65 60.56 3iob s ILE 100 Cb 0.13 -0.51 -0.02 0.00 0.01 0.00 0.00 42.46 42.08 3iob s ILE 100 CO 0.90 0.22 -0.11 0.00 0.00 0.00 0.00 174.94 175.95 3iob s ALA 101 N 1.31 2.70 -0.30 9.38 0.00 -0.15 -1.44 121.76 133.27 3iob s ALA 101 Ca -0.05 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 3iob s ALA 101 Cb -0.13 -1.28 0.03 0.00 0.00 0.00 0.00 23.12 21.73 3iob s ALA 101 CO -0.02 0.25 0.04 0.12 0.00 0.00 0.00 175.76 176.14 3iob s PHE 102 N 0.33 3.18 -0.58 0.00 5.36 0.04 -1.38 117.98 124.92 3iob s PHE 102 Ca -0.09 -1.40 0.06 0.00 -0.96 0.00 0.00 56.93 54.53 3iob s PHE 102 Cb -0.15 -2.18 0.23 0.00 -0.34 0.00 0.00 43.02 40.57 3iob s PHE 102 CO 0.05 -0.70 0.62 0.25 -1.46 0.00 0.00 175.22 173.99 3iob n THR 103 N 4.76 1.31 -1.83 0.12 -2.24 -0.14 -1.02 114.28 115.23 3iob n THR 103 Ca -0.14 -4.77 -0.32 0.00 -2.27 0.00 0.00 64.05 56.55 3iob n THR 103 Cb 0.46 -2.05 0.03 0.00 -2.10 0.00 0.00 70.33 66.67 3iob n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3iob s PRO 104 N -1.83 3.10 0.57 -0.78 0.04 -1.25 -4.37 135.00 130.48 3iob s PRO 104 Ca 0.36 1.14 -0.09 0.00 0.04 0.00 0.00 61.00 62.44 3iob s PRO 104 Cb 0.11 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 3iob s PRO 104 CO -0.08 -0.98 0.95 0.95 0.04 0.00 0.00 177.00 177.88 3iob s THR 105 N -2.65 4.76 0.24 1.26 -4.23 -1.26 -4.90 115.64 108.86 3iob s THR 105 Ca 0.62 0.69 -0.07 0.00 -1.18 0.00 0.00 61.69 61.75 3iob s THR 105 Cb -0.16 -3.86 0.22 0.00 1.34 0.00 0.00 72.50 70.04 3iob s THR 105 CO 0.44 -1.03 1.90 0.74 -0.54 0.00 0.00 174.62 176.13 3iob h THR 106 N -0.08 1.18 -0.72 3.99 2.02 -1.97 -2.38 112.91 114.96 3iob h THR 106 Ca -0.45 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 3iob h THR 106 Cb 1.19 -0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 3iob h THR 106 CO 0.62 0.21 0.42 0.00 0.37 0.00 0.00 175.52 177.14 3iob h ALA 107 N 1.35 1.38 -0.01 6.16 0.00 -1.94 0.10 119.26 126.30 3iob h ALA 107 Ca 0.34 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 3iob h ALA 107 Cb -0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3iob h ALA 107 CO -0.10 0.53 -0.67 0.00 0.00 0.00 0.00 179.25 179.01 3iob h ALA 108 N 1.46 0.88 0.11 0.00 0.00 -1.86 -2.38 119.26 117.47 3iob h ALA 108 Ca 0.26 -0.60 -0.30 0.00 0.00 0.00 0.00 54.91 54.26 3iob h ALA 108 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3iob h ALA 108 CO -0.05 0.82 -1.51 0.52 0.00 0.00 0.00 179.25 179.04 3iob h MET 109 N 0.02 0.23 -1.74 0.00 2.07 -0.95 -3.40 114.93 111.17 3iob h MET 109 Ca -0.01 -0.40 -0.52 0.00 -2.07 0.00 0.00 59.70 56.71 3iob h MET 109 Cb 1.19 0.15 -0.41 0.00 -1.87 0.00 0.00 31.60 30.65 3iob h MET 109 CO 0.09 1.09 -0.91 0.66 1.07 0.00 0.00 176.91 178.91 3iob n TYR 110 N -3.44 2.41 0.29 -0.22 4.01 0.31 -4.89 117.16 115.64 3iob n TYR 110 Ca -0.16 -3.46 0.17 0.00 -0.16 0.00 0.00 57.90 54.29 3iob n TYR 110 Cb 1.04 -0.34 0.85 0.00 -0.31 0.00 0.00 39.34 40.58 3iob n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3iob h PRO 111 N 2.88 0.00 -0.26 -0.72 0.13 -1.64 -2.06 132.00 130.33 3iob h PRO 111 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3iob h PRO 111 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3iob h PRO 111 CO 0.69 0.05 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 3iob n ASP 112 N -3.32 3.68 0.00 1.44 8.00 -1.26 -5.09 116.55 119.99 3iob n ASP 112 Ca -0.01 -2.88 0.00 0.00 0.71 0.00 0.00 54.79 52.61 3iob n ASP 112 Cb 0.21 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 3iob n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iob n GLY 113 N -0.41 0.77 3.47 0.44 0.00 -0.78 -4.33 105.19 104.35 3iob n GLY 113 Ca 0.20 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 3iob n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iob s LEU 114 N 0.00 4.72 0.00 0.99 1.43 -1.26 -4.86 118.68 119.70 3iob s LEU 114 Ca 0.00 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 3iob s LEU 114 Cb 0.00 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.66 3iob s LEU 114 CO 0.00 -0.96 0.00 -1.14 0.23 0.00 0.00 176.35 174.48 3iob n ARG 115 N 6.47 0.00 -2.59 1.70 0.63 -1.26 -5.02 116.66 116.60 3iob n ARG 115 Ca -0.04 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.48 3iob n ARG 115 Cb 0.46 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.33 3iob n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3iob s THR 116 N 0.54 4.20 0.18 5.15 2.01 -1.26 -5.03 115.64 121.44 3iob s THR 116 Ca 0.00 1.78 -0.00 0.00 0.31 0.00 0.00 61.69 63.78 3iob s THR 116 Cb 0.00 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 3iob s THR 116 CO 0.00 0.25 0.08 0.42 -0.69 0.00 0.00 174.62 174.68 3iob s THR 117 N 0.19 0.25 -0.10 -0.82 -4.23 -1.26 -5.12 115.64 104.56 3iob s THR 117 Ca 0.50 -1.97 -0.17 0.00 -1.18 0.00 0.00 61.69 58.88 3iob s THR 117 Cb -0.27 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.22 3iob s THR 117 CO 0.32 -0.24 0.43 -0.69 -0.54 0.00 0.00 174.62 173.89 3iob s VAL 118 N -3.96 5.17 -0.44 2.29 1.01 -1.26 -5.05 120.40 118.15 3iob s VAL 118 Ca 0.31 0.85 -0.13 0.00 0.00 0.00 0.00 61.98 63.01 3iob s VAL 118 Cb 0.07 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 32.75 3iob s VAL 118 CO 0.07 0.40 0.33 -1.58 0.00 0.00 0.00 175.10 174.32 3iob s GLN 119 N 0.18 2.87 0.91 2.72 2.00 -1.26 -4.60 119.66 122.48 3iob s GLN 119 Ca 0.24 -1.29 -0.12 0.00 -2.00 0.00 0.00 55.36 52.19 3iob s GLN 119 Cb -0.15 -3.98 0.14 0.00 0.80 0.00 0.00 33.01 29.82 3iob s GLN 119 CO 0.10 -0.93 1.09 -2.14 -0.50 0.00 0.00 175.29 172.91 3iob s PRO 120 N 1.59 1.11 1.14 1.67 0.02 -1.26 -5.05 135.00 134.22 3iob s PRO 120 Ca 0.04 0.84 -0.19 0.00 0.02 0.00 0.00 61.00 61.70 3iob s PRO 120 Cb -0.23 -1.79 0.29 0.00 0.02 0.00 0.00 34.50 32.79 3iob s PRO 120 CO 0.06 -2.35 0.92 0.41 -0.33 0.00 0.00 177.00 175.71 3iob n GLY 121 N -0.99 -3.04 0.33 0.52 0.00 -1.26 -4.86 105.19 95.89 3iob n GLY 121 Ca 0.07 -1.44 0.18 0.00 0.00 0.00 0.00 46.02 44.83 3iob n GLY 121 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iob h PRO 122 N 0.00 0.00 -0.18 1.61 0.11 -2.03 -2.12 132.00 129.39 3iob h PRO 122 Ca -0.36 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.77 3iob h PRO 122 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3iob h PRO 122 CO 0.23 0.00 0.12 1.25 -0.21 0.00 0.00 178.00 179.40 3iob h LEU 123 N 0.00 0.13 -1.72 2.35 5.85 -1.94 -2.08 115.31 117.90 3iob h LEU 123 Ca 0.04 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3iob h LEU 123 Cb 0.30 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3iob h LEU 123 CO -0.00 0.09 0.00 0.00 -0.34 0.00 0.00 178.44 178.19 3iob h ALA 124 N 1.90 1.00 -0.00 1.25 0.00 -1.71 -2.33 119.26 119.37 3iob h ALA 124 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3iob h ALA 124 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3iob h ALA 124 CO -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 179.25 179.05 3iob n ALA 125 N -1.96 2.85 -2.47 0.00 0.00 -0.78 -3.96 120.51 114.18 3iob n ALA 125 Ca -0.00 -0.24 -0.23 0.00 0.00 0.00 0.00 53.44 52.97 3iob n ALA 125 Cb 0.17 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 3iob n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3iob s GLU 126 N -2.79 2.43 5.07 0.00 2.02 -0.88 -2.78 118.70 121.77 3iob s GLU 126 Ca 0.19 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.64 3iob s GLU 126 Cb 0.19 -2.22 0.00 0.00 0.10 0.00 0.00 34.13 32.20 3iob s GLU 126 CO 0.56 0.05 0.00 1.28 0.02 0.00 0.00 175.26 177.16 3iob n LEU 127 N -1.24 0.00 0.03 1.80 4.77 -1.26 -0.42 117.00 120.68 3iob n LEU 127 Ca -0.02 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.14 3iob n LEU 127 Cb 0.61 0.00 0.67 0.00 -2.33 0.00 0.00 43.42 42.37 3iob n LEU 127 CO 0.43 0.00 1.17 -0.33 -1.33 0.00 0.00 177.39 177.33 3iob h GLU 128 N 0.00 0.03 0.00 3.23 4.39 -1.93 -2.59 114.58 117.71 3iob h GLU 128 Ca 0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3iob h GLU 128 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 3iob h GLU 128 CO 0.00 0.02 0.00 0.41 -1.16 0.00 0.00 179.01 178.28 3iob n GLY 129 N -1.62 -1.60 0.44 -3.84 0.00 0.44 -3.98 105.19 95.03 3iob n GLY 129 Ca 0.08 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 3iob n GLY 129 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3iob h GLY 130 N 4.69 -1.20 1.80 -0.02 0.00 -1.28 -2.09 103.07 104.98 3iob h GLY 130 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 47.33 47.88 3iob h GLY 130 CO 0.00 -0.36 -0.01 -1.55 0.00 0.00 0.00 176.54 174.62 3iob n PRO 131 N -5.11 0.18 -3.18 4.80 -0.04 -1.26 -4.34 135.00 126.06 3iob n PRO 131 Ca -0.11 -0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.12 3iob n PRO 131 Cb 0.41 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 3iob n PRO 131 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3iob n ARG 132 N -1.41 1.71 0.19 0.54 1.74 -0.84 -4.98 116.66 113.63 3iob n ARG 132 Ca 0.10 -3.92 0.14 0.00 -0.77 0.00 0.00 57.85 53.40 3iob n ARG 132 Cb 0.30 -1.80 0.67 0.00 -1.02 0.00 0.00 32.46 30.62 3iob n ARG 132 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3iob h PRO 133 N 3.51 0.00 -0.02 5.56 0.13 -1.62 -1.84 132.00 137.72 3iob h PRO 133 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3iob h PRO 133 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3iob h PRO 133 CO 0.63 0.00 -0.34 0.25 -0.23 0.00 0.00 178.00 178.31 3iob n THR 134 N -2.47 0.00 0.05 1.56 -2.24 -1.26 -4.70 114.28 105.22 3iob n THR 134 Ca -0.00 -0.33 -0.11 0.00 -2.27 0.00 0.00 64.05 61.33 3iob n THR 134 Cb 0.13 1.26 -0.04 0.00 -2.10 0.00 0.00 70.33 69.58 3iob n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3iob h HIS 135 N 2.48 -0.64 0.00 4.78 6.17 -1.61 -2.56 115.15 123.77 3iob h HIS 135 Ca 0.00 0.02 -0.11 0.00 0.71 0.00 0.00 60.37 61.00 3iob h HIS 135 Cb 0.70 0.29 -0.02 0.00 2.52 0.00 0.00 27.41 30.90 3iob h HIS 135 CO 0.00 -0.33 -0.51 0.74 0.71 0.00 0.00 177.93 178.54 3iob h PHE 136 N -0.36 0.00 -0.87 5.26 0.04 -1.84 -2.26 116.94 116.92 3iob h PHE 136 Ca 0.07 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.86 3iob h PHE 136 Cb 0.45 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.56 3iob h PHE 136 CO -0.29 0.51 0.56 0.00 -0.60 0.00 0.00 178.31 178.49 3iob h ALA 137 N 1.49 1.12 -0.71 2.45 0.00 -1.79 0.19 119.26 122.02 3iob h ALA 137 Ca -0.01 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3iob h ALA 137 Cb 1.17 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 3iob h ALA 137 CO 0.07 0.44 0.45 0.78 0.00 0.00 0.00 179.25 180.99 3iob h GLY 138 N 1.12 1.03 0.60 0.00 0.00 -1.01 -1.61 103.07 103.19 3iob h GLY 138 Ca 0.33 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 3iob h GLY 138 CO -0.10 0.30 -0.03 -2.08 0.00 0.00 0.00 176.54 174.63 3iob h VAL 139 N 0.89 1.20 -0.22 4.60 2.07 -0.99 -2.27 116.25 121.54 3iob h VAL 139 Ca 0.28 -0.90 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 3iob h VAL 139 Cb 0.00 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3iob h VAL 139 CO -0.10 0.22 -0.16 -0.07 0.02 0.00 0.00 177.57 177.48 3iob h LEU 140 N -0.48 0.35 -0.12 2.57 3.38 -0.60 -1.05 115.31 119.35 3iob h LEU 140 Ca -0.01 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3iob h LEU 140 Cb 0.43 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3iob h LEU 140 CO 0.01 0.54 0.00 0.74 0.09 0.00 0.00 178.44 179.82 3iob h THR 141 N 0.34 1.25 -0.33 0.22 2.02 -1.29 -0.84 112.91 114.28 3iob h THR 141 Ca 0.06 -0.81 -0.11 0.00 0.77 0.00 0.00 66.41 66.32 3iob h THR 141 Cb 0.48 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 3iob h THR 141 CO 0.03 0.23 -0.25 1.62 0.37 0.00 0.00 175.52 177.53 3iob h VAL 142 N -0.05 1.27 -0.39 3.16 3.04 -1.19 -2.17 116.25 119.92 3iob h VAL 142 Ca 0.03 -1.33 -0.16 0.00 -1.01 0.00 0.00 66.70 64.24 3iob h VAL 142 Cb 0.36 1.29 -0.01 0.00 -2.01 0.00 0.00 31.29 30.92 3iob h VAL 142 CO 0.01 0.43 -0.37 0.58 -1.01 0.00 0.00 177.57 177.21 3iob h VAL 143 N 0.57 1.27 -0.26 1.51 2.07 -1.14 0.23 116.25 120.50 3iob h VAL 143 Ca 0.08 -1.54 0.03 0.00 0.82 0.00 0.00 66.70 66.08 3iob h VAL 143 Cb 0.72 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 3iob h VAL 143 CO 0.06 0.52 0.08 0.25 0.02 0.00 0.00 177.57 178.49 3iob h LEU 144 N 0.77 0.07 -0.59 2.57 5.85 -1.03 0.44 115.31 123.39 3iob h LEU 144 Ca 0.07 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3iob h LEU 144 Cb 0.96 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3iob h LEU 144 CO 0.09 0.07 0.37 0.11 -0.34 0.00 0.00 178.44 178.74 3iob h LYS 145 N 0.19 0.80 -0.61 1.25 1.57 -1.02 -1.38 116.57 117.37 3iob h LYS 145 Ca 0.11 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3iob h LYS 145 Cb 0.09 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 3iob h LYS 145 CO -0.13 0.57 0.27 -0.07 -0.57 0.00 0.00 179.45 179.52 3iob h LEU 146 N 0.80 0.82 -1.24 2.94 3.38 -0.60 0.13 115.31 121.55 3iob h LEU 146 Ca 0.21 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3iob h LEU 146 Cb -0.03 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3iob h LEU 146 CO -0.04 0.74 0.38 -0.07 0.09 0.00 0.00 178.44 179.54 3iob h LEU 147 N 0.84 0.80 -0.21 1.67 3.38 -0.55 -0.76 115.31 120.47 3iob h LEU 147 Ca 0.21 -0.05 -0.22 0.00 0.09 0.00 0.00 57.88 57.91 3iob h LEU 147 Cb 0.16 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.71 3iob h LEU 147 CO -0.02 0.63 -0.85 1.56 0.09 0.00 0.00 178.44 179.85 3iob h GLN 148 N 0.91 0.56 -0.04 1.13 1.08 -0.61 0.17 115.11 118.31 3iob h GLN 148 Ca 0.24 -0.52 -0.01 0.00 -1.45 0.00 0.00 58.65 56.91 3iob h GLN 148 Cb -0.00 0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.55 3iob h GLN 148 CO -0.04 1.14 0.01 0.82 -0.95 0.00 0.00 178.83 179.81 3iob h ILE 149 N 0.36 1.21 0.00 2.54 2.04 -0.75 -3.35 117.51 119.56 3iob h ILE 149 Ca -0.07 -0.64 -0.24 0.00 1.00 0.00 0.00 64.86 64.92 3iob h ILE 149 Cb 1.47 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 39.06 3iob h ILE 149 CO 0.16 0.17 -1.76 0.52 0.00 0.00 0.00 178.15 177.24 3iob n VAL 150 N -4.92 1.30 -3.89 1.67 0.31 -0.31 -4.11 118.33 108.37 3iob n VAL 150 Ca -0.07 -0.75 -0.40 0.00 -0.01 0.00 0.00 64.34 63.11 3iob n VAL 150 Cb 0.16 -0.73 0.03 0.00 -0.91 0.00 0.00 33.84 32.39 3iob n VAL 150 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3iob n ARG 151 N -2.87 -0.69 -1.85 5.55 3.00 0.59 -4.79 116.66 115.60 3iob n ARG 151 Ca -0.17 0.26 -0.31 0.00 -0.00 0.00 0.00 57.85 57.63 3iob n ARG 151 Cb 0.96 -3.23 0.02 0.00 0.00 0.00 0.00 32.46 30.21 3iob n ARG 151 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 3iob s PRO 152 N -6.73 3.39 0.18 -0.14 0.04 -1.26 -4.87 135.00 125.61 3iob s PRO 152 Ca 0.48 0.88 -0.04 0.00 0.04 0.00 0.00 61.00 62.36 3iob s PRO 152 Cb -0.22 -2.05 0.09 0.00 0.04 0.00 0.00 34.50 32.36 3iob s PRO 152 CO 0.92 -0.73 1.50 -0.44 0.04 0.00 0.00 177.00 178.29 3iob h ASP 153 N -0.24 0.69 -4.57 6.66 3.32 -1.01 -3.43 116.42 117.83 3iob h ASP 153 Ca -0.44 -0.35 -0.19 0.00 0.02 0.00 0.00 57.03 56.06 3iob h ASP 153 Cb 1.20 -0.20 -0.23 0.00 0.22 0.00 0.00 39.33 40.32 3iob h ASP 153 CO 0.60 1.08 -0.70 -0.13 -1.72 0.00 0.00 179.24 178.37 3iob s ARG 154 N -4.08 0.22 -0.04 3.56 0.52 -1.22 -1.67 118.95 116.24 3iob s ARG 154 Ca -0.08 -0.40 0.05 0.00 -0.52 0.00 0.00 55.73 54.78 3iob s ARG 154 Cb 0.11 0.08 -0.01 0.00 0.52 0.00 0.00 34.95 35.65 3iob s ARG 154 CO 0.85 -0.04 -0.18 0.54 0.02 0.00 0.00 175.30 176.49 3iob s VAL 155 N -0.97 1.49 -0.16 3.52 0.11 -0.29 -1.27 120.40 122.82 3iob s VAL 155 Ca -0.11 -0.76 -0.02 0.00 -2.93 0.00 0.00 61.98 58.17 3iob s VAL 155 Cb -0.07 -1.27 -0.01 0.00 -1.53 0.00 0.00 36.38 33.50 3iob s VAL 155 CO -0.01 0.43 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.73 3iob s PHE 156 N -0.08 2.88 0.05 1.54 0.40 -0.29 -1.03 117.98 121.45 3iob s PHE 156 Ca -0.01 -0.72 0.05 0.00 -0.60 0.00 0.00 56.93 55.64 3iob s PHE 156 Cb -0.11 -1.93 -0.02 0.00 0.51 0.00 0.00 43.02 41.46 3iob s PHE 156 CO 0.02 -0.31 -0.15 -0.06 0.70 0.00 0.00 175.22 175.42 3iob s PHE 157 N 0.70 1.26 0.36 0.36 0.08 -0.53 -4.21 117.98 116.00 3iob s PHE 157 Ca -0.05 -0.39 -0.25 0.00 0.12 0.00 0.00 56.93 56.37 3iob s PHE 157 Cb -0.15 -0.73 -0.10 0.00 -0.57 0.00 0.00 43.02 41.46 3iob s PHE 157 CO 0.02 0.05 0.96 0.20 -0.10 0.00 0.00 175.22 176.35 3iob s GLY 158 N -1.36 2.69 0.60 4.36 0.00 -1.26 -0.65 107.32 111.69 3iob s GLY 158 Ca 0.01 0.51 0.38 0.00 0.00 0.00 0.00 44.72 45.63 3iob s GLY 158 CO 0.02 0.92 2.15 0.83 0.00 0.00 0.00 173.10 177.01 3iob h GLU 159 N 2.78 0.00 -0.68 2.90 5.08 -1.13 -3.23 114.58 120.30 3iob h GLU 159 Ca -0.47 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.00 3iob h GLU 159 Cb 1.19 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.36 3iob h GLU 159 CO 0.64 0.00 0.25 -0.22 -1.00 0.00 0.00 179.01 178.68 3iob h LYS 160 N 0.00 0.40 -3.64 2.33 3.11 -1.92 -2.61 116.57 114.24 3iob h LYS 160 Ca 0.00 -0.02 -0.79 0.00 -2.81 0.00 0.00 60.65 57.03 3iob h LYS 160 Cb 0.29 -0.09 -0.25 0.00 -1.00 0.00 0.00 32.23 31.17 3iob h LYS 160 CO 0.00 0.27 0.79 -0.25 -2.81 0.00 0.00 179.45 177.45 3iob n ASP 161 N -5.01 5.63 -0.08 4.20 8.00 -1.22 -4.64 116.55 123.43 3iob n ASP 161 Ca 0.11 -3.11 -0.14 0.00 0.71 0.00 0.00 54.79 52.36 3iob n ASP 161 Cb 0.34 -1.40 -0.05 0.00 -0.02 0.00 0.00 41.12 39.99 3iob n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3iob h TYR 162 N 6.42 0.91 -0.85 1.24 3.20 -1.70 -1.90 116.97 124.29 3iob h TYR 162 Ca 0.22 -0.30 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 3iob h TYR 162 Cb 0.80 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 3iob h TYR 162 CO 0.90 1.08 0.42 0.37 -1.64 0.00 0.00 178.16 179.29 3iob h GLN 163 N 0.48 1.22 -0.71 1.82 4.15 -1.88 -0.81 115.11 119.39 3iob h GLN 163 Ca 0.03 -0.17 0.01 0.00 0.77 0.00 0.00 58.65 59.28 3iob h GLN 163 Cb 0.98 -0.22 -0.04 0.00 0.21 0.00 0.00 27.48 28.41 3iob h GLN 163 CO 0.09 0.93 0.46 0.37 -1.93 0.00 0.00 178.83 178.76 3iob h GLN 164 N 1.21 0.91 -0.46 1.69 4.15 -1.88 -1.41 115.11 119.33 3iob h GLN 164 Ca 0.29 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.66 3iob h GLN 164 Cb 0.11 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 3iob h GLN 164 CO -0.04 0.61 0.30 1.25 -1.93 0.00 0.00 178.83 179.01 3iob h LEU 165 N 0.94 0.54 -0.41 -2.39 5.85 -0.54 -0.86 115.31 118.44 3iob h LEU 165 Ca 0.26 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.96 3iob h LEU 165 Cb -0.09 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 3iob h LEU 165 CO -0.06 0.40 0.27 0.58 -0.34 0.00 0.00 178.44 179.29 3iob h VAL 166 N 0.62 1.09 -0.37 1.05 2.07 -0.95 -1.39 116.25 118.38 3iob h VAL 166 Ca 0.17 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 3iob h VAL 166 Cb -0.05 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 3iob h VAL 166 CO -0.03 0.10 0.00 -0.07 0.02 0.00 0.00 177.57 177.59 3iob h LEU 167 N 0.54 0.55 -0.69 2.57 3.38 -1.02 -1.24 115.31 119.40 3iob h LEU 167 Ca 0.15 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3iob h LEU 167 Cb -0.05 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3iob h LEU 167 CO -0.04 0.62 -0.06 0.40 0.09 0.00 0.00 178.44 179.44 3iob h ILE 168 N 0.56 1.26 -0.41 1.22 2.04 -0.80 0.12 117.51 121.50 3iob h ILE 168 Ca 0.12 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.75 3iob h ILE 168 Cb 0.35 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3iob h ILE 168 CO 0.01 0.42 0.04 0.03 0.00 0.00 0.00 178.15 178.65 3iob h ARG 169 N 0.86 0.64 -0.09 2.37 3.08 -0.69 -1.32 114.38 119.23 3iob h ARG 169 Ca 0.15 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 3iob h ARG 169 Cb 0.59 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 3iob h ARG 169 CO 0.04 0.64 0.03 1.96 -1.07 0.00 0.00 179.97 181.56 3iob h GLN 170 N 0.62 0.14 -0.35 0.04 4.20 -0.72 -0.93 115.11 118.11 3iob h GLN 170 Ca 0.13 -0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.89 3iob h GLN 170 Cb 0.33 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.01 3iob h GLN 170 CO 0.01 0.29 -0.24 1.25 -0.67 0.00 0.00 178.83 179.47 3iob h LEU 171 N -0.04 -0.78 -0.16 1.46 5.85 -0.67 0.32 115.31 121.29 3iob h LEU 171 Ca 0.03 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 3iob h LEU 171 Cb 0.21 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 3iob h LEU 171 CO -0.00 -0.26 0.09 0.58 -0.34 0.00 0.00 178.44 178.50 3iob h VAL 172 N -0.19 1.10 -0.09 1.05 2.07 -1.14 -1.31 116.25 117.75 3iob h VAL 172 Ca 0.17 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 3iob h VAL 172 Cb 0.46 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 3iob h VAL 172 CO -0.46 0.09 0.05 0.00 0.02 0.00 0.00 177.57 177.28 3iob h ALA 173 N 0.98 0.12 0.00 1.67 0.00 -0.89 -0.93 119.26 120.21 3iob h ALA 173 Ca 0.06 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3iob h ALA 173 Cb 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3iob h ALA 173 CO -0.01 -0.35 -0.56 -0.44 0.00 0.00 0.00 179.25 177.89 3iob h ASP 174 N 0.05 0.00 -0.65 0.00 3.32 -0.25 -2.70 116.42 116.20 3iob h ASP 174 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3iob h ASP 174 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3iob h ASP 174 CO -0.01 0.56 0.00 0.49 -1.72 0.00 0.00 179.24 178.57 3iob n PHE 175 N -3.78 1.11 -3.86 4.55 3.72 -0.50 -4.98 117.46 113.72 3iob n PHE 175 Ca -0.01 -0.55 -0.30 0.00 -0.05 0.00 0.00 57.45 56.54 3iob n PHE 175 Cb 0.58 -0.10 0.02 0.00 -0.94 0.00 0.00 39.48 39.04 3iob n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3iob n ASN 176 N 1.29 -4.70 -4.75 4.37 4.13 -0.96 -4.93 115.26 109.72 3iob n ASN 176 Ca 0.24 -0.74 -0.41 0.00 1.68 0.00 0.00 54.58 55.34 3iob n ASN 176 Cb 0.71 -3.76 -0.03 0.00 -1.54 0.00 0.00 39.78 35.15 3iob n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3iob s LEU 177 N -7.20 4.46 -1.25 3.41 1.43 -0.39 -4.93 118.68 114.20 3iob s LEU 177 Ca 0.64 2.34 -0.08 0.00 -1.03 0.00 0.00 54.13 55.99 3iob s LEU 177 Cb -0.32 -3.62 0.19 0.00 0.03 0.00 0.00 46.19 42.47 3iob s LEU 177 CO 0.79 -0.39 1.84 -0.67 0.23 0.00 0.00 176.35 178.15 3iob n ASP 178 N 2.08 5.35 -3.75 2.29 2.03 -1.26 -4.86 116.55 118.43 3iob n ASP 178 Ca 0.03 -3.16 -0.13 0.00 0.52 0.00 0.00 54.79 52.05 3iob n ASP 178 Cb 0.44 -1.44 -0.10 0.00 -0.72 0.00 0.00 41.12 39.30 3iob n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3iob s VAL 179 N -0.12 0.02 -0.11 5.18 0.11 -1.26 -4.84 120.40 119.38 3iob s VAL 179 Ca 0.39 -0.17 -0.16 0.00 -2.93 0.00 0.00 61.98 59.11 3iob s VAL 179 Cb 0.09 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.35 3iob s VAL 179 CO 0.02 -0.09 0.39 0.00 -3.33 0.00 0.00 175.10 172.09 3iob s ALA 180 N -0.36 3.57 -0.20 1.54 0.00 -0.67 -4.97 121.76 120.67 3iob s ALA 180 Ca -0.05 -0.29 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 3iob s ALA 180 Cb -0.03 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.56 3iob s ALA 180 CO 0.02 0.14 0.48 0.08 0.00 0.00 0.00 175.76 176.48 3iob s VAL 181 N 0.18 5.14 -0.26 0.00 1.01 -1.26 -1.14 120.40 124.06 3iob s VAL 181 Ca 0.22 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 63.03 3iob s VAL 181 Cb -0.15 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.45 3iob s VAL 181 CO 0.09 0.20 -0.02 -0.69 0.00 0.00 0.00 175.10 174.68 3iob s VAL 182 N 1.54 3.19 -0.02 2.92 1.01 -0.20 -4.97 120.40 123.87 3iob s VAL 182 Ca 0.22 -0.93 -0.21 0.00 0.00 0.00 0.00 61.98 61.06 3iob s VAL 182 Cb -0.15 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 3iob s VAL 182 CO 0.09 0.16 0.61 -0.83 0.00 0.00 0.00 175.10 175.13 3iob s GLY 183 N 1.37 2.60 -0.11 4.51 0.00 -1.26 -1.46 107.32 112.98 3iob s GLY 183 Ca 0.01 0.04 0.02 0.00 0.00 0.00 0.00 44.72 44.79 3iob s GLY 183 CO -0.02 0.84 -0.18 0.14 0.00 0.00 0.00 173.10 173.88 3iob s VAL 184 N 0.05 2.66 0.52 1.40 1.01 0.17 -4.91 120.40 121.29 3iob s VAL 184 Ca 0.32 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 3iob s VAL 184 Cb -0.18 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 3iob s VAL 184 CO 0.17 0.54 1.30 -2.65 0.00 0.00 0.00 175.10 174.46 3iob n PRO 185 N 3.43 1.70 -1.69 2.72 -0.02 -1.26 -0.57 135.00 139.31 3iob n PRO 185 Ca -0.18 0.62 -0.44 0.00 -2.02 0.00 0.00 63.50 61.48 3iob n PRO 185 Cb 0.53 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 3iob n PRO 185 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3iob n THR 186 N -0.87 0.04 -3.10 3.45 -1.04 -1.26 -4.75 114.28 106.75 3iob n THR 186 Ca 0.10 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.71 3iob n THR 186 Cb 0.44 -1.80 -0.05 0.00 -1.82 0.00 0.00 70.33 67.09 3iob n THR 186 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3iob s VAL 187 N 1.24 4.77 0.14 12.58 1.01 -1.26 -5.02 120.40 133.85 3iob s VAL 187 Ca 0.78 1.44 0.08 0.00 0.00 0.00 0.00 61.98 64.28 3iob s VAL 187 Cb -0.58 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 3iob s VAL 187 CO 0.35 0.42 -0.18 -0.13 0.00 0.00 0.00 175.10 175.56 3iob s ARG 188 N -0.31 1.17 0.97 2.72 0.52 -1.26 -1.49 118.95 121.27 3iob s ARG 188 Ca 0.34 -1.30 -0.12 0.00 -0.52 0.00 0.00 55.73 54.13 3iob s ARG 188 Cb -0.20 -1.25 0.17 0.00 0.52 0.00 0.00 34.95 34.19 3iob s ARG 188 CO 0.21 0.26 1.09 -1.21 0.02 0.00 0.00 175.30 175.66 3iob s GLU 189 N -2.51 0.64 0.41 3.54 0.41 0.06 -4.89 118.70 116.36 3iob s GLU 189 Ca 0.11 0.72 0.13 0.00 -0.41 0.00 0.00 54.97 55.52 3iob s GLU 189 Cb -0.07 -1.74 0.96 0.00 -1.78 0.00 0.00 34.13 31.50 3iob s GLU 189 CO 0.05 -2.64 1.94 0.00 -0.49 0.00 0.00 175.26 174.12 3iob h ALA 190 N -1.84 1.98 -0.00 5.21 0.00 -2.01 -0.75 119.26 121.85 3iob h ALA 190 Ca -0.53 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3iob h ALA 190 Cb 1.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3iob h ALA 190 CO 0.55 -0.15 -0.01 -0.40 0.00 0.00 0.00 179.25 179.24 3iob n ASP 191 N -4.49 0.08 0.00 0.00 5.75 -1.26 -4.92 116.55 111.71 3iob n ASP 191 Ca 0.13 -0.77 0.00 0.00 -0.01 0.00 0.00 54.79 54.14 3iob n ASP 191 Cb 0.43 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 3iob n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iob n GLY 192 N 1.10 2.80 3.67 6.12 0.00 -0.29 -4.88 105.19 113.71 3iob n GLY 192 Ca 0.21 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.75 3iob n GLY 192 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3iob n LEU 193 N 0.00 3.22 -4.72 0.99 7.94 -1.26 -4.58 117.00 118.59 3iob n LEU 193 Ca 0.00 1.03 -0.42 0.00 -1.11 0.00 0.00 56.01 55.51 3iob n LEU 193 Cb 0.00 -1.38 -0.03 0.00 0.53 0.00 0.00 43.42 42.54 3iob n LEU 193 CO 0.00 -0.19 1.35 0.00 -1.11 0.00 0.00 177.39 177.44 3iob s ALA 194 N 2.65 3.89 0.24 1.96 0.00 -1.26 -0.76 121.76 128.48 3iob s ALA 194 Ca 0.87 1.52 -0.31 0.00 0.00 0.00 0.00 51.96 54.04 3iob s ALA 194 Cb -0.71 -3.69 -0.12 0.00 0.00 0.00 0.00 23.12 18.61 3iob s ALA 194 CO 0.46 -0.92 1.67 -1.64 0.00 0.00 0.00 175.76 175.33 3iob s MET 195 N 1.33 4.12 -0.14 0.00 -1.94 -0.56 -4.87 119.30 117.25 3iob s MET 195 Ca 0.74 2.59 -0.22 0.00 -1.71 0.00 0.00 55.69 57.10 3iob s MET 195 Cb -0.48 -3.05 0.05 0.00 2.01 0.00 0.00 34.83 33.36 3iob s MET 195 CO 0.32 -0.70 0.55 0.45 -0.01 0.00 0.00 175.02 175.63 3iob s SER 196 N 0.88 -0.54 0.58 3.03 0.15 -1.26 -4.95 113.70 111.60 3iob s SER 196 Ca 0.70 0.85 0.38 0.00 0.70 0.00 0.00 55.95 58.58 3iob s SER 196 Cb -0.49 0.85 1.91 0.00 -1.71 0.00 0.00 66.02 66.58 3iob s SER 196 CO 0.39 -0.34 2.15 0.77 1.20 0.00 0.00 173.24 177.41 3iob h SER 197 N 4.44 0.00 1.03 5.45 4.64 -1.95 -2.00 113.55 125.17 3iob h SER 197 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3iob h SER 197 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3iob h SER 197 CO 0.25 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.75 3iob n ARG 198 N -2.97 0.08 0.28 4.77 1.74 -1.26 -3.62 116.66 115.68 3iob n ARG 198 Ca -0.01 0.12 0.16 0.00 -0.77 0.00 0.00 57.85 57.35 3iob n ARG 198 Cb 0.15 -1.61 0.80 0.00 -1.02 0.00 0.00 32.46 30.79 3iob n ARG 198 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3iob h ASN 199 N 0.00 0.00 0.31 0.55 2.35 -1.73 -1.93 115.58 115.12 3iob h ASN 199 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iob h ASN 199 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 3iob h ASN 199 CO 0.00 0.07 0.00 0.08 -1.65 0.00 0.00 177.43 175.93 3iob h ARG 200 N 0.00 0.00 -0.15 0.81 0.11 -1.77 -2.48 114.38 110.90 3iob h ARG 200 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3iob h ARG 200 Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 3iob h ARG 200 CO 0.01 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.74 3iob n TYR 201 N -2.68 0.18 -3.07 4.08 4.01 -0.73 -4.84 117.16 114.11 3iob n TYR 201 Ca -0.01 -0.09 -0.40 0.00 -0.16 0.00 0.00 57.90 57.24 3iob n TYR 201 Cb 0.13 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.10 3iob n TYR 201 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3iob s LEU 202 N -1.73 4.14 0.94 7.72 1.43 -0.93 -4.86 118.68 125.39 3iob s LEU 202 Ca 0.34 0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 54.21 3iob s LEU 202 Cb 0.20 -2.95 0.15 0.00 0.03 0.00 0.00 46.19 43.62 3iob s LEU 202 CO 0.30 -0.31 1.12 1.51 0.23 0.00 0.00 176.35 179.21 3iob s ASP 203 N 1.21 3.22 0.29 2.29 1.47 -1.26 -4.55 116.67 119.34 3iob s ASP 203 Ca 0.30 1.03 0.04 0.00 1.18 0.00 0.00 52.55 55.10 3iob s ASP 203 Cb -0.16 -1.64 0.75 0.00 -0.34 0.00 0.00 42.92 41.53 3iob s ASP 203 CO 0.10 -2.74 1.68 -0.65 0.68 0.00 0.00 175.17 174.24 3iob h PRO 204 N -1.63 0.34 -0.32 2.11 0.11 -1.99 0.38 132.00 131.00 3iob h PRO 204 Ca -0.52 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.54 3iob h PRO 204 Cb 1.33 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3iob h PRO 204 CO 0.61 0.22 0.08 0.00 -0.21 0.00 0.00 178.00 178.70 3iob h ALA 205 N 1.73 0.43 -0.62 -0.75 0.00 -2.00 -2.28 119.26 115.77 3iob h ALA 205 Ca 0.57 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.21 3iob h ALA 205 Cb 1.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3iob h ALA 205 CO -0.56 0.09 0.02 1.96 0.00 0.00 0.00 179.25 180.76 3iob h GLN 206 N 0.36 1.08 -0.67 0.00 4.20 -1.62 -1.96 115.11 116.51 3iob h GLN 206 Ca 0.10 -0.33 0.05 0.00 0.06 0.00 0.00 58.65 58.53 3iob h GLN 206 Cb 0.30 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.92 3iob h GLN 206 CO 0.00 1.04 0.39 -0.09 -0.67 0.00 0.00 178.83 179.50 3iob h ARG 207 N 0.99 0.70 -0.19 1.46 9.65 -0.24 0.64 114.38 127.39 3iob h ARG 207 Ca 0.18 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.01 3iob h ARG 207 Cb 0.54 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 3iob h ARG 207 CO 0.03 0.46 0.11 0.00 2.80 0.00 0.00 179.97 183.37 3iob h ALA 208 N 1.33 0.25 -0.58 2.80 0.00 -1.14 -3.05 119.26 118.87 3iob h ALA 208 Ca 0.29 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3iob h ALA 208 Cb 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3iob h ALA 208 CO -0.16 -0.23 0.17 0.00 0.00 0.00 0.00 179.25 179.03 3iob h ALA 209 N 1.00 1.19 0.00 0.00 0.00 -0.93 -3.15 119.26 117.38 3iob h ALA 209 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3iob h ALA 209 Cb 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3iob h ALA 209 CO -0.01 0.56 0.09 0.00 0.00 0.00 0.00 179.25 179.89 3iob h ALA 210 N 1.32 1.08 0.00 0.00 0.00 -0.76 -1.65 119.26 119.25 3iob h ALA 210 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3iob h ALA 210 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3iob h ALA 210 CO -0.01 -0.08 -0.01 -0.24 0.00 0.00 0.00 179.25 178.91 3iob h VAL 211 N 0.00 0.12 -0.06 0.00 3.04 -1.66 -2.88 116.25 114.81 3iob h VAL 211 Ca 0.00 -0.14 0.02 0.00 -1.01 0.00 0.00 66.70 65.56 3iob h VAL 211 Cb 0.18 1.13 -0.00 0.00 -2.01 0.00 0.00 31.29 30.58 3iob h VAL 211 CO 0.00 0.01 0.05 0.00 -1.01 0.00 0.00 177.57 176.62 3iob h ALA 212 N 1.99 2.02 0.18 3.17 0.00 -1.55 -1.05 119.26 124.00 3iob h ALA 212 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3iob h ALA 212 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3iob h ALA 212 CO 0.00 -0.08 -0.08 -0.07 0.00 0.00 0.00 179.25 179.02 3iob h LEU 213 N 0.00 -0.20 -0.45 0.00 4.07 -1.76 0.09 115.31 117.06 3iob h LEU 213 Ca 0.03 -0.20 -0.16 0.00 0.08 0.00 0.00 57.88 57.62 3iob h LEU 213 Cb 0.12 0.05 -0.00 0.00 1.08 0.00 0.00 40.66 41.91 3iob h LEU 213 CO -0.00 0.10 -0.49 0.77 -1.08 0.00 0.00 178.44 177.74 3iob h SER 214 N -0.52 0.80 -0.81 -0.43 4.64 -1.71 -1.89 113.55 113.63 3iob h SER 214 Ca -0.02 -0.40 0.07 0.00 -0.47 0.00 0.00 61.79 60.96 3iob h SER 214 Cb 0.39 -0.23 -0.06 0.00 -0.31 0.00 0.00 62.40 62.19 3iob h SER 214 CO 0.04 1.15 0.48 0.00 -0.87 0.00 0.00 176.83 177.64 3iob h ALA 215 N 0.87 1.11 -0.17 5.18 0.00 -1.17 -0.70 119.26 124.38 3iob h ALA 215 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3iob h ALA 215 Cb 1.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3iob h ALA 215 CO 0.10 0.19 -0.02 0.00 0.00 0.00 0.00 179.25 179.52 3iob h ALA 216 N 1.40 0.24 -0.22 0.00 0.00 -0.80 -0.81 119.26 119.07 3iob h ALA 216 Ca 0.36 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3iob h ALA 216 Cb 0.21 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3iob h ALA 216 CO -0.19 -0.02 0.11 -0.07 0.00 0.00 0.00 179.25 179.08 3iob h LEU 217 N 0.05 0.28 -0.62 0.00 3.38 -1.12 -1.53 115.31 115.76 3iob h LEU 217 Ca 0.05 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 3iob h LEU 217 Cb 0.44 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3iob h LEU 217 CO 0.01 0.32 -0.10 0.71 0.09 0.00 0.00 178.44 179.48 3iob h THR 218 N 0.23 1.27 -0.42 0.22 1.35 -1.13 -0.46 112.91 113.97 3iob h THR 218 Ca 0.08 -1.24 0.07 0.00 -0.55 0.00 0.00 66.41 64.77 3iob h THR 218 Cb 0.11 0.96 -0.06 0.00 -1.73 0.00 0.00 68.15 67.42 3iob h THR 218 CO -0.01 0.44 0.07 0.00 -0.25 0.00 0.00 175.52 175.77 3iob h ALA 219 N 1.00 0.44 -0.60 6.62 0.00 -1.09 -2.40 119.26 123.23 3iob h ALA 219 Ca 0.14 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3iob h ALA 219 Cb 0.65 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3iob h ALA 219 CO 0.04 -0.33 0.25 0.00 0.00 0.00 0.00 179.25 179.22 3iob h ALA 220 N 1.33 0.77 -0.81 0.00 0.00 -0.85 0.96 119.26 120.67 3iob h ALA 220 Ca 0.20 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.02 3iob h ALA 220 Cb 0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 3iob h ALA 220 CO -0.28 0.38 0.53 0.00 0.00 0.00 0.00 179.25 179.87 3iob h ALA 221 N 1.10 1.63 0.08 0.00 0.00 -0.78 -1.16 119.26 120.13 3iob h ALA 221 Ca 0.20 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.82 3iob h ALA 221 Cb 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3iob h ALA 221 CO -0.02 0.24 -1.33 0.45 0.00 0.00 0.00 179.25 178.59 3iob h HIS 222 N 0.86 0.31 0.00 0.00 3.86 -0.92 -3.24 115.15 116.02 3iob h HIS 222 Ca 0.35 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 3iob h HIS 222 Cb 0.25 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 3iob h HIS 222 CO -0.00 1.22 -0.07 0.00 0.86 0.00 0.00 177.93 179.94 3iob h ALA 223 N 0.69 1.17 0.00 2.45 0.00 -0.42 -3.28 119.26 119.88 3iob h ALA 223 Ca -0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3iob h ALA 223 Cb 1.94 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.72 3iob h ALA 223 CO 0.16 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.49 3iob n ALA 224 N -2.20 1.23 0.24 0.00 0.00 -0.48 -1.10 120.51 118.21 3iob n ALA 224 Ca -0.02 0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.63 3iob n ALA 224 Cb 0.21 -1.29 0.59 0.00 0.00 0.00 0.00 19.45 18.97 3iob n ALA 224 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3iob h THR 225 N 0.00 1.04 -0.01 0.00 1.35 -1.74 0.38 112.91 113.94 3iob h THR 225 Ca 0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 3iob h THR 225 Cb 0.10 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 3iob h THR 225 CO 0.00 0.06 -0.00 0.00 -0.25 0.00 0.00 175.52 175.33 3iob n ALA 226 N -2.53 2.64 0.00 6.62 0.00 -0.25 -4.05 120.51 122.94 3iob n ALA 226 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3iob n ALA 226 Cb 0.14 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.23 3iob n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iob n GLY 227 N 1.08 1.13 0.19 0.00 0.00 -0.61 -4.61 105.19 102.37 3iob n GLY 227 Ca 0.22 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 3iob n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iob h ALA 228 N 0.00 0.49 -0.50 4.61 0.00 -1.93 -2.23 119.26 119.69 3iob h ALA 228 Ca 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.78 3iob h ALA 228 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3iob h ALA 228 CO 0.00 0.11 0.30 0.37 0.00 0.00 0.00 179.25 180.03 3iob h GLN 229 N 0.46 0.59 -0.43 0.00 5.75 -1.99 -0.82 115.11 118.68 3iob h GLN 229 Ca 0.12 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 3iob h GLN 229 Cb 0.21 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.60 3iob h GLN 229 CO -0.01 0.39 0.26 0.00 -2.65 0.00 0.00 178.83 176.83 3iob h ALA 230 N 1.21 0.55 0.02 3.38 0.00 -1.79 0.29 119.26 122.91 3iob h ALA 230 Ca 0.20 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3iob h ALA 230 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3iob h ALA 230 CO -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 3iob h ALA 231 N 1.18 -0.02 -0.72 0.00 0.00 -0.99 -0.77 119.26 117.94 3iob h ALA 231 Ca 0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3iob h ALA 231 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3iob h ALA 231 CO -0.06 -0.46 0.35 -0.07 0.00 0.00 0.00 179.25 179.01 3iob h LEU 232 N -0.14 0.94 -0.70 0.00 3.38 -1.01 -1.93 115.31 115.85 3iob h LEU 232 Ca -0.00 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.70 3iob h LEU 232 Cb 0.13 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3iob h LEU 232 CO 0.00 0.81 -0.47 0.44 0.09 0.00 0.00 178.44 179.31 3iob h ASP 233 N 1.00 0.47 -0.31 -0.43 3.32 -0.82 0.25 116.42 119.90 3iob h ASP 233 Ca 0.25 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 3iob h ASP 233 Cb 0.12 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 3iob h ASP 233 CO -0.03 0.87 0.17 0.00 -1.72 0.00 0.00 179.24 178.53 3iob h ALA 234 N 1.15 0.40 -0.42 3.45 0.00 -0.96 -0.10 119.26 122.78 3iob h ALA 234 Ca 0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3iob h ALA 234 Cb 0.96 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3iob h ALA 234 CO 0.08 -0.07 0.18 0.00 0.00 0.00 0.00 179.25 179.44 3iob h ALA 235 N 1.04 0.55 -0.74 0.00 0.00 -1.05 -2.65 119.26 116.41 3iob h ALA 235 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3iob h ALA 235 Cb 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3iob h ALA 235 CO -0.02 0.14 0.44 -0.09 0.00 0.00 0.00 179.25 179.72 3iob h ARG 236 N 0.54 1.01 -0.60 0.00 9.65 -0.78 -1.53 114.38 122.67 3iob h ARG 236 Ca 0.14 -0.09 0.03 0.00 -1.10 0.00 0.00 59.98 58.96 3iob h ARG 236 Cb 0.17 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 28.50 3iob h ARG 236 CO -0.01 0.72 0.36 0.00 2.80 0.00 0.00 179.97 183.83 3iob h ALA 237 N 1.23 0.79 -0.10 2.80 0.00 -0.73 0.13 119.26 123.38 3iob h ALA 237 Ca 0.27 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3iob h ALA 237 Cb -0.03 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3iob h ALA 237 CO -0.05 0.07 0.03 0.28 0.00 0.00 0.00 179.25 179.59 3iob h VAL 238 N 0.69 1.17 -0.79 0.00 2.07 -1.14 -1.79 116.25 116.46 3iob h VAL 238 Ca 0.25 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3iob h VAL 238 Cb 0.06 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3iob h VAL 238 CO -0.12 0.15 0.45 -0.07 0.02 0.00 0.00 177.57 178.00 3iob h LEU 239 N -0.01 0.97 -1.88 2.57 3.38 -0.91 -1.97 115.31 117.45 3iob h LEU 239 Ca 0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3iob h LEU 239 Cb 0.20 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3iob h LEU 239 CO -0.00 0.77 -0.03 0.44 0.09 0.00 0.00 178.44 179.70 3iob h ASP 240 N 1.09 0.03 -0.08 -0.43 3.32 -0.66 -2.14 116.42 117.55 3iob h ASP 240 Ca 0.28 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3iob h ASP 240 Cb -0.00 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3iob h ASP 240 CO -0.05 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 3iob n ALA 241 N -2.53 2.56 -2.98 3.45 0.00 -0.68 -4.85 120.51 115.48 3iob n ALA 241 Ca -0.03 -0.28 -0.37 0.00 0.00 0.00 0.00 53.44 52.76 3iob n ALA 241 Cb 0.13 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.27 3iob n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iob s ALA 242 N -1.90 3.22 -0.18 0.00 0.00 -0.81 -5.04 121.76 117.05 3iob s ALA 242 Ca 0.27 -1.11 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 3iob s ALA 242 Cb 0.14 -2.13 -0.06 0.00 0.00 0.00 0.00 23.12 21.06 3iob s ALA 242 CO 0.21 -0.47 2.18 -0.35 0.00 0.00 0.00 175.76 177.33 3iob n PRO 243 N 4.90 2.06 -1.96 0.00 -0.04 -1.26 -2.94 135.00 135.76 3iob n PRO 243 Ca -0.16 0.61 -0.09 0.00 -0.04 0.00 0.00 63.50 63.82 3iob n PRO 243 Cb 0.52 -3.15 -0.01 0.00 -0.04 0.00 0.00 33.50 30.82 3iob n PRO 243 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3iob n GLY 244 N 5.59 0.25 3.57 0.55 0.00 -1.26 -4.84 105.19 109.05 3iob n GLY 244 Ca 0.29 -0.55 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 3iob n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iob s VAL 245 N -2.41 5.19 -0.39 1.61 1.01 -1.15 -4.38 120.40 119.89 3iob s VAL 245 Ca 0.00 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.12 3iob s VAL 245 Cb 0.00 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.69 3iob s VAL 245 CO 0.00 0.05 0.24 0.00 0.00 0.00 0.00 175.10 175.39 3iob s ALA 246 N 1.99 3.32 -0.07 5.51 0.00 0.04 -4.95 121.76 127.61 3iob s ALA 246 Ca 0.12 -1.79 -0.30 0.00 0.00 0.00 0.00 51.96 49.99 3iob s ALA 246 Cb -0.16 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 3iob s ALA 246 CO 0.11 -1.45 1.16 0.08 0.00 0.00 0.00 175.76 175.66 3iob s VAL 247 N 1.56 4.36 -0.13 0.00 1.01 -1.26 -0.32 120.40 125.62 3iob s VAL 247 Ca 0.03 1.67 -0.17 0.00 0.00 0.00 0.00 61.98 63.51 3iob s VAL 247 Cb -0.20 -4.07 -0.15 0.00 0.00 0.00 0.00 36.38 31.96 3iob s VAL 247 CO 0.07 -0.00 0.42 0.44 0.00 0.00 0.00 175.10 176.02 3iob h ASP 248 N 7.38 0.00 -5.12 3.32 3.32 -1.20 -3.48 116.42 120.64 3iob h ASP 248 Ca -0.33 -0.56 -0.08 0.00 0.02 0.00 0.00 57.03 56.07 3iob h ASP 248 Cb 1.16 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.56 3iob h ASP 248 CO 0.88 0.83 -0.30 -0.72 -1.72 0.00 0.00 179.24 178.21 3iob s TYR 249 N -1.98 0.04 -0.19 4.55 -0.85 -1.12 -5.00 117.35 112.80 3iob s TYR 249 Ca -0.12 -0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 55.99 3iob s TYR 249 Cb -0.01 0.02 0.09 0.00 0.38 0.00 0.00 41.96 42.44 3iob s TYR 249 CO 0.41 -0.56 0.23 -1.17 -1.52 0.00 0.00 175.55 172.94 3iob s LEU 250 N -2.69 -0.15 -0.01 -3.49 2.96 -1.26 -2.17 118.68 111.88 3iob s LEU 250 Ca 0.02 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.84 3iob s LEU 250 Cb 0.03 0.44 0.00 0.00 0.50 0.00 0.00 46.19 47.16 3iob s LEU 250 CO -0.10 -0.31 -0.02 -1.61 -1.32 0.00 0.00 176.35 172.99 3iob s GLU 251 N 2.34 0.20 -0.26 1.98 2.02 0.07 -4.97 118.70 120.08 3iob s GLU 251 Ca 0.06 -0.04 -0.07 0.00 0.02 0.00 0.00 54.97 54.95 3iob s GLU 251 Cb -0.15 -0.23 -0.01 0.00 0.10 0.00 0.00 34.13 33.83 3iob s GLU 251 CO -0.12 0.01 0.06 -1.17 0.02 0.00 0.00 175.26 174.06 3iob s LEU 252 N 0.18 3.51 0.25 1.80 2.96 -1.26 -0.34 118.68 125.78 3iob s LEU 252 Ca -0.01 -0.42 0.07 0.00 -0.22 0.00 0.00 54.13 53.54 3iob s LEU 252 Cb -0.04 -1.88 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 3iob s LEU 252 CO -0.00 -0.09 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.73 3iob s ARG 253 N 1.55 1.46 0.73 1.98 0.52 -0.25 -4.94 118.95 120.01 3iob s ARG 253 Ca 0.05 -1.72 -0.16 0.00 -0.52 0.00 0.00 55.73 53.38 3iob s ARG 253 Cb -0.16 -1.08 -0.00 0.00 0.52 0.00 0.00 34.95 34.22 3iob s ARG 253 CO 0.02 0.06 0.80 -3.47 0.02 0.00 0.00 175.30 172.73 3iob n ASP 254 N -0.51 -0.20 0.21 0.23 2.03 -1.26 -0.79 116.55 116.26 3iob n ASP 254 Ca -0.06 0.62 0.12 0.00 0.52 0.00 0.00 54.79 55.99 3iob n ASP 254 Cb 0.63 -1.33 0.71 0.00 -0.72 0.00 0.00 41.12 40.40 3iob n ASP 254 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3iob h ILE 255 N -0.38 0.82 -0.01 5.18 3.07 -1.85 0.43 117.51 124.77 3iob h ILE 255 Ca -0.46 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.95 3iob h ILE 255 Cb 1.34 0.93 0.00 0.00 -0.27 0.00 0.00 36.82 38.82 3iob h ILE 255 CO 0.45 0.00 -0.13 0.61 -1.05 0.00 0.00 178.15 178.03 3iob n GLY 256 N -1.51 -0.63 2.71 0.16 0.00 -1.26 -4.92 105.19 99.74 3iob n GLY 256 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 3iob n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iob n LEU 257 N -0.61 0.37 0.00 0.99 4.77 0.14 -4.94 117.00 117.72 3iob n LEU 257 Ca 0.15 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 3iob n LEU 257 Cb 0.31 -2.11 0.00 0.00 -2.33 0.00 0.00 43.42 39.28 3iob n LEU 257 CO 0.23 -0.79 0.00 0.61 -1.33 0.00 0.00 177.39 176.10 3iob n GLY 258 N -0.12 1.76 2.28 -0.72 0.00 -1.26 -4.94 105.19 102.19 3iob n GLY 258 Ca -0.03 -2.04 -0.26 0.00 0.00 0.00 0.00 46.02 43.69 3iob n GLY 258 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3iob n PRO 259 N -0.21 2.72 -3.81 1.61 -0.04 -1.26 -4.78 135.00 129.24 3iob n PRO 259 Ca 0.00 -1.60 -0.13 0.00 -0.04 0.00 0.00 63.50 61.73 3iob n PRO 259 Cb 0.00 -2.44 -0.13 0.00 -0.04 0.00 0.00 33.50 30.90 3iob n PRO 259 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3iob s MET 260 N 2.10 0.17 0.60 0.54 -1.94 -1.26 -5.15 119.30 114.36 3iob s MET 260 Ca 0.60 0.24 -0.16 0.00 -1.71 0.00 0.00 55.69 54.66 3iob s MET 260 Cb 0.20 0.06 -0.03 0.00 2.01 0.00 0.00 34.83 37.07 3iob s MET 260 CO -0.03 -0.04 1.08 -1.25 -0.01 0.00 0.00 175.02 174.76 3iob s PRO 261 N 0.22 3.19 0.11 2.03 0.04 -1.26 -4.46 135.00 134.87 3iob s PRO 261 Ca -0.01 1.29 -0.31 0.00 0.04 0.00 0.00 61.00 62.01 3iob s PRO 261 Cb -0.02 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 3iob s PRO 261 CO -0.01 -0.92 1.85 -0.11 0.04 0.00 0.00 177.00 177.85 3iob n LEU 262 N -2.05 4.04 0.00 -3.56 7.94 -1.26 -4.71 117.00 117.39 3iob n LEU 262 Ca 0.09 0.98 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 3iob n LEU 262 Cb 0.52 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.93 3iob n LEU 262 CO 0.47 0.17 0.00 -0.46 -1.11 0.00 0.00 177.39 176.46 3iob n ASN 263 N 5.78 0.00 0.05 1.96 0.23 -1.26 -4.99 115.26 117.03 3iob n ASN 263 Ca 0.18 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.35 3iob n ASN 263 Cb 0.37 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.29 3iob n ASN 263 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3iob n GLY 264 N 5.00 -1.42 2.92 4.83 0.00 -1.26 -4.68 105.19 110.59 3iob n GLY 264 Ca 0.00 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 3iob n GLY 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iob s SER 265 N -4.05 1.99 0.33 1.61 0.01 -1.26 -1.64 113.70 110.69 3iob s SER 265 Ca 0.07 -0.28 0.07 0.00 1.31 0.00 0.00 55.95 57.12 3iob s SER 265 Cb 0.14 -0.80 -0.03 0.00 0.21 0.00 0.00 66.02 65.54 3iob s SER 265 CO 0.70 -0.09 0.27 -0.83 0.41 0.00 0.00 173.24 173.71 3iob s GLY 266 N 1.45 2.35 -0.06 3.44 0.00 0.33 -3.61 107.32 111.21 3iob s GLY 266 Ca -0.00 -2.04 0.03 0.00 0.00 0.00 0.00 44.72 42.71 3iob s GLY 266 CO -0.05 -1.49 -0.15 -1.60 0.00 0.00 0.00 173.10 169.82 3iob s ARG 267 N -3.46 1.87 -0.25 2.90 6.06 0.03 -1.06 118.95 125.04 3iob s ARG 267 Ca 0.40 -0.51 -0.11 0.00 -2.50 0.00 0.00 55.73 53.01 3iob s ARG 267 Cb 0.02 -1.53 -0.05 0.00 0.06 0.00 0.00 34.95 33.45 3iob s ARG 267 CO 0.27 0.10 0.16 -1.17 -2.50 0.00 0.00 175.30 172.16 3iob s LEU 268 N 0.47 4.06 -0.03 -0.88 2.96 -0.30 -1.09 118.68 123.87 3iob s LEU 268 Ca -0.12 0.07 0.07 0.00 -0.22 0.00 0.00 54.13 53.92 3iob s LEU 268 Cb -0.15 -2.10 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 3iob s LEU 268 CO 0.04 0.03 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.11 3iob s LEU 269 N 1.27 2.19 0.04 -0.68 1.02 0.54 -1.62 118.68 121.44 3iob s LEU 269 Ca 0.07 -0.42 0.04 0.00 0.02 0.00 0.00 54.13 53.84 3iob s LEU 269 Cb -0.14 -1.39 -0.02 0.00 0.02 0.00 0.00 46.19 44.66 3iob s LEU 269 CO 0.06 0.31 -0.13 0.54 0.02 0.00 0.00 176.35 177.15 3iob s VAL 270 N -0.54 1.02 -0.01 -1.59 0.11 -0.39 -0.75 120.40 118.25 3iob s VAL 270 Ca 0.07 -0.99 0.01 0.00 -2.93 0.00 0.00 61.98 58.14 3iob s VAL 270 Cb -0.11 -0.94 0.01 0.00 -1.53 0.00 0.00 36.38 33.81 3iob s VAL 270 CO 0.00 -0.05 -0.02 0.00 -3.33 0.00 0.00 175.10 171.70 3iob s ALA 271 N -0.90 0.30 0.01 1.54 0.00 -0.92 -2.05 121.76 119.73 3iob s ALA 271 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 51.96 51.79 3iob s ALA 271 Cb -0.08 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.89 3iob s ALA 271 CO 0.01 0.01 0.32 0.00 0.00 0.00 0.00 175.76 176.11 3iob s ALA 272 N 0.35 -0.78 -0.17 0.00 0.00 -0.31 -0.59 121.76 120.27 3iob s ALA 272 Ca -0.03 0.24 -0.07 0.00 0.00 0.00 0.00 51.96 52.09 3iob s ALA 272 Cb -0.06 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 3iob s ALA 272 CO -0.01 -0.32 0.07 1.03 0.00 0.00 0.00 175.76 176.53 3iob s ARG 273 N -1.79 3.83 -0.37 0.00 0.52 0.56 0.08 118.95 121.77 3iob s ARG 273 Ca -0.10 -0.32 -0.01 0.00 -0.52 0.00 0.00 55.73 54.78 3iob s ARG 273 Cb -0.03 -3.18 0.10 0.00 0.52 0.00 0.00 34.95 32.36 3iob s ARG 273 CO 0.02 0.38 0.13 -0.51 0.02 0.00 0.00 175.30 175.33 3iob s LEU 274 N 0.08 4.92 0.00 2.53 1.02 0.07 -0.78 118.68 126.52 3iob s LEU 274 Ca 0.06 -1.97 0.00 0.00 0.02 0.00 0.00 54.13 52.23 3iob s LEU 274 Cb -0.12 -1.75 0.00 0.00 0.02 0.00 0.00 46.19 44.34 3iob s LEU 274 CO 0.01 -0.46 0.00 0.61 0.02 0.00 0.00 176.35 176.53 3iob n GLY 275 N 4.49 3.63 0.14 -3.19 0.00 -1.26 -1.80 105.19 107.19 3iob n GLY 275 Ca -0.02 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3iob n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iob n THR 276 N 0.00 0.00 -2.90 2.61 -2.24 -1.26 -4.88 114.28 105.62 3iob n THR 276 Ca 0.00 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 3iob n THR 276 Cb 0.00 0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 68.71 3iob n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3iob s THR 277 N -2.77 4.83 -0.21 4.28 2.01 -0.75 -5.04 115.64 118.01 3iob s THR 277 Ca 0.16 1.53 -0.14 0.00 0.31 0.00 0.00 61.69 63.55 3iob s THR 277 Cb 0.18 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 3iob s THR 277 CO 0.65 -0.09 0.32 -0.60 -0.69 0.00 0.00 174.62 174.21 3iob s ARG 278 N 2.85 4.16 0.01 4.92 3.52 -1.26 -0.75 118.95 132.40 3iob s ARG 278 Ca 0.35 0.06 0.07 0.00 -0.13 0.00 0.00 55.73 56.08 3iob s ARG 278 Cb -0.15 -3.52 -0.03 0.00 -1.56 0.00 0.00 34.95 29.69 3iob s ARG 278 CO 0.08 0.02 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.87 3iob s LEU 279 N 1.13 2.42 0.17 -0.88 1.43 0.11 -4.96 118.68 118.11 3iob s LEU 279 Ca 0.16 -0.43 0.10 0.00 -1.03 0.00 0.00 54.13 52.93 3iob s LEU 279 Cb -0.14 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3iob s LEU 279 CO 0.06 0.28 -0.20 -0.76 0.23 0.00 0.00 176.35 175.97 3iob s LEU 280 N -1.11 2.59 0.16 1.79 1.43 -1.26 -1.17 118.68 121.11 3iob s LEU 280 Ca 0.13 -0.74 -0.23 0.00 -1.03 0.00 0.00 54.13 52.25 3iob s LEU 280 Cb -0.10 -1.34 0.07 0.00 0.03 0.00 0.00 46.19 44.84 3iob s LEU 280 CO 0.02 0.13 0.62 -0.62 0.23 0.00 0.00 176.35 176.73 3iob s ASP 281 N -2.57 -0.54 0.21 2.29 -1.08 -0.87 -4.89 116.67 109.22 3iob s ASP 281 Ca 0.21 -0.05 -0.19 0.00 -0.52 0.00 0.00 52.55 51.99 3iob s ASP 281 Cb -0.09 0.60 0.03 0.00 -1.46 0.00 0.00 42.92 42.01 3iob s ASP 281 CO 0.11 -0.99 0.58 0.54 0.52 0.00 0.00 175.17 175.93 3iob s ASN 282 N -2.76 -0.32 -0.00 -0.34 2.20 -1.26 -1.27 114.94 111.19 3iob s ASN 282 Ca 0.02 -0.42 -0.18 0.00 -0.94 0.00 0.00 52.86 51.34 3iob s ASN 282 Cb -0.01 0.61 0.03 0.00 -2.00 0.00 0.00 41.25 39.88 3iob s ASN 282 CO -0.11 -1.10 0.39 -0.51 -2.94 0.00 0.00 177.10 172.83 3iob s ILE 283 N -3.86 0.05 0.30 0.54 2.07 -0.64 -4.99 121.20 114.67 3iob s ILE 283 Ca 0.08 -0.41 -0.29 0.00 -1.41 0.00 0.00 60.65 58.62 3iob s ILE 283 Cb -0.02 -0.78 -0.10 0.00 0.13 0.00 0.00 42.46 41.70 3iob s ILE 283 CO -0.03 -0.23 1.25 0.00 -1.91 0.00 0.00 174.94 174.02 3iob s ALA 284 N -1.65 3.48 -0.07 1.50 0.00 -1.26 -1.15 121.76 122.60 3iob s ALA 284 Ca -0.11 1.14 0.02 0.00 0.00 0.00 0.00 51.96 53.02 3iob s ALA 284 Cb -0.03 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.67 3iob s ALA 284 CO 0.03 -0.49 -0.13 0.42 0.00 0.00 0.00 175.76 175.58 3iob s ILE 285 N -1.00 1.24 -0.16 0.00 -1.09 -0.22 -4.84 121.20 115.13 3iob s ILE 285 Ca 0.49 -0.54 -0.03 0.00 -2.23 0.00 0.00 60.65 58.34 3iob s ILE 285 Cb -0.37 -1.12 -0.02 0.00 -1.58 0.00 0.00 42.46 39.37 3iob s ILE 285 CO 0.48 0.38 -0.06 -1.61 -1.23 0.00 0.00 174.94 172.90 3iob s GLU 286 N 0.64 3.55 -0.06 2.79 8.01 -1.26 -0.51 118.70 131.86 3iob s GLU 286 Ca -0.15 -0.58 -0.20 0.00 0.01 0.00 0.00 54.97 54.06 3iob s GLU 286 Cb -0.16 -2.86 -0.05 0.00 -4.31 0.00 0.00 34.13 26.76 3iob s GLU 286 CO 0.04 0.17 0.56 0.42 0.01 0.00 0.00 175.26 176.45 3iob s ILE 287 N 0.54 5.06 -1.83 -1.63 -1.09 -0.65 -3.75 121.20 117.84 3iob s ILE 287 Ca -0.05 1.14 0.00 0.00 -2.23 0.00 0.00 60.65 59.51 3iob s ILE 287 Cb -0.15 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.84 3iob s ILE 287 CO 0.03 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.71 3iob n GLY 288 N 2.88 -0.20 0.00 6.18 0.00 0.03 -4.86 105.19 109.22 3iob n GLY 288 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3iob n GLY 288 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73