#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1f s LYS 2 N 0.00 0.56 0.02 2.12 1.02 -0.63 -1.26 119.74 121.57 3d1f s LYS 2 Ca 0.00 0.07 -0.27 0.00 0.02 0.00 0.00 55.97 55.79 3d1f s LYS 2 Cb 0.00 0.26 0.09 0.00 -0.52 0.00 0.00 37.83 37.66 3d1f s LYS 2 CO 0.00 -0.13 0.78 -0.59 -0.92 0.00 0.00 175.35 174.49 3d1f s PHE 3 N -0.73 -0.45 -0.12 3.18 -0.71 -0.75 -1.24 117.98 117.16 3d1f s PHE 3 Ca -0.08 0.41 -0.03 0.00 -1.04 0.00 0.00 56.93 56.19 3d1f s PHE 3 Cb -0.04 0.52 0.04 0.00 -1.21 0.00 0.00 43.02 42.33 3d1f s PHE 3 CO 0.03 -0.63 0.05 0.99 -1.34 0.00 0.00 175.22 174.32 3d1f s THR 4 N -2.85 0.18 0.04 -4.49 2.01 -1.26 0.04 115.64 109.31 3d1f s THR 4 Ca 0.01 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.01 3d1f s THR 4 Cb -0.01 -0.58 -0.02 0.00 0.01 0.00 0.00 72.50 71.90 3d1f s THR 4 CO -0.07 -0.02 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.02 3d1f s VAL 5 N 2.03 1.08 0.32 3.82 1.01 -0.62 -4.54 120.40 123.50 3d1f s VAL 5 Ca 0.03 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 60.68 3d1f s VAL 5 Cb -0.14 -0.99 -0.10 0.00 0.00 0.00 0.00 36.38 35.14 3d1f s VAL 5 CO -0.06 -0.04 1.31 -0.70 0.00 0.00 0.00 175.10 175.60 3d1f s GLU 6 N -1.24 4.36 0.27 2.72 2.12 -1.26 -0.65 118.70 125.02 3d1f s GLU 6 Ca 0.01 2.21 -0.01 0.00 0.36 0.00 0.00 54.97 57.54 3d1f s GLU 6 Cb -0.08 -3.08 0.60 0.00 0.26 0.00 0.00 34.13 31.83 3d1f s GLU 6 CO 0.01 -0.20 1.67 -0.09 -0.54 0.00 0.00 175.26 176.12 3d1f h ARG 7 N 3.51 0.25 0.00 4.30 2.43 -1.00 -0.58 114.38 123.29 3d1f h ARG 7 Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3d1f h ARG 7 Cb 1.23 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3d1f h ARG 7 CO 0.66 0.16 0.00 0.93 -1.51 0.00 0.00 179.97 180.22 3d1f h GLU 8 N 0.26 0.00 0.00 0.20 3.07 -1.91 -1.62 114.58 114.58 3d1f h GLU 8 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 3d1f h GLU 8 Cb 0.92 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 3d1f h GLU 8 CO -0.58 0.00 -0.85 0.72 -1.40 0.00 0.00 179.01 176.90 3d1f n HIS 9 N -2.53 0.11 -0.06 4.33 8.25 -0.24 -4.36 115.22 120.72 3d1f n HIS 9 Ca -0.00 0.03 -0.04 0.00 -0.26 0.00 0.00 57.72 57.45 3d1f n HIS 9 Cb 0.15 -0.26 -0.13 0.00 1.12 0.00 0.00 29.99 30.87 3d1f n HIS 9 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3d1f n LEU 10 N -1.69 0.00 0.20 2.41 7.94 -0.68 -4.60 117.00 120.57 3d1f n LEU 10 Ca 0.04 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.79 3d1f n LEU 10 Cb 0.38 0.31 -0.07 0.00 0.53 0.00 0.00 43.42 44.56 3d1f n LEU 10 CO 0.39 0.31 0.63 -0.07 -1.11 0.00 0.00 177.39 177.54 3d1f h LEU 11 N 0.00 -0.99 -0.24 -1.96 3.38 -1.56 -1.41 115.31 112.54 3d1f h LEU 11 Ca -0.34 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3d1f h LEU 11 Cb 1.73 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 42.81 3d1f h LEU 11 CO 0.02 -0.48 0.13 0.50 0.09 0.00 0.00 178.44 178.70 3d1f h LYS 12 N -0.70 0.34 -0.46 1.13 3.11 -1.85 -1.56 116.57 116.57 3d1f h LYS 12 Ca -0.01 -0.04 0.06 0.00 -2.81 0.00 0.00 60.65 57.85 3d1f h LYS 12 Cb 0.65 -0.07 -0.05 0.00 -1.00 0.00 0.00 32.23 31.77 3d1f h LYS 12 CO -0.10 0.30 0.17 -1.35 -2.81 0.00 0.00 179.45 175.66 3d1f h PRO 13 N 0.28 0.33 -0.76 1.90 0.11 -1.80 0.11 132.00 132.17 3d1f h PRO 13 Ca 0.08 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 3d1f h PRO 13 Cb 0.06 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 3d1f h PRO 13 CO -0.01 0.22 0.31 -0.07 -0.21 0.00 0.00 178.00 178.23 3d1f h LEU 14 N 0.34 1.05 -0.44 2.35 3.38 -1.11 -0.59 115.31 120.29 3d1f h LEU 14 Ca 0.21 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 3d1f h LEU 14 Cb 0.21 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3d1f h LEU 14 CO -0.21 0.94 -0.00 -0.61 0.09 0.00 0.00 178.44 178.64 3d1f h GLN 15 N 1.10 0.79 0.01 1.13 4.15 -0.80 -2.77 115.11 118.71 3d1f h GLN 15 Ca 0.25 -0.25 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 3d1f h GLN 15 Cb 0.21 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.83 3d1f h GLN 15 CO -0.02 0.85 -0.00 0.37 -1.93 0.00 0.00 178.83 178.10 3d1f h GLN 16 N 0.63 -0.01 0.00 1.69 5.75 -0.56 -3.15 115.11 119.47 3d1f h GLN 16 Ca 0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 3d1f h GLN 16 Cb 0.50 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.05 3d1f h GLN 16 CO 0.02 0.31 0.00 -0.39 -2.65 0.00 0.00 178.83 176.12 3d1f h VAL 17 N -0.32 0.00 -0.00 2.39 -1.51 -1.16 -1.76 116.25 113.88 3d1f h VAL 17 Ca -0.00 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 3d1f h VAL 17 Cb 0.32 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 3d1f h VAL 17 CO 0.00 0.00 -0.02 -1.20 -1.23 0.00 0.00 177.57 175.12 3d1f n SER 18 N -2.90 0.11 0.04 4.19 7.64 -1.05 -3.78 113.62 117.87 3d1f n SER 18 Ca 0.00 -0.39 -0.15 0.00 1.01 0.00 0.00 58.87 59.34 3d1f n SER 18 Cb 0.25 -0.19 -0.10 0.00 -1.01 0.00 0.00 64.21 63.17 3d1f n SER 18 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3d1f h GLY 19 N 4.99 -1.08 2.00 0.23 0.00 -1.36 -2.07 103.07 105.79 3d1f h GLY 19 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 47.33 47.99 3d1f h GLY 19 CO 0.00 -0.22 0.00 -1.55 0.00 0.00 0.00 176.54 174.77 3d1f n PRO 20 N -5.45 0.07 0.00 4.80 -0.04 -1.26 -4.69 135.00 128.43 3d1f n PRO 20 Ca -0.07 0.57 0.00 0.00 -0.04 0.00 0.00 63.50 63.97 3d1f n PRO 20 Cb 0.39 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 3d1f n PRO 20 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3d1f n LEU 21 N -1.91 0.00 0.00 1.53 4.32 -0.78 -4.52 117.00 115.65 3d1f n LEU 21 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.98 3d1f n LEU 21 Cb 0.02 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.82 3d1f n LEU 21 CO 0.05 -0.53 0.00 0.61 -1.22 0.00 0.00 177.39 176.31 3d1f n GLY 22 N 4.56 0.99 3.72 -0.72 0.00 -1.26 -5.00 105.19 107.47 3d1f n GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d1f n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1f n GLY 23 N 0.00 2.72 2.47 -0.02 0.00 -1.26 -4.76 105.19 104.35 3d1f n GLY 23 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3d1f n GLY 23 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3d1f n ARG 24 N -0.76 1.98 -1.60 1.61 0.63 -1.26 -5.11 116.66 112.14 3d1f n ARG 24 Ca 0.00 -4.10 -0.32 0.00 -0.92 0.00 0.00 57.85 52.50 3d1f n ARG 24 Cb 0.00 -1.90 0.06 0.00 0.45 0.00 0.00 32.46 31.07 3d1f n ARG 24 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 3d1f s PRO 25 N -2.52 2.63 0.14 -0.14 0.04 -1.26 -4.95 135.00 128.93 3d1f s PRO 25 Ca 0.42 1.33 0.26 0.00 0.04 0.00 0.00 61.00 63.05 3d1f s PRO 25 Cb 0.25 -1.93 0.71 0.00 0.04 0.00 0.00 34.50 33.57 3d1f s PRO 25 CO -0.09 -1.38 1.64 0.25 0.04 0.00 0.00 177.00 177.46 3d1f n THR 26 N -2.75 0.39 -4.10 1.26 -2.24 -1.26 -4.77 114.28 100.82 3d1f n THR 26 Ca 0.10 -0.22 -0.17 0.00 -2.27 0.00 0.00 64.05 61.49 3d1f n THR 26 Cb 0.52 -0.37 -0.15 0.00 -2.10 0.00 0.00 70.33 68.23 3d1f n THR 26 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3d1f s LEU 27 N -4.09 1.59 0.20 3.22 1.43 -1.26 -5.06 118.68 114.71 3d1f s LEU 27 Ca 0.10 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 3d1f s LEU 27 Cb 0.14 -0.30 0.25 0.00 0.03 0.00 0.00 46.19 46.31 3d1f s LEU 27 CO 0.63 -0.01 1.68 -0.65 0.23 0.00 0.00 176.35 178.23 3d1f h PRO 28 N 6.67 0.14 -0.19 1.29 0.11 -2.01 -1.73 132.00 136.29 3d1f h PRO 28 Ca -0.35 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3d1f h PRO 28 Cb 1.16 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3d1f h PRO 28 CO 0.49 0.09 0.08 0.97 -0.21 0.00 0.00 178.00 179.42 3d1f h ILE 29 N 0.14 1.07 0.00 4.15 6.09 -1.97 -0.63 117.51 126.37 3d1f h ILE 29 Ca 0.29 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 63.57 3d1f h ILE 29 Cb 0.45 0.84 0.00 0.00 0.47 0.00 0.00 36.82 38.58 3d1f h ILE 29 CO -0.46 0.08 0.00 0.18 -3.07 0.00 0.00 178.15 174.89 3d1f n LEU 30 N -4.47 0.00 -0.68 2.19 4.77 -0.66 -1.35 117.00 116.80 3d1f n LEU 30 Ca -0.00 0.30 0.12 0.00 -0.03 0.00 0.00 56.01 56.40 3d1f n LEU 30 Cb 0.11 -0.30 0.21 0.00 -2.33 0.00 0.00 43.42 41.11 3d1f n LEU 30 CO 0.35 -0.12 0.63 0.61 -1.33 0.00 0.00 177.39 177.53 3d1f n GLY 31 N 0.31 0.40 3.83 -0.72 0.00 -0.24 -4.78 105.19 103.99 3d1f n GLY 31 Ca 0.09 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.30 3d1f n GLY 31 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3d1f s ASN 32 N -2.15 5.16 -0.05 1.61 -0.87 -0.46 -1.30 114.94 116.89 3d1f s ASN 32 Ca 0.28 -0.56 0.03 0.00 -1.57 0.00 0.00 52.86 51.04 3d1f s ASN 32 Cb 0.20 -0.91 -0.03 0.00 -0.02 0.00 0.00 41.25 40.49 3d1f s ASN 32 CO 0.39 -0.35 -0.13 -0.76 -2.57 0.00 0.00 177.10 173.67 3d1f s LEU 33 N -3.97 2.79 -0.18 0.60 1.43 0.11 -4.70 118.68 114.76 3d1f s LEU 33 Ca 0.40 -0.18 -0.22 0.00 -1.03 0.00 0.00 54.13 53.11 3d1f s LEU 33 Cb -0.05 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 3d1f s LEU 33 CO 0.26 0.34 0.67 -0.22 0.23 0.00 0.00 176.35 177.63 3d1f s LEU 34 N -0.78 4.16 -0.14 1.79 2.96 -0.17 -1.98 118.68 124.52 3d1f s LEU 34 Ca 0.12 0.92 -0.02 0.00 -0.22 0.00 0.00 54.13 54.93 3d1f s LEU 34 Cb -0.11 -2.96 -0.02 0.00 0.50 0.00 0.00 46.19 43.60 3d1f s LEU 34 CO 0.01 -0.28 -0.09 -0.76 -1.32 0.00 0.00 176.35 173.91 3d1f s LEU 35 N 1.85 2.97 -0.05 -0.68 1.43 0.55 -1.17 118.68 123.58 3d1f s LEU 35 Ca 0.31 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 3d1f s LEU 35 Cb -0.16 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.39 3d1f s LEU 35 CO 0.11 0.17 -0.06 -1.10 0.23 0.00 0.00 176.35 175.70 3d1f s GLN 36 N 0.36 0.96 -0.16 1.70 -0.21 -0.44 -1.51 119.66 120.37 3d1f s GLN 36 Ca -0.08 -0.15 -0.02 0.00 0.02 0.00 0.00 55.36 55.13 3d1f s GLN 36 Cb -0.15 -0.94 -0.02 0.00 1.00 0.00 0.00 33.01 32.91 3d1f s GLN 36 CO 0.04 -0.07 -0.09 0.08 -2.12 0.00 0.00 175.29 173.14 3d1f s VAL 37 N 0.91 3.34 -0.28 1.09 1.01 0.25 -0.08 120.40 126.64 3d1f s VAL 37 Ca -0.11 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.07 3d1f s VAL 37 Cb -0.14 -2.45 0.14 0.00 0.00 0.00 0.00 36.38 33.93 3d1f s VAL 37 CO 0.00 0.49 1.13 0.00 0.00 0.00 0.00 175.10 176.73 3d1f s ALA 38 N 0.64 -2.03 -1.37 5.51 0.00 -0.45 -2.20 121.76 121.86 3d1f s ALA 38 Ca -0.05 1.81 -0.05 0.00 0.00 0.00 0.00 51.96 53.67 3d1f s ALA 38 Cb -0.15 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.49 3d1f s ALA 38 CO 0.03 -0.21 0.43 -0.25 0.00 0.00 0.00 175.76 175.76 3d1f n ASP 39 N 1.96 -1.11 -0.65 0.00 8.00 -1.26 -0.98 116.55 122.51 3d1f n ASP 39 Ca -0.12 -1.06 -0.08 0.00 0.71 0.00 0.00 54.79 54.23 3d1f n ASP 39 Cb 0.56 -2.81 -0.04 0.00 -0.02 0.00 0.00 41.12 38.81 3d1f n ASP 39 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d1f n GLY 40 N -2.03 0.96 2.98 0.44 0.00 -1.26 -4.99 105.19 101.29 3d1f n GLY 40 Ca -0.27 -0.24 -0.18 0.00 0.00 0.00 0.00 46.02 45.32 3d1f n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d1f s THR 41 N -2.07 0.61 -0.25 2.61 2.01 -0.15 -0.78 115.64 117.63 3d1f s THR 41 Ca 0.00 -0.30 -0.08 0.00 0.31 0.00 0.00 61.69 61.62 3d1f s THR 41 Cb 0.00 -0.54 -0.03 0.00 0.01 0.00 0.00 72.50 71.94 3d1f s THR 41 CO 0.00 0.19 0.10 -0.22 -0.69 0.00 0.00 174.62 174.00 3d1f s LEU 42 N 0.05 3.61 -0.12 4.42 2.96 0.49 -1.34 118.68 128.74 3d1f s LEU 42 Ca -0.00 -0.13 -0.03 0.00 -0.22 0.00 0.00 54.13 53.74 3d1f s LEU 42 Cb -0.06 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 3d1f s LEU 42 CO -0.00 -0.02 0.00 -0.44 -1.32 0.00 0.00 176.35 174.57 3d1f s SER 43 N 1.53 5.18 -0.10 3.68 0.01 0.88 -0.15 113.70 124.72 3d1f s SER 43 Ca 0.06 0.05 0.04 0.00 1.31 0.00 0.00 55.95 57.41 3d1f s SER 43 Cb -0.15 -1.66 -0.00 0.00 0.21 0.00 0.00 66.02 64.42 3d1f s SER 43 CO 0.05 0.28 -0.24 -0.76 0.41 0.00 0.00 173.24 172.98 3d1f s LEU 44 N -0.27 2.12 -0.03 2.44 2.01 0.12 -1.32 118.68 123.74 3d1f s LEU 44 Ca 0.06 -0.55 0.02 0.00 0.01 0.00 0.00 54.13 53.68 3d1f s LEU 44 Cb -0.12 -1.42 0.00 0.00 0.01 0.00 0.00 46.19 44.66 3d1f s LEU 44 CO 0.02 0.16 -0.09 -0.89 1.01 0.00 0.00 176.35 176.56 3d1f s THR 45 N 0.32 0.81 0.06 5.49 2.01 -0.31 -0.63 115.64 123.39 3d1f s THR 45 Ca -0.18 -0.37 0.07 0.00 0.31 0.00 0.00 61.69 61.52 3d1f s THR 45 Cb -0.18 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 3d1f s THR 45 CO 0.09 0.26 -0.20 -0.83 -0.69 0.00 0.00 174.62 173.24 3d1f s GLY 46 N 0.24 1.11 0.16 4.40 0.00 -0.43 -1.00 107.32 111.80 3d1f s GLY 46 Ca -0.04 -1.09 -0.15 0.00 0.00 0.00 0.00 44.72 43.44 3d1f s GLY 46 CO 0.01 -1.04 0.42 -1.08 0.00 0.00 0.00 173.10 171.40 3d1f s THR 47 N -0.93 0.05 -0.04 0.90 -1.32 -1.26 -1.07 115.64 111.98 3d1f s THR 47 Ca 0.06 -0.87 0.05 0.00 -1.21 0.00 0.00 61.69 59.73 3d1f s THR 47 Cb -0.09 -1.50 0.08 0.00 -1.51 0.00 0.00 72.50 69.48 3d1f s THR 47 CO 0.02 -0.24 1.01 -0.90 -2.21 0.00 0.00 174.62 172.31 3d1f n ASP 48 N -0.27 0.73 0.00 8.08 5.75 -1.08 -4.65 116.55 125.12 3d1f n ASP 48 Ca -0.11 -2.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.42 3d1f n ASP 48 Cb 0.63 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 3d1f n ASP 48 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3d1f n LEU 49 N -0.43 0.00 -0.06 -2.12 4.77 -1.26 -4.69 117.00 113.21 3d1f n LEU 49 Ca 0.05 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.90 3d1f n LEU 49 Cb 0.66 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.60 3d1f n LEU 49 CO 0.00 0.00 -0.90 -0.62 -1.33 0.00 0.00 177.39 174.55 3d1f n GLU 50 N -1.37 0.68 -3.94 3.23 1.02 -1.26 -4.94 120.64 114.05 3d1f n GLU 50 Ca 0.00 0.17 -0.10 0.00 -0.02 0.00 0.00 57.16 57.22 3d1f n GLU 50 Cb 0.00 -1.65 -0.06 0.00 -0.02 0.00 0.00 31.44 29.70 3d1f n GLU 50 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d1f s MET 51 N -2.55 1.22 -0.00 3.49 0.23 -1.26 -1.40 119.30 119.03 3d1f s MET 51 Ca -0.14 -1.15 -0.05 0.00 -1.03 0.00 0.00 55.69 53.32 3d1f s MET 51 Cb 0.07 0.40 -0.00 0.00 -1.53 0.00 0.00 34.83 33.77 3d1f s MET 51 CO 0.78 -0.46 0.09 -1.83 -2.03 0.00 0.00 175.02 171.57 3d1f s GLU 52 N -3.96 0.38 -0.11 3.16 -1.05 0.38 -2.63 118.70 114.86 3d1f s GLU 52 Ca 0.17 -0.35 0.03 0.00 -0.15 0.00 0.00 54.97 54.66 3d1f s GLU 52 Cb 0.02 0.15 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 3d1f s GLU 52 CO 0.01 -0.08 -0.20 1.41 0.95 0.00 0.00 175.26 177.34 3d1f s MET 53 N -1.14 2.72 -0.03 -4.83 -2.45 -0.23 -1.57 119.30 111.76 3d1f s MET 53 Ca -0.12 -0.75 0.06 0.00 -1.25 0.00 0.00 55.69 53.62 3d1f s MET 53 Cb -0.07 -2.16 -0.01 0.00 1.25 0.00 0.00 34.83 33.83 3d1f s MET 53 CO 0.01 0.05 -0.22 0.08 1.05 0.00 0.00 175.02 175.98 3d1f s VAL 54 N 0.67 1.77 -0.02 10.11 1.01 -0.33 -1.31 120.40 132.30 3d1f s VAL 54 Ca -0.12 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 60.98 3d1f s VAL 54 Cb -0.16 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 3d1f s VAL 54 CO 0.03 0.50 -0.20 0.00 0.00 0.00 0.00 175.10 175.43 3d1f s ALA 55 N -0.32 1.68 -0.14 5.51 0.00 0.19 -0.48 121.76 128.21 3d1f s ALA 55 Ca 0.03 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.14 3d1f s ALA 55 Cb -0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 3d1f s ALA 55 CO 0.01 0.39 -0.14 1.03 0.00 0.00 0.00 175.76 177.05 3d1f s ARG 56 N -0.37 3.29 -0.17 0.00 0.52 -0.52 -0.71 118.95 120.99 3d1f s ARG 56 Ca 0.05 -0.72 0.01 0.00 -0.52 0.00 0.00 55.73 54.55 3d1f s ARG 56 Cb -0.09 -2.62 0.03 0.00 0.52 0.00 0.00 34.95 32.79 3d1f s ARG 56 CO -0.00 0.11 -0.15 0.08 0.02 0.00 0.00 175.30 175.35 3d1f s VAL 57 N 0.60 1.77 0.30 3.52 1.01 0.79 -4.88 120.40 123.52 3d1f s VAL 57 Ca -0.08 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.77 3d1f s VAL 57 Cb -0.16 -1.68 -0.11 0.00 0.00 0.00 0.00 36.38 34.44 3d1f s VAL 57 CO 0.03 0.42 1.46 0.00 0.00 0.00 0.00 175.10 177.01 3d1f s ALA 58 N 1.39 3.62 -0.47 5.51 0.00 -1.26 -0.38 121.76 130.17 3d1f s ALA 58 Ca 0.03 1.43 -0.09 0.00 0.00 0.00 0.00 51.96 53.33 3d1f s ALA 58 Cb -0.14 -3.57 0.12 0.00 0.00 0.00 0.00 23.12 19.53 3d1f s ALA 58 CO -0.11 -0.85 0.33 -0.51 0.00 0.00 0.00 175.76 174.63 3d1f s LEU 59 N -1.06 5.65 0.00 0.00 1.43 0.04 -4.85 118.68 119.89 3d1f s LEU 59 Ca 0.57 -1.90 0.26 0.00 -1.03 0.00 0.00 54.13 52.03 3d1f s LEU 59 Cb -0.44 -2.00 0.67 0.00 0.03 0.00 0.00 46.19 44.45 3d1f s LEU 59 CO 0.51 -0.68 1.53 1.33 0.23 0.00 0.00 176.35 179.27 3d1f n VAL 60 N 4.89 0.00 -4.05 -1.59 0.24 -1.26 -4.82 118.33 111.74 3d1f n VAL 60 Ca -0.08 -0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.00 3d1f n VAL 60 Cb 0.41 0.09 -0.04 0.00 -1.47 0.00 0.00 33.84 32.83 3d1f n VAL 60 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 3d1f s GLN 61 N -2.99 2.86 0.46 7.34 -0.21 -1.26 -5.07 119.66 120.79 3d1f s GLN 61 Ca 0.12 -1.12 -0.22 0.00 0.02 0.00 0.00 55.36 54.16 3d1f s GLN 61 Cb 0.18 -2.53 -0.11 0.00 1.00 0.00 0.00 33.01 31.55 3d1f s GLN 61 CO 0.66 0.33 0.72 -2.30 -2.12 0.00 0.00 175.29 172.58 3d1f n PRO 62 N -1.22 0.82 -3.86 2.91 -0.02 -1.26 -4.82 135.00 127.55 3d1f n PRO 62 Ca -0.06 0.30 -0.07 0.00 -2.02 0.00 0.00 63.50 61.64 3d1f n PRO 62 Cb 0.58 -1.76 -0.02 0.00 -0.02 0.00 0.00 33.50 32.28 3d1f n PRO 62 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3d1f s HIS 63 N -1.46 -0.14 -0.02 6.00 -3.43 -1.26 -4.18 115.29 110.81 3d1f s HIS 63 Ca 0.65 -0.30 0.01 0.00 -0.80 0.00 0.00 55.06 54.63 3d1f s HIS 63 Cb -0.54 0.64 0.01 0.00 -1.43 0.00 0.00 32.58 31.25 3d1f s HIS 63 CO 0.56 -1.19 -0.04 -1.21 -2.00 0.00 0.00 174.74 170.86 3d1f s GLU 64 N -3.92 0.49 0.76 -0.38 2.02 -0.37 -4.94 118.70 112.34 3d1f s GLU 64 Ca 0.12 -0.12 -0.14 0.00 0.02 0.00 0.00 54.97 54.85 3d1f s GLU 64 Cb -0.05 -0.51 0.05 0.00 0.10 0.00 0.00 34.13 33.72 3d1f s GLU 64 CO 0.06 0.02 1.20 -1.25 0.02 0.00 0.00 175.26 175.32 3d1f s PRO 65 N 0.31 1.97 0.00 0.39 0.04 -1.26 -1.60 135.00 134.85 3d1f s PRO 65 Ca -0.03 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.75 3d1f s PRO 65 Cb -0.07 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.66 3d1f s PRO 65 CO -0.00 -1.96 0.00 0.41 0.04 0.00 0.00 177.00 175.49 3d1f n GLY 66 N 0.37 -0.07 3.38 0.56 0.00 -0.93 -3.28 105.19 105.23 3d1f n GLY 66 Ca 0.13 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.45 3d1f n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1f s ALA 67 N -1.62 -1.28 0.18 4.61 0.00 -1.26 -0.58 121.76 121.80 3d1f s ALA 67 Ca 0.00 0.55 -0.23 0.00 0.00 0.00 0.00 51.96 52.28 3d1f s ALA 67 Cb 0.00 0.39 0.08 0.00 0.00 0.00 0.00 23.12 23.59 3d1f s ALA 67 CO 0.00 -0.51 1.03 -0.08 0.00 0.00 0.00 175.76 176.20 3d1f s THR 68 N -2.49 0.00 -0.01 0.00 -1.32 -0.57 -4.59 115.64 106.66 3d1f s THR 68 Ca -0.05 -0.60 0.03 0.00 -1.21 0.00 0.00 61.69 59.86 3d1f s THR 68 Cb -0.01 -2.76 -0.00 0.00 -1.51 0.00 0.00 72.50 68.22 3d1f s THR 68 CO -0.02 0.00 -0.09 0.42 -2.21 0.00 0.00 174.62 172.72 3d1f s THR 69 N -2.32 0.73 0.07 5.08 -4.23 -1.00 -0.33 115.64 113.64 3d1f s THR 69 Ca 0.20 -0.37 0.02 0.00 -1.18 0.00 0.00 61.69 60.36 3d1f s THR 69 Cb -0.02 -0.63 -0.03 0.00 1.34 0.00 0.00 72.50 73.15 3d1f s THR 69 CO 0.05 0.22 -0.07 0.68 -0.54 0.00 0.00 174.62 174.96 3d1f s VAL 70 N -0.04 0.58 -0.10 2.29 -7.23 -0.84 -2.16 120.40 112.90 3d1f s VAL 70 Ca 0.01 -1.52 -0.36 0.00 -1.81 0.00 0.00 61.98 58.30 3d1f s VAL 70 Cb -0.06 -1.15 -0.13 0.00 0.56 0.00 0.00 36.38 35.60 3d1f s VAL 70 CO -0.00 -0.65 1.77 -2.65 -0.31 0.00 0.00 175.10 173.26 3d1f n PRO 71 N 0.68 1.80 0.31 4.82 -0.02 -1.26 -0.71 135.00 140.62 3d1f n PRO 71 Ca -0.17 0.66 -0.16 0.00 -2.02 0.00 0.00 63.50 61.80 3d1f n PRO 71 Cb 0.58 -2.43 -0.09 0.00 -0.02 0.00 0.00 33.50 31.54 3d1f n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1f h ALA 72 N 7.93 -0.75 -0.33 3.55 0.00 -1.48 -2.48 119.26 125.68 3d1f h ALA 72 Ca -0.47 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.29 3d1f h ALA 72 Cb 1.29 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 3d1f h ALA 72 CO 0.93 -0.89 0.13 -0.09 0.00 0.00 0.00 179.25 179.34 3d1f h ARG 73 N -0.83 0.27 -0.48 0.00 9.65 -1.90 -0.94 114.38 120.15 3d1f h ARG 73 Ca -0.08 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.77 3d1f h ARG 73 Cb 0.61 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.10 3d1f h ARG 73 CO 0.13 0.18 0.23 0.87 2.80 0.00 0.00 179.97 184.18 3d1f h LYS 74 N 0.28 0.69 -0.60 0.20 1.57 -1.95 -0.56 116.57 116.21 3d1f h LYS 74 Ca 0.15 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.78 3d1f h LYS 74 Cb 0.10 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 3d1f h LYS 74 CO -0.14 0.58 0.21 0.35 -0.57 0.00 0.00 179.45 179.89 3d1f h PHE 75 N 0.63 0.94 -0.14 -1.35 3.57 -1.23 -1.03 116.94 118.33 3d1f h PHE 75 Ca 0.17 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3d1f h PHE 75 Cb 0.12 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 3d1f h PHE 75 CO -0.01 0.76 0.05 0.35 -2.23 0.00 0.00 178.31 177.23 3d1f h PHE 76 N 0.84 0.22 -0.97 0.41 3.57 -0.99 -2.19 116.94 117.83 3d1f h PHE 76 Ca 0.20 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.70 3d1f h PHE 76 Cb 0.24 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.87 3d1f h PHE 76 CO 0.01 0.32 0.64 -0.44 -2.23 0.00 0.00 178.31 176.61 3d1f h ASP 77 N 0.06 1.08 0.10 0.41 3.32 -0.90 0.55 116.42 121.03 3d1f h ASP 77 Ca 0.05 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 3d1f h ASP 77 Cb 0.20 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3d1f h ASP 77 CO -0.00 0.76 -0.05 0.40 -1.72 0.00 0.00 179.24 178.63 3d1f h ILE 78 N 1.26 0.95 -0.69 0.35 2.04 -1.01 0.98 117.51 121.40 3d1f h ILE 78 Ca 0.37 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 66.03 3d1f h ILE 78 Cb -0.07 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 3d1f h ILE 78 CO -0.10 0.05 0.37 0.00 0.00 0.00 0.00 178.15 178.47 3d1f h ARG 80 N 0.95 0.24 0.00 0.00 2.43 -0.77 -2.98 114.38 114.25 3d1f h ARG 80 Ca 0.24 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3d1f h ARG 80 Cb 0.05 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3d1f h ARG 80 CO -0.04 0.52 0.00 0.41 -1.51 0.00 0.00 179.97 179.36 3d1f n GLY 81 N -0.45 -1.62 3.82 2.80 0.00 0.33 -4.84 105.19 105.24 3d1f n GLY 81 Ca -0.01 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 3d1f n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d1f s LEU 82 N -4.47 3.41 0.69 0.99 1.43 -0.98 -5.01 118.68 114.74 3d1f s LEU 82 Ca 0.09 1.69 -0.16 0.00 -1.03 0.00 0.00 54.13 54.73 3d1f s LEU 82 Cb 0.12 -4.51 0.02 0.00 0.03 0.00 0.00 46.19 41.84 3d1f s LEU 82 CO 0.55 -1.09 1.19 -2.16 0.23 0.00 0.00 176.35 175.07 3d1f s PRO 83 N -4.39 2.41 0.29 1.29 0.04 -1.26 -4.92 135.00 128.46 3d1f s PRO 83 Ca 0.61 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 63.05 3d1f s PRO 83 Cb -0.14 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 3d1f s PRO 83 CO 0.41 -1.61 1.40 -1.91 0.04 0.00 0.00 177.00 175.33 3d1f n GLU 84 N -2.47 2.21 -0.50 4.56 2.13 -1.26 -1.69 120.64 123.62 3d1f n GLU 84 Ca 0.13 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.73 3d1f n GLU 84 Cb 0.50 -2.43 0.00 0.00 0.27 0.00 0.00 31.44 29.78 3d1f n GLU 84 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3d1f n GLY 85 N 1.56 1.53 3.76 8.31 0.00 -1.26 -5.02 105.19 114.07 3d1f n GLY 85 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3d1f n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1f s ALA 86 N -3.32 3.05 -0.23 4.61 0.00 -0.68 -4.75 121.76 120.43 3d1f s ALA 86 Ca 0.00 1.37 -0.13 0.00 0.00 0.00 0.00 51.96 53.20 3d1f s ALA 86 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 3d1f s ALA 86 CO 0.00 -1.22 0.28 -1.21 0.00 0.00 0.00 175.76 173.61 3d1f s GLU 87 N -2.64 4.09 -0.40 0.00 0.41 -1.26 -0.36 118.70 118.55 3d1f s GLU 87 Ca 0.65 -0.06 -0.10 0.00 -0.41 0.00 0.00 54.97 55.05 3d1f s GLU 87 Cb -0.41 -3.56 0.05 0.00 -1.78 0.00 0.00 34.13 28.43 3d1f s GLU 87 CO 0.51 -0.03 0.23 0.42 -0.49 0.00 0.00 175.26 175.90 3d1f s ILE 88 N 1.32 4.41 -0.08 -1.63 1.01 0.18 -4.37 121.20 122.05 3d1f s ILE 88 Ca 0.13 -1.12 -0.17 0.00 0.00 0.00 0.00 60.65 59.48 3d1f s ILE 88 Cb -0.14 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 3d1f s ILE 88 CO 0.07 -0.37 0.46 0.00 0.00 0.00 0.00 174.94 175.10 3d1f s ALA 89 N 1.49 3.54 -0.03 9.38 0.00 0.06 -1.60 121.76 134.61 3d1f s ALA 89 Ca 0.02 -0.19 0.05 0.00 0.00 0.00 0.00 51.96 51.84 3d1f s ALA 89 Cb -0.21 -2.57 -0.01 0.00 0.00 0.00 0.00 23.12 20.33 3d1f s ALA 89 CO 0.04 0.15 -0.17 0.08 0.00 0.00 0.00 175.76 175.87 3d1f s VAL 90 N 0.08 1.38 -0.09 0.00 1.01 0.11 -0.43 120.40 122.45 3d1f s VAL 90 Ca 0.25 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 3d1f s VAL 90 Cb -0.16 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 35.11 3d1f s VAL 90 CO 0.11 0.39 0.17 -1.58 0.00 0.00 0.00 175.10 174.20 3d1f s GLN 91 N -0.17 0.05 0.05 2.72 0.74 -0.14 -1.81 119.66 121.10 3d1f s GLN 91 Ca 0.01 0.57 -0.29 0.00 0.05 0.00 0.00 55.36 55.70 3d1f s GLN 91 Cb -0.09 -0.24 -0.05 0.00 1.10 0.00 0.00 33.01 33.73 3d1f s GLN 91 CO 0.01 -0.30 0.94 -1.17 -0.55 0.00 0.00 175.29 174.22 3d1f s LEU 92 N 2.25 4.43 -0.43 3.68 2.96 -0.39 -0.31 118.68 130.87 3d1f s LEU 92 Ca 0.02 1.69 0.08 0.00 -0.22 0.00 0.00 54.13 55.70 3d1f s LEU 92 Cb -0.12 -3.53 0.25 0.00 0.50 0.00 0.00 46.19 43.29 3d1f s LEU 92 CO -0.06 -0.14 0.55 -0.62 -1.32 0.00 0.00 176.35 174.76 3d1f n GLU 93 N 3.29 0.98 0.00 1.98 1.02 0.30 -4.63 120.64 123.59 3d1f n GLU 93 Ca 0.03 -3.44 0.00 0.00 -0.02 0.00 0.00 57.16 53.74 3d1f n GLU 93 Cb 0.50 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 3d1f n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d1f n GLY 94 N 1.32 2.92 0.00 0.62 0.00 -1.26 -2.67 105.19 106.12 3d1f n GLY 94 Ca 0.22 0.12 0.03 0.00 0.00 0.00 0.00 46.02 46.40 3d1f n GLY 94 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d1f n GLU 95 N 8.12 0.66 -3.76 1.61 1.02 -1.26 -4.74 120.64 122.29 3d1f n GLU 95 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 3d1f n GLU 95 Cb 0.00 -1.15 -0.08 0.00 -0.02 0.00 0.00 31.44 30.19 3d1f n GLU 95 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3d1f s ARG 96 N -2.00 0.73 -0.16 3.49 1.70 -1.09 -2.46 118.95 119.15 3d1f s ARG 96 Ca 0.10 -0.31 0.01 0.00 -0.47 0.00 0.00 55.73 55.05 3d1f s ARG 96 Cb 0.04 0.32 0.01 0.00 -0.57 0.00 0.00 34.95 34.76 3d1f s ARG 96 CO 0.07 -0.21 -0.19 1.41 -1.08 0.00 0.00 175.30 175.30 3d1f s MET 97 N -1.82 3.05 0.14 3.89 -2.45 0.05 -0.54 119.30 121.63 3d1f s MET 97 Ca -0.10 -0.82 -0.16 0.00 -1.25 0.00 0.00 55.69 53.36 3d1f s MET 97 Cb -0.03 -2.56 -0.07 0.00 1.25 0.00 0.00 34.83 33.42 3d1f s MET 97 CO 0.01 -0.11 0.57 -0.51 1.05 0.00 0.00 175.02 176.03 3d1f s LEU 98 N 1.07 4.38 -0.05 4.11 1.43 0.57 -1.28 118.68 128.91 3d1f s LEU 98 Ca -0.01 1.15 0.02 0.00 -1.03 0.00 0.00 54.13 54.26 3d1f s LEU 98 Cb -0.14 -3.22 0.01 0.00 0.03 0.00 0.00 46.19 42.87 3d1f s LEU 98 CO -0.07 0.13 -0.09 -0.69 0.23 0.00 0.00 176.35 175.86 3d1f s VAL 99 N -1.39 0.89 -0.02 -1.59 1.01 0.11 -0.96 120.40 118.45 3d1f s VAL 99 Ca 0.36 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 3d1f s VAL 99 Cb -0.16 -0.83 0.01 0.00 0.00 0.00 0.00 36.38 35.40 3d1f s VAL 99 CO 0.19 0.29 0.05 -0.60 0.00 0.00 0.00 175.10 175.03 3d1f s ARG 100 N 0.59 0.03 -0.17 2.72 3.52 0.43 -0.55 118.95 125.51 3d1f s ARG 100 Ca -0.11 0.12 -0.05 0.00 -0.13 0.00 0.00 55.73 55.56 3d1f s ARG 100 Cb -0.14 -0.07 0.08 0.00 -1.56 0.00 0.00 34.95 33.27 3d1f s ARG 100 CO 0.02 -0.06 0.33 0.45 -0.81 0.00 0.00 175.30 175.23 3d1f s SER 101 N 0.41 0.17 1.95 -2.12 0.15 -0.50 -0.76 113.70 113.00 3d1f s SER 101 Ca -0.03 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.27 3d1f s SER 101 Cb -0.05 0.97 0.00 0.00 -1.71 0.00 0.00 66.02 65.24 3d1f s SER 101 CO -0.01 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.79 3d1f n GLY 102 N 5.37 4.00 1.43 9.45 0.00 -1.26 -0.53 105.19 123.64 3d1f n GLY 102 Ca -0.07 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 3d1f n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d1f n ARG 103 N 14.00 2.24 -3.77 1.61 1.74 -1.26 -4.91 116.66 126.32 3d1f n ARG 103 Ca 0.00 -3.40 -0.37 0.00 -0.77 0.00 0.00 57.85 53.31 3d1f n ARG 103 Cb 0.00 -1.95 -0.13 0.00 -1.02 0.00 0.00 32.46 29.37 3d1f n ARG 103 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3d1f s SER 104 N -2.71 5.08 0.01 0.55 0.01 0.31 -5.10 113.70 111.86 3d1f s SER 104 Ca 0.48 -0.67 0.07 0.00 1.31 0.00 0.00 55.95 57.14 3d1f s SER 104 Cb 0.42 -1.87 -0.02 0.00 0.21 0.00 0.00 66.02 64.75 3d1f s SER 104 CO -0.00 -0.18 -0.22 -0.13 0.41 0.00 0.00 173.24 173.12 3d1f s ARG 105 N 1.50 1.69 0.03 12.44 0.52 -1.26 -1.41 118.95 132.47 3d1f s ARG 105 Ca 0.03 -0.88 -0.03 0.00 -0.52 0.00 0.00 55.73 54.32 3d1f s ARG 105 Cb -0.17 -1.72 -0.02 0.00 0.52 0.00 0.00 34.95 33.57 3d1f s ARG 105 CO 0.02 0.46 0.04 -0.06 0.02 0.00 0.00 175.30 175.78 3d1f s PHE 106 N -0.64 0.25 -0.12 -0.53 0.40 0.28 -5.00 117.98 112.62 3d1f s PHE 106 Ca 0.09 -0.55 -0.01 0.00 -0.60 0.00 0.00 56.93 55.85 3d1f s PHE 106 Cb -0.09 -0.18 0.04 0.00 0.51 0.00 0.00 43.02 43.29 3d1f s PHE 106 CO 0.00 -0.31 -0.02 0.45 0.70 0.00 0.00 175.22 176.05 3d1f s SER 107 N -1.96 2.22 -0.02 1.36 0.15 -1.26 -0.71 113.70 113.47 3d1f s SER 107 Ca -0.08 -0.39 0.02 0.00 0.70 0.00 0.00 55.95 56.20 3d1f s SER 107 Cb -0.03 -0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 63.59 3d1f s SER 107 CO -0.04 -0.20 -0.04 -0.76 1.20 0.00 0.00 173.24 173.41 3d1f s LEU 108 N 1.82 3.30 0.24 3.45 1.43 -0.41 -4.91 118.68 123.60 3d1f s LEU 108 Ca 0.03 -0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 52.79 3d1f s LEU 108 Cb -0.14 -1.84 -0.09 0.00 0.03 0.00 0.00 46.19 44.16 3d1f s LEU 108 CO -0.07 0.31 1.20 -0.94 0.23 0.00 0.00 176.35 177.09 3d1f s SER 109 N -1.25 7.06 0.43 2.29 1.04 -1.26 -0.77 113.70 121.24 3d1f s SER 109 Ca 0.16 2.34 0.07 0.00 0.48 0.00 0.00 55.95 59.00 3d1f s SER 109 Cb -0.11 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.35 3d1f s SER 109 CO 0.06 -0.36 0.21 0.42 0.98 0.00 0.00 173.24 174.55 3d1f s THR 110 N -0.51 2.22 -0.00 2.02 -4.23 -1.03 -4.20 115.64 109.92 3d1f s THR 110 Ca 0.50 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 3d1f s THR 110 Cb -0.34 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 70.61 3d1f s THR 110 CO 0.41 0.00 -0.00 -0.76 -0.54 0.00 0.00 174.62 173.73 3d1f s LEU 111 N -3.95 1.96 0.18 4.79 1.43 -0.92 -4.90 118.68 117.27 3d1f s LEU 111 Ca 0.39 -0.00 -0.32 0.00 -1.03 0.00 0.00 54.13 53.17 3d1f s LEU 111 Cb 0.03 -0.02 -0.16 0.00 0.03 0.00 0.00 46.19 46.07 3d1f s LEU 111 CO 0.22 -0.00 1.07 -2.65 0.23 0.00 0.00 176.35 175.22 3d1f n PRO 112 N 3.12 0.98 0.24 1.29 -0.02 -1.26 -2.38 135.00 136.97 3d1f n PRO 112 Ca -0.13 0.35 0.07 0.00 -2.02 0.00 0.00 63.50 61.77 3d1f n PRO 112 Cb 0.59 -1.78 0.58 0.00 -0.02 0.00 0.00 33.50 32.88 3d1f n PRO 112 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1f h ALA 113 N 2.93 1.81 0.00 3.55 0.00 -1.85 -0.62 119.26 125.08 3d1f h ALA 113 Ca -0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 3d1f h ALA 113 Cb 1.36 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 3d1f h ALA 113 CO 0.67 0.12 -0.07 0.00 0.00 0.00 0.00 179.25 179.98 3d1f h ALA 114 N 1.90 1.10 0.00 0.00 0.00 -1.94 -2.16 119.26 118.15 3d1f h ALA 114 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3d1f h ALA 114 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3d1f h ALA 114 CO 0.01 0.08 -0.08 -0.44 0.00 0.00 0.00 179.25 178.82 3d1f h ASP 115 N 0.00 0.00 -2.63 0.00 5.19 -1.46 -3.46 116.42 114.07 3d1f h ASP 115 Ca -0.00 -0.01 -0.54 0.00 -0.62 0.00 0.00 57.03 55.86 3d1f h ASP 115 Cb 0.37 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.90 3d1f h ASP 115 CO 0.01 0.01 1.05 0.12 -3.12 0.00 0.00 179.24 177.31 3d1f s PHE 116 N -3.16 2.17 -0.20 4.55 5.36 -0.82 -4.95 117.98 120.94 3d1f s PHE 116 Ca 0.08 0.19 -0.29 0.00 -0.96 0.00 0.00 56.93 55.95 3d1f s PHE 116 Cb 0.09 -3.99 -0.01 0.00 -0.34 0.00 0.00 43.02 38.78 3d1f s PHE 116 CO 0.64 -4.10 1.20 -2.14 -1.46 0.00 0.00 175.22 169.36 3d1f s PRO 117 N 3.19 4.22 0.13 10.12 0.02 -1.26 -5.04 135.00 146.38 3d1f s PRO 117 Ca 0.76 1.54 0.09 0.00 0.02 0.00 0.00 61.00 63.40 3d1f s PRO 117 Cb -0.39 -3.73 -0.04 0.00 0.02 0.00 0.00 34.50 30.36 3d1f s PRO 117 CO 0.33 -0.71 -0.15 -0.80 -0.33 0.00 0.00 177.00 175.33 3d1f s ASN 118 N 1.79 4.03 0.62 2.53 -0.87 -1.26 -4.88 114.94 116.89 3d1f s ASN 118 Ca 0.51 -0.54 -0.18 0.00 -1.57 0.00 0.00 52.86 51.09 3d1f s ASN 118 Cb -0.19 -0.62 -0.02 0.00 -0.02 0.00 0.00 41.25 40.40 3d1f s ASN 118 CO 0.12 0.16 1.17 -0.76 -2.57 0.00 0.00 177.10 175.23 3d1f s LEU 119 N -2.30 3.57 0.55 0.60 1.43 -1.26 -4.99 118.68 116.28 3d1f s LEU 119 Ca 0.20 2.26 -0.18 0.00 -1.03 0.00 0.00 54.13 55.38 3d1f s LEU 119 Cb -0.10 -4.58 -0.05 0.00 0.03 0.00 0.00 46.19 41.48 3d1f s LEU 119 CO 0.12 -1.64 1.09 -1.81 0.23 0.00 0.00 176.35 174.34 3d1f s ASP 120 N -1.90 5.84 0.64 2.29 1.11 -1.26 -4.99 116.67 118.40 3d1f s ASP 120 Ca 0.74 2.02 -0.17 0.00 0.18 0.00 0.00 52.55 55.32 3d1f s ASP 120 Cb -0.27 -2.56 -0.01 0.00 1.07 0.00 0.00 42.92 41.15 3d1f s ASP 120 CO 0.35 -1.13 1.19 1.51 1.18 0.00 0.00 175.17 178.27 3d1f s ASP 121 N -2.11 4.89 0.30 0.27 -4.77 -1.26 -5.04 116.67 108.96 3d1f s ASP 121 Ca 0.69 2.30 -0.08 0.00 -3.30 0.00 0.00 52.55 52.16 3d1f s ASP 121 Cb -0.20 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 39.05 3d1f s ASP 121 CO 0.28 -1.79 0.49 -1.66 0.70 0.00 0.00 175.17 173.19 3d1f s TRP 122 N -1.85 0.72 -0.05 2.11 1.48 -1.26 -5.17 118.94 114.92 3d1f s TRP 122 Ca 0.74 -1.04 0.06 0.00 -1.06 0.00 0.00 56.10 54.81 3d1f s TRP 122 Cb -0.28 0.08 -0.01 0.00 -1.16 0.00 0.00 33.47 32.10 3d1f s TRP 122 CO 0.38 -1.10 -0.25 -0.65 -4.06 0.00 0.00 176.95 171.27 3d1f s GLN 123 N -3.40 2.40 0.25 3.25 -1.52 -1.26 -5.12 119.66 114.27 3d1f s GLN 123 Ca 0.27 -0.89 -0.30 0.00 -1.95 0.00 0.00 55.36 52.49 3d1f s GLN 123 Cb -0.01 -2.09 -0.09 0.00 -0.22 0.00 0.00 33.01 30.60 3d1f s GLN 123 CO 0.15 0.41 0.98 0.45 -0.25 0.00 0.00 175.29 177.03 3d1f s SER 124 N -0.25 7.53 -0.02 5.90 0.15 -1.26 -4.27 113.70 121.49 3d1f s SER 124 Ca -0.01 2.03 0.06 0.00 0.70 0.00 0.00 55.95 58.74 3d1f s SER 124 Cb -0.13 -2.61 -0.10 0.00 -1.71 0.00 0.00 66.02 61.47 3d1f s SER 124 CO 0.03 0.07 0.13 -0.62 1.20 0.00 0.00 173.24 174.04 3d1f n GLU 125 N 1.37 0.57 -4.08 5.44 1.02 0.13 -4.93 120.64 120.16 3d1f n GLU 125 Ca -0.02 -0.05 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 3d1f n GLU 125 Cb 0.47 -1.16 -0.13 0.00 -0.02 0.00 0.00 31.44 30.60 3d1f n GLU 125 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3d1f s VAL 126 N -2.41 0.36 -0.13 2.62 1.01 -0.46 -4.99 120.40 116.40 3d1f s VAL 126 Ca -0.02 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 3d1f s VAL 126 Cb 0.04 -0.36 0.04 0.00 0.00 0.00 0.00 36.38 36.10 3d1f s VAL 126 CO 0.27 -0.08 0.34 -1.61 0.00 0.00 0.00 175.10 174.02 3d1f s GLU 127 N -0.60 0.37 0.22 2.72 2.02 -1.26 -0.38 118.70 121.79 3d1f s GLU 127 Ca -0.03 0.55 -0.22 0.00 0.02 0.00 0.00 54.97 55.30 3d1f s GLU 127 Cb -0.04 0.10 0.04 0.00 0.10 0.00 0.00 34.13 34.33 3d1f s GLU 127 CO -0.00 -0.09 0.64 -0.59 0.02 0.00 0.00 175.26 175.25 3d1f s PHE 128 N 0.60 -0.35 0.10 1.61 -0.12 -0.69 -5.02 117.98 114.11 3d1f s PHE 128 Ca -0.03 0.02 0.05 0.00 -0.05 0.00 0.00 56.93 56.92 3d1f s PHE 128 Cb -0.05 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 3d1f s PHE 128 CO -0.04 -1.03 -0.14 0.95 -0.05 0.00 0.00 175.22 174.92 3d1f s THR 129 N -3.84 1.20 0.20 -4.49 -4.23 -1.26 -0.80 115.64 102.43 3d1f s THR 129 Ca 0.06 -1.52 -0.23 0.00 -1.18 0.00 0.00 61.69 58.82 3d1f s THR 129 Cb -0.03 -1.31 0.05 0.00 1.34 0.00 0.00 72.50 72.55 3d1f s THR 129 CO -0.03 -0.34 0.76 -1.48 -0.54 0.00 0.00 174.62 172.99 3d1f s LEU 130 N -2.12 -0.31 0.34 4.79 2.34 -0.37 -4.96 118.68 118.38 3d1f s LEU 130 Ca 0.04 -0.39 -0.28 0.00 0.06 0.00 0.00 54.13 53.56 3d1f s LEU 130 Cb -0.07 2.52 -0.09 0.00 -0.56 0.00 0.00 46.19 47.98 3d1f s LEU 130 CO 0.02 -1.11 1.16 -2.84 -1.06 0.00 0.00 176.35 172.52 3d1f s PRO 131 N -3.68 4.36 0.33 1.48 0.02 -1.26 0.98 135.00 137.24 3d1f s PRO 131 Ca 0.09 1.88 0.07 0.00 0.02 0.00 0.00 61.00 63.06 3d1f s PRO 131 Cb -0.04 -2.95 0.74 0.00 0.02 0.00 0.00 34.50 32.27 3d1f s PRO 131 CO 0.01 -0.07 1.86 1.96 -0.33 0.00 0.00 177.00 180.43 3d1f h GLN 132 N 3.25 0.76 -0.80 5.54 4.20 -1.56 -0.93 115.11 125.57 3d1f h GLN 132 Ca -0.48 -0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.29 3d1f h GLN 132 Cb 1.22 -0.17 -0.05 0.00 0.30 0.00 0.00 27.48 28.78 3d1f h GLN 132 CO 0.65 0.50 0.52 0.00 -0.67 0.00 0.00 178.83 179.83 3d1f h ALA 133 N 1.58 1.78 -0.11 3.87 0.00 -1.87 0.67 119.26 125.18 3d1f h ALA 133 Ca 0.46 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.32 3d1f h ALA 133 Cb 0.64 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3d1f h ALA 133 CO -0.22 0.05 -0.11 1.15 0.00 0.00 0.00 179.25 180.12 3d1f h THR 134 N 0.71 1.36 -0.79 0.00 2.02 -1.50 -1.23 112.91 113.48 3d1f h THR 134 Ca 0.37 -1.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 3d1f h THR 134 Cb 0.47 1.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.79 3d1f h THR 134 CO -0.14 0.36 0.33 -0.03 0.37 0.00 0.00 175.52 176.41 3d1f h MET 135 N -0.12 1.17 -0.70 6.66 -1.53 -1.32 -0.92 114.93 118.17 3d1f h MET 135 Ca 0.02 -0.20 -0.03 0.00 -3.44 0.00 0.00 59.70 56.05 3d1f h MET 135 Cb 0.63 -0.19 -0.03 0.00 -0.55 0.00 0.00 31.60 31.45 3d1f h MET 135 CO 0.03 0.94 0.33 -0.22 0.14 0.00 0.00 176.91 178.12 3d1f h LYS 136 N 1.14 1.02 -0.24 0.39 3.64 -0.82 -1.70 116.57 120.00 3d1f h LYS 136 Ca 0.27 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3d1f h LYS 136 Cb 0.20 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3d1f h LYS 136 CO -0.02 0.81 0.04 -0.09 -2.27 0.00 0.00 179.45 177.92 3d1f h ARG 137 N 0.99 0.39 -0.91 1.90 9.65 -0.71 -0.53 114.38 125.16 3d1f h ARG 137 Ca 0.24 -0.10 0.08 0.00 -1.10 0.00 0.00 59.98 59.10 3d1f h ARG 137 Cb 0.14 -0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.60 3d1f h ARG 137 CO -0.03 0.52 0.56 -0.07 2.80 0.00 0.00 179.97 183.75 3d1f h LEU 138 N 0.20 0.87 0.03 3.80 3.38 -0.97 -1.02 115.31 121.60 3d1f h LEU 138 Ca 0.07 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3d1f h LEU 138 Cb 0.31 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3d1f h LEU 138 CO 0.00 0.53 -0.02 0.40 0.09 0.00 0.00 178.44 179.44 3d1f h ILE 139 N 0.99 1.39 -0.16 1.22 2.04 -1.17 -3.28 117.51 118.54 3d1f h ILE 139 Ca 0.41 -1.63 -0.00 0.00 1.00 0.00 0.00 64.86 64.64 3d1f h ILE 139 Cb 0.26 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.77 3d1f h ILE 139 CO -0.20 0.40 0.09 -0.33 0.00 0.00 0.00 178.15 178.10 3d1f h GLU 140 N -0.79 0.22 0.00 2.37 5.08 -1.02 0.13 114.58 120.56 3d1f h GLU 140 Ca -0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3d1f h GLU 140 Cb 0.69 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 3d1f h GLU 140 CO 0.01 0.16 -0.04 0.00 -1.00 0.00 0.00 179.01 178.14 3d1f h ALA 141 N 1.88 1.01 0.00 3.43 0.00 -1.27 -3.37 119.26 120.94 3d1f h ALA 141 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3d1f h ALA 141 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3d1f h ALA 141 CO -0.01 0.05 -0.48 0.25 0.00 0.00 0.00 179.25 179.06 3d1f n THR 142 N -3.16 0.00 -0.26 0.00 -2.24 -0.79 -4.82 114.28 103.01 3d1f n THR 142 Ca 0.00 -0.06 0.19 0.00 -2.27 0.00 0.00 64.05 61.92 3d1f n THR 142 Cb 0.32 0.43 0.50 0.00 -2.10 0.00 0.00 70.33 69.48 3d1f n THR 142 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 3d1f h GLN 143 N 0.00 0.41 0.00 -0.78 -0.00 -0.94 -1.50 115.11 112.30 3d1f h GLN 143 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 3d1f h GLN 143 Cb 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 27.48 27.39 3d1f h GLN 143 CO 0.00 0.27 0.00 1.97 -0.00 0.00 0.00 178.83 181.07 3d1f n PHE 144 N -4.53 0.58 1.30 0.06 -1.74 -1.26 -2.20 117.46 109.67 3d1f n PHE 144 Ca 0.20 0.26 0.13 0.00 -0.56 0.00 0.00 57.45 57.49 3d1f n PHE 144 Cb 0.71 -0.92 0.36 0.00 1.52 0.00 0.00 39.48 41.15 3d1f n PHE 144 CO 0.00 0.00 0.00 0.43 -0.56 0.00 0.00 176.76 176.63 3d1f n SER 145 N -2.06 2.08 -4.77 5.98 7.64 -0.57 -4.94 113.62 116.98 3d1f n SER 145 Ca 0.01 -1.69 -0.36 0.00 1.01 0.00 0.00 58.87 57.83 3d1f n SER 145 Cb 0.12 -0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.30 3d1f n SER 145 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3d1f s MET 146 N -1.99 3.66 0.74 1.43 -1.94 -0.93 -2.31 119.30 117.95 3d1f s MET 146 Ca 0.34 1.69 -0.11 0.00 -1.71 0.00 0.00 55.69 55.90 3d1f s MET 146 Cb 0.21 -2.28 0.03 0.00 2.01 0.00 0.00 34.83 34.80 3d1f s MET 146 CO 0.32 -0.62 1.08 0.00 -0.01 0.00 0.00 175.02 175.79 3d1f s ALA 147 N -1.64 2.53 -0.18 3.03 0.00 -0.36 -4.77 121.76 120.38 3d1f s ALA 147 Ca 0.66 -0.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.35 3d1f s ALA 147 Cb -0.26 -3.12 -0.07 0.00 0.00 0.00 0.00 23.12 19.67 3d1f s ALA 147 CO 0.31 -1.41 -0.32 0.72 0.00 0.00 0.00 175.76 175.06 3d1f n HIS 148 N -3.23 0.00 -2.66 0.00 8.25 -1.26 -4.34 115.22 111.98 3d1f n HIS 148 Ca 0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.46 3d1f n HIS 148 Cb 0.55 -0.56 0.04 0.00 1.12 0.00 0.00 29.99 31.14 3d1f n HIS 148 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3d1f n GLN 149 N -4.32 1.92 -2.36 -0.41 6.02 -1.26 -4.88 117.38 112.09 3d1f n GLN 149 Ca -0.21 -3.59 -0.39 0.00 -0.01 0.00 0.00 57.00 52.80 3d1f n GLN 149 Cb 0.56 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 3d1f n GLN 149 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3d1f s ASP 150 N -3.57 6.90 0.56 1.08 -1.08 -1.26 -4.90 116.67 114.40 3d1f s ASP 150 Ca 0.32 2.34 0.27 0.00 -0.52 0.00 0.00 52.55 54.96 3d1f s ASP 150 Cb 0.38 -2.62 1.65 0.00 -1.46 0.00 0.00 42.92 40.87 3d1f s ASP 150 CO -0.02 -0.41 2.19 1.62 0.52 0.00 0.00 175.17 179.07 3d1f h VAL 151 N 2.75 0.60 -1.32 1.11 3.04 -2.03 -3.24 116.25 117.17 3d1f h VAL 151 Ca -0.48 -0.16 -0.65 0.00 -1.01 0.00 0.00 66.70 64.40 3d1f h VAL 151 Cb 1.22 1.10 -0.11 0.00 -2.01 0.00 0.00 31.29 31.49 3d1f h VAL 151 CO 0.65 0.04 1.63 -0.13 -1.01 0.00 0.00 177.57 178.75 3d1f s ARG 152 N -4.56 3.78 0.33 4.17 0.52 -1.26 -4.85 118.95 117.08 3d1f s ARG 152 Ca -0.04 -1.66 0.12 0.00 -0.52 0.00 0.00 55.73 53.62 3d1f s ARG 152 Cb 0.15 -5.33 1.01 0.00 0.52 0.00 0.00 34.95 31.30 3d1f s ARG 152 CO 0.57 -2.12 1.68 1.88 0.02 0.00 0.00 175.30 177.33 3d1f h TYR 153 N 8.63 0.90 0.00 -0.53 0.05 -1.92 -0.89 116.97 123.20 3d1f h TYR 153 Ca 0.29 0.04 0.00 0.00 0.05 0.00 0.00 58.73 59.11 3d1f h TYR 153 Cb 0.95 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.46 3d1f h TYR 153 CO 1.30 -0.13 0.00 2.48 -1.05 0.00 0.00 178.16 180.76 3d1f n TYR 154 N -5.03 0.20 0.72 4.88 0.18 -1.26 -1.41 117.16 115.44 3d1f n TYR 154 Ca 0.30 0.10 0.11 0.00 1.88 0.00 0.00 57.90 60.29 3d1f n TYR 154 Cb 0.90 -0.65 0.09 0.00 -0.38 0.00 0.00 39.34 39.30 3d1f n TYR 154 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3d1f n LEU 155 N -1.70 0.63 -2.61 -3.48 4.77 -0.34 -4.33 117.00 109.95 3d1f n LEU 155 Ca 0.01 -0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.69 3d1f n LEU 155 Cb 0.06 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 40.94 3d1f n LEU 155 CO 0.06 0.07 1.84 0.59 -1.33 0.00 0.00 177.39 178.62 3d1f n ASN 156 N -1.82 6.62 0.00 -1.43 5.03 -0.50 -1.22 115.26 121.94 3d1f n ASN 156 Ca 0.03 -3.01 0.00 0.00 0.87 0.00 0.00 54.58 52.47 3d1f n ASN 156 Cb 0.40 -1.31 0.00 0.00 -1.02 0.00 0.00 39.78 37.85 3d1f n ASN 156 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d1f n GLY 157 N 1.51 -1.02 3.07 7.41 0.00 -1.26 -1.01 105.19 113.90 3d1f n GLY 157 Ca 0.52 -0.74 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 3d1f n GLY 157 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3d1f s MET 158 N -0.03 1.25 -0.02 1.61 1.75 -0.02 -4.71 119.30 119.13 3d1f s MET 158 Ca 0.00 -0.45 -0.28 0.00 -1.25 0.00 0.00 55.69 53.71 3d1f s MET 158 Cb 0.00 -1.15 -0.03 0.00 2.84 0.00 0.00 34.83 36.49 3d1f s MET 158 CO 0.00 0.21 0.88 -1.17 -0.65 0.00 0.00 175.02 174.29 3d1f s LEU 159 N -0.02 4.36 -0.22 4.11 2.96 -0.04 -0.54 118.68 129.28 3d1f s LEU 159 Ca -0.00 1.50 -0.02 0.00 -0.22 0.00 0.00 54.13 55.38 3d1f s LEU 159 Cb -0.08 -3.40 0.00 0.00 0.50 0.00 0.00 46.19 43.21 3d1f s LEU 159 CO 0.01 -0.19 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.40 3d1f s PHE 160 N 0.86 2.94 -0.05 5.38 0.40 0.70 -1.67 117.98 126.54 3d1f s PHE 160 Ca 0.47 -1.20 0.02 0.00 -0.60 0.00 0.00 56.93 55.62 3d1f s PHE 160 Cb -0.20 -2.06 0.01 0.00 0.51 0.00 0.00 43.02 41.28 3d1f s PHE 160 CO 0.25 -0.64 -0.10 -2.00 0.70 0.00 0.00 175.22 173.43 3d1f s GLU 161 N 1.41 1.35 -0.15 0.44 2.12 0.82 -1.44 118.70 123.26 3d1f s GLU 161 Ca 0.05 -0.31 -0.04 0.00 0.36 0.00 0.00 54.97 55.03 3d1f s GLU 161 Cb -0.14 -1.18 -0.03 0.00 0.26 0.00 0.00 34.13 33.04 3d1f s GLU 161 CO -0.05 0.01 -0.02 0.95 -0.54 0.00 0.00 175.26 175.60 3d1f s THR 162 N 0.66 4.02 -0.17 -1.70 -4.23 -0.20 0.50 115.64 114.51 3d1f s THR 162 Ca -0.12 -0.32 -0.07 0.00 -1.18 0.00 0.00 61.69 60.00 3d1f s THR 162 Cb -0.14 -2.76 0.07 0.00 1.34 0.00 0.00 72.50 71.01 3d1f s THR 162 CO 0.02 0.50 0.37 -0.70 -0.54 0.00 0.00 174.62 174.28 3d1f s GLU 163 N 0.20 0.30 6.88 3.99 2.12 -0.30 -1.91 118.70 129.98 3d1f s GLU 163 Ca -0.01 0.85 0.00 0.00 0.36 0.00 0.00 54.97 56.16 3d1f s GLU 163 Cb -0.14 0.09 0.00 0.00 0.26 0.00 0.00 34.13 34.35 3d1f s GLU 163 CO 0.03 -0.21 0.00 0.41 -0.54 0.00 0.00 175.26 174.94 3d1f n GLY 164 N 4.86 2.50 0.36 -1.50 0.00 -1.22 -0.91 105.19 109.28 3d1f n GLY 164 Ca -0.15 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3d1f n GLY 164 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d1f n GLU 165 N 5.96 1.62 -4.72 1.61 1.02 -1.26 0.01 120.64 124.88 3d1f n GLU 165 Ca 0.00 -2.80 -0.30 0.00 -0.02 0.00 0.00 57.16 54.04 3d1f n GLU 165 Cb 0.00 -1.60 -0.14 0.00 -0.02 0.00 0.00 31.44 29.69 3d1f n GLU 165 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3d1f s GLU 166 N -2.97 1.73 -0.15 3.49 2.02 -0.09 0.17 118.70 122.91 3d1f s GLU 166 Ca 0.35 -1.16 -0.01 0.00 0.02 0.00 0.00 54.97 54.17 3d1f s GLU 166 Cb 0.31 -1.99 -0.02 0.00 0.10 0.00 0.00 34.13 32.54 3d1f s GLU 166 CO 0.02 0.50 -0.10 -1.17 0.02 0.00 0.00 175.26 174.52 3d1f s LEU 167 N -1.52 2.82 0.06 1.80 2.96 -0.34 -1.15 118.68 123.31 3d1f s LEU 167 Ca 0.13 -0.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.80 3d1f s LEU 167 Cb -0.10 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 3d1f s LEU 167 CO 0.04 0.14 -0.17 -0.60 -1.32 0.00 0.00 176.35 174.43 3d1f s ARG 168 N 0.52 1.10 0.03 1.98 3.52 0.18 -1.32 118.95 124.96 3d1f s ARG 168 Ca -0.07 -0.92 0.08 0.00 -0.13 0.00 0.00 55.73 54.69 3d1f s ARG 168 Cb -0.15 -1.19 -0.02 0.00 -1.56 0.00 0.00 34.95 32.02 3d1f s ARG 168 CO 0.04 0.29 -0.23 0.95 -0.81 0.00 0.00 175.30 175.53 3d1f s THR 169 N -0.95 1.87 -0.00 4.11 -4.23 0.38 -0.13 115.64 116.70 3d1f s THR 169 Ca 0.04 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.33 3d1f s THR 169 Cb -0.09 -1.60 -0.00 0.00 1.34 0.00 0.00 72.50 72.15 3d1f s THR 169 CO 0.02 0.33 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.72 3d1f s VAL 170 N -0.75 0.15 -0.08 2.29 1.01 -0.67 -1.48 120.40 120.87 3d1f s VAL 170 Ca 0.09 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 3d1f s VAL 170 Cb -0.09 -0.14 0.02 0.00 0.00 0.00 0.00 36.38 36.17 3d1f s VAL 170 CO 0.01 0.02 0.20 0.00 0.00 0.00 0.00 175.10 175.34 3d1f s ALA 171 N -0.10 -0.50 0.02 5.51 0.00 -0.50 -0.87 121.76 125.32 3d1f s ALA 171 Ca 0.00 0.60 -0.26 0.00 0.00 0.00 0.00 51.96 52.31 3d1f s ALA 171 Cb -0.01 -0.35 0.06 0.00 0.00 0.00 0.00 23.12 22.82 3d1f s ALA 171 CO -0.00 -0.10 0.59 -0.08 0.00 0.00 0.00 175.76 176.16 3d1f s THR 172 N 0.20 0.01 -0.08 0.00 -1.32 -1.07 -0.67 115.64 112.71 3d1f s THR 172 Ca -0.01 -0.12 0.12 0.00 -1.21 0.00 0.00 61.69 60.47 3d1f s THR 172 Cb -0.02 -0.97 0.18 0.00 -1.51 0.00 0.00 72.50 70.18 3d1f s THR 172 CO -0.00 -0.07 1.07 -0.90 -2.21 0.00 0.00 174.62 172.51 3d1f n ASP 173 N 0.55 1.81 0.00 8.08 5.75 -0.98 -3.50 116.55 128.26 3d1f n ASP 173 Ca -0.19 -2.64 0.00 0.00 -0.01 0.00 0.00 54.79 51.96 3d1f n ASP 173 Cb 0.59 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 3d1f n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d1f n GLY 174 N -0.99 3.06 0.06 6.12 0.00 -1.26 -4.75 105.19 107.44 3d1f n GLY 174 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 3d1f n GLY 174 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3d1f n HIS 175 N -2.00 0.00 -3.90 1.61 8.25 -1.26 -4.97 115.22 112.95 3d1f n HIS 175 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 3d1f n HIS 175 Cb 0.00 -0.58 -0.08 0.00 1.12 0.00 0.00 29.99 30.45 3d1f n HIS 175 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3d1f s ARG 176 N -2.29 0.76 0.03 -0.41 1.04 -1.26 -1.21 118.95 115.61 3d1f s ARG 176 Ca -0.11 -0.94 0.00 0.00 -1.04 0.00 0.00 55.73 53.64 3d1f s ARG 176 Cb 0.04 0.30 -0.02 0.00 -2.04 0.00 0.00 34.95 33.23 3d1f s ARG 176 CO 0.43 -0.22 -0.04 -1.17 -0.04 0.00 0.00 175.30 174.26 3d1f s LEU 177 N -2.70 2.27 -0.02 -1.89 0.20 0.72 -2.39 118.68 114.88 3d1f s LEU 177 Ca 0.03 -0.57 0.02 0.00 0.69 0.00 0.00 54.13 54.30 3d1f s LEU 177 Cb 0.04 0.05 0.00 0.00 -0.43 0.00 0.00 46.19 45.85 3d1f s LEU 177 CO -0.09 -0.31 -0.08 0.00 -0.29 0.00 0.00 176.35 175.58 3d1f s ALA 178 N -1.73 0.74 -0.01 5.97 0.00 0.15 -0.98 121.76 125.90 3d1f s ALA 178 Ca -0.12 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 51.57 3d1f s ALA 178 Cb -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3d1f s ALA 178 CO -0.02 0.12 -0.02 0.54 0.00 0.00 0.00 175.76 176.38 3d1f s VAL 179 N 0.18 0.19 -0.06 0.00 0.11 -0.28 -1.41 120.40 119.13 3d1f s VAL 179 Ca -0.02 -0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 58.90 3d1f s VAL 179 Cb -0.07 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.61 3d1f s VAL 179 CO 0.00 0.07 0.16 0.00 -3.33 0.00 0.00 175.10 172.00 3d1f s SER 181 N 0.33 1.06 -0.02 0.00 1.04 -0.39 -0.47 113.70 115.25 3d1f s SER 181 Ca -0.02 -0.38 -0.04 0.00 0.48 0.00 0.00 55.95 55.99 3d1f s SER 181 Cb -0.03 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.04 3d1f s SER 181 CO -0.01 -0.04 0.08 -0.32 0.98 0.00 0.00 173.24 173.92 3d1f s MET 182 N -1.00 0.22 0.28 4.02 1.75 -0.44 -4.79 119.30 119.35 3d1f s MET 182 Ca -0.03 -0.11 -0.29 0.00 -1.25 0.00 0.00 55.69 54.01 3d1f s MET 182 Cb -0.07 0.09 -0.10 0.00 2.84 0.00 0.00 34.83 37.60 3d1f s MET 182 CO 0.00 -0.04 1.19 -1.25 -0.65 0.00 0.00 175.02 174.27 3d1f s PRO 183 N -0.52 4.52 -0.05 4.11 0.04 -1.26 -1.20 135.00 140.64 3d1f s PRO 183 Ca -0.06 1.96 0.18 0.00 0.04 0.00 0.00 61.00 63.12 3d1f s PRO 183 Cb -0.04 -3.15 -0.28 0.00 0.04 0.00 0.00 34.50 31.07 3d1f s PRO 183 CO 0.00 0.03 0.34 -0.89 0.04 0.00 0.00 177.00 176.53 3d1f n ILE 184 N 1.24 0.23 -0.85 0.56 2.08 0.46 -4.89 119.36 118.18 3d1f n ILE 184 Ca 0.00 -0.49 0.00 0.00 0.56 0.00 0.00 62.75 62.82 3d1f n ILE 184 Cb 0.44 -0.04 0.00 0.00 -0.75 0.00 0.00 39.64 39.28 3d1f n ILE 184 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3d1f n GLY 185 N 1.53 0.55 3.09 7.39 0.00 -1.24 -4.96 105.19 111.55 3d1f n GLY 185 Ca -0.08 -0.25 -0.12 0.00 0.00 0.00 0.00 46.02 45.57 3d1f n GLY 185 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3d1f s GLN 186 N -0.56 0.30 -0.02 1.61 -2.07 -1.26 -5.13 119.66 112.54 3d1f s GLN 186 Ca 0.00 0.13 -0.30 0.00 -1.82 0.00 0.00 55.36 53.37 3d1f s GLN 186 Cb 0.00 0.14 -0.05 0.00 -1.09 0.00 0.00 33.01 32.01 3d1f s GLN 186 CO 0.00 -0.05 1.33 0.45 -1.32 0.00 0.00 175.29 175.70 3d1f s SER 187 N -0.24 6.92 0.10 12.60 0.15 -1.26 -4.30 113.70 127.67 3d1f s SER 187 Ca -0.03 2.01 0.08 0.00 0.70 0.00 0.00 55.95 58.70 3d1f s SER 187 Cb -0.03 -2.56 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 3d1f s SER 187 CO 0.01 -0.67 -0.19 -0.76 1.20 0.00 0.00 173.24 172.83 3d1f s LEU 188 N 2.28 2.31 0.53 3.45 2.01 0.10 -5.01 118.68 124.36 3d1f s LEU 188 Ca 0.61 -0.69 -0.17 0.00 0.01 0.00 0.00 54.13 53.89 3d1f s LEU 188 Cb -0.29 -0.81 -0.07 0.00 0.01 0.00 0.00 46.19 45.03 3d1f s LEU 188 CO 0.25 0.02 1.02 -2.16 1.01 0.00 0.00 176.35 176.49 3d1f s PRO 189 N -1.96 3.71 -0.13 1.29 0.04 -1.26 -3.43 135.00 133.26 3d1f s PRO 189 Ca 0.06 1.11 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 3d1f s PRO 189 Cb -0.10 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 3d1f s PRO 189 CO 0.04 -0.48 1.59 -1.12 0.04 0.00 0.00 177.00 177.07 3d1f s SER 190 N -2.75 6.60 0.01 6.66 0.01 -1.25 -4.45 113.70 118.52 3d1f s SER 190 Ca 0.62 1.94 -0.12 0.00 1.31 0.00 0.00 55.95 59.71 3d1f s SER 190 Cb -0.13 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.58 3d1f s SER 190 CO 0.31 -1.02 0.24 -2.28 0.41 0.00 0.00 173.24 170.89 3d1f s HIS 191 N 4.39 -0.06 -0.14 2.43 5.04 -0.80 -4.99 115.29 121.15 3d1f s HIS 191 Ca 0.70 0.01 -0.07 0.00 -1.54 0.00 0.00 55.06 54.16 3d1f s HIS 191 Cb -0.29 0.03 0.06 0.00 0.04 0.00 0.00 32.58 32.42 3d1f s HIS 191 CO 0.27 -0.39 0.34 0.45 -2.34 0.00 0.00 174.74 173.07 3d1f s SER 192 N -1.60 -0.37 0.05 9.88 0.15 -1.26 -1.04 113.70 119.51 3d1f s SER 192 Ca -0.11 0.74 -0.00 0.00 0.70 0.00 0.00 55.95 57.28 3d1f s SER 192 Cb -0.04 0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 64.88 3d1f s SER 192 CO 0.01 -0.19 -0.03 0.68 1.20 0.00 0.00 173.24 174.91 3d1f s VAL 193 N 1.45 0.25 -0.24 4.45 -7.23 -0.52 -4.99 120.40 113.57 3d1f s VAL 193 Ca -0.09 -1.57 -0.05 0.00 -1.81 0.00 0.00 61.98 58.46 3d1f s VAL 193 Cb -0.09 -1.19 -0.01 0.00 0.56 0.00 0.00 36.38 35.64 3d1f s VAL 193 CO -0.11 -0.84 -0.00 -0.63 -0.31 0.00 0.00 175.10 173.21 3d1f s ILE 194 N -3.19 3.65 -0.11 -0.62 1.01 -1.26 -0.21 121.20 120.46 3d1f s ILE 194 Ca 0.01 -0.46 -0.18 0.00 0.00 0.00 0.00 60.65 60.03 3d1f s ILE 194 Cb 0.03 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 3d1f s ILE 194 CO -0.07 0.35 0.47 -0.69 0.00 0.00 0.00 174.94 175.00 3d1f s VAL 195 N 1.51 5.18 0.49 2.92 1.01 0.30 -0.51 120.40 131.29 3d1f s VAL 195 Ca 0.05 0.93 -0.24 0.00 0.00 0.00 0.00 61.98 62.73 3d1f s VAL 195 Cb -0.15 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.35 3d1f s VAL 195 CO -0.01 0.34 1.39 -0.81 0.00 0.00 0.00 175.10 176.02 3d1f n PRO 196 N 3.55 2.02 -0.32 2.72 -0.04 -1.26 -0.84 135.00 140.83 3d1f n PRO 196 Ca -0.08 0.73 0.10 0.00 -0.04 0.00 0.00 63.50 64.21 3d1f n PRO 196 Cb 0.52 -2.59 0.27 0.00 -0.04 0.00 0.00 33.50 31.66 3d1f n PRO 196 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 3d1f h ARG 197 N 1.95 0.65 -0.57 0.54 0.11 -1.39 0.16 114.38 115.84 3d1f h ARG 197 Ca -0.51 -0.04 -0.02 0.00 0.10 0.00 0.00 59.98 59.51 3d1f h ARG 197 Cb 1.28 -0.15 -0.03 0.00 1.11 0.00 0.00 29.97 32.19 3d1f h ARG 197 CO 0.59 0.43 0.26 -0.22 0.10 0.00 0.00 179.97 181.14 3d1f h LYS 198 N 0.67 0.80 -0.10 0.08 3.64 -1.90 -1.93 116.57 117.85 3d1f h LYS 198 Ca 0.52 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.67 3d1f h LYS 198 Cb 0.78 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 3d1f h LYS 198 CO -0.38 0.63 -0.51 0.78 -2.27 0.00 0.00 179.45 177.70 3d1f h GLY 199 N 0.90 0.28 0.87 5.01 0.00 -1.10 -2.11 103.07 106.93 3d1f h GLY 199 Ca 0.20 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 3d1f h GLY 199 CO -0.02 0.28 0.06 -2.08 0.00 0.00 0.00 176.54 174.77 3d1f h VAL 200 N 0.21 1.19 -0.55 4.60 2.07 -0.47 -1.14 116.25 122.16 3d1f h VAL 200 Ca 0.01 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 3d1f h VAL 200 Cb 0.97 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3d1f h VAL 200 CO 0.08 0.19 0.24 0.40 0.02 0.00 0.00 177.57 178.50 3d1f h ILE 201 N 0.15 1.21 -0.77 4.57 2.04 -1.30 0.81 117.51 124.22 3d1f h ILE 201 Ca 0.06 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 3d1f h ILE 201 Cb 0.24 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 3d1f h ILE 201 CO -0.00 0.25 0.41 -0.08 0.00 0.00 0.00 178.15 178.73 3d1f h GLU 202 N 0.75 1.09 -0.21 2.37 4.57 -1.29 -0.76 114.58 121.10 3d1f h GLU 202 Ca 0.19 -0.14 -0.03 0.00 -1.18 0.00 0.00 59.36 58.20 3d1f h GLU 202 Cb 0.17 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 3d1f h GLU 202 CO -0.02 0.82 0.01 1.25 -1.18 0.00 0.00 179.01 179.90 3d1f h LEU 203 N 1.08 0.34 -1.09 1.64 5.85 -0.86 -2.63 115.31 119.65 3d1f h LEU 203 Ca 0.27 -0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.77 3d1f h LEU 203 Cb 0.06 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 3d1f h LEU 203 CO -0.04 0.55 0.62 -0.03 -0.34 0.00 0.00 178.44 179.20 3d1f h MET 204 N 0.13 1.04 0.00 1.25 4.05 -0.51 -2.08 114.93 118.80 3d1f h MET 204 Ca 0.06 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3d1f h MET 204 Cb 0.37 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 3d1f h MET 204 CO 0.01 0.69 0.00 0.54 0.23 0.00 0.00 176.91 178.37 3d1f n ARG 205 N -4.51 0.15 0.00 0.39 1.74 -0.32 -2.77 116.66 111.33 3d1f n ARG 205 Ca 0.15 0.24 0.13 0.00 -0.77 0.00 0.00 57.85 57.60 3d1f n ARG 205 Cb 0.22 -1.71 0.31 0.00 -1.02 0.00 0.00 32.46 30.26 3d1f n ARG 205 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d1f n MET 206 N -1.98 1.11 -2.90 5.56 0.00 -0.78 -4.72 117.12 113.41 3d1f n MET 206 Ca 0.04 -0.74 -0.44 0.00 0.00 0.00 0.00 57.70 56.57 3d1f n MET 206 Cb 0.31 -1.48 -0.03 0.00 0.00 0.00 0.00 33.22 32.01 3d1f n MET 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3d1f s LEU 207 N -2.39 4.93 0.00 3.17 1.02 -1.12 -4.89 118.68 119.41 3d1f s LEU 207 Ca 0.25 -1.94 0.00 0.00 0.02 0.00 0.00 54.13 52.47 3d1f s LEU 207 Cb 0.19 -2.41 0.00 0.00 0.02 0.00 0.00 46.19 43.99 3d1f s LEU 207 CO 0.49 -1.11 0.00 -0.90 0.02 0.00 0.00 176.35 174.85 3d1f n ASP 208 N 6.74 0.00 -4.55 2.29 5.68 -1.26 -4.89 116.55 120.56 3d1f n ASP 208 Ca 0.22 0.00 -0.39 0.00 -0.50 0.00 0.00 54.79 54.13 3d1f n ASP 208 Cb 0.49 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.44 3d1f n ASP 208 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3d1f s GLY 209 N -0.32 0.23 0.58 6.12 0.00 -1.26 -4.86 107.32 107.82 3d1f s GLY 209 Ca 0.00 -0.69 0.38 0.00 0.00 0.00 0.00 44.72 44.41 3d1f s GLY 209 CO 0.00 3.38 1.50 -1.33 0.00 0.00 0.00 173.10 176.65 3d1f h GLY 210 N 16.25 0.00 0.00 0.20 0.00 -1.93 -3.10 103.07 114.50 3d1f h GLY 210 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3d1f h GLY 210 CO 1.22 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.98 3d1f n ASP 211 N -3.64 0.00 -3.67 0.19 8.00 -1.26 -3.42 116.55 112.75 3d1f n ASP 211 Ca 0.31 0.54 -0.44 0.00 0.71 0.00 0.00 54.79 55.91 3d1f n ASP 211 Cb 1.65 -0.04 -0.05 0.00 -0.02 0.00 0.00 41.12 42.67 3d1f n ASP 211 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3d1f n ASN 212 N -0.66 -0.52 -4.79 -2.24 4.13 -1.17 -4.50 115.26 105.51 3d1f n ASN 212 Ca 0.00 0.94 -0.32 0.00 1.68 0.00 0.00 54.58 56.89 3d1f n ASN 212 Cb 0.00 -0.77 0.05 0.00 -1.54 0.00 0.00 39.78 37.52 3d1f n ASN 212 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 3d1f s PRO 213 N -0.41 2.86 -0.07 3.52 0.04 -1.26 -3.08 135.00 136.59 3d1f s PRO 213 Ca 0.64 1.16 0.04 0.00 0.04 0.00 0.00 61.00 62.88 3d1f s PRO 213 Cb -0.91 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 31.64 3d1f s PRO 213 CO 0.47 -1.18 -0.19 -1.17 0.04 0.00 0.00 177.00 174.97 3d1f s LEU 214 N -5.21 2.44 -0.19 -3.56 2.96 0.28 -4.50 118.68 110.90 3d1f s LEU 214 Ca 0.62 -0.36 -0.03 0.00 -0.22 0.00 0.00 54.13 54.13 3d1f s LEU 214 Cb -0.17 -1.49 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 3d1f s LEU 214 CO 0.47 0.26 -0.05 -0.60 -1.32 0.00 0.00 176.35 175.12 3d1f s ARG 215 N -0.24 3.46 -0.09 1.98 3.52 -0.76 -1.24 118.95 125.58 3d1f s ARG 215 Ca -0.00 -0.60 0.03 0.00 -0.13 0.00 0.00 55.73 55.03 3d1f s ARG 215 Cb -0.13 -2.95 -0.01 0.00 -1.56 0.00 0.00 34.95 30.29 3d1f s ARG 215 CO 0.03 -0.03 -0.18 0.08 -0.81 0.00 0.00 175.30 174.39 3d1f s VAL 216 N 1.06 2.68 -0.09 7.11 1.01 0.02 -0.01 120.40 132.17 3d1f s VAL 216 Ca 0.01 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.20 3d1f s VAL 216 Cb -0.15 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.18 3d1f s VAL 216 CO 0.00 0.55 -0.17 -1.10 0.00 0.00 0.00 175.10 174.38 3d1f s GLN 217 N 0.03 2.31 -0.13 2.72 -0.21 0.02 -1.70 119.66 122.70 3d1f s GLN 217 Ca -0.06 -0.61 0.02 0.00 0.02 0.00 0.00 55.36 54.72 3d1f s GLN 217 Cb -0.15 -1.86 0.00 0.00 1.00 0.00 0.00 33.01 32.00 3d1f s GLN 217 CO 0.05 0.04 -0.19 0.42 -2.12 0.00 0.00 175.29 173.49 3d1f s ILE 218 N 0.68 2.39 0.26 1.08 1.01 0.49 -0.14 121.20 126.96 3d1f s ILE 218 Ca -0.13 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.67 3d1f s ILE 218 Cb -0.16 -1.97 0.03 0.00 0.01 0.00 0.00 42.46 40.37 3d1f s ILE 218 CO 0.03 0.54 0.22 0.61 0.00 0.00 0.00 174.94 176.34 3d1f n GLY 219 N 3.84 2.76 0.18 6.18 0.00 0.88 0.20 105.19 119.23 3d1f n GLY 219 Ca -0.19 -2.22 0.01 0.00 0.00 0.00 0.00 46.02 43.62 3d1f n GLY 219 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d1f h SER 220 N 0.27 0.04 0.00 1.61 4.64 -1.97 -3.33 113.55 114.82 3d1f h SER 220 Ca -0.16 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3d1f h SER 220 Cb 0.60 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 3d1f h SER 220 CO 0.25 0.46 -0.03 0.59 -0.87 0.00 0.00 176.83 177.23 3d1f n ASN 221 N -4.03 0.79 -3.90 4.97 3.02 -1.26 -4.98 115.26 109.87 3d1f n ASN 221 Ca -0.02 -1.49 -0.09 0.00 -0.03 0.00 0.00 54.58 52.96 3d1f n ASN 221 Cb 0.45 -0.03 -0.07 0.00 -0.61 0.00 0.00 39.78 39.52 3d1f n ASN 221 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3d1f s ASN 222 N -0.51 0.13 -0.00 6.41 -0.87 -1.25 -1.70 114.94 117.15 3d1f s ASN 222 Ca 0.01 -0.74 0.02 0.00 -1.57 0.00 0.00 52.86 50.58 3d1f s ASN 222 Cb 0.01 0.35 -0.01 0.00 -0.02 0.00 0.00 41.25 41.58 3d1f s ASN 222 CO 0.00 -0.76 -0.07 -0.51 -2.57 0.00 0.00 177.10 173.19 3d1f s ILE 223 N -3.89 0.56 0.00 0.60 2.07 -0.49 -0.09 121.20 119.96 3d1f s ILE 223 Ca 0.08 -0.36 0.03 0.00 -1.41 0.00 0.00 60.65 58.99 3d1f s ILE 223 Cb 0.05 -0.48 -0.01 0.00 0.13 0.00 0.00 42.46 42.15 3d1f s ILE 223 CO -0.08 0.12 -0.09 -0.60 -1.91 0.00 0.00 174.94 172.37 3d1f s ARG 224 N -0.28 0.70 -0.08 3.50 3.52 0.81 -1.44 118.95 125.68 3d1f s ARG 224 Ca 0.02 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.26 3d1f s ARG 224 Cb -0.03 -0.66 0.02 0.00 -1.56 0.00 0.00 34.95 32.71 3d1f s ARG 224 CO -0.00 0.18 -0.11 0.00 -0.81 0.00 0.00 175.30 174.56 3d1f s ALA 225 N -0.34 1.24 -0.33 6.12 0.00 0.53 -0.80 121.76 128.18 3d1f s ALA 225 Ca 0.02 -0.43 -0.09 0.00 0.00 0.00 0.00 51.96 51.46 3d1f s ALA 225 Cb -0.04 -0.64 0.01 0.00 0.00 0.00 0.00 23.12 22.45 3d1f s ALA 225 CO -0.00 -0.02 0.16 -1.01 0.00 0.00 0.00 175.76 174.89 3d1f s HIS 226 N 0.92 3.20 -0.26 0.00 3.76 0.98 -0.67 115.29 123.21 3d1f s HIS 226 Ca -0.10 -0.81 0.02 0.00 -0.15 0.00 0.00 55.06 54.02 3d1f s HIS 226 Cb -0.15 -2.36 0.07 0.00 1.11 0.00 0.00 32.58 31.25 3d1f s HIS 226 CO 0.01 -0.55 -0.04 0.08 -0.85 0.00 0.00 174.74 173.38 3d1f s VAL 227 N 1.56 1.77 0.00 -0.90 1.01 0.27 -1.82 120.40 122.29 3d1f s VAL 227 Ca 0.03 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.48 3d1f s VAL 227 Cb -0.18 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.14 3d1f s VAL 227 CO 0.06 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.55 3d1f n GLY 228 N 4.55 3.89 1.83 4.51 0.00 -1.26 -0.28 105.19 118.42 3d1f n GLY 228 Ca -0.09 0.20 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 3d1f n GLY 228 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d1f n ASP 229 N 7.91 4.30 -4.34 1.61 8.00 -1.26 -4.93 116.55 127.84 3d1f n ASP 229 Ca 0.00 -3.33 -0.31 0.00 0.71 0.00 0.00 54.79 51.86 3d1f n ASP 229 Cb 0.00 -0.73 -0.15 0.00 -0.02 0.00 0.00 41.12 40.22 3d1f n ASP 229 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3d1f s PHE 230 N -3.06 2.36 -0.16 1.24 0.08 0.61 -1.44 117.98 117.61 3d1f s PHE 230 Ca 0.53 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 57.17 3d1f s PHE 230 Cb 0.43 -1.46 0.04 0.00 -0.57 0.00 0.00 43.02 41.47 3d1f s PHE 230 CO 0.11 0.06 -0.03 0.42 -0.10 0.00 0.00 175.22 175.68 3d1f s ILE 231 N -0.72 0.94 -0.16 0.64 1.01 0.37 -0.56 121.20 122.71 3d1f s ILE 231 Ca 0.11 -0.55 -0.06 0.00 0.00 0.00 0.00 60.65 60.15 3d1f s ILE 231 Cb -0.10 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 3d1f s ILE 231 CO 0.01 0.07 0.03 0.12 0.00 0.00 0.00 174.94 175.17 3d1f s PHE 232 N 1.70 3.18 -0.04 3.97 5.36 0.16 -1.18 117.98 131.13 3d1f s PHE 232 Ca 0.01 -0.02 0.02 0.00 -0.96 0.00 0.00 56.93 55.98 3d1f s PHE 232 Cb -0.15 -2.00 0.01 0.00 -0.34 0.00 0.00 43.02 40.53 3d1f s PHE 232 CO -0.07 0.15 -0.10 0.99 -1.46 0.00 0.00 175.22 174.72 3d1f s THR 233 N 0.19 0.87 0.04 0.12 2.01 -0.61 -0.35 115.64 117.91 3d1f s THR 233 Ca 0.02 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.66 3d1f s THR 233 Cb -0.13 -0.79 -0.02 0.00 0.01 0.00 0.00 72.50 71.56 3d1f s THR 233 CO 0.01 0.28 -0.06 -0.55 -0.69 0.00 0.00 174.62 173.61 3d1f s SER 234 N 0.39 0.67 0.80 3.53 0.15 -0.52 -0.47 113.70 118.25 3d1f s SER 234 Ca -0.07 -0.56 -0.11 0.00 0.70 0.00 0.00 55.95 55.90 3d1f s SER 234 Cb -0.11 0.06 0.07 0.00 -1.71 0.00 0.00 66.02 64.33 3d1f s SER 234 CO 0.01 -0.25 1.10 -0.54 1.20 0.00 0.00 173.24 174.76 3d1f s LYS 235 N -1.69 2.03 0.32 5.44 1.02 -0.49 -1.39 119.74 124.97 3d1f s LYS 235 Ca -0.11 0.65 0.07 0.00 0.02 0.00 0.00 55.97 56.60 3d1f s LYS 235 Cb -0.09 -1.91 -0.03 0.00 -0.52 0.00 0.00 37.83 35.28 3d1f s LYS 235 CO -0.01 -1.66 0.27 -0.51 -0.92 0.00 0.00 175.35 172.53 3d1f s LEU 236 N -5.80 3.66 -0.11 3.17 1.43 -0.69 -4.40 118.68 115.94 3d1f s LEU 236 Ca 0.61 -0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 53.17 3d1f s LEU 236 Cb -0.15 -2.26 -0.05 0.00 0.03 0.00 0.00 46.19 43.77 3d1f s LEU 236 CO 0.54 -0.28 0.24 -0.69 0.23 0.00 0.00 176.35 176.39 3d1f s VAL 237 N -2.26 5.33 0.52 -1.59 1.01 0.34 -4.92 120.40 118.83 3d1f s VAL 237 Ca 0.39 0.44 -0.06 0.00 0.00 0.00 0.00 61.98 62.75 3d1f s VAL 237 Cb -0.06 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 3d1f s VAL 237 CO 0.26 0.53 0.83 -0.62 0.00 0.00 0.00 175.10 176.10 3d1f s ASP 238 N -0.51 6.09 0.00 3.32 2.15 -1.26 -4.29 116.67 122.18 3d1f s ASP 238 Ca 0.17 0.90 0.00 0.00 0.43 0.00 0.00 52.55 54.05 3d1f s ASP 238 Cb -0.13 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 3d1f s ASP 238 CO 0.05 -0.72 0.00 0.61 -0.17 0.00 0.00 175.17 174.95 3d1f n GLY 239 N -2.37 2.94 3.50 2.66 0.00 -1.26 -4.25 105.19 106.41 3d1f n GLY 239 Ca 0.02 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 3d1f n GLY 239 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d1f s ARG 240 N -2.65 3.20 0.24 1.61 1.70 -1.26 -5.00 118.95 116.79 3d1f s ARG 240 Ca 0.00 -0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 54.40 3d1f s ARG 240 Cb 0.00 -3.99 -0.09 0.00 -0.57 0.00 0.00 34.95 30.30 3d1f s ARG 240 CO 0.00 -1.03 1.15 0.12 -1.08 0.00 0.00 175.30 174.46 3d1f s PHE 241 N 2.65 3.48 0.88 5.89 5.36 -1.26 -4.99 117.98 130.00 3d1f s PHE 241 Ca 0.19 1.57 -0.11 0.00 -0.96 0.00 0.00 56.93 57.61 3d1f s PHE 241 Cb -0.16 -3.37 0.13 0.00 -0.34 0.00 0.00 43.02 39.28 3d1f s PHE 241 CO 0.16 -0.89 1.17 -1.25 -1.46 0.00 0.00 175.22 172.95 3d1f s PRO 242 N -0.92 1.21 -0.45 10.12 0.04 -1.26 -4.96 135.00 138.78 3d1f s PRO 242 Ca 0.48 1.63 -0.20 0.00 0.04 0.00 0.00 61.00 62.95 3d1f s PRO 242 Cb -0.33 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 32.50 3d1f s PRO 242 CO 0.40 -2.51 0.64 0.34 0.04 0.00 0.00 177.00 175.91 3d1f s ASP 243 N -2.48 6.30 0.49 6.66 -1.08 -1.26 -4.94 116.67 120.36 3d1f s ASP 243 Ca 0.69 -0.43 0.21 0.00 -0.52 0.00 0.00 52.55 52.49 3d1f s ASP 243 Cb -0.25 -2.31 1.25 0.00 -1.46 0.00 0.00 42.92 40.15 3d1f s ASP 243 CO 0.55 -0.80 1.99 0.10 0.52 0.00 0.00 175.17 177.54 3d1f h TYR 244 N 8.90 0.17 -0.06 -5.34 -0.00 -2.01 -0.76 116.97 117.87 3d1f h TYR 244 Ca -0.26 0.00 0.02 0.00 0.00 0.00 0.00 58.73 58.50 3d1f h TYR 244 Cb 1.10 -0.05 -0.00 0.00 0.00 0.00 0.00 36.73 37.77 3d1f h TYR 244 CO 0.73 0.07 0.06 0.00 -0.00 0.00 0.00 178.16 179.03 3d1f h ARG 245 N 0.15 0.00 0.00 0.10 3.08 -1.97 -2.11 114.38 113.64 3d1f h ARG 245 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 3d1f h ARG 245 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 3d1f h ARG 245 CO -0.04 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.40 3d1f n ARG 246 N -3.93 0.08 -0.00 0.04 1.74 -0.29 -3.45 116.66 110.85 3d1f n ARG 246 Ca -0.01 0.08 0.07 0.00 -0.77 0.00 0.00 57.85 57.22 3d1f n ARG 246 Cb 0.16 -1.60 -0.09 0.00 -1.02 0.00 0.00 32.46 29.91 3d1f n ARG 246 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3d1f n VAL 247 N -1.74 0.00 -2.00 1.55 0.24 -0.80 -4.94 118.33 110.63 3d1f n VAL 247 Ca 0.06 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.34 61.77 3d1f n VAL 247 Cb 0.36 0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 33.58 3d1f n VAL 247 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3d1f s LEU 248 N -2.91 4.36 0.34 1.34 1.43 -1.18 -4.79 118.68 117.28 3d1f s LEU 248 Ca 0.04 2.46 -0.27 0.00 -1.03 0.00 0.00 54.13 55.33 3d1f s LEU 248 Cb 0.11 -3.58 -0.12 0.00 0.03 0.00 0.00 46.19 42.63 3d1f s LEU 248 CO 0.63 -0.81 1.13 -0.81 0.23 0.00 0.00 176.35 176.72 3d1f n PRO 249 N 4.75 1.68 -4.26 1.29 -0.04 -1.26 -4.97 135.00 132.19 3d1f n PRO 249 Ca 0.14 0.59 -0.34 0.00 -0.04 0.00 0.00 63.50 63.85 3d1f n PRO 249 Cb 0.40 -2.10 -0.11 0.00 -0.04 0.00 0.00 33.50 31.66 3d1f n PRO 249 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 3d1f s LYS 250 N -1.81 3.62 -1.36 0.54 -2.85 -1.26 -4.57 119.74 112.04 3d1f s LYS 250 Ca 0.58 -0.43 -0.01 0.00 -1.00 0.00 0.00 55.97 55.11 3d1f s LYS 250 Cb -0.61 -2.99 0.01 0.00 -2.06 0.00 0.00 37.83 32.18 3d1f s LYS 250 CO 0.60 0.37 0.63 0.09 0.10 0.00 0.00 175.35 177.14 3d1f n ASN 251 N 3.18 -1.21 -4.69 0.03 3.02 -1.26 -4.85 115.26 109.48 3d1f n ASN 251 Ca -0.17 -0.88 -0.44 0.00 -0.03 0.00 0.00 54.58 53.06 3d1f n ASN 251 Cb 0.53 -3.71 -0.04 0.00 -0.61 0.00 0.00 39.78 35.95 3d1f n ASN 251 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3d1f n PRO 252 N -4.35 2.49 -0.15 3.52 -0.04 -1.26 -4.86 135.00 130.35 3d1f n PRO 252 Ca -0.27 0.90 0.11 0.00 -0.04 0.00 0.00 63.50 64.20 3d1f n PRO 252 Cb 0.67 -2.72 0.19 0.00 -0.04 0.00 0.00 33.50 31.60 3d1f n PRO 252 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3d1f n ASP 253 N 3.98 3.32 -3.94 3.54 5.75 -1.01 -4.89 116.55 123.29 3d1f n ASP 253 Ca 0.17 -1.97 -0.22 0.00 -0.01 0.00 0.00 54.79 52.76 3d1f n ASP 253 Cb 0.32 -0.20 -0.16 0.00 -1.03 0.00 0.00 41.12 40.05 3d1f n ASP 253 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3d1f s LYS 254 N -1.51 1.14 -0.04 0.11 1.02 -0.95 -4.53 119.74 114.98 3d1f s LYS 254 Ca 0.35 -0.21 0.02 0.00 0.02 0.00 0.00 55.97 56.15 3d1f s LYS 254 Cb 0.21 -1.05 0.01 0.00 -0.52 0.00 0.00 37.83 36.48 3d1f s LYS 254 CO 0.30 -0.05 -0.10 -1.58 -0.92 0.00 0.00 175.35 173.00 3d1f s HIS 255 N 0.86 1.09 0.00 3.18 2.46 -1.00 -1.04 115.29 120.84 3d1f s HIS 255 Ca -0.12 -0.32 0.03 0.00 0.47 0.00 0.00 55.06 55.12 3d1f s HIS 255 Cb -0.15 -0.81 -0.01 0.00 -0.13 0.00 0.00 32.58 31.48 3d1f s HIS 255 CO 0.01 -0.17 -0.10 -1.17 -2.47 0.00 0.00 174.74 170.84 3d1f s LEU 256 N 0.44 2.05 -0.00 8.88 0.20 -0.16 -2.30 118.68 127.80 3d1f s LEU 256 Ca -0.08 -0.24 0.01 0.00 0.69 0.00 0.00 54.13 54.51 3d1f s LEU 256 Cb -0.12 -0.49 0.00 0.00 -0.43 0.00 0.00 46.19 45.15 3d1f s LEU 256 CO 0.01 0.09 -0.02 -0.70 -0.29 0.00 0.00 176.35 175.45 3d1f s GLU 257 N -0.44 0.14 0.20 1.98 2.12 -0.66 0.08 118.70 122.12 3d1f s GLU 257 Ca 0.03 -0.05 -0.23 0.00 0.36 0.00 0.00 54.97 55.08 3d1f s GLU 257 Cb -0.05 -0.15 0.05 0.00 0.26 0.00 0.00 34.13 34.24 3d1f s GLU 257 CO -0.00 0.03 0.67 0.00 -0.54 0.00 0.00 175.26 175.42 3d1f s ALA 258 N 0.02 -1.46 0.26 6.30 0.00 -0.62 -1.54 121.76 124.71 3d1f s ALA 258 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 3d1f s ALA 258 Cb -0.01 0.85 -0.11 0.00 0.00 0.00 0.00 23.12 23.85 3d1f s ALA 258 CO -0.00 -0.88 1.52 0.20 0.00 0.00 0.00 175.76 176.60 3d1f s GLY 259 N -2.81 2.13 0.13 0.00 0.00 -1.26 -0.69 107.32 104.82 3d1f s GLY 259 Ca 0.05 1.44 -0.16 0.00 0.00 0.00 0.00 44.72 46.05 3d1f s GLY 259 CO -0.05 2.44 1.64 0.00 0.00 0.00 0.00 173.10 177.13 3d1f h ASP 261 N 0.50 0.21 -0.70 0.00 1.82 -1.81 0.27 116.42 116.71 3d1f h ASP 261 Ca 0.13 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.68 3d1f h ASP 261 Cb 0.29 -0.05 -0.03 0.00 0.68 0.00 0.00 39.33 40.21 3d1f h ASP 261 CO -0.00 0.23 0.40 -0.07 -1.61 0.00 0.00 179.24 178.19 3d1f h LEU 262 N 0.18 0.85 -0.02 2.28 3.38 -1.93 -0.57 115.31 119.48 3d1f h LEU 262 Ca 0.06 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3d1f h LEU 262 Cb 0.06 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3d1f h LEU 262 CO -0.01 0.68 0.01 -0.07 0.09 0.00 0.00 178.44 179.14 3d1f h LEU 263 N 0.95 0.03 -0.16 1.67 3.38 -1.22 -1.53 115.31 118.43 3d1f h LEU 263 Ca 0.25 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3d1f h LEU 263 Cb 0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3d1f h LEU 263 CO -0.04 0.13 0.00 0.50 0.09 0.00 0.00 178.44 179.12 3d1f h LYS 264 N -0.08 0.05 -0.44 1.13 3.64 -0.70 -1.11 116.57 119.06 3d1f h LYS 264 Ca 0.01 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 3d1f h LYS 264 Cb 0.12 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 3d1f h LYS 264 CO -0.00 0.03 0.08 1.96 -2.27 0.00 0.00 179.45 179.25 3d1f h GLN 265 N 0.05 0.68 -0.33 1.90 1.08 -1.06 0.77 115.11 118.20 3d1f h GLN 265 Ca 0.07 -0.14 -0.08 0.00 -1.45 0.00 0.00 58.65 57.06 3d1f h GLN 265 Cb 0.09 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 3d1f h GLN 265 CO -0.13 0.64 -0.09 0.00 -0.95 0.00 0.00 178.83 178.31 3d1f h ALA 266 N 1.43 0.46 -0.57 3.87 0.00 -0.91 -1.40 119.26 122.14 3d1f h ALA 266 Ca 0.14 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3d1f h ALA 266 Cb 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3d1f h ALA 266 CO 0.00 0.30 0.02 0.74 0.00 0.00 0.00 179.25 180.32 3d1f h PHE 267 N 0.43 1.04 -0.59 0.00 0.04 -0.86 -1.79 116.94 115.20 3d1f h PHE 267 Ca 0.08 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 3d1f h PHE 267 Cb 0.59 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.43 3d1f h PHE 267 CO 0.05 0.92 0.34 0.00 -0.60 0.00 0.00 178.31 179.02 3d1f h ALA 268 N 1.12 0.75 -0.32 2.45 0.00 -0.66 -0.06 119.26 122.55 3d1f h ALA 268 Ca 0.17 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3d1f h ALA 268 Cb 0.49 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3d1f h ALA 268 CO 0.02 0.24 -0.35 0.00 0.00 0.00 0.00 179.25 179.16 3d1f h ARG 269 N 0.79 0.80 -0.88 0.00 3.08 -1.11 -3.09 114.38 113.98 3d1f h ARG 269 Ca 0.21 -0.44 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 3d1f h ARG 269 Cb 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 3d1f h ARG 269 CO -0.04 1.07 0.45 0.00 -1.07 0.00 0.00 179.97 180.39 3d1f h ALA 270 N 0.72 1.13 -0.72 0.04 0.00 -1.15 -2.36 119.26 116.91 3d1f h ALA 270 Ca 0.05 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 55.01 3d1f h ALA 270 Cb 0.94 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3d1f h ALA 270 CO 0.09 0.66 0.52 0.00 0.00 0.00 0.00 179.25 180.52 3d1f h ALA 271 N 1.25 2.65 -0.72 0.00 0.00 -0.92 -1.72 119.26 119.80 3d1f h ALA 271 Ca 0.31 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.31 3d1f h ALA 271 Cb 0.07 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3d1f h ALA 271 CO -0.04 -0.86 0.48 0.82 0.00 0.00 0.00 179.25 179.65 3d1f h ILE 272 N 0.02 0.86 -0.37 0.00 2.04 -1.45 -1.58 117.51 117.03 3d1f h ILE 272 Ca 0.35 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.96 3d1f h ILE 272 Cb 1.35 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 3d1f h ILE 272 CO -0.01 0.09 0.03 0.18 0.00 0.00 0.00 178.15 178.44 3d1f n LEU 273 N -4.49 4.39 -4.93 1.44 4.77 -0.65 -4.98 117.00 112.55 3d1f n LEU 273 Ca 0.13 -3.20 -0.25 0.00 -0.03 0.00 0.00 56.01 52.66 3d1f n LEU 273 Cb 0.43 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3d1f n LEU 273 CO 0.33 0.81 0.32 -0.94 -1.33 0.00 0.00 177.39 176.58 3d1f s SER 274 N -1.86 6.06 0.07 -1.43 1.04 -0.60 -2.35 113.70 114.63 3d1f s SER 274 Ca 0.45 0.55 -0.32 0.00 0.48 0.00 0.00 55.95 57.11 3d1f s SER 274 Cb 0.37 -1.89 -0.11 0.00 0.10 0.00 0.00 66.02 64.49 3d1f s SER 274 CO 0.08 -0.59 1.82 -3.20 0.98 0.00 0.00 173.24 172.33 3d1f n ASN 275 N -2.10 3.76 0.08 7.02 2.85 -1.23 -4.76 115.26 120.88 3d1f n ASN 275 Ca -0.00 0.99 0.18 0.00 -0.11 0.00 0.00 54.58 55.64 3d1f n ASN 275 Cb 0.57 -1.48 0.73 0.00 1.24 0.00 0.00 39.78 40.83 3d1f n ASN 275 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3d1f h GLU 276 N 8.49 0.00 0.02 1.20 5.08 -1.94 0.35 114.58 127.78 3d1f h GLU 276 Ca -0.47 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.53 3d1f h GLU 276 Cb 1.24 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 3d1f h GLU 276 CO 0.94 0.00 -2.01 1.63 -1.00 0.00 0.00 179.01 178.57 3d1f n LYS 277 N -4.16 0.61 0.10 2.33 5.02 -1.26 -4.61 118.16 116.19 3d1f n LYS 277 Ca 0.06 0.36 0.10 0.00 -2.02 0.00 0.00 58.31 56.82 3d1f n LYS 277 Cb 0.50 -1.62 -0.01 0.00 -0.02 0.00 0.00 35.03 33.88 3d1f n LYS 277 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3d1f n PHE 278 N -4.07 0.98 -2.86 2.13 3.72 -1.19 -4.99 117.46 111.18 3d1f n PHE 278 Ca -0.42 0.29 -0.18 0.00 -0.05 0.00 0.00 57.45 57.09 3d1f n PHE 278 Cb 0.85 -0.98 -0.00 0.00 -0.94 0.00 0.00 39.48 38.42 3d1f n PHE 278 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3d1f n ARG 279 N -2.70 -2.99 -2.71 -1.08 5.12 0.12 -4.79 116.66 107.64 3d1f n ARG 279 Ca -0.01 0.59 -0.40 0.00 -1.93 0.00 0.00 57.85 56.10 3d1f n ARG 279 Cb 0.58 -5.27 -0.05 0.00 -1.16 0.00 0.00 32.46 26.56 3d1f n ARG 279 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 3d1f s GLY 280 N -2.37 3.06 0.10 -0.13 0.00 -1.26 -0.73 107.32 105.99 3d1f s GLY 280 Ca 0.19 0.64 0.04 0.00 0.00 0.00 0.00 44.72 45.58 3d1f s GLY 280 CO 0.23 1.33 -0.10 -1.34 0.00 0.00 0.00 173.10 173.22 3d1f s VAL 281 N -0.73 0.94 -0.05 1.40 -7.23 -0.39 -4.53 120.40 109.81 3d1f s VAL 281 Ca 0.44 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 58.96 3d1f s VAL 281 Cb -0.26 -1.41 -0.02 0.00 0.56 0.00 0.00 36.38 35.25 3d1f s VAL 281 CO 0.32 -0.59 -0.15 -0.13 -0.31 0.00 0.00 175.10 174.23 3d1f s ARG 282 N -2.92 2.50 -0.15 4.82 0.52 0.60 -1.61 118.95 122.72 3d1f s ARG 282 Ca 0.07 -0.72 -0.01 0.00 -0.52 0.00 0.00 55.73 54.55 3d1f s ARG 282 Cb -0.02 -2.36 -0.01 0.00 0.52 0.00 0.00 34.95 33.08 3d1f s ARG 282 CO -0.00 0.60 -0.11 -0.51 0.02 0.00 0.00 175.30 175.30 3d1f s LEU 283 N -0.67 2.80 -0.24 2.53 1.02 0.31 -0.87 118.68 123.56 3d1f s LEU 283 Ca 0.10 -0.32 -0.00 0.00 0.02 0.00 0.00 54.13 53.93 3d1f s LEU 283 Cb -0.11 -1.65 0.03 0.00 0.02 0.00 0.00 46.19 44.49 3d1f s LEU 283 CO 0.01 0.14 -0.08 -0.31 0.02 0.00 0.00 176.35 176.12 3d1f s TYR 284 N 0.53 3.08 -0.14 0.29 1.51 0.57 -1.01 117.35 122.17 3d1f s TYR 284 Ca -0.07 -1.73 -0.05 0.00 -1.01 0.00 0.00 57.07 54.20 3d1f s TYR 284 Cb -0.15 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 3d1f s TYR 284 CO 0.04 -0.77 0.05 0.14 -1.11 0.00 0.00 175.55 173.90 3d1f s VAL 285 N 1.27 4.75 0.31 0.71 -7.23 -0.24 -1.31 120.40 118.67 3d1f s VAL 285 Ca -0.01 -0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 59.99 3d1f s VAL 285 Cb -0.17 -3.08 0.01 0.00 0.56 0.00 0.00 36.38 33.71 3d1f s VAL 285 CO -0.05 0.54 0.57 -0.94 -0.31 0.00 0.00 175.10 174.91 3d1f s SER 286 N -0.34 0.25 -0.47 4.85 1.04 -0.70 -2.14 113.70 116.19 3d1f s SER 286 Ca 0.09 -1.13 -0.22 0.00 0.48 0.00 0.00 55.95 55.16 3d1f s SER 286 Cb -0.12 0.68 -0.12 0.00 0.10 0.00 0.00 66.02 66.56 3d1f s SER 286 CO 0.02 -1.33 1.47 1.21 0.98 0.00 0.00 173.24 175.58 3d1f n GLU 287 N -0.48 0.00 -3.62 4.02 4.07 -1.26 -0.45 120.64 122.92 3d1f n GLU 287 Ca -0.02 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.83 3d1f n GLU 287 Cb 0.61 -0.90 -0.04 0.00 -0.06 0.00 0.00 31.44 31.05 3d1f n GLU 287 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3d1f n ASN 288 N 5.50 -1.94 -3.83 4.31 3.02 -1.22 -4.93 115.26 116.17 3d1f n ASN 288 Ca 0.37 -0.48 -0.12 0.00 -0.03 0.00 0.00 54.58 54.31 3d1f n ASN 288 Cb -0.00 -1.70 -0.11 0.00 -0.61 0.00 0.00 39.78 37.36 3d1f n ASN 288 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3d1f s GLN 289 N -6.24 0.40 -0.06 3.52 0.74 0.40 -2.32 119.66 116.11 3d1f s GLN 289 Ca 0.47 -0.10 0.02 0.00 0.05 0.00 0.00 55.36 55.79 3d1f s GLN 289 Cb -0.27 0.17 0.02 0.00 1.10 0.00 0.00 33.01 34.03 3d1f s GLN 289 CO 0.57 -0.09 -0.10 -1.17 -0.55 0.00 0.00 175.29 173.96 3d1f s LEU 290 N -0.77 1.54 -0.12 3.68 2.96 -0.82 -1.72 118.68 123.43 3d1f s LEU 290 Ca -0.09 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 3d1f s LEU 290 Cb -0.05 -0.71 0.01 0.00 0.50 0.00 0.00 46.19 45.94 3d1f s LEU 290 CO 0.01 0.00 -0.22 -0.75 -1.32 0.00 0.00 176.35 174.08 3d1f s LYS 291 N 0.75 2.91 -0.15 1.98 2.20 -0.42 -1.10 119.74 125.91 3d1f s LYS 291 Ca -0.13 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 54.65 3d1f s LYS 291 Cb -0.15 -2.31 -0.01 0.00 -1.51 0.00 0.00 37.83 33.85 3d1f s LYS 291 CO 0.02 0.04 -0.12 0.42 -0.36 0.00 0.00 175.35 175.36 3d1f s ILE 292 N 0.68 3.04 0.14 5.43 1.01 0.45 -0.32 121.20 131.64 3d1f s ILE 292 Ca -0.11 -0.65 0.07 0.00 0.00 0.00 0.00 60.65 59.96 3d1f s ILE 292 Cb -0.16 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 3d1f s ILE 292 CO 0.02 0.51 -0.15 0.42 0.00 0.00 0.00 174.94 175.73 3d1f s THR 293 N 0.62 1.53 -0.10 2.92 -4.23 -0.05 -0.38 115.64 115.95 3d1f s THR 293 Ca -0.07 -1.84 -0.16 0.00 -1.18 0.00 0.00 61.69 58.44 3d1f s THR 293 Cb -0.15 -1.70 0.04 0.00 1.34 0.00 0.00 72.50 72.03 3d1f s THR 293 CO 0.03 -0.40 0.40 0.00 -0.54 0.00 0.00 174.62 174.11 3d1f s ALA 294 N -2.21 -1.01 0.04 3.99 0.00 -0.69 -0.29 121.76 121.58 3d1f s ALA 294 Ca 0.13 0.91 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 3d1f s ALA 294 Cb -0.05 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 3d1f s ALA 294 CO 0.04 -0.23 0.13 0.54 0.00 0.00 0.00 175.76 176.24 3d1f s ASN 295 N -0.40 0.13 0.49 0.00 4.22 -1.19 -0.87 114.94 117.31 3d1f s ASN 295 Ca -0.05 -0.47 0.02 0.00 -2.14 0.00 0.00 52.86 50.21 3d1f s ASN 295 Cb -0.03 0.24 -0.01 0.00 1.28 0.00 0.00 41.25 42.73 3d1f s ASN 295 CO 0.03 -0.51 0.06 0.54 -2.04 0.00 0.00 177.10 175.17 3d1f s ASN 296 N -2.07 3.68 0.58 3.54 2.20 -0.99 -3.54 114.94 118.33 3d1f s ASN 296 Ca -0.06 -1.72 0.27 0.00 -0.94 0.00 0.00 52.86 50.41 3d1f s ASN 296 Cb -0.01 0.67 1.70 0.00 -2.00 0.00 0.00 41.25 41.60 3d1f s ASN 296 CO -0.04 -0.96 2.21 -0.65 -2.94 0.00 0.00 177.10 174.72 3d1f h PRO 297 N 1.45 0.00 0.00 3.55 0.11 -1.91 -0.97 132.00 134.23 3d1f h PRO 297 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 3d1f h PRO 297 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3d1f h PRO 297 CO 0.65 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.83 3d1f n GLU 298 N -3.97 0.95 -1.44 1.05 4.71 -1.26 -4.85 120.64 115.83 3d1f n GLU 298 Ca -0.02 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.02 3d1f n GLU 298 Cb 0.13 -1.25 -0.04 0.00 -1.01 0.00 0.00 31.44 29.26 3d1f n GLU 298 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3d1f n GLN 299 N -0.75 -0.80 -2.87 3.49 1.13 -0.37 -5.00 117.38 112.21 3d1f n GLN 299 Ca 0.11 0.86 -0.32 0.00 -1.94 0.00 0.00 57.00 55.71 3d1f n GLN 299 Cb 0.05 -4.86 -0.05 0.00 0.11 0.00 0.00 30.24 25.49 3d1f n GLN 299 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3d1f s GLU 300 N -3.15 3.99 0.02 -1.09 2.02 -1.26 -4.88 118.70 114.34 3d1f s GLU 300 Ca 0.00 0.77 0.00 0.00 0.02 0.00 0.00 54.97 55.76 3d1f s GLU 300 Cb 0.00 -2.31 -0.02 0.00 0.10 0.00 0.00 34.13 31.90 3d1f s GLU 300 CO 0.00 -0.01 -0.03 -1.21 0.02 0.00 0.00 175.26 174.03 3d1f s GLU 301 N -3.43 0.31 0.05 1.61 2.02 -1.26 -2.43 118.70 115.57 3d1f s GLU 301 Ca 0.56 -0.57 0.06 0.00 0.02 0.00 0.00 54.97 55.04 3d1f s GLU 301 Cb -0.10 0.04 -0.02 0.00 0.10 0.00 0.00 34.13 34.14 3d1f s GLU 301 CO 0.22 -0.03 -0.16 0.00 0.02 0.00 0.00 175.26 175.31 3d1f s ALA 302 N -1.29 1.38 -0.11 5.21 0.00 -0.05 -4.98 121.76 121.92 3d1f s ALA 302 Ca -0.13 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 3d1f s ALA 302 Cb -0.09 -0.22 0.05 0.00 0.00 0.00 0.00 23.12 22.86 3d1f s ALA 302 CO -0.01 0.27 0.24 -2.00 0.00 0.00 0.00 175.76 174.27 3d1f s GLU 303 N -1.28 0.19 -0.07 0.00 2.12 -1.26 -1.71 118.70 116.70 3d1f s GLU 303 Ca 0.03 0.55 0.03 0.00 0.36 0.00 0.00 54.97 55.94 3d1f s GLU 303 Cb -0.08 -0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.20 3d1f s GLU 303 CO 0.02 -0.18 -0.16 -1.21 -0.54 0.00 0.00 175.26 173.19 3d1f s GLU 304 N 1.39 2.08 -0.11 4.30 0.41 0.49 -4.97 118.70 122.30 3d1f s GLU 304 Ca -0.08 -0.55 0.02 0.00 -0.41 0.00 0.00 54.97 53.94 3d1f s GLU 304 Cb -0.11 -1.66 -0.01 0.00 -1.78 0.00 0.00 34.13 30.57 3d1f s GLU 304 CO -0.08 0.08 -0.17 0.42 -0.49 0.00 0.00 175.26 175.01 3d1f s ILE 305 N 0.54 2.66 0.07 -1.63 1.01 -1.26 -0.41 121.20 122.18 3d1f s ILE 305 Ca -0.15 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 59.75 3d1f s ILE 305 Cb -0.16 -2.08 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 3d1f s ILE 305 CO 0.05 0.54 -0.16 -0.76 0.00 0.00 0.00 174.94 174.62 3d1f s LEU 306 N 0.26 2.25 0.01 2.97 2.01 -0.25 -5.01 118.68 120.92 3d1f s LEU 306 Ca -0.12 -0.59 -0.26 0.00 0.01 0.00 0.00 54.13 53.17 3d1f s LEU 306 Cb -0.16 -0.63 -0.04 0.00 0.01 0.00 0.00 46.19 45.36 3d1f s LEU 306 CO 0.06 -0.01 0.79 -1.81 1.01 0.00 0.00 176.35 176.39 3d1f s ASP 307 N -1.60 7.18 0.26 2.29 -0.00 -1.26 -1.94 116.67 121.60 3d1f s ASP 307 Ca 0.01 1.42 -0.04 0.00 -0.00 0.00 0.00 52.55 53.94 3d1f s ASP 307 Cb -0.09 -2.47 -0.02 0.00 -0.00 0.00 0.00 42.92 40.33 3d1f s ASP 307 CO 0.02 -0.08 0.33 0.68 -0.00 0.00 0.00 175.17 176.13 3d1f s VAL 308 N 0.40 0.00 -0.39 -1.27 -7.23 -0.98 -4.86 120.40 106.08 3d1f s VAL 308 Ca 0.41 -1.73 -0.12 0.00 -1.81 0.00 0.00 61.98 58.73 3d1f s VAL 308 Cb -0.20 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.32 3d1f s VAL 308 CO 0.23 0.00 0.24 -0.89 -0.31 0.00 0.00 175.10 174.36 3d1f s THR 309 N -3.78 4.81 -0.04 5.32 2.01 -0.59 -4.09 115.64 119.28 3d1f s THR 309 Ca 0.32 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.55 3d1f s THR 309 Cb 0.02 -3.68 0.01 0.00 0.01 0.00 0.00 72.50 68.87 3d1f s THR 309 CO 0.15 -0.26 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.28 3d1f s TYR 310 N 1.60 0.86 -0.04 4.92 5.04 -1.26 -1.66 117.35 126.82 3d1f s TYR 310 Ca 0.03 -0.24 0.03 0.00 -2.44 0.00 0.00 57.07 54.45 3d1f s TYR 310 Cb -0.19 -0.68 0.00 0.00 0.35 0.00 0.00 41.96 41.45 3d1f s TYR 310 CO 0.08 -0.15 -0.12 -1.12 -1.34 0.00 0.00 175.55 172.89 3d1f s SER 311 N 0.54 1.63 0.00 4.32 0.01 -0.97 -3.43 113.70 115.79 3d1f s SER 311 Ca -0.08 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 56.92 3d1f s SER 311 Cb -0.12 -0.49 0.00 0.00 0.21 0.00 0.00 66.02 65.63 3d1f s SER 311 CO 0.01 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.36 3d1f n GLY 312 N 3.31 1.41 3.78 3.44 0.00 -1.26 -2.39 105.19 113.48 3d1f n GLY 312 Ca -0.19 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.45 3d1f n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1f s ALA 313 N -1.22 2.64 0.46 4.61 0.00 -1.26 -4.84 121.76 122.15 3d1f s ALA 313 Ca 0.00 0.62 -0.23 0.00 0.00 0.00 0.00 51.96 52.35 3d1f s ALA 313 Cb 0.00 -3.31 -0.07 0.00 0.00 0.00 0.00 23.12 19.74 3d1f s ALA 313 CO 0.00 -0.92 1.20 -1.21 0.00 0.00 0.00 175.76 174.83 3d1f s GLU 314 N -3.72 3.74 0.06 0.00 2.02 -1.26 -4.86 118.70 114.68 3d1f s GLU 314 Ca 0.68 1.87 -0.26 0.00 0.02 0.00 0.00 54.97 57.28 3d1f s GLU 314 Cb -0.20 -2.45 0.08 0.00 0.10 0.00 0.00 34.13 31.65 3d1f s GLU 314 CO 0.33 -0.60 0.68 1.41 0.02 0.00 0.00 175.26 177.11 3d1f s MET 315 N -2.63 1.12 -0.07 1.61 1.75 -0.91 -5.00 119.30 115.17 3d1f s MET 315 Ca 0.63 -0.23 0.04 0.00 -1.25 0.00 0.00 55.69 54.88 3d1f s MET 315 Cb -0.31 0.52 -0.02 0.00 2.84 0.00 0.00 34.83 37.86 3d1f s MET 315 CO 0.38 -0.45 -0.18 -2.00 -0.65 0.00 0.00 175.02 172.12 3d1f s GLU 316 N -2.86 2.72 -0.11 4.11 -6.30 -1.26 -1.08 118.70 113.92 3d1f s GLU 316 Ca -0.02 -0.77 -0.08 0.00 -2.50 0.00 0.00 54.97 51.60 3d1f s GLU 316 Cb -0.01 -2.36 0.04 0.00 0.00 0.00 0.00 34.13 31.80 3d1f s GLU 316 CO -0.06 0.45 0.28 -1.50 0.02 0.00 0.00 175.26 174.45 3d1f s ILE 317 N -0.28 -0.01 0.11 -3.70 2.07 -0.18 -4.67 121.20 114.53 3d1f s ILE 317 Ca 0.01 0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.32 3d1f s ILE 317 Cb -0.13 -0.41 -0.04 0.00 0.13 0.00 0.00 42.46 42.01 3d1f s ILE 317 CO 0.03 0.02 0.23 -0.83 -1.91 0.00 0.00 174.94 172.48 3d1f s GLY 318 N 0.59 1.95 0.06 1.50 0.00 -1.23 -0.53 107.32 109.65 3d1f s GLY 318 Ca -0.04 -0.95 -0.11 0.00 0.00 0.00 0.00 44.72 43.62 3d1f s GLY 318 CO -0.03 -0.94 0.24 -1.36 0.00 0.00 0.00 173.10 171.01 3d1f s PHE 319 N -1.62 0.01 -0.40 1.90 0.40 -0.63 -0.26 117.98 117.39 3d1f s PHE 319 Ca 0.34 -0.26 -0.29 0.00 -0.60 0.00 0.00 56.93 56.12 3d1f s PHE 319 Cb -0.12 0.02 0.02 0.00 0.51 0.00 0.00 43.02 43.45 3d1f s PHE 319 CO 0.28 -0.50 1.10 1.21 0.70 0.00 0.00 175.22 178.01 3d1f s ASN 320 N -2.31 6.79 0.53 1.36 3.84 -1.26 -1.26 114.94 122.63 3d1f s ASN 320 Ca -0.02 0.76 0.20 0.00 0.21 0.00 0.00 52.86 54.01 3d1f s ASN 320 Cb 0.01 -2.54 1.36 0.00 -0.55 0.00 0.00 41.25 39.52 3d1f s ASN 320 CO -0.06 -1.06 2.12 1.62 -2.79 0.00 0.00 177.10 176.94 3d1f h VAL 321 N 5.97 0.88 -0.45 -5.21 3.04 -1.24 -2.05 116.25 117.19 3d1f h VAL 321 Ca -0.22 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.39 3d1f h VAL 321 Cb 1.06 0.94 -0.02 0.00 -2.01 0.00 0.00 31.29 31.26 3d1f h VAL 321 CO 1.08 0.00 -0.06 0.28 -1.01 0.00 0.00 177.57 177.86 3d1f h SER 322 N 0.00 0.76 -0.38 3.17 0.02 -1.91 0.21 113.55 115.42 3d1f h SER 322 Ca 0.06 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.70 3d1f h SER 322 Cb 0.24 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3d1f h SER 322 CO -0.00 0.86 -0.14 1.88 -1.14 0.00 0.00 176.83 178.29 3d1f h TYR 323 N 0.72 0.94 -0.09 3.45 0.05 -1.77 -0.12 116.97 120.15 3d1f h TYR 323 Ca 0.13 -0.19 -0.03 0.00 0.05 0.00 0.00 58.73 58.70 3d1f h TYR 323 Cb 0.52 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.02 3d1f h TYR 323 CO 0.03 0.93 -0.05 0.28 -1.05 0.00 0.00 178.16 178.29 3d1f h VAL 324 N 0.76 1.33 -0.72 -2.88 2.07 -1.29 -2.90 116.25 112.60 3d1f h VAL 324 Ca 0.12 -1.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 3d1f h VAL 324 Cb 0.65 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 32.24 3d1f h VAL 324 CO 0.05 0.31 0.44 -0.07 0.02 0.00 0.00 177.57 178.31 3d1f h LEU 325 N -0.17 0.86 -0.48 2.57 3.38 -0.86 -1.25 115.31 119.35 3d1f h LEU 325 Ca 0.02 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.00 3d1f h LEU 325 Cb 0.51 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 3d1f h LEU 325 CO 0.01 0.66 0.20 0.44 0.09 0.00 0.00 178.44 179.84 3d1f h ASP 326 N 0.99 0.23 0.15 -0.43 3.32 -0.94 0.17 116.42 119.92 3d1f h ASP 326 Ca 0.26 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 3d1f h ASP 326 Cb -0.05 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3d1f h ASP 326 CO -0.05 0.17 -0.07 0.58 -1.72 0.00 0.00 179.24 178.15 3d1f h VAL 327 N 0.39 0.94 -0.90 -1.35 2.07 -1.18 -1.46 116.25 114.76 3d1f h VAL 327 Ca 0.23 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3d1f h VAL 327 Cb 0.20 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 3d1f h VAL 327 CO -0.21 0.09 0.59 -0.07 0.02 0.00 0.00 177.57 177.99 3d1f h LEU 328 N -0.37 0.93 -0.97 2.57 3.38 -0.87 0.59 115.31 120.57 3d1f h LEU 328 Ca -0.02 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 3d1f h LEU 328 Cb 0.29 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3d1f h LEU 328 CO 0.03 0.61 -0.50 0.78 0.09 0.00 0.00 178.44 179.45 3d1f h ASN 329 N 1.06 0.00 1.14 -0.43 -0.26 -0.55 -2.75 115.58 113.79 3d1f h ASN 329 Ca 0.38 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.97 3d1f h ASN 329 Cb 0.14 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.38 3d1f h ASN 329 CO -0.13 0.50 -0.70 0.00 -1.06 0.00 0.00 177.43 176.04 3d1f h ALA 330 N 1.50 0.61 -2.06 -0.83 0.00 -0.09 -3.38 119.26 115.00 3d1f h ALA 330 Ca -0.00 -0.63 -0.70 0.00 0.00 0.00 0.00 54.91 53.57 3d1f h ALA 330 Cb 0.91 -0.11 -0.19 0.00 0.00 0.00 0.00 17.79 18.40 3d1f h ALA 330 CO 0.06 0.87 0.49 -0.51 0.00 0.00 0.00 179.25 180.16 3d1f s LEU 331 N -6.74 5.38 -1.24 0.00 1.43 0.07 -4.92 118.68 112.67 3d1f s LEU 331 Ca 0.02 -1.90 -0.09 0.00 -1.03 0.00 0.00 54.13 51.13 3d1f s LEU 331 Cb 0.09 -2.34 0.19 0.00 0.03 0.00 0.00 46.19 44.17 3d1f s LEU 331 CO 0.77 -1.03 1.77 0.29 0.23 0.00 0.00 176.35 178.38 3d1f n LYS 332 N 6.14 3.76 -4.39 1.70 5.02 -1.26 -4.84 118.16 124.30 3d1f n LYS 332 Ca 0.11 -3.75 -0.22 0.00 -2.02 0.00 0.00 58.31 52.43 3d1f n LYS 332 Cb 0.47 -2.85 -0.08 0.00 -0.02 0.00 0.00 35.03 32.54 3d1f n LYS 332 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d1f h GLU 334 N 2.03 -0.16 -6.54 0.00 4.57 -1.97 -3.41 114.58 109.10 3d1f h GLU 334 Ca -0.31 0.01 -0.62 0.00 -1.18 0.00 0.00 59.36 57.25 3d1f h GLU 334 Cb 1.25 0.04 -0.22 0.00 -0.16 0.00 0.00 28.75 29.66 3d1f h GLU 334 CO 0.49 0.24 -0.85 -0.80 -1.18 0.00 0.00 179.01 176.91 3d1f s ASN 335 N -5.56 2.94 0.06 1.04 0.02 -1.26 -0.08 114.94 112.11 3d1f s ASN 335 Ca -0.10 -0.72 0.08 0.00 -1.02 0.00 0.00 52.86 51.10 3d1f s ASN 335 Cb -0.00 -0.18 -0.03 0.00 0.02 0.00 0.00 41.25 41.06 3d1f s ASN 335 CO 0.38 0.12 -0.23 0.54 0.02 0.00 0.00 177.10 177.93 3d1f s VAL 336 N -1.14 1.89 -0.03 1.60 0.11 0.14 -0.90 120.40 122.07 3d1f s VAL 336 Ca 0.11 -1.37 0.06 0.00 -2.93 0.00 0.00 61.98 57.85 3d1f s VAL 336 Cb -0.10 -1.65 -0.02 0.00 -1.53 0.00 0.00 36.38 33.08 3d1f s VAL 336 CO 0.05 0.20 -0.22 -0.60 -3.33 0.00 0.00 175.10 171.20 3d1f s ARG 337 N -1.41 2.24 -0.04 1.54 3.52 0.19 -1.58 118.95 123.40 3d1f s ARG 337 Ca 0.09 -0.85 0.03 0.00 -0.13 0.00 0.00 55.73 54.87 3d1f s ARG 337 Cb -0.09 -2.16 0.00 0.00 -1.56 0.00 0.00 34.95 31.14 3d1f s ARG 337 CO 0.03 0.58 -0.13 -1.64 -0.81 0.00 0.00 175.30 173.32 3d1f s MET 338 N -0.67 1.52 -0.15 5.12 -1.94 0.11 -1.47 119.30 121.82 3d1f s MET 338 Ca 0.11 -0.47 0.02 0.00 -1.71 0.00 0.00 55.69 53.64 3d1f s MET 338 Cb -0.10 -1.32 0.01 0.00 2.01 0.00 0.00 34.83 35.42 3d1f s MET 338 CO -0.00 0.14 -0.20 -1.64 -0.01 0.00 0.00 175.02 173.31 3d1f s MET 339 N 0.26 3.07 0.33 2.03 -1.94 0.28 -0.99 119.30 122.34 3d1f s MET 339 Ca -0.07 -0.83 0.03 0.00 -1.71 0.00 0.00 55.69 53.12 3d1f s MET 339 Cb -0.12 -2.49 -0.05 0.00 2.01 0.00 0.00 34.83 34.18 3d1f s MET 339 CO 0.02 -0.01 0.08 -0.51 -0.01 0.00 0.00 175.02 174.58 3d1f s LEU 340 N 0.84 2.05 0.00 -0.03 1.02 -0.21 -1.59 118.68 120.75 3d1f s LEU 340 Ca -0.06 -1.43 0.00 0.00 0.02 0.00 0.00 54.13 52.65 3d1f s LEU 340 Cb -0.15 -0.26 0.00 0.00 0.02 0.00 0.00 46.19 45.80 3d1f s LEU 340 CO -0.02 -0.69 0.00 0.35 0.02 0.00 0.00 176.35 176.01 3d1f n THR 341 N -0.69 0.00 -3.94 5.49 -2.24 -1.26 -2.25 114.28 109.39 3d1f n THR 341 Ca -0.03 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.49 3d1f n THR 341 Cb 0.66 -0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 3d1f n THR 341 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3d1f s ASP 342 N 1.00 4.61 0.32 3.42 1.47 -1.26 -4.84 116.67 121.39 3d1f s ASP 342 Ca 0.00 -1.22 0.24 0.00 1.18 0.00 0.00 52.55 52.74 3d1f s ASP 342 Cb 0.00 0.27 1.17 0.00 -0.34 0.00 0.00 42.92 44.02 3d1f s ASP 342 CO 0.00 -1.00 1.72 0.28 0.68 0.00 0.00 175.17 176.85 3d1f h SER 343 N 0.87 0.00 0.00 2.11 0.02 -2.01 -2.98 113.55 111.57 3d1f h SER 343 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 3d1f h SER 343 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 3d1f h SER 343 CO 0.60 0.00 -0.07 1.33 -1.14 0.00 0.00 176.83 177.55 3d1f n VAL 344 N -2.31 1.06 -4.08 2.27 0.24 -1.26 -4.57 118.33 109.67 3d1f n VAL 344 Ca -0.00 -1.20 -0.22 0.00 -2.04 0.00 0.00 64.34 60.88 3d1f n VAL 344 Cb 0.11 0.30 -0.05 0.00 -1.47 0.00 0.00 33.84 32.73 3d1f n VAL 344 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3d1f s SER 345 N -1.55 5.11 0.38 -1.34 0.01 -1.13 -4.75 113.70 110.43 3d1f s SER 345 Ca 0.12 -0.48 -0.25 0.00 1.31 0.00 0.00 55.95 56.65 3d1f s SER 345 Cb 0.10 -1.07 -0.12 0.00 0.21 0.00 0.00 66.02 65.14 3d1f s SER 345 CO 0.01 -0.14 0.87 -1.20 0.41 0.00 0.00 173.24 173.19 3d1f n SER 346 N -1.15 0.62 -4.18 2.44 7.64 -1.26 -4.45 113.62 113.27 3d1f n SER 346 Ca -0.05 1.04 -0.31 0.00 1.01 0.00 0.00 58.87 60.56 3d1f n SER 346 Cb 0.59 -1.26 -0.17 0.00 -1.01 0.00 0.00 64.21 62.36 3d1f n SER 346 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3d1f s VAL 347 N -1.26 1.88 -0.16 0.44 1.01 -0.93 -4.47 120.40 116.90 3d1f s VAL 347 Ca 0.62 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 3d1f s VAL 347 Cb -0.62 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3d1f s VAL 347 CO 0.58 0.52 0.10 -1.58 0.00 0.00 0.00 175.10 174.72 3d1f s GLN 348 N 0.40 3.82 -0.03 2.72 0.74 -0.62 -1.16 119.66 125.52 3d1f s GLN 348 Ca -0.18 -0.24 0.04 0.00 0.05 0.00 0.00 55.36 55.03 3d1f s GLN 348 Cb -0.17 -3.25 -0.01 0.00 1.10 0.00 0.00 33.01 30.68 3d1f s GLN 348 CO 0.08 0.46 -0.16 0.42 -0.55 0.00 0.00 175.29 175.54 3d1f s ILE 349 N -0.14 1.29 0.23 -2.34 1.01 0.12 -0.56 121.20 120.82 3d1f s ILE 349 Ca 0.09 -0.66 -0.19 0.00 0.00 0.00 0.00 60.65 59.89 3d1f s ILE 349 Cb -0.12 -1.10 0.03 0.00 0.01 0.00 0.00 42.46 41.28 3d1f s ILE 349 CO 0.01 0.37 0.60 -1.83 0.00 0.00 0.00 174.94 174.09 3d1f s GLU 350 N -0.10 1.55 0.12 2.79 -1.05 -0.54 -0.97 118.70 120.49 3d1f s GLU 350 Ca 0.00 -0.92 -0.31 0.00 -0.15 0.00 0.00 54.97 53.59 3d1f s GLU 350 Cb -0.09 0.56 -0.09 0.00 -0.44 0.00 0.00 34.13 34.06 3d1f s GLU 350 CO 0.01 -0.68 1.57 0.34 0.95 0.00 0.00 175.26 177.45 3d1f s ASP 351 N -2.90 6.63 0.64 0.83 -1.08 -1.25 -0.64 116.67 118.90 3d1f s ASP 351 Ca 0.11 2.51 0.42 0.00 -0.52 0.00 0.00 52.55 55.07 3d1f s ASP 351 Cb -0.03 -2.58 2.17 0.00 -1.46 0.00 0.00 42.92 41.02 3d1f s ASP 351 CO 0.01 -0.82 2.28 0.00 0.52 0.00 0.00 175.17 177.16 3d1f h ALA 352 N 7.39 1.02 -0.47 3.66 0.00 -1.31 -2.43 119.26 127.12 3d1f h ALA 352 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3d1f h ALA 352 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3d1f h ALA 352 CO 0.91 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.17 3d1f n ALA 353 N -2.09 2.97 -3.64 0.00 0.00 -1.26 -4.97 120.51 111.52 3d1f n ALA 353 Ca -0.02 -1.76 -0.06 0.00 0.00 0.00 0.00 53.44 51.60 3d1f n ALA 353 Cb 0.13 -0.82 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 3d1f n ALA 353 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3d1f s SER 354 N -1.22 -0.61 0.00 0.00 0.15 -0.92 -5.03 113.70 106.08 3d1f s SER 354 Ca 0.43 1.04 0.19 0.00 0.70 0.00 0.00 55.95 58.31 3d1f s SER 354 Cb 0.30 1.18 0.54 0.00 -1.71 0.00 0.00 66.02 66.34 3d1f s SER 354 CO 0.17 -0.17 1.45 0.00 1.20 0.00 0.00 173.24 175.90 3d1f n GLN 355 N 3.35 2.76 0.23 5.44 6.02 -1.26 -3.97 117.38 129.95 3d1f n GLN 355 Ca -0.17 -2.48 0.06 0.00 -0.01 0.00 0.00 57.00 54.41 3d1f n GLN 355 Cb 0.57 -1.48 0.53 0.00 1.02 0.00 0.00 30.24 30.88 3d1f n GLN 355 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3d1f h SER 356 N 3.64 0.00 -4.31 1.08 4.64 -1.95 -3.43 113.55 113.21 3d1f h SER 356 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 3d1f h SER 356 Cb 0.91 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.76 3d1f h SER 356 CO 0.00 0.19 -0.81 0.00 -0.87 0.00 0.00 176.83 175.34 3d1f s ALA 357 N -4.52 1.37 -0.00 5.18 0.00 -1.26 -1.27 121.76 121.26 3d1f s ALA 357 Ca -0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 3d1f s ALA 357 Cb 0.15 -0.22 -0.00 0.00 0.00 0.00 0.00 23.12 23.04 3d1f s ALA 357 CO 0.68 0.27 0.04 0.00 0.00 0.00 0.00 175.76 176.75 3d1f s ALA 358 N -0.89 -0.08 -0.01 0.00 0.00 0.31 -4.61 121.76 116.48 3d1f s ALA 358 Ca 0.03 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 51.86 3d1f s ALA 358 Cb -0.08 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 3d1f s ALA 358 CO 0.02 -0.11 -0.16 0.71 0.00 0.00 0.00 175.76 176.22 3d1f s TYR 359 N -0.81 1.40 -0.08 0.00 2.02 -0.15 -1.12 117.35 118.62 3d1f s TYR 359 Ca -0.09 -0.27 0.04 0.00 -0.37 0.00 0.00 57.07 56.38 3d1f s TYR 359 Cb -0.05 -0.91 0.00 0.00 -0.40 0.00 0.00 41.96 40.60 3d1f s TYR 359 CO -0.00 -0.03 -0.20 0.08 -1.57 0.00 0.00 175.55 173.83 3d1f s VAL 360 N -0.34 1.69 -0.08 0.71 1.01 -0.15 0.15 120.40 123.39 3d1f s VAL 360 Ca 0.05 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.23 3d1f s VAL 360 Cb -0.06 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 34.86 3d1f s VAL 360 CO -0.00 0.48 -0.11 -0.69 0.00 0.00 0.00 175.10 174.78 3d1f s VAL 361 N 0.33 1.09 0.05 2.92 1.01 -0.31 -0.20 120.40 125.30 3d1f s VAL 361 Ca -0.14 -0.41 -0.25 0.00 0.00 0.00 0.00 61.98 61.18 3d1f s VAL 361 Cb -0.16 -1.03 -0.06 0.00 0.00 0.00 0.00 36.38 35.14 3d1f s VAL 361 CO 0.06 0.36 0.78 -0.04 0.00 0.00 0.00 175.10 176.25 3d1f s MET 362 N 0.99 4.51 1.14 2.72 -1.94 -0.35 -2.18 119.30 124.19 3d1f s MET 362 Ca -0.09 1.09 -0.18 0.00 -1.71 0.00 0.00 55.69 54.80 3d1f s MET 362 Cb -0.15 -3.36 0.26 0.00 2.01 0.00 0.00 34.83 33.60 3d1f s MET 362 CO -0.00 0.30 1.15 -1.25 -0.01 0.00 0.00 175.02 175.21 3d1f s PRO 363 N -0.12 -0.72 0.07 2.03 0.04 -1.26 -4.77 135.00 130.26 3d1f s PRO 363 Ca 0.39 -0.10 0.06 0.00 0.04 0.00 0.00 61.00 61.39 3d1f s PRO 363 Cb -0.21 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 3d1f s PRO 363 CO 0.23 -3.37 -0.11 -1.64 0.04 0.00 0.00 177.00 172.15 3d1f s MET 364 N -5.48 2.21 -0.56 4.56 -1.94 0.65 -4.93 119.30 113.81 3d1f s MET 364 Ca 0.71 -0.95 -0.25 0.00 -1.71 0.00 0.00 55.69 53.49 3d1f s MET 364 Cb -0.09 -2.32 0.04 0.00 2.01 0.00 0.00 34.83 34.46 3d1f s MET 364 CO 0.55 0.54 1.00 1.03 -0.01 0.00 0.00 175.02 178.13 3d1f s ARG 365 N -1.88 3.36 0.00 2.03 0.52 -1.26 -3.55 118.95 118.18 3d1f s ARG 365 Ca 0.19 -0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.24 3d1f s ARG 365 Cb -0.11 -4.05 0.00 0.00 0.52 0.00 0.00 34.95 31.31 3d1f s ARG 365 CO 0.11 -1.55 0.00 1.47 0.02 0.00 0.00 175.30 175.35