#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 0.71 0.14 2.12 2.20 -0.71 -1.14 119.74 123.06 3d1f s LYS 2 Ca 0.00 0.67 -0.24 0.00 -0.36 0.00 0.00 55.97 56.05 3d1f s LYS 2 Cb 0.00 0.34 0.07 0.00 -1.51 0.00 0.00 37.83 36.73 3d1f s LYS 2 CO 0.00 -0.11 0.64 -0.59 -0.36 0.00 0.00 175.35 174.93 3d1f s PHE 3 N 0.04 -0.51 -0.06 4.03 -0.71 -0.59 -0.38 117.98 119.81 3d1f s PHE 3 Ca -0.02 0.30 -0.02 0.00 -1.04 0.00 0.00 56.93 56.15 3d1f s PHE 3 Cb -0.04 0.56 0.03 0.00 -1.21 0.00 0.00 43.02 42.37 3d1f s PHE 3 CO 0.02 -0.82 0.06 0.99 -1.34 0.00 0.00 175.22 174.13 3d1f s THR 4 N -3.67 -0.09 0.05 -4.49 2.01 -1.26 0.25 115.64 108.44 3d1f s THR 4 Ca 0.02 0.34 0.03 0.00 0.31 0.00 0.00 61.69 62.38 3d1f s THR 4 Cb -0.01 -0.22 -0.03 0.00 0.01 0.00 0.00 72.50 72.25 3d1f s THR 4 CO -0.12 0.11 -0.09 0.54 -0.69 0.00 0.00 174.62 174.37 3d1f s VAL 5 N 2.16 0.70 0.42 3.82 0.11 -0.65 -4.51 120.40 122.45 3d1f s VAL 5 Ca 0.05 -1.16 -0.25 0.00 -2.93 0.00 0.00 61.98 57.69 3d1f s VAL 5 Cb -0.13 -0.75 -0.08 0.00 -1.53 0.00 0.00 36.38 33.89 3d1f s VAL 5 CO -0.04 -0.35 1.25 -1.61 -3.33 0.00 0.00 175.10 171.02 3d1f s GLU 6 N -1.67 3.89 0.22 1.54 2.02 -1.26 -0.95 118.70 122.48 3d1f s GLU 6 Ca -0.07 2.02 -0.08 0.00 0.02 0.00 0.00 54.97 56.85 3d1f s GLU 6 Cb -0.10 -2.64 0.34 0.00 0.10 0.00 0.00 34.13 31.83 3d1f s GLU 6 CO 0.01 -0.51 1.72 -0.09 0.02 0.00 0.00 175.26 176.40 3d1f h ARG 7 N 2.47 0.33 0.00 1.61 2.43 -1.13 -1.56 114.38 118.54 3d1f h ARG 7 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3d1f h ARG 7 Cb 1.25 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3d1f h ARG 7 CO 0.62 0.22 0.00 0.93 -1.51 0.00 0.00 179.97 180.23 3d1f h GLU 8 N 0.34 0.00 -0.00 0.20 3.07 -1.91 -0.89 114.58 115.38 3d1f h GLU 8 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 3d1f h GLU 8 Cb 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3d1f h GLU 8 CO -0.38 0.00 -0.73 0.72 -1.40 0.00 0.00 179.01 177.22 3d1f n HIS 9 N -2.52 0.00 -0.03 4.33 8.25 -0.60 -4.37 115.22 120.28 3d1f n HIS 9 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3d1f n HIS 9 Cb 0.11 -0.08 -0.09 0.00 1.12 0.00 0.00 29.99 31.05 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 -1.25 0.00 0.21 2.41 7.94 -0.45 -4.62 117.00 121.24 3d1f n LEU 10 Ca 0.06 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.81 3d1f n LEU 10 Cb 0.35 0.14 -0.07 0.00 0.53 0.00 0.00 43.42 44.37 3d1f n LEU 10 CO 0.37 0.14 0.69 -0.07 -1.11 0.00 0.00 177.39 177.41 3d1f h LEU 11 N 0.00 -0.70 -0.24 -1.96 3.38 -1.47 -1.75 115.31 112.57 3d1f h LEU 11 Ca -0.16 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3d1f h LEU 11 Cb 1.14 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 3d1f h LEU 11 CO 0.01 -0.40 0.05 0.50 0.09 0.00 0.00 178.44 178.69 3d1f h LYS 12 N -0.60 0.39 -0.45 1.13 3.64 -1.86 -1.54 116.57 117.28 3d1f h LYS 12 Ca -0.02 -0.10 0.07 0.00 -1.27 0.00 0.00 60.65 59.33 3d1f h LYS 12 Cb 0.53 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.24 3d1f h LYS 12 CO -0.02 0.51 0.11 -1.35 -2.27 0.00 0.00 179.45 176.42 3d1f h PRO 13 N 0.21 0.24 -0.87 1.90 0.11 -1.81 0.69 132.00 132.46 3d1f h PRO 13 Ca 0.07 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3d1f h PRO 13 Cb 0.30 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.31 3d1f h PRO 13 CO 0.00 0.16 0.48 -0.07 -0.21 0.00 0.00 178.00 178.36 3d1f h LEU 14 N 0.25 1.09 -0.42 2.35 3.38 -1.20 -1.22 115.31 119.53 3d1f h LEU 14 Ca 0.22 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3d1f h LEU 14 Cb 0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3d1f h LEU 14 CO -0.28 0.88 0.01 -0.61 0.09 0.00 0.00 178.44 178.53 3d1f h GLN 15 N 1.22 0.73 -0.30 1.13 4.15 -0.59 -2.80 115.11 118.66 3d1f h GLN 15 Ca 0.31 -0.23 -0.09 0.00 0.77 0.00 0.00 58.65 59.41 3d1f h GLN 15 Cb 0.03 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 3d1f h GLN 15 CO -0.05 0.81 -0.15 1.96 -1.93 0.00 0.00 178.83 179.47 3d1f h GLN 16 N 0.57 0.63 0.00 1.69 1.08 -0.61 -3.14 115.11 115.33 3d1f h GLN 16 Ca 0.12 -0.28 -0.01 0.00 -1.45 0.00 0.00 58.65 57.04 3d1f h GLN 16 Cb 0.47 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.88 3d1f h GLN 16 CO 0.02 0.86 -0.03 -0.39 -0.95 0.00 0.00 178.83 178.34 3d1f h VAL 17 N 0.38 0.07 0.00 -0.54 -1.51 -1.27 -2.24 116.25 111.14 3d1f h VAL 17 Ca 0.07 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 3d1f h VAL 17 Cb 0.67 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 3d1f h VAL 17 CO 0.04 0.03 0.00 -1.20 -1.23 0.00 0.00 177.57 175.21 3d1f n SER 18 N -3.13 0.00 -0.10 4.19 7.64 -1.06 -3.85 113.62 117.31 3d1f n SER 18 Ca 0.01 0.43 -0.10 0.00 1.01 0.00 0.00 58.87 60.22 3d1f n SER 18 Cb 0.35 -0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 63.02 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 4.66 -0.56 1.84 0.23 0.00 -1.42 -1.74 103.07 106.07 3d1f h GLY 19 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 47.33 47.86 3d1f h GLY 19 CO 0.00 -0.19 0.00 -1.55 0.00 0.00 0.00 176.54 174.80 3d1f n PRO 20 N -5.42 0.06 -2.46 4.80 -0.04 -1.26 -4.74 135.00 125.93 3d1f n PRO 20 Ca -0.01 0.28 -0.42 0.00 -0.04 0.00 0.00 63.50 63.30 3d1f n PRO 20 Cb 0.35 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.28 3d1f n PRO 20 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3d1f s LEU 21 N -2.84 4.34 0.55 1.53 1.02 -0.66 -4.46 118.68 118.16 3d1f s LEU 21 Ca 0.07 1.92 0.31 0.00 0.02 0.00 0.00 54.13 56.44 3d1f s LEU 21 Cb 0.07 -3.57 1.56 0.00 0.02 0.00 0.00 46.19 44.27 3d1f s LEU 21 CO 0.17 -0.48 2.09 1.23 0.02 0.00 0.00 176.35 179.38 3d1f h GLY 22 N 7.22 0.00 0.00 -3.19 0.00 -1.87 -3.46 103.07 101.78 3d1f h GLY 22 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 3d1f h GLY 22 CO 0.82 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.97 3d1f n GLY 23 N -0.56 1.17 2.37 4.60 0.00 -1.26 -4.76 105.19 106.74 3d1f n GLY 23 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.00 0.74 -0.89 1.61 0.63 -1.26 -5.15 116.66 110.34 3d1f n ARG 24 Ca 0.00 -0.91 -0.29 0.00 -0.92 0.00 0.00 57.85 55.73 3d1f n ARG 24 Cb 0.00 0.14 0.19 0.00 0.45 0.00 0.00 32.46 33.24 3d1f n ARG 24 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3d1f s PRO 25 N 0.09 0.23 -0.37 -0.14 0.02 -1.26 -4.92 135.00 128.64 3d1f s PRO 25 Ca 0.08 0.85 0.02 0.00 0.02 0.00 0.00 61.00 61.97 3d1f s PRO 25 Cb 0.25 -1.69 0.50 0.00 0.02 0.00 0.00 34.50 33.58 3d1f s PRO 25 CO -0.07 -2.96 1.76 -2.37 -0.33 0.00 0.00 177.00 173.04 3d1f n THR 26 N -4.38 2.79 -3.33 0.99 5.66 -1.26 -4.71 114.28 110.03 3d1f n THR 26 Ca 0.06 -1.61 -0.09 0.00 -3.05 0.00 0.00 64.05 59.36 3d1f n THR 26 Cb 0.55 -0.68 -0.07 0.00 -1.55 0.00 0.00 70.33 68.58 3d1f n THR 26 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 3d1f s LEU 27 N -2.61 -0.69 0.26 1.09 1.98 -1.26 -5.06 118.68 112.38 3d1f s LEU 27 Ca 0.45 0.06 -0.06 0.00 -2.89 0.00 0.00 54.13 51.69 3d1f s LEU 27 Cb 0.38 1.13 0.49 0.00 0.66 0.00 0.00 46.19 48.84 3d1f s LEU 27 CO 0.07 -0.32 1.62 -0.65 -1.89 0.00 0.00 176.35 175.19 3d1f h PRO 28 N 8.17 0.08 -0.22 0.98 0.11 -2.01 -0.76 132.00 138.36 3d1f h PRO 28 Ca -0.17 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 3d1f h PRO 28 Cb 1.14 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3d1f h PRO 28 CO 0.27 0.05 0.07 0.97 -0.21 0.00 0.00 178.00 179.16 3d1f h ILE 29 N 0.08 1.10 0.00 4.15 6.09 -1.97 -1.20 117.51 125.77 3d1f h ILE 29 Ca 0.44 -0.32 0.00 0.00 -1.37 0.00 0.00 64.86 63.61 3d1f h ILE 29 Cb 0.80 0.86 0.00 0.00 0.47 0.00 0.00 36.82 38.95 3d1f h ILE 29 CO -0.72 0.12 0.00 0.18 -3.07 0.00 0.00 178.15 174.65 3d1f n LEU 30 N -4.43 0.00 -0.89 2.19 4.77 -0.30 -1.44 117.00 116.90 3d1f n LEU 30 Ca 0.00 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.49 3d1f n LEU 30 Cb 0.13 -0.38 0.23 0.00 -2.33 0.00 0.00 43.42 41.07 3d1f n LEU 30 CO 0.36 -0.16 0.70 0.61 -1.33 0.00 0.00 177.39 177.57 3d1f n GLY 31 N 0.26 0.95 3.81 -0.72 0.00 -0.45 -4.74 105.19 104.29 3d1f n GLY 31 Ca 0.07 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.83 5.15 -0.06 1.61 -0.87 -0.52 -1.51 114.94 116.91 3d1f s ASN 32 Ca 0.33 -0.52 0.03 0.00 -1.57 0.00 0.00 52.86 51.13 3d1f s ASN 32 Cb 0.21 -0.99 -0.03 0.00 -0.02 0.00 0.00 41.25 40.42 3d1f s ASN 32 CO 0.31 -0.26 -0.12 -0.76 -2.57 0.00 0.00 177.10 173.70 3d1f s LEU 33 N -3.91 2.85 -0.16 0.60 1.43 0.15 -4.68 118.68 114.96 3d1f s LEU 33 Ca 0.38 -0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.08 3d1f s LEU 33 Cb -0.05 -1.59 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 3d1f s LEU 33 CO 0.25 0.34 0.76 -0.22 0.23 0.00 0.00 176.35 177.70 3d1f s LEU 34 N -0.66 4.19 -0.16 1.79 2.96 0.39 -2.12 118.68 125.07 3d1f s LEU 34 Ca 0.10 1.10 -0.03 0.00 -0.22 0.00 0.00 54.13 55.08 3d1f s LEU 34 Cb -0.11 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.43 3d1f s LEU 34 CO 0.01 -0.32 -0.05 -0.76 -1.32 0.00 0.00 176.35 173.91 3d1f s LEU 35 N 1.83 3.11 -0.06 -0.68 1.02 0.59 -0.94 118.68 123.55 3d1f s LEU 35 Ca 0.36 -0.20 0.00 0.00 0.02 0.00 0.00 54.13 54.31 3d1f s LEU 35 Cb -0.17 -1.75 0.02 0.00 0.02 0.00 0.00 46.19 44.32 3d1f s LEU 35 CO 0.13 0.14 -0.04 -1.10 0.02 0.00 0.00 176.35 175.50 3d1f s GLN 36 N 0.53 0.89 -0.19 1.70 -0.21 -0.03 -1.73 119.66 120.62 3d1f s GLN 36 Ca -0.04 -0.08 -0.03 0.00 0.02 0.00 0.00 55.36 55.22 3d1f s GLN 36 Cb -0.15 -0.98 -0.01 0.00 1.00 0.00 0.00 33.01 32.87 3d1f s GLN 36 CO 0.03 -0.15 -0.05 0.08 -2.12 0.00 0.00 175.29 173.08 3d1f s VAL 37 N 1.25 3.45 -0.27 1.09 1.01 0.05 0.27 120.40 127.25 3d1f s VAL 37 Ca -0.06 -0.48 -0.25 0.00 0.00 0.00 0.00 61.98 61.19 3d1f s VAL 37 Cb -0.14 -2.54 0.10 0.00 0.00 0.00 0.00 36.38 33.80 3d1f s VAL 37 CO -0.02 0.45 0.88 0.00 0.00 0.00 0.00 175.10 176.42 3d1f s ALA 38 N 1.08 -1.88 -1.14 5.51 0.00 -0.52 -2.19 121.76 122.62 3d1f s ALA 38 Ca 0.01 1.92 -0.28 0.00 0.00 0.00 0.00 51.96 53.61 3d1f s ALA 38 Cb -0.15 -1.27 0.04 0.00 0.00 0.00 0.00 23.12 21.74 3d1f s ALA 38 CO -0.00 -0.29 0.67 -3.47 0.00 0.00 0.00 175.76 172.67 3d1f n ASP 39 N 2.36 -4.31 -1.12 0.00 4.64 -1.26 -1.02 116.55 115.84 3d1f n ASP 39 Ca -0.13 -1.23 -0.15 0.00 -1.38 0.00 0.00 54.79 51.90 3d1f n ASP 39 Cb 0.56 -1.71 -0.06 0.00 -1.04 0.00 0.00 41.12 38.86 3d1f n ASP 39 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3d1f n GLY 40 N -2.01 1.43 2.93 0.27 0.00 -1.26 -4.98 105.19 101.58 3d1f n GLY 40 Ca -0.15 -0.10 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.34 0.46 -0.24 2.61 2.01 -0.19 -0.89 115.64 117.05 3d1f s THR 41 Ca 0.00 -0.18 -0.09 0.00 0.31 0.00 0.00 61.69 61.73 3d1f s THR 41 Cb 0.00 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 72.04 3d1f s THR 41 CO 0.00 0.16 0.11 -0.22 -0.69 0.00 0.00 174.62 173.98 3d1f s LEU 42 N 0.27 3.76 -0.12 4.42 2.96 0.42 -1.45 118.68 128.95 3d1f s LEU 42 Ca -0.03 -0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 53.80 3d1f s LEU 42 Cb -0.07 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 3d1f s LEU 42 CO -0.00 0.01 -0.05 -0.44 -1.32 0.00 0.00 176.35 174.55 3d1f s SER 43 N 1.36 4.74 -0.11 3.68 0.01 0.14 -0.26 113.70 123.26 3d1f s SER 43 Ca 0.06 -0.08 0.03 0.00 1.31 0.00 0.00 55.95 57.27 3d1f s SER 43 Cb -0.15 -1.55 0.00 0.00 0.21 0.00 0.00 66.02 64.54 3d1f s SER 43 CO 0.05 0.25 -0.23 -0.76 0.41 0.00 0.00 173.24 172.96 3d1f s LEU 44 N -0.12 2.09 -0.04 2.44 1.02 -0.16 -0.85 118.68 123.06 3d1f s LEU 44 Ca 0.02 -0.57 0.03 0.00 0.02 0.00 0.00 54.13 53.63 3d1f s LEU 44 Cb -0.13 -1.41 0.00 0.00 0.02 0.00 0.00 46.19 44.67 3d1f s LEU 44 CO 0.03 0.13 -0.12 -0.89 0.02 0.00 0.00 176.35 175.51 3d1f s THR 45 N 0.53 1.06 0.06 5.49 2.01 -0.12 -1.05 115.64 123.63 3d1f s THR 45 Ca -0.14 -0.50 0.08 0.00 0.31 0.00 0.00 61.69 61.43 3d1f s THR 45 Cb -0.17 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 3d1f s THR 45 CO 0.05 0.32 -0.21 -0.83 -0.69 0.00 0.00 174.62 173.26 3d1f s GLY 46 N 0.19 1.16 0.15 4.40 0.00 -0.77 -0.46 107.32 111.98 3d1f s GLY 46 Ca -0.05 -1.11 -0.15 0.00 0.00 0.00 0.00 44.72 43.42 3d1f s GLY 46 CO 0.01 -1.06 0.39 -1.08 0.00 0.00 0.00 173.10 171.37 3d1f s THR 47 N -0.90 0.06 -0.04 0.90 -1.32 -1.26 -1.36 115.64 111.72 3d1f s THR 47 Ca 0.07 -0.83 0.06 0.00 -1.21 0.00 0.00 61.69 59.78 3d1f s THR 47 Cb -0.09 -1.41 0.08 0.00 -1.51 0.00 0.00 72.50 69.57 3d1f s THR 47 CO 0.02 -0.29 1.00 -0.90 -2.21 0.00 0.00 174.62 172.24 3d1f n ASP 48 N -0.24 0.78 0.00 8.08 5.75 -1.08 -4.63 116.55 125.22 3d1f n ASP 48 Ca -0.13 -2.22 0.00 0.00 -0.01 0.00 0.00 54.79 52.43 3d1f n ASP 48 Cb 0.63 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 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 -0.45 0.00 -0.04 -2.12 4.77 -1.26 -4.70 117.00 113.21 3d1f n LEU 49 Ca 0.05 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.97 3d1f n LEU 49 Cb 0.64 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.59 3d1f n LEU 49 CO 0.00 0.00 -0.77 -0.62 -1.33 0.00 0.00 177.39 174.68 3d1f n GLU 50 N -0.16 0.66 -3.82 3.23 -0.58 -1.26 -4.90 120.64 113.80 3d1f n GLU 50 Ca 0.00 0.10 -0.09 0.00 -0.42 0.00 0.00 57.16 56.75 3d1f n GLU 50 Cb 0.00 -1.65 -0.06 0.00 -0.57 0.00 0.00 31.44 29.15 3d1f n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3d1f s MET 51 N -2.71 0.96 0.02 3.49 0.23 -1.26 -1.42 119.30 118.60 3d1f s MET 51 Ca -0.07 -0.93 -0.01 0.00 -1.03 0.00 0.00 55.69 53.64 3d1f s MET 51 Cb 0.08 0.38 -0.02 0.00 -1.53 0.00 0.00 34.83 33.74 3d1f s MET 51 CO 0.83 -0.34 0.00 -1.83 -2.03 0.00 0.00 175.02 171.66 3d1f s GLU 52 N -3.87 0.37 -0.12 3.16 -1.05 0.51 -2.63 118.70 115.07 3d1f s GLU 52 Ca 0.07 -0.62 0.02 0.00 -0.15 0.00 0.00 54.97 54.28 3d1f s GLU 52 Cb 0.04 0.14 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 3d1f s GLU 52 CO -0.09 -0.07 -0.16 1.41 0.95 0.00 0.00 175.26 177.30 3d1f s MET 53 N -1.64 2.37 -0.07 -4.83 -2.45 -0.46 -1.46 119.30 110.75 3d1f s MET 53 Ca -0.14 -0.61 0.05 0.00 -1.25 0.00 0.00 55.69 53.74 3d1f s MET 53 Cb -0.08 -2.01 -0.01 0.00 1.25 0.00 0.00 34.83 33.98 3d1f s MET 53 CO -0.01 -0.07 -0.24 0.08 1.05 0.00 0.00 175.02 175.83 3d1f s VAL 54 N 1.01 2.14 -0.03 10.11 1.01 0.25 -1.86 120.40 133.04 3d1f s VAL 54 Ca -0.05 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 60.97 3d1f s VAL 54 Cb -0.15 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 3d1f s VAL 54 CO -0.03 0.57 -0.22 0.00 0.00 0.00 0.00 175.10 175.42 3d1f s ALA 55 N -0.03 1.86 -0.14 5.51 0.00 -0.21 0.25 121.76 129.01 3d1f s ALA 55 Ca -0.07 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 50.96 3d1f s ALA 55 Cb -0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 3d1f s ALA 55 CO 0.05 0.42 -0.16 1.03 0.00 0.00 0.00 175.76 177.11 3d1f s ARG 56 N -0.38 3.25 -0.20 0.00 0.52 -0.48 -0.99 118.95 120.67 3d1f s ARG 56 Ca 0.05 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 54.52 3d1f s ARG 56 Cb -0.10 -2.58 0.03 0.00 0.52 0.00 0.00 34.95 32.83 3d1f s ARG 56 CO 0.00 0.11 -0.15 0.08 0.02 0.00 0.00 175.30 175.37 3d1f s VAL 57 N 0.58 1.91 0.35 3.52 1.01 0.64 -4.87 120.40 123.53 3d1f s VAL 57 Ca -0.09 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.55 3d1f s VAL 57 Cb -0.16 -1.85 -0.11 0.00 0.00 0.00 0.00 36.38 34.26 3d1f s VAL 57 CO 0.03 0.32 1.47 0.00 0.00 0.00 0.00 175.10 176.93 3d1f s ALA 58 N 1.31 3.59 -0.43 5.51 0.00 -1.26 -0.43 121.76 130.04 3d1f s ALA 58 Ca 0.01 1.51 -0.05 0.00 0.00 0.00 0.00 51.96 53.43 3d1f s ALA 58 Cb -0.15 -3.59 0.11 0.00 0.00 0.00 0.00 23.12 19.48 3d1f s ALA 58 CO -0.10 -0.97 0.25 -0.51 0.00 0.00 0.00 175.76 174.43 3d1f s LEU 59 N -1.75 5.35 0.05 0.00 1.43 -0.07 -4.84 118.68 118.86 3d1f s LEU 59 Ca 0.54 -1.92 0.26 0.00 -1.03 0.00 0.00 54.13 51.98 3d1f s LEU 59 Cb -0.45 -1.90 0.61 0.00 0.03 0.00 0.00 46.19 44.48 3d1f s LEU 59 CO 0.59 -0.58 1.51 1.33 0.23 0.00 0.00 176.35 179.42 3d1f n VAL 60 N 4.73 0.15 -4.04 -1.59 0.24 -1.26 -4.81 118.33 111.74 3d1f n VAL 60 Ca -0.05 -0.10 -0.23 0.00 -2.04 0.00 0.00 64.34 61.91 3d1f n VAL 60 Cb 0.41 -0.06 -0.04 0.00 -1.47 0.00 0.00 33.84 32.68 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 -3.06 3.14 0.42 7.34 -0.21 -1.26 -5.06 119.66 120.97 3d1f s GLN 61 Ca 0.10 -0.86 -0.23 0.00 0.02 0.00 0.00 55.36 54.39 3d1f s GLN 61 Cb 0.16 -2.73 -0.12 0.00 1.00 0.00 0.00 33.01 31.32 3d1f s GLN 61 CO 0.67 0.45 0.71 -0.35 -2.12 0.00 0.00 175.29 174.65 3d1f n PRO 62 N -0.95 0.82 -3.83 2.91 -0.04 -1.26 -4.80 135.00 127.85 3d1f n PRO 62 Ca -0.08 0.30 -0.09 0.00 -0.04 0.00 0.00 63.50 63.59 3d1f n PRO 62 Cb 0.56 -1.69 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 3d1f n PRO 62 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 3d1f s HIS 63 N -1.40 -0.05 -0.02 0.54 -3.43 -1.26 -4.20 115.29 105.48 3d1f s HIS 63 Ca 0.64 -0.33 0.03 0.00 -0.80 0.00 0.00 55.06 54.59 3d1f s HIS 63 Cb -0.59 0.46 -0.00 0.00 -1.43 0.00 0.00 32.58 31.02 3d1f s HIS 63 CO 0.57 -1.04 -0.09 -1.21 -2.00 0.00 0.00 174.74 170.96 3d1f s GLU 64 N -3.92 0.91 0.81 -0.38 2.02 0.49 -4.94 118.70 113.69 3d1f s GLU 64 Ca 0.13 -0.32 -0.12 0.00 0.02 0.00 0.00 54.97 54.67 3d1f s GLU 64 Cb -0.03 -0.86 0.08 0.00 0.10 0.00 0.00 34.13 33.42 3d1f s GLU 64 CO 0.03 0.15 1.16 -1.25 0.02 0.00 0.00 175.26 175.37 3d1f s PRO 65 N 0.04 1.73 0.00 0.39 0.04 -1.26 -1.74 135.00 134.20 3d1f s PRO 65 Ca -0.01 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.61 3d1f s PRO 65 Cb -0.07 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.67 3d1f s PRO 65 CO 0.00 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.34 3d1f n GLY 66 N 0.04 0.19 3.43 0.56 0.00 -0.93 -3.11 105.19 105.36 3d1f n GLY 66 Ca 0.12 -1.63 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.52 -1.51 0.18 4.61 0.00 -1.26 -0.77 121.76 121.49 3d1f s ALA 67 Ca 0.00 0.72 -0.22 0.00 0.00 0.00 0.00 51.96 52.46 3d1f s ALA 67 Cb 0.00 0.47 0.08 0.00 0.00 0.00 0.00 23.12 23.66 3d1f s ALA 67 CO 0.00 -0.56 1.03 -0.08 0.00 0.00 0.00 175.76 176.15 3d1f s THR 68 N -2.61 0.00 -0.01 0.00 -1.32 -0.71 -4.58 115.64 106.41 3d1f s THR 68 Ca -0.04 -0.59 0.02 0.00 -1.21 0.00 0.00 61.69 59.87 3d1f s THR 68 Cb -0.01 -2.82 -0.00 0.00 -1.51 0.00 0.00 72.50 68.17 3d1f s THR 68 CO -0.03 0.00 -0.08 0.42 -2.21 0.00 0.00 174.62 172.72 3d1f s THR 69 N -2.25 0.69 0.09 5.08 -4.23 -1.01 -0.30 115.64 113.70 3d1f s THR 69 Ca 0.21 -0.34 0.02 0.00 -1.18 0.00 0.00 61.69 60.39 3d1f s THR 69 Cb -0.02 -0.60 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 3d1f s THR 69 CO 0.05 0.21 -0.07 0.68 -0.54 0.00 0.00 174.62 174.95 3d1f s VAL 70 N -0.01 0.65 -0.11 2.29 -7.23 -0.90 -1.99 120.40 113.09 3d1f s VAL 70 Ca 0.00 -1.78 -0.35 0.00 -1.81 0.00 0.00 61.98 58.05 3d1f s VAL 70 Cb -0.06 -1.48 -0.12 0.00 0.56 0.00 0.00 36.38 35.28 3d1f s VAL 70 CO -0.00 -0.79 1.86 -2.65 -0.31 0.00 0.00 175.10 173.21 3d1f n PRO 71 N 0.23 2.07 0.28 4.82 -0.02 -1.26 -0.68 135.00 140.45 3d1f n PRO 71 Ca -0.14 0.76 -0.16 0.00 -2.02 0.00 0.00 63.50 61.94 3d1f n PRO 71 Cb 0.60 -2.59 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 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 8.96 -0.66 -0.36 3.55 0.00 -1.56 -2.19 119.26 126.99 3d1f h ALA 72 Ca -0.48 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.30 3d1f h ALA 72 Cb 1.28 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 3d1f h ALA 72 CO 0.95 -0.86 0.19 -0.09 0.00 0.00 0.00 179.25 179.43 3d1f h ARG 73 N -0.68 0.37 -0.36 0.00 1.12 -1.91 -0.83 114.38 112.10 3d1f h ARG 73 Ca -0.07 -0.02 -0.03 0.00 -1.11 0.00 0.00 59.98 58.75 3d1f h ARG 73 Cb 0.52 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 30.38 3d1f h ARG 73 CO 0.11 0.25 0.10 0.87 -3.11 0.00 0.00 179.97 178.19 3d1f h LYS 74 N 0.38 0.57 -0.64 0.20 1.57 -1.95 -0.75 116.57 115.95 3d1f h LYS 74 Ca 0.15 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 3d1f h LYS 74 Cb 0.05 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 3d1f h LYS 74 CO -0.10 0.59 0.26 0.35 -0.57 0.00 0.00 179.45 179.99 3d1f h PHE 75 N 0.43 0.97 -0.19 -1.35 3.57 -1.24 -0.83 116.94 118.31 3d1f h PHE 75 Ca 0.12 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3d1f h PHE 75 Cb 0.27 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3d1f h PHE 75 CO 0.01 0.76 0.06 0.35 -2.23 0.00 0.00 178.31 177.26 3d1f h PHE 76 N 0.90 0.30 -0.89 0.41 3.57 -1.02 -1.94 116.94 118.26 3d1f h PHE 76 Ca 0.21 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.69 3d1f h PHE 76 Cb 0.20 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 3d1f h PHE 76 CO 0.01 0.38 0.58 -0.44 -2.23 0.00 0.00 178.31 176.61 3d1f h ASP 77 N 0.13 1.03 -0.12 0.41 3.32 -0.93 0.51 116.42 120.77 3d1f h ASP 77 Ca 0.06 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 3d1f h ASP 77 Cb 0.22 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3d1f h ASP 77 CO -0.00 0.75 0.05 0.40 -1.72 0.00 0.00 179.24 178.72 3d1f h ILE 78 N 1.21 1.15 -0.69 0.35 2.04 -0.98 0.08 117.51 120.67 3d1f h ILE 78 Ca 0.33 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 3d1f h ILE 78 Cb -0.13 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3d1f h ILE 78 CO -0.07 0.13 0.29 0.00 0.00 0.00 0.00 178.15 178.51 3d1f h ARG 80 N 0.98 0.00 0.00 0.00 2.43 -0.81 -3.04 114.38 113.95 3d1f h ARG 80 Ca 0.23 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3d1f h ARG 80 Cb 0.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3d1f h ARG 80 CO -0.02 0.29 0.00 0.78 -1.51 0.00 0.00 179.97 179.50 3d1f h GLY 81 N 2.29 0.00 -1.48 2.80 0.00 -0.51 -3.45 103.07 102.71 3d1f h GLY 81 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.82 3d1f h GLY 81 CO 0.04 0.00 0.38 1.08 0.00 0.00 0.00 176.54 178.04 3d1f s LEU 82 N -4.76 3.28 0.71 3.11 1.43 -1.06 -5.02 118.68 116.38 3d1f s LEU 82 Ca 0.09 1.64 -0.14 0.00 -1.03 0.00 0.00 54.13 54.69 3d1f s LEU 82 Cb 0.11 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.85 3d1f s LEU 82 CO 0.57 -1.22 1.15 -2.16 0.23 0.00 0.00 176.35 174.91 3d1f s PRO 83 N -4.72 2.38 0.37 1.29 0.04 -1.26 -4.93 135.00 128.18 3d1f s PRO 83 Ca 0.59 1.53 -0.27 0.00 0.04 0.00 0.00 61.00 62.89 3d1f s PRO 83 Cb -0.14 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 3d1f s PRO 83 CO 0.48 -1.60 1.27 -1.91 0.04 0.00 0.00 177.00 175.28 3d1f n GLU 84 N -2.73 2.03 -0.96 4.56 2.13 -1.26 -1.73 120.64 122.69 3d1f n GLU 84 Ca 0.12 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.65 3d1f n GLU 84 Cb 0.51 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.90 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 0.80 0.53 3.77 8.31 0.00 -1.26 -5.00 105.19 112.34 3d1f n GLY 85 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.34 3.06 -0.22 4.61 0.00 -0.70 -4.80 121.76 121.36 3d1f s ALA 86 Ca 0.00 1.06 -0.13 0.00 0.00 0.00 0.00 51.96 52.89 3d1f s ALA 86 Cb 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 3d1f s ALA 86 CO 0.00 -0.75 0.28 -1.21 0.00 0.00 0.00 175.76 174.08 3d1f s GLU 87 N -2.52 4.11 -0.35 0.00 0.41 -1.26 -0.54 118.70 118.56 3d1f s GLU 87 Ca 0.61 -0.03 -0.07 0.00 -0.41 0.00 0.00 54.97 55.07 3d1f s GLU 87 Cb -0.33 -3.55 0.04 0.00 -1.78 0.00 0.00 34.13 28.52 3d1f s GLU 87 CO 0.40 -0.01 0.12 0.42 -0.49 0.00 0.00 175.26 175.71 3d1f s ILE 88 N 1.25 3.88 -0.07 -1.63 1.01 -0.13 -4.36 121.20 121.14 3d1f s ILE 88 Ca 0.13 -1.13 -0.15 0.00 0.00 0.00 0.00 60.65 59.51 3d1f s ILE 88 Cb -0.14 -3.21 -0.05 0.00 0.01 0.00 0.00 42.46 39.07 3d1f s ILE 88 CO 0.06 -0.21 0.38 0.00 0.00 0.00 0.00 174.94 175.18 3d1f s ALA 89 N 1.42 3.63 -0.03 9.38 0.00 -0.22 -1.64 121.76 134.30 3d1f s ALA 89 Ca -0.01 -0.29 0.04 0.00 0.00 0.00 0.00 51.96 51.70 3d1f s ALA 89 Cb -0.20 -2.42 -0.00 0.00 0.00 0.00 0.00 23.12 20.50 3d1f s ALA 89 CO 0.03 0.29 -0.15 0.08 0.00 0.00 0.00 175.76 176.01 3d1f s VAL 90 N -0.32 1.23 -0.10 0.00 1.01 0.14 -0.90 120.40 121.45 3d1f s VAL 90 Ca 0.22 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.54 3d1f s VAL 90 Cb -0.15 -1.05 0.05 0.00 0.00 0.00 0.00 36.38 35.23 3d1f s VAL 90 CO 0.10 0.36 0.19 -1.58 0.00 0.00 0.00 175.10 174.16 3d1f s GLN 91 N -0.07 0.07 0.10 2.72 0.74 -0.46 -1.54 119.66 121.22 3d1f s GLN 91 Ca -0.00 0.59 -0.30 0.00 0.05 0.00 0.00 55.36 55.70 3d1f s GLN 91 Cb -0.09 -0.26 -0.06 0.00 1.10 0.00 0.00 33.01 33.70 3d1f s GLN 91 CO 0.01 -0.32 1.00 -1.17 -0.55 0.00 0.00 175.29 174.26 3d1f s LEU 92 N 2.33 4.47 -0.40 3.68 2.96 -0.29 -0.93 118.68 130.49 3d1f s LEU 92 Ca 0.03 1.84 0.07 0.00 -0.22 0.00 0.00 54.13 55.85 3d1f s LEU 92 Cb -0.12 -3.59 0.23 0.00 0.50 0.00 0.00 46.19 43.21 3d1f s LEU 92 CO -0.07 -0.15 0.49 -0.62 -1.32 0.00 0.00 176.35 174.68 3d1f n GLU 93 N 2.97 0.66 0.00 1.98 1.02 0.29 -4.62 120.64 122.93 3d1f n GLU 93 Ca 0.03 -3.27 0.00 0.00 -0.02 0.00 0.00 57.16 53.91 3d1f n GLU 93 Cb 0.49 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 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 1.70 3.02 0.20 0.62 0.00 -1.26 -2.81 105.19 106.67 3d1f n GLY 94 Ca 0.23 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3d1f n GLY 94 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3d1f n GLU 95 N 13.17 0.86 -3.84 1.61 0.28 -1.26 -4.73 120.64 126.74 3d1f n GLU 95 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.88 3d1f n GLU 95 Cb 0.00 -1.17 -0.11 0.00 1.43 0.00 0.00 31.44 31.59 3d1f n GLU 95 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 3d1f s ARG 96 N -1.59 0.36 -0.17 3.44 1.81 -1.12 -2.10 118.95 119.57 3d1f s ARG 96 Ca 0.00 -0.10 0.01 0.00 -1.72 0.00 0.00 55.73 53.92 3d1f s ARG 96 Cb 0.00 0.16 0.01 0.00 -0.45 0.00 0.00 34.95 34.67 3d1f s ARG 96 CO 0.00 -0.08 -0.19 1.41 -0.68 0.00 0.00 175.30 175.76 3d1f s MET 97 N -0.71 3.03 0.17 3.54 -2.45 0.27 -0.55 119.30 122.59 3d1f s MET 97 Ca -0.08 -0.82 -0.14 0.00 -1.25 0.00 0.00 55.69 53.40 3d1f s MET 97 Cb -0.05 -2.57 -0.07 0.00 1.25 0.00 0.00 34.83 33.39 3d1f s MET 97 CO 0.01 -0.15 0.57 -0.51 1.05 0.00 0.00 175.02 175.98 3d1f s LEU 98 N 1.17 4.31 -0.05 4.11 1.43 -0.11 -1.17 118.68 128.37 3d1f s LEU 98 Ca 0.02 1.09 0.01 0.00 -1.03 0.00 0.00 54.13 54.22 3d1f s LEU 98 Cb -0.14 -3.36 0.02 0.00 0.03 0.00 0.00 46.19 42.74 3d1f s LEU 98 CO -0.09 0.07 -0.06 -0.69 0.23 0.00 0.00 176.35 175.81 3d1f s VAL 99 N -1.52 0.65 -0.01 -1.59 1.01 0.33 -1.35 120.40 117.92 3d1f s VAL 99 Ca 0.40 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.20 3d1f s VAL 99 Cb -0.15 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.59 3d1f s VAL 99 CO 0.19 0.25 -0.02 -0.60 0.00 0.00 0.00 175.10 174.93 3d1f s ARG 100 N 0.87 0.20 -0.19 2.72 3.52 -0.08 0.01 118.95 126.00 3d1f s ARG 100 Ca -0.12 -0.04 -0.05 0.00 -0.13 0.00 0.00 55.73 55.39 3d1f s ARG 100 Cb -0.15 -0.24 0.09 0.00 -1.56 0.00 0.00 34.95 33.10 3d1f s ARG 100 CO 0.01 0.00 0.35 0.45 -0.81 0.00 0.00 175.30 175.30 3d1f s SER 101 N 0.20 0.17 1.97 -2.12 0.15 -0.11 -1.05 113.70 112.90 3d1f s SER 101 Ca -0.02 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.22 3d1f s SER 101 Cb -0.04 1.04 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 3d1f s SER 101 CO -0.01 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.79 3d1f n GLY 102 N 5.37 3.83 1.57 9.45 0.00 -1.26 -0.52 105.19 123.63 3d1f n GLY 102 Ca -0.06 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 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 13.93 2.32 -3.77 1.61 1.74 -1.26 -4.90 116.66 126.34 3d1f n ARG 103 Ca 0.00 -3.39 -0.37 0.00 -0.77 0.00 0.00 57.85 53.32 3d1f n ARG 103 Cb 0.00 -2.00 -0.13 0.00 -1.02 0.00 0.00 32.46 29.32 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 -2.58 5.04 -0.01 0.55 0.01 0.33 -5.10 113.70 111.94 3d1f s SER 104 Ca 0.50 -0.53 0.06 0.00 1.31 0.00 0.00 55.95 57.28 3d1f s SER 104 Cb 0.43 -1.88 -0.02 0.00 0.21 0.00 0.00 66.02 64.76 3d1f s SER 104 CO 0.01 -0.13 -0.20 -0.13 0.41 0.00 0.00 173.24 173.20 3d1f s ARG 105 N 1.53 1.59 0.03 12.44 0.52 -1.26 -0.94 118.95 132.86 3d1f s ARG 105 Ca 0.04 -0.72 -0.00 0.00 -0.52 0.00 0.00 55.73 54.53 3d1f s ARG 105 Cb -0.16 -1.54 -0.03 0.00 0.52 0.00 0.00 34.95 33.74 3d1f s ARG 105 CO 0.02 0.42 -0.03 -0.06 0.02 0.00 0.00 175.30 175.67 3d1f s PHE 106 N -0.49 0.38 -0.16 -0.53 0.40 0.10 -4.99 117.98 112.69 3d1f s PHE 106 Ca 0.08 -0.71 -0.02 0.00 -0.60 0.00 0.00 56.93 55.67 3d1f s PHE 106 Cb -0.08 -0.27 0.05 0.00 0.51 0.00 0.00 43.02 43.23 3d1f s PHE 106 CO -0.01 -0.25 -0.00 0.45 0.70 0.00 0.00 175.22 176.11 3d1f s SER 107 N -1.98 2.64 -0.05 1.36 0.15 -1.26 -0.51 113.70 114.05 3d1f s SER 107 Ca -0.08 -0.63 -0.01 0.00 0.70 0.00 0.00 55.95 55.94 3d1f s SER 107 Cb -0.04 -0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 63.55 3d1f s SER 107 CO -0.04 -0.24 0.01 -0.76 1.20 0.00 0.00 173.24 173.41 3d1f s LEU 108 N 1.79 3.58 0.20 3.45 1.43 -0.32 -4.91 118.68 123.91 3d1f s LEU 108 Ca 0.01 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.90 3d1f s LEU 108 Cb -0.16 -1.92 -0.08 0.00 0.03 0.00 0.00 46.19 44.07 3d1f s LEU 108 CO -0.07 0.34 1.13 -0.94 0.23 0.00 0.00 176.35 177.04 3d1f s SER 109 N -1.17 7.21 0.42 2.29 1.04 -1.26 -0.56 113.70 121.66 3d1f s SER 109 Ca 0.16 2.18 0.07 0.00 0.48 0.00 0.00 55.95 58.85 3d1f s SER 109 Cb -0.11 -2.61 -0.03 0.00 0.10 0.00 0.00 66.02 63.36 3d1f s SER 109 CO 0.06 -0.25 0.30 0.42 0.98 0.00 0.00 173.24 174.74 3d1f s THR 110 N -0.40 2.49 -0.01 2.02 -4.23 -0.89 -4.22 115.64 110.40 3d1f s THR 110 Ca 0.49 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 3d1f s THR 110 Cb -0.31 -2.98 0.01 0.00 1.34 0.00 0.00 72.50 70.55 3d1f s THR 110 CO 0.37 0.00 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.68 3d1f s LEU 111 N -4.04 1.79 0.09 4.79 1.43 -0.84 -4.89 118.68 117.00 3d1f s LEU 111 Ca 0.45 -0.02 -0.36 0.00 -1.03 0.00 0.00 54.13 53.17 3d1f s LEU 111 Cb -0.00 -0.10 -0.18 0.00 0.03 0.00 0.00 46.19 45.94 3d1f s LEU 111 CO 0.26 -0.01 1.04 -2.65 0.23 0.00 0.00 176.35 175.21 3d1f n PRO 112 N 3.32 0.46 0.27 1.29 -0.02 -1.26 -2.40 135.00 136.65 3d1f n PRO 112 Ca -0.16 0.16 0.11 0.00 -2.02 0.00 0.00 63.50 61.60 3d1f n PRO 112 Cb 0.57 -1.60 0.74 0.00 -0.02 0.00 0.00 33.50 33.19 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 2.97 1.53 0.00 3.55 0.00 -1.85 -0.19 119.26 125.27 3d1f h ALA 113 Ca -0.45 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 3d1f h ALA 113 Cb 1.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3d1f h ALA 113 CO 0.67 0.10 -0.19 0.00 0.00 0.00 0.00 179.25 179.82 3d1f h ALA 114 N 1.92 1.08 0.00 0.00 0.00 -1.94 -2.74 119.26 117.59 3d1f h ALA 114 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3d1f h ALA 114 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3d1f h ALA 114 CO 0.01 0.24 0.00 -0.25 0.00 0.00 0.00 179.25 179.25 3d1f n ASP 115 N -3.45 0.72 -4.69 0.00 9.92 -0.09 -4.84 116.55 114.13 3d1f n ASP 115 Ca -0.00 0.57 -0.42 0.00 -0.53 0.00 0.00 54.79 54.41 3d1f n ASP 115 Cb 0.37 -0.76 -0.03 0.00 -0.64 0.00 0.00 41.12 40.06 3d1f n ASP 115 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 3d1f s PHE 116 N -3.10 2.44 -0.17 1.24 5.36 -1.03 -4.96 117.98 117.75 3d1f s PHE 116 Ca 0.11 0.39 -0.29 0.00 -0.96 0.00 0.00 56.93 56.17 3d1f s PHE 116 Cb 0.13 -3.90 -0.01 0.00 -0.34 0.00 0.00 43.02 38.89 3d1f s PHE 116 CO 0.58 -3.61 1.25 -2.14 -1.46 0.00 0.00 175.22 169.84 3d1f s PRO 117 N 2.79 4.23 0.03 10.12 0.02 -1.26 -5.04 135.00 145.89 3d1f s PRO 117 Ca 0.72 1.65 0.06 0.00 0.02 0.00 0.00 61.00 63.44 3d1f s PRO 117 Cb -0.37 -3.76 -0.03 0.00 0.02 0.00 0.00 34.50 30.35 3d1f s PRO 117 CO 0.31 -0.71 -0.14 -0.80 -0.33 0.00 0.00 177.00 175.33 3d1f s ASN 118 N 1.95 4.08 0.60 2.53 0.01 -1.26 -4.90 114.94 117.95 3d1f s ASN 118 Ca 0.54 -0.32 -0.18 0.00 -0.71 0.00 0.00 52.86 52.18 3d1f s ASN 118 Cb -0.21 -0.77 -0.03 0.00 0.41 0.00 0.00 41.25 40.64 3d1f s ASN 118 CO 0.14 0.27 1.20 -0.76 -1.51 0.00 0.00 177.10 176.44 3d1f s LEU 119 N -1.40 3.63 0.64 0.60 1.02 -1.26 -4.97 118.68 116.94 3d1f s LEU 119 Ca 0.15 2.35 -0.16 0.00 0.02 0.00 0.00 54.13 56.50 3d1f s LEU 119 Cb -0.11 -4.59 -0.01 0.00 0.02 0.00 0.00 46.19 41.50 3d1f s LEU 119 CO 0.06 -1.61 1.12 1.51 0.02 0.00 0.00 176.35 177.44 3d1f s ASP 120 N -1.68 5.16 0.64 2.29 -4.77 -1.26 -4.99 116.67 112.05 3d1f s ASP 120 Ca 0.76 2.05 -0.17 0.00 -3.30 0.00 0.00 52.55 51.90 3d1f s ASP 120 Cb -0.29 -2.56 -0.01 0.00 -1.09 0.00 0.00 42.92 38.97 3d1f s ASP 120 CO 0.34 -1.60 1.18 1.51 0.70 0.00 0.00 175.17 177.30 3d1f s ASP 121 N -2.40 4.95 0.33 2.11 3.84 -1.26 -5.05 116.67 119.19 3d1f s ASP 121 Ca 0.68 2.27 -0.07 0.00 -0.00 0.00 0.00 52.55 55.44 3d1f s ASP 121 Cb -0.22 -2.58 0.01 0.00 -1.38 0.00 0.00 42.92 38.75 3d1f s ASP 121 CO 0.39 -1.75 0.52 -1.66 -0.00 0.00 0.00 175.17 172.68 3d1f s TRP 122 N -1.88 0.74 -0.06 2.11 1.48 -1.26 -5.17 118.94 114.90 3d1f s TRP 122 Ca 0.74 -1.08 0.05 0.00 -1.06 0.00 0.00 56.10 54.75 3d1f s TRP 122 Cb -0.27 0.13 -0.01 0.00 -1.16 0.00 0.00 33.47 32.16 3d1f s TRP 122 CO 0.38 -1.17 -0.22 -0.65 -4.06 0.00 0.00 176.95 171.23 3d1f s GLN 123 N -3.17 2.35 0.21 3.25 1.11 -1.26 -5.12 119.66 117.03 3d1f s GLN 123 Ca 0.26 -0.79 -0.30 0.00 0.01 0.00 0.00 55.36 54.55 3d1f s GLN 123 Cb -0.01 -1.96 -0.08 0.00 -1.01 0.00 0.00 33.01 29.95 3d1f s GLN 123 CO 0.16 0.29 1.03 0.45 0.01 0.00 0.00 175.29 177.23 3d1f s SER 124 N 0.02 7.42 -0.01 5.90 0.15 -1.26 -4.22 113.70 121.70 3d1f s SER 124 Ca -0.07 2.04 0.10 0.00 0.70 0.00 0.00 55.95 58.72 3d1f s SER 124 Cb -0.14 -2.61 -0.15 0.00 -1.71 0.00 0.00 66.02 61.41 3d1f s SER 124 CO 0.04 -0.06 0.23 -0.62 1.20 0.00 0.00 173.24 174.02 3d1f n GLU 125 N 1.92 0.51 -3.69 5.44 1.02 0.76 -4.94 120.64 121.65 3d1f n GLU 125 Ca 0.00 -0.08 -0.14 0.00 -0.02 0.00 0.00 57.16 56.92 3d1f n GLU 125 Cb 0.47 -1.22 -0.09 0.00 -0.02 0.00 0.00 31.44 30.58 3d1f n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3d1f s VAL 126 N -2.64 0.00 -0.10 2.62 0.11 -0.91 -5.00 120.40 114.48 3d1f s VAL 126 Ca -0.03 -0.02 -0.16 0.00 -2.93 0.00 0.00 61.98 58.84 3d1f s VAL 126 Cb 0.06 -0.72 0.04 0.00 -1.53 0.00 0.00 36.38 34.23 3d1f s VAL 126 CO 0.41 -0.01 0.40 -1.83 -3.33 0.00 0.00 175.10 170.74 3d1f s GLU 127 N 0.15 0.58 0.23 1.54 -1.05 -1.26 -0.08 118.70 118.81 3d1f s GLU 127 Ca -0.01 0.32 -0.11 0.00 -0.15 0.00 0.00 54.97 55.02 3d1f s GLU 127 Cb -0.04 0.27 -0.01 0.00 -0.44 0.00 0.00 34.13 33.92 3d1f s GLU 127 CO 0.01 -0.11 0.41 -0.59 0.95 0.00 0.00 175.26 175.93 3d1f s PHE 128 N -0.35 0.49 0.13 4.83 -0.71 -0.63 -5.00 117.98 116.74 3d1f s PHE 128 Ca -0.05 -0.83 0.07 0.00 -1.04 0.00 0.00 56.93 55.08 3d1f s PHE 128 Cb -0.03 0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 3d1f s PHE 128 CO 0.02 -0.92 -0.17 0.95 -1.34 0.00 0.00 175.22 173.76 3d1f s THR 129 N -4.04 1.57 0.09 -4.49 -4.23 -1.26 -0.61 115.64 102.68 3d1f s THR 129 Ca 0.25 -1.73 -0.26 0.00 -1.18 0.00 0.00 61.69 58.76 3d1f s THR 129 Cb 0.01 -1.62 0.08 0.00 1.34 0.00 0.00 72.50 72.30 3d1f s THR 129 CO 0.09 -0.30 0.86 -1.48 -0.54 0.00 0.00 174.62 173.24 3d1f s LEU 130 N -2.39 -0.32 0.33 4.79 2.34 -0.20 -4.96 118.68 118.27 3d1f s LEU 130 Ca 0.10 -0.18 -0.28 0.00 0.06 0.00 0.00 54.13 53.83 3d1f s LEU 130 Cb -0.06 2.21 -0.10 0.00 -0.56 0.00 0.00 46.19 47.67 3d1f s LEU 130 CO 0.05 -0.82 1.27 -2.84 -1.06 0.00 0.00 176.35 172.95 3d1f s PRO 131 N -3.33 4.35 0.43 1.48 0.02 -1.26 0.71 135.00 137.39 3d1f s PRO 131 Ca 0.07 2.14 0.14 0.00 0.02 0.00 0.00 61.00 63.37 3d1f s PRO 131 Cb -0.02 -3.04 1.02 0.00 0.02 0.00 0.00 34.50 32.48 3d1f s PRO 131 CO -0.05 -0.17 1.98 1.96 -0.33 0.00 0.00 177.00 180.40 3d1f h GLN 132 N 3.34 0.41 -0.49 5.54 4.20 -1.01 -0.43 115.11 126.67 3d1f h GLN 132 Ca -0.49 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.19 3d1f h GLN 132 Cb 1.23 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.89 3d1f h GLN 132 CO 0.65 0.27 0.26 0.00 -0.67 0.00 0.00 178.83 179.34 3d1f h ALA 133 N 1.70 1.54 -0.20 3.87 0.00 -1.58 0.02 119.26 124.60 3d1f h ALA 133 Ca 0.28 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 3d1f h ALA 133 Cb 0.53 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3d1f h ALA 133 CO -0.08 0.38 -0.14 1.15 0.00 0.00 0.00 179.25 180.57 3d1f h THR 134 N 0.68 1.32 -0.62 0.00 2.02 -1.37 -0.80 112.91 114.14 3d1f h THR 134 Ca 0.17 -1.25 -0.08 0.00 0.77 0.00 0.00 66.41 66.02 3d1f h THR 134 Cb 0.03 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 3d1f h THR 134 CO -0.03 0.38 0.05 -0.03 0.37 0.00 0.00 175.52 176.27 3d1f h MET 135 N 0.14 1.04 -0.79 6.66 -1.53 -1.32 -1.76 114.93 117.37 3d1f h MET 135 Ca 0.04 -0.29 -0.05 0.00 -3.44 0.00 0.00 59.70 55.96 3d1f h MET 135 Cb 0.66 -0.11 -0.03 0.00 -0.55 0.00 0.00 31.60 31.56 3d1f h MET 135 CO 0.04 0.98 0.31 -0.22 0.14 0.00 0.00 176.91 178.16 3d1f h LYS 136 N 0.97 1.19 -0.26 0.39 3.11 -0.90 -1.85 116.57 119.22 3d1f h LYS 136 Ca 0.18 -0.22 -0.04 0.00 -2.81 0.00 0.00 60.65 57.76 3d1f h LYS 136 Cb 0.48 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.51 3d1f h LYS 136 CO 0.02 0.97 0.00 -0.09 -2.81 0.00 0.00 179.45 177.54 3d1f h ARG 137 N 1.15 0.45 -0.80 1.90 9.65 -0.88 -1.01 114.38 124.85 3d1f h ARG 137 Ca 0.26 -0.14 0.08 0.00 -1.10 0.00 0.00 59.98 59.08 3d1f h ARG 137 Cb 0.23 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.70 3d1f h ARG 137 CO -0.02 0.62 0.47 -0.07 2.80 0.00 0.00 179.97 183.76 3d1f h LEU 138 N 0.23 0.70 0.00 3.80 3.38 -1.08 -1.14 115.31 121.20 3d1f h LEU 138 Ca 0.07 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3d1f h LEU 138 Cb 0.41 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3d1f h LEU 138 CO 0.01 0.43 -0.00 0.40 0.09 0.00 0.00 178.44 179.37 3d1f h ILE 139 N 0.82 1.59 -0.21 1.22 2.04 -1.27 -3.29 117.51 118.41 3d1f h ILE 139 Ca 0.37 -1.79 0.02 0.00 1.00 0.00 0.00 64.86 64.46 3d1f h ILE 139 Cb 0.26 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 39.12 3d1f h ILE 139 CO -0.21 0.46 0.14 -0.33 0.00 0.00 0.00 178.15 178.22 3d1f h GLU 140 N -0.78 0.19 0.00 2.37 5.08 -1.11 0.17 114.58 120.50 3d1f h GLU 140 Ca -0.00 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3d1f h GLU 140 Cb 0.76 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 3d1f h GLU 140 CO 0.00 0.12 -0.00 0.00 -1.00 0.00 0.00 179.01 178.13 3d1f h ALA 141 N 1.88 1.00 0.00 3.43 0.00 -1.29 -3.37 119.26 120.90 3d1f h ALA 141 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3d1f h ALA 141 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3d1f h ALA 141 CO -0.02 0.01 -0.39 0.25 0.00 0.00 0.00 179.25 179.10 3d1f n THR 142 N -3.10 0.00 -0.24 0.00 -2.24 -0.70 -4.81 114.28 103.19 3d1f n THR 142 Ca 0.01 -0.07 0.18 0.00 -2.27 0.00 0.00 64.05 61.90 3d1f n THR 142 Cb 0.33 0.45 0.49 0.00 -2.10 0.00 0.00 70.33 69.51 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 0.43 0.00 -0.78 -0.00 -0.88 -1.23 115.11 112.66 3d1f h GLN 143 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 3d1f h GLN 143 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 27.48 27.38 3d1f h GLN 143 CO 0.00 0.28 0.00 0.27 -0.00 0.00 0.00 178.83 179.38 3d1f h PHE 144 N 0.44 0.00 -0.04 0.06 -0.00 -1.84 -2.36 116.94 113.20 3d1f h PHE 144 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.43 3d1f h PHE 144 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.04 3d1f h PHE 144 CO -0.00 0.00 0.00 0.43 -0.00 0.00 0.00 178.31 178.74 3d1f n SER 145 N -2.31 1.93 -4.77 -0.68 7.64 -0.46 -4.93 113.62 110.03 3d1f n SER 145 Ca 0.00 -1.65 -0.35 0.00 1.01 0.00 0.00 58.87 57.88 3d1f n SER 145 Cb 0.13 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 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 -1.97 3.35 0.71 1.43 -1.94 -0.89 -2.34 119.30 117.64 3d1f s MET 146 Ca 0.35 1.61 -0.11 0.00 -1.71 0.00 0.00 55.69 55.83 3d1f s MET 146 Cb 0.21 -2.00 0.01 0.00 2.01 0.00 0.00 34.83 35.05 3d1f s MET 146 CO 0.32 -0.85 1.08 0.00 -0.01 0.00 0.00 175.02 175.56 3d1f s ALA 147 N -1.78 2.77 -0.07 3.03 0.00 -0.57 -4.74 121.76 120.39 3d1f s ALA 147 Ca 0.73 -0.20 -0.07 0.00 0.00 0.00 0.00 51.96 52.41 3d1f s ALA 147 Cb -0.24 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 3d1f s ALA 147 CO 0.27 -1.18 -0.14 0.72 0.00 0.00 0.00 175.76 175.42 3d1f n HIS 148 N -3.06 0.00 -2.54 0.00 8.25 -1.26 -4.36 115.22 112.25 3d1f n HIS 148 Ca 0.07 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.38 3d1f n HIS 148 Cb 0.56 -0.20 0.02 0.00 1.12 0.00 0.00 29.99 31.49 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 -3.30 2.32 -2.46 -0.41 6.02 -1.26 -4.84 117.38 113.45 3d1f n GLN 149 Ca -0.06 -3.81 -0.38 0.00 -0.01 0.00 0.00 57.00 52.74 3d1f n GLN 149 Cb 0.21 -1.77 -0.04 0.00 1.02 0.00 0.00 30.24 29.66 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 -3.45 6.89 0.60 1.08 -1.08 -1.26 -4.90 116.67 114.55 3d1f s ASP 150 Ca 0.37 2.20 0.33 0.00 -0.52 0.00 0.00 52.55 54.93 3d1f s ASP 150 Cb 0.41 -2.61 1.92 0.00 -1.46 0.00 0.00 42.92 41.18 3d1f s ASP 150 CO -0.04 -0.40 2.26 0.58 0.52 0.00 0.00 175.17 178.08 3d1f h VAL 151 N 2.57 0.38 -1.74 1.11 2.07 -2.03 -3.23 116.25 115.38 3d1f h VAL 151 Ca -0.48 -0.09 -0.68 0.00 0.82 0.00 0.00 66.70 66.27 3d1f h VAL 151 Cb 1.22 1.06 -0.14 0.00 -1.52 0.00 0.00 31.29 31.91 3d1f h VAL 151 CO 0.64 0.02 1.40 -0.13 0.02 0.00 0.00 177.57 179.52 3d1f s ARG 152 N -4.42 3.81 0.31 1.57 0.52 -1.26 -4.86 118.95 114.62 3d1f s ARG 152 Ca -0.05 -1.89 0.08 0.00 -0.52 0.00 0.00 55.73 53.35 3d1f s ARG 152 Cb 0.14 -5.18 0.87 0.00 0.52 0.00 0.00 34.95 31.30 3d1f s ARG 152 CO 0.52 -1.97 1.68 1.88 0.02 0.00 0.00 175.30 177.43 3d1f h TYR 153 N 8.34 0.74 0.00 -0.53 0.05 -1.93 -0.55 116.97 123.09 3d1f h TYR 153 Ca 0.27 0.04 0.00 0.00 0.05 0.00 0.00 58.73 59.09 3d1f h TYR 153 Cb 0.95 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.51 3d1f h TYR 153 CO 1.23 -0.10 0.00 2.48 -1.05 0.00 0.00 178.16 180.72 3d1f n TYR 154 N -5.06 0.61 0.45 4.88 0.18 -1.26 -0.99 117.16 115.98 3d1f n TYR 154 Ca 0.26 0.32 0.12 0.00 1.88 0.00 0.00 57.90 60.47 3d1f n TYR 154 Cb 0.78 -1.01 0.10 0.00 -0.38 0.00 0.00 39.34 38.83 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 -2.13 0.72 -2.20 -3.48 4.77 -0.21 -4.26 117.00 110.21 3d1f n LEU 155 Ca -0.01 0.20 -0.18 0.00 -0.03 0.00 0.00 56.01 55.99 3d1f n LEU 155 Cb 0.04 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 40.87 3d1f n LEU 155 CO 0.08 -0.07 1.64 0.59 -1.33 0.00 0.00 177.39 178.30 3d1f n ASN 156 N -2.22 5.74 -0.48 -1.43 5.03 -0.16 -1.51 115.26 120.23 3d1f n ASN 156 Ca 0.02 -2.74 0.00 0.00 0.87 0.00 0.00 54.58 52.73 3d1f n ASN 156 Cb 0.47 -1.36 0.00 0.00 -1.02 0.00 0.00 39.78 37.87 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 1.94 0.89 3.01 7.41 0.00 -1.26 -0.85 105.19 116.33 3d1f n GLY 157 Ca 0.46 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.44 1.10 0.04 1.61 1.75 -0.29 -4.69 119.30 118.38 3d1f s MET 158 Ca 0.00 -0.33 -0.29 0.00 -1.25 0.00 0.00 55.69 53.82 3d1f s MET 158 Cb 0.00 -1.00 -0.04 0.00 2.84 0.00 0.00 34.83 36.62 3d1f s MET 158 CO 0.00 0.11 0.91 -1.17 -0.65 0.00 0.00 175.02 174.22 3d1f s LEU 159 N 0.26 4.42 -0.22 4.11 2.96 -0.03 -0.61 118.68 129.56 3d1f s LEU 159 Ca -0.05 1.62 -0.01 0.00 -0.22 0.00 0.00 54.13 55.47 3d1f s LEU 159 Cb -0.10 -3.47 0.02 0.00 0.50 0.00 0.00 46.19 43.14 3d1f s LEU 159 CO 0.01 -0.14 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.45 3d1f s PHE 160 N 0.48 2.96 -0.07 5.38 0.40 0.89 -1.73 117.98 126.29 3d1f s PHE 160 Ca 0.47 -1.42 0.02 0.00 -0.60 0.00 0.00 56.93 55.39 3d1f s PHE 160 Cb -0.21 -2.03 0.01 0.00 0.51 0.00 0.00 43.02 41.30 3d1f s PHE 160 CO 0.27 -0.70 -0.12 -2.00 0.70 0.00 0.00 175.22 173.37 3d1f s GLU 161 N 1.35 1.69 -0.13 0.44 2.12 0.88 -1.30 118.70 123.75 3d1f s GLU 161 Ca 0.03 -0.40 -0.05 0.00 0.36 0.00 0.00 54.97 54.92 3d1f s GLU 161 Cb -0.15 -1.43 -0.04 0.00 0.26 0.00 0.00 34.13 32.77 3d1f s GLU 161 CO -0.06 -0.01 0.04 0.95 -0.54 0.00 0.00 175.26 175.64 3d1f s THR 162 N 0.78 4.60 -0.26 -1.70 -4.23 -0.14 0.61 115.64 115.30 3d1f s THR 162 Ca -0.12 -0.12 -0.08 0.00 -1.18 0.00 0.00 61.69 60.18 3d1f s THR 162 Cb -0.15 -3.00 0.12 0.00 1.34 0.00 0.00 72.50 70.80 3d1f s THR 162 CO 0.02 0.55 0.55 -0.70 -0.54 0.00 0.00 174.62 174.50 3d1f s GLU 163 N -0.38 0.47 7.31 3.99 2.12 -0.31 -1.93 118.70 129.97 3d1f s GLU 163 Ca 0.08 1.25 0.00 0.00 0.36 0.00 0.00 54.97 56.67 3d1f s GLU 163 Cb -0.12 0.62 0.00 0.00 0.26 0.00 0.00 34.13 34.89 3d1f s GLU 163 CO 0.02 -0.25 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 3d1f n GLY 164 N 5.42 2.68 0.33 -1.50 0.00 -1.23 -1.44 105.19 109.46 3d1f n GLY 164 Ca -0.10 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 45.89 3d1f n GLY 164 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3d1f n GLU 165 N 8.48 2.54 -4.18 1.61 0.00 -1.26 0.65 120.64 128.48 3d1f n GLU 165 Ca 0.00 -2.13 -0.29 0.00 0.00 0.00 0.00 57.16 54.74 3d1f n GLU 165 Cb 0.00 -1.34 -0.08 0.00 0.00 0.00 0.00 31.44 30.02 3d1f n GLU 165 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 3d1f s GLU 166 N -1.78 2.37 -0.11 3.44 2.02 -0.52 0.12 118.70 124.24 3d1f s GLU 166 Ca 0.21 -0.98 0.03 0.00 0.02 0.00 0.00 54.97 54.25 3d1f s GLU 166 Cb 0.16 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.98 3d1f s GLU 166 CO 0.06 0.50 -0.23 -1.17 0.02 0.00 0.00 175.26 174.44 3d1f s LEU 167 N -2.48 2.13 0.05 1.80 0.20 -0.22 -1.17 118.68 118.99 3d1f s LEU 167 Ca 0.25 -0.56 0.06 0.00 0.69 0.00 0.00 54.13 54.58 3d1f s LEU 167 Cb -0.11 -1.43 -0.03 0.00 -0.43 0.00 0.00 46.19 44.20 3d1f s LEU 167 CO 0.17 0.14 -0.18 -0.60 -0.29 0.00 0.00 176.35 175.59 3d1f s ARG 168 N 0.45 1.16 0.01 1.98 3.52 0.20 -1.67 118.95 124.61 3d1f s ARG 168 Ca -0.16 -0.91 0.09 0.00 -0.13 0.00 0.00 55.73 54.62 3d1f s ARG 168 Cb -0.17 -1.25 -0.02 0.00 -1.56 0.00 0.00 34.95 31.94 3d1f s ARG 168 CO 0.06 0.31 -0.26 0.95 -0.81 0.00 0.00 175.30 175.56 3d1f s THR 169 N -0.89 2.06 -0.01 4.11 -4.23 -0.18 -0.08 115.64 116.42 3d1f s THR 169 Ca 0.05 -1.24 0.01 0.00 -1.18 0.00 0.00 61.69 59.33 3d1f s THR 169 Cb -0.09 -1.74 0.00 0.00 1.34 0.00 0.00 72.50 72.02 3d1f s THR 169 CO 0.02 0.46 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.84 3d1f s VAL 170 N -0.71 0.21 -0.05 2.29 1.01 -0.70 -1.66 120.40 120.79 3d1f s VAL 170 Ca 0.11 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 3d1f s VAL 170 Cb -0.10 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.10 3d1f s VAL 170 CO 0.01 0.07 0.12 0.00 0.00 0.00 0.00 175.10 175.30 3d1f s ALA 171 N 0.06 -0.30 -0.01 5.51 0.00 -0.52 -0.85 121.76 125.64 3d1f s ALA 171 Ca -0.00 0.35 -0.28 0.00 0.00 0.00 0.00 51.96 52.03 3d1f s ALA 171 Cb -0.03 -0.21 0.07 0.00 0.00 0.00 0.00 23.12 22.95 3d1f s ALA 171 CO -0.00 -0.06 0.63 -0.08 0.00 0.00 0.00 175.76 176.25 3d1f s THR 172 N 0.09 0.01 -0.07 0.00 -1.32 -1.06 -0.88 115.64 112.40 3d1f s THR 172 Ca -0.00 -0.05 0.10 0.00 -1.21 0.00 0.00 61.69 60.53 3d1f s THR 172 Cb -0.01 -0.98 0.15 0.00 -1.51 0.00 0.00 72.50 70.15 3d1f s THR 172 CO 0.00 -0.03 1.05 -0.90 -2.21 0.00 0.00 174.62 172.53 3d1f n ASP 173 N 0.71 1.90 0.00 8.08 5.68 -0.99 -3.55 116.55 128.39 3d1f n ASP 173 Ca -0.19 -2.51 0.00 0.00 -0.50 0.00 0.00 54.79 51.59 3d1f n ASP 173 Cb 0.58 -0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 3d1f n ASP 173 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d1f n GLY 174 N -0.92 3.21 0.06 6.12 0.00 -1.26 -4.76 105.19 107.65 3d1f n GLY 174 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.85 1.61 8.25 -1.26 -4.97 115.22 113.00 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 -0.60 -0.07 0.00 1.12 0.00 0.00 29.99 30.44 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 -2.30 0.81 0.03 -0.41 1.04 -1.26 -1.29 118.95 115.58 3d1f s ARG 176 Ca -0.09 -0.86 0.00 0.00 -1.04 0.00 0.00 55.73 53.74 3d1f s ARG 176 Cb 0.04 0.33 -0.03 0.00 -2.04 0.00 0.00 34.95 33.26 3d1f s ARG 176 CO 0.47 -0.26 -0.04 -1.17 -0.04 0.00 0.00 175.30 174.27 3d1f s LEU 177 N -2.66 2.32 -0.01 -1.89 0.20 0.66 -2.40 118.68 114.90 3d1f s LEU 177 Ca 0.02 -0.65 0.01 0.00 0.69 0.00 0.00 54.13 54.20 3d1f s LEU 177 Cb 0.03 0.08 0.00 0.00 -0.43 0.00 0.00 46.19 45.88 3d1f s LEU 177 CO -0.09 -0.37 -0.04 0.00 -0.29 0.00 0.00 176.35 175.56 3d1f s ALA 178 N -2.16 0.41 -0.01 5.97 0.00 -0.06 -1.15 121.76 124.77 3d1f s ALA 178 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.74 3d1f s ALA 178 Cb -0.05 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 22.92 3d1f s ALA 178 CO -0.03 0.06 -0.01 0.54 0.00 0.00 0.00 175.76 176.33 3d1f s VAL 179 N 0.14 0.09 -0.02 0.00 0.11 -0.31 -1.44 120.40 118.97 3d1f s VAL 179 Ca -0.01 -0.01 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 3d1f s VAL 179 Cb -0.05 -0.12 0.01 0.00 -1.53 0.00 0.00 36.38 34.70 3d1f s VAL 179 CO -0.00 0.05 0.04 0.00 -3.33 0.00 0.00 175.10 171.86 3d1f s SER 181 N 0.34 1.53 -0.01 0.00 0.15 0.05 -1.01 113.70 114.74 3d1f s SER 181 Ca -0.03 -0.24 -0.01 0.00 0.70 0.00 0.00 55.95 56.38 3d1f s SER 181 Cb -0.04 -0.21 0.01 0.00 -1.71 0.00 0.00 66.02 64.06 3d1f s SER 181 CO -0.01 0.15 0.03 -0.04 1.20 0.00 0.00 173.24 174.57 3d1f s MET 182 N -0.22 0.03 0.33 5.44 -1.94 -0.67 -4.77 119.30 117.49 3d1f s MET 182 Ca 0.03 0.07 -0.24 0.00 -1.71 0.00 0.00 55.69 53.85 3d1f s MET 182 Cb -0.06 -0.03 -0.10 0.00 2.01 0.00 0.00 34.83 36.66 3d1f s MET 182 CO -0.00 -0.03 0.90 -1.25 -0.01 0.00 0.00 175.02 174.63 3d1f s PRO 183 N 0.20 4.44 0.00 2.03 0.04 -1.26 -1.06 135.00 139.39 3d1f s PRO 183 Ca -0.02 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.22 3d1f s PRO 183 Cb -0.02 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.85 3d1f s PRO 183 CO -0.01 0.23 0.76 0.44 0.04 0.00 0.00 177.00 178.47 3d1f n ILE 184 N 0.30 0.58 -2.01 0.56 -5.35 0.12 -4.92 119.36 108.65 3d1f n ILE 184 Ca 0.02 -0.69 -0.16 0.00 -0.27 0.00 0.00 62.75 61.65 3d1f n ILE 184 Cb 0.51 0.76 -0.03 0.00 -1.74 0.00 0.00 39.64 39.14 3d1f n ILE 184 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d1f n GLY 185 N -0.29 0.41 2.77 3.28 0.00 -1.24 -4.97 105.19 105.15 3d1f n GLY 185 Ca 0.00 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.62 3d1f n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d1f s GLN 186 N -4.30 0.26 0.04 1.61 -0.21 -1.26 -5.10 119.66 110.69 3d1f s GLN 186 Ca 0.00 0.15 -0.30 0.00 0.02 0.00 0.00 55.36 55.23 3d1f s GLN 186 Cb 0.00 -0.57 -0.08 0.00 1.00 0.00 0.00 33.01 33.35 3d1f s GLN 186 CO 0.00 -0.21 1.87 0.45 -2.12 0.00 0.00 175.29 175.28 3d1f s SER 187 N 1.46 6.50 0.09 5.90 0.15 -1.26 -4.33 113.70 122.20 3d1f s SER 187 Ca -0.04 2.59 0.10 0.00 0.70 0.00 0.00 55.95 59.30 3d1f s SER 187 Cb -0.13 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 3d1f s SER 187 CO -0.03 -1.01 -0.26 -0.76 1.20 0.00 0.00 173.24 172.38 3d1f s LEU 188 N 3.99 2.25 0.35 3.45 1.43 0.21 -5.00 118.68 125.36 3d1f s LEU 188 Ca 0.83 -0.67 -0.26 0.00 -1.03 0.00 0.00 54.13 53.01 3d1f s LEU 188 Cb -0.41 -1.19 -0.10 0.00 0.03 0.00 0.00 46.19 44.52 3d1f s LEU 188 CO 0.38 0.20 0.99 -2.16 0.23 0.00 0.00 176.35 175.98 3d1f s PRO 189 N -1.67 4.45 0.02 1.29 0.04 -1.26 -3.47 135.00 134.40 3d1f s PRO 189 Ca 0.12 1.41 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 3d1f s PRO 189 Cb -0.10 -2.73 -0.07 0.00 0.04 0.00 0.00 34.50 31.64 3d1f s PRO 189 CO 0.04 0.14 1.70 -1.12 0.04 0.00 0.00 177.00 177.80 3d1f s SER 190 N -1.57 6.61 0.05 6.66 0.01 -1.26 -4.50 113.70 119.70 3d1f s SER 190 Ca 0.52 2.42 -0.23 0.00 1.31 0.00 0.00 55.95 59.97 3d1f s SER 190 Cb -0.20 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.54 3d1f s SER 190 CO 0.26 -0.92 0.55 -2.28 0.41 0.00 0.00 173.24 171.25 3d1f s HIS 191 N 3.43 -0.46 -0.14 2.43 5.04 -0.81 -4.99 115.29 119.79 3d1f s HIS 191 Ca 0.76 0.54 -0.09 0.00 -1.54 0.00 0.00 55.06 54.73 3d1f s HIS 191 Cb -0.38 0.37 0.05 0.00 0.04 0.00 0.00 32.58 32.66 3d1f s HIS 191 CO 0.33 -0.66 0.34 -1.12 -2.34 0.00 0.00 174.74 171.28 3d1f s SER 192 N -1.95 -0.39 0.04 9.88 0.01 -1.26 -0.97 113.70 119.06 3d1f s SER 192 Ca -0.05 0.71 -0.02 0.00 1.31 0.00 0.00 55.95 57.90 3d1f s SER 192 Cb -0.01 0.64 -0.03 0.00 0.21 0.00 0.00 66.02 66.84 3d1f s SER 192 CO -0.01 -0.16 0.00 0.68 0.41 0.00 0.00 173.24 174.16 3d1f s VAL 193 N 0.90 0.16 -0.24 3.43 -7.23 -0.42 -4.98 120.40 112.02 3d1f s VAL 193 Ca -0.06 -1.33 -0.06 0.00 -1.81 0.00 0.00 61.98 58.72 3d1f s VAL 193 Cb -0.07 -0.94 -0.02 0.00 0.56 0.00 0.00 36.38 35.92 3d1f s VAL 193 CO -0.07 -0.73 0.03 -0.63 -0.31 0.00 0.00 175.10 173.39 3d1f s ILE 194 N -2.77 3.94 -0.09 -0.62 1.01 -1.26 -0.08 121.20 121.33 3d1f s ILE 194 Ca -0.04 -0.34 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 3d1f s ILE 194 Cb -0.00 -2.85 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 3d1f s ILE 194 CO -0.06 0.34 0.46 -0.69 0.00 0.00 0.00 174.94 175.00 3d1f s VAL 195 N 1.55 5.15 0.44 2.92 1.01 0.22 -0.71 120.40 130.98 3d1f s VAL 195 Ca 0.06 0.93 -0.25 0.00 0.00 0.00 0.00 61.98 62.72 3d1f s VAL 195 Cb -0.15 -3.80 -0.09 0.00 0.00 0.00 0.00 36.38 32.34 3d1f s VAL 195 CO 0.01 0.38 1.28 -2.65 0.00 0.00 0.00 175.10 174.13 3d1f n PRO 196 N 3.28 1.92 -0.25 2.72 -0.02 -1.26 -1.14 135.00 140.24 3d1f n PRO 196 Ca -0.09 0.69 -0.07 0.00 -2.02 0.00 0.00 63.50 62.01 3d1f n PRO 196 Cb 0.52 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 3d1f n PRO 196 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3d1f h ARG 197 N 2.02 -0.15 -0.58 -0.52 2.43 -1.32 0.17 114.38 116.44 3d1f h ARG 197 Ca -0.48 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.72 3d1f h ARG 197 Cb 1.29 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.85 3d1f h ARG 197 CO 0.60 -0.10 0.38 -0.22 -1.51 0.00 0.00 179.97 179.12 3d1f h LYS 198 N -0.16 0.68 -0.37 0.20 3.64 -1.91 -1.73 116.57 116.93 3d1f h LYS 198 Ca 0.22 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 3d1f h LYS 198 Cb 0.56 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3d1f h LYS 198 CO -0.76 0.45 -0.23 0.78 -2.27 0.00 0.00 179.45 177.42 3d1f h GLY 199 N 0.70 0.80 0.98 5.01 0.00 -1.10 -1.92 103.07 107.55 3d1f h GLY 199 Ca 0.23 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 3d1f h GLY 199 CO -0.06 0.63 0.24 -2.08 0.00 0.00 0.00 176.54 175.26 3d1f h VAL 200 N 0.65 1.13 -0.35 4.60 2.07 -0.13 -1.12 116.25 123.10 3d1f h VAL 200 Ca 0.09 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 3d1f h VAL 200 Cb 0.73 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 3d1f h VAL 200 CO 0.06 0.13 0.09 0.40 0.02 0.00 0.00 177.57 178.27 3d1f h ILE 201 N 0.52 1.22 -0.70 4.57 1.08 -1.32 -0.35 117.51 122.53 3d1f h ILE 201 Ca 0.14 -0.75 -0.03 0.00 -0.39 0.00 0.00 64.86 63.84 3d1f h ILE 201 Cb 0.01 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 34.77 3d1f h ILE 201 CO -0.03 0.25 0.34 -0.08 -0.69 0.00 0.00 178.15 177.94 3d1f h GLU 202 N 0.41 1.00 -0.15 2.37 4.57 -1.23 -0.48 114.58 121.06 3d1f h GLU 202 Ca 0.11 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 3d1f h GLU 202 Cb 0.30 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 3d1f h GLU 202 CO 0.00 0.77 -0.00 1.25 -1.18 0.00 0.00 179.01 179.85 3d1f h LEU 203 N 0.99 0.26 -0.86 1.64 5.85 -0.94 -2.62 115.31 119.64 3d1f h LEU 203 Ca 0.24 -0.31 0.08 0.00 0.84 0.00 0.00 57.88 58.73 3d1f h LEU 203 Cb 0.10 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 3d1f h LEU 203 CO -0.03 0.51 0.52 -0.03 -0.34 0.00 0.00 178.44 179.07 3d1f h MET 204 N -0.00 0.88 0.00 1.25 4.05 -0.65 -1.85 114.93 118.60 3d1f h MET 204 Ca 0.04 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 3d1f h MET 204 Cb 0.38 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.98 3d1f h MET 204 CO 0.01 0.58 0.00 0.00 0.23 0.00 0.00 176.91 177.73 3d1f h ARG 205 N 0.90 0.00 -0.01 0.39 -0.00 -0.88 -2.64 114.38 112.14 3d1f h ARG 205 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.87 3d1f h ARG 205 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.25 3d1f h ARG 205 CO -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 179.97 179.62 3d1f n MET 206 N -2.81 1.29 -3.05 0.04 0.00 -0.70 -4.79 117.12 107.10 3d1f n MET 206 Ca 0.01 -0.78 -0.43 0.00 0.00 0.00 0.00 57.70 56.50 3d1f n MET 206 Cb 0.25 -1.48 -0.06 0.00 0.00 0.00 0.00 33.22 31.92 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 -2.25 4.37 0.00 3.17 1.02 -1.00 -4.73 118.68 119.26 3d1f s LEU 207 Ca 0.31 -0.18 0.00 0.00 0.02 0.00 0.00 54.13 54.28 3d1f s LEU 207 Cb 0.20 -2.84 0.00 0.00 0.02 0.00 0.00 46.19 43.57 3d1f s LEU 207 CO 0.43 -0.81 0.05 -0.90 0.02 0.00 0.00 176.35 175.14 3d1f n ASP 208 N 6.43 0.00 -0.90 2.29 5.75 -1.26 -4.92 116.55 123.93 3d1f n ASP 208 Ca 0.00 -1.00 0.06 0.00 -0.01 0.00 0.00 54.79 53.84 3d1f n ASP 208 Cb 0.48 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.76 3d1f n ASP 208 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d1f n GLY 209 N 0.00 1.31 7.00 6.12 0.00 -1.26 -5.00 105.19 113.36 3d1f n GLY 209 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3d1f n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1f n GLY 210 N 0.93 1.28 0.00 -0.02 0.00 -1.26 -0.02 105.19 106.11 3d1f n GLY 210 Ca 0.14 0.59 0.15 0.00 0.00 0.00 0.00 46.02 46.90 3d1f n GLY 210 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d1f n ASP 211 N 6.94 0.00 -4.75 1.61 5.68 -1.26 -1.62 116.55 123.15 3d1f n ASP 211 Ca 0.00 -0.86 -0.41 0.00 -0.50 0.00 0.00 54.79 53.02 3d1f n ASP 211 Cb 0.00 -0.03 -0.02 0.00 -1.14 0.00 0.00 41.12 39.93 3d1f n ASP 211 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 3d1f s ASN 212 N -2.05 6.69 0.43 -1.12 0.02 0.98 -4.70 114.94 115.18 3d1f s ASN 212 Ca 0.43 2.66 -0.25 0.00 -1.02 0.00 0.00 52.86 54.69 3d1f s ASN 212 Cb 0.20 -2.63 -0.08 0.00 0.02 0.00 0.00 41.25 38.77 3d1f s ASN 212 CO 0.35 -0.65 1.23 -2.16 0.02 0.00 0.00 177.10 175.89 3d1f s PRO 213 N -0.72 3.88 -0.05 -0.60 0.04 -1.26 -1.36 135.00 134.93 3d1f s PRO 213 Ca 0.57 1.96 0.06 0.00 0.04 0.00 0.00 61.00 63.63 3d1f s PRO 213 Cb -0.41 -2.60 -0.02 0.00 0.04 0.00 0.00 34.50 31.51 3d1f s PRO 213 CO 0.46 -0.51 -0.23 -1.17 0.04 0.00 0.00 177.00 175.59 3d1f s LEU 214 N -2.68 2.20 -0.17 -3.56 2.96 0.22 -4.50 118.68 113.14 3d1f s LEU 214 Ca 0.60 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.05 3d1f s LEU 214 Cb -0.33 -1.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 3d1f s LEU 214 CO 0.42 0.28 -0.09 -0.60 -1.32 0.00 0.00 176.35 175.04 3d1f s ARG 215 N -0.37 3.40 -0.07 1.98 6.06 -0.86 -1.04 118.95 128.05 3d1f s ARG 215 Ca 0.03 -0.65 0.04 0.00 -2.50 0.00 0.00 55.73 52.65 3d1f s ARG 215 Cb -0.12 -2.79 -0.02 0.00 0.06 0.00 0.00 34.95 32.08 3d1f s ARG 215 CO 0.02 0.05 -0.20 0.08 -2.50 0.00 0.00 175.30 172.76 3d1f s VAL 216 N 0.79 2.55 -0.07 7.11 1.01 0.22 -0.25 120.40 131.77 3d1f s VAL 216 Ca -0.04 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.07 3d1f s VAL 216 Cb -0.15 -1.98 0.02 0.00 0.00 0.00 0.00 36.38 34.27 3d1f s VAL 216 CO 0.01 0.57 -0.10 -1.10 0.00 0.00 0.00 175.10 174.48 3d1f s GLN 217 N -0.27 1.50 -0.13 2.72 -0.21 -0.01 -1.60 119.66 121.66 3d1f s GLN 217 Ca 0.00 -0.33 0.02 0.00 0.02 0.00 0.00 55.36 55.08 3d1f s GLN 217 Cb -0.13 -1.32 0.00 0.00 1.00 0.00 0.00 33.01 32.56 3d1f s GLN 217 CO 0.03 -0.04 -0.20 0.42 -2.12 0.00 0.00 175.29 173.38 3d1f s ILE 218 N 0.87 2.32 0.25 1.08 1.01 0.88 0.06 121.20 127.67 3d1f s ILE 218 Ca -0.11 -0.91 0.03 0.00 0.00 0.00 0.00 60.65 59.66 3d1f s ILE 218 Cb -0.15 -1.93 0.03 0.00 0.01 0.00 0.00 42.46 40.41 3d1f s ILE 218 CO 0.01 0.54 0.21 0.61 0.00 0.00 0.00 174.94 176.31 3d1f n GLY 219 N 3.80 2.77 0.19 6.18 0.00 0.13 -0.17 105.19 118.08 3d1f n GLY 219 Ca -0.19 -2.22 0.03 0.00 0.00 0.00 0.00 46.02 43.64 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 0.25 0.00 0.00 1.61 4.64 -1.97 -3.32 113.55 114.76 3d1f h SER 220 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3d1f h SER 220 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3d1f h SER 220 CO 0.23 0.37 -0.09 0.59 -0.87 0.00 0.00 176.83 177.06 3d1f n ASN 221 N -4.08 0.60 -3.83 4.97 4.13 -1.26 -4.98 115.26 110.81 3d1f n ASN 221 Ca -0.02 -1.54 -0.09 0.00 1.68 0.00 0.00 54.58 54.61 3d1f n ASN 221 Cb 0.41 -0.07 -0.07 0.00 -1.54 0.00 0.00 39.78 38.51 3d1f n ASN 221 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3d1f s ASN 222 N -0.60 0.06 0.02 6.41 -0.87 -1.25 -1.69 114.94 117.02 3d1f s ASN 222 Ca 0.02 -0.62 0.03 0.00 -1.57 0.00 0.00 52.86 50.73 3d1f s ASN 222 Cb 0.02 0.37 -0.02 0.00 -0.02 0.00 0.00 41.25 41.60 3d1f s ASN 222 CO 0.00 -0.76 -0.10 -0.51 -2.57 0.00 0.00 177.10 173.16 3d1f s ILE 223 N -3.86 0.79 0.00 0.60 2.07 -0.47 0.21 121.20 120.54 3d1f s ILE 223 Ca 0.06 -0.75 0.02 0.00 -1.41 0.00 0.00 60.65 58.56 3d1f s ILE 223 Cb 0.04 -0.72 -0.01 0.00 0.13 0.00 0.00 42.46 41.90 3d1f s ILE 223 CO -0.10 -0.02 -0.06 -0.60 -1.91 0.00 0.00 174.94 172.25 3d1f s ARG 224 N -0.86 0.49 -0.08 3.50 3.52 0.11 -1.60 118.95 124.03 3d1f s ARG 224 Ca -0.00 -0.28 0.02 0.00 -0.13 0.00 0.00 55.73 55.33 3d1f s ARG 224 Cb -0.06 -0.45 0.02 0.00 -1.56 0.00 0.00 34.95 32.89 3d1f s ARG 224 CO 0.00 0.12 -0.12 0.00 -0.81 0.00 0.00 175.30 174.50 3d1f s ALA 225 N -0.30 1.34 -0.36 6.12 0.00 0.62 -0.83 121.76 128.35 3d1f s ALA 225 Ca 0.01 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 3d1f s ALA 225 Cb -0.03 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.42 3d1f s ALA 225 CO -0.00 -0.04 0.21 -1.01 0.00 0.00 0.00 175.76 174.92 3d1f s HIS 226 N 0.95 3.22 -0.33 0.00 3.76 0.66 -0.66 115.29 122.89 3d1f s HIS 226 Ca -0.09 -0.73 0.03 0.00 -0.15 0.00 0.00 55.06 54.12 3d1f s HIS 226 Cb -0.15 -2.44 0.10 0.00 1.11 0.00 0.00 32.58 31.20 3d1f s HIS 226 CO 0.00 -0.56 0.06 0.08 -0.85 0.00 0.00 174.74 173.47 3d1f s VAL 227 N 1.60 1.98 0.00 -0.90 1.01 0.71 -2.03 120.40 122.77 3d1f s VAL 227 Ca 0.04 -2.13 0.00 0.00 0.00 0.00 0.00 61.98 59.89 3d1f s VAL 227 Cb -0.18 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.74 3d1f s VAL 227 CO 0.07 -0.60 0.00 0.61 0.00 0.00 0.00 175.10 175.19 3d1f n GLY 228 N 4.38 3.89 1.97 4.51 0.00 -1.26 -0.46 105.19 118.22 3d1f n GLY 228 Ca 0.02 0.20 -0.17 0.00 0.00 0.00 0.00 46.02 46.08 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 9.32 3.67 -4.23 1.61 8.00 -1.26 -4.92 116.55 128.73 3d1f n ASP 229 Ca 0.00 -3.58 -0.27 0.00 0.71 0.00 0.00 54.79 51.65 3d1f n ASP 229 Cb 0.00 -0.78 -0.15 0.00 -0.02 0.00 0.00 41.12 40.17 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 -3.24 1.89 -0.17 1.24 0.08 0.39 -1.39 117.98 116.79 3d1f s PHE 230 Ca 0.54 -0.36 -0.01 0.00 0.12 0.00 0.00 56.93 57.22 3d1f s PHE 230 Cb 0.46 -1.20 0.04 0.00 -0.57 0.00 0.00 43.02 41.76 3d1f s PHE 230 CO 0.09 -0.00 -0.04 0.42 -0.10 0.00 0.00 175.22 175.59 3d1f s ILE 231 N -0.56 1.03 -0.17 0.64 1.01 0.14 -0.21 121.20 123.08 3d1f s ILE 231 Ca 0.08 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 60.06 3d1f s ILE 231 Cb -0.08 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.10 3d1f s ILE 231 CO -0.00 0.08 0.02 0.12 0.00 0.00 0.00 174.94 175.16 3d1f s PHE 232 N 1.66 3.16 -0.03 3.97 5.36 0.16 -0.59 117.98 131.68 3d1f s PHE 232 Ca 0.00 -0.07 0.02 0.00 -0.96 0.00 0.00 56.93 55.92 3d1f s PHE 232 Cb -0.16 -2.02 0.01 0.00 -0.34 0.00 0.00 43.02 40.51 3d1f s PHE 232 CO -0.07 0.09 -0.08 0.99 -1.46 0.00 0.00 175.22 174.68 3d1f s THR 233 N 0.31 0.75 0.02 0.12 2.01 -0.54 -0.27 115.64 118.04 3d1f s THR 233 Ca 0.00 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.67 3d1f s THR 233 Cb -0.13 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 3d1f s THR 233 CO 0.01 0.24 -0.03 -0.55 -0.69 0.00 0.00 174.62 173.60 3d1f s SER 234 N 0.28 0.27 0.82 3.53 0.15 -0.63 -0.36 113.70 117.76 3d1f s SER 234 Ca -0.04 -0.50 -0.11 0.00 0.70 0.00 0.00 55.95 55.99 3d1f s SER 234 Cb -0.09 0.10 0.08 0.00 -1.71 0.00 0.00 66.02 64.40 3d1f s SER 234 CO 0.01 -0.29 1.10 -0.54 1.20 0.00 0.00 173.24 174.71 3d1f s LYS 235 N -1.46 1.92 0.37 5.44 1.02 -0.51 -1.37 119.74 125.14 3d1f s LYS 235 Ca -0.16 0.66 0.08 0.00 0.02 0.00 0.00 55.97 56.57 3d1f s LYS 235 Cb -0.10 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.29 3d1f s LYS 235 CO -0.01 -1.74 0.32 -0.51 -0.92 0.00 0.00 175.35 172.49 3d1f s LEU 236 N -5.86 3.52 -0.16 3.17 1.43 -0.68 -4.37 118.68 115.72 3d1f s LEU 236 Ca 0.61 -0.59 -0.10 0.00 -1.03 0.00 0.00 54.13 53.03 3d1f s LEU 236 Cb -0.15 -2.15 -0.05 0.00 0.03 0.00 0.00 46.19 43.87 3d1f s LEU 236 CO 0.55 -0.47 0.16 -0.69 0.23 0.00 0.00 176.35 176.13 3d1f s VAL 237 N -2.37 5.42 0.66 -1.59 1.01 0.11 -4.91 120.40 118.72 3d1f s VAL 237 Ca 0.44 0.26 -0.09 0.00 0.00 0.00 0.00 61.98 62.58 3d1f s VAL 237 Cb -0.05 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 32.87 3d1f s VAL 237 CO 0.27 0.51 1.02 -1.81 0.00 0.00 0.00 175.10 175.08 3d1f s ASP 238 N -0.19 5.57 0.00 3.32 1.01 -1.26 -4.31 116.67 120.81 3d1f s ASP 238 Ca 0.12 1.00 0.00 0.00 0.71 0.00 0.00 52.55 54.39 3d1f s ASP 238 Cb -0.12 -1.90 0.00 0.00 1.01 0.00 0.00 42.92 41.91 3d1f s ASP 238 CO 0.01 -1.20 0.00 0.61 0.21 0.00 0.00 175.17 174.81 3d1f n GLY 239 N -2.83 2.94 3.50 0.21 0.00 -1.26 -4.30 105.19 103.45 3d1f n GLY 239 Ca 0.06 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 3d1f n GLY 239 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d1f s ARG 240 N -2.62 3.22 0.16 1.61 0.52 -1.26 -5.00 118.95 115.59 3d1f s ARG 240 Ca 0.00 -0.57 -0.30 0.00 -0.52 0.00 0.00 55.73 54.34 3d1f s ARG 240 Cb 0.00 -3.94 -0.07 0.00 0.52 0.00 0.00 34.95 31.46 3d1f s ARG 240 CO 0.00 -0.86 1.06 0.12 0.02 0.00 0.00 175.30 175.64 3d1f s PHE 241 N 2.35 3.66 0.91 -0.53 2.19 -1.26 -5.00 117.98 120.30 3d1f s PHE 241 Ca 0.16 1.66 -0.12 0.00 0.33 0.00 0.00 56.93 58.96 3d1f s PHE 241 Cb -0.16 -3.21 0.09 0.00 -1.31 0.00 0.00 43.02 38.43 3d1f s PHE 241 CO 0.15 -0.37 0.86 -0.35 1.83 0.00 0.00 175.22 177.34 3d1f n PRO 242 N 2.48 -0.28 -3.20 10.12 -0.04 -1.26 -4.95 135.00 137.88 3d1f n PRO 242 Ca 0.03 -0.02 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 3d1f n PRO 242 Cb 0.47 -2.17 -0.07 0.00 -0.04 0.00 0.00 33.50 31.69 3d1f n PRO 242 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3d1f s ASP 243 N -2.28 6.24 0.45 3.54 -1.08 -1.26 -4.95 116.67 117.32 3d1f s ASP 243 Ca 0.64 -0.70 0.18 0.00 -0.52 0.00 0.00 52.55 52.15 3d1f s ASP 243 Cb -0.24 -2.28 1.12 0.00 -1.46 0.00 0.00 42.92 40.07 3d1f s ASP 243 CO 0.60 -0.77 1.92 0.10 0.52 0.00 0.00 175.17 177.55 3d1f h TYR 244 N 8.88 0.40 -0.53 -5.34 -0.00 -2.01 -0.71 116.97 117.66 3d1f h TYR 244 Ca -0.27 0.01 0.14 0.00 -0.00 0.00 0.00 58.73 58.62 3d1f h TYR 244 Cb 1.10 -0.13 -0.02 0.00 -0.00 0.00 0.00 36.73 37.68 3d1f h TYR 244 CO 0.70 0.15 0.37 0.00 -0.00 0.00 0.00 178.16 179.39 3d1f h ARG 245 N 0.34 0.07 0.00 0.10 3.08 -1.97 -1.20 114.38 114.80 3d1f h ARG 245 Ca 0.36 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 3d1f h ARG 245 Cb 0.93 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.96 3d1f h ARG 245 CO -0.10 0.05 0.00 0.54 -1.07 0.00 0.00 179.97 179.38 3d1f n ARG 246 N -4.40 0.20 -0.00 0.04 1.74 -0.27 -3.30 116.66 110.67 3d1f n ARG 246 Ca 0.09 0.29 0.09 0.00 -0.77 0.00 0.00 57.85 57.55 3d1f n ARG 246 Cb 0.55 -1.80 -0.11 0.00 -1.02 0.00 0.00 32.46 30.09 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 -2.16 0.00 -1.94 1.55 0.24 -0.46 -4.94 118.33 110.61 3d1f n VAL 247 Ca 0.04 -0.14 -0.42 0.00 -2.04 0.00 0.00 64.34 61.78 3d1f n VAL 247 Cb 0.33 0.82 -0.03 0.00 -1.47 0.00 0.00 33.84 33.49 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 -3.14 4.37 0.41 1.34 1.43 -1.15 -4.79 118.68 117.14 3d1f s LEU 248 Ca 0.04 2.69 -0.26 0.00 -1.03 0.00 0.00 54.13 55.57 3d1f s LEU 248 Cb 0.13 -3.61 -0.10 0.00 0.03 0.00 0.00 46.19 42.64 3d1f s LEU 248 CO 0.75 -0.79 1.25 -0.81 0.23 0.00 0.00 176.35 176.98 3d1f n PRO 249 N 3.10 1.90 -4.02 1.29 -0.04 -1.26 -4.98 135.00 130.99 3d1f n PRO 249 Ca 0.10 0.68 -0.35 0.00 -0.04 0.00 0.00 63.50 63.89 3d1f n PRO 249 Cb 0.39 -2.35 -0.10 0.00 -0.04 0.00 0.00 33.50 31.41 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 -2.15 3.90 -1.08 0.54 0.00 -1.26 -4.61 119.74 115.09 3d1f s LYS 250 Ca 0.60 -0.34 -0.19 0.00 0.00 0.00 0.00 55.97 56.05 3d1f s LYS 250 Cb -0.52 -3.19 -0.00 0.00 0.00 0.00 0.00 37.83 34.12 3d1f s LYS 250 CO 0.58 0.32 0.76 0.09 0.00 0.00 0.00 175.35 177.10 3d1f n ASN 251 N 3.39 -5.40 -4.70 0.03 3.02 -1.26 -4.85 115.26 105.49 3d1f n ASN 251 Ca -0.17 -0.96 -0.42 0.00 -0.03 0.00 0.00 54.58 53.00 3d1f n ASN 251 Cb 0.52 -3.22 -0.03 0.00 -0.61 0.00 0.00 39.78 36.45 3d1f n ASN 251 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 3d1f s PRO 252 N -5.76 4.17 0.00 3.52 0.02 -1.26 -4.88 135.00 130.81 3d1f s PRO 252 Ca 0.40 2.46 0.19 0.00 0.02 0.00 0.00 61.00 64.07 3d1f s PRO 252 Cb -0.15 -3.39 0.26 0.00 0.02 0.00 0.00 34.50 31.24 3d1f s PRO 252 CO 0.87 -0.74 1.20 -0.40 -0.33 0.00 0.00 177.00 177.60 3d1f n ASP 253 N 4.92 2.87 -3.94 2.53 5.75 -1.00 -4.90 116.55 122.78 3d1f n ASP 253 Ca 0.16 -1.85 -0.21 0.00 -0.01 0.00 0.00 54.79 52.88 3d1f n ASP 253 Cb 0.38 -0.11 -0.16 0.00 -1.03 0.00 0.00 41.12 40.20 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 -1.41 0.99 -0.03 0.11 1.02 -0.95 -4.50 119.74 114.97 3d1f s LYS 254 Ca 0.27 -0.20 0.01 0.00 0.02 0.00 0.00 55.97 56.07 3d1f s LYS 254 Cb 0.17 -0.93 0.02 0.00 -0.52 0.00 0.00 37.83 36.58 3d1f s LYS 254 CO 0.25 -0.02 -0.02 -1.01 -0.92 0.00 0.00 175.35 173.63 3d1f s HIS 255 N 0.69 0.50 0.04 3.18 3.76 -1.02 -0.87 115.29 121.56 3d1f s HIS 255 Ca -0.10 -0.09 0.06 0.00 -0.15 0.00 0.00 55.06 54.78 3d1f s HIS 255 Cb -0.13 -0.50 -0.02 0.00 1.11 0.00 0.00 32.58 33.04 3d1f s HIS 255 CO 0.01 -0.14 -0.18 -1.17 -0.85 0.00 0.00 174.74 172.41 3d1f s LEU 256 N 0.86 2.17 -0.05 0.89 0.20 0.24 -2.47 118.68 120.52 3d1f s LEU 256 Ca -0.10 -0.49 -0.02 0.00 0.69 0.00 0.00 54.13 54.21 3d1f s LEU 256 Cb -0.13 -0.80 0.03 0.00 -0.43 0.00 0.00 46.19 44.86 3d1f s LEU 256 CO -0.01 0.10 0.11 -0.70 -0.29 0.00 0.00 176.35 175.56 3d1f s GLU 257 N -1.14 0.07 0.22 1.98 2.12 -0.57 0.15 118.70 121.53 3d1f s GLU 257 Ca 0.05 0.25 -0.20 0.00 0.36 0.00 0.00 54.97 55.43 3d1f s GLU 257 Cb -0.08 -0.11 0.03 0.00 0.26 0.00 0.00 34.13 34.23 3d1f s GLU 257 CO 0.01 -0.11 0.60 0.00 -0.54 0.00 0.00 175.26 175.23 3d1f s ALA 258 N 0.75 -1.16 0.27 6.30 0.00 -0.70 -1.32 121.76 125.90 3d1f s ALA 258 Ca -0.06 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 3d1f s ALA 258 Cb -0.08 0.87 -0.11 0.00 0.00 0.00 0.00 23.12 23.81 3d1f s ALA 258 CO -0.03 -0.87 1.49 0.20 0.00 0.00 0.00 175.76 176.54 3d1f s GLY 259 N -2.86 2.30 0.10 0.00 0.00 -1.26 -0.68 107.32 104.92 3d1f s GLY 259 Ca 0.08 1.41 -0.18 0.00 0.00 0.00 0.00 44.72 46.04 3d1f s GLY 259 CO -0.02 2.36 1.60 0.00 0.00 0.00 0.00 173.10 177.04 3d1f h ASP 261 N 0.31 -0.19 -0.97 0.00 3.58 -1.82 0.49 116.42 117.82 3d1f h ASP 261 Ca 0.09 -0.03 0.03 0.00 0.42 0.00 0.00 57.03 57.54 3d1f h ASP 261 Cb 0.29 0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.34 3d1f h ASP 261 CO 0.00 -0.10 0.64 -0.07 -2.88 0.00 0.00 179.24 176.83 3d1f h LEU 262 N -0.27 1.08 -0.05 2.28 3.38 -1.94 0.77 115.31 120.55 3d1f h LEU 262 Ca -0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3d1f h LEU 262 Cb 0.21 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3d1f h LEU 262 CO 0.04 0.75 0.02 -0.07 0.09 0.00 0.00 178.44 179.27 3d1f h LEU 263 N 1.26 0.07 -0.48 1.67 3.38 -1.15 -2.05 115.31 118.01 3d1f h LEU 263 Ca 0.38 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3d1f h LEU 263 Cb -0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3d1f h LEU 263 CO -0.11 0.23 0.31 0.50 0.09 0.00 0.00 178.44 179.46 3d1f h LYS 264 N -0.08 0.64 -0.14 1.13 3.64 -0.40 -1.75 116.57 119.61 3d1f h LYS 264 Ca 0.02 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 3d1f h LYS 264 Cb 0.18 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3d1f h LYS 264 CO -0.00 0.44 -0.29 1.96 -2.27 0.00 0.00 179.45 179.29 3d1f h GLN 265 N 0.65 0.25 -0.30 1.90 1.08 -0.83 -0.15 115.11 117.72 3d1f h GLN 265 Ca 0.18 -0.09 -0.12 0.00 -1.45 0.00 0.00 58.65 57.17 3d1f h GLN 265 Cb -0.06 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.35 3d1f h GLN 265 CO -0.04 0.53 -0.28 0.00 -0.95 0.00 0.00 178.83 178.09 3d1f h ALA 266 N 1.48 0.43 -0.42 3.87 0.00 -1.03 -1.49 119.26 122.10 3d1f h ALA 266 Ca 0.03 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 3d1f h ALA 266 Cb 0.63 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3d1f h ALA 266 CO 0.05 0.44 -0.18 0.74 0.00 0.00 0.00 179.25 180.30 3d1f h PHE 267 N 0.46 0.91 -0.37 0.00 0.04 -1.13 -1.75 116.94 115.10 3d1f h PHE 267 Ca 0.05 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.63 3d1f h PHE 267 Cb 0.85 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 3d1f h PHE 267 CO 0.07 0.92 0.24 0.00 -0.60 0.00 0.00 178.31 178.94 3d1f h ALA 268 N 1.08 0.47 -0.31 2.45 0.00 -0.87 0.25 119.26 122.33 3d1f h ALA 268 Ca 0.11 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 3d1f h ALA 268 Cb 0.69 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3d1f h ALA 268 CO 0.05 -0.05 -0.22 0.00 0.00 0.00 0.00 179.25 179.03 3d1f h ARG 269 N 0.50 0.70 -0.76 0.00 3.08 -1.19 -3.06 114.38 113.64 3d1f h ARG 269 Ca 0.14 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 3d1f h ARG 269 Cb -0.04 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 3d1f h ARG 269 CO -0.03 0.94 0.43 0.00 -1.07 0.00 0.00 179.97 180.24 3d1f h ALA 270 N 0.74 1.32 -0.49 0.04 0.00 -1.16 -2.13 119.26 117.57 3d1f h ALA 270 Ca 0.06 -0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.00 3d1f h ALA 270 Cb 0.77 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3d1f h ALA 270 CO 0.06 0.57 0.36 0.00 0.00 0.00 0.00 179.25 180.24 3d1f h ALA 271 N 1.41 2.45 -0.72 0.00 0.00 -0.84 -2.02 119.26 119.53 3d1f h ALA 271 Ca 0.27 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.29 3d1f h ALA 271 Cb 0.01 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3d1f h ALA 271 CO -0.05 -0.62 0.48 0.82 0.00 0.00 0.00 179.25 179.89 3d1f h ILE 272 N 0.00 0.84 -0.39 0.00 2.04 -1.41 -1.83 117.51 116.76 3d1f h ILE 272 Ca 0.23 -0.15 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 3d1f h ILE 272 Cb 0.96 0.35 -0.07 0.00 -0.74 0.00 0.00 36.82 37.31 3d1f h ILE 272 CO -0.00 0.08 0.04 0.18 0.00 0.00 0.00 178.15 178.45 3d1f n LEU 273 N -4.48 4.37 -4.95 1.44 4.77 -0.76 -4.98 117.00 112.40 3d1f n LEU 273 Ca 0.13 -3.36 -0.23 0.00 -0.03 0.00 0.00 56.01 52.52 3d1f n LEU 273 Cb 0.47 -0.62 -0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3d1f n LEU 273 CO 0.33 0.93 0.19 -0.94 -1.33 0.00 0.00 177.39 176.57 3d1f s SER 274 N -2.04 6.13 0.09 -1.43 1.04 -0.69 -2.21 113.70 114.59 3d1f s SER 274 Ca 0.45 0.34 -0.34 0.00 0.48 0.00 0.00 55.95 56.88 3d1f s SER 274 Cb 0.38 -1.81 -0.14 0.00 0.10 0.00 0.00 66.02 64.55 3d1f s SER 274 CO 0.06 -0.42 1.61 -3.20 0.98 0.00 0.00 173.24 172.27 3d1f n ASN 275 N -1.86 2.96 0.14 7.02 5.15 -1.24 -4.75 115.26 122.68 3d1f n ASN 275 Ca -0.03 1.07 0.15 0.00 -0.60 0.00 0.00 54.58 55.17 3d1f n ASN 275 Cb 0.57 -1.38 0.69 0.00 -0.53 0.00 0.00 39.78 39.13 3d1f n ASN 275 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 3d1f h GLU 276 N 6.45 0.00 0.00 1.20 5.08 -1.95 0.66 114.58 126.02 3d1f h GLU 276 Ca -0.46 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 57.71 3d1f h GLU 276 Cb 1.27 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 3d1f h GLU 276 CO 0.89 0.00 -1.88 0.36 -1.00 0.00 0.00 179.01 177.38 3d1f n LYS 277 N -4.37 1.40 0.01 2.33 2.85 -1.26 -4.62 118.16 114.49 3d1f n LYS 277 Ca 0.03 -0.04 0.11 0.00 -1.05 0.00 0.00 58.31 57.36 3d1f n LYS 277 Cb 0.35 -1.36 -0.12 0.00 -0.65 0.00 0.00 35.03 33.25 3d1f n LYS 277 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3d1f n PHE 278 N -2.38 0.12 -2.48 5.58 0.99 -1.20 -4.99 117.46 113.10 3d1f n PHE 278 Ca -0.17 0.04 -0.10 0.00 -0.00 0.00 0.00 57.45 57.22 3d1f n PHE 278 Cb 0.80 -0.45 -0.00 0.00 -1.00 0.00 0.00 39.48 38.83 3d1f n PHE 278 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3d1f n ARG 279 N -2.14 -2.43 -2.53 -1.08 5.12 0.22 -4.79 116.66 109.03 3d1f n ARG 279 Ca -0.02 0.46 -0.41 0.00 -1.93 0.00 0.00 57.85 55.95 3d1f n ARG 279 Cb 0.51 -5.03 -0.04 0.00 -1.16 0.00 0.00 32.46 26.74 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 -2.04 2.88 0.06 -0.13 0.00 -1.26 -0.70 107.32 106.13 3d1f s GLY 280 Ca 0.01 0.80 0.04 0.00 0.00 0.00 0.00 44.72 45.57 3d1f s GLY 280 CO 0.01 1.62 -0.11 -1.34 0.00 0.00 0.00 173.10 173.28 3d1f s VAL 281 N -0.34 0.83 -0.09 1.40 -7.23 -0.34 -4.53 120.40 110.11 3d1f s VAL 281 Ca 0.49 -1.24 -0.01 0.00 -1.81 0.00 0.00 61.98 59.41 3d1f s VAL 281 Cb -0.29 -0.90 -0.03 0.00 0.56 0.00 0.00 36.38 35.72 3d1f s VAL 281 CO 0.35 -0.33 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.63 3d1f s ARG 282 N -1.79 2.99 -0.10 4.82 0.52 0.92 -1.53 118.95 124.78 3d1f s ARG 282 Ca -0.05 -0.52 0.01 0.00 -0.52 0.00 0.00 55.73 54.66 3d1f s ARG 282 Cb -0.09 -2.70 -0.02 0.00 0.52 0.00 0.00 34.95 32.66 3d1f s ARG 282 CO 0.01 0.58 -0.13 -0.51 0.02 0.00 0.00 175.30 175.27 3d1f s LEU 283 N -0.57 2.73 -0.19 2.53 1.02 0.05 -0.38 118.68 123.86 3d1f s LEU 283 Ca 0.09 -0.28 0.01 0.00 0.02 0.00 0.00 54.13 53.97 3d1f s LEU 283 Cb -0.12 -1.59 0.03 0.00 0.02 0.00 0.00 46.19 44.53 3d1f s LEU 283 CO 0.02 0.22 -0.15 -0.31 0.02 0.00 0.00 176.35 176.16 3d1f s TYR 284 N -0.01 2.67 -0.14 0.29 1.51 0.54 -1.04 117.35 121.17 3d1f s TYR 284 Ca -0.04 -1.69 -0.04 0.00 -1.01 0.00 0.00 57.07 54.30 3d1f s TYR 284 Cb -0.14 -1.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 3d1f s TYR 284 CO 0.04 -0.78 0.00 0.14 -1.11 0.00 0.00 175.55 173.84 3d1f s VAL 285 N 1.32 4.26 0.28 0.71 -7.23 -0.21 -1.11 120.40 118.41 3d1f s VAL 285 Ca 0.01 -0.24 -0.04 0.00 -1.81 0.00 0.00 61.98 59.90 3d1f s VAL 285 Cb -0.15 -2.85 -0.01 0.00 0.56 0.00 0.00 36.38 33.92 3d1f s VAL 285 CO -0.10 0.52 0.36 -0.94 -0.31 0.00 0.00 175.10 174.64 3d1f s SER 286 N -0.07 0.56 -0.45 4.85 1.04 -0.44 -2.18 113.70 117.00 3d1f s SER 286 Ca 0.04 -1.35 -0.43 0.00 0.48 0.00 0.00 55.95 54.68 3d1f s SER 286 Cb -0.13 0.56 -0.18 0.00 0.10 0.00 0.00 66.02 66.37 3d1f s SER 286 CO 0.02 -1.11 1.99 1.21 0.98 0.00 0.00 173.24 176.33 3d1f n GLU 287 N -0.45 0.29 -2.85 4.02 2.13 -1.26 -0.93 120.64 121.59 3d1f n GLU 287 Ca 0.01 0.09 -0.14 0.00 0.66 0.00 0.00 57.16 57.78 3d1f n GLU 287 Cb 0.63 -1.71 -0.01 0.00 0.27 0.00 0.00 31.44 30.62 3d1f n GLU 287 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3d1f n ASN 288 N 6.92 -3.05 -3.74 4.31 5.03 -1.21 -4.93 115.26 118.59 3d1f n ASN 288 Ca 0.45 0.02 -0.12 0.00 0.87 0.00 0.00 54.58 55.79 3d1f n ASN 288 Cb 0.02 -2.60 -0.11 0.00 -1.02 0.00 0.00 39.78 36.06 3d1f n ASN 288 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 3d1f s GLN 289 N -5.44 0.38 -0.08 3.52 0.74 -0.11 -2.35 119.66 116.33 3d1f s GLN 289 Ca 0.17 0.56 0.04 0.00 0.05 0.00 0.00 55.36 56.18 3d1f s GLN 289 Cb -0.09 0.11 0.00 0.00 1.10 0.00 0.00 33.01 34.13 3d1f s GLN 289 CO 0.20 -0.09 -0.21 -1.17 -0.55 0.00 0.00 175.29 173.48 3d1f s LEU 290 N 0.61 1.98 -0.11 3.68 2.96 -0.74 -1.32 118.68 125.73 3d1f s LEU 290 Ca -0.03 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 3d1f s LEU 290 Cb -0.05 -1.23 0.01 0.00 0.50 0.00 0.00 46.19 45.42 3d1f s LEU 290 CO -0.04 0.15 -0.20 -0.75 -1.32 0.00 0.00 176.35 174.19 3d1f s LYS 291 N 0.27 2.70 -0.14 1.98 2.20 -0.27 -1.01 119.74 125.46 3d1f s LYS 291 Ca -0.13 -0.75 -0.00 0.00 -0.36 0.00 0.00 55.97 54.73 3d1f s LYS 291 Cb -0.16 -2.15 -0.01 0.00 -1.51 0.00 0.00 37.83 34.00 3d1f s LYS 291 CO 0.06 0.04 -0.13 0.42 -0.36 0.00 0.00 175.35 175.38 3d1f s ILE 292 N 0.68 2.95 0.14 5.43 1.01 0.41 -0.34 121.20 131.48 3d1f s ILE 292 Ca -0.12 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 59.93 3d1f s ILE 292 Cb -0.16 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 3d1f s ILE 292 CO 0.02 0.51 -0.18 0.42 0.00 0.00 0.00 174.94 175.72 3d1f s THR 293 N 0.58 1.66 -0.09 2.92 -4.23 0.48 -0.41 115.64 116.56 3d1f s THR 293 Ca -0.08 -1.78 -0.14 0.00 -1.18 0.00 0.00 61.69 58.51 3d1f s THR 293 Cb -0.16 -1.69 0.03 0.00 1.34 0.00 0.00 72.50 72.02 3d1f s THR 293 CO 0.03 -0.28 0.36 0.00 -0.54 0.00 0.00 174.62 174.19 3d1f s ALA 294 N -1.87 -0.90 -0.00 3.99 0.00 -0.65 -0.06 121.76 122.27 3d1f s ALA 294 Ca 0.12 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.76 3d1f s ALA 294 Cb -0.06 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3d1f s ALA 294 CO 0.05 -0.21 0.25 0.54 0.00 0.00 0.00 175.76 176.39 3d1f s ASN 295 N -0.40 -0.11 0.51 0.00 2.20 -1.17 -0.85 114.94 115.12 3d1f s ASN 295 Ca -0.05 -0.05 0.01 0.00 -0.94 0.00 0.00 52.86 51.83 3d1f s ASN 295 Cb -0.03 0.28 -0.01 0.00 -2.00 0.00 0.00 41.25 39.48 3d1f s ASN 295 CO 0.02 -0.44 0.01 0.54 -2.94 0.00 0.00 177.10 174.29 3d1f s ASN 296 N -1.43 4.14 0.61 3.54 2.20 -0.94 -3.66 114.94 119.40 3d1f s ASN 296 Ca -0.13 -1.65 0.32 0.00 -0.94 0.00 0.00 52.86 50.47 3d1f s ASN 296 Cb -0.05 0.52 1.89 0.00 -2.00 0.00 0.00 41.25 41.61 3d1f s ASN 296 CO 0.03 -0.86 2.23 -0.65 -2.94 0.00 0.00 177.10 174.91 3d1f h PRO 297 N 1.34 0.00 -0.02 3.55 0.11 -1.91 -1.39 132.00 133.67 3d1f h PRO 297 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3d1f h PRO 297 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3d1f h PRO 297 CO 0.74 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.92 3d1f n GLU 298 N -3.67 1.04 -1.28 1.05 4.71 -1.26 -4.86 120.64 116.38 3d1f n GLU 298 Ca -0.02 -0.07 -0.10 0.00 -0.01 0.00 0.00 57.16 56.97 3d1f n GLU 298 Cb 0.15 -1.09 -0.04 0.00 -1.01 0.00 0.00 31.44 29.45 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 -0.52 -0.79 -3.08 3.49 3.00 -0.52 -5.00 117.38 113.96 3d1f n GLN 299 Ca 0.04 0.81 -0.33 0.00 -0.01 0.00 0.00 57.00 57.51 3d1f n GLN 299 Cb 0.03 -4.74 -0.06 0.00 0.00 0.00 0.00 30.24 25.47 3d1f n GLN 299 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3d1f s GLU 300 N -2.69 4.06 0.04 -1.09 2.02 -1.26 -4.90 118.70 114.88 3d1f s GLU 300 Ca 0.00 0.76 0.01 0.00 0.02 0.00 0.00 54.97 55.77 3d1f s GLU 300 Cb 0.00 -2.40 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 3d1f s GLU 300 CO 0.00 0.13 -0.06 -1.21 0.02 0.00 0.00 175.26 174.14 3d1f s GLU 301 N -2.98 0.46 0.03 1.61 2.02 -1.26 -2.47 118.70 116.11 3d1f s GLU 301 Ca 0.55 -0.73 0.04 0.00 0.02 0.00 0.00 54.97 54.86 3d1f s GLU 301 Cb -0.10 -0.13 -0.02 0.00 0.10 0.00 0.00 34.13 33.98 3d1f s GLU 301 CO 0.17 0.01 -0.13 0.00 0.02 0.00 0.00 175.26 175.32 3d1f s ALA 302 N -1.52 1.10 -0.08 5.21 0.00 -0.03 -4.98 121.76 121.46 3d1f s ALA 302 Ca -0.11 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.04 3d1f s ALA 302 Cb -0.09 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 22.89 3d1f s ALA 302 CO -0.00 0.21 0.18 -2.00 0.00 0.00 0.00 175.76 174.15 3d1f s GLU 303 N -1.02 0.12 -0.07 0.00 2.12 -1.26 -1.63 118.70 116.96 3d1f s GLU 303 Ca 0.01 0.48 0.04 0.00 0.36 0.00 0.00 54.97 55.86 3d1f s GLU 303 Cb -0.07 -0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.15 3d1f s GLU 303 CO 0.01 -0.20 -0.20 -1.21 -0.54 0.00 0.00 175.26 173.12 3d1f s GLU 304 N 1.47 2.33 -0.10 4.30 0.41 0.45 -4.97 118.70 122.61 3d1f s GLU 304 Ca -0.06 -0.71 0.03 0.00 -0.41 0.00 0.00 54.97 53.81 3d1f s GLU 304 Cb -0.11 -1.88 -0.01 0.00 -1.78 0.00 0.00 34.13 30.34 3d1f s GLU 304 CO -0.07 0.20 -0.18 0.42 -0.49 0.00 0.00 175.26 175.14 3d1f s ILE 305 N 0.24 2.63 0.03 -1.63 1.01 -1.26 -0.44 121.20 121.78 3d1f s ILE 305 Ca -0.11 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.75 3d1f s ILE 305 Cb -0.15 -2.05 -0.02 0.00 0.01 0.00 0.00 42.46 40.25 3d1f s ILE 305 CO 0.05 0.55 -0.12 -0.76 0.00 0.00 0.00 174.94 174.66 3d1f s LEU 306 N 0.07 2.16 -0.03 2.97 1.02 -0.18 -5.01 118.68 119.69 3d1f s LEU 306 Ca -0.08 -0.42 -0.25 0.00 0.02 0.00 0.00 54.13 53.39 3d1f s LEU 306 Cb -0.15 -0.51 -0.04 0.00 0.02 0.00 0.00 46.19 45.51 3d1f s LEU 306 CO 0.05 0.01 0.79 -1.81 0.02 0.00 0.00 176.35 175.41 3d1f s ASP 307 N -1.06 7.13 0.26 2.29 1.01 -1.26 -1.79 116.67 123.25 3d1f s ASP 307 Ca 0.00 1.36 -0.03 0.00 0.71 0.00 0.00 52.55 54.60 3d1f s ASP 307 Cb -0.07 -2.46 -0.02 0.00 1.01 0.00 0.00 42.92 41.37 3d1f s ASP 307 CO 0.01 -0.13 0.30 0.68 0.21 0.00 0.00 175.17 176.24 3d1f s VAL 308 N 0.69 0.00 -0.38 -1.27 -7.23 -0.99 -4.86 120.40 106.36 3d1f s VAL 308 Ca 0.42 -1.78 -0.13 0.00 -1.81 0.00 0.00 61.98 58.67 3d1f s VAL 308 Cb -0.19 -2.46 0.02 0.00 0.56 0.00 0.00 36.38 34.31 3d1f s VAL 308 CO 0.22 0.00 0.25 -0.89 -0.31 0.00 0.00 175.10 174.37 3d1f s THR 309 N -3.80 4.97 -0.04 5.32 2.01 -0.44 -3.99 115.64 119.68 3d1f s THR 309 Ca 0.34 -0.67 0.01 0.00 0.31 0.00 0.00 61.69 61.68 3d1f s THR 309 Cb 0.03 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.83 3d1f s THR 309 CO 0.15 -0.23 -0.05 -0.47 -0.69 0.00 0.00 174.62 173.34 3d1f s TYR 310 N 1.63 0.72 -0.03 4.92 5.04 -1.26 -1.51 117.35 126.86 3d1f s TYR 310 Ca 0.04 -0.19 0.04 0.00 -2.44 0.00 0.00 57.07 54.52 3d1f s TYR 310 Cb -0.19 -0.62 -0.00 0.00 0.35 0.00 0.00 41.96 41.49 3d1f s TYR 310 CO 0.09 -0.17 -0.15 -1.12 -1.34 0.00 0.00 175.55 172.86 3d1f s SER 311 N 0.78 1.85 0.00 4.32 0.01 -1.03 -3.36 113.70 116.27 3d1f s SER 311 Ca -0.10 -0.29 0.00 0.00 1.31 0.00 0.00 55.95 56.86 3d1f s SER 311 Cb -0.13 -0.42 0.00 0.00 0.21 0.00 0.00 66.02 65.68 3d1f s SER 311 CO 0.00 0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.41 3d1f n GLY 312 N 3.05 1.66 3.77 3.44 0.00 -1.26 -2.43 105.19 113.41 3d1f n GLY 312 Ca -0.17 -2.05 -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 -1.36 2.57 0.44 4.61 0.00 -1.26 -4.82 121.76 121.94 3d1f s ALA 313 Ca 0.00 0.73 -0.24 0.00 0.00 0.00 0.00 51.96 52.45 3d1f s ALA 313 Cb 0.00 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.69 3d1f s ALA 313 CO 0.00 -1.04 1.23 -1.21 0.00 0.00 0.00 175.76 174.74 3d1f s GLU 314 N -3.63 3.82 0.05 0.00 2.02 -1.26 -4.87 118.70 114.83 3d1f s GLU 314 Ca 0.71 1.97 -0.27 0.00 0.02 0.00 0.00 54.97 57.40 3d1f s GLU 314 Cb -0.23 -2.57 0.07 0.00 0.10 0.00 0.00 34.13 31.50 3d1f s GLU 314 CO 0.34 -0.56 0.65 1.41 0.02 0.00 0.00 175.26 177.12 3d1f s MET 315 N -2.48 1.16 -0.09 1.61 1.75 -0.93 -4.99 119.30 115.33 3d1f s MET 315 Ca 0.61 -0.11 0.02 0.00 -1.25 0.00 0.00 55.69 54.96 3d1f s MET 315 Cb -0.34 0.54 -0.02 0.00 2.84 0.00 0.00 34.83 37.86 3d1f s MET 315 CO 0.42 -0.44 -0.16 -2.00 -0.65 0.00 0.00 175.02 172.18 3d1f s GLU 316 N -2.48 2.95 -0.08 4.11 -6.30 -1.26 -1.04 118.70 114.59 3d1f s GLU 316 Ca -0.05 -0.74 -0.06 0.00 -2.50 0.00 0.00 54.97 51.62 3d1f s GLU 316 Cb -0.01 -2.45 0.03 0.00 0.00 0.00 0.00 34.13 31.70 3d1f s GLU 316 CO -0.02 0.37 0.21 -1.50 0.02 0.00 0.00 175.26 174.34 3d1f s ILE 317 N -0.08 -0.01 0.19 -3.70 2.07 -0.21 -4.66 121.20 114.80 3d1f s ILE 317 Ca -0.03 0.05 -0.00 0.00 -1.41 0.00 0.00 60.65 59.26 3d1f s ILE 317 Cb -0.14 -0.30 -0.04 0.00 0.13 0.00 0.00 42.46 42.10 3d1f s ILE 317 CO 0.04 0.02 0.37 -0.83 -1.91 0.00 0.00 174.94 172.63 3d1f s GLY 318 N 0.50 1.80 0.03 1.50 0.00 -1.23 -0.77 107.32 109.15 3d1f s GLY 318 Ca -0.03 -0.85 -0.16 0.00 0.00 0.00 0.00 44.72 43.67 3d1f s GLY 318 CO -0.03 -0.81 0.36 -1.36 0.00 0.00 0.00 173.10 171.26 3d1f s PHE 319 N -1.84 -0.20 -0.40 1.90 0.08 -0.58 -1.14 117.98 115.80 3d1f s PHE 319 Ca 0.38 0.18 -0.29 0.00 0.12 0.00 0.00 56.93 57.33 3d1f s PHE 319 Cb -0.11 0.15 0.02 0.00 -0.57 0.00 0.00 43.02 42.52 3d1f s PHE 319 CO 0.29 -0.51 1.08 1.21 -0.10 0.00 0.00 175.22 177.19 3d1f s ASN 320 N -1.83 6.76 0.54 1.36 3.84 -1.26 -1.20 114.94 123.15 3d1f s ASN 320 Ca -0.07 0.71 0.19 0.00 0.21 0.00 0.00 52.86 53.90 3d1f s ASN 320 Cb -0.02 -2.53 1.39 0.00 -0.55 0.00 0.00 41.25 39.54 3d1f s ASN 320 CO -0.01 -1.05 2.16 1.62 -2.79 0.00 0.00 177.10 177.03 3d1f h VAL 321 N 5.98 0.88 -0.57 -5.21 3.04 -1.22 -2.03 116.25 117.12 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 0.97 -0.02 0.00 -2.01 0.00 0.00 31.29 31.29 3d1f h VAL 321 CO 1.07 0.00 0.04 0.28 -1.01 0.00 0.00 177.57 177.95 3d1f h SER 322 N 0.00 0.91 -0.68 3.17 0.02 -1.91 0.34 113.55 115.40 3d1f h SER 322 Ca 0.02 -0.22 -0.08 0.00 -0.84 0.00 0.00 61.79 60.67 3d1f h SER 322 Cb 0.09 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 3d1f h SER 322 CO -0.00 0.95 0.12 1.88 -1.14 0.00 0.00 176.83 178.64 3d1f h TYR 323 N 0.89 1.19 -0.03 3.45 0.05 -1.77 0.27 116.97 121.01 3d1f h TYR 323 Ca 0.17 -0.16 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 3d1f h TYR 323 Cb 0.46 -0.33 -0.00 0.00 1.01 0.00 0.00 36.73 37.87 3d1f h TYR 323 CO 0.03 0.99 0.00 0.28 -1.05 0.00 0.00 178.16 178.41 3d1f h VAL 324 N 1.05 1.24 -0.57 -2.88 2.07 -1.26 -2.81 116.25 113.09 3d1f h VAL 324 Ca 0.21 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3d1f h VAL 324 Cb 0.43 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 3d1f h VAL 324 CO 0.01 0.20 0.37 -0.07 0.02 0.00 0.00 177.57 178.10 3d1f h LEU 325 N -0.24 0.67 -0.44 2.57 3.38 -0.80 -1.09 115.31 119.36 3d1f h LEU 325 Ca 0.01 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.98 3d1f h LEU 325 Cb 0.32 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3d1f h LEU 325 CO 0.00 0.49 0.26 0.44 0.09 0.00 0.00 178.44 179.73 3d1f h ASP 326 N 0.78 0.43 0.08 -0.43 3.32 -0.83 0.11 116.42 119.88 3d1f h ASP 326 Ca 0.21 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 3d1f h ASP 326 Cb -0.07 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.39 3d1f h ASP 326 CO -0.04 0.31 -0.04 0.58 -1.72 0.00 0.00 179.24 178.33 3d1f h VAL 327 N 0.53 1.01 -0.35 -1.35 2.07 -1.09 -1.34 116.25 115.73 3d1f h VAL 327 Ca 0.18 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3d1f h VAL 327 Cb 0.01 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 3d1f h VAL 327 CO -0.08 0.07 0.18 -0.07 0.02 0.00 0.00 177.57 177.69 3d1f h LEU 328 N -0.23 0.42 -0.59 2.57 3.38 -0.96 -1.27 115.31 118.63 3d1f h LEU 328 Ca -0.01 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 3d1f h LEU 328 Cb 0.20 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3d1f h LEU 328 CO 0.02 0.36 -0.69 0.78 0.09 0.00 0.00 178.44 179.00 3d1f h ASN 329 N 0.48 0.14 0.81 -0.43 -0.26 -0.62 -3.05 115.58 112.66 3d1f h ASN 329 Ca 0.13 -0.09 -0.14 0.00 -0.56 0.00 0.00 56.30 55.63 3d1f h ASN 329 Cb 0.04 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 37.23 3d1f h ASN 329 CO -0.02 0.78 -0.65 0.00 -1.06 0.00 0.00 177.43 176.48 3d1f h ALA 330 N 1.21 0.82 -2.31 -0.83 0.00 -0.37 -3.41 119.26 114.38 3d1f h ALA 330 Ca -0.01 -0.59 -0.59 0.00 0.00 0.00 0.00 54.91 53.71 3d1f h ALA 330 Cb 1.22 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 3d1f h ALA 330 CO 0.10 0.81 0.45 -0.51 0.00 0.00 0.00 179.25 180.10 3d1f s LEU 331 N -7.23 4.10 -0.87 0.00 1.43 -0.56 -4.94 118.68 110.60 3d1f s LEU 331 Ca -0.00 1.05 0.01 0.00 -1.03 0.00 0.00 54.13 54.15 3d1f s LEU 331 Cb 0.11 -3.18 0.28 0.00 0.03 0.00 0.00 46.19 43.43 3d1f s LEU 331 CO 0.76 -0.49 1.12 0.29 0.23 0.00 0.00 176.35 178.26 3d1f n LYS 332 N 5.85 3.52 -4.19 1.70 4.76 -1.26 -4.88 118.16 123.66 3d1f n LYS 332 Ca 0.05 -4.61 -0.13 0.00 -2.87 0.00 0.00 58.31 50.75 3d1f n LYS 332 Cb 0.48 -2.39 -0.09 0.00 -1.84 0.00 0.00 35.03 31.19 3d1f n LYS 332 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3d1f h GLU 334 N 2.48 -0.21 -6.51 0.00 4.57 -1.97 -3.41 114.58 109.53 3d1f h GLU 334 Ca -0.33 0.01 -0.62 0.00 -1.18 0.00 0.00 59.36 57.25 3d1f h GLU 334 Cb 1.25 0.05 -0.22 0.00 -0.16 0.00 0.00 28.75 29.67 3d1f h GLU 334 CO 0.48 0.21 -0.85 -0.80 -1.18 0.00 0.00 179.01 176.87 3d1f s ASN 335 N -5.47 2.90 0.05 1.04 0.02 -1.26 0.13 114.94 112.35 3d1f s ASN 335 Ca -0.12 -0.72 0.09 0.00 -1.02 0.00 0.00 52.86 51.09 3d1f s ASN 335 Cb 0.00 -0.18 -0.03 0.00 0.02 0.00 0.00 41.25 41.07 3d1f s ASN 335 CO 0.46 0.11 -0.25 0.54 0.02 0.00 0.00 177.10 177.99 3d1f s VAL 336 N -1.12 2.01 -0.05 1.60 0.11 0.15 -1.05 120.40 122.05 3d1f s VAL 336 Ca 0.10 -1.36 0.05 0.00 -2.93 0.00 0.00 61.98 57.84 3d1f s VAL 336 Cb -0.10 -1.73 -0.02 0.00 -1.53 0.00 0.00 36.38 33.00 3d1f s VAL 336 CO 0.05 0.30 -0.18 -0.60 -3.33 0.00 0.00 175.10 171.34 3d1f s ARG 337 N -1.27 2.49 -0.05 1.54 3.52 0.23 -1.72 118.95 123.68 3d1f s ARG 337 Ca 0.11 -0.78 0.03 0.00 -0.13 0.00 0.00 55.73 54.96 3d1f s ARG 337 Cb -0.10 -2.29 0.01 0.00 -1.56 0.00 0.00 34.95 31.01 3d1f s ARG 337 CO 0.02 0.54 -0.14 -1.64 -0.81 0.00 0.00 175.30 173.27 3d1f s MET 338 N -0.53 1.68 -0.15 5.12 -1.94 0.12 -1.57 119.30 122.03 3d1f s MET 338 Ca 0.07 -0.48 0.01 0.00 -1.71 0.00 0.00 55.69 53.58 3d1f s MET 338 Cb -0.11 -1.42 0.01 0.00 2.01 0.00 0.00 34.83 35.31 3d1f s MET 338 CO 0.01 0.12 -0.19 -1.64 -0.01 0.00 0.00 175.02 173.31 3d1f s MET 339 N 0.37 3.10 0.31 2.03 -1.94 -0.06 -0.59 119.30 122.52 3d1f s MET 339 Ca -0.09 -0.80 0.03 0.00 -1.71 0.00 0.00 55.69 53.11 3d1f s MET 339 Cb -0.13 -2.54 -0.06 0.00 2.01 0.00 0.00 34.83 34.11 3d1f s MET 339 CO 0.03 -0.03 0.06 -0.51 -0.01 0.00 0.00 175.02 174.57 3d1f s LEU 340 N 0.88 2.05 0.00 -0.03 1.02 -0.05 -1.52 118.68 121.03 3d1f s LEU 340 Ca -0.05 -1.37 0.00 0.00 0.02 0.00 0.00 54.13 52.73 3d1f s LEU 340 Cb -0.15 -0.28 0.00 0.00 0.02 0.00 0.00 46.19 45.77 3d1f s LEU 340 CO -0.02 -0.63 0.00 0.35 0.02 0.00 0.00 176.35 176.07 3d1f n THR 341 N -0.62 0.00 -3.87 5.49 -2.24 -1.26 -2.23 114.28 109.54 3d1f n THR 341 Ca -0.02 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.51 3d1f n THR 341 Cb 0.66 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.88 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 4.66 0.48 3.42 1.47 -1.26 -4.83 116.67 121.61 3d1f s ASP 342 Ca 0.00 -1.17 0.33 0.00 1.18 0.00 0.00 52.55 52.88 3d1f s ASP 342 Cb 0.00 0.22 1.63 0.00 -0.34 0.00 0.00 42.92 44.43 3d1f s ASP 342 CO 0.00 -1.00 1.99 0.28 0.68 0.00 0.00 175.17 177.12 3d1f h SER 343 N 0.85 0.00 0.00 2.11 0.02 -2.00 -2.96 113.55 111.57 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 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 3d1f h SER 343 CO 0.58 0.00 -0.04 1.33 -1.14 0.00 0.00 176.83 177.56 3d1f n VAL 344 N -2.71 1.35 -4.11 2.27 0.24 -1.26 -4.53 118.33 109.58 3d1f n VAL 344 Ca -0.01 -1.55 -0.23 0.00 -2.04 0.00 0.00 64.34 60.51 3d1f n VAL 344 Cb 0.13 0.12 -0.06 0.00 -1.47 0.00 0.00 33.84 32.56 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 -1.97 4.67 0.42 -1.34 0.01 -1.12 -4.77 113.70 109.61 3d1f s SER 345 Ca 0.17 -0.77 -0.23 0.00 1.31 0.00 0.00 55.95 56.43 3d1f s SER 345 Cb 0.15 -0.73 -0.11 0.00 0.21 0.00 0.00 66.02 65.53 3d1f s SER 345 CO 0.02 -0.29 0.76 -1.20 0.41 0.00 0.00 173.24 172.94 3d1f n SER 346 N -1.14 0.09 -4.08 2.44 7.64 -1.26 -4.44 113.62 112.87 3d1f n SER 346 Ca -0.03 0.96 -0.27 0.00 1.01 0.00 0.00 58.87 60.54 3d1f n SER 346 Cb 0.61 -1.22 -0.17 0.00 -1.01 0.00 0.00 64.21 62.42 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 -1.37 1.41 -0.14 0.44 1.01 -0.98 -4.39 120.40 116.37 3d1f s VAL 347 Ca 0.64 -0.63 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 3d1f s VAL 347 Cb -0.59 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 3d1f s VAL 347 CO 0.57 0.42 0.11 -1.58 0.00 0.00 0.00 175.10 174.61 3d1f s GLN 348 N 0.60 3.63 -0.01 2.72 0.74 -0.57 -1.19 119.66 125.57 3d1f s GLN 348 Ca -0.15 -0.22 0.04 0.00 0.05 0.00 0.00 55.36 55.08 3d1f s GLN 348 Cb -0.16 -3.19 -0.01 0.00 1.10 0.00 0.00 33.01 30.74 3d1f s GLN 348 CO 0.05 0.59 -0.14 0.42 -0.55 0.00 0.00 175.29 175.66 3d1f s ILE 349 N -0.50 1.09 0.25 -2.34 1.01 0.15 -0.88 121.20 119.98 3d1f s ILE 349 Ca 0.11 -0.58 -0.22 0.00 0.00 0.00 0.00 60.65 59.97 3d1f s ILE 349 Cb -0.12 -0.92 0.03 0.00 0.01 0.00 0.00 42.46 41.47 3d1f s ILE 349 CO 0.02 0.31 0.69 -1.83 0.00 0.00 0.00 174.94 174.13 3d1f s GLU 350 N -0.27 1.66 0.09 2.79 -1.05 -0.61 -0.92 118.70 120.40 3d1f s GLU 350 Ca 0.04 -0.86 -0.31 0.00 -0.15 0.00 0.00 54.97 53.69 3d1f s GLU 350 Cb -0.06 0.60 -0.08 0.00 -0.44 0.00 0.00 34.13 34.15 3d1f s GLU 350 CO -0.00 -0.76 1.52 0.34 0.95 0.00 0.00 175.26 177.32 3d1f s ASP 351 N -2.88 6.69 0.53 0.83 -1.08 -1.26 -0.60 116.67 118.91 3d1f s ASP 351 Ca 0.09 2.42 0.36 0.00 -0.52 0.00 0.00 52.55 54.89 3d1f s ASP 351 Cb -0.05 -2.58 1.79 0.00 -1.46 0.00 0.00 42.92 40.63 3d1f s ASP 351 CO 0.02 -0.79 2.08 0.00 0.52 0.00 0.00 175.17 177.01 3d1f h ALA 352 N 7.49 1.00 -0.32 3.66 0.00 -1.38 -2.39 119.26 127.31 3d1f h ALA 352 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 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 0.00 179.25 180.16 3d1f n ALA 353 N -2.00 2.39 -3.39 0.00 0.00 -1.26 -4.97 120.51 111.29 3d1f n ALA 353 Ca -0.01 -0.96 -0.14 0.00 0.00 0.00 0.00 53.44 52.34 3d1f n ALA 353 Cb 0.14 -0.73 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.34 -0.50 0.00 0.00 0.15 -0.90 -5.03 113.70 106.08 3d1f s SER 354 Ca 0.33 0.94 0.14 0.00 0.70 0.00 0.00 55.95 58.05 3d1f s SER 354 Cb 0.19 0.96 0.27 0.00 -1.71 0.00 0.00 66.02 65.73 3d1f s SER 354 CO 0.27 -0.20 1.16 0.00 1.20 0.00 0.00 173.24 175.67 3d1f n GLN 355 N 2.67 2.05 0.26 5.44 6.02 -1.26 -3.98 117.38 128.59 3d1f n GLN 355 Ca -0.14 -1.83 0.11 0.00 -0.01 0.00 0.00 57.00 55.13 3d1f n GLN 355 Cb 0.57 -1.31 0.71 0.00 1.02 0.00 0.00 30.24 31.23 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 2.61 0.00 -4.39 1.08 4.64 -1.95 -3.43 113.55 112.11 3d1f h SER 356 Ca 0.00 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.91 3d1f h SER 356 Cb 0.70 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.56 3d1f h SER 356 CO 0.00 0.08 -0.78 0.00 -0.87 0.00 0.00 176.83 175.26 3d1f s ALA 357 N -4.60 1.08 -0.01 5.18 0.00 -1.26 -0.77 121.76 121.37 3d1f s ALA 357 Ca -0.04 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 51.04 3d1f s ALA 357 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.14 3d1f s ALA 357 CO 0.62 0.18 0.09 0.00 0.00 0.00 0.00 175.76 176.65 3d1f s ALA 358 N -0.98 -0.22 -0.01 0.00 0.00 0.24 -4.61 121.76 116.17 3d1f s ALA 358 Ca -0.01 -0.01 0.05 0.00 0.00 0.00 0.00 51.96 51.99 3d1f s ALA 358 Cb -0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 3d1f s ALA 358 CO 0.01 -0.13 -0.15 0.71 0.00 0.00 0.00 175.76 176.20 3d1f s TYR 359 N -0.73 1.39 -0.09 0.00 1.51 -0.10 -1.16 117.35 118.17 3d1f s TYR 359 Ca -0.08 -0.27 0.04 0.00 -1.01 0.00 0.00 57.07 55.74 3d1f s TYR 359 Cb -0.05 -0.90 0.00 0.00 -0.11 0.00 0.00 41.96 40.91 3d1f s TYR 359 CO 0.00 -0.03 -0.21 0.08 -1.11 0.00 0.00 175.55 174.28 3d1f s VAL 360 N -0.32 1.83 -0.07 0.71 1.01 -0.30 0.32 120.40 123.58 3d1f s VAL 360 Ca 0.05 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.16 3d1f s VAL 360 Cb -0.06 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 34.74 3d1f s VAL 360 CO -0.00 0.51 -0.13 -0.69 0.00 0.00 0.00 175.10 174.79 3d1f s VAL 361 N 0.38 1.17 0.04 2.92 1.01 -0.33 -0.25 120.40 125.34 3d1f s VAL 361 Ca -0.17 -0.50 -0.24 0.00 0.00 0.00 0.00 61.98 61.07 3d1f s VAL 361 Cb -0.17 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.09 3d1f s VAL 361 CO 0.07 0.36 0.74 -0.04 0.00 0.00 0.00 175.10 176.23 3d1f s MET 362 N 0.64 4.47 1.06 2.72 -1.94 -0.41 -2.32 119.30 123.51 3d1f s MET 362 Ca -0.15 1.01 -0.17 0.00 -1.71 0.00 0.00 55.69 54.68 3d1f s MET 362 Cb -0.16 -3.35 0.23 0.00 2.01 0.00 0.00 34.83 33.56 3d1f s MET 362 CO 0.04 0.32 1.22 -1.25 -0.01 0.00 0.00 175.02 175.34 3d1f s PRO 363 N -0.16 -0.11 0.13 2.03 0.04 -1.26 -4.76 135.00 130.92 3d1f s PRO 363 Ca 0.37 -0.22 0.11 0.00 0.04 0.00 0.00 61.00 61.30 3d1f s PRO 363 Cb -0.20 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 3d1f s PRO 363 CO 0.22 -2.94 -0.26 0.00 0.04 0.00 0.00 177.00 174.05 3d1f s MET 364 N -5.65 1.38 -0.69 4.56 0.23 -0.29 -4.93 119.30 113.92 3d1f s MET 364 Ca 0.72 -1.34 -0.27 0.00 -1.03 0.00 0.00 55.69 53.77 3d1f s MET 364 Cb -0.07 -1.86 0.03 0.00 -1.53 0.00 0.00 34.83 31.41 3d1f s MET 364 CO 0.54 0.44 1.23 1.03 -2.03 0.00 0.00 175.02 176.23 3d1f s ARG 365 N -2.08 3.27 0.00 3.16 0.52 -1.26 -3.54 118.95 119.03 3d1f s ARG 365 Ca 0.14 -0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.19 3d1f s ARG 365 Cb -0.10 -4.14 0.00 0.00 0.52 0.00 0.00 34.95 31.23 3d1f s ARG 365 CO 0.06 -1.99 0.22 1.28 0.02 0.00 0.00 175.30 174.89