#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xll s GLN 3 N 0.00 0.42 0.42 7.34 -1.52 -1.26 -4.93 119.66 120.14 1xll s GLN 3 Ca 0.00 0.15 -0.25 0.00 -1.95 0.00 0.00 55.36 53.31 1xll s GLN 3 Cb 0.00 -0.78 -0.08 0.00 -0.22 0.00 0.00 33.01 31.93 1xll s GLN 3 CO 0.00 -0.27 1.20 -1.25 -0.25 0.00 0.00 175.29 174.72 1xll s PRO 4 N 1.79 3.93 0.13 2.91 0.04 -1.26 -5.04 135.00 137.49 1xll s PRO 4 Ca 0.01 1.89 0.05 0.00 0.04 0.00 0.00 61.00 63.00 1xll s PRO 4 Cb -0.13 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 1xll s PRO 4 CO -0.04 -0.44 -0.12 0.95 0.04 0.00 0.00 177.00 177.39 1xll s THR 5 N -1.42 1.25 0.65 1.26 -4.23 -1.26 -4.65 115.64 107.25 1xll s THR 5 Ca 0.59 -1.85 0.20 0.00 -1.18 0.00 0.00 61.69 59.46 1xll s THR 5 Cb -0.32 -1.63 0.21 0.00 1.34 0.00 0.00 72.50 72.10 1xll s THR 5 CO 0.40 -0.55 1.58 -0.65 -0.54 0.00 0.00 174.62 174.86 1xll h PRO 6 N 3.23 0.00 0.00 3.99 0.11 -1.81 -0.33 132.00 137.19 1xll h PRO 6 Ca -0.38 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.71 1xll h PRO 6 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xll h PRO 6 CO 0.56 0.00 -0.09 0.00 -0.21 0.00 0.00 178.00 178.26 1xll h ALA 7 N 0.87 1.22 -0.01 -0.75 0.00 -1.96 -2.54 119.26 116.09 1xll h ALA 7 Ca 0.04 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 1xll h ALA 7 Cb 1.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1xll h ALA 7 CO -0.00 0.11 -0.81 -0.44 0.00 0.00 0.00 179.25 178.11 1xll h ASP 8 N 0.00 0.24 -3.72 0.00 3.32 -1.43 -3.48 116.42 111.35 1xll h ASP 8 Ca -0.00 -0.18 -0.26 0.00 0.02 0.00 0.00 57.03 56.60 1xll h ASP 8 Cb 0.30 -0.07 0.07 0.00 0.22 0.00 0.00 39.33 39.85 1xll h ASP 8 CO 0.01 0.95 -0.42 1.41 -1.72 0.00 0.00 179.24 179.47 1xll n HIS 9 N -3.70 -1.64 -2.64 4.55 8.25 -0.96 -4.72 115.22 114.36 1xll n HIS 9 Ca -0.03 0.53 -0.42 0.00 -0.26 0.00 0.00 57.72 57.54 1xll n HIS 9 Cb 0.76 -3.50 -0.03 0.00 1.12 0.00 0.00 29.99 28.35 1xll n HIS 9 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1xll s PHE 10 N -3.11 3.46 0.11 4.41 0.08 -1.26 -1.31 117.98 120.36 1xll s PHE 10 Ca 0.31 1.53 0.08 0.00 0.12 0.00 0.00 56.93 58.97 1xll s PHE 10 Cb -0.14 -3.23 -0.04 0.00 -0.57 0.00 0.00 43.02 39.05 1xll s PHE 10 CO 0.38 -0.43 -0.21 0.95 -0.10 0.00 0.00 175.22 175.81 1xll s THR 11 N 1.97 1.76 0.03 0.64 -4.23 -0.83 -0.81 115.64 114.16 1xll s THR 11 Ca 0.50 -1.57 0.01 0.00 -1.18 0.00 0.00 61.69 59.45 1xll s THR 11 Cb -0.20 -1.60 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 1xll s THR 11 CO 0.19 -0.06 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.81 1xll s PHE 12 N -1.18 0.46 0.31 3.99 0.40 -1.12 -1.40 117.98 119.43 1xll s PHE 12 Ca 0.07 -0.41 -0.03 0.00 -0.60 0.00 0.00 56.93 55.97 1xll s PHE 12 Cb -0.10 -0.29 -0.04 0.00 0.51 0.00 0.00 43.02 43.10 1xll s PHE 12 CO 0.04 -0.10 0.55 0.20 0.70 0.00 0.00 175.22 176.62 1xll s GLY 13 N -1.20 1.70 0.30 4.36 0.00 -1.25 -1.09 107.32 110.14 1xll s GLY 13 Ca -0.09 -0.67 0.03 0.00 0.00 0.00 0.00 44.72 43.98 1xll s GLY 13 CO -0.00 -0.58 1.78 -2.00 0.00 0.00 0.00 173.10 172.30 1xll h LEU 14 N 1.39 0.52 -1.21 0.66 5.85 -1.52 -2.43 115.31 118.56 1xll h LEU 14 Ca -0.48 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.09 1xll h LEU 14 Cb 1.20 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1xll h LEU 14 CO 0.65 0.68 -0.05 4.11 -0.34 0.00 0.00 178.44 183.49 1xll h TRP 15 N 0.50 0.00 0.04 1.25 0.09 -1.90 0.17 115.95 116.09 1xll h TRP 15 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 58.89 59.07 1xll h TRP 15 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.75 1xll h TRP 15 CO 0.02 0.05 -0.02 1.79 0.09 0.00 0.00 178.44 180.37 1xll h THR 16 N 0.00 0.00 0.00 0.12 1.35 -1.63 -2.11 112.91 110.64 1xll h THR 16 Ca -0.00 -0.26 -0.04 0.00 -0.55 0.00 0.00 66.41 65.56 1xll h THR 16 Cb 0.62 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.04 1xll h THR 16 CO 0.01 0.00 -0.20 -0.37 -0.25 0.00 0.00 175.52 174.71 1xll h VAL 17 N -0.31 0.62 -0.04 6.82 -1.51 -1.69 -2.10 116.25 118.05 1xll h VAL 17 Ca -0.01 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 1xll h VAL 17 Cb 0.04 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 1xll h VAL 17 CO 0.01 0.20 0.00 0.61 -1.23 0.00 0.00 177.57 177.15 1xll n GLY 18 N -0.25 -0.36 3.66 5.19 0.00 0.58 -4.85 105.19 109.15 1xll n GLY 18 Ca -0.01 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1xll n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1xll s TRP 19 N -1.95 1.54 -1.10 1.61 -0.00 -0.79 -4.67 118.94 113.59 1xll s TRP 19 Ca 0.38 -0.16 0.29 0.00 -0.00 0.00 0.00 56.10 56.60 1xll s TRP 19 Cb 0.19 -4.11 1.16 0.00 -0.00 0.00 0.00 33.47 30.71 1xll s TRP 19 CO 0.31 -4.83 1.86 2.41 -0.00 0.00 0.00 176.95 176.69 1xll n THR 20 N 5.64 0.00 0.00 5.86 -1.04 -1.26 -4.85 114.28 118.62 1xll n THR 20 Ca 0.19 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1xll n THR 20 Cb 0.42 -0.35 0.00 0.00 -1.82 0.00 0.00 70.33 68.58 1xll n THR 20 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xll n GLY 21 N 1.46 1.41 3.69 3.41 0.00 -1.26 -1.15 105.19 112.76 1xll n GLY 21 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1xll n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xll s ALA 22 N -2.26 3.73 0.03 4.61 0.00 -1.26 -4.53 121.76 122.07 1xll s ALA 22 Ca 0.00 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.27 1xll s ALA 22 Cb 0.00 -3.71 -0.00 0.00 0.00 0.00 0.00 23.12 19.41 1xll s ALA 22 CO 0.00 -1.11 0.00 -0.40 0.00 0.00 0.00 175.76 174.26 1xll n ASP 23 N 5.43 1.49 0.20 0.00 5.68 -0.20 -4.94 116.55 124.22 1xll n ASP 23 Ca 0.16 -1.13 0.04 0.00 -0.50 0.00 0.00 54.79 53.36 1xll n ASP 23 Cb 0.39 0.04 0.42 0.00 -1.14 0.00 0.00 41.12 40.84 1xll n ASP 23 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1xll h PRO 24 N 0.00 0.00 -0.43 0.11 0.11 -2.01 -3.23 132.00 126.55 1xll h PRO 24 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1xll h PRO 24 Cb 0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.19 1xll h PRO 24 CO 0.04 0.31 0.00 1.19 -0.21 0.00 0.00 178.00 179.32 1xll n PHE 25 N -4.10 0.56 -3.62 0.65 3.72 -1.26 -5.05 117.46 108.35 1xll n PHE 25 Ca -0.02 -0.33 -0.07 0.00 -0.05 0.00 0.00 57.45 56.97 1xll n PHE 25 Cb 0.36 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.87 1xll n PHE 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1xll s GLY 26 N -1.22 -0.36 0.75 1.37 0.00 -1.22 -5.18 107.32 101.46 1xll s GLY 26 Ca 0.36 0.44 -0.10 0.00 0.00 0.00 0.00 44.72 45.42 1xll s GLY 26 CO 0.27 0.13 1.09 -1.34 0.00 0.00 0.00 173.10 173.26 1xll s VAL 27 N -3.39 2.35 0.49 1.40 -7.23 -1.26 -1.03 120.40 111.73 1xll s VAL 27 Ca 0.08 -0.05 -0.22 0.00 -1.81 0.00 0.00 61.98 59.98 1xll s VAL 27 Cb -0.02 -3.08 -0.08 0.00 0.56 0.00 0.00 36.38 33.77 1xll s VAL 27 CO -0.04 -0.09 1.09 0.00 -0.31 0.00 0.00 175.10 175.75 1xll n ALA 28 N -3.10 0.58 0.45 1.32 0.00 -1.26 -4.17 120.51 114.33 1xll n ALA 28 Ca 0.08 0.15 0.05 0.00 0.00 0.00 0.00 53.44 53.72 1xll n ALA 28 Cb 0.60 -2.16 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 1xll n ALA 28 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xll n THR 29 N -0.89 0.00 -4.30 0.00 -2.24 -0.30 -4.84 114.28 101.72 1xll n THR 29 Ca 0.10 -0.35 -0.21 0.00 -2.27 0.00 0.00 64.05 61.33 1xll n THR 29 Cb 0.43 1.07 -0.11 0.00 -2.10 0.00 0.00 70.33 69.61 1xll n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xll s ARG 30 N -1.59 1.18 0.61 -0.78 0.52 -0.83 -5.01 118.95 113.04 1xll s ARG 30 Ca 0.06 -1.33 -0.13 0.00 -0.52 0.00 0.00 55.73 53.81 1xll s ARG 30 Cb 0.08 -1.20 -0.04 0.00 0.52 0.00 0.00 34.95 34.31 1xll s ARG 30 CO 0.31 0.24 1.03 -1.59 0.02 0.00 0.00 175.30 175.32 1xll s LYS 31 N -2.67 3.49 0.60 3.54 0.00 -1.26 -4.83 119.74 118.61 1xll s LYS 31 Ca 0.13 0.91 -0.20 0.00 0.00 0.00 0.00 55.97 56.81 1xll s LYS 31 Cb -0.06 -2.07 -0.03 0.00 0.00 0.00 0.00 37.83 35.68 1xll s LYS 31 CO 0.05 -0.66 1.30 -0.80 0.00 0.00 0.00 175.35 175.24 1xll s ASN 32 N -3.62 4.97 -0.12 0.03 -0.87 -1.26 -4.91 114.94 109.16 1xll s ASN 32 Ca 0.58 2.63 -0.16 0.00 -1.57 0.00 0.00 52.86 54.34 1xll s ASN 32 Cb -0.12 -2.62 -0.05 0.00 -0.02 0.00 0.00 41.25 38.44 1xll s ASN 32 CO 0.46 -1.76 0.38 -0.22 -2.57 0.00 0.00 177.10 173.40 1xll s LEU 33 N -3.99 4.29 0.12 0.60 2.96 -1.26 -5.05 118.68 116.36 1xll s LEU 33 Ca 0.77 0.70 -0.30 0.00 -0.22 0.00 0.00 54.13 55.08 1xll s LEU 33 Cb -0.37 -2.53 -0.06 0.00 0.50 0.00 0.00 46.19 43.72 1xll s LEU 33 CO 0.41 0.09 1.10 -0.62 -1.32 0.00 0.00 176.35 176.01 1xll s ASP 34 N 0.30 7.25 0.25 3.68 -1.08 -1.26 -4.95 116.67 120.87 1xll s ASP 34 Ca 0.21 2.00 -0.05 0.00 -0.52 0.00 0.00 52.55 54.20 1xll s ASP 34 Cb -0.14 -2.59 0.33 0.00 -1.46 0.00 0.00 42.92 39.06 1xll s ASP 34 CO 0.08 -0.27 1.87 -0.65 0.52 0.00 0.00 175.17 176.72 1xll h PRO 35 N 5.74 1.07 -0.25 4.34 0.11 -1.96 -1.91 132.00 139.14 1xll h PRO 35 Ca -0.43 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.66 1xll h PRO 35 Cb 1.21 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 32.04 1xll h PRO 35 CO 0.75 0.71 -0.03 0.28 -0.21 0.00 0.00 178.00 179.49 1xll h VAL 36 N 1.10 0.79 -0.69 3.15 2.07 -1.92 -1.50 116.25 119.25 1xll h VAL 36 Ca 0.39 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.88 1xll h VAL 36 Cb 0.10 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1xll h VAL 36 CO -0.15 0.01 0.37 -0.08 0.02 0.00 0.00 177.57 177.73 1xll h GLU 37 N 0.04 0.95 -0.26 1.57 4.81 -1.83 -2.41 114.58 117.45 1xll h GLU 37 Ca 0.12 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1xll h GLU 37 Cb 0.17 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1xll h GLU 37 CO -0.23 0.71 0.17 0.00 -0.73 0.00 0.00 179.01 178.93 1xll h ALA 38 N 1.45 0.33 0.10 2.92 0.00 -0.55 -0.85 119.26 122.66 1xll h ALA 38 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1xll h ALA 38 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xll h ALA 38 CO -0.04 -0.18 -0.10 0.28 0.00 0.00 0.00 179.25 179.21 1xll h VAL 39 N 0.35 0.76 -0.07 0.00 2.07 -1.15 -2.35 116.25 115.87 1xll h VAL 39 Ca 0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 1xll h VAL 39 Cb -0.02 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1xll h VAL 39 CO -0.02 0.00 0.00 0.45 0.02 0.00 0.00 177.57 178.02 1xll h HIS 40 N -0.23 0.13 -0.47 1.57 -0.00 -1.37 -2.20 115.15 112.58 1xll h HIS 40 Ca 0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.37 1xll h HIS 40 Cb 0.22 -0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.57 1xll h HIS 40 CO -0.12 0.39 0.28 -0.22 -0.00 0.00 0.00 177.93 178.26 1xll h LYS 41 N -0.17 0.55 -0.54 2.45 1.63 -1.13 -2.18 116.57 117.18 1xll h LYS 41 Ca 0.02 -0.03 -0.12 0.00 -0.85 0.00 0.00 60.65 59.67 1xll h LYS 41 Cb 0.34 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 1xll h LYS 41 CO 0.00 0.36 -0.12 -0.07 -3.45 0.00 0.00 179.45 176.18 1xll h LEU 42 N 0.57 1.03 -0.43 5.20 3.38 -1.47 -2.43 115.31 121.16 1xll h LEU 42 Ca 0.18 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1xll h LEU 42 Cb 0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1xll h LEU 42 CO -0.08 1.14 0.21 0.00 0.09 0.00 0.00 178.44 179.80 1xll h ALA 43 N 0.94 0.56 0.00 1.53 0.00 -1.22 -0.97 119.26 120.11 1xll h ALA 43 Ca 0.14 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1xll h ALA 43 Cb 0.69 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xll h ALA 43 CO 0.05 0.11 -0.11 1.05 0.00 0.00 0.00 179.25 180.35 1xll h GLU 44 N 0.56 0.00 0.00 0.00 4.11 -1.11 -2.93 114.58 115.21 1xll h GLU 44 Ca 0.15 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.47 1xll h GLU 44 Cb 0.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1xll h GLU 44 CO -0.02 0.11 -0.51 -0.07 0.07 0.00 0.00 179.01 178.59 1xll h LEU 45 N 0.00 0.00 0.00 3.06 3.38 -0.94 -3.47 115.31 117.34 1xll h LEU 45 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xll h LEU 45 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1xll h LEU 45 CO 0.01 0.51 0.00 0.61 0.09 0.00 0.00 178.44 179.67 1xll n GLY 46 N 0.83 0.61 3.74 0.83 0.00 -1.04 -4.71 105.19 105.44 1xll n GLY 46 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1xll n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xll s ALA 47 N -1.43 2.35 -0.21 4.61 0.00 -0.42 -3.44 121.76 123.23 1xll s ALA 47 Ca 0.00 1.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.83 1xll s ALA 47 Cb 0.00 -3.50 -0.19 0.00 0.00 0.00 0.00 23.12 19.43 1xll s ALA 47 CO 0.00 -1.55 0.16 0.98 0.00 0.00 0.00 175.76 175.35 1xll n TYR 48 N -2.04 0.91 -3.94 0.00 9.36 0.01 -4.59 117.16 116.87 1xll n TYR 48 Ca 0.15 0.38 -0.10 0.00 3.32 0.00 0.00 57.90 61.64 1xll n TYR 48 Cb 0.49 -1.09 -0.02 0.00 -0.63 0.00 0.00 39.34 38.09 1xll n TYR 48 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1xll s GLY 49 N -4.99 0.69 0.17 2.98 0.00 -0.96 -2.90 107.32 102.32 1xll s GLY 49 Ca -0.30 -0.96 0.10 0.00 0.00 0.00 0.00 44.72 43.57 1xll s GLY 49 CO 0.59 -0.56 -0.22 -1.50 0.00 0.00 0.00 173.10 171.40 1xll s ILE 50 N -3.13 2.14 0.06 0.90 2.07 -0.63 -2.81 121.20 119.79 1xll s ILE 50 Ca 0.21 -1.94 0.00 0.00 -1.41 0.00 0.00 60.65 57.51 1xll s ILE 50 Cb -0.03 -1.98 -0.04 0.00 0.13 0.00 0.00 42.46 40.54 1xll s ILE 50 CO 0.13 -0.15 -0.04 0.42 -1.91 0.00 0.00 174.94 173.38 1xll s THR 51 N -1.69 0.36 0.28 4.00 -4.23 -0.25 -3.93 115.64 110.19 1xll s THR 51 Ca 0.18 -1.74 -0.20 0.00 -1.18 0.00 0.00 61.69 58.74 1xll s THR 51 Cb -0.08 -1.42 0.02 0.00 1.34 0.00 0.00 72.50 72.36 1xll s THR 51 CO 0.08 -0.89 0.71 0.72 -0.54 0.00 0.00 174.62 174.70 1xll s PHE 52 N -3.51 -0.15 -0.00 3.99 -0.71 -1.25 -1.12 117.98 115.23 1xll s PHE 52 Ca 0.06 -0.31 -0.01 0.00 -1.04 0.00 0.00 56.93 55.63 1xll s PHE 52 Cb 0.05 0.68 -0.04 0.00 -1.21 0.00 0.00 43.02 42.50 1xll s PHE 52 CO -0.07 -1.23 0.12 -1.01 -1.34 0.00 0.00 175.22 171.69 1xll s HIS 53 N -3.89 3.39 0.18 3.49 3.76 -1.26 -1.07 115.29 119.89 1xll s HIS 53 Ca 0.12 0.26 -0.24 0.00 -0.15 0.00 0.00 55.06 55.05 1xll s HIS 53 Cb -0.06 -1.77 0.08 0.00 1.11 0.00 0.00 32.58 31.94 1xll s HIS 53 CO 0.07 0.59 1.57 0.38 -0.85 0.00 0.00 174.74 176.50 1xll h ASP 54 N 3.92 -1.45 0.09 1.40 2.03 -1.73 -0.42 116.42 120.27 1xll h ASP 54 Ca -0.49 0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.07 1xll h ASP 54 Cb 1.18 0.68 0.00 0.00 -0.83 0.00 0.00 39.33 40.36 1xll h ASP 54 CO 0.65 -0.32 0.00 0.59 -1.03 0.00 0.00 179.24 179.14 1xll n ASN 55 N -5.41 0.00 -0.11 4.15 5.03 -1.24 -1.60 115.26 116.07 1xll n ASN 55 Ca 0.03 -0.76 -0.12 0.00 0.87 0.00 0.00 54.58 54.60 1xll n ASN 55 Cb 0.35 -0.05 -0.03 0.00 -1.02 0.00 0.00 39.78 39.03 1xll n ASN 55 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1xll h ASP 56 N 0.00 0.73 0.00 6.41 3.32 -1.47 -3.38 116.42 122.03 1xll h ASP 56 Ca 0.00 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1xll h ASP 56 Cb 0.05 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1xll h ASP 56 CO 0.00 0.98 -0.42 0.25 -1.72 0.00 0.00 179.24 178.33 1xll h LEU 57 N 0.48 0.00 -8.45 1.55 5.85 -1.61 -3.47 115.31 109.66 1xll h LEU 57 Ca 0.07 0.00 -0.68 0.00 0.84 0.00 0.00 57.88 58.11 1xll h LEU 57 Cb 0.71 0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.49 1xll h LEU 57 CO 0.05 0.70 -0.57 -0.63 -0.34 0.00 0.00 178.44 177.65 1xll s ILE 58 N -2.11 4.37 0.63 4.05 1.01 -0.63 -5.01 121.20 123.51 1xll s ILE 58 Ca -0.12 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 59.73 1xll s ILE 58 Cb 0.02 -3.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1xll s ILE 58 CO 0.18 -0.00 0.74 -2.65 0.00 0.00 0.00 174.94 173.21 1xll n PRO 59 N 4.94 0.60 -0.17 2.79 -0.02 -1.26 -3.63 135.00 138.25 1xll n PRO 59 Ca -0.14 0.24 -0.04 0.00 -2.02 0.00 0.00 63.50 61.55 1xll n PRO 59 Cb 0.48 -1.96 0.06 0.00 -0.02 0.00 0.00 33.50 32.05 1xll n PRO 59 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xll h PHE 60 N 0.14 0.43 -0.11 6.00 3.04 -1.96 -2.83 116.94 121.65 1xll h PHE 60 Ca -0.47 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.50 1xll h PHE 60 Cb 1.37 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.76 1xll h PHE 60 CO 0.35 0.19 0.00 -0.40 -2.02 0.00 0.00 178.31 176.43 1xll n ASP 61 N -4.92 1.50 -4.69 0.41 5.68 -1.26 -5.02 116.55 108.26 1xll n ASP 61 Ca 0.05 -1.62 -0.44 0.00 -0.50 0.00 0.00 54.79 52.28 1xll n ASP 61 Cb 0.16 -0.07 -0.03 0.00 -1.14 0.00 0.00 41.12 40.05 1xll n ASP 61 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xll n ALA 62 N 0.20 1.57 -1.64 2.12 0.00 -1.07 -5.02 120.51 116.66 1xll n ALA 62 Ca 0.17 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.72 1xll n ALA 62 Cb 0.32 -2.34 0.18 0.00 0.00 0.00 0.00 19.45 17.61 1xll n ALA 62 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xll s THR 63 N 0.14 1.91 0.29 0.00 -4.23 -1.26 -4.81 115.64 107.68 1xll s THR 63 Ca 0.69 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 61.24 1xll s THR 63 Cb -0.61 -2.82 0.06 0.00 1.34 0.00 0.00 72.50 70.47 1xll s THR 63 CO 0.47 0.00 1.72 1.05 -0.54 0.00 0.00 174.62 177.32 1xll h GLU 64 N -1.76 0.39 0.59 3.99 9.09 -1.99 -2.00 114.58 122.89 1xll h GLU 64 Ca -0.46 -0.16 -0.03 0.00 0.05 0.00 0.00 59.36 58.76 1xll h GLU 64 Cb 1.28 -0.02 0.01 0.00 -1.65 0.00 0.00 28.75 28.37 1xll h GLU 64 CO 0.46 0.66 -0.28 0.00 0.05 0.00 0.00 179.01 179.89 1xll h ALA 65 N 1.34 -0.83 -0.71 1.06 0.00 -1.99 -1.06 119.26 117.07 1xll h ALA 65 Ca 0.05 -0.17 0.14 0.00 0.00 0.00 0.00 54.91 54.92 1xll h ALA 65 Cb 0.71 0.30 -0.13 0.00 0.00 0.00 0.00 17.79 18.67 1xll h ALA 65 CO 0.05 -0.77 -0.25 0.93 0.00 0.00 0.00 179.25 179.22 1xll h GLU 66 N -1.14 -0.05 -0.45 0.00 5.08 -1.91 -0.69 114.58 115.42 1xll h GLU 66 Ca -0.08 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1xll h GLU 66 Cb 0.60 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 1xll h GLU 66 CO 0.13 -0.03 0.22 -0.09 -1.00 0.00 0.00 179.01 178.24 1xll h ARG 67 N -0.05 0.42 -0.96 2.33 2.43 -1.35 -1.68 114.38 115.53 1xll h ARG 67 Ca 0.32 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1xll h ARG 67 Cb 0.55 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.96 1xll h ARG 67 CO -0.75 0.28 0.63 1.49 -1.51 0.00 0.00 179.97 180.11 1xll h GLU 68 N 0.43 1.26 0.25 0.20 4.57 0.22 -1.50 114.58 120.01 1xll h GLU 68 Ca 0.20 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 1xll h GLU 68 Cb 0.12 -0.28 0.00 0.00 -0.16 0.00 0.00 28.75 28.43 1xll h GLU 68 CO -0.15 0.84 -0.12 -0.22 -1.18 0.00 0.00 179.01 178.18 1xll h LYS 69 N 1.30 -0.33 -0.44 1.92 3.11 -0.84 -1.62 116.57 119.67 1xll h LYS 69 Ca 0.35 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 58.30 1xll h LYS 69 Cb -0.15 0.07 -0.09 0.00 -1.00 0.00 0.00 32.23 31.07 1xll h LYS 69 CO -0.08 -0.02 -0.15 0.82 -2.81 0.00 0.00 179.45 177.22 1xll h ILE 70 N -0.65 0.48 -0.46 2.00 2.04 -1.31 0.26 117.51 119.87 1xll h ILE 70 Ca -0.03 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 1xll h ILE 70 Cb 0.46 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1xll h ILE 70 CO 0.06 0.00 0.14 -0.07 0.00 0.00 0.00 178.15 178.27 1xll h LEU 71 N -0.05 0.62 -0.63 1.44 3.38 -1.25 -1.63 115.31 117.19 1xll h LEU 71 Ca 0.22 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 1xll h LEU 71 Cb 0.38 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1xll h LEU 71 CO -0.48 0.60 -0.27 1.23 0.09 0.00 0.00 178.44 179.60 1xll h GLY 72 N 0.85 0.85 0.83 0.83 0.00 0.18 -1.12 103.07 105.50 1xll h GLY 72 Ca 0.15 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.69 1xll h GLY 72 CO -0.01 0.70 0.02 -0.55 0.00 0.00 0.00 176.54 176.70 1xll h ASP 73 N 0.67 0.35 -0.24 0.19 3.32 -0.34 -2.48 116.42 117.89 1xll h ASP 73 Ca 0.08 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 56.76 1xll h ASP 73 Cb 0.80 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1xll h ASP 73 CO 0.07 0.54 -0.22 0.15 -1.72 0.00 0.00 179.24 178.06 1xll h PHE 74 N 0.14 0.68 -0.08 4.55 3.57 -1.16 -2.71 116.94 121.93 1xll h PHE 74 Ca 0.06 -0.20 -0.06 0.00 3.53 0.00 0.00 57.97 61.31 1xll h PHE 74 Cb 0.35 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1xll h PHE 74 CO 0.03 0.89 -0.21 -0.91 -2.23 0.00 0.00 178.31 175.88 1xll h ASN 75 N 0.27 0.13 0.95 0.41 -0.26 -1.28 -2.34 115.58 113.46 1xll h ASN 75 Ca 0.04 -0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.70 1xll h ASN 75 Cb 0.77 -0.03 0.01 0.00 -1.06 0.00 0.00 38.32 38.01 1xll h ASN 75 CO 0.06 0.35 -0.46 -0.61 -1.06 0.00 0.00 177.43 175.71 1xll h GLN 76 N 0.12 -1.23 -0.69 0.81 5.75 -1.34 -1.96 115.11 116.58 1xll h GLN 76 Ca 0.02 0.08 0.15 0.00 -0.15 0.00 0.00 58.65 58.75 1xll h GLN 76 Cb 0.44 0.28 -0.11 0.00 1.07 0.00 0.00 27.48 29.17 1xll h GLN 76 CO 0.03 -0.82 0.10 0.00 -2.65 0.00 0.00 178.83 175.49 1xll h ALA 77 N -1.29 0.81 -0.36 3.38 0.00 -1.35 0.13 119.26 120.57 1xll h ALA 77 Ca -0.13 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xll h ALA 77 Cb 0.98 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1xll h ALA 77 CO 0.21 -0.36 0.19 -0.07 0.00 0.00 0.00 179.25 179.22 1xll h LEU 78 N 0.20 0.46 -0.00 0.00 3.38 -1.46 -1.09 115.31 116.80 1xll h LEU 78 Ca 0.38 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1xll h LEU 78 Cb 0.63 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1xll h LEU 78 CO -0.52 0.43 0.00 0.11 0.09 0.00 0.00 178.44 178.55 1xll h LYS 79 N 0.46 0.01 -0.37 1.13 1.57 -0.22 0.19 116.57 119.33 1xll h LYS 79 Ca 0.13 -0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1xll h LYS 79 Cb 0.08 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.33 1xll h LYS 79 CO -0.02 0.28 0.01 -0.44 -0.57 0.00 0.00 179.45 178.71 1xll h ASP 80 N -0.26 -0.13 0.80 0.86 3.32 -0.76 -3.25 116.42 117.00 1xll h ASP 80 Ca 0.00 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.03 1xll h ASP 80 Cb 0.27 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1xll h ASP 80 CO 0.00 -0.03 -1.27 0.35 -1.72 0.00 0.00 179.24 176.56 1xll n THR 81 N -5.18 0.98 -0.59 0.35 -2.24 -0.42 -5.00 114.28 102.19 1xll n THR 81 Ca 0.02 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1xll n THR 81 Cb 0.19 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 1xll n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xll n GLY 82 N 1.32 0.71 3.76 3.38 0.00 0.65 -5.02 105.19 109.98 1xll n GLY 82 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1xll n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xll s LEU 83 N 0.00 4.48 0.32 0.99 1.02 -1.19 -5.02 118.68 119.28 1xll s LEU 83 Ca 0.00 2.53 -0.01 0.00 0.02 0.00 0.00 54.13 56.67 1xll s LEU 83 Cb 0.00 -3.64 -0.04 0.00 0.02 0.00 0.00 46.19 42.53 1xll s LEU 83 CO 0.00 -0.38 0.54 -0.75 0.02 0.00 0.00 176.35 175.77 1xll s LYS 84 N -1.64 3.52 -0.66 1.70 2.47 -1.14 -4.83 119.74 119.16 1xll s LYS 84 Ca 0.47 -0.26 0.04 0.00 -1.56 0.00 0.00 55.97 54.66 1xll s LYS 84 Cb -0.37 -2.67 0.16 0.00 -1.46 0.00 0.00 37.83 33.49 1xll s LYS 84 CO 0.48 0.18 0.44 0.08 0.16 0.00 0.00 175.35 176.70 1xll s VAL 85 N -2.23 2.96 -0.66 4.02 1.01 -1.26 -1.61 120.40 122.64 1xll s VAL 85 Ca 0.41 -3.87 0.26 0.00 0.00 0.00 0.00 61.98 58.77 1xll s VAL 85 Cb -0.10 -2.97 0.30 0.00 0.00 0.00 0.00 36.38 33.61 1xll s VAL 85 CO 0.34 -0.94 1.75 1.55 0.00 0.00 0.00 175.10 177.80 1xll h PRO 86 N 5.89 0.00 -2.98 2.72 0.14 -1.85 -2.71 132.00 133.20 1xll h PRO 86 Ca 0.06 0.00 -0.13 0.00 0.14 0.00 0.00 66.00 66.08 1xll h PRO 86 Cb 0.81 0.00 -0.22 0.00 0.14 0.00 0.00 31.00 31.73 1xll h PRO 86 CO 0.72 0.00 -0.30 1.41 0.14 0.00 0.00 178.00 179.98 1xll s MET 87 N -3.13 0.55 -0.00 0.86 -2.45 -1.26 -2.18 119.30 111.68 1xll s MET 87 Ca 0.10 0.10 0.01 0.00 -1.25 0.00 0.00 55.69 54.65 1xll s MET 87 Cb 0.11 0.25 -0.00 0.00 1.25 0.00 0.00 34.83 36.44 1xll s MET 87 CO 0.60 -0.12 -0.04 0.08 1.05 0.00 0.00 175.02 176.59 1xll s VAL 88 N -0.66 0.32 0.23 10.11 1.01 -1.04 -3.76 120.40 126.61 1xll s VAL 88 Ca -0.08 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 61.75 1xll s VAL 88 Cb -0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 1xll s VAL 88 CO 0.03 0.09 0.04 0.28 0.00 0.00 0.00 175.10 175.54 1xll s THR 89 N -0.07 0.72 0.01 3.92 -1.32 -0.23 -2.82 115.64 115.84 1xll s THR 89 Ca 0.01 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.52 1xll s THR 89 Cb -0.02 -2.42 -0.03 0.00 -1.51 0.00 0.00 72.50 68.52 1xll s THR 89 CO -0.00 -0.22 -0.06 -0.89 -2.21 0.00 0.00 174.62 171.24 1xll s THR 90 N -3.63 3.69 -0.55 5.08 2.01 -1.26 -1.97 115.64 119.00 1xll s THR 90 Ca 0.31 -0.78 -0.20 0.00 0.31 0.00 0.00 61.69 61.33 1xll s THR 90 Cb 0.07 -2.61 0.07 0.00 0.01 0.00 0.00 72.50 70.03 1xll s THR 90 CO 0.10 0.38 0.74 0.21 -0.69 0.00 0.00 174.62 175.36 1xll s ASN 91 N -1.47 6.23 -0.32 3.53 3.84 -1.26 -4.85 114.94 120.64 1xll s ASN 91 Ca 0.18 -0.92 0.08 0.00 0.21 0.00 0.00 52.86 52.40 1xll s ASN 91 Cb -0.11 -2.34 0.50 0.00 -0.55 0.00 0.00 41.25 38.75 1xll s ASN 91 CO 0.08 -1.07 1.46 0.18 -2.79 0.00 0.00 177.10 174.97 1xll n LEU 92 N 6.64 4.47 0.00 3.21 4.77 -1.26 -4.69 117.00 130.14 1xll n LEU 92 Ca -0.05 -3.97 0.00 0.00 -0.03 0.00 0.00 56.01 51.96 1xll n LEU 92 Cb 0.45 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1xll n LEU 92 CO 0.58 1.41 -0.02 2.22 -1.33 0.00 0.00 177.39 180.25 1xll n PHE 93 N -1.06 0.00 0.14 -1.77 1.16 -1.26 -4.42 117.46 110.26 1xll n PHE 93 Ca 0.37 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.70 1xll n PHE 93 Cb 0.99 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.70 1xll n PHE 93 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1xll h SER 94 N 0.00 0.84 -4.06 5.98 0.02 -1.94 -3.45 113.55 110.93 1xll h SER 94 Ca 0.00 -0.92 -0.51 0.00 -0.84 0.00 0.00 61.79 59.52 1xll h SER 94 Cb 0.03 -0.27 0.08 0.00 0.14 0.00 0.00 62.40 62.38 1xll h SER 94 CO 0.00 1.71 0.46 -2.28 -1.14 0.00 0.00 176.83 175.58 1xll s HIS 95 N -2.59 2.66 0.43 3.45 5.65 -1.26 -4.93 115.29 118.70 1xll s HIS 95 Ca -0.09 1.53 0.22 0.00 0.25 0.00 0.00 55.06 56.96 1xll s HIS 95 Cb 0.04 -3.38 1.19 0.00 -1.18 0.00 0.00 32.58 29.25 1xll s HIS 95 CO 0.94 -1.75 1.80 -1.35 -0.65 0.00 0.00 174.74 173.74 1xll h PRO 96 N 1.40 0.30 -1.00 2.88 0.11 -2.02 -1.08 132.00 132.58 1xll h PRO 96 Ca -0.50 -0.02 0.22 0.00 0.11 0.00 0.00 66.00 65.81 1xll h PRO 96 Cb 1.27 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 32.20 1xll h PRO 96 CO 0.58 0.20 0.61 -0.24 -0.21 0.00 0.00 178.00 178.93 1xll h VAL 97 N 0.31 0.63 -0.10 3.15 3.04 -1.96 -0.99 116.25 120.33 1xll h VAL 97 Ca 0.55 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 1xll h VAL 97 Cb 1.57 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.76 1xll h VAL 97 CO -0.21 0.12 0.00 0.49 -1.01 0.00 0.00 177.57 176.96 1xll n PHE 98 N -4.80 0.27 0.17 3.17 3.72 -0.41 -4.54 117.46 115.05 1xll n PHE 98 Ca 0.25 -0.10 0.16 0.00 -0.05 0.00 0.00 57.45 57.71 1xll n PHE 98 Cb 0.66 -0.11 0.78 0.00 -0.94 0.00 0.00 39.48 39.87 1xll n PHE 98 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1xll h LYS 99 N 0.64 0.00 -0.32 -1.08 2.10 -1.32 -0.02 116.57 116.57 1xll h LYS 99 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xll h LYS 99 Cb 0.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 1xll h LYS 99 CO 0.05 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.03 1xll n ASP 100 N -4.01 2.84 0.00 7.07 2.03 -1.26 -5.03 116.55 118.18 1xll n ASP 100 Ca 0.02 -2.00 0.00 0.00 0.52 0.00 0.00 54.79 53.34 1xll n ASP 100 Cb 0.34 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.53 1xll n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xll n GLY 101 N 0.43 1.78 0.00 0.27 0.00 -0.02 -3.80 105.19 103.86 1xll n GLY 101 Ca 0.11 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1xll n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xll n GLY 102 N -0.64 0.01 0.39 -0.02 0.00 -1.26 -4.37 105.19 99.30 1xll n GLY 102 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 1xll n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xll h PHE 103 N 0.00 0.57 -0.33 1.61 -1.00 -1.89 -2.63 116.94 113.27 1xll h PHE 103 Ca 0.00 0.02 -0.07 0.00 2.81 0.00 0.00 57.97 60.72 1xll h PHE 103 Cb 0.00 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.34 1xll h PHE 103 CO 0.00 0.16 0.01 0.25 -1.61 0.00 0.00 178.31 177.12 1xll n THR 104 N -4.52 2.42 -1.45 -1.55 -2.24 -1.26 -4.41 114.28 101.28 1xll n THR 104 Ca 0.19 -2.10 -0.35 0.00 -2.27 0.00 0.00 64.05 59.52 1xll n THR 104 Cb 0.66 -0.29 0.09 0.00 -2.10 0.00 0.00 70.33 68.70 1xll n THR 104 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xll s SER 105 N -2.04 4.15 0.11 3.42 0.15 -0.99 -4.83 113.70 113.68 1xll s SER 105 Ca 0.44 2.46 -0.11 0.00 0.70 0.00 0.00 55.95 59.44 1xll s SER 105 Cb 0.37 -2.60 -0.12 0.00 -1.71 0.00 0.00 66.02 61.96 1xll s SER 105 CO 0.07 -2.30 1.33 0.78 1.20 0.00 0.00 173.24 174.31 1xll h ASN 106 N -0.17 0.89 -2.93 5.45 4.21 -1.92 -3.43 115.58 117.67 1xll h ASN 106 Ca -0.48 -0.58 -0.55 0.00 1.21 0.00 0.00 56.30 55.89 1xll h ASN 106 Cb 1.31 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 38.23 1xll h ASN 106 CO 0.50 1.37 0.84 -0.62 -1.29 0.00 0.00 177.43 178.23 1xll s ASP 107 N -7.09 6.92 0.27 5.81 -1.08 -1.26 -4.95 116.67 115.29 1xll s ASP 107 Ca -0.10 1.90 0.03 0.00 -0.52 0.00 0.00 52.55 53.86 1xll s ASP 107 Cb 0.09 -2.55 0.38 0.00 -1.46 0.00 0.00 42.92 39.38 1xll s ASP 107 CO 0.90 -0.71 1.69 -0.09 0.52 0.00 0.00 175.17 177.47 1xll h ARG 108 N 8.01 0.44 -0.23 4.34 2.43 -1.99 -2.06 114.38 125.31 1xll h ARG 108 Ca -0.33 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 58.56 1xll h ARG 108 Cb 1.15 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1xll h ARG 108 CO 0.92 0.72 -0.20 0.66 -1.51 0.00 0.00 179.97 180.56 1xll h SER 109 N 0.38 0.58 -0.56 -3.80 4.64 -1.98 -2.25 113.55 110.56 1xll h SER 109 Ca 0.05 -0.46 0.10 0.00 -0.47 0.00 0.00 61.79 61.01 1xll h SER 109 Cb 0.75 -0.16 -0.08 0.00 -0.31 0.00 0.00 62.40 62.60 1xll h SER 109 CO 0.06 0.91 0.09 0.40 -0.87 0.00 0.00 176.83 177.42 1xll h ILE 110 N 0.25 0.64 -0.69 0.95 2.04 -1.93 -0.57 117.51 118.20 1xll h ILE 110 Ca 0.04 -0.07 0.08 0.00 1.00 0.00 0.00 64.86 65.91 1xll h ILE 110 Cb 0.74 0.41 -0.07 0.00 -0.74 0.00 0.00 36.82 37.16 1xll h ILE 110 CO 0.05 0.04 0.35 0.03 0.00 0.00 0.00 178.15 178.62 1xll h ARG 111 N 0.22 0.60 -0.39 2.37 3.08 -1.11 0.28 114.38 119.43 1xll h ARG 111 Ca 0.29 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 60.14 1xll h ARG 111 Cb 0.43 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1xll h ARG 111 CO -0.40 0.40 -0.39 0.00 -1.07 0.00 0.00 179.97 178.51 1xll h ARG 112 N 0.62 0.94 -0.09 0.04 3.08 -0.58 -1.54 114.38 116.85 1xll h ARG 112 Ca 0.33 -0.50 0.01 0.00 0.07 0.00 0.00 59.98 59.89 1xll h ARG 112 Cb 0.31 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1xll h ARG 112 CO -0.24 1.15 0.03 0.35 -1.07 0.00 0.00 179.97 180.19 1xll h PHE 113 N 0.77 0.05 -0.30 3.04 3.57 -0.33 0.15 116.94 123.89 1xll h PHE 113 Ca 0.06 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.63 1xll h PHE 113 Cb 0.98 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.64 1xll h PHE 113 CO 0.06 0.03 -0.27 0.00 -2.23 0.00 0.00 178.31 175.90 1xll h ALA 114 N 1.06 -0.14 -0.81 2.41 0.00 -0.36 0.33 119.26 121.74 1xll h ALA 114 Ca 0.04 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1xll h ALA 114 Cb 0.02 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1xll h ALA 114 CO -0.04 -0.68 0.35 1.25 0.00 0.00 0.00 179.25 180.12 1xll h LEU 115 N -0.25 1.10 -0.20 0.00 5.85 -1.02 -2.09 115.31 118.69 1xll h LEU 115 Ca 0.15 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1xll h LEU 115 Cb 0.49 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1xll h LEU 115 CO -0.44 0.95 0.01 0.00 -0.34 0.00 0.00 178.44 178.62 1xll h ALA 116 N 1.21 0.18 -0.83 1.25 0.00 0.87 -1.19 119.26 120.74 1xll h ALA 116 Ca 0.27 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.29 1xll h ALA 116 Cb 0.18 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1xll h ALA 116 CO -0.03 -0.42 0.54 -0.22 0.00 0.00 0.00 179.25 179.12 1xll h LYS 117 N 0.08 0.91 -0.03 0.00 3.64 -0.19 -2.09 116.57 118.89 1xll h LYS 117 Ca 0.09 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1xll h LYS 117 Cb 0.11 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1xll h LYS 117 CO -0.15 0.60 -0.03 0.28 -2.27 0.00 0.00 179.45 177.89 1xll h VAL 118 N 0.94 1.38 -0.16 2.00 2.07 -0.73 -2.97 116.25 118.78 1xll h VAL 118 Ca 0.35 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.73 1xll h VAL 118 Cb 0.18 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1xll h VAL 118 CO -0.12 0.31 -0.06 -0.07 0.02 0.00 0.00 177.57 177.65 1xll h LEU 119 N -0.40 -0.21 -0.20 2.57 3.38 -0.83 -0.39 115.31 119.22 1xll h LEU 119 Ca 0.00 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.08 1xll h LEU 119 Cb 0.52 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 1xll h LEU 119 CO 0.01 -0.08 -0.13 0.45 0.09 0.00 0.00 178.44 178.77 1xll h HIS 120 N -0.03 -0.33 -0.38 1.13 3.86 -1.49 -1.61 115.15 116.29 1xll h HIS 120 Ca 0.08 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.36 1xll h HIS 120 Cb 0.16 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 1xll h HIS 120 CO -0.21 -0.20 0.26 -0.97 0.86 0.00 0.00 177.93 177.67 1xll h ASN 121 N -0.13 0.29 -0.90 2.45 -1.24 -1.26 -1.92 115.58 112.86 1xll h ASN 121 Ca 0.12 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 1xll h ASN 121 Cb 0.30 -0.07 -0.04 0.00 0.73 0.00 0.00 38.32 39.25 1xll h ASN 121 CO -0.28 0.20 0.49 0.40 -1.29 0.00 0.00 177.43 176.95 1xll h ILE 122 N 0.34 1.26 0.38 2.57 2.04 -0.07 -1.13 117.51 122.90 1xll h ILE 122 Ca 0.16 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1xll h ILE 122 Cb 0.21 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 1xll h ILE 122 CO -0.04 0.29 -0.27 0.44 0.00 0.00 0.00 178.15 178.58 1xll h ASP 123 N 1.27 -0.69 -0.42 1.72 3.32 -1.20 -1.44 116.42 118.98 1xll h ASP 123 Ca 0.32 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.46 1xll h ASP 123 Cb 0.03 0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 1xll h ASP 123 CO -0.05 -0.41 0.18 0.25 -1.72 0.00 0.00 179.24 177.49 1xll h LEU 124 N -0.64 0.23 -0.56 1.55 5.85 -1.19 -0.98 115.31 119.57 1xll h LEU 124 Ca -0.03 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.80 1xll h LEU 124 Cb 0.54 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.51 1xll h LEU 124 CO 0.01 0.17 0.21 0.00 -0.34 0.00 0.00 178.44 178.49 1xll h ALA 125 N 1.25 0.71 -0.54 1.25 0.00 -1.08 0.20 119.26 121.05 1xll h ALA 125 Ca 0.19 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1xll h ALA 125 Cb 0.14 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1xll h ALA 125 CO -0.16 -0.19 0.02 0.00 0.00 0.00 0.00 179.25 178.91 1xll h ALA 126 N 1.38 0.73 -0.52 0.00 0.00 -0.91 -2.17 119.26 117.77 1xll h ALA 126 Ca 0.28 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1xll h ALA 126 Cb 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1xll h ALA 126 CO -0.27 0.54 0.02 0.93 0.00 0.00 0.00 179.25 180.46 1xll h GLU 127 N 0.82 0.90 0.00 0.00 5.08 0.56 -2.94 114.58 119.01 1xll h GLU 127 Ca 0.16 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1xll h GLU 127 Cb 0.51 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1xll h GLU 127 CO 0.02 0.92 0.00 -1.33 -1.00 0.00 0.00 179.01 177.62 1xll n MET 128 N -4.32 0.05 -0.82 2.33 2.81 0.45 -4.89 117.12 112.73 1xll n MET 128 Ca 0.01 0.44 0.00 0.00 -1.81 0.00 0.00 57.70 56.34 1xll n MET 128 Cb 0.31 -1.62 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1xll n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xll n GLY 129 N -0.85 0.52 3.77 3.03 0.00 -1.06 -4.44 105.19 106.15 1xll n GLY 129 Ca 0.01 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 1xll n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xll s ALA 130 N -2.00 3.19 -0.11 4.61 0.00 -0.84 -4.73 121.76 121.89 1xll s ALA 130 Ca 0.00 1.03 0.16 0.00 0.00 0.00 0.00 51.96 53.15 1xll s ALA 130 Cb 0.00 -3.40 -0.21 0.00 0.00 0.00 0.00 23.12 19.51 1xll s ALA 130 CO 0.00 -0.58 0.58 0.39 0.00 0.00 0.00 175.76 176.15 1xll n GLU 131 N 0.15 0.64 -5.06 0.00 -0.58 -0.98 -4.72 120.64 110.10 1xll n GLU 131 Ca 0.04 0.17 -0.29 0.00 -0.42 0.00 0.00 57.16 56.66 1xll n GLU 131 Cb 0.46 -1.72 -0.15 0.00 -0.57 0.00 0.00 31.44 29.45 1xll n GLU 131 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1xll s THR 132 N -2.75 1.87 -0.30 2.62 2.01 -0.93 -2.48 115.64 115.68 1xll s THR 132 Ca -0.05 -1.09 0.03 0.00 0.31 0.00 0.00 61.69 60.89 1xll s THR 132 Cb 0.08 -1.57 0.08 0.00 0.01 0.00 0.00 72.50 71.10 1xll s THR 132 CO 0.83 0.46 -0.02 0.12 -0.69 0.00 0.00 174.62 175.31 1xll s PHE 133 N -0.62 3.50 -0.03 4.92 5.36 0.52 -2.49 117.98 129.13 1xll s PHE 133 Ca 0.09 -2.67 -0.13 0.00 -0.96 0.00 0.00 56.93 53.26 1xll s PHE 133 Cb -0.09 -2.44 -0.05 0.00 -0.34 0.00 0.00 43.02 40.09 1xll s PHE 133 CO -0.00 -0.91 0.35 0.08 -1.46 0.00 0.00 175.22 173.28 1xll s VAL 134 N 1.01 5.13 -0.20 3.12 1.01 -1.13 0.03 120.40 129.37 1xll s VAL 134 Ca 0.02 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1xll s VAL 134 Cb -0.19 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.56 1xll s VAL 134 CO -0.07 0.58 -0.16 -0.04 0.00 0.00 0.00 175.10 175.41 1xll s MET 135 N -0.98 2.92 -0.42 2.72 1.00 -0.39 -4.20 119.30 119.95 1xll s MET 135 Ca 0.22 -0.89 -0.01 0.00 0.00 0.00 0.00 55.69 55.00 1xll s MET 135 Cb -0.16 -2.70 0.11 0.00 0.00 0.00 0.00 34.83 32.08 1xll s MET 135 CO 0.11 -0.27 0.20 -0.46 0.00 0.00 0.00 175.02 174.59 1xll s TRP 136 N 1.29 3.60 -1.50 -0.03 -0.00 -1.26 -0.99 118.94 120.05 1xll s TRP 136 Ca 0.03 -2.57 -0.10 0.00 -0.00 0.00 0.00 56.10 53.46 1xll s TRP 136 Cb -0.14 -3.16 -0.07 0.00 -0.00 0.00 0.00 33.47 30.09 1xll s TRP 136 CO -0.10 -0.95 2.75 0.41 -0.00 0.00 0.00 176.95 179.05 1xll n GLY 137 N 4.40 4.09 0.31 5.86 0.00 -1.26 -4.75 105.19 113.85 1xll n GLY 137 Ca -0.00 -1.42 0.21 0.00 0.00 0.00 0.00 46.02 44.80 1xll n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xll h GLY 138 N 7.68 0.00 -1.00 -0.02 0.00 -1.91 -2.79 103.07 105.03 1xll h GLY 138 Ca 0.78 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.11 1xll h GLY 138 CO 1.76 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.84 1xll n ARG 139 N -3.10 2.21 -2.90 4.80 5.12 -1.26 -3.99 116.66 117.53 1xll n ARG 139 Ca -0.02 -1.73 -0.43 0.00 -1.93 0.00 0.00 57.85 53.75 1xll n ARG 139 Cb 0.16 -1.22 -0.05 0.00 -1.16 0.00 0.00 32.46 30.20 1xll n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1xll s GLU 140 N -0.94 3.60 0.00 5.56 0.41 -1.05 -2.41 118.70 123.87 1xll s GLU 140 Ca 0.17 0.18 0.00 0.00 -0.41 0.00 0.00 54.97 54.91 1xll s GLU 140 Cb 0.10 -3.88 0.00 0.00 -1.78 0.00 0.00 34.13 28.57 1xll s GLU 140 CO 0.13 -1.05 0.00 0.41 -0.49 0.00 0.00 175.26 174.26 1xll n GLY 141 N 4.76 0.18 3.68 -1.39 0.00 -1.26 -1.45 105.19 109.71 1xll n GLY 141 Ca 0.04 -1.30 -0.06 0.00 0.00 0.00 0.00 46.02 44.70 1xll n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xll s SER 142 N -4.00 -0.29 -0.16 1.61 1.04 -0.73 -4.98 113.70 106.20 1xll s SER 142 Ca 0.00 -0.31 0.13 0.00 0.48 0.00 0.00 55.95 56.24 1xll s SER 142 Cb 0.00 0.53 -0.23 0.00 0.10 0.00 0.00 66.02 66.42 1xll s SER 142 CO 0.00 -0.95 0.21 -0.62 0.98 0.00 0.00 173.24 172.87 1xll n GLU 143 N -0.41 0.67 -5.07 4.02 4.71 -1.26 -1.39 120.64 121.91 1xll n GLU 143 Ca -0.08 0.12 -0.30 0.00 -0.01 0.00 0.00 57.16 56.88 1xll n GLU 143 Cb 0.61 -1.61 -0.15 0.00 -1.01 0.00 0.00 31.44 29.28 1xll n GLU 143 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1xll s TYR 144 N -2.53 2.33 0.29 -0.32 2.02 -1.26 -4.91 117.35 112.97 1xll s TYR 144 Ca -0.13 -0.42 0.20 0.00 -0.37 0.00 0.00 57.07 56.35 1xll s TYR 144 Cb 0.07 -1.44 0.92 0.00 -0.40 0.00 0.00 41.96 41.12 1xll s TYR 144 CO 0.79 0.06 1.86 -0.44 -1.57 0.00 0.00 175.55 176.25 1xll h ASP 145 N 5.07 0.00 -0.01 2.29 3.32 -1.98 -3.15 116.42 121.96 1xll h ASP 145 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1xll h ASP 145 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1xll h ASP 145 CO 0.45 0.29 -0.01 0.61 -1.72 0.00 0.00 179.24 178.86 1xll n GLY 146 N -0.21 0.11 0.26 2.75 0.00 -1.26 -4.38 105.19 102.45 1xll n GLY 146 Ca -0.01 -0.48 0.17 0.00 0.00 0.00 0.00 46.02 45.70 1xll n GLY 146 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xll h SER 147 N 2.63 0.00 -4.43 1.61 0.02 -1.99 -3.44 113.55 107.95 1xll h SER 147 Ca 0.00 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.52 1xll h SER 147 Cb 0.57 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.90 1xll h SER 147 CO 0.00 0.00 -0.79 -0.54 -1.14 0.00 0.00 176.83 174.36 1xll s LYS 148 N -3.71 0.87 -0.51 3.45 -0.14 -1.26 -5.03 119.74 113.40 1xll s LYS 148 Ca 0.00 -0.99 -0.16 0.00 -1.36 0.00 0.00 55.97 53.46 1xll s LYS 148 Cb 0.10 -0.91 0.10 0.00 -1.68 0.00 0.00 37.83 35.44 1xll s LYS 148 CO 0.46 0.20 0.47 0.34 -0.76 0.00 0.00 175.35 176.07 1xll s ASP 149 N -1.78 6.17 0.43 2.83 -1.08 -1.26 -4.96 116.67 117.02 1xll s ASP 149 Ca -0.01 -1.52 0.11 0.00 -0.52 0.00 0.00 52.55 50.61 1xll s ASP 149 Cb -0.10 -2.21 0.94 0.00 -1.46 0.00 0.00 42.92 40.10 1xll s ASP 149 CO 0.03 -0.78 2.03 0.25 0.52 0.00 0.00 175.17 177.21 1xll h LEU 150 N 8.94 0.24 -0.01 -1.34 7.12 -1.97 0.40 115.31 128.69 1xll h LEU 150 Ca -0.29 -0.02 -0.27 0.00 0.13 0.00 0.00 57.88 57.43 1xll h LEU 150 Cb 1.10 -0.06 0.02 0.00 -0.53 0.00 0.00 40.66 41.19 1xll h LEU 150 CO 0.97 0.26 -1.06 0.00 -0.13 0.00 0.00 178.44 178.48 1xll h ALA 151 N 1.78 0.14 -0.34 1.25 0.00 -2.00 -3.02 119.26 117.06 1xll h ALA 151 Ca 0.07 -0.71 -0.17 0.00 0.00 0.00 0.00 54.91 54.10 1xll h ALA 151 Cb 0.13 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xll h ALA 151 CO -0.00 0.71 -0.45 0.00 0.00 0.00 0.00 179.25 179.51 1xll h ALA 152 N 0.43 0.55 -0.37 0.00 0.00 -1.84 -2.55 119.26 115.48 1xll h ALA 152 Ca -0.13 -0.48 0.07 0.00 0.00 0.00 0.00 54.91 54.38 1xll h ALA 152 Cb 1.71 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 1xll h ALA 152 CO 0.20 0.68 -0.08 0.00 0.00 0.00 0.00 179.25 180.06 1xll h ALA 153 N 0.76 0.26 -0.39 0.00 0.00 -0.21 -0.81 119.26 118.88 1xll h ALA 153 Ca 0.04 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1xll h ALA 153 Cb 1.04 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1xll h ALA 153 CO 0.10 -0.45 -0.05 -0.07 0.00 0.00 0.00 179.25 178.78 1xll h LEU 154 N 0.02 0.62 -0.31 0.00 3.38 -1.45 -2.38 115.31 115.17 1xll h LEU 154 Ca 0.18 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1xll h LEU 154 Cb 0.27 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1xll h LEU 154 CO -0.37 0.72 0.09 0.44 0.09 0.00 0.00 178.44 179.42 1xll h ASP 155 N 0.60 0.46 -0.48 -0.43 3.32 -0.96 0.24 116.42 119.16 1xll h ASP 155 Ca 0.12 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 56.98 1xll h ASP 155 Cb 0.46 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1xll h ASP 155 CO 0.02 0.56 0.28 0.03 -1.72 0.00 0.00 179.24 178.41 1xll h ARG 156 N 0.35 0.54 0.59 3.56 2.47 -1.07 0.15 114.38 120.97 1xll h ARG 156 Ca 0.10 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 1xll h ARG 156 Cb 0.26 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 1xll h ARG 156 CO -0.00 0.36 -0.42 1.98 0.56 0.00 0.00 179.97 182.45 1xll h MET 157 N 0.56 -0.94 -0.73 0.04 4.05 -1.27 -2.01 114.93 114.64 1xll h MET 157 Ca 0.20 0.06 0.13 0.00 -0.28 0.00 0.00 59.70 59.81 1xll h MET 157 Cb 0.03 0.21 -0.09 0.00 -0.80 0.00 0.00 31.60 30.95 1xll h MET 157 CO -0.10 -0.63 0.28 -0.09 0.23 0.00 0.00 176.91 176.61 1xll h ARG 158 N -0.97 0.42 -0.16 0.39 2.43 -0.04 -1.54 114.38 114.91 1xll h ARG 158 Ca -0.07 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1xll h ARG 158 Cb 0.81 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 1xll h ARG 158 CO 0.04 0.28 -0.07 1.49 -1.51 0.00 0.00 179.97 180.20 1xll h GLU 159 N 0.43 -0.04 0.67 0.20 4.81 -0.42 0.80 114.58 121.04 1xll h GLU 159 Ca 0.40 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.60 1xll h GLU 159 Cb 0.59 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1xll h GLU 159 CO -0.39 -0.03 -0.40 0.78 -0.73 0.00 0.00 179.01 178.24 1xll h GLY 160 N -0.04 -1.16 0.97 1.92 0.00 -0.75 -0.61 103.07 103.40 1xll h GLY 160 Ca 0.09 0.47 0.01 0.00 0.00 0.00 0.00 47.33 47.90 1xll h GLY 160 CO -0.19 -0.40 0.31 -2.08 0.00 0.00 0.00 176.54 174.18 1xll h VAL 161 N -1.00 1.10 -0.15 4.60 2.07 -1.24 -1.91 116.25 119.73 1xll h VAL 161 Ca -0.09 -0.21 -0.12 0.00 0.82 0.00 0.00 66.70 67.10 1xll h VAL 161 Cb 0.80 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1xll h VAL 161 CO 0.10 0.11 -0.41 0.44 0.02 0.00 0.00 177.57 177.83 1xll h ASP 162 N 0.62 0.35 -0.45 0.57 3.32 -0.87 -2.57 116.42 117.39 1xll h ASP 162 Ca 0.18 -0.15 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 1xll h ASP 162 Cb -0.05 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1xll h ASP 162 CO -0.05 0.73 -0.07 0.74 -1.72 0.00 0.00 179.24 178.87 1xll h THR 163 N 0.28 1.26 -0.64 0.35 2.02 -0.64 -1.05 112.91 114.49 1xll h THR 163 Ca 0.02 -1.17 -0.04 0.00 0.77 0.00 0.00 66.41 65.99 1xll h THR 163 Cb 0.85 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 1xll h THR 163 CO 0.07 0.41 0.23 0.00 0.37 0.00 0.00 175.52 176.60 1xll h ALA 164 N 1.10 0.83 -0.13 6.16 0.00 -1.31 -1.66 119.26 124.25 1xll h ALA 164 Ca 0.14 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 1xll h ALA 164 Cb 0.59 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.14 1xll h ALA 164 CO 0.04 0.48 -0.82 0.00 0.00 0.00 0.00 179.25 178.94 1xll h ALA 165 N 1.09 0.28 -0.22 0.00 0.00 -1.34 -2.72 119.26 116.35 1xll h ALA 165 Ca 0.21 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1xll h ALA 165 Cb 0.25 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xll h ALA 165 CO -0.01 0.69 0.10 0.78 0.00 0.00 0.00 179.25 180.80 1xll h GLY 166 N 0.54 0.35 0.62 0.00 0.00 -1.13 -2.03 103.07 101.42 1xll h GLY 166 Ca -0.07 -0.18 0.08 0.00 0.00 0.00 0.00 47.33 47.16 1xll h GLY 166 CO 0.17 0.17 0.53 -1.82 0.00 0.00 0.00 176.54 175.59 1xll h TYR 167 N 0.21 0.97 -0.51 5.60 3.20 -1.31 0.20 116.97 125.32 1xll h TYR 167 Ca 0.07 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1xll h TYR 167 Cb 0.16 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1xll h TYR 167 CO -0.01 0.45 0.27 0.82 -1.64 0.00 0.00 178.16 178.04 1xll h ILE 168 N 0.92 1.18 0.51 1.81 2.04 -1.12 -0.87 117.51 121.97 1xll h ILE 168 Ca 0.40 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1xll h ILE 168 Cb 0.28 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1xll h ILE 168 CO -0.21 0.20 -0.24 0.11 0.00 0.00 0.00 178.15 178.00 1xll h LYS 169 N 0.69 -0.66 -0.72 2.37 1.57 -0.79 -2.01 116.57 117.02 1xll h LYS 169 Ca 0.18 0.04 0.09 0.00 -1.87 0.00 0.00 60.65 59.10 1xll h LYS 169 Cb 0.07 0.15 -0.07 0.00 0.08 0.00 0.00 32.23 32.46 1xll h LYS 169 CO -0.03 -0.37 0.36 -0.44 -0.57 0.00 0.00 179.45 178.41 1xll h ASP 170 N -0.86 0.48 1.03 0.86 3.32 -0.40 -2.33 116.42 118.52 1xll h ASP 170 Ca -0.07 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1xll h ASP 170 Cb 0.59 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1xll h ASP 170 CO 0.11 0.28 0.00 0.29 -1.72 0.00 0.00 179.24 178.20 1xll n LYS 171 N -4.85 0.17 -1.12 3.56 4.76 -0.35 -4.94 118.16 115.38 1xll n LYS 171 Ca 0.11 0.25 -0.04 0.00 -2.87 0.00 0.00 58.31 55.76 1xll n LYS 171 Cb 0.27 -1.74 -0.02 0.00 -1.84 0.00 0.00 35.03 31.70 1xll n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xll n GLY 172 N 0.74 0.70 3.77 0.72 0.00 -0.78 -5.02 105.19 105.32 1xll n GLY 172 Ca 0.04 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 1xll n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xll s TYR 173 N -2.07 3.17 -1.34 1.61 2.02 -1.03 -4.95 117.35 114.76 1xll s TYR 173 Ca 0.00 1.51 -0.10 0.00 -0.37 0.00 0.00 57.07 58.11 1xll s TYR 173 Cb 0.00 -3.54 0.12 0.00 -0.40 0.00 0.00 41.96 38.14 1xll s TYR 173 CO 0.00 -1.46 2.05 0.09 -1.57 0.00 0.00 175.55 174.66 1xll n ASN 174 N 0.76 5.20 -4.07 2.29 5.03 -1.26 -4.77 115.26 118.43 1xll n ASN 174 Ca 0.01 -3.03 -0.20 0.00 0.87 0.00 0.00 54.58 52.23 1xll n ASN 174 Cb 0.43 -1.51 -0.14 0.00 -1.02 0.00 0.00 39.78 37.53 1xll n ASN 174 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1xll s LEU 175 N 0.25 2.05 -0.02 3.41 1.43 -1.26 -4.32 118.68 120.22 1xll s LEU 175 Ca 0.44 -0.25 0.06 0.00 -1.03 0.00 0.00 54.13 53.34 1xll s LEU 175 Cb 0.12 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.77 1xll s LEU 175 CO -0.03 0.11 -0.19 -0.13 0.23 0.00 0.00 176.35 176.34 1xll s ARG 176 N -0.45 1.61 -0.07 1.70 0.52 -1.04 -4.97 118.95 116.24 1xll s ARG 176 Ca 0.03 -0.67 -0.18 0.00 -0.52 0.00 0.00 55.73 54.39 1xll s ARG 176 Cb -0.05 -1.51 -0.05 0.00 0.52 0.00 0.00 34.95 33.86 1xll s ARG 176 CO -0.00 0.38 0.50 0.42 0.02 0.00 0.00 175.30 176.61 1xll s ILE 177 N -0.35 5.09 -0.15 1.52 1.01 -0.56 -0.36 121.20 127.40 1xll s ILE 177 Ca 0.05 1.01 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1xll s ILE 177 Cb -0.08 -3.83 0.02 0.00 0.01 0.00 0.00 42.46 38.58 1xll s ILE 177 CO -0.00 0.39 -0.13 0.00 0.00 0.00 0.00 174.94 175.20 1xll s ALA 178 N 0.14 1.84 0.19 9.38 0.00 0.10 -0.49 121.76 132.93 1xll s ALA 178 Ca 0.27 -0.92 -0.20 0.00 0.00 0.00 0.00 51.96 51.11 1xll s ALA 178 Cb -0.16 -1.07 -0.08 0.00 0.00 0.00 0.00 23.12 21.81 1xll s ALA 178 CO 0.13 -0.44 0.70 -0.51 0.00 0.00 0.00 175.76 175.64 1xll s LEU 179 N 1.49 4.39 -0.24 0.00 1.43 0.14 -1.27 118.68 124.63 1xll s LEU 179 Ca 0.04 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.57 1xll s LEU 179 Cb -0.13 -3.46 0.05 0.00 0.03 0.00 0.00 46.19 42.68 1xll s LEU 179 CO -0.10 0.08 -0.12 -0.70 0.23 0.00 0.00 176.35 175.74 1xll s GLU 180 N -1.78 2.26 0.52 1.70 2.12 -0.16 -0.39 118.70 122.97 1xll s GLU 180 Ca 0.40 -1.16 -0.17 0.00 0.36 0.00 0.00 54.97 54.40 1xll s GLU 180 Cb -0.18 -2.74 -0.07 0.00 0.26 0.00 0.00 34.13 31.40 1xll s GLU 180 CO 0.21 -0.50 1.01 -2.14 -0.54 0.00 0.00 175.26 173.30 1xll s PRO 181 N 1.21 3.80 -0.28 4.30 0.02 -1.26 -4.37 135.00 138.40 1xll s PRO 181 Ca -0.05 1.09 -0.16 0.00 0.02 0.00 0.00 61.00 61.90 1xll s PRO 181 Cb -0.18 -2.11 0.11 0.00 0.02 0.00 0.00 34.50 32.34 1xll s PRO 181 CO -0.07 -0.41 0.81 0.21 -0.33 0.00 0.00 177.00 177.21 1xll s LYS 182 N -3.86 0.58 0.12 5.54 2.20 -1.23 -4.65 119.74 118.44 1xll s LYS 182 Ca 0.62 0.99 -0.00 0.00 -0.36 0.00 0.00 55.97 57.22 1xll s LYS 182 Cb -0.12 0.12 -0.17 0.00 -1.51 0.00 0.00 37.83 36.15 1xll s LYS 182 CO 0.29 -0.12 1.25 -1.00 -0.36 0.00 0.00 175.35 175.41 1xll h PRO 183 N 6.59 0.21 -3.24 4.03 0.13 -1.73 -3.38 132.00 134.61 1xll h PRO 183 Ca -0.29 -0.30 0.02 0.00 -0.87 0.00 0.00 66.00 64.55 1xll h PRO 183 Cb 1.21 0.10 -0.06 0.00 0.13 0.00 0.00 31.00 32.39 1xll h PRO 183 CO 0.17 1.09 0.11 0.54 -0.23 0.00 0.00 178.00 179.68 1xll s ASN 184 N -7.00 -0.18 0.06 1.44 4.22 -1.26 -1.34 114.94 110.88 1xll s ASN 184 Ca -0.03 -0.75 0.00 0.00 -2.14 0.00 0.00 52.86 49.94 1xll s ASN 184 Cb 0.09 0.68 0.00 0.00 1.28 0.00 0.00 41.25 43.30 1xll s ASN 184 CO 0.85 -1.29 0.00 1.21 -2.04 0.00 0.00 177.10 175.83 1xll n GLU 185 N -0.44 -2.61 0.25 3.55 2.13 -1.26 -4.83 120.64 117.42 1xll n GLU 185 Ca -0.03 2.13 0.14 0.00 0.66 0.00 0.00 57.16 60.05 1xll n GLU 185 Cb 0.60 -2.30 0.54 0.00 0.27 0.00 0.00 31.44 30.56 1xll n GLU 185 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1xll h PRO 186 N 2.07 0.00 -7.15 5.31 0.13 -2.00 -3.49 132.00 126.87 1xll h PRO 186 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 1xll h PRO 186 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 1xll h PRO 186 CO 0.00 0.10 0.26 1.03 -0.23 0.00 0.00 178.00 179.16 1xll s ARG 187 N -3.63 3.48 0.18 0.86 1.81 -1.26 -4.96 118.95 115.43 1xll s ARG 187 Ca 0.01 0.42 -0.11 0.00 -1.72 0.00 0.00 55.73 54.32 1xll s ARG 187 Cb 0.09 -2.23 0.09 0.00 -0.45 0.00 0.00 34.95 32.45 1xll s ARG 187 CO 0.60 -0.44 1.75 0.78 -0.68 0.00 0.00 175.30 177.31 1xll h GLY 188 N -0.07 0.99 -6.55 -3.53 0.00 -1.90 -3.42 103.07 88.60 1xll h GLY 188 Ca -0.46 -0.52 -0.38 0.00 0.00 0.00 0.00 47.33 45.97 1xll h GLY 188 CO 0.62 0.49 -0.76 0.99 0.00 0.00 0.00 176.54 177.88 1xll s ASP 189 N -6.10 0.87 -0.10 0.19 1.01 -0.49 -4.66 116.67 107.39 1xll s ASP 189 Ca -0.13 -0.06 -0.05 0.00 0.71 0.00 0.00 52.55 53.02 1xll s ASP 189 Cb 0.13 -0.33 -0.04 0.00 1.01 0.00 0.00 42.92 43.70 1xll s ASP 189 CO 0.80 -0.12 0.09 -0.63 0.21 0.00 0.00 175.17 175.52 1xll s ILE 190 N 1.27 5.10 0.47 0.77 1.01 -0.45 -1.77 121.20 127.61 1xll s ILE 190 Ca -0.06 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.40 1xll s ILE 190 Cb -0.13 -3.21 -0.07 0.00 0.01 0.00 0.00 42.46 39.06 1xll s ILE 190 CO -0.02 0.61 1.32 -0.36 0.00 0.00 0.00 174.94 176.49 1xll s PHE 191 N -0.99 2.58 -1.00 3.97 0.08 -0.53 -3.36 117.98 118.74 1xll s PHE 191 Ca 0.15 1.39 -0.09 0.00 0.12 0.00 0.00 56.93 58.50 1xll s PHE 191 Cb -0.12 -3.71 -0.03 0.00 -0.57 0.00 0.00 43.02 38.59 1xll s PHE 191 CO 0.04 -2.42 0.82 1.28 -0.10 0.00 0.00 175.22 174.84 1xll n LEU 192 N -0.43 -4.90 0.28 -0.37 4.77 -1.26 -4.86 117.00 110.23 1xll n LEU 192 Ca 0.07 -0.68 0.17 0.00 -0.03 0.00 0.00 56.01 55.54 1xll n LEU 192 Cb 0.44 -2.92 0.81 0.00 -2.33 0.00 0.00 43.42 39.43 1xll n LEU 192 CO 0.54 -0.04 1.02 1.55 -1.33 0.00 0.00 177.39 179.14 1xll h PRO 193 N -0.95 0.00 -4.76 3.23 0.13 -1.74 -3.38 132.00 124.53 1xll h PRO 193 Ca -0.50 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.28 1xll h PRO 193 Cb 1.26 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.25 1xll h PRO 193 CO 0.42 0.05 -0.57 0.95 -0.23 0.00 0.00 178.00 178.62 1xll s THR 194 N -3.93 0.12 0.25 1.56 -4.23 -1.26 -2.40 115.64 105.74 1xll s THR 194 Ca -0.02 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.46 1xll s THR 194 Cb 0.11 -2.51 0.22 0.00 1.34 0.00 0.00 72.50 71.66 1xll s THR 194 CO 0.53 0.00 1.73 0.58 -0.54 0.00 0.00 174.62 176.92 1xll h VAL 195 N 2.38 0.66 -0.03 2.29 2.07 -1.94 -1.89 116.25 119.79 1xll h VAL 195 Ca -0.33 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.07 1xll h VAL 195 Cb 1.25 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.13 1xll h VAL 195 CO 0.49 0.08 -0.47 1.23 0.02 0.00 0.00 177.57 178.92 1xll h GLY 196 N 0.45 -0.90 0.94 2.17 0.00 -1.96 0.14 103.07 103.90 1xll h GLY 196 Ca 0.42 0.58 0.02 0.00 0.00 0.00 0.00 47.33 48.34 1xll h GLY 196 CO -0.40 -0.24 0.53 0.45 0.00 0.00 0.00 176.54 176.88 1xll h HIS 197 N -0.60 1.00 0.03 5.60 -0.00 -1.81 -1.91 115.15 117.46 1xll h HIS 197 Ca 0.04 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 1xll h HIS 197 Cb 0.68 -0.33 -0.01 0.00 -0.00 0.00 0.00 27.41 27.75 1xll h HIS 197 CO -0.48 0.60 -0.04 0.78 -0.00 0.00 0.00 177.93 178.79 1xll h GLY 198 N 1.05 -0.07 0.63 2.45 0.00 -0.93 -1.75 103.07 104.44 1xll h GLY 198 Ca 0.31 0.05 0.07 0.00 0.00 0.00 0.00 47.33 47.77 1xll h GLY 198 CO -0.09 -0.05 0.45 1.41 0.00 0.00 0.00 176.54 178.26 1xll h LEU 199 N -0.09 0.67 0.02 3.11 3.38 -0.46 -2.37 115.31 119.57 1xll h LEU 199 Ca 0.01 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1xll h LEU 199 Cb 0.10 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1xll h LEU 199 CO -0.02 0.41 -0.10 0.00 0.09 0.00 0.00 178.44 178.82 1xll h ALA 200 N 1.41 -0.13 -0.50 1.53 0.00 -1.16 -3.09 119.26 117.32 1xll h ALA 200 Ca 0.36 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.34 1xll h ALA 200 Cb 0.25 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1xll h ALA 200 CO -0.21 -0.60 0.17 0.35 0.00 0.00 0.00 179.25 178.97 1xll h PHE 201 N -0.18 0.31 -0.74 0.00 3.57 -1.06 -1.94 116.94 116.89 1xll h PHE 201 Ca 0.03 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.70 1xll h PHE 201 Cb 0.21 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.79 1xll h PHE 201 CO -0.15 0.10 0.25 0.82 -2.23 0.00 0.00 178.31 177.10 1xll h ILE 202 N 0.35 0.60 0.00 1.41 2.04 -1.35 -1.28 117.51 119.28 1xll h ILE 202 Ca 0.24 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1xll h ILE 202 Cb 0.26 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1xll h ILE 202 CO -0.25 0.07 0.00 -0.62 0.00 0.00 0.00 178.15 177.35 1xll n GLU 203 N -5.06 0.06 0.00 2.37 -0.58 -0.73 -1.32 120.64 115.38 1xll n GLU 203 Ca 0.14 0.53 0.11 0.00 -0.42 0.00 0.00 57.16 57.52 1xll n GLU 203 Cb 0.43 -1.68 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 1xll n GLU 203 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xll n GLN 204 N -1.80 0.88 -2.83 3.49 1.13 -0.49 -4.97 117.38 112.79 1xll n GLN 204 Ca -0.00 -0.73 -0.36 0.00 -1.94 0.00 0.00 57.00 53.97 1xll n GLN 204 Cb 0.03 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 28.84 1xll n GLN 204 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xll s LEU 205 N -2.62 4.30 0.13 1.08 1.43 -0.43 -4.98 118.68 117.59 1xll s LEU 205 Ca 0.16 1.76 -0.15 0.00 -1.03 0.00 0.00 54.13 54.87 1xll s LEU 205 Cb 0.18 -4.01 -0.01 0.00 0.03 0.00 0.00 46.19 42.38 1xll s LEU 205 CO 0.65 -0.08 1.60 -0.08 0.23 0.00 0.00 176.35 178.67 1xll h GLU 206 N 3.08 0.68 -1.53 1.70 4.81 -1.93 -3.25 114.58 118.14 1xll h GLU 206 Ca -0.47 -0.19 -0.65 0.00 -0.13 0.00 0.00 59.36 57.92 1xll h GLU 206 Cb 1.19 -0.08 -0.36 0.00 0.63 0.00 0.00 28.75 30.13 1xll h GLU 206 CO 0.65 0.73 0.01 0.72 -0.73 0.00 0.00 179.01 180.38 1xll n HIS 207 N -4.50 3.17 0.39 0.92 8.25 -1.26 -4.84 115.22 117.36 1xll n HIS 207 Ca -0.00 -2.73 0.10 0.00 -0.26 0.00 0.00 57.72 54.82 1xll n HIS 207 Cb 0.24 -0.61 0.41 0.00 1.12 0.00 0.00 29.99 31.15 1xll n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xll n GLY 208 N -0.57 -1.11 0.25 -1.41 0.00 -1.23 -3.17 105.19 97.95 1xll n GLY 208 Ca 0.47 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.64 1xll n GLY 208 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xll h ASP 209 N 0.00 0.00 -0.28 1.61 2.03 -1.90 -2.33 116.42 115.55 1xll h ASP 209 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1xll h ASP 209 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 1xll h ASP 209 CO 0.00 0.13 0.00 2.30 -1.03 0.00 0.00 179.24 180.64 1xll n ILE 210 N -3.93 2.11 -4.67 4.15 -5.35 -1.19 -4.95 119.36 105.54 1xll n ILE 210 Ca -0.02 -1.75 -0.32 0.00 -0.27 0.00 0.00 62.75 60.39 1xll n ILE 210 Cb 0.22 -0.15 -0.17 0.00 -1.74 0.00 0.00 39.64 37.81 1xll n ILE 210 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xll s VAL 211 N -2.56 2.05 0.00 7.28 1.01 -0.88 -1.50 120.40 125.80 1xll s VAL 211 Ca 0.40 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1xll s VAL 211 Cb 0.31 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.88 1xll s VAL 211 CO 0.10 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.36 1xll n GLY 212 N 4.07 3.99 3.77 4.51 0.00 0.36 -4.92 105.19 116.97 1xll n GLY 212 Ca -0.20 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.26 1xll n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xll s LEU 213 N 0.00 3.56 -0.44 0.99 2.01 0.82 -0.68 118.68 124.93 1xll s LEU 213 Ca 0.00 -0.45 0.06 0.00 0.01 0.00 0.00 54.13 53.75 1xll s LEU 213 Cb 0.00 -2.09 0.20 0.00 0.01 0.00 0.00 46.19 44.31 1xll s LEU 213 CO 0.00 -0.10 0.44 -3.20 1.01 0.00 0.00 176.35 174.50 1xll n ASN 214 N -1.12 0.30 -4.78 2.29 5.15 0.48 -2.51 115.26 115.07 1xll n ASN 214 Ca -0.06 -2.62 -0.37 0.00 -0.60 0.00 0.00 54.58 50.93 1xll n ASN 214 Cb 0.59 -0.61 -0.04 0.00 -0.53 0.00 0.00 39.78 39.19 1xll n ASN 214 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1xll s PRO 215 N -0.65 4.23 -0.07 1.20 0.02 -1.26 -4.29 135.00 134.18 1xll s PRO 215 Ca 0.33 1.53 0.05 0.00 0.02 0.00 0.00 61.00 62.93 1xll s PRO 215 Cb 0.08 -2.61 -0.01 0.00 0.02 0.00 0.00 34.50 31.98 1xll s PRO 215 CO -0.16 -0.09 -0.23 -2.00 -0.33 0.00 0.00 177.00 174.20 1xll s GLU 216 N -2.38 2.71 0.14 5.54 2.12 -1.26 -1.21 118.70 124.35 1xll s GLU 216 Ca 0.56 -0.87 -0.24 0.00 0.36 0.00 0.00 54.97 54.78 1xll s GLU 216 Cb -0.23 -2.24 -0.01 0.00 0.26 0.00 0.00 34.13 31.91 1xll s GLU 216 CO 0.28 0.35 1.63 1.15 -0.54 0.00 0.00 175.26 178.13 1xll h THR 217 N 5.15 0.38 -0.12 -1.70 2.02 -1.76 -2.64 112.91 114.24 1xll h THR 217 Ca -0.30 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 1xll h THR 217 Cb 1.19 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 1xll h THR 217 CO 0.48 0.00 -0.46 1.23 0.37 0.00 0.00 175.52 177.14 1xll h GLY 218 N -0.33 0.32 0.96 2.16 0.00 -1.88 -3.07 103.07 101.23 1xll h GLY 218 Ca 0.10 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1xll h GLY 218 CO -0.33 0.30 0.05 0.45 0.00 0.00 0.00 176.54 177.00 1xll h HIS 219 N 0.24 0.10 -0.10 5.60 3.86 -1.81 -1.98 115.15 121.06 1xll h HIS 219 Ca 0.02 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 1xll h HIS 219 Cb 0.91 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.33 1xll h HIS 219 CO 0.02 0.11 -0.22 0.93 0.86 0.00 0.00 177.93 179.64 1xll h GLU 220 N 0.06 0.17 0.00 2.45 4.39 -1.54 -2.73 114.58 117.39 1xll h GLU 220 Ca 0.03 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1xll h GLU 220 Cb 0.04 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1xll h GLU 220 CO -0.01 0.39 0.00 1.96 -1.16 0.00 0.00 179.01 180.19 1xll h GLN 221 N 0.16 0.00 0.00 2.33 4.20 -1.38 -2.20 115.11 118.22 1xll h GLN 221 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1xll h GLN 221 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1xll h GLN 221 CO 0.03 0.00 0.00 0.52 -0.67 0.00 0.00 178.83 178.71 1xll h MET 222 N 0.00 0.00 -0.15 1.46 2.86 -1.03 -2.00 114.93 116.06 1xll h MET 222 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xll h MET 222 Cb 0.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1xll h MET 222 CO 0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 1xll n ALA 223 N -1.83 2.35 -1.91 6.32 0.00 -1.20 -4.63 120.51 119.61 1xll n ALA 223 Ca 0.01 -0.82 -0.13 0.00 0.00 0.00 0.00 53.44 52.50 1xll n ALA 223 Cb 0.22 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.26 1xll n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xll n GLY 224 N 0.54 0.45 3.95 0.00 0.00 -0.75 -5.02 105.19 104.36 1xll n GLY 224 Ca 0.08 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 1xll n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xll s LEU 225 N -3.51 2.96 -0.40 0.99 1.43 -0.83 -4.97 118.68 114.36 1xll s LEU 225 Ca 0.00 0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 53.11 1xll s LEU 225 Cb 0.00 -2.84 0.01 0.00 0.03 0.00 0.00 46.19 43.39 1xll s LEU 225 CO 0.00 -1.57 0.51 0.21 0.23 0.00 0.00 176.35 175.73 1xll s ASN 226 N -4.54 6.26 0.20 2.29 3.84 -1.26 -4.33 114.94 117.40 1xll s ASN 226 Ca 0.61 -0.37 -0.10 0.00 0.21 0.00 0.00 52.86 53.21 1xll s ASN 226 Cb -0.09 -2.26 0.24 0.00 -0.55 0.00 0.00 41.25 38.58 1xll s ASN 226 CO 0.43 -0.58 1.76 0.15 -2.79 0.00 0.00 177.10 176.07 1xll h PHE 227 N 8.67 0.43 -0.89 0.43 3.57 -1.91 -0.97 116.94 126.28 1xll h PHE 227 Ca -0.27 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.36 1xll h PHE 227 Cb 1.11 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 39.67 1xll h PHE 227 CO 0.68 0.15 0.53 1.15 -2.23 0.00 0.00 178.31 178.59 1xll h THR 228 N 0.45 0.93 -0.37 4.41 2.02 -1.92 -0.84 112.91 117.58 1xll h THR 228 Ca 0.28 -0.30 -0.13 0.00 0.77 0.00 0.00 66.41 67.03 1xll h THR 228 Cb 0.30 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 1xll h THR 228 CO -0.26 0.16 -0.29 0.45 0.37 0.00 0.00 175.52 175.96 1xll h HIS 229 N 0.89 1.01 -0.30 3.16 3.86 -1.62 -2.91 115.15 119.23 1xll h HIS 229 Ca 0.42 -0.28 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 1xll h HIS 229 Cb 0.37 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1xll h HIS 229 CO -0.04 1.07 0.15 0.78 0.86 0.00 0.00 177.93 180.75 1xll h GLY 230 N 0.66 0.46 2.00 2.45 0.00 -0.92 -1.65 103.07 106.07 1xll h GLY 230 Ca 0.07 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1xll h GLY 230 CO 0.08 0.22 -0.27 0.16 0.00 0.00 0.00 176.54 176.73 1xll h ILE 231 N 0.35 0.64 -0.42 2.60 3.07 -1.22 -2.10 117.51 120.43 1xll h ILE 231 Ca 0.10 -1.24 -0.12 0.00 1.55 0.00 0.00 64.86 65.15 1xll h ILE 231 Cb 0.11 1.82 -0.01 0.00 -0.27 0.00 0.00 36.82 38.47 1xll h ILE 231 CO -0.01 0.26 -0.21 0.00 -1.05 0.00 0.00 178.15 177.14 1xll h ALA 232 N 1.73 0.84 -0.07 0.16 0.00 -1.28 0.31 119.26 120.95 1xll h ALA 232 Ca -0.00 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.32 1xll h ALA 232 Cb 0.80 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1xll h ALA 232 CO 0.03 0.64 -0.83 0.37 0.00 0.00 0.00 179.25 179.46 1xll h GLN 233 N 0.73 0.57 -0.17 0.00 4.15 -0.99 -1.53 115.11 117.86 1xll h GLN 233 Ca 0.10 -0.51 -0.02 0.00 0.77 0.00 0.00 58.65 58.99 1xll h GLN 233 Cb 0.74 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.54 1xll h GLN 233 CO 0.06 1.14 0.05 0.00 -1.93 0.00 0.00 178.83 178.14 1xll h ALA 234 N 0.70 0.22 -0.32 3.38 0.00 -0.86 -2.10 119.26 120.28 1xll h ALA 234 Ca -0.06 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1xll h ALA 234 Cb 1.45 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1xll h ALA 234 CO 0.16 -0.14 0.16 -0.07 0.00 0.00 0.00 179.25 179.35 1xll h LEU 235 N 0.09 0.24 -1.03 0.00 3.38 -0.41 0.17 115.31 117.75 1xll h LEU 235 Ca 0.05 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.09 1xll h LEU 235 Cb 0.24 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 1xll h LEU 235 CO -0.00 0.18 0.65 -0.25 0.09 0.00 0.00 178.44 179.10 1xll h TRP 236 N 0.33 1.20 -0.07 1.13 7.01 -1.13 0.60 115.95 125.02 1xll h TRP 236 Ca 0.13 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.16 1xll h TRP 236 Cb 0.05 -0.40 0.00 0.00 -2.10 0.00 0.00 29.16 26.71 1xll h TRP 236 CO -0.10 0.65 0.00 0.00 -2.79 0.00 0.00 178.44 176.20 1xll n ALA 237 N -2.37 2.57 -3.51 2.65 0.00 -0.80 -4.92 120.51 114.13 1xll n ALA 237 Ca 0.15 -0.39 -0.20 0.00 0.00 0.00 0.00 53.44 52.99 1xll n ALA 237 Cb 0.15 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.46 1xll n ALA 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xll n GLU 238 N -0.07 -3.84 -0.30 0.00 1.02 0.20 -4.92 120.64 112.74 1xll n GLU 238 Ca 0.18 0.71 0.03 0.00 -0.02 0.00 0.00 57.16 58.06 1xll n GLU 238 Cb 0.26 -5.34 0.04 0.00 -0.02 0.00 0.00 31.44 26.39 1xll n GLU 238 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xll n LYS 239 N -3.92 0.51 -2.94 3.49 4.76 0.56 -4.95 118.16 115.68 1xll n LYS 239 Ca -0.19 -1.39 -0.44 0.00 -2.87 0.00 0.00 58.31 53.41 1xll n LYS 239 Cb 0.64 -0.80 -0.01 0.00 -1.84 0.00 0.00 35.03 33.03 1xll n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xll s LEU 240 N -0.83 5.06 0.21 -0.35 2.96 -1.22 -0.13 118.68 124.38 1xll s LEU 240 Ca 0.09 -2.78 0.12 0.00 -0.22 0.00 0.00 54.13 51.34 1xll s LEU 240 Cb 0.08 -2.40 -0.06 0.00 0.50 0.00 0.00 46.19 44.31 1xll s LEU 240 CO 0.01 -0.82 1.36 -0.26 -1.32 0.00 0.00 176.35 175.32 1xll h PHE 241 N 7.55 0.00 -2.95 5.38 -1.00 -1.86 -3.47 116.94 120.59 1xll h PHE 241 Ca 0.28 0.00 0.07 0.00 2.81 0.00 0.00 57.97 61.13 1xll h PHE 241 Cb 0.91 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.42 1xll h PHE 241 CO 1.12 0.72 0.25 -1.58 -1.61 0.00 0.00 178.31 177.21 1xll s HIS 242 N -2.85 -0.16 -0.19 -0.55 2.46 -1.04 -4.83 115.29 108.13 1xll s HIS 242 Ca 0.03 -0.31 -0.18 0.00 0.47 0.00 0.00 55.06 55.06 1xll s HIS 242 Cb 0.09 0.72 0.05 0.00 -0.13 0.00 0.00 32.58 33.30 1xll s HIS 242 CO 0.78 -1.24 0.52 -1.50 -2.47 0.00 0.00 174.74 170.83 1xll s ILE 243 N -3.73 0.00 -0.20 0.89 2.07 -1.26 -4.04 121.20 114.92 1xll s ILE 243 Ca 0.12 -0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.32 1xll s ILE 243 Cb -0.06 -0.73 -0.00 0.00 0.13 0.00 0.00 42.46 41.80 1xll s ILE 243 CO 0.07 -0.01 -0.08 -1.81 -1.91 0.00 0.00 174.94 171.21 1xll s ASP 244 N 0.21 4.07 -0.05 4.50 1.11 -0.35 -3.40 116.67 122.76 1xll s ASP 244 Ca -0.01 -0.43 0.02 0.00 0.18 0.00 0.00 52.55 52.31 1xll s ASP 244 Cb -0.04 -1.68 -0.03 0.00 1.07 0.00 0.00 42.92 42.24 1xll s ASP 244 CO 0.01 0.00 -0.09 -0.76 1.18 0.00 0.00 175.17 175.51 1xll s LEU 245 N 1.34 3.06 0.00 1.23 1.43 0.72 -2.22 118.68 124.24 1xll s LEU 245 Ca 0.04 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1xll s LEU 245 Cb -0.14 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1xll s LEU 245 CO -0.04 0.34 0.00 -0.46 0.23 0.00 0.00 176.35 176.42 1xll n ASN 246 N 2.09 0.00 -4.12 2.29 0.23 -1.26 -3.06 115.26 111.43 1xll n ASN 246 Ca -0.17 -0.85 -0.16 0.00 -0.53 0.00 0.00 54.58 52.87 1xll n ASN 246 Cb 0.53 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.11 1xll n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1xll s GLY 247 N -1.85 0.68 -0.03 4.83 0.00 0.03 -4.34 107.32 106.65 1xll s GLY 247 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.84 1xll s GLY 247 CO 0.00 -0.91 0.06 1.62 0.00 0.00 0.00 173.10 173.86 1xll s GLN 248 N -1.63 -0.01 -0.83 2.90 2.00 -1.26 -0.73 119.66 120.10 1xll s GLN 248 Ca -0.06 0.22 0.01 0.00 -2.00 0.00 0.00 55.36 53.53 1xll s GLN 248 Cb -0.10 -0.21 0.25 0.00 0.80 0.00 0.00 33.01 33.75 1xll s GLN 248 CO 0.01 -0.16 0.94 0.54 -0.50 0.00 0.00 175.29 176.12 1xll n ARG 249 N 4.11 3.03 0.00 1.67 1.74 -1.26 -3.37 116.66 122.58 1xll n ARG 249 Ca -0.26 -4.59 0.00 0.00 -0.77 0.00 0.00 57.85 52.23 1xll n ARG 249 Cb 0.51 -2.37 0.00 0.00 -1.02 0.00 0.00 32.46 29.58 1xll n ARG 249 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xll n GLY 250 N 1.41 1.02 3.50 -0.13 0.00 -1.26 -4.91 105.19 104.81 1xll n GLY 250 Ca 0.26 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 1xll n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xll s ILE 251 N -1.33 4.29 0.00 -0.61 1.01 -1.26 -4.54 121.20 118.76 1xll s ILE 251 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.71 1xll s ILE 251 Cb 0.00 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.83 1xll s ILE 251 CO 0.00 -1.33 0.00 2.29 0.00 0.00 0.00 174.94 175.90 1xll n LYS 252 N 7.77 0.00 -0.75 2.79 2.85 -1.26 -5.09 118.16 124.47 1xll n LYS 252 Ca -0.00 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.94 1xll n LYS 252 Cb 0.47 0.00 0.14 0.00 -0.65 0.00 0.00 35.03 34.99 1xll n LYS 252 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1xll n TYR 253 N 0.00 -0.86 -2.25 5.58 4.11 -1.26 -4.86 117.16 117.62 1xll n TYR 253 Ca 0.00 0.26 -0.41 0.00 -0.00 0.00 0.00 57.90 57.76 1xll n TYR 253 Cb 0.00 -1.83 -0.03 0.00 -0.00 0.00 0.00 39.34 37.48 1xll n TYR 253 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1xll s ASP 254 N -2.18 5.80 0.02 9.48 2.15 -1.26 -4.86 116.67 125.83 1xll s ASP 254 Ca 0.60 0.31 -0.20 0.00 0.43 0.00 0.00 52.55 53.68 1xll s ASP 254 Cb -0.21 -2.54 -0.18 0.00 -0.30 0.00 0.00 42.92 39.69 1xll s ASP 254 CO 0.65 -1.96 1.23 1.56 -0.17 0.00 0.00 175.17 176.47 1xll h GLN 255 N 12.49 0.37 -5.66 4.34 4.20 -1.89 -3.49 115.11 125.48 1xll h GLN 255 Ca -0.27 -0.28 -0.33 0.00 0.06 0.00 0.00 58.65 57.83 1xll h GLN 255 Cb 1.12 0.05 0.16 0.00 0.30 0.00 0.00 27.48 29.11 1xll h GLN 255 CO 1.19 0.90 -0.78 -0.25 -0.67 0.00 0.00 178.83 179.22 1xll n ASP 256 N -4.42 -2.44 -4.76 1.46 8.00 -1.22 -4.62 116.55 108.55 1xll n ASP 256 Ca -0.08 -0.64 -0.29 0.00 0.71 0.00 0.00 54.79 54.49 1xll n ASP 256 Cb 0.49 -5.06 0.11 0.00 -0.02 0.00 0.00 41.12 36.64 1xll n ASP 256 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xll s LEU 257 N -6.29 2.54 0.41 0.64 1.43 0.09 -0.19 118.68 117.31 1xll s LEU 257 Ca 0.05 0.68 -0.26 0.00 -1.03 0.00 0.00 54.13 53.57 1xll s LEU 257 Cb -0.01 -3.09 -0.09 0.00 0.03 0.00 0.00 46.19 43.03 1xll s LEU 257 CO 0.74 -2.06 1.41 -0.69 0.23 0.00 0.00 176.35 175.98 1xll s VAL 258 N -3.64 2.21 0.14 -1.59 1.01 -1.26 -0.79 120.40 116.48 1xll s VAL 258 Ca 0.64 0.20 -0.34 0.00 0.00 0.00 0.00 61.98 62.48 1xll s VAL 258 Cb -0.10 -3.12 -0.13 0.00 0.00 0.00 0.00 36.38 33.03 1xll s VAL 258 CO 0.50 0.04 1.63 0.33 0.00 0.00 0.00 175.10 177.59 1xll n PHE 259 N 0.13 2.33 0.00 5.22 7.35 -1.26 -0.67 117.46 130.56 1xll n PHE 259 Ca 0.03 0.20 0.00 0.00 -0.76 0.00 0.00 57.45 56.93 1xll n PHE 259 Cb 0.41 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.67 1xll n PHE 259 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xll n GLY 260 N 3.59 0.95 0.19 7.13 0.00 -1.26 -4.71 105.19 111.08 1xll n GLY 260 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 1xll n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xll n HIS 261 N -2.00 0.00 0.00 1.61 8.25 0.15 -4.53 115.22 118.71 1xll n HIS 261 Ca 0.00 -0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1xll n HIS 261 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1xll n HIS 261 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xll n GLY 262 N 1.07 1.17 3.52 -1.41 0.00 -1.26 -4.82 105.19 103.46 1xll n GLY 262 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1xll n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xll s ASP 263 N 0.25 6.37 0.05 1.61 -1.08 -1.22 -4.91 116.67 117.74 1xll s ASP 263 Ca 0.00 -0.29 -0.28 0.00 -0.52 0.00 0.00 52.55 51.46 1xll s ASP 263 Cb 0.00 -2.41 -0.17 0.00 -1.46 0.00 0.00 42.92 38.88 1xll s ASP 263 CO 0.00 -1.08 1.48 0.25 0.52 0.00 0.00 175.17 176.35 1xll h LEU 264 N 10.54 -0.51 -0.59 -1.34 5.85 -1.95 -1.04 115.31 126.27 1xll h LEU 264 Ca -0.26 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.44 1xll h LEU 264 Cb 1.08 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1xll h LEU 264 CO 1.03 -0.27 0.36 0.74 -0.34 0.00 0.00 178.44 179.96 1xll h THR 265 N -0.74 1.08 -0.39 1.05 2.02 -1.96 0.17 112.91 114.14 1xll h THR 265 Ca -0.06 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 1xll h THR 265 Cb 0.53 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1xll h THR 265 CO 0.10 0.13 0.21 -1.28 0.37 0.00 0.00 175.52 175.05 1xll h SER 266 N 0.72 0.49 -0.44 4.18 0.87 -1.96 -2.01 113.55 115.40 1xll h SER 266 Ca 0.23 -0.10 0.08 0.00 -1.23 0.00 0.00 61.79 60.78 1xll h SER 266 Cb 0.01 -0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 61.77 1xll h SER 266 CO -0.09 0.45 0.02 0.00 -0.53 0.00 0.00 176.83 176.68 1xll h ALA 267 N 1.06 0.43 -0.16 6.23 0.00 0.19 -1.26 119.26 125.76 1xll h ALA 267 Ca 0.14 0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.22 1xll h ALA 267 Cb 0.07 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1xll h ALA 267 CO -0.02 -0.37 -0.23 0.35 0.00 0.00 0.00 179.25 178.98 1xll h PHE 268 N 0.14 -0.60 -0.14 0.00 3.57 -0.42 0.50 116.94 119.99 1xll h PHE 268 Ca 0.22 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 1xll h PHE 268 Cb 0.31 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1xll h PHE 268 CO -0.27 -0.31 -0.19 0.74 -2.23 0.00 0.00 178.31 176.05 1xll h PHE 269 N -0.27 0.26 -0.14 0.41 0.04 -1.14 -0.65 116.94 115.44 1xll h PHE 269 Ca 0.11 -0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.78 1xll h PHE 269 Cb 0.44 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.52 1xll h PHE 269 CO -0.34 0.43 -0.17 1.15 -0.60 0.00 0.00 178.31 178.77 1xll h THR 270 N 0.22 1.35 -0.62 -1.55 2.02 -0.34 -2.51 112.91 111.49 1xll h THR 270 Ca 0.04 -1.36 0.02 0.00 0.77 0.00 0.00 66.41 65.88 1xll h THR 270 Cb 0.48 1.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.76 1xll h THR 270 CO 0.03 0.40 0.40 0.58 0.37 0.00 0.00 175.52 177.30 1xll h VAL 271 N -0.01 1.11 -0.93 3.16 2.07 -0.68 -0.34 116.25 120.63 1xll h VAL 271 Ca 0.02 -0.27 0.08 0.00 0.82 0.00 0.00 66.70 67.35 1xll h VAL 271 Cb 0.72 0.25 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 1xll h VAL 271 CO 0.04 0.14 0.58 -0.78 0.02 0.00 0.00 177.57 177.57 1xll h ASP 272 N 0.79 0.89 0.12 0.57 3.58 -1.07 0.19 116.42 121.49 1xll h ASP 272 Ca 0.24 0.03 -0.18 0.00 0.42 0.00 0.00 57.03 57.54 1xll h ASP 272 Cb -0.03 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 40.86 1xll h ASP 272 CO -0.08 0.53 -0.66 0.25 -2.88 0.00 0.00 179.24 176.40 1xll h LEU 273 N 1.00 0.59 -0.08 2.28 7.12 -0.97 0.47 115.31 125.73 1xll h LEU 273 Ca 0.42 -0.35 -0.17 0.00 0.13 0.00 0.00 57.88 57.91 1xll h LEU 273 Cb 0.28 -0.17 0.01 0.00 -0.53 0.00 0.00 40.66 40.25 1xll h LEU 273 CO -0.21 1.09 -0.61 -0.07 -0.13 0.00 0.00 178.44 178.51 1xll h LEU 274 N 0.37 0.67 0.00 2.25 3.38 -0.10 -2.85 115.31 119.03 1xll h LEU 274 Ca -0.02 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 57.27 1xll h LEU 274 Cb 1.23 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1xll h LEU 274 CO 0.12 1.24 -0.12 -0.33 0.09 0.00 0.00 178.44 179.44 1xll h GLU 275 N 0.15 0.00 -0.00 1.13 4.39 -0.74 -3.41 114.58 116.09 1xll h GLU 275 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1xll h GLU 275 Cb 1.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1xll h GLU 275 CO 0.12 0.13 -0.21 0.09 -1.16 0.00 0.00 179.01 177.99 1xll n ASN 276 N -4.72 0.29 0.00 1.42 3.02 0.17 -5.06 115.26 110.37 1xll n ASN 276 Ca -0.03 -0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1xll n ASN 276 Cb 0.11 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1xll n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xll n GLY 277 N 1.45 0.19 3.80 7.41 0.00 -1.07 -4.77 105.19 112.20 1xll n GLY 277 Ca 0.08 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.75 1xll n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xll s PHE 278 N 0.00 3.84 0.34 1.61 0.08 -1.26 -4.58 117.98 118.00 1xll s PHE 278 Ca 0.00 1.39 0.14 0.00 0.12 0.00 0.00 56.93 58.58 1xll s PHE 278 Cb 0.00 -2.59 1.08 0.00 -0.57 0.00 0.00 43.02 40.94 1xll s PHE 278 CO 0.00 0.55 1.63 -1.35 -0.10 0.00 0.00 175.22 175.96 1xll h PRO 279 N 4.52 0.20 -0.74 0.24 0.11 -1.97 0.68 132.00 135.04 1xll h PRO 279 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xll h PRO 279 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1xll h PRO 279 CO 0.64 0.13 0.00 0.09 -0.21 0.00 0.00 178.00 178.66 1xll n ASN 280 N -5.16 4.07 0.00 -2.05 3.02 -1.26 -5.05 115.26 108.83 1xll n ASN 280 Ca 0.31 -2.05 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 1xll n ASN 280 Cb 1.00 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 1xll n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xll n GLY 281 N 1.63 1.06 0.00 7.41 0.00 0.24 -5.09 105.19 110.44 1xll n GLY 281 Ca 0.25 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1xll n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xll n GLY 282 N 1.05 0.86 3.68 -0.02 0.00 -1.26 -4.64 105.19 104.86 1xll n GLY 282 Ca 0.00 -1.69 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 1xll n GLY 282 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xll s PRO 283 N -1.48 1.16 0.05 1.61 0.04 -1.26 -4.82 135.00 130.30 1xll s PRO 283 Ca 0.00 1.54 0.06 0.00 0.04 0.00 0.00 61.00 62.64 1xll s PRO 283 Cb 0.00 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 1xll s PRO 283 CO 0.00 -2.52 -0.16 0.15 0.04 0.00 0.00 177.00 174.50 1xll s LYS 284 N -4.62 1.04 -0.04 4.56 -0.14 -1.26 -4.65 119.74 114.63 1xll s LYS 284 Ca 0.67 -0.87 -0.27 0.00 -1.36 0.00 0.00 55.97 54.15 1xll s LYS 284 Cb -0.23 -1.09 -0.03 0.00 -1.68 0.00 0.00 37.83 34.79 1xll s LYS 284 CO 0.57 0.27 0.83 -0.47 -0.76 0.00 0.00 175.35 175.79 1xll s TYR 285 N -0.93 3.61 -0.25 3.18 5.04 -1.26 -5.00 117.35 121.75 1xll s TYR 285 Ca 0.03 1.46 0.07 0.00 -2.44 0.00 0.00 57.07 56.19 1xll s TYR 285 Cb -0.09 -2.96 -0.09 0.00 0.35 0.00 0.00 41.96 39.18 1xll s TYR 285 CO 0.02 0.04 0.27 0.25 -1.34 0.00 0.00 175.55 174.78 1xll n THR 286 N 3.85 0.00 -0.17 4.34 -2.24 -1.26 -4.97 114.28 113.83 1xll n THR 286 Ca 0.02 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1xll n THR 286 Cb 0.51 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1xll n THR 286 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xll n GLY 287 N 1.43 -3.06 3.75 3.38 0.00 -1.26 -4.99 105.19 104.44 1xll n GLY 287 Ca 0.01 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 1xll n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xll s PRO 288 N -2.23 2.76 -0.65 1.61 0.04 -1.26 -4.95 135.00 130.32 1xll s PRO 288 Ca 0.00 1.83 -0.12 0.00 0.04 0.00 0.00 61.00 62.74 1xll s PRO 288 Cb 0.00 -1.90 0.17 0.00 0.04 0.00 0.00 34.50 32.80 1xll s PRO 288 CO 0.00 -1.37 0.57 1.03 0.04 0.00 0.00 177.00 177.26 1xll s ARG 289 N -3.48 3.08 -0.14 4.56 3.00 -0.43 -4.42 118.95 121.11 1xll s ARG 289 Ca 0.77 -2.10 -0.08 0.00 0.00 0.00 0.00 55.73 54.33 1xll s ARG 289 Cb -0.31 -4.21 -0.04 0.00 0.00 0.00 0.00 34.95 30.39 1xll s ARG 289 CO 0.36 -1.27 0.13 -1.58 0.00 0.00 0.00 175.30 172.94 1xll s HIS 290 N 0.82 3.52 -0.36 -0.53 2.46 -1.22 -1.97 115.29 118.01 1xll s HIS 290 Ca 0.11 0.45 -0.09 0.00 0.47 0.00 0.00 55.06 56.00 1xll s HIS 290 Cb -0.21 -2.00 0.04 0.00 -0.13 0.00 0.00 32.58 30.28 1xll s HIS 290 CO -0.03 0.59 0.17 -0.06 -2.47 0.00 0.00 174.74 172.94 1xll s PHE 291 N -0.61 3.26 -0.72 3.88 0.08 -0.49 -0.20 117.98 123.17 1xll s PHE 291 Ca 0.13 -1.20 -0.06 0.00 0.12 0.00 0.00 56.93 55.92 1xll s PHE 291 Cb -0.12 -2.40 0.19 0.00 -0.57 0.00 0.00 43.02 40.12 1xll s PHE 291 CO 0.02 -0.70 0.58 0.34 -0.10 0.00 0.00 175.22 175.37 1xll s ASP 292 N 1.52 5.79 0.30 1.36 2.15 -1.17 -3.91 116.67 122.70 1xll s ASP 292 Ca 0.00 -2.91 0.03 0.00 0.43 0.00 0.00 52.55 50.11 1xll s ASP 292 Cb -0.20 -1.97 -0.04 0.00 -0.30 0.00 0.00 42.92 40.41 1xll s ASP 292 CO 0.05 -0.41 0.15 -0.72 -0.17 0.00 0.00 175.17 174.07 1xll s TYR 293 N -0.15 1.59 -0.06 -5.34 1.13 -1.26 -4.66 117.35 108.60 1xll s TYR 293 Ca 0.18 -1.35 0.00 0.00 -1.41 0.00 0.00 57.07 54.50 1xll s TYR 293 Cb -0.16 -0.86 0.02 0.00 -1.10 0.00 0.00 41.96 39.86 1xll s TYR 293 CO -0.06 -0.50 -0.04 0.15 -2.51 0.00 0.00 175.55 172.59 1xll s LYS 294 N -3.84 0.91 0.11 -3.49 1.02 0.73 -4.37 119.74 110.80 1xll s LYS 294 Ca 0.36 -0.07 -0.31 0.00 0.02 0.00 0.00 55.97 55.96 1xll s LYS 294 Cb 0.05 -1.02 -0.09 0.00 -0.52 0.00 0.00 37.83 36.25 1xll s LYS 294 CO 0.17 -0.17 1.68 -2.14 -0.92 0.00 0.00 175.35 173.96 1xll s PRO 295 N 1.36 4.18 0.24 -1.68 0.02 -1.26 -4.66 135.00 133.21 1xll s PRO 295 Ca -0.04 2.42 -0.28 0.00 0.02 0.00 0.00 61.00 63.12 1xll s PRO 295 Cb -0.13 -3.46 -0.16 0.00 0.02 0.00 0.00 34.50 30.77 1xll s PRO 295 CO -0.03 -0.73 0.73 0.43 -0.33 0.00 0.00 177.00 177.07 1xll n SER 296 N 5.12 -0.16 0.00 2.53 7.64 -1.26 -4.85 113.62 122.64 1xll n SER 296 Ca 0.16 1.15 0.04 0.00 1.01 0.00 0.00 58.87 61.23 1xll n SER 296 Cb 0.39 -1.10 0.20 0.00 -1.01 0.00 0.00 64.21 62.69 1xll n SER 296 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1xll n ARG 297 N 0.87 0.02 0.16 1.43 1.85 -1.26 -2.91 116.66 116.82 1xll n ARG 297 Ca 0.14 0.33 0.03 0.00 -1.00 0.00 0.00 57.85 57.35 1xll n ARG 297 Cb 0.28 -1.50 0.25 0.00 -1.05 0.00 0.00 32.46 30.44 1xll n ARG 297 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1xll h THR 298 N 0.00 1.07 -3.20 8.89 1.35 -1.99 -3.46 112.91 115.58 1xll h THR 298 Ca 0.00 -1.82 -0.58 0.00 -0.55 0.00 0.00 66.41 63.46 1xll h THR 298 Cb 0.15 2.06 -0.04 0.00 -1.73 0.00 0.00 68.15 68.59 1xll h THR 298 CO 0.00 0.47 -0.14 -1.81 -0.25 0.00 0.00 175.52 173.79 1xll s ASP 299 N -6.56 6.82 0.63 5.36 1.11 -1.15 -5.11 116.67 117.76 1xll s ASP 299 Ca 0.00 1.02 -0.01 0.00 0.18 0.00 0.00 52.55 53.74 1xll s ASP 299 Cb 0.11 -2.27 0.03 0.00 1.07 0.00 0.00 42.92 41.86 1xll s ASP 299 CO 0.72 0.19 0.18 0.61 1.18 0.00 0.00 175.17 178.05 1xll n GLY 300 N 1.18 0.10 0.28 0.21 0.00 -1.26 -4.83 105.19 100.86 1xll n GLY 300 Ca -0.08 -1.87 0.11 0.00 0.00 0.00 0.00 46.02 44.17 1xll n GLY 300 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xll h TYR 301 N -0.65 0.00 -0.63 1.61 0.05 -1.99 -0.68 116.97 114.67 1xll h TYR 301 Ca -0.06 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.67 1xll h TYR 301 Cb 0.19 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.91 1xll h TYR 301 CO 0.00 0.00 0.18 -0.44 -1.05 0.00 0.00 178.16 176.85 1xll h ASP 302 N 0.00 0.93 -0.63 3.88 3.32 -2.00 -2.06 116.42 119.86 1xll h ASP 302 Ca 0.01 -0.22 0.07 0.00 0.02 0.00 0.00 57.03 56.91 1xll h ASP 302 Cb 0.05 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.30 1xll h ASP 302 CO -0.00 0.90 0.31 1.23 -1.72 0.00 0.00 179.24 179.96 1xll h GLY 303 N 0.91 0.91 0.78 2.75 0.00 -1.48 -2.29 103.07 104.64 1xll h GLY 303 Ca 0.20 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1xll h GLY 303 CO -0.00 0.09 0.17 -2.08 0.00 0.00 0.00 176.54 174.72 1xll h VAL 304 N 0.56 0.95 0.00 4.60 2.07 -0.95 -0.21 116.25 123.28 1xll h VAL 304 Ca 0.29 -0.12 -0.13 0.00 0.82 0.00 0.00 66.70 67.56 1xll h VAL 304 Cb 0.25 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1xll h VAL 304 CO -0.22 0.07 -0.64 -0.50 0.02 0.00 0.00 177.57 176.30 1xll h TRP 305 N 0.36 0.00 0.72 1.57 4.06 -1.42 -2.41 115.95 118.83 1xll h TRP 305 Ca 0.16 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.08 1xll h TRP 305 Cb 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1xll h TRP 305 CO -0.11 0.64 -0.48 -0.44 -3.56 0.00 0.00 178.44 174.49 1xll h ASP 306 N 0.00 -1.23 -0.77 -3.49 3.32 -1.09 -2.39 116.42 110.77 1xll h ASP 306 Ca -0.01 0.07 0.11 0.00 0.02 0.00 0.00 57.03 57.22 1xll h ASP 306 Cb 1.34 0.37 -0.08 0.00 0.22 0.00 0.00 39.33 41.18 1xll h ASP 306 CO 0.08 -0.71 0.40 0.77 -1.72 0.00 0.00 179.24 178.05 1xll h SER 307 N -1.13 0.52 -0.52 6.45 4.64 -1.01 0.38 113.55 122.87 1xll h SER 307 Ca -0.10 0.07 0.03 0.00 -0.47 0.00 0.00 61.79 61.32 1xll h SER 307 Cb 0.92 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.95 1xll h SER 307 CO 0.07 0.28 0.29 0.00 -0.87 0.00 0.00 176.83 176.60 1xll h ALA 308 N 1.47 0.67 -0.21 5.18 0.00 -1.44 -1.08 119.26 123.85 1xll h ALA 308 Ca 0.39 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 55.11 1xll h ALA 308 Cb 0.44 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xll h ALA 308 CO -0.29 -0.02 -0.63 -0.22 0.00 0.00 0.00 179.25 178.09 1xll h LYS 309 N 0.57 0.73 -0.65 0.00 3.64 -0.85 -3.13 116.57 116.89 1xll h LYS 309 Ca 0.22 -0.51 0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1xll h LYS 309 Cb 0.08 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 1xll h LYS 309 CO -0.12 1.13 0.42 0.00 -2.27 0.00 0.00 179.45 178.61 1xll h ALA 310 N 0.75 0.82 -0.17 5.00 0.00 0.29 -0.69 119.26 125.25 1xll h ALA 310 Ca -0.01 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1xll h ALA 310 Cb 1.22 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 1xll h ALA 310 CO 0.13 0.23 -0.36 -0.91 0.00 0.00 0.00 179.25 178.34 1xll h ASN 311 N 0.86 -1.14 -0.30 0.00 2.35 -1.17 -0.54 115.58 115.64 1xll h ASN 311 Ca 0.24 0.16 -0.10 0.00 -0.55 0.00 0.00 56.30 56.05 1xll h ASN 311 Cb -0.08 0.48 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 1xll h ASN 311 CO -0.06 -0.38 -0.18 0.24 -1.65 0.00 0.00 177.43 175.41 1xll h MET 312 N -0.41 0.76 0.11 0.81 2.86 -1.49 -2.53 114.93 115.04 1xll h MET 312 Ca 0.10 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1xll h MET 312 Cb 0.58 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1xll h MET 312 CO -0.40 0.89 -0.05 0.77 1.06 0.00 0.00 176.91 179.17 1xll h SER 313 N 0.68 -0.12 0.03 1.22 0.02 -0.90 -1.90 113.55 112.58 1xll h SER 313 Ca 0.10 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1xll h SER 313 Cb 0.67 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.20 1xll h SER 313 CO 0.05 -0.06 -0.24 0.24 -1.14 0.00 0.00 176.83 175.68 1xll h MET 314 N -0.18 -0.38 -0.37 3.45 2.07 -1.09 0.67 114.93 119.10 1xll h MET 314 Ca -0.01 0.03 0.06 0.00 -2.07 0.00 0.00 59.70 57.70 1xll h MET 314 Cb 0.14 0.09 -0.05 0.00 -1.87 0.00 0.00 31.60 29.91 1xll h MET 314 CO 0.02 -0.25 0.06 -0.92 1.07 0.00 0.00 176.91 176.89 1xll h TYR 315 N -0.39 0.10 -0.59 -0.22 5.03 -1.44 -1.05 116.97 118.41 1xll h TYR 315 Ca 0.05 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.35 1xll h TYR 315 Cb 0.46 0.01 -0.03 0.00 1.55 0.00 0.00 36.73 38.73 1xll h TYR 315 CO -0.27 0.00 0.22 -0.07 -1.32 0.00 0.00 178.16 176.73 1xll h LEU 316 N 0.18 0.82 -0.75 2.82 3.38 -0.82 -1.08 115.31 119.86 1xll h LEU 316 Ca 0.18 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1xll h LEU 316 Cb 0.21 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1xll h LEU 316 CO -0.24 0.78 0.45 -0.07 0.09 0.00 0.00 178.44 179.44 1xll h LEU 317 N 0.82 0.90 -0.30 1.67 3.38 -0.78 -1.97 115.31 119.03 1xll h LEU 317 Ca 0.19 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1xll h LEU 317 Cb 0.22 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1xll h LEU 317 CO -0.01 0.70 -0.04 -0.07 0.09 0.00 0.00 178.44 179.11 1xll h LEU 318 N 1.02 0.55 -0.80 1.67 3.38 -1.02 -2.84 115.31 117.27 1xll h LEU 318 Ca 0.27 -0.34 0.09 0.00 0.09 0.00 0.00 57.88 57.98 1xll h LEU 318 Cb -0.03 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.50 1xll h LEU 318 CO -0.05 0.76 0.46 0.50 0.09 0.00 0.00 178.44 180.20 1xll h LYS 319 N 0.33 0.76 -0.12 1.13 3.64 -1.02 -0.80 116.57 120.48 1xll h LYS 319 Ca 0.08 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1xll h LYS 319 Cb 0.50 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1xll h LYS 319 CO 0.02 0.50 0.04 1.49 -2.27 0.00 0.00 179.45 179.24 1xll h GLU 320 N 0.78 0.19 -0.50 1.90 4.81 -1.32 -1.80 114.58 118.66 1xll h GLU 320 Ca 0.38 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1xll h GLU 320 Cb 0.32 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1xll h GLU 320 CO -0.23 0.32 0.22 0.00 -0.73 0.00 0.00 179.01 178.58 1xll h ARG 321 N 0.03 0.72 -0.72 1.92 3.08 -1.27 -2.01 114.38 116.14 1xll h ARG 321 Ca 0.04 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1xll h ARG 321 Cb 0.20 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 1xll h ARG 321 CO -0.00 0.62 0.34 0.00 -1.07 0.00 0.00 179.97 179.86 1xll h ALA 322 N 1.06 1.25 0.00 0.04 0.00 -1.08 0.80 119.26 121.34 1xll h ALA 322 Ca 0.17 -0.14 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1xll h ALA 322 Cb 0.15 -0.29 0.02 0.00 0.00 0.00 0.00 17.79 17.67 1xll h ALA 322 CO -0.02 0.58 -1.04 -0.07 0.00 0.00 0.00 179.25 178.70 1xll h LEU 323 N 1.02 0.88 -0.59 0.00 3.38 -1.27 -2.88 115.31 115.85 1xll h LEU 323 Ca 0.25 -0.71 -0.12 0.00 0.09 0.00 0.00 57.88 57.39 1xll h LEU 323 Cb 0.11 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1xll h LEU 323 CO -0.03 1.51 -0.17 0.00 0.09 0.00 0.00 178.44 179.84 1xll h ALA 324 N 0.43 0.78 0.42 1.53 0.00 -1.11 -2.79 119.26 118.54 1xll h ALA 324 Ca -0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1xll h ALA 324 Cb 1.69 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1xll h ALA 324 CO 0.20 0.66 -0.45 0.35 0.00 0.00 0.00 179.25 180.01 1xll h PHE 325 N 0.83 -1.25 0.00 0.00 3.57 -0.90 -2.28 116.94 116.91 1xll h PHE 325 Ca 0.12 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1xll h PHE 325 Cb 0.73 0.49 -0.00 0.00 2.79 0.00 0.00 35.95 39.95 1xll h PHE 325 CO 0.05 -0.61 -0.13 0.00 -2.23 0.00 0.00 178.31 175.39 1xll h ARG 326 N -0.90 0.00 0.00 1.11 2.47 -1.50 -2.99 114.38 112.58 1xll h ARG 326 Ca -0.04 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1xll h ARG 326 Cb 0.80 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 1xll h ARG 326 CO -0.08 0.13 -0.13 0.00 0.56 0.00 0.00 179.97 180.45 1xll h ALA 327 N 1.87 0.92 -2.34 0.04 0.00 -1.41 -3.44 119.26 114.91 1xll h ALA 327 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1xll h ALA 327 Cb 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1xll h ALA 327 CO 0.02 0.00 0.68 0.34 0.00 0.00 0.00 179.25 180.29 1xll s ASP 328 N -5.15 7.05 0.37 0.00 -1.08 -0.87 -4.94 116.67 112.05 1xll s ASP 328 Ca 0.08 1.86 0.05 0.00 -0.52 0.00 0.00 52.55 54.02 1xll s ASP 328 Cb 0.10 -2.56 0.73 0.00 -1.46 0.00 0.00 42.92 39.73 1xll s ASP 328 CO 0.65 -0.57 1.98 -0.65 0.52 0.00 0.00 175.17 177.10 1xll h PRO 329 N 7.37 0.73 -0.26 4.34 0.11 -1.89 -1.83 132.00 140.58 1xll h PRO 329 Ca -0.36 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 1xll h PRO 329 Cb 1.17 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1xll h PRO 329 CO 0.87 0.49 0.07 1.49 -0.21 0.00 0.00 178.00 180.70 1xll h GLU 330 N 0.76 0.42 -0.26 1.05 4.57 -1.95 -1.76 114.58 117.40 1xll h GLU 330 Ca 0.28 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1xll h GLU 330 Cb 0.15 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1xll h GLU 330 CO -0.08 0.51 0.02 0.28 -1.18 0.00 0.00 179.01 178.55 1xll h VAL 331 N 0.25 1.25 -0.38 0.32 2.07 -1.66 -2.06 116.25 116.04 1xll h VAL 331 Ca 0.08 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1xll h VAL 331 Cb 0.28 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 1xll h VAL 331 CO 0.00 0.27 0.15 1.56 0.02 0.00 0.00 177.57 179.58 1xll h GLN 332 N 0.24 0.53 -0.24 1.57 1.08 -1.20 -2.35 115.11 114.73 1xll h GLN 332 Ca 0.08 -0.06 -0.10 0.00 -1.45 0.00 0.00 58.65 57.12 1xll h GLN 332 Cb 0.39 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1xll h GLN 332 CO 0.01 0.44 -0.23 1.49 -0.95 0.00 0.00 178.83 179.58 1xll h GLU 333 N 0.53 0.58 -0.75 1.46 4.81 -1.12 -2.86 114.58 117.22 1xll h GLU 333 Ca 0.13 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1xll h GLU 333 Cb 0.10 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1xll h GLU 333 CO -0.01 0.89 0.49 0.00 -0.73 0.00 0.00 179.01 179.65 1xll h ALA 334 N 0.67 0.96 -0.79 2.92 0.00 -1.18 -1.89 119.26 119.95 1xll h ALA 334 Ca 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xll h ALA 334 Cb 0.79 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1xll h ALA 334 CO 0.06 0.39 0.45 0.52 0.00 0.00 0.00 179.25 180.67 1xll h MET 335 N 1.02 1.09 -0.08 0.00 2.86 -1.41 -2.17 114.93 116.24 1xll h MET 335 Ca 0.27 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.75 1xll h MET 335 Cb -0.10 -0.22 -0.00 0.00 0.06 0.00 0.00 31.60 31.34 1xll h MET 335 CO -0.06 0.79 -0.13 -0.22 1.06 0.00 0.00 176.91 178.35 1xll h LYS 336 N 1.09 0.24 -0.72 1.72 3.11 -1.25 -0.10 116.57 120.66 1xll h LYS 336 Ca 0.28 -0.15 0.11 0.00 -2.81 0.00 0.00 60.65 58.09 1xll h LYS 336 Cb 0.00 0.01 -0.08 0.00 -1.00 0.00 0.00 32.23 31.17 1xll h LYS 336 CO -0.05 0.72 0.32 1.15 -2.81 0.00 0.00 179.45 178.78 1xll h THR 337 N -0.21 0.77 0.00 1.00 2.02 -1.19 -1.27 112.91 114.02 1xll h THR 337 Ca 0.01 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1xll h THR 337 Cb 0.70 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1xll h THR 337 CO 0.03 0.10 0.00 -1.20 0.37 0.00 0.00 175.52 174.82 1xll n SER 338 N -4.93 0.08 -0.23 4.18 7.64 -0.83 -4.87 113.62 114.66 1xll n SER 338 Ca 0.12 0.51 -0.02 0.00 1.01 0.00 0.00 58.87 60.49 1xll n SER 338 Cb 0.33 -0.53 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 1xll n SER 338 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xll n GLY 339 N 1.01 0.41 0.27 0.23 0.00 -0.48 -4.95 105.19 101.69 1xll n GLY 339 Ca 0.06 -0.88 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 1xll n GLY 339 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xll h VAL 340 N 0.00 1.23 0.03 1.61 2.07 -1.22 -1.99 116.25 117.97 1xll h VAL 340 Ca -0.05 -0.74 -0.21 0.00 0.82 0.00 0.00 66.70 66.51 1xll h VAL 340 Cb 0.61 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1xll h VAL 340 CO 0.07 0.29 -0.97 -0.26 0.02 0.00 0.00 177.57 176.72 1xll h PHE 341 N 0.83 0.26 0.00 1.57 0.04 -1.86 -3.29 116.94 114.49 1xll h PHE 341 Ca 0.20 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 1xll h PHE 341 Cb 0.23 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.35 1xll h PHE 341 CO 0.01 1.03 -0.04 0.93 -0.60 0.00 0.00 178.31 179.64 1xll h GLU 342 N 0.08 0.00 -0.81 1.51 5.08 -1.79 -2.57 114.58 116.07 1xll h GLU 342 Ca -0.05 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.39 1xll h GLU 342 Cb 1.64 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.84 1xll h GLU 342 CO 0.14 0.04 0.53 1.25 -1.00 0.00 0.00 179.01 179.97 1xll h LEU 343 N 0.00 0.73 -0.35 1.33 5.85 -1.44 -1.94 115.31 119.48 1xll h LEU 343 Ca -0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1xll h LEU 343 Cb 0.08 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1xll h LEU 343 CO 0.01 0.45 0.00 0.61 -0.34 0.00 0.00 178.44 179.16 1xll n GLY 344 N -1.43 -1.03 3.76 3.75 0.00 -0.97 -4.68 105.19 104.59 1xll n GLY 344 Ca 0.13 0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1xll n GLY 344 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xll s GLU 345 N -3.15 4.39 0.58 1.61 2.02 -0.73 -5.04 118.70 118.38 1xll s GLU 345 Ca 0.05 0.87 -0.20 0.00 0.02 0.00 0.00 54.97 55.70 1xll s GLU 345 Cb 0.08 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.93 1xll s GLU 345 CO 0.27 0.35 1.33 0.95 0.02 0.00 0.00 175.26 178.18 1xll s THR 346 N -0.18 2.11 0.00 3.63 -4.23 -1.26 -4.95 115.64 110.76 1xll s THR 346 Ca 0.34 0.08 -0.25 0.00 -1.18 0.00 0.00 61.69 60.68 1xll s THR 346 Cb -0.19 -3.04 -0.19 0.00 1.34 0.00 0.00 72.50 70.42 1xll s THR 346 CO 0.20 -0.01 1.36 0.74 -0.54 0.00 0.00 174.62 176.37 1xll h THR 347 N 1.16 1.29 -4.03 3.99 2.02 -1.96 -3.43 112.91 111.94 1xll h THR 347 Ca -0.51 -0.89 -0.50 0.00 0.77 0.00 0.00 66.41 65.28 1xll h THR 347 Cb 1.31 1.89 0.05 0.00 -1.74 0.00 0.00 68.15 69.65 1xll h THR 347 CO 0.56 0.23 0.29 -0.76 0.37 0.00 0.00 175.52 176.21 1xll s LEU 348 N -9.44 3.43 0.43 2.58 1.43 -1.26 -5.07 118.68 110.77 1xll s LEU 348 Ca -0.15 1.23 -0.08 0.00 -1.03 0.00 0.00 54.13 54.10 1xll s LEU 348 Cb 0.03 -4.24 -0.05 0.00 0.03 0.00 0.00 46.19 41.96 1xll s LEU 348 CO 0.67 -0.72 0.76 0.20 0.23 0.00 0.00 176.35 177.49 1xll s ASN 349 N -4.04 6.43 0.08 2.29 0.01 -1.26 -4.99 114.94 113.46 1xll s ASN 349 Ca 0.52 1.04 -0.34 0.00 -0.71 0.00 0.00 52.86 53.37 1xll s ASN 349 Cb -0.11 -2.29 -0.14 0.00 0.41 0.00 0.00 41.25 39.13 1xll s ASN 349 CO 0.48 -0.45 1.64 0.00 -1.51 0.00 0.00 177.10 177.26 1xll n ALA 350 N -1.61 0.99 -3.79 0.60 0.00 -1.26 -1.83 120.51 113.60 1xll n ALA 350 Ca 0.02 0.41 -0.27 0.00 0.00 0.00 0.00 53.44 53.59 1xll n ALA 350 Cb 0.54 -2.36 0.02 0.00 0.00 0.00 0.00 19.45 17.65 1xll n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xll n GLY 351 N 3.62 -0.57 3.34 0.00 0.00 -1.26 -4.99 105.19 105.33 1xll n GLY 351 Ca 0.19 0.28 -0.32 0.00 0.00 0.00 0.00 46.02 46.16 1xll n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xll s GLU 352 N -6.20 3.02 0.21 1.61 2.12 -0.76 -5.14 118.70 113.56 1xll s GLU 352 Ca 0.21 -0.76 0.03 0.00 0.36 0.00 0.00 54.97 54.81 1xll s GLU 352 Cb -0.07 -2.44 0.03 0.00 0.26 0.00 0.00 34.13 31.90 1xll s GLU 352 CO 0.86 0.31 0.25 -1.13 -0.54 0.00 0.00 175.26 175.01 1xll n SER 353 N 3.21 1.11 0.10 -1.70 3.41 -1.26 -4.80 113.62 113.69 1xll n SER 353 Ca -0.18 -1.63 -0.07 0.00 -0.26 0.00 0.00 58.87 56.73 1xll n SER 353 Cb 0.53 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1xll n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xll h ALA 354 N 0.49 -0.87 -0.94 7.33 0.00 -2.00 -2.50 119.26 120.76 1xll h ALA 354 Ca -0.11 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 54.84 1xll h ALA 354 Cb 0.47 0.48 -0.13 0.00 0.00 0.00 0.00 17.79 18.61 1xll h ALA 354 CO 0.17 -0.89 -0.52 0.00 0.00 0.00 0.00 179.25 178.01 1xll h ALA 355 N -1.37 -0.34 -0.81 0.00 0.00 -1.99 0.26 119.26 115.01 1xll h ALA 355 Ca -0.02 0.16 0.16 0.00 0.00 0.00 0.00 54.91 55.21 1xll h ALA 355 Cb 0.33 1.23 -0.06 0.00 0.00 0.00 0.00 17.79 19.30 1xll h ALA 355 CO -0.04 -0.86 0.54 -0.44 0.00 0.00 0.00 179.25 178.45 1xll h ASP 356 N -0.03 0.42 -0.09 0.00 3.32 -1.92 -2.39 116.42 115.73 1xll h ASP 356 Ca 0.21 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.24 1xll h ASP 356 Cb 0.48 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1xll h ASP 356 CO -0.92 0.20 -0.16 0.25 -1.72 0.00 0.00 179.24 176.89 1xll h LEU 357 N 0.44 0.30 -1.03 1.55 5.85 -0.54 -1.40 115.31 120.48 1xll h LEU 357 Ca 0.41 -0.56 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 1xll h LEU 357 Cb 0.93 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 1xll h LEU 357 CO -0.14 0.80 0.51 0.24 -0.34 0.00 0.00 178.44 179.50 1xll h MET 358 N -0.19 1.18 0.00 1.25 2.86 -0.93 -1.78 114.93 117.32 1xll h MET 358 Ca 0.00 -0.11 -0.20 0.00 -2.06 0.00 0.00 59.70 57.33 1xll h MET 358 Cb 0.74 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 1xll h MET 358 CO 0.04 0.84 -0.87 -0.97 1.06 0.00 0.00 176.91 177.00 1xll h ASN 359 N 1.20 0.28 -1.81 1.22 -0.00 -1.54 -3.44 115.58 111.49 1xll h ASN 359 Ca 0.31 -0.23 -0.61 0.00 -0.00 0.00 0.00 56.30 55.78 1xll h ASN 359 Cb -0.03 -0.09 -0.00 0.00 -0.00 0.00 0.00 38.32 38.20 1xll h ASN 359 CO -0.06 1.02 1.46 -0.67 -0.00 0.00 0.00 177.43 179.19 1xll n ASP 360 N -3.67 3.07 -0.35 1.15 2.03 -0.53 -4.83 116.55 113.42 1xll n ASP 360 Ca -0.04 0.29 0.06 0.00 0.52 0.00 0.00 54.79 55.63 1xll n ASP 360 Cb 0.80 -1.49 0.24 0.00 -0.72 0.00 0.00 41.12 39.95 1xll n ASP 360 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1xll h SER 361 N 14.21 0.92 -0.27 1.67 0.87 -1.85 -1.72 113.55 127.38 1xll h SER 361 Ca -0.39 0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.14 1xll h SER 361 Cb 1.26 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 63.04 1xll h SER 361 CO 0.97 0.53 -0.05 0.00 -0.53 0.00 0.00 176.83 177.75 1xll h ALA 362 N 1.52 1.20 0.00 6.23 0.00 -1.88 1.26 119.26 127.60 1xll h ALA 362 Ca 0.46 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xll h ALA 362 Cb 0.40 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xll h ALA 362 CO -0.22 0.52 -0.15 0.77 0.00 0.00 0.00 179.25 180.17 1xll h SER 363 N 0.59 0.00 0.00 0.00 0.02 -1.64 -3.33 113.55 109.19 1xll h SER 363 Ca 0.11 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1xll h SER 363 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1xll h SER 363 CO 0.02 0.00 0.00 0.33 -1.14 0.00 0.00 176.83 176.05 1xll n PHE 364 N -2.91 0.00 -0.27 3.45 7.35 -1.17 -4.80 117.46 119.12 1xll n PHE 364 Ca 0.04 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.81 1xll n PHE 364 Cb 0.52 0.02 0.23 0.00 0.35 0.00 0.00 39.48 40.59 1xll n PHE 364 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xll h ALA 365 N 0.00 1.11 -0.41 3.13 0.00 -1.77 -1.09 119.26 120.24 1xll h ALA 365 Ca 0.00 0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.89 1xll h ALA 365 Cb 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 1xll h ALA 365 CO 0.00 -0.36 -0.01 0.41 0.00 0.00 0.00 179.25 179.30 1xll n GLY 366 N -1.36 4.79 3.73 0.00 0.00 0.43 -4.99 105.19 107.78 1xll n GLY 366 Ca 0.17 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 1xll n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xll s PHE 367 N -3.22 3.70 -1.03 1.61 5.36 -0.41 -4.83 117.98 119.15 1xll s PHE 367 Ca 0.46 1.68 -0.15 0.00 -0.96 0.00 0.00 56.93 57.96 1xll s PHE 367 Cb 0.41 -3.16 0.17 0.00 -0.34 0.00 0.00 43.02 40.11 1xll s PHE 367 CO 0.02 -0.18 1.18 0.34 -1.46 0.00 0.00 175.22 175.12 1xll s ASP 368 N 0.26 6.88 0.19 6.13 2.15 -1.26 -4.85 116.67 126.17 1xll s ASP 368 Ca 0.50 -2.65 -0.12 0.00 0.43 0.00 0.00 52.55 50.71 1xll s ASP 368 Cb -0.25 -2.35 0.21 0.00 -0.30 0.00 0.00 42.92 40.23 1xll s ASP 368 CO 0.31 -0.79 1.75 0.00 -0.17 0.00 0.00 175.17 176.26 1xll h ALA 369 N 7.85 0.67 -0.47 3.66 0.00 -1.95 -1.70 119.26 127.32 1xll h ALA 369 Ca 0.21 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1xll h ALA 369 Cb 0.96 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1xll h ALA 369 CO 1.09 -0.20 0.29 0.93 0.00 0.00 0.00 179.25 181.37 1xll h GLU 370 N 0.39 0.64 -0.61 0.00 4.39 -1.99 -1.00 114.58 116.40 1xll h GLU 370 Ca 0.26 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 1xll h GLU 370 Cb 0.29 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1xll h GLU 370 CO -0.26 0.46 0.29 0.00 -1.16 0.00 0.00 179.01 178.34 1xll h ALA 371 N 1.14 0.79 -0.36 3.43 0.00 -1.85 -2.81 119.26 119.60 1xll h ALA 371 Ca 0.17 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1xll h ALA 371 Cb -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1xll h ALA 371 CO -0.03 0.35 -0.07 0.00 0.00 0.00 0.00 179.25 179.50 1xll h ALA 372 N 1.12 1.22 0.00 0.00 0.00 -1.05 -2.65 119.26 117.90 1xll h ALA 372 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xll h ALA 372 Cb 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xll h ALA 372 CO -0.03 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1xll n ALA 373 N -2.48 1.18 0.16 0.00 0.00 -0.40 -2.25 120.51 116.72 1xll n ALA 373 Ca 0.01 0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.58 1xll n ALA 373 Cb 0.30 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.62 1xll n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xll h GLU 374 N 0.00 0.00 -6.30 0.00 5.08 -1.48 -3.47 114.58 108.41 1xll h GLU 374 Ca 0.00 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.70 1xll h GLU 374 Cb 0.07 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.40 1xll h GLU 374 CO 0.00 0.37 0.21 -2.13 -1.00 0.00 0.00 179.01 176.46 1xll n ARG 375 N -3.19 1.05 -3.05 2.33 0.63 -0.95 -4.92 116.66 108.57 1xll n ARG 375 Ca 0.02 0.38 -0.44 0.00 -0.92 0.00 0.00 57.85 56.89 1xll n ARG 375 Cb 0.68 -1.84 -0.04 0.00 0.45 0.00 0.00 32.46 31.70 1xll n ARG 375 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1xll s ASN 376 N -0.07 6.19 0.38 6.15 2.47 -1.26 -4.94 114.94 123.85 1xll s ASN 376 Ca 0.73 -1.26 0.09 0.00 0.42 0.00 0.00 52.86 52.84 1xll s ASN 376 Cb -0.87 -2.33 0.76 0.00 -1.45 0.00 0.00 41.25 37.36 1xll s ASN 376 CO 0.53 -1.18 1.91 -0.26 -3.72 0.00 0.00 177.10 174.38 1xll h PHE 377 N 9.27 0.28 -5.60 0.43 0.04 -1.91 -3.46 116.94 115.99 1xll h PHE 377 Ca -0.29 -0.03 -0.30 0.00 2.80 0.00 0.00 57.97 60.15 1xll h PHE 377 Cb 1.08 -0.08 0.18 0.00 2.20 0.00 0.00 35.95 39.33 1xll h PHE 377 CO 0.86 0.39 -0.81 0.00 -0.60 0.00 0.00 178.31 178.14 1xll n ALA 378 N -2.49 -2.23 0.04 2.45 0.00 -1.26 -3.97 120.51 113.05 1xll n ALA 378 Ca -0.00 0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.33 1xll n ALA 378 Cb 0.26 -3.86 -0.13 0.00 0.00 0.00 0.00 19.45 15.72 1xll n ALA 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xll h PHE 379 N -1.56 0.20 0.29 0.00 0.04 -1.97 -3.05 116.94 110.89 1xll h PHE 379 Ca -0.60 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.02 1xll h PHE 379 Cb 1.33 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.46 1xll h PHE 379 CO 0.38 1.17 -0.19 0.82 -0.60 0.00 0.00 178.31 179.88 1xll h ILE 380 N 0.03 0.59 -0.59 -0.55 2.04 -1.99 -0.78 117.51 116.27 1xll h ILE 380 Ca -0.17 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1xll h ILE 380 Cb 1.93 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 1xll h ILE 380 CO 0.13 0.00 0.39 -0.09 0.00 0.00 0.00 178.15 178.58 1xll h ARG 381 N -0.47 0.77 -0.64 2.37 2.43 -1.97 0.83 114.38 117.69 1xll h ARG 381 Ca -0.03 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1xll h ARG 381 Cb 0.40 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1xll h ARG 381 CO 0.02 0.51 0.17 1.25 -1.51 0.00 0.00 179.97 180.41 1xll h LEU 382 N 0.79 0.94 -0.49 3.80 5.85 -1.40 -1.35 115.31 123.45 1xll h LEU 382 Ca 0.22 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 1xll h LEU 382 Cb -0.08 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 1xll h LEU 382 CO -0.05 0.89 -0.09 -1.13 -0.34 0.00 0.00 178.44 177.72 1xll h ASN 383 N 0.96 0.92 -0.32 1.25 -1.24 -0.51 -1.97 115.58 114.66 1xll h ASN 383 Ca 0.21 -0.35 0.02 0.00 0.71 0.00 0.00 56.30 56.89 1xll h ASN 383 Cb 0.31 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.09 1xll h ASN 383 CO -0.00 1.06 0.16 -0.61 -1.29 0.00 0.00 177.43 176.74 1xll h GLN 384 N 0.77 0.32 -0.46 6.67 5.75 -0.60 -1.07 115.11 126.49 1xll h GLN 384 Ca 0.13 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.63 1xll h GLN 384 Cb 0.64 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 1xll h GLN 384 CO 0.04 0.21 0.26 -0.07 -2.65 0.00 0.00 178.83 176.63 1xll h LEU 385 N 0.33 0.42 -0.07 -2.39 3.38 -1.00 -2.02 115.31 113.96 1xll h LEU 385 Ca 0.14 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1xll h LEU 385 Cb 0.05 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1xll h LEU 385 CO -0.10 0.30 -0.12 0.00 0.09 0.00 0.00 178.44 178.61 1xll h ALA 386 N 1.21 -0.08 -0.35 1.53 0.00 -0.67 -1.58 119.26 119.32 1xll h ALA 386 Ca 0.19 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1xll h ALA 386 Cb 0.03 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1xll h ALA 386 CO -0.09 -0.59 0.10 0.82 0.00 0.00 0.00 179.25 179.48 1xll h ILE 387 N -0.17 0.87 -0.87 0.00 1.08 -0.86 -0.12 117.51 117.43 1xll h ILE 387 Ca 0.07 -0.08 0.09 0.00 -0.39 0.00 0.00 64.86 64.55 1xll h ILE 387 Cb 0.27 0.61 -0.07 0.00 -3.07 0.00 0.00 36.82 34.56 1xll h ILE 387 CO -0.17 0.04 0.52 -0.33 -0.69 0.00 0.00 178.15 177.52 1xll h GLU 388 N 0.24 0.87 -0.27 2.37 5.08 -1.21 -0.74 114.58 120.92 1xll h GLU 388 Ca 0.16 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.28 1xll h GLU 388 Cb 0.16 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1xll h GLU 388 CO -0.19 0.57 -0.59 0.45 -1.00 0.00 0.00 179.01 178.26 1xll h HIS 389 N 0.89 1.10 -0.77 4.33 3.86 -0.26 -1.98 115.15 122.32 1xll h HIS 389 Ca 0.41 -0.41 0.05 0.00 -1.16 0.00 0.00 60.37 59.26 1xll h HIS 389 Cb 0.32 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 1xll h HIS 389 CO -0.04 1.24 0.50 1.25 0.86 0.00 0.00 177.93 181.74 1xll h LEU 390 N 0.65 0.76 -0.35 2.43 5.85 0.33 -2.38 115.31 122.59 1xll h LEU 390 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xll h LEU 390 Cb 1.20 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1xll h LEU 390 CO 0.13 0.50 -0.12 0.18 -0.34 0.00 0.00 178.44 178.80 1xll n LEU 391 N -4.47 0.66 -3.73 2.25 4.77 -0.52 -4.95 117.00 111.02 1xll n LEU 391 Ca 0.11 -0.10 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 1xll n LEU 391 Cb 0.18 -0.14 0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1xll n LEU 391 CO 0.34 0.12 -0.11 0.61 -1.33 0.00 0.00 177.39 177.02 1xll n GLY 392 N 1.26 -0.59 0.42 -0.72 0.00 -0.90 -4.87 105.19 99.79 1xll n GLY 392 Ca 0.15 0.28 0.07 0.00 0.00 0.00 0.00 46.02 46.52 1xll n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xll n SER 393 N -2.91 1.77 0.00 1.61 3.41 -0.76 -5.05 113.62 111.70 1xll n SER 393 Ca -0.21 -1.39 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 1xll n SER 393 Cb 0.64 0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1xll n SER 393 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42