#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmf h MET 3 N 0.00 0.78 0.01 -1.46 4.05 -2.08 -3.26 114.93 112.97 1xmf h MET 3 Ca 0.00 -0.21 -0.00 0.00 -0.28 0.00 0.00 59.70 59.21 1xmf h MET 3 Cb 0.00 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 30.71 1xmf h MET 3 CO 0.00 0.79 -0.00 1.25 0.23 0.00 0.00 176.91 179.18 1xmf h LEU 4 N 0.65 -0.01 0.00 3.39 5.85 -2.11 -3.51 115.31 119.57 1xmf h LEU 4 Ca 0.14 -0.84 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1xmf h LEU 4 Cb 0.39 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1xmf h LEU 4 CO 0.01 0.86 0.00 0.61 -0.34 0.00 0.00 178.44 179.58 1xmf n GLY 5 N 1.31 1.91 0.12 3.75 0.00 -1.23 -4.92 105.19 106.13 1xmf n GLY 5 Ca -0.09 -2.12 -0.15 0.00 0.00 0.00 0.00 46.02 43.66 1xmf n GLY 5 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xmf n GLU 6 N 0.00 0.67 -2.29 1.61 4.71 -1.26 -4.92 120.64 119.16 1xmf n GLU 6 Ca 0.00 0.12 -0.43 0.00 -0.01 0.00 0.00 57.16 56.84 1xmf n GLU 6 Cb 0.00 -1.55 -0.02 0.00 -1.01 0.00 0.00 31.44 28.85 1xmf n GLU 6 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 1xmf s ARG 7 N -2.52 4.23 -0.20 3.49 3.52 -1.26 -4.99 118.95 121.22 1xmf s ARG 7 Ca -0.24 1.83 -0.20 0.00 -0.13 0.00 0.00 55.73 56.99 1xmf s ARG 7 Cb 0.08 -3.81 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 1xmf s ARG 7 CO 0.70 -0.73 0.57 1.03 -0.81 0.00 0.00 175.30 176.06 1xmf s ARG 8 N 3.53 4.20 -0.20 5.12 0.52 -1.26 -5.05 118.95 125.81 1xmf s ARG 8 Ca 0.61 0.51 -0.10 0.00 -0.52 0.00 0.00 55.73 56.23 1xmf s ARG 8 Cb -0.26 -3.57 -0.05 0.00 0.52 0.00 0.00 34.95 31.59 1xmf s ARG 8 CO 0.20 -0.20 0.14 1.03 0.02 0.00 0.00 175.30 176.49 1xmf s ARG 9 N 1.78 4.18 0.52 3.54 0.52 -1.26 -4.98 118.95 123.26 1xmf s ARG 9 Ca 0.26 -0.22 0.31 0.00 -0.52 0.00 0.00 55.73 55.56 1xmf s ARG 9 Cb -0.16 -3.43 1.45 0.00 0.52 0.00 0.00 34.95 33.33 1xmf s ARG 9 CO 0.10 0.28 1.87 0.78 0.02 0.00 0.00 175.30 178.35 1xmf h GLY 10 N 6.73 0.13 2.00 -3.53 0.00 -1.95 0.33 103.07 106.78 1xmf h GLY 10 Ca -0.41 -0.02 -0.16 0.00 0.00 0.00 0.00 47.33 46.74 1xmf h GLY 10 CO 0.75 -0.01 -0.77 -2.00 0.00 0.00 0.00 176.54 174.51 1xmf h LEU 11 N 0.05 0.00 0.00 3.11 5.85 -1.95 -3.10 115.31 119.27 1xmf h LEU 11 Ca 0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.18 1xmf h LEU 11 Cb 1.75 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.78 1xmf h LEU 11 CO -0.03 0.77 -0.95 0.35 -0.34 0.00 0.00 178.44 178.24 1xmf n THR 12 N -3.37 0.00 -2.57 1.05 -2.24 -0.58 -4.91 114.28 101.67 1xmf n THR 12 Ca 0.00 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.13 1xmf n THR 12 Cb 0.82 0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 69.61 1xmf n THR 12 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xmf s ASP 13 N -2.38 7.00 0.16 3.42 -1.08 0.11 -4.94 116.67 118.96 1xmf s ASP 13 Ca -0.01 1.41 -0.21 0.00 -0.52 0.00 0.00 52.55 53.22 1xmf s ASP 13 Cb 0.05 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 39.04 1xmf s ASP 13 CO 0.29 -0.76 1.63 -0.65 0.52 0.00 0.00 175.17 176.20 1xmf h PRO 14 N 7.90 -0.18 0.48 4.34 0.11 -1.92 0.31 132.00 143.05 1xmf h PRO 14 Ca -0.22 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.89 1xmf h PRO 14 Cb 1.08 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1xmf h PRO 14 CO 0.99 -0.12 -0.44 1.49 -0.21 0.00 0.00 178.00 179.71 1xmf h GLU 15 N -0.19 -0.87 -0.11 1.05 4.81 -1.97 -1.43 114.58 115.87 1xmf h GLU 15 Ca 0.17 0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.48 1xmf h GLU 15 Cb 0.46 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1xmf h GLU 15 CO -0.46 -0.58 0.01 0.52 -0.73 0.00 0.00 179.01 177.77 1xmf h MET 16 N -0.91 0.05 -0.90 1.92 2.86 -1.85 -2.47 114.93 113.63 1xmf h MET 16 Ca -0.06 -0.00 0.10 0.00 -2.06 0.00 0.00 59.70 57.67 1xmf h MET 16 Cb 0.77 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.36 1xmf h MET 16 CO -0.03 0.04 0.58 0.00 1.06 0.00 0.00 176.91 178.56 1xmf h ALA 17 N 1.08 1.62 -0.39 6.32 0.00 -0.30 -0.40 119.26 127.19 1xmf h ALA 17 Ca 0.05 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1xmf h ALA 17 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1xmf h ALA 17 CO -0.07 0.19 -0.25 1.49 0.00 0.00 0.00 179.25 180.61 1xmf h GLU 18 N 0.90 0.81 -0.41 0.00 4.57 -0.91 0.26 114.58 119.80 1xmf h GLU 18 Ca 0.42 -0.34 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1xmf h GLU 18 Cb 0.41 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.95 1xmf h GLU 18 CO -0.18 0.97 0.22 0.28 -1.18 0.00 0.00 179.01 179.12 1xmf h VAL 19 N 0.70 1.15 0.38 0.32 2.07 -0.78 -0.91 116.25 119.18 1xmf h VAL 19 Ca 0.09 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 1xmf h VAL 19 Cb 0.78 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1xmf h VAL 19 CO 0.06 0.16 -0.18 0.40 0.02 0.00 0.00 177.57 178.03 1xmf h ILE 20 N 0.52 0.63 -0.70 4.57 2.04 -0.68 -2.61 117.51 121.28 1xmf h ILE 20 Ca 0.14 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 66.03 1xmf h ILE 20 Cb 0.06 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 1xmf h ILE 20 CO -0.02 0.01 0.46 -0.07 0.00 0.00 0.00 178.15 178.53 1xmf h LEU 21 N -0.54 0.54 -1.06 1.44 3.38 -0.39 -1.24 115.31 117.44 1xmf h LEU 21 Ca -0.05 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1xmf h LEU 21 Cb 0.41 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1xmf h LEU 21 CO 0.09 0.33 -0.22 0.50 0.09 0.00 0.00 178.44 179.23 1xmf h LYS 22 N 0.61 0.40 -0.00 1.13 3.64 -0.89 -2.96 116.57 118.50 1xmf h LYS 22 Ca 0.32 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1xmf h LYS 22 Cb 0.44 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1xmf h LYS 22 CO -0.11 0.61 -0.11 0.00 -2.27 0.00 0.00 179.45 177.57 1xmf n ALA 23 N -2.48 2.73 -1.79 5.00 0.00 -0.49 -4.92 120.51 118.55 1xmf n ALA 23 Ca -0.00 -0.23 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 1xmf n ALA 23 Cb 0.37 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1xmf n ALA 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xmf s LEU 24 N -2.58 3.84 0.59 0.00 1.43 -1.08 -5.04 118.68 115.83 1xmf s LEU 24 Ca 0.26 1.98 -0.12 0.00 -1.03 0.00 0.00 54.13 55.22 1xmf s LEU 24 Cb 0.20 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.82 1xmf s LEU 24 CO 0.49 -0.85 1.00 -2.16 0.23 0.00 0.00 176.35 175.07 1xmf s PRO 25 N -3.21 3.67 0.24 1.29 0.04 -1.26 -4.96 135.00 130.80 1xmf s PRO 25 Ca 0.68 0.74 -0.06 0.00 0.04 0.00 0.00 61.00 62.40 1xmf s PRO 25 Cb -0.18 -2.12 0.30 0.00 0.04 0.00 0.00 34.50 32.54 1xmf s PRO 25 CO 0.21 -0.47 1.88 1.05 0.04 0.00 0.00 177.00 179.71 1xmf h GLU 26 N -0.01 1.08 -4.53 4.56 9.09 -1.99 -3.45 114.58 119.34 1xmf h GLU 26 Ca -0.45 -0.06 -0.22 0.00 0.05 0.00 0.00 59.36 58.68 1xmf h GLU 26 Cb 1.19 -0.24 -0.15 0.00 -1.65 0.00 0.00 28.75 27.90 1xmf h GLU 26 CO 0.62 0.71 -0.62 0.00 0.05 0.00 0.00 179.01 179.77 1xmf s ALA 27 N -6.09 1.06 0.61 1.06 0.00 -1.26 -5.14 121.76 112.01 1xmf s ALA 27 Ca -0.13 -1.62 -0.19 0.00 0.00 0.00 0.00 51.96 50.02 1xmf s ALA 27 Cb 0.18 1.24 -0.04 0.00 0.00 0.00 0.00 23.12 24.50 1xmf s ALA 27 CO 0.80 -0.57 1.13 -2.30 0.00 0.00 0.00 175.76 174.82 1xmf n PRO 28 N -0.22 1.06 -0.01 0.00 -0.02 -1.26 -4.88 135.00 129.66 1xmf n PRO 28 Ca -0.00 0.41 0.05 0.00 -2.02 0.00 0.00 63.50 61.94 1xmf n PRO 28 Cb 0.65 -2.34 0.27 0.00 -0.02 0.00 0.00 33.50 32.07 1xmf n PRO 28 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xmf n LEU 29 N -1.19 0.21 -3.65 2.45 4.77 -1.26 -4.70 117.00 113.63 1xmf n LEU 29 Ca 0.14 -0.09 -0.02 0.00 -0.03 0.00 0.00 56.01 56.01 1xmf n LEU 29 Cb 0.47 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.48 1xmf n LEU 29 CO 0.49 0.05 0.77 -0.62 -1.33 0.00 0.00 177.39 176.75 1xmf s ASP 30 N -1.29 -0.38 0.00 -1.43 -1.08 -1.26 -5.04 116.67 106.18 1xmf s ASP 30 Ca 0.16 0.62 0.30 0.00 -0.52 0.00 0.00 52.55 53.10 1xmf s ASP 30 Cb 0.07 1.11 1.45 0.00 -1.46 0.00 0.00 42.92 44.09 1xmf s ASP 30 CO 0.12 -0.10 1.98 0.61 0.52 0.00 0.00 175.17 178.30 1xmf n GLY 31 N 3.41 -0.83 3.52 2.66 0.00 -1.26 -4.58 105.19 108.11 1xmf n GLY 31 Ca -0.18 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1xmf n GLY 31 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xmf s ASN 32 N -2.24 6.84 -0.19 1.61 2.47 -1.26 -4.80 114.94 117.36 1xmf s ASN 32 Ca 0.37 -2.43 0.05 0.00 0.42 0.00 0.00 52.86 51.27 1xmf s ASN 32 Cb 0.21 -2.49 0.42 0.00 -1.45 0.00 0.00 41.25 37.94 1xmf s ASN 32 CO 0.41 -1.06 1.36 -0.46 -3.72 0.00 0.00 177.10 173.63 1xmf n ASN 33 N 7.23 3.56 -4.20 -4.21 6.94 -1.26 -4.81 115.26 118.51 1xmf n ASN 33 Ca 0.38 -2.71 -0.39 0.00 -0.02 0.00 0.00 54.58 51.84 1xmf n ASN 33 Cb 0.46 -0.65 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 1xmf n ASN 33 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1xmf s LYS 34 N -1.93 2.39 0.19 -3.83 1.02 -1.26 -5.07 119.74 111.25 1xmf s LYS 34 Ca 0.31 -1.69 -0.31 0.00 0.02 0.00 0.00 55.97 54.31 1xmf s LYS 34 Cb 0.25 -3.78 -0.10 0.00 -0.52 0.00 0.00 37.83 33.68 1xmf s LYS 34 CO 0.08 -1.08 1.54 1.41 -0.92 0.00 0.00 175.35 176.38 1xmf s MET 35 N 1.32 4.22 0.00 1.68 1.75 -1.26 -1.92 119.30 125.08 1xmf s MET 35 Ca 0.05 2.37 0.00 0.00 -1.25 0.00 0.00 55.69 56.86 1xmf s MET 35 Cb -0.24 -3.13 0.00 0.00 2.84 0.00 0.00 34.83 34.29 1xmf s MET 35 CO -0.01 -0.57 0.00 0.41 -0.65 0.00 0.00 175.02 174.20 1xmf n GLY 36 N 3.30 0.59 0.38 2.11 0.00 -1.26 -4.81 105.19 105.48 1xmf n GLY 36 Ca 0.12 -0.36 0.20 0.00 0.00 0.00 0.00 46.02 45.97 1xmf n GLY 36 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1xmf h TYR 37 N 0.00 0.00 -0.00 1.61 -0.00 -1.82 -0.25 116.97 116.51 1xmf h TYR 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1xmf h TYR 37 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1xmf h TYR 37 CO 0.00 0.00 -0.03 1.97 -0.00 0.00 0.00 178.16 180.10 1xmf n PHE 38 N -3.95 0.00 -2.91 0.10 1.16 -1.26 -4.85 117.46 105.75 1xmf n PHE 38 Ca 0.07 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.26 1xmf n PHE 38 Cb 0.56 -0.12 -0.06 0.00 -1.61 0.00 0.00 39.48 38.25 1xmf n PHE 38 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1xmf s VAL 39 N -2.26 4.28 -0.39 1.97 1.01 -0.11 -5.01 120.40 119.89 1xmf s VAL 39 Ca 0.37 1.82 -0.29 0.00 0.00 0.00 0.00 61.98 63.88 1xmf s VAL 39 Cb 0.21 -4.19 0.02 0.00 0.00 0.00 0.00 36.38 32.42 1xmf s VAL 39 CO 0.42 0.51 1.16 -0.89 0.00 0.00 0.00 175.10 176.30 1xmf s THR 40 N -1.16 4.28 0.39 3.92 2.01 -1.26 -4.99 115.64 118.83 1xmf s THR 40 Ca 0.37 1.40 -0.27 0.00 0.31 0.00 0.00 61.69 63.50 1xmf s THR 40 Cb -0.24 -4.44 -0.10 0.00 0.01 0.00 0.00 72.50 67.73 1xmf s THR 40 CO 0.28 -0.72 1.42 -2.84 -0.69 0.00 0.00 174.62 172.07 1xmf s PRO 41 N 4.16 4.01 0.05 4.92 0.02 -1.26 -4.93 135.00 141.97 1xmf s PRO 41 Ca 0.49 2.42 0.07 0.00 0.02 0.00 0.00 61.00 64.01 1xmf s PRO 41 Cb -0.11 -2.87 -0.23 0.00 0.02 0.00 0.00 34.50 31.31 1xmf s PRO 41 CO 0.25 -0.55 1.03 -0.09 -0.33 0.00 0.00 177.00 177.30 1xmf h ARG 42 N 2.83 0.04 0.00 5.54 9.65 -1.94 -3.47 114.38 127.02 1xmf h ARG 42 Ca -0.50 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.31 1xmf h ARG 42 Cb 1.25 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.85 1xmf h ARG 42 CO 0.63 0.86 0.00 0.91 2.80 0.00 0.00 179.97 185.17 1xmf n TRP 43 N -3.27 -0.71 0.10 2.20 8.01 -1.26 -5.06 117.44 117.45 1xmf n TRP 43 Ca -0.08 0.00 -0.15 0.00 -1.31 0.00 0.00 57.50 55.96 1xmf n TRP 43 Cb 0.99 0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 30.20 1xmf n TRP 43 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.69 178.25 1xmf h LYS 44 N 0.00 -0.67 -6.36 -0.99 -0.00 -2.04 -3.43 116.57 103.07 1xmf h LYS 44 Ca 0.00 0.05 -0.62 0.00 -0.00 0.00 0.00 60.65 60.08 1xmf h LYS 44 Cb 0.00 0.15 -0.14 0.00 -0.00 0.00 0.00 32.23 32.24 1xmf h LYS 44 CO 0.00 -0.45 -0.75 -0.98 -0.00 0.00 0.00 179.45 177.27 1xmf s ARG 45 N -5.56 1.82 0.45 0.07 3.03 -1.26 -5.01 118.95 112.49 1xmf s ARG 45 Ca -0.15 -1.54 -0.25 0.00 2.03 0.00 0.00 55.73 55.82 1xmf s ARG 45 Cb 0.06 -1.94 -0.08 0.00 -1.03 0.00 0.00 34.95 31.96 1xmf s ARG 45 CO 0.56 0.38 1.34 -1.17 -1.13 0.00 0.00 175.30 175.28 1xmf s LEU 46 N -3.18 4.09 0.21 -1.89 2.96 -1.26 -4.83 118.68 114.77 1xmf s LEU 46 Ca 0.27 2.73 0.06 0.00 -0.22 0.00 0.00 54.13 56.96 1xmf s LEU 46 Cb -0.07 -4.02 -0.04 0.00 0.50 0.00 0.00 46.19 42.57 1xmf s LEU 46 CO 0.14 -1.10 0.20 0.42 -1.32 0.00 0.00 176.35 174.69 1xmf s THR 47 N -1.28 4.62 0.28 3.68 -4.23 -1.26 -5.00 115.64 112.45 1xmf s THR 47 Ca 0.62 -1.17 -0.03 0.00 -1.18 0.00 0.00 61.69 59.93 1xmf s THR 47 Cb -0.39 -3.43 0.27 0.00 1.34 0.00 0.00 72.50 70.28 1xmf s THR 47 CO 0.50 -0.23 1.92 -0.08 -0.54 0.00 0.00 174.62 176.18 1xmf h GLU 48 N 1.89 1.15 -0.42 3.99 4.81 -1.98 -0.05 114.58 123.97 1xmf h GLU 48 Ca -0.48 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 58.73 1xmf h GLU 48 Cb 1.22 -0.26 -0.05 0.00 0.63 0.00 0.00 28.75 30.29 1xmf h GLU 48 CO 0.62 0.76 0.12 -0.92 -0.73 0.00 0.00 179.01 178.87 1xmf h TYR 49 N 1.19 0.21 -0.16 0.92 3.20 -1.95 -0.57 116.97 119.81 1xmf h TYR 49 Ca 0.39 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.23 1xmf h TYR 49 Cb 0.04 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.28 1xmf h TYR 49 CO -0.00 0.06 -0.10 0.93 -1.64 0.00 0.00 178.16 177.40 1xmf h GLU 50 N 0.27 0.35 -0.27 1.82 5.08 -1.70 -2.48 114.58 117.65 1xmf h GLU 50 Ca 0.20 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1xmf h GLU 50 Cb 0.22 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 1xmf h GLU 50 CO -0.23 0.69 0.02 0.00 -1.00 0.00 0.00 179.01 178.49 1xmf h ALA 51 N 0.65 0.26 0.00 3.43 0.00 -0.79 -0.39 119.26 122.42 1xmf h ALA 51 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1xmf h ALA 51 Cb 0.60 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1xmf h ALA 51 CO 0.03 -0.39 0.00 -0.07 0.00 0.00 0.00 179.25 178.82 1xmf h LEU 52 N 0.11 0.00 0.00 0.00 3.38 -1.15 -3.40 115.31 114.26 1xmf h LEU 52 Ca 0.13 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1xmf h LEU 52 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1xmf h LEU 52 CO -0.19 0.00 -1.20 0.41 0.09 0.00 0.00 178.44 177.54 1xmf n THR 53 N -2.63 0.88 -1.68 0.22 -1.04 -0.78 -4.89 114.28 104.36 1xmf n THR 53 Ca 0.02 0.00 -0.48 0.00 -2.04 0.00 0.00 64.05 61.56 1xmf n THR 53 Cb 0.30 -1.74 -0.05 0.00 -1.82 0.00 0.00 70.33 67.02 1xmf n THR 53 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1xmf n VAL 54 N -3.65 0.35 -0.80 12.58 0.31 -0.22 -1.92 118.33 124.98 1xmf n VAL 54 Ca -0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1xmf n VAL 54 Cb 0.50 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1xmf n VAL 54 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1xmf n TYR 55 N 5.35 0.00 0.05 3.52 4.01 -1.26 -4.91 117.16 123.92 1xmf n TYR 55 Ca 0.20 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.93 1xmf n TYR 55 Cb 0.29 0.00 0.27 0.00 -0.31 0.00 0.00 39.34 39.59 1xmf n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xmf h ALA 56 N 0.00 1.26 -2.20 -0.72 0.00 -1.73 -3.40 119.26 112.47 1xmf h ALA 56 Ca 0.00 -0.29 -0.56 0.00 0.00 0.00 0.00 54.91 54.06 1xmf h ALA 56 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1xmf h ALA 56 CO 0.00 0.49 0.92 -1.14 0.00 0.00 0.00 179.25 179.52 1xmf s GLN 57 N -4.60 4.23 0.00 0.00 0.74 -1.26 -4.91 119.66 113.86 1xmf s GLN 57 Ca -0.06 1.80 0.00 0.00 0.05 0.00 0.00 55.36 57.14 1xmf s GLN 57 Cb 0.14 -3.78 0.00 0.00 1.10 0.00 0.00 33.01 30.47 1xmf s GLN 57 CO 0.77 -0.71 1.14 -0.35 -0.55 0.00 0.00 175.29 175.59 1xmf n PRO 58 N 6.53 0.58 -2.11 1.67 -0.04 -1.26 -4.92 135.00 135.46 1xmf n PRO 58 Ca 0.14 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.21 1xmf n PRO 58 Cb 0.44 -1.21 -0.01 0.00 -0.04 0.00 0.00 33.50 32.69 1xmf n PRO 58 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1xmf s ASN 59 N 1.95 6.36 0.43 3.54 0.01 -1.26 -4.80 114.94 121.16 1xmf s ASN 59 Ca 0.00 2.58 -0.01 0.00 -0.71 0.00 0.00 52.86 54.72 1xmf s ASN 59 Cb 0.00 -2.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.00 1xmf s ASN 59 CO 0.00 -0.81 0.67 0.00 -1.51 0.00 0.00 177.10 175.45 1xmf s ALA 60 N -1.29 3.61 0.64 0.60 0.00 -1.26 -1.59 121.76 122.46 1xmf s ALA 60 Ca 0.57 -0.83 0.27 0.00 0.00 0.00 0.00 51.96 51.96 1xmf s ALA 60 Cb -0.36 -2.27 1.41 0.00 0.00 0.00 0.00 23.12 21.89 1xmf s ALA 60 CO 0.47 -0.26 1.81 0.38 0.00 0.00 0.00 175.76 178.16 1xmf h ASP 61 N 0.45 0.00 0.00 0.00 -0.00 -0.54 -1.63 116.42 114.70 1xmf h ASP 61 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.55 1xmf h ASP 61 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.56 1xmf h ASP 61 CO 0.60 0.00 0.00 -2.67 -0.00 0.00 0.00 179.24 177.17 1xmf n TRP 62 N -3.14 0.00 -4.02 4.15 4.27 -1.26 -4.05 117.44 113.39 1xmf n TRP 62 Ca 0.02 0.00 -0.31 0.00 -3.89 0.00 0.00 57.50 53.32 1xmf n TRP 62 Cb 0.57 0.00 -0.15 0.00 -1.36 0.00 0.00 31.31 30.37 1xmf n TRP 62 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1xmf s ILE 63 N -2.00 2.22 0.00 -1.67 1.01 -0.61 -4.86 121.20 115.29 1xmf s ILE 63 Ca 0.31 -2.18 0.00 0.00 0.00 0.00 0.00 60.65 58.78 1xmf s ILE 63 Cb 0.14 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 40.03 1xmf s ILE 63 CO 0.24 -0.49 0.00 0.00 0.00 0.00 0.00 174.94 174.69 1xmf n ALA 64 N 4.30 0.00 -0.04 9.38 0.00 -1.26 -1.19 120.51 131.71 1xmf n ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xmf n ALA 64 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1xmf n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xmf n GLY 65 N 0.00 1.19 3.74 0.00 0.00 -1.24 -1.68 105.19 107.20 1xmf n GLY 65 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1xmf n GLY 65 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xmf s GLY 66 N -1.94 2.59 -0.01 -0.02 0.00 -0.33 -4.89 107.32 102.71 1xmf s GLY 66 Ca 0.00 0.95 0.13 0.00 0.00 0.00 0.00 44.72 45.80 1xmf s GLY 66 CO 0.00 1.34 0.48 1.04 0.00 0.00 0.00 173.10 175.96 1xmf n LEU 67 N -2.01 0.43 0.00 0.66 4.77 -0.94 -3.63 117.00 116.29 1xmf n LEU 67 Ca 0.13 -0.35 -0.13 0.00 -0.03 0.00 0.00 56.01 55.63 1xmf n LEU 67 Cb 0.50 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.67 1xmf n LEU 67 CO 0.46 0.11 0.36 -0.67 -1.33 0.00 0.00 177.39 176.32 1xmf n ASP 68 N -1.50 0.36 -4.00 -1.43 -0.08 -0.62 -4.73 116.55 104.54 1xmf n ASP 68 Ca 0.01 -1.40 -0.08 0.00 -1.51 0.00 0.00 54.79 51.81 1xmf n ASP 68 Cb 0.25 -0.42 -0.09 0.00 2.34 0.00 0.00 41.12 43.20 1xmf n ASP 68 CO 0.00 0.00 0.00 -1.66 0.12 0.00 0.00 177.20 175.66 1xmf s TRP 69 N -1.95 0.37 0.00 -0.67 1.48 -1.26 -0.07 118.94 116.84 1xmf s TRP 69 Ca 0.36 -0.86 0.00 0.00 -1.06 0.00 0.00 56.10 54.54 1xmf s TRP 69 Cb -0.01 -0.26 0.00 0.00 -1.16 0.00 0.00 33.47 32.04 1xmf s TRP 69 CO 0.24 -0.43 0.00 0.41 -4.06 0.00 0.00 176.95 173.11 1xmf n GLY 70 N 0.12 -0.81 3.85 3.67 0.00 -1.26 -4.91 105.19 105.85 1xmf n GLY 70 Ca -0.15 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 43.91 1xmf n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xmf s ASP 71 N -3.16 3.44 0.60 1.61 -1.08 -1.26 -4.77 116.67 112.05 1xmf s ASP 71 Ca 0.00 0.65 -0.16 0.00 -0.52 0.00 0.00 52.55 52.52 1xmf s ASP 71 Cb 0.00 -0.99 -0.03 0.00 -1.46 0.00 0.00 42.92 40.44 1xmf s ASP 71 CO 0.00 -2.56 1.06 0.26 0.52 0.00 0.00 175.17 174.45 1xmf s TRP 72 N -3.55 2.95 0.13 -5.34 0.52 -1.26 -4.97 118.94 107.42 1xmf s TRP 72 Ca 0.67 1.51 -0.09 0.00 0.02 0.00 0.00 56.10 58.22 1xmf s TRP 72 Cb -0.09 -3.02 -0.07 0.00 -1.15 0.00 0.00 33.47 29.13 1xmf s TRP 72 CO 0.52 -1.18 1.37 1.79 0.02 0.00 0.00 176.95 179.48 1xmf h THR 73 N 0.38 1.30 -3.44 2.01 1.35 -2.01 -3.43 112.91 109.06 1xmf h THR 73 Ca -0.47 -1.94 -0.39 0.00 -0.55 0.00 0.00 66.41 63.06 1xmf h THR 73 Cb 1.22 1.92 -0.35 0.00 -1.73 0.00 0.00 68.15 69.21 1xmf h THR 73 CO 0.57 0.61 -0.76 -1.58 -0.25 0.00 0.00 175.52 174.11 1xmf s GLN 74 N -3.82 0.60 0.33 4.72 0.74 -1.26 -5.15 119.66 115.82 1xmf s GLN 74 Ca -0.09 -0.01 0.02 0.00 0.05 0.00 0.00 55.36 55.33 1xmf s GLN 74 Cb 0.10 -0.73 0.02 0.00 1.10 0.00 0.00 33.01 33.49 1xmf s GLN 74 CO 0.88 -0.13 0.13 1.63 -0.55 0.00 0.00 175.29 177.25 1xmf n LYS 75 N 4.25 1.11 -1.82 1.67 5.02 -1.26 -4.65 118.16 122.48 1xmf n LYS 75 Ca -0.23 -2.20 -0.31 0.00 -2.02 0.00 0.00 58.31 53.55 1xmf n LYS 75 Cb 0.51 0.41 0.02 0.00 -0.02 0.00 0.00 35.03 35.95 1xmf n LYS 75 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1xmf s PHE 76 N -1.89 3.35 0.21 2.13 0.40 0.15 -4.92 117.98 117.42 1xmf s PHE 76 Ca 0.10 1.38 -0.32 0.00 -0.60 0.00 0.00 56.93 57.49 1xmf s PHE 76 Cb -0.01 -2.81 -0.12 0.00 0.51 0.00 0.00 43.02 40.59 1xmf s PHE 76 CO 0.06 -0.91 1.71 -1.01 0.70 0.00 0.00 175.22 175.78 1xmf s HIS 77 N -3.01 2.89 0.00 0.36 3.76 -1.26 -0.42 115.29 117.61 1xmf s HIS 77 Ca 0.57 0.38 0.00 0.00 -0.15 0.00 0.00 55.06 55.86 1xmf s HIS 77 Cb -0.12 -4.14 0.00 0.00 1.11 0.00 0.00 32.58 29.43 1xmf s HIS 77 CO 0.51 -4.26 0.00 0.41 -0.85 0.00 0.00 174.74 170.54 1xmf n GLY 78 N 3.83 2.19 0.00 -2.22 0.00 -1.26 -4.52 105.19 103.22 1xmf n GLY 78 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1xmf n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xmf n GLY 79 N -0.01 1.32 3.65 -0.02 0.00 0.44 -5.09 105.19 105.49 1xmf n GLY 79 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.52 1xmf n GLY 79 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xmf n ARG 80 N -0.30 1.67 -2.22 1.61 0.00 -1.24 -4.61 116.66 111.56 1xmf n ARG 80 Ca 0.00 0.61 -0.36 0.00 -0.00 0.00 0.00 57.85 58.10 1xmf n ARG 80 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 32.46 30.13 1xmf n ARG 80 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1xmf s PRO 81 N 1.86 3.37 0.25 -0.14 0.04 -1.26 -0.68 135.00 138.45 1xmf s PRO 81 Ca 0.87 1.67 -0.03 0.00 0.04 0.00 0.00 61.00 63.55 1xmf s PRO 81 Cb -0.84 -2.06 0.51 0.00 0.04 0.00 0.00 34.50 32.15 1xmf s PRO 81 CO 0.48 -0.85 1.69 0.77 0.04 0.00 0.00 177.00 179.14 1xmf h SER 82 N 1.30 0.10 -4.27 6.66 0.02 -1.92 -3.40 113.55 112.04 1xmf h SER 82 Ca -0.50 0.14 -0.19 0.00 -0.84 0.00 0.00 61.79 60.40 1xmf h SER 82 Cb 1.26 0.17 -0.25 0.00 0.14 0.00 0.00 62.40 63.73 1xmf h SER 82 CO 0.57 -0.01 -0.63 0.26 -1.14 0.00 0.00 176.83 175.88 1xmf s TRP 83 N -6.02 0.03 0.16 3.45 0.51 -1.26 -4.99 118.94 110.82 1xmf s TRP 83 Ca -0.12 -0.04 -0.24 0.00 -2.12 0.00 0.00 56.10 53.57 1xmf s TRP 83 Cb 0.22 -0.04 0.07 0.00 -0.81 0.00 0.00 33.47 32.91 1xmf s TRP 83 CO 0.76 -0.12 0.68 0.20 -0.51 0.00 0.00 176.95 177.96 1xmf s GLY 84 N -0.58 -0.49 0.52 0.98 0.00 -1.26 -5.01 107.32 101.47 1xmf s GLY 84 Ca -0.06 0.42 0.17 0.00 0.00 0.00 0.00 44.72 45.25 1xmf s GLY 84 CO 0.00 0.14 2.14 3.43 0.00 0.00 0.00 173.10 178.81 1xmf h ASN 85 N 2.00 0.00 0.10 1.64 2.35 -1.94 -2.87 115.58 116.85 1xmf h ASN 85 Ca -0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1xmf h ASN 85 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 1xmf h ASN 85 CO 0.34 0.03 0.00 -1.84 -1.65 0.00 0.00 177.43 174.31 1xmf n GLU 86 N -4.42 0.02 -0.06 0.81 0.28 -1.26 -2.92 120.64 113.08 1xmf n GLU 86 Ca -0.03 0.37 0.11 0.00 -0.16 0.00 0.00 57.16 57.46 1xmf n GLU 86 Cb 0.11 -1.50 0.41 0.00 1.43 0.00 0.00 31.44 31.89 1xmf n GLU 86 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1xmf n THR 87 N -1.42 0.16 -3.59 3.84 -2.24 -1.08 -4.90 114.28 105.05 1xmf n THR 87 Ca 0.01 -0.33 -0.16 0.00 -2.27 0.00 0.00 64.05 61.30 1xmf n THR 87 Cb 0.03 0.41 -0.07 0.00 -2.10 0.00 0.00 70.33 68.61 1xmf n THR 87 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1xmf s THR 88 N -1.84 0.00 0.25 4.28 -1.32 -1.15 -3.86 115.64 112.00 1xmf s THR 88 Ca 0.34 -0.03 0.08 0.00 -1.21 0.00 0.00 61.69 60.87 1xmf s THR 88 Cb 0.18 -0.95 -0.04 0.00 -1.51 0.00 0.00 72.50 70.18 1xmf s THR 88 CO 0.28 -0.01 1.57 -0.33 -2.21 0.00 0.00 174.62 173.92 1xmf h GLU 89 N 4.00 0.09 -7.07 7.08 4.39 -1.90 -3.45 114.58 117.72 1xmf h GLU 89 Ca -0.28 -0.07 -0.54 0.00 0.34 0.00 0.00 59.36 58.82 1xmf h GLU 89 Cb 1.15 0.01 0.12 0.00 -0.10 0.00 0.00 28.75 29.93 1xmf h GLU 89 CO 0.24 0.70 0.52 -0.51 -1.16 0.00 0.00 179.01 178.80 1xmf s LEU 90 N -7.68 3.76 0.06 1.33 1.43 -1.26 -5.03 118.68 111.29 1xmf s LEU 90 Ca -0.02 2.52 0.04 0.00 -1.03 0.00 0.00 54.13 55.64 1xmf s LEU 90 Cb 0.12 -4.45 -0.03 0.00 0.03 0.00 0.00 46.19 41.87 1xmf s LEU 90 CO 0.78 -1.53 -0.12 -0.13 0.23 0.00 0.00 176.35 175.58 1xmf s ARG 91 N -3.11 0.70 0.27 1.70 1.81 -1.26 -5.09 118.95 113.97 1xmf s ARG 91 Ca 0.74 -0.86 -0.08 0.00 -1.72 0.00 0.00 55.73 53.81 1xmf s ARG 91 Cb -0.34 -0.61 -0.01 0.00 -0.45 0.00 0.00 34.95 33.54 1xmf s ARG 91 CO 0.38 0.13 0.43 -0.08 -0.68 0.00 0.00 175.30 175.48 1xmf s THR 92 N -1.30 0.00 -0.18 0.02 -1.32 -1.26 -4.77 115.64 106.84 1xmf s THR 92 Ca -0.05 -1.55 0.21 0.00 -1.21 0.00 0.00 61.69 59.08 1xmf s THR 92 Cb -0.10 -2.40 -0.09 0.00 -1.51 0.00 0.00 72.50 68.41 1xmf s THR 92 CO 0.01 0.00 0.89 0.55 -2.21 0.00 0.00 174.62 173.86 1xmf n VAL 93 N -0.42 0.76 -3.34 5.08 3.14 -1.26 -4.83 118.33 117.46 1xmf n VAL 93 Ca -0.00 -0.60 0.02 0.00 -2.96 0.00 0.00 64.34 60.80 1xmf n VAL 93 Cb 0.62 -0.43 -0.02 0.00 -1.06 0.00 0.00 33.84 32.95 1xmf n VAL 93 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1xmf s ASP 94 N -5.41 -1.20 0.00 6.55 -1.08 -1.26 -3.70 116.67 110.57 1xmf s ASP 94 Ca -0.02 1.08 0.19 0.00 -0.52 0.00 0.00 52.55 53.27 1xmf s ASP 94 Cb 0.10 2.14 1.00 0.00 -1.46 0.00 0.00 42.92 44.69 1xmf s ASP 94 CO 0.81 -0.23 1.55 0.79 0.52 0.00 0.00 175.17 178.61 1xmf n TRP 95 N 5.41 0.00 -0.15 -5.34 7.02 -0.68 -2.66 117.44 121.05 1xmf n TRP 95 Ca -0.06 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.54 1xmf n TRP 95 Cb 0.51 -0.19 0.29 0.00 -2.42 0.00 0.00 31.31 29.49 1xmf n TRP 95 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1xmf n PHE 96 N -1.19 0.82 0.03 -5.99 3.01 -1.26 -4.38 117.46 108.49 1xmf n PHE 96 Ca 0.11 -0.42 -0.07 0.00 1.01 0.00 0.00 57.45 58.08 1xmf n PHE 96 Cb 0.12 -0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.69 1xmf n PHE 96 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1xmf h LYS 97 N 4.35 0.47 -6.60 -1.08 1.57 -1.92 -3.46 116.57 109.91 1xmf h LYS 97 Ca 0.00 -0.28 -0.58 0.00 -1.87 0.00 0.00 60.65 57.92 1xmf h LYS 97 Cb 0.99 0.02 0.15 0.00 0.08 0.00 0.00 32.23 33.47 1xmf h LYS 97 CO 0.00 0.87 -0.03 1.58 -0.57 0.00 0.00 179.45 181.29 1xmf n HIS 98 N -3.97 0.53 -3.71 -1.35 -0.00 -1.26 -5.02 115.22 100.44 1xmf n HIS 98 Ca -0.02 0.53 -0.13 0.00 -0.00 0.00 0.00 57.72 58.09 1xmf n HIS 98 Cb 0.57 -2.13 -0.14 0.00 -0.00 0.00 0.00 29.99 28.30 1xmf n HIS 98 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1xmf s ARG 99 N -2.07 0.16 -0.19 1.57 1.81 -1.26 -4.87 118.95 114.11 1xmf s ARG 99 Ca 0.66 0.55 -0.29 0.00 -1.72 0.00 0.00 55.73 54.93 1xmf s ARG 99 Cb -0.53 -0.13 -0.01 0.00 -0.45 0.00 0.00 34.95 33.83 1xmf s ARG 99 CO 0.55 -0.20 1.32 0.34 -0.68 0.00 0.00 175.30 176.63 1xmf s ASP 100 N 1.57 6.84 0.54 0.23 3.68 -1.26 -4.85 116.67 123.41 1xmf s ASP 100 Ca -0.06 1.64 0.26 0.00 2.13 0.00 0.00 52.55 56.52 1xmf s ASP 100 Cb -0.11 -2.54 1.44 0.00 -1.45 0.00 0.00 42.92 40.26 1xmf s ASP 100 CO -0.08 -0.87 2.00 -0.65 0.13 0.00 0.00 175.17 175.70 1xmf h PRO 101 N 8.67 0.00 -0.00 4.34 0.11 -1.94 0.42 132.00 143.60 1xmf h PRO 101 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1xmf h PRO 101 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1xmf h PRO 101 CO 0.98 0.00 -0.10 1.28 -0.21 0.00 0.00 178.00 179.95 1xmf n LEU 102 N -4.23 0.50 -3.84 2.35 4.77 -1.26 -4.94 117.00 110.35 1xmf n LEU 102 Ca 0.09 -0.02 -0.26 0.00 -0.03 0.00 0.00 56.01 55.79 1xmf n LEU 102 Cb 0.58 -0.16 0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1xmf n LEU 102 CO 0.35 0.09 -0.02 0.54 -1.33 0.00 0.00 177.39 177.02 1xmf n ARG 103 N -0.90 -4.85 -2.93 3.23 1.74 0.15 -4.92 116.66 108.18 1xmf n ARG 103 Ca 0.15 0.57 -0.43 0.00 -0.77 0.00 0.00 57.85 57.37 1xmf n ARG 103 Cb 0.27 -5.20 -0.05 0.00 -1.02 0.00 0.00 32.46 26.46 1xmf n ARG 103 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1xmf s ARG 104 N -6.34 3.58 0.58 5.56 0.52 -1.26 -4.75 118.95 116.83 1xmf s ARG 104 Ca 0.29 0.13 0.08 0.00 -0.52 0.00 0.00 55.73 55.71 1xmf s ARG 104 Cb -0.14 -3.88 0.08 0.00 0.52 0.00 0.00 34.95 31.52 1xmf s ARG 104 CO 0.83 -1.02 0.66 1.67 0.02 0.00 0.00 175.30 177.47 1xmf s TRP 105 N 3.30 1.35 0.20 -0.53 1.48 -1.26 -4.91 118.94 118.56 1xmf s TRP 105 Ca 0.32 -0.80 -0.13 0.00 -1.06 0.00 0.00 56.10 54.43 1xmf s TRP 105 Cb -0.12 -2.08 0.22 0.00 -1.16 0.00 0.00 33.47 30.33 1xmf s TRP 105 CO 0.21 -0.97 1.67 1.25 -4.06 0.00 0.00 176.95 175.05 1xmf h HIS 106 N 0.35 -0.05 0.21 1.66 -0.00 -2.00 -2.79 115.15 112.54 1xmf h HIS 106 Ca -0.31 0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.10 1xmf h HIS 106 Cb 1.30 0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 28.78 1xmf h HIS 106 CO 0.66 -0.14 -0.31 0.00 -0.00 0.00 0.00 177.93 178.15 1xmf h ALA 107 N 1.48 -0.59 -0.77 5.26 0.00 -2.00 -1.93 119.26 120.71 1xmf h ALA 107 Ca 0.27 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1xmf h ALA 107 Cb 0.42 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1xmf h ALA 107 CO -0.46 -0.88 0.51 -1.35 0.00 0.00 0.00 179.25 177.08 1xmf h PRO 108 N -0.59 1.00 0.66 0.00 0.11 -1.93 -1.68 132.00 129.57 1xmf h PRO 108 Ca 0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 1xmf h PRO 108 Cb 0.57 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.46 1xmf h PRO 108 CO -0.12 0.66 -0.32 -0.92 -0.21 0.00 0.00 178.00 177.10 1xmf h TYR 109 N 1.03 -0.83 0.00 0.65 3.20 -1.20 -1.63 116.97 118.20 1xmf h TYR 109 Ca 0.29 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.09 1xmf h TYR 109 Cb -0.10 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1xmf h TYR 109 CO -0.00 -0.50 -0.22 -0.39 -1.64 0.00 0.00 178.16 175.42 1xmf h VAL 110 N -0.94 0.76 -0.01 1.81 -1.51 -1.32 -2.25 116.25 112.80 1xmf h VAL 110 Ca -0.09 -0.88 -0.00 0.00 -1.23 0.00 0.00 66.70 64.50 1xmf h VAL 110 Cb 0.70 1.54 -0.00 0.00 -2.13 0.00 0.00 31.29 31.40 1xmf h VAL 110 CO 0.15 0.21 0.00 0.50 -1.23 0.00 0.00 177.57 177.20 1xmf h LYS 111 N 0.00 0.01 -0.37 5.19 3.64 -1.08 0.28 116.57 124.24 1xmf h LYS 111 Ca -0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1xmf h LYS 111 Cb 0.52 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1xmf h LYS 111 CO 0.03 0.26 0.17 -0.44 -2.27 0.00 0.00 179.45 177.21 1xmf h ASP 112 N -0.24 0.49 -0.29 4.20 5.19 -1.13 -1.82 116.42 122.82 1xmf h ASP 112 Ca 0.00 -0.14 -0.08 0.00 -0.62 0.00 0.00 57.03 56.19 1xmf h ASP 112 Cb 0.26 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 1xmf h ASP 112 CO 0.00 0.49 -0.10 0.50 -3.12 0.00 0.00 179.24 177.01 1xmf h LYS 113 N 0.46 0.69 -0.66 3.56 3.64 -1.39 -1.98 116.57 120.88 1xmf h LYS 113 Ca 0.13 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 1xmf h LYS 113 Cb 0.13 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1xmf h LYS 113 CO -0.01 0.78 0.13 0.00 -2.27 0.00 0.00 179.45 178.07 1xmf h ALA 114 N 1.26 0.88 -0.76 5.00 0.00 -0.73 0.11 119.26 125.03 1xmf h ALA 114 Ca 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1xmf h ALA 114 Cb 0.54 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1xmf h ALA 114 CO 0.03 0.62 0.43 0.93 0.00 0.00 0.00 179.25 181.26 1xmf h GLU 115 N 1.01 1.04 -0.46 0.00 5.08 -1.02 -0.10 114.58 120.14 1xmf h GLU 115 Ca 0.20 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1xmf h GLU 115 Cb 0.41 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1xmf h GLU 115 CO 0.01 0.77 0.19 0.93 -1.00 0.00 0.00 179.01 179.90 1xmf h GLU 116 N 1.04 0.68 0.20 2.33 5.08 -0.85 -0.66 114.58 122.39 1xmf h GLU 116 Ca 0.27 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1xmf h GLU 116 Cb 0.01 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1xmf h GLU 116 CO -0.05 0.61 -0.11 2.35 -1.00 0.00 0.00 179.01 180.82 1xmf h TRP 117 N 0.60 -0.29 -0.41 4.33 -0.00 -0.27 0.67 115.95 120.58 1xmf h TRP 117 Ca 0.15 -0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 58.99 1xmf h TRP 117 Cb 0.18 0.10 -0.02 0.00 -0.00 0.00 0.00 29.16 29.43 1xmf h TRP 117 CO 0.00 -0.18 0.06 0.00 -0.00 0.00 0.00 178.44 178.32 1xmf h ARG 118 N -0.30 0.63 -0.25 2.65 3.08 -0.91 -1.81 114.38 117.48 1xmf h ARG 118 Ca -0.02 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.82 1xmf h ARG 118 Cb 0.24 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1xmf h ARG 118 CO 0.03 0.60 -0.18 -0.92 -1.07 0.00 0.00 179.97 178.42 1xmf h TYR 119 N 0.61 0.66 -0.62 3.04 3.20 -0.89 -2.46 116.97 120.50 1xmf h TYR 119 Ca 0.13 -0.18 0.11 0.00 3.14 0.00 0.00 58.73 61.93 1xmf h TYR 119 Cb 0.29 -0.14 -0.08 0.00 1.54 0.00 0.00 36.73 38.33 1xmf h TYR 119 CO 0.01 0.86 0.17 1.15 -1.64 0.00 0.00 178.16 178.71 1xmf h THR 120 N 0.27 0.67 -0.21 1.81 2.02 -0.44 0.38 112.91 117.42 1xmf h THR 120 Ca 0.05 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 67.14 1xmf h THR 120 Cb 0.72 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1xmf h THR 120 CO 0.05 0.06 0.05 -0.78 0.37 0.00 0.00 175.52 175.27 1xmf h ASP 121 N 0.31 0.04 -0.72 4.18 1.82 -1.21 -0.55 116.42 120.28 1xmf h ASP 121 Ca 0.33 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 1xmf h ASP 121 Cb 0.47 0.03 -0.04 0.00 0.68 0.00 0.00 39.33 40.47 1xmf h ASP 121 CO -0.38 0.05 0.45 0.03 -1.61 0.00 0.00 179.24 177.78 1xmf h ARG 122 N 0.14 0.97 0.66 0.28 3.08 -0.72 -2.12 114.38 116.67 1xmf h ARG 122 Ca 0.09 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1xmf h ARG 122 Cb 0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1xmf h ARG 122 CO -0.11 0.67 -0.45 0.35 -1.07 0.00 0.00 179.97 179.36 1xmf h PHE 123 N 0.98 -1.21 -0.94 3.04 3.57 0.28 -1.59 116.94 121.08 1xmf h PHE 123 Ca 0.26 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.91 1xmf h PHE 123 Cb -0.06 0.44 -0.08 0.00 2.79 0.00 0.00 35.95 39.04 1xmf h PHE 123 CO -0.02 -0.66 0.60 -0.07 -2.23 0.00 0.00 178.31 175.93 1xmf h LEU 124 N -1.06 0.70 -0.85 0.59 3.38 -1.00 0.30 115.31 117.38 1xmf h LEU 124 Ca -0.08 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1xmf h LEU 124 Cb 0.87 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1xmf h LEU 124 CO 0.05 0.33 -0.36 1.56 0.09 0.00 0.00 178.44 180.11 1xmf h GLN 125 N 0.73 0.42 0.03 1.13 4.20 -1.13 -1.75 115.11 118.74 1xmf h GLN 125 Ca 0.49 -0.19 -0.18 0.00 0.06 0.00 0.00 58.65 58.83 1xmf h GLN 125 Cb 0.78 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.57 1xmf h GLN 125 CO -0.25 0.73 -0.73 0.78 -0.67 0.00 0.00 178.83 178.68 1xmf h GLY 126 N 1.11 0.50 0.36 3.46 0.00 -0.08 -2.74 103.07 105.68 1xmf h GLY 126 Ca 0.04 -0.93 0.05 0.00 0.00 0.00 0.00 47.33 46.49 1xmf h GLY 126 CO 0.06 0.82 -0.17 -1.82 0.00 0.00 0.00 176.54 175.44 1xmf h TYR 127 N -0.05 -0.43 -0.61 5.60 3.20 -0.38 0.32 116.97 124.61 1xmf h TYR 127 Ca -0.10 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.71 1xmf h TYR 127 Cb 1.45 0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.92 1xmf h TYR 127 CO 0.15 -0.24 0.03 0.66 -1.64 0.00 0.00 178.16 177.11 1xmf h SER 128 N -0.19 1.03 0.42 -2.11 4.64 -1.43 -2.42 113.55 113.49 1xmf h SER 128 Ca 0.11 -0.29 -0.09 0.00 -0.47 0.00 0.00 61.79 61.05 1xmf h SER 128 Cb 0.36 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1xmf h SER 128 CO -0.29 1.07 -0.43 0.00 -0.87 0.00 0.00 176.83 176.30 1xmf h ALA 129 N 1.00 1.26 -0.00 5.18 0.00 -1.12 -1.80 119.26 123.77 1xmf h ALA 129 Ca 0.18 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1xmf h ALA 129 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1xmf h ALA 129 CO 0.03 0.55 -0.06 -3.47 0.00 0.00 0.00 179.25 176.30 1xmf n ASP 130 N -4.02 0.24 -2.07 0.00 2.03 0.11 -4.91 116.55 107.93 1xmf n ASP 130 Ca -0.02 -0.40 -0.17 0.00 0.52 0.00 0.00 54.79 54.72 1xmf n ASP 130 Cb 0.46 -0.16 -0.03 0.00 -0.72 0.00 0.00 41.12 40.67 1xmf n ASP 130 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xmf n GLY 131 N 1.27 0.29 0.33 0.27 0.00 -0.68 -4.84 105.19 101.83 1xmf n GLY 131 Ca 0.15 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.36 1xmf n GLY 131 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xmf h GLN 132 N 0.00 0.00 -0.38 1.61 4.20 -1.78 -2.38 115.11 116.38 1xmf h GLN 132 Ca -0.38 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.44 1xmf h GLN 132 Cb 1.22 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 1xmf h GLN 132 CO 0.48 0.00 0.32 0.97 -0.67 0.00 0.00 178.83 179.93 1xmf h ILE 133 N 0.00 0.62 -0.63 2.54 6.09 -1.89 -2.82 117.51 121.42 1xmf h ILE 133 Ca 0.01 0.00 0.12 0.00 -1.37 0.00 0.00 64.86 63.61 1xmf h ILE 133 Cb 0.09 0.76 -0.09 0.00 0.47 0.00 0.00 36.82 38.06 1xmf h ILE 133 CO -0.00 0.00 0.16 0.03 -3.07 0.00 0.00 178.15 175.27 1xmf h ARG 134 N 0.00 0.29 -0.37 2.19 3.08 -1.82 -2.15 114.38 115.61 1xmf h ARG 134 Ca 0.18 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1xmf h ARG 134 Cb 0.82 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1xmf h ARG 134 CO -0.00 0.19 0.00 0.00 -1.07 0.00 0.00 179.97 179.09 1xmf n ALA 135 N -2.57 2.38 -2.74 0.04 0.00 -1.07 -4.84 120.51 111.71 1xmf n ALA 135 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.18 1xmf n ALA 135 Cb 0.33 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.71 1xmf n ALA 135 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1xmf s MET 136 N -1.59 4.08 0.10 0.00 0.00 -0.81 -4.35 119.30 116.73 1xmf s MET 136 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 55.69 55.33 1xmf s MET 136 Cb 0.00 -3.37 -0.12 0.00 0.00 0.00 0.00 34.83 31.34 1xmf s MET 136 CO 0.00 0.38 1.76 -1.71 0.00 0.00 0.00 175.02 175.45 1xmf n ASN 137 N 3.18 3.65 -0.12 1.11 2.85 -0.13 -4.91 115.26 120.89 1xmf n ASN 137 Ca -0.15 1.02 -0.09 0.00 -0.11 0.00 0.00 54.58 55.25 1xmf n ASN 137 Cb 0.52 -1.48 -0.01 0.00 1.24 0.00 0.00 39.78 40.05 1xmf n ASN 137 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1xmf h PRO 138 N 7.72 0.52 -0.11 1.20 0.11 -1.96 -1.78 132.00 137.69 1xmf h PRO 138 Ca -0.46 -0.09 0.01 0.00 0.11 0.00 0.00 66.00 65.58 1xmf h PRO 138 Cb 1.24 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1xmf h PRO 138 CO 0.93 0.49 0.02 1.15 -0.21 0.00 0.00 178.00 180.38 1xmf h THR 139 N 0.43 0.95 -0.98 -1.15 2.02 -1.98 0.13 112.91 112.34 1xmf h THR 139 Ca 0.12 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.28 1xmf h THR 139 Cb 0.15 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1xmf h THR 139 CO -0.01 0.01 0.64 -0.25 0.37 0.00 0.00 175.52 176.28 1xmf h TRP 140 N 0.07 1.24 0.45 3.16 2.91 -1.94 0.12 115.95 121.97 1xmf h TRP 140 Ca 0.05 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.07 1xmf h TRP 140 Cb 0.04 -0.42 0.00 0.00 -0.51 0.00 0.00 29.16 28.28 1xmf h TRP 140 CO -0.12 0.79 -0.22 -0.09 -1.03 0.00 0.00 178.44 177.78 1xmf h ARG 141 N 1.33 -0.58 0.00 2.65 2.43 -0.84 0.10 114.38 119.47 1xmf h ARG 141 Ca 0.36 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.57 1xmf h ARG 141 Cb -0.14 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1xmf h ARG 141 CO -0.08 -0.28 -0.00 -0.44 -1.51 0.00 0.00 179.97 177.67 1xmf h ASP 142 N -0.92 0.00 0.00 -3.80 3.32 -0.70 -2.50 116.42 111.82 1xmf h ASP 142 Ca -0.06 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1xmf h ASP 142 Cb 0.58 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.13 1xmf h ASP 142 CO 0.10 0.00 -0.62 1.21 -1.72 0.00 0.00 179.24 178.22 1xmf n GLU 143 N -3.10 0.31 0.04 3.56 2.13 0.43 -4.43 120.64 119.58 1xmf n GLU 143 Ca 0.03 0.12 -0.19 0.00 0.66 0.00 0.00 57.16 57.78 1xmf n GLU 143 Cb 0.45 -1.05 -0.09 0.00 0.27 0.00 0.00 31.44 31.02 1xmf n GLU 143 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 1xmf h PHE 144 N -0.59 0.97 0.09 4.31 -1.00 -1.49 -2.17 116.94 117.06 1xmf h PHE 144 Ca -0.01 -0.52 -0.00 0.00 2.81 0.00 0.00 57.97 60.25 1xmf h PHE 144 Cb 0.60 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.05 1xmf h PHE 144 CO -0.25 1.35 -0.04 0.82 -1.61 0.00 0.00 178.31 178.58 1xmf h ILE 145 N 0.38 1.01 -0.59 -0.55 1.08 -1.05 0.24 117.51 118.03 1xmf h ILE 145 Ca -0.11 -1.43 -0.09 0.00 -0.39 0.00 0.00 64.86 62.84 1xmf h ILE 145 Cb 1.65 1.79 -0.02 0.00 -3.07 0.00 0.00 36.82 37.16 1xmf h ILE 145 CO 0.19 0.30 0.01 -1.13 -0.69 0.00 0.00 178.15 176.82 1xmf h ASN 146 N -0.89 1.00 0.00 1.72 -0.73 -1.60 -1.10 115.58 113.99 1xmf h ASN 146 Ca -0.01 -0.28 -0.01 0.00 1.87 0.00 0.00 56.30 57.87 1xmf h ASN 146 Cb 0.57 -0.27 -0.00 0.00 0.27 0.00 0.00 38.32 38.89 1xmf h ASN 146 CO 0.02 1.05 -0.69 -1.14 -0.37 0.00 0.00 177.43 176.30 1xmf n ARG 147 N -4.18 0.48 0.04 6.67 0.63 -0.82 -3.85 116.66 115.62 1xmf n ARG 147 Ca 0.03 0.43 -0.20 0.00 -0.92 0.00 0.00 57.85 57.19 1xmf n ARG 147 Cb 0.34 -1.61 -0.11 0.00 0.45 0.00 0.00 32.46 31.53 1xmf n ARG 147 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1xmf h TYR 148 N -1.00 0.92 -0.22 -0.14 -1.99 -1.42 -0.02 116.97 113.10 1xmf h TYR 148 Ca -0.01 -0.52 -0.15 0.00 2.00 0.00 0.00 58.73 60.05 1xmf h TYR 148 Cb 0.68 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 39.32 1xmf h TYR 148 CO -0.28 1.35 -0.44 2.35 -0.00 0.00 0.00 178.16 181.14 1xmf h TRP 149 N 0.23 0.87 -0.82 4.88 -0.00 -0.48 -2.83 115.95 117.80 1xmf h TRP 149 Ca -0.13 -0.31 0.07 0.00 -0.00 0.00 0.00 58.89 58.52 1xmf h TRP 149 Cb 1.63 -0.16 -0.06 0.00 -0.00 0.00 0.00 29.16 30.57 1xmf h TRP 149 CO 0.12 1.09 0.49 0.78 -0.00 0.00 0.00 178.44 180.92 1xmf h GLY 150 N 0.40 1.23 1.58 2.65 0.00 -1.23 -1.72 103.07 105.99 1xmf h GLY 150 Ca 0.01 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1xmf h GLY 150 CO 0.10 0.22 0.05 0.00 0.00 0.00 0.00 176.54 176.90 1xmf h ALA 151 N 1.40 1.43 -0.15 3.60 0.00 -0.91 -2.48 119.26 122.15 1xmf h ALA 151 Ca 0.36 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1xmf h ALA 151 Cb 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1xmf h ALA 151 CO -0.19 0.41 0.14 0.35 0.00 0.00 0.00 179.25 179.96 1xmf h PHE 152 N 0.52 0.00 -0.79 0.00 3.57 -1.05 -1.67 116.94 117.52 1xmf h PHE 152 Ca 0.12 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.72 1xmf h PHE 152 Cb 0.26 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 1xmf h PHE 152 CO 0.01 0.00 0.52 1.37 -2.23 0.00 0.00 178.31 177.98 1xmf h LEU 153 N 0.00 0.62 -1.52 0.59 8.10 -1.46 0.33 115.31 121.98 1xmf h LEU 153 Ca 0.07 0.02 -0.02 0.00 0.11 0.00 0.00 57.88 58.06 1xmf h LEU 153 Cb 0.35 -0.11 -0.00 0.00 -0.44 0.00 0.00 40.66 40.45 1xmf h LEU 153 CO -0.00 0.36 -0.08 -0.26 -4.11 0.00 0.00 178.44 174.35 1xmf h PHE 154 N 0.69 0.00 0.02 0.17 -1.00 -1.49 0.25 116.94 115.58 1xmf h PHE 154 Ca 0.37 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.15 1xmf h PHE 154 Cb 0.50 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.06 1xmf h PHE 154 CO -0.00 0.08 -0.01 -0.97 -1.61 0.00 0.00 178.31 175.80 1xmf h ASN 155 N 0.00 -0.02 -0.47 2.17 -0.73 -0.46 -1.13 115.58 114.94 1xmf h ASN 155 Ca -0.00 -0.60 -0.07 0.00 1.87 0.00 0.00 56.30 57.50 1xmf h ASN 155 Cb 0.53 0.01 -0.02 0.00 0.27 0.00 0.00 38.32 39.10 1xmf h ASN 155 CO 0.01 0.60 0.06 -0.33 -0.37 0.00 0.00 177.43 177.40 1xmf h GLU 156 N -0.66 0.85 -0.68 6.67 4.39 -1.10 -1.07 114.58 122.98 1xmf h GLU 156 Ca -0.00 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 1xmf h GLU 156 Cb 0.62 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 1xmf h GLU 156 CO 0.00 0.81 0.31 -0.92 -1.16 0.00 0.00 179.01 178.05 1xmf h TYR 157 N 0.80 1.00 -0.71 4.33 3.20 -0.52 -0.51 116.97 124.55 1xmf h TYR 157 Ca 0.16 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 1xmf h TYR 157 Cb 0.40 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 1xmf h TYR 157 CO 0.02 0.75 0.20 0.78 -1.64 0.00 0.00 178.16 178.28 1xmf h GLY 158 N 0.95 1.21 1.53 1.82 0.00 -0.64 -1.70 103.07 106.24 1xmf h GLY 158 Ca 0.23 -0.74 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 1xmf h GLY 158 CO -0.03 0.69 -0.13 1.41 0.00 0.00 0.00 176.54 178.49 1xmf h LEU 159 N 1.07 0.56 0.36 3.11 3.38 -0.80 -2.14 115.31 120.85 1xmf h LEU 159 Ca 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1xmf h LEU 159 Cb 0.34 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1xmf h LEU 159 CO -0.00 0.71 -0.24 0.15 0.09 0.00 0.00 178.44 179.15 1xmf h PHE 160 N 0.52 -0.64 -0.01 1.13 3.57 -0.66 -2.34 116.94 118.52 1xmf h PHE 160 Ca 0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1xmf h PHE 160 Cb 0.53 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 1xmf h PHE 160 CO 0.02 -0.37 0.03 -0.91 -2.23 0.00 0.00 178.31 174.85 1xmf h ASN 161 N -0.59 0.00 0.74 0.41 -0.26 -1.04 -0.86 115.58 113.97 1xmf h ASN 161 Ca -0.04 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1xmf h ASN 161 Cb 0.50 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.76 1xmf h ASN 161 CO 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.39 1xmf n ALA 162 N -2.14 1.65 0.78 -0.83 0.00 -0.83 -2.30 120.51 116.84 1xmf n ALA 162 Ca -0.03 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.63 1xmf n ALA 162 Cb 0.10 -1.40 0.30 0.00 0.00 0.00 0.00 19.45 18.45 1xmf n ALA 162 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1xmf n HIS 163 N -2.28 0.34 -0.14 0.00 8.25 -0.33 -4.38 115.22 116.68 1xmf n HIS 163 Ca 0.02 0.10 -0.05 0.00 -0.26 0.00 0.00 57.72 57.53 1xmf n HIS 163 Cb 0.23 -0.54 0.01 0.00 1.12 0.00 0.00 29.99 30.81 1xmf n HIS 163 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1xmf h SER 164 N 0.00 -0.77 -0.60 0.41 4.64 -1.61 -1.35 113.55 114.28 1xmf h SER 164 Ca 0.00 0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.47 1xmf h SER 164 Cb 0.63 0.41 -0.03 0.00 -0.31 0.00 0.00 62.40 63.10 1xmf h SER 164 CO 0.00 -0.25 0.31 -0.61 -0.87 0.00 0.00 176.83 175.41 1xmf h GLN 165 N -0.13 0.87 -0.31 4.77 4.15 -1.82 -2.21 115.11 120.43 1xmf h GLN 165 Ca 0.21 -0.10 -0.05 0.00 0.77 0.00 0.00 58.65 59.48 1xmf h GLN 165 Cb 0.46 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 1xmf h GLN 165 CO -0.53 0.67 -0.03 0.78 -1.93 0.00 0.00 178.83 177.78 1xmf h GLY 166 N 0.95 0.53 1.97 2.39 0.00 -1.53 0.25 103.07 107.63 1xmf h GLY 166 Ca 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 1xmf h GLY 166 CO -0.03 0.29 -0.09 0.00 0.00 0.00 0.00 176.54 176.71 1xmf h ALA 167 N 1.51 1.80 0.13 3.60 0.00 -0.73 0.27 119.26 125.84 1xmf h ALA 167 Ca 0.10 -0.10 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1xmf h ALA 167 Cb 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1xmf h ALA 167 CO 0.01 0.15 -1.85 -0.09 0.00 0.00 0.00 179.25 177.48 1xmf h ARG 168 N 0.03 0.27 0.00 0.00 9.65 -1.20 -3.42 114.38 119.71 1xmf h ARG 168 Ca 0.01 -0.46 -0.03 0.00 -1.10 0.00 0.00 59.98 58.40 1xmf h ARG 168 Cb 0.19 0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1xmf h ARG 168 CO 0.01 1.22 -1.29 0.39 2.80 0.00 0.00 179.97 183.10 1xmf n GLU 169 N -3.62 0.62 -1.43 0.20 -0.58 0.79 -4.99 120.64 111.64 1xmf n GLU 169 Ca -0.30 0.06 -0.53 0.00 -0.42 0.00 0.00 57.16 55.97 1xmf n GLU 169 Cb 1.01 -1.75 -0.05 0.00 -0.57 0.00 0.00 31.44 30.07 1xmf n GLU 169 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xmf n ALA 170 N -2.23 -3.24 0.58 0.62 0.00 0.07 -4.84 120.51 111.47 1xmf n ALA 170 Ca -0.03 0.51 0.05 0.00 0.00 0.00 0.00 53.44 53.98 1xmf n ALA 170 Cb 0.60 -1.66 0.17 0.00 0.00 0.00 0.00 19.45 18.56 1xmf n ALA 170 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xmf n LEU 171 N 1.72 2.41 -3.47 0.00 4.77 -1.26 -4.88 117.00 116.29 1xmf n LEU 171 Ca 0.19 -1.21 -0.10 0.00 -0.03 0.00 0.00 56.01 54.85 1xmf n LEU 171 Cb 0.16 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.86 1xmf n LEU 171 CO 0.58 0.46 0.55 -0.94 -1.33 0.00 0.00 177.39 176.71 1xmf s SER 172 N -0.77 -0.46 0.03 -1.43 1.04 -1.26 -4.88 113.70 105.97 1xmf s SER 172 Ca 0.25 -0.00 -0.25 0.00 0.48 0.00 0.00 55.95 56.43 1xmf s SER 172 Cb 0.15 0.49 -0.18 0.00 0.10 0.00 0.00 66.02 66.58 1xmf s SER 172 CO 0.13 -0.79 1.47 -2.24 0.98 0.00 0.00 173.24 172.79 1xmf h ASP 173 N 2.00 -0.08 -0.91 7.02 3.04 -1.89 -0.34 116.42 125.26 1xmf h ASP 173 Ca -0.28 -0.23 0.11 0.00 -3.24 0.00 0.00 57.03 53.39 1xmf h ASP 173 Cb 1.27 0.02 -0.07 0.00 -1.04 0.00 0.00 39.33 39.51 1xmf h ASP 173 CO 0.34 0.19 0.59 -0.37 -2.04 0.00 0.00 179.24 177.94 1xmf h VAL 174 N -0.34 0.95 0.01 4.15 -1.51 -1.89 0.10 116.25 117.71 1xmf h VAL 174 Ca -0.01 -0.30 -0.10 0.00 -1.23 0.00 0.00 66.70 65.05 1xmf h VAL 174 Cb 0.30 -0.02 0.01 0.00 -2.13 0.00 0.00 31.29 29.45 1xmf h VAL 174 CO 0.01 0.16 -0.41 0.71 -1.23 0.00 0.00 177.57 176.82 1xmf h THR 175 N 0.88 1.51 -0.53 7.19 1.35 -1.84 -2.78 112.91 118.69 1xmf h THR 175 Ca 0.43 -2.05 0.07 0.00 -0.55 0.00 0.00 66.41 64.31 1xmf h THR 175 Cb 0.46 2.76 -0.06 0.00 -1.73 0.00 0.00 68.15 69.58 1xmf h THR 175 CO -0.19 0.57 0.21 -0.09 -0.25 0.00 0.00 175.52 175.77 1xmf h ARG 176 N -0.37 0.40 -0.36 4.72 2.43 -0.54 0.11 114.38 120.77 1xmf h ARG 176 Ca -0.05 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1xmf h ARG 176 Cb 1.16 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 1xmf h ARG 176 CO 0.08 0.26 0.17 0.28 -1.51 0.00 0.00 179.97 179.25 1xmf h VAL 177 N 0.41 1.17 0.08 0.20 2.07 -0.89 -0.27 116.25 119.01 1xmf h VAL 177 Ca 0.26 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1xmf h VAL 177 Cb 0.26 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1xmf h VAL 177 CO -0.24 0.17 -0.04 0.28 0.02 0.00 0.00 177.57 177.77 1xmf h SER 178 N 0.44 -0.09 -0.51 0.57 0.02 -1.13 -1.72 113.55 111.12 1xmf h SER 178 Ca 0.12 -0.02 0.10 0.00 -0.84 0.00 0.00 61.79 61.15 1xmf h SER 178 Cb 0.12 0.02 -0.09 0.00 0.14 0.00 0.00 62.40 62.59 1xmf h SER 178 CO -0.02 -0.04 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.48 1xmf h LEU 179 N -0.14 -0.39 -0.69 5.07 3.38 -0.61 0.80 115.31 122.73 1xmf h LEU 179 Ca -0.01 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.15 1xmf h LEU 179 Cb 0.11 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1xmf h LEU 179 CO 0.02 -0.14 0.40 0.00 0.09 0.00 0.00 178.44 178.81 1xmf h ALA 180 N 1.50 0.92 0.00 1.53 0.00 -0.77 -1.48 119.26 120.95 1xmf h ALA 180 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 1xmf h ALA 180 Cb 0.39 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1xmf h ALA 180 CO -0.50 0.11 -0.61 0.74 0.00 0.00 0.00 179.25 178.99 1xmf h PHE 181 N 0.75 0.00 -0.01 0.00 0.05 -0.36 -0.55 116.94 116.83 1xmf h PHE 181 Ca 0.30 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 62.09 1xmf h PHE 181 Cb 0.14 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.09 1xmf h PHE 181 CO -0.06 0.61 0.00 -1.49 -0.18 0.00 0.00 178.31 177.19 1xmf h TRP 182 N 0.00 0.02 -0.61 -0.55 6.55 -0.24 -1.94 115.95 119.17 1xmf h TRP 182 Ca -0.01 -0.00 -0.08 0.00 0.95 0.00 0.00 58.89 59.75 1xmf h TRP 182 Cb 1.09 -0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 29.37 1xmf h TRP 182 CO 0.00 0.31 0.05 0.78 -1.05 0.00 0.00 178.44 178.53 1xmf h GLY 183 N -0.29 1.11 1.44 1.49 0.00 -1.23 -2.75 103.07 102.84 1xmf h GLY 183 Ca 0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 47.33 46.52 1xmf h GLY 183 CO 0.00 0.71 0.07 -2.75 0.00 0.00 0.00 176.54 174.57 1xmf h PHE 184 N 0.96 0.73 -0.22 5.60 3.57 -1.05 -1.52 116.94 125.00 1xmf h PHE 184 Ca 0.18 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.53 1xmf h PHE 184 Cb 0.49 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1xmf h PHE 184 CO 0.03 0.64 -0.21 -0.44 -2.23 0.00 0.00 178.31 176.11 1xmf h ASP 185 N 0.68 0.39 -0.33 0.41 5.19 -1.14 -1.57 116.42 120.05 1xmf h ASP 185 Ca 0.15 -0.12 -0.15 0.00 -0.62 0.00 0.00 57.03 56.30 1xmf h ASP 185 Cb 0.31 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 39.71 1xmf h ASP 185 CO 0.00 0.62 -0.36 0.11 -3.12 0.00 0.00 179.24 176.49 1xmf h LYS 186 N 0.36 0.83 -0.26 3.56 1.79 -1.02 -1.43 116.57 120.40 1xmf h LYS 186 Ca 0.06 -0.45 -0.08 0.00 -2.18 0.00 0.00 60.65 58.00 1xmf h LYS 186 Cb 0.58 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 1xmf h LYS 186 CO 0.04 1.09 -0.18 0.97 -1.08 0.00 0.00 179.45 180.29 1xmf h ILE 187 N 0.61 1.24 0.07 1.86 6.09 -1.25 -1.89 117.51 124.24 1xmf h ILE 187 Ca 0.05 -1.11 0.00 0.00 -1.37 0.00 0.00 64.86 62.43 1xmf h ILE 187 Cb 0.95 1.24 -0.00 0.00 0.47 0.00 0.00 36.82 39.48 1xmf h ILE 187 CO 0.09 0.35 -0.06 -0.78 -3.07 0.00 0.00 178.15 174.69 1xmf h ASP 188 N 0.42 -0.14 -0.53 2.19 1.82 -1.01 -0.69 116.42 118.46 1xmf h ASP 188 Ca 0.07 0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.76 1xmf h ASP 188 Cb 0.56 0.05 -0.04 0.00 0.68 0.00 0.00 39.33 40.57 1xmf h ASP 188 CO 0.04 -0.09 0.29 0.40 -1.61 0.00 0.00 179.24 178.27 1xmf h ILE 189 N -0.14 0.99 -0.76 2.25 1.08 -0.94 0.20 117.51 120.20 1xmf h ILE 189 Ca -0.00 -0.19 0.04 0.00 -0.39 0.00 0.00 64.86 64.31 1xmf h ILE 189 Cb 0.12 0.38 -0.05 0.00 -3.07 0.00 0.00 36.82 34.20 1xmf h ILE 189 CO -0.01 0.10 0.47 0.00 -0.69 0.00 0.00 178.15 178.03 1xmf h ALA 190 N 1.27 1.01 -0.03 1.87 0.00 -1.07 0.07 119.26 122.38 1xmf h ALA 190 Ca 0.23 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1xmf h ALA 190 Cb 0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1xmf h ALA 190 CO -0.14 0.25 -0.42 1.96 0.00 0.00 0.00 179.25 180.90 1xmf h GLN 191 N 0.91 0.06 -0.13 0.00 4.20 -0.12 -2.48 115.11 117.55 1xmf h GLN 191 Ca 0.31 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.85 1xmf h GLN 191 Cb 0.06 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1xmf h GLN 191 CO -0.13 0.48 -0.54 0.52 -0.67 0.00 0.00 178.83 178.48 1xmf h MET 192 N 0.05 0.38 -0.67 1.46 2.86 0.76 0.16 114.93 119.94 1xmf h MET 192 Ca 0.00 -0.23 -0.04 0.00 -2.06 0.00 0.00 59.70 57.37 1xmf h MET 192 Cb 0.77 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.42 1xmf h MET 192 CO 0.06 0.82 0.27 0.82 1.06 0.00 0.00 176.91 179.94 1xmf h ILE 193 N 0.29 1.24 -0.12 -1.22 2.04 -0.70 -1.28 117.51 117.76 1xmf h ILE 193 Ca 0.01 -0.75 -0.13 0.00 1.00 0.00 0.00 64.86 64.98 1xmf h ILE 193 Cb 1.05 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1xmf h ILE 193 CO 0.09 0.30 -0.49 -0.61 0.00 0.00 0.00 178.15 177.44 1xmf h GLN 194 N 0.95 0.31 -0.77 2.37 5.75 -1.09 -2.83 115.11 119.80 1xmf h GLN 194 Ca 0.22 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1xmf h GLN 194 Cb 0.21 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.73 1xmf h GLN 194 CO -0.02 0.74 0.38 1.25 -2.65 0.00 0.00 178.83 178.53 1xmf h LEU 195 N 0.25 0.98 -0.54 -2.39 5.85 0.02 -0.39 115.31 119.10 1xmf h LEU 195 Ca 0.01 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.51 1xmf h LEU 195 Cb 0.95 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1xmf h LEU 195 CO 0.08 0.82 -0.11 -0.08 -0.34 0.00 0.00 178.44 178.81 1xmf h GLU 196 N 1.09 1.03 -0.44 1.25 4.81 -1.07 -0.02 114.58 121.22 1xmf h GLU 196 Ca 0.27 -0.38 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 1xmf h GLU 196 Cb 0.09 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 1xmf h GLU 196 CO -0.04 1.07 -0.14 0.00 -0.73 0.00 0.00 179.01 179.17 1xmf h ARG 197 N 0.91 0.82 0.00 1.92 3.08 -1.23 -0.36 114.38 119.52 1xmf h ARG 197 Ca 0.14 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 59.82 1xmf h ARG 197 Cb 0.68 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1xmf h ARG 197 CO 0.05 0.91 -0.37 0.78 -1.07 0.00 0.00 179.97 180.27 1xmf h GLY 198 N 0.97 0.00 0.76 0.04 0.00 -0.87 -1.97 103.07 102.00 1xmf h GLY 198 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.32 1xmf h GLY 198 CO 0.05 0.00 -0.48 -2.75 0.00 0.00 0.00 176.54 173.35 1xmf h PHE 199 N 0.00 0.57 -0.76 5.60 3.57 -0.41 -3.17 116.94 122.34 1xmf h PHE 199 Ca -0.00 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.20 1xmf h PHE 199 Cb 0.86 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 1xmf h PHE 199 CO 0.00 1.07 0.39 -0.07 -2.23 0.00 0.00 178.31 177.47 1xmf h LEU 200 N -0.09 0.96 -2.35 0.59 3.38 -0.96 -1.53 115.31 115.31 1xmf h LEU 200 Ca -0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1xmf h LEU 200 Cb 1.16 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 1xmf h LEU 200 CO 0.10 0.79 -0.02 0.00 0.09 0.00 0.00 178.44 179.39 1xmf h ALA 201 N 1.36 1.50 0.04 1.53 0.00 -1.37 0.28 119.26 122.60 1xmf h ALA 201 Ca 0.27 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.87 1xmf h ALA 201 Cb 0.06 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1xmf h ALA 201 CO -0.04 0.03 -1.56 0.87 0.00 0.00 0.00 179.25 178.55 1xmf h LYS 202 N 0.00 0.08 -0.06 0.00 1.57 -1.26 -3.37 116.57 113.53 1xmf h LYS 202 Ca -0.00 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1xmf h LYS 202 Cb 0.06 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1xmf h LYS 202 CO 0.00 0.80 0.00 0.44 -0.57 0.00 0.00 179.45 180.13 1xmf n ILE 203 N -3.24 0.08 -3.70 1.86 -5.35 -1.00 -4.80 119.36 103.20 1xmf n ILE 203 Ca -0.15 -0.54 -0.30 0.00 -0.27 0.00 0.00 62.75 61.49 1xmf n ILE 203 Cb 1.03 1.30 -0.14 0.00 -1.74 0.00 0.00 39.64 40.09 1xmf n ILE 203 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xmf s VAL 204 N -1.44 0.90 0.16 7.28 1.01 0.94 -5.07 120.40 124.18 1xmf s VAL 204 Ca 0.22 -1.65 -0.34 0.00 0.00 0.00 0.00 61.98 60.21 1xmf s VAL 204 Cb 0.15 -1.67 -0.15 0.00 0.00 0.00 0.00 36.38 34.71 1xmf s VAL 204 CO 0.22 -0.75 1.37 -2.65 0.00 0.00 0.00 175.10 173.29 1xmf n PRO 205 N 4.52 1.59 -0.22 2.72 -0.02 -1.26 -1.70 135.00 140.63 1xmf n PRO 205 Ca 0.01 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1xmf n PRO 205 Cb 0.40 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1xmf n PRO 205 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xmf n GLY 206 N 2.52 0.99 3.65 -1.23 0.00 -1.26 -5.03 105.19 104.83 1xmf n GLY 206 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1xmf n GLY 206 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xmf s PHE 207 N -2.64 3.29 -0.30 1.61 5.36 -0.69 -5.01 117.98 119.60 1xmf s PHE 207 Ca 0.00 1.26 -0.21 0.00 -0.96 0.00 0.00 56.93 57.03 1xmf s PHE 207 Cb 0.00 -3.26 -0.01 0.00 -0.34 0.00 0.00 43.02 39.41 1xmf s PHE 207 CO 0.00 -0.51 0.66 0.34 -1.46 0.00 0.00 175.22 174.25 1xmf s ASP 208 N 1.35 6.54 0.00 6.13 -1.08 -1.26 -4.46 116.67 123.89 1xmf s ASP 208 Ca 0.40 0.51 0.31 0.00 -0.52 0.00 0.00 52.55 53.25 1xmf s ASP 208 Cb -0.15 -2.34 1.64 0.00 -1.46 0.00 0.00 42.92 40.61 1xmf s ASP 208 CO 0.08 -0.49 2.10 -1.84 0.52 0.00 0.00 175.17 175.55 1xmf n GLU 209 N 5.91 0.69 -1.69 4.34 0.28 -1.26 -4.87 120.64 124.04 1xmf n GLU 209 Ca -0.00 -0.04 -0.40 0.00 -0.16 0.00 0.00 57.16 56.56 1xmf n GLU 209 Cb 0.49 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.88 1xmf n GLU 209 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1xmf n SER 210 N -1.12 2.37 -0.13 -1.84 2.88 -1.26 -4.82 113.62 109.69 1xmf n SER 210 Ca 0.18 1.07 0.13 0.00 -1.33 0.00 0.00 58.87 58.92 1xmf n SER 210 Cb 0.20 -1.49 0.42 0.00 -0.75 0.00 0.00 64.21 62.59 1xmf n SER 210 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1xmf n THR 211 N -0.41 0.00 -0.26 2.46 -2.24 -1.26 -4.34 114.28 108.22 1xmf n THR 211 Ca 0.08 -0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.77 1xmf n THR 211 Cb 0.41 0.17 0.04 0.00 -2.10 0.00 0.00 70.33 68.84 1xmf n THR 211 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xmf h ALA 212 N 3.43 0.17 0.64 6.98 0.00 -1.97 0.26 119.26 128.78 1xmf h ALA 212 Ca 0.00 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1xmf h ALA 212 Cb 0.47 0.78 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1xmf h ALA 212 CO 0.00 -0.58 -0.31 0.28 0.00 0.00 0.00 179.25 178.64 1xmf h VAL 213 N -0.08 0.00 -0.72 0.00 2.07 -1.96 -0.13 116.25 115.44 1xmf h VAL 213 Ca 0.30 -0.07 0.12 0.00 0.82 0.00 0.00 66.70 67.87 1xmf h VAL 213 Cb 0.57 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 1xmf h VAL 213 CO -0.79 0.00 0.48 1.55 0.02 0.00 0.00 177.57 178.83 1xmf h PRO 214 N -0.93 0.48 -0.29 1.57 0.13 -1.70 -0.57 132.00 130.69 1xmf h PRO 214 Ca -0.09 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.97 1xmf h PRO 214 Cb 0.66 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 1xmf h PRO 214 CO 0.14 0.32 0.01 -0.22 -0.23 0.00 0.00 178.00 178.02 1xmf h LYS 215 N 0.50 0.51 -0.95 0.86 3.64 -0.41 -1.44 116.57 119.27 1xmf h LYS 215 Ca 0.34 -0.16 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1xmf h LYS 215 Cb 0.65 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.37 1xmf h LYS 215 CO -0.11 0.65 0.62 0.00 -2.27 0.00 0.00 179.45 178.34 1xmf h ALA 216 N 0.84 1.42 -0.62 5.00 0.00 0.34 0.21 119.26 126.46 1xmf h ALA 216 Ca 0.08 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1xmf h ALA 216 Cb 0.42 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1xmf h ALA 216 CO 0.01 0.47 0.21 1.49 0.00 0.00 0.00 179.25 181.43 1xmf h GLU 217 N 1.16 0.95 -0.14 0.00 4.57 -0.86 0.04 114.58 120.30 1xmf h GLU 217 Ca 0.39 -0.19 -0.05 0.00 -1.18 0.00 0.00 59.36 58.33 1xmf h GLU 217 Cb 0.08 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1xmf h GLU 217 CO -0.13 0.83 -0.10 2.35 -1.18 0.00 0.00 179.01 180.77 1xmf h TRP 218 N 0.87 0.36 -0.08 0.92 2.91 -0.13 0.20 115.95 121.01 1xmf h TRP 218 Ca 0.20 -0.10 -0.18 0.00 1.13 0.00 0.00 58.89 59.94 1xmf h TRP 218 Cb 0.26 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.83 1xmf h TRP 218 CO 0.02 0.68 -0.70 1.79 -1.03 0.00 0.00 178.44 179.19 1xmf h THR 219 N -0.06 1.38 0.00 2.65 1.35 -0.58 -3.38 112.91 114.28 1xmf h THR 219 Ca 0.03 -2.12 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 1xmf h THR 219 Cb 0.60 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1xmf h THR 219 CO 0.03 0.63 0.00 0.59 -0.25 0.00 0.00 175.52 176.52 1xmf n ASN 220 N -3.84 1.04 -4.29 5.36 4.13 -0.01 -5.05 115.26 112.60 1xmf n ASN 220 Ca -0.04 -1.39 -0.30 0.00 1.68 0.00 0.00 54.58 54.54 1xmf n ASN 220 Cb 0.69 0.00 0.17 0.00 -1.54 0.00 0.00 39.78 39.10 1xmf n ASN 220 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1xmf s GLY 221 N -0.39 1.72 -0.20 7.41 0.00 0.69 -4.98 107.32 111.57 1xmf s GLY 221 Ca 0.00 -1.04 0.09 0.00 0.00 0.00 0.00 44.72 43.77 1xmf s GLY 221 CO 0.00 -0.33 -0.07 1.18 0.00 0.00 0.00 173.10 173.88 1xmf n GLU 222 N -3.75 0.83 -0.27 2.90 -0.58 -1.26 -3.82 120.64 114.69 1xmf n GLU 222 Ca 0.13 0.06 0.03 0.00 -0.42 0.00 0.00 57.16 56.97 1xmf n GLU 222 Cb 0.60 -1.45 0.17 0.00 -0.57 0.00 0.00 31.44 30.18 1xmf n GLU 222 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1xmf h VAL 223 N 0.00 0.86 -0.40 2.62 2.07 -1.90 -2.84 116.25 116.67 1xmf h VAL 223 Ca -0.49 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1xmf h VAL 223 Cb 1.93 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1xmf h VAL 223 CO -0.03 0.13 0.00 -1.22 0.02 0.00 0.00 177.57 176.47 1xmf n TYR 224 N -4.81 0.53 0.09 1.57 4.02 -1.26 -2.70 117.16 114.60 1xmf n TYR 224 Ca 0.13 -0.47 -0.13 0.00 -0.01 0.00 0.00 57.90 57.42 1xmf n TYR 224 Cb 0.30 -0.02 -0.08 0.00 -0.02 0.00 0.00 39.34 39.52 1xmf n TYR 224 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1xmf h LYS 225 N 2.47 -0.59 -0.06 -0.72 3.64 -1.60 0.15 116.57 119.86 1xmf h LYS 225 Ca 0.00 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1xmf h LYS 225 Cb 0.77 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1xmf h LYS 225 CO 0.00 -0.39 -0.03 0.77 -2.27 0.00 0.00 179.45 177.53 1xmf h SER 226 N -0.61 0.08 0.02 4.20 0.02 -1.86 -0.65 113.55 114.76 1xmf h SER 226 Ca -0.01 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1xmf h SER 226 Cb 0.61 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1xmf h SER 226 CO -0.23 0.13 -0.01 0.00 -1.14 0.00 0.00 176.83 175.58 1xmf h ALA 227 N 1.89 -0.03 -0.96 3.77 0.00 -1.61 -1.32 119.26 121.00 1xmf h ALA 227 Ca 0.02 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xmf h ALA 227 Cb 0.11 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1xmf h ALA 227 CO 0.00 -0.42 0.63 -0.09 0.00 0.00 0.00 179.25 179.37 1xmf h ARG 228 N -0.22 1.26 -0.93 0.00 2.43 -0.04 -0.23 114.38 116.65 1xmf h ARG 228 Ca -0.00 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1xmf h ARG 228 Cb 0.21 -0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 29.43 1xmf h ARG 228 CO 0.01 0.84 0.56 -0.07 -1.51 0.00 0.00 179.97 179.79 1xmf h LEU 229 N 1.30 1.12 -0.15 3.80 3.38 -0.87 0.14 115.31 124.03 1xmf h LEU 229 Ca 0.35 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.20 1xmf h LEU 229 Cb -0.14 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.32 1xmf h LEU 229 CO -0.07 0.86 -0.10 0.00 0.09 0.00 0.00 178.44 179.21 1xmf h ALA 230 N 1.33 0.22 -0.19 1.53 0.00 -0.52 -2.61 119.26 119.02 1xmf h ALA 230 Ca 0.33 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1xmf h ALA 230 Cb -0.05 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1xmf h ALA 230 CO -0.06 0.05 -0.08 0.28 0.00 0.00 0.00 179.25 179.44 1xmf h VAL 231 N -0.01 0.72 -0.90 0.00 2.07 -0.73 0.09 116.25 117.49 1xmf h VAL 231 Ca 0.03 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.66 1xmf h VAL 231 Cb 0.60 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1xmf h VAL 231 CO 0.03 0.00 0.58 -0.33 0.02 0.00 0.00 177.57 177.87 1xmf h GLU 232 N -0.06 0.84 0.07 1.57 5.08 -0.72 -1.46 114.58 119.90 1xmf h GLU 232 Ca 0.10 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1xmf h GLU 232 Cb 0.21 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1xmf h GLU 232 CO -0.23 0.56 -0.03 0.78 -1.00 0.00 0.00 179.01 179.09 1xmf h GLY 233 N 0.87 -0.09 0.45 -3.84 0.00 -0.92 -0.82 103.07 98.72 1xmf h GLY 233 Ca 0.43 0.03 0.14 0.00 0.00 0.00 0.00 47.33 47.93 1xmf h GLY 233 CO -0.19 -0.03 0.60 1.41 0.00 0.00 0.00 176.54 178.33 1xmf h LEU 234 N -0.68 0.75 0.02 3.11 3.38 -0.80 0.39 115.31 121.48 1xmf h LEU 234 Ca -0.01 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xmf h LEU 234 Cb 0.57 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1xmf h LEU 234 CO 0.01 0.37 -0.01 -0.25 0.09 0.00 0.00 178.44 178.66 1xmf h TRP 235 N 0.79 -0.02 -0.00 1.13 7.01 -1.31 -3.38 115.95 120.17 1xmf h TRP 235 Ca 0.48 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.48 1xmf h TRP 235 Cb 0.68 0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.75 1xmf h TRP 235 CO -0.00 0.52 -0.80 1.04 -2.79 0.00 0.00 178.44 176.41 1xmf n GLN 236 N -4.71 0.85 0.00 2.65 1.13 -0.31 -4.43 117.38 112.55 1xmf n GLN 236 Ca -0.06 -0.19 0.08 0.00 -1.94 0.00 0.00 57.00 54.90 1xmf n GLN 236 Cb 0.27 -1.40 0.05 0.00 0.11 0.00 0.00 30.24 29.28 1xmf n GLN 236 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1xmf n GLU 237 N -1.17 1.36 -3.93 -1.09 1.02 0.14 -4.90 120.64 112.06 1xmf n GLU 237 Ca 0.05 -1.34 -0.35 0.00 -0.02 0.00 0.00 57.16 55.50 1xmf n GLU 237 Cb 0.32 -1.30 -0.14 0.00 -0.02 0.00 0.00 31.44 30.30 1xmf n GLU 237 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1xmf s VAL 238 N -1.46 3.38 -2.12 2.62 1.01 -1.15 -4.96 120.40 117.72 1xmf s VAL 238 Ca 0.18 -0.49 0.19 0.00 0.00 0.00 0.00 61.98 61.86 1xmf s VAL 238 Cb 0.13 -2.53 0.08 0.00 0.00 0.00 0.00 36.38 34.06 1xmf s VAL 238 CO 0.24 0.43 1.05 0.49 0.00 0.00 0.00 175.10 177.30 1xmf n PHE 239 N 4.75 0.00 -3.21 5.22 3.01 -1.26 -4.86 117.46 121.12 1xmf n PHE 239 Ca -0.18 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 57.84 1xmf n PHE 239 Cb 0.51 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.91 1xmf n PHE 239 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1xmf s ASP 240 N -1.89 6.22 0.56 4.37 3.68 -1.26 -4.94 116.67 123.42 1xmf s ASP 240 Ca 0.20 -0.81 0.31 0.00 2.13 0.00 0.00 52.55 54.37 1xmf s ASP 240 Cb 0.16 -2.27 1.46 0.00 -1.45 0.00 0.00 42.92 40.82 1xmf s ASP 240 CO 0.36 -0.79 1.86 4.11 0.13 0.00 0.00 175.17 180.84 1xmf h TRP 241 N 8.90 0.00 0.16 -5.34 5.08 -1.90 -0.54 115.95 122.31 1xmf h TRP 241 Ca -0.27 0.00 -0.33 0.00 1.08 0.00 0.00 58.89 59.37 1xmf h TRP 241 Cb 1.10 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 27.26 1xmf h TRP 241 CO 0.71 0.00 -1.60 -0.91 -1.28 0.00 0.00 178.44 175.36 1xmf h ASN 242 N 0.00 0.53 -0.66 0.11 2.35 -1.93 -2.79 115.58 113.20 1xmf h ASN 242 Ca 0.36 -0.72 -0.03 0.00 -0.55 0.00 0.00 56.30 55.36 1xmf h ASN 242 Cb 1.61 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 39.78 1xmf h ASN 242 CO -0.00 1.60 0.29 -0.08 -1.65 0.00 0.00 177.43 177.58 1xmf h GLU 243 N 0.09 0.97 0.75 0.81 4.81 -1.55 0.17 114.58 120.63 1xmf h GLU 243 Ca -0.28 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 58.75 1xmf h GLU 243 Cb 2.06 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 31.29 1xmf h GLU 243 CO 0.18 0.79 -0.36 1.03 -0.73 0.00 0.00 179.01 179.93 1xmf h SER 244 N 0.92 -0.86 -0.48 1.04 0.87 -1.34 0.16 113.55 113.87 1xmf h SER 244 Ca 0.22 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.84 1xmf h SER 244 Cb 0.17 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 1xmf h SER 244 CO -0.02 -0.60 0.27 0.00 -0.53 0.00 0.00 176.83 175.94 1xmf h ALA 245 N -0.78 0.61 -0.03 6.23 0.00 -1.35 -0.22 119.26 123.72 1xmf h ALA 245 Ca -0.10 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xmf h ALA 245 Cb 0.78 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xmf h ALA 245 CO 0.17 -0.06 0.00 0.35 0.00 0.00 0.00 179.25 179.72 1xmf h PHE 246 N 0.53 0.05 -0.15 0.00 3.57 -0.65 -1.91 116.94 118.38 1xmf h PHE 246 Ca 0.20 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 1xmf h PHE 246 Cb 0.05 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 1xmf h PHE 246 CO -0.08 0.29 -0.20 0.77 -2.23 0.00 0.00 178.31 176.86 1xmf h SER 247 N -0.21 0.25 0.12 0.41 0.02 -0.54 0.42 113.55 114.03 1xmf h SER 247 Ca 0.01 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1xmf h SER 247 Cb 0.27 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1xmf h SER 247 CO 0.00 0.47 -0.06 0.58 -1.14 0.00 0.00 176.83 176.69 1xmf h VAL 248 N 0.24 1.04 0.03 2.27 2.07 -1.00 -1.22 116.25 119.68 1xmf h VAL 248 Ca 0.04 -1.14 -0.27 0.00 0.82 0.00 0.00 66.70 66.15 1xmf h VAL 248 Cb 0.50 1.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1xmf h VAL 248 CO 0.03 0.25 -1.47 0.45 0.02 0.00 0.00 177.57 176.86 1xmf h HIS 249 N -0.75 0.10 -0.31 1.57 3.86 -1.30 0.77 115.15 119.09 1xmf h HIS 249 Ca -0.02 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.12 1xmf h HIS 249 Cb 0.54 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1xmf h HIS 249 CO 0.09 1.10 0.00 0.00 0.86 0.00 0.00 177.93 179.98 1xmf n ALA 250 N -2.53 2.44 -0.45 2.45 0.00 0.15 -3.84 120.51 118.72 1xmf n ALA 250 Ca -0.12 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1xmf n ALA 250 Cb 1.02 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1xmf n ALA 250 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xmf n VAL 251 N 1.32 0.00 0.32 0.00 0.31 -1.15 -4.82 118.33 114.30 1xmf n VAL 251 Ca 0.18 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.34 1xmf n VAL 251 Cb 0.57 -0.06 -0.09 0.00 -0.91 0.00 0.00 33.84 33.36 1xmf n VAL 251 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1xmf h TYR 252 N 0.00 -0.72 0.00 3.52 5.03 -1.29 -2.18 116.97 121.34 1xmf h TYR 252 Ca 0.00 -0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.25 1xmf h TYR 252 Cb 0.00 0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.51 1xmf h TYR 252 CO 0.00 -0.43 -0.19 0.22 -1.32 0.00 0.00 178.16 176.44 1xmf h ASP 253 N -0.82 0.00 1.23 -2.11 3.58 -1.07 0.14 116.42 117.37 1xmf h ASP 253 Ca -0.08 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.30 1xmf h ASP 253 Cb 0.61 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.65 1xmf h ASP 253 CO 0.13 0.19 -0.32 0.00 -2.88 0.00 0.00 179.24 176.36 1xmf h ALA 254 N 1.81 0.88 -1.22 -0.78 0.00 -1.65 -1.61 119.26 116.69 1xmf h ALA 254 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xmf h ALA 254 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1xmf h ALA 254 CO 0.03 0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.96 1xmf n LEU 255 N -3.31 0.00 0.20 0.00 4.77 -0.82 -4.33 117.00 113.51 1xmf n LEU 255 Ca 0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 1xmf n LEU 255 Cb 0.56 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 1xmf n LEU 255 CO 0.36 -0.30 0.66 0.15 -1.33 0.00 0.00 177.39 176.94 1xmf h PHE 256 N 0.00 -0.81 -0.24 -1.77 3.57 -0.95 -1.46 116.94 115.28 1xmf h PHE 256 Ca 0.00 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.54 1xmf h PHE 256 Cb 0.00 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 1xmf h PHE 256 CO 0.00 -0.44 0.00 0.78 -2.23 0.00 0.00 178.31 176.43 1xmf h GLY 257 N -0.64 0.23 1.46 2.40 0.00 -1.49 -0.76 103.07 104.28 1xmf h GLY 257 Ca -0.02 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1xmf h GLY 257 CO -0.05 -0.04 0.22 1.46 0.00 0.00 0.00 176.54 178.13 1xmf h GLN 258 N 0.08 0.70 0.30 4.80 1.08 -1.24 -0.57 115.11 120.26 1xmf h GLN 258 Ca 0.11 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1xmf h GLN 258 Cb 0.14 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1xmf h GLN 258 CO -0.18 0.56 -0.14 0.35 -0.95 0.00 0.00 178.83 178.46 1xmf h PHE 259 N 0.70 -0.37 0.21 2.96 3.57 -0.52 -1.20 116.94 122.28 1xmf h PHE 259 Ca 0.17 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1xmf h PHE 259 Cb 0.10 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1xmf h PHE 259 CO 0.01 -0.03 -0.26 0.28 -2.23 0.00 0.00 178.31 176.08 1xmf h VAL 260 N -0.79 0.45 0.45 1.41 2.07 -1.04 0.26 116.25 119.06 1xmf h VAL 260 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1xmf h VAL 260 Cb 0.51 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1xmf h VAL 260 CO 0.07 0.00 -0.21 0.03 0.02 0.00 0.00 177.57 177.47 1xmf h ARG 261 N -0.52 -0.58 0.07 1.57 3.08 -1.19 -2.58 114.38 114.23 1xmf h ARG 261 Ca 0.00 0.04 -0.23 0.00 0.07 0.00 0.00 59.98 59.87 1xmf h ARG 261 Cb 0.50 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 1xmf h ARG 261 CO -0.08 -0.33 -1.19 -0.09 -1.07 0.00 0.00 179.97 177.21 1xmf h ARG 262 N -0.72 0.14 -0.00 0.04 2.43 -1.25 -1.32 114.38 113.70 1xmf h ARG 262 Ca -0.06 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1xmf h ARG 262 Cb 0.52 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1xmf h ARG 262 CO 0.10 1.11 -0.14 0.39 -1.51 0.00 0.00 179.97 179.93 1xmf n GLU 263 N -4.15 0.46 0.00 0.20 -0.58 0.85 -2.37 120.64 115.05 1xmf n GLU 263 Ca -0.25 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.34 1xmf n GLU 263 Cb 0.78 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 1xmf n GLU 263 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1xmf n PHE 264 N -1.14 0.00 -0.10 -0.32 7.35 -0.81 -4.65 117.46 117.79 1xmf n PHE 264 Ca 0.12 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.70 1xmf n PHE 264 Cb 0.29 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.09 1xmf n PHE 264 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1xmf h PHE 265 N 0.00 0.57 -0.58 -5.13 -1.00 -1.58 0.11 116.94 109.32 1xmf h PHE 265 Ca 0.00 -0.09 -0.03 0.00 2.81 0.00 0.00 57.97 60.66 1xmf h PHE 265 Cb 0.00 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.38 1xmf h PHE 265 CO 0.00 0.64 0.23 0.37 -1.61 0.00 0.00 178.31 177.94 1xmf h GLN 266 N 0.34 0.87 -0.11 1.51 5.75 -1.35 0.07 115.11 122.18 1xmf h GLN 266 Ca 0.09 -0.16 -0.17 0.00 -0.15 0.00 0.00 58.65 58.26 1xmf h GLN 266 Cb 0.40 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 1xmf h GLN 266 CO 0.01 0.75 -0.66 -0.09 -2.65 0.00 0.00 178.83 176.19 1xmf h ARG 267 N 0.80 0.43 0.00 1.69 2.43 -1.39 -3.37 114.38 114.96 1xmf h ARG 267 Ca 0.19 -0.32 -0.33 0.00 -0.81 0.00 0.00 59.98 58.71 1xmf h ARG 267 Cb 0.20 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 1xmf h ARG 267 CO -0.02 0.94 -2.30 1.28 -1.51 0.00 0.00 179.97 178.37 1xmf n LEU 268 N -3.88 0.08 -0.22 3.80 4.77 0.36 -4.53 117.00 117.38 1xmf n LEU 268 Ca -0.04 0.04 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1xmf n LEU 268 Cb 0.66 0.43 0.06 0.00 -2.33 0.00 0.00 43.42 42.25 1xmf n LEU 268 CO 0.47 0.45 0.72 0.00 -1.33 0.00 0.00 177.39 177.70 1xmf h ALA 269 N 1.08 0.36 -1.00 -1.18 0.00 -1.14 0.18 119.26 117.56 1xmf h ALA 269 Ca -0.48 0.24 0.16 0.00 0.00 0.00 0.00 54.91 54.82 1xmf h ALA 269 Cb 2.13 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 20.37 1xmf h ALA 269 CO 0.03 -0.46 0.62 -1.35 0.00 0.00 0.00 179.25 178.09 1xmf h PRO 270 N -0.03 0.84 0.00 0.00 0.11 -1.75 0.67 132.00 131.84 1xmf h PRO 270 Ca 0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1xmf h PRO 270 Cb 0.50 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1xmf h PRO 270 CO -0.68 0.56 0.00 0.00 -0.21 0.00 0.00 178.00 177.67 1xmf h ARG 271 N 0.87 0.00 -0.30 1.05 3.08 -1.20 -0.97 114.38 116.91 1xmf h ARG 271 Ca 0.54 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.49 1xmf h ARG 271 Cb 0.71 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.70 1xmf h ARG 271 CO -0.32 0.00 -0.03 1.19 -1.07 0.00 0.00 179.97 179.74 1xmf n PHE 272 N -2.56 0.98 -2.39 3.04 3.01 0.16 -4.94 117.46 114.75 1xmf n PHE 272 Ca -0.02 -1.26 -0.18 0.00 1.01 0.00 0.00 57.45 57.01 1xmf n PHE 272 Cb 0.08 -0.40 -0.00 0.00 -0.01 0.00 0.00 39.48 39.14 1xmf n PHE 272 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xmf n GLY 273 N -0.89 -0.35 3.21 1.37 0.00 -0.37 -0.96 105.19 107.20 1xmf n GLY 273 Ca 0.27 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1xmf n GLY 273 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xmf s ASP 274 N -2.27 5.31 0.00 1.61 2.15 -0.78 -3.77 116.67 118.93 1xmf s ASP 274 Ca 0.03 -1.54 0.11 0.00 0.43 0.00 0.00 52.55 51.58 1xmf s ASP 274 Cb -0.01 -1.86 0.08 0.00 -0.30 0.00 0.00 42.92 40.83 1xmf s ASP 274 CO 0.03 -0.44 0.84 0.59 -0.17 0.00 0.00 175.17 176.02 1xmf n ASN 275 N 4.74 1.89 0.12 -0.34 3.02 -1.26 -3.19 115.26 120.23 1xmf n ASN 275 Ca -0.09 -1.44 -0.09 0.00 -0.03 0.00 0.00 54.58 52.93 1xmf n ASN 275 Cb 0.43 0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.58 1xmf n ASN 275 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1xmf h LEU 276 N 2.13 -0.33 -0.71 3.41 5.85 -1.97 -3.22 115.31 120.47 1xmf h LEU 276 Ca 0.00 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.67 1xmf h LEU 276 Cb 0.46 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.51 1xmf h LEU 276 CO 0.00 0.16 0.39 0.74 -0.34 0.00 0.00 178.44 179.39 1xmf h THR 277 N -1.03 0.94 -0.03 1.05 2.02 -1.99 -1.04 112.91 112.82 1xmf h THR 277 Ca -0.04 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 66.91 1xmf h THR 277 Cb 0.43 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1xmf h THR 277 CO 0.06 0.13 0.05 -0.65 0.37 0.00 0.00 175.52 175.48 1xmf h PRO 278 N 0.70 0.00 -0.54 6.66 0.11 -1.79 -1.04 132.00 136.10 1xmf h PRO 278 Ca 0.33 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.36 1xmf h PRO 278 Cb 0.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 1xmf h PRO 278 CO -0.21 0.00 0.04 0.35 -0.21 0.00 0.00 178.00 177.97 1xmf h PHE 279 N 0.00 0.99 0.05 0.65 3.57 -1.19 -1.39 116.94 119.62 1xmf h PHE 279 Ca 0.02 -0.16 -0.23 0.00 3.53 0.00 0.00 57.97 61.13 1xmf h PHE 279 Cb 0.11 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1xmf h PHE 279 CO 0.00 0.90 -1.05 0.74 -2.23 0.00 0.00 178.31 176.67 1xmf h PHE 280 N 0.80 0.39 0.00 0.41 -1.00 -1.26 -3.14 116.94 113.13 1xmf h PHE 280 Ca 0.16 -0.25 -0.06 0.00 2.81 0.00 0.00 57.97 60.63 1xmf h PHE 280 Cb 0.47 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 1xmf h PHE 280 CO 0.03 1.13 -0.28 0.82 -1.61 0.00 0.00 178.31 178.40 1xmf h ILE 281 N 0.10 1.01 -0.64 -0.55 2.04 -1.20 -1.09 117.51 117.19 1xmf h ILE 281 Ca -0.08 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 64.78 1xmf h ILE 281 Cb 1.74 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 39.36 1xmf h ILE 281 CO 0.17 0.27 0.42 0.78 0.00 0.00 0.00 178.15 179.79 1xmf h ASN 282 N 0.00 0.68 0.20 1.72 2.35 -1.20 0.19 115.58 119.53 1xmf h ASN 282 Ca -0.00 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1xmf h ASN 282 Cb 0.56 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1xmf h ASN 282 CO 0.04 0.48 -0.10 1.56 -1.65 0.00 0.00 177.43 177.76 1xmf h GLN 283 N 0.80 -0.27 -0.99 0.81 4.20 -1.29 -1.57 115.11 116.81 1xmf h GLN 283 Ca 0.25 0.02 0.17 0.00 0.06 0.00 0.00 58.65 59.14 1xmf h GLN 283 Cb 0.01 0.06 -0.10 0.00 0.30 0.00 0.00 27.48 27.75 1xmf h GLN 283 CO -0.06 0.12 0.62 0.00 -0.67 0.00 0.00 178.83 178.84 1xmf h ALA 284 N -0.35 1.68 -0.15 3.87 0.00 -1.02 0.40 119.26 123.70 1xmf h ALA 284 Ca -0.03 0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1xmf h ALA 284 Cb 0.51 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1xmf h ALA 284 CO 0.05 -0.01 -0.60 1.96 0.00 0.00 0.00 179.25 180.65 1xmf h GLN 285 N 0.80 0.51 -0.36 0.00 1.08 -0.65 0.14 115.11 116.63 1xmf h GLN 285 Ca 0.54 -0.34 -0.04 0.00 -1.45 0.00 0.00 58.65 57.36 1xmf h GLN 285 Cb 0.80 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.26 1xmf h GLN 285 CO -0.33 0.96 0.08 1.15 -0.95 0.00 0.00 178.83 179.73 1xmf h THR 286 N 0.38 1.23 -0.59 -0.54 2.02 0.15 -1.45 112.91 114.11 1xmf h THR 286 Ca -0.00 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.36 1xmf h THR 286 Cb 1.15 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 1xmf h THR 286 CO 0.11 0.27 0.30 1.88 0.37 0.00 0.00 175.52 178.44 1xmf h TYR 287 N 0.43 0.84 -0.58 3.16 0.99 -0.13 -1.09 116.97 120.59 1xmf h TYR 287 Ca 0.11 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.81 1xmf h TYR 287 Cb 0.33 -0.26 -0.03 0.00 1.00 0.00 0.00 36.73 37.77 1xmf h TYR 287 CO 0.02 0.63 0.36 0.35 -0.00 0.00 0.00 178.16 179.52 1xmf h PHE 288 N 0.80 0.76 0.00 4.88 3.57 -0.53 -0.35 116.94 126.07 1xmf h PHE 288 Ca 0.20 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 1xmf h PHE 288 Cb 0.10 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1xmf h PHE 288 CO -0.00 0.51 -0.38 1.96 -2.23 0.00 0.00 178.31 178.17 1xmf h GLN 289 N 0.78 0.00 -0.04 1.11 1.08 -1.00 -0.42 115.11 116.61 1xmf h GLN 289 Ca 0.21 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.21 1xmf h GLN 289 Cb -0.03 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1xmf h GLN 289 CO -0.04 0.38 -0.76 0.82 -0.95 0.00 0.00 178.83 178.28 1xmf h ILE 290 N 0.00 1.34 -0.15 2.54 2.04 -0.69 -3.15 117.51 119.45 1xmf h ILE 290 Ca -0.00 -2.07 -0.13 0.00 1.00 0.00 0.00 64.86 63.66 1xmf h ILE 290 Cb 0.78 2.35 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1xmf h ILE 290 CO 0.05 0.63 -0.47 0.00 0.00 0.00 0.00 178.15 178.36 1xmf h ALA 291 N 0.41 0.93 -0.73 1.87 0.00 -0.92 -3.10 119.26 117.73 1xmf h ALA 291 Ca -0.08 -0.46 0.07 0.00 0.00 0.00 0.00 54.91 54.43 1xmf h ALA 291 Cb 1.43 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 1xmf h ALA 291 CO 0.15 0.65 0.41 -0.22 0.00 0.00 0.00 179.25 180.24 1xmf h LYS 292 N 0.30 0.72 -0.95 0.00 3.64 -1.07 0.19 116.57 119.40 1xmf h LYS 292 Ca 0.02 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1xmf h LYS 292 Cb 0.94 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.55 1xmf h LYS 292 CO 0.08 0.47 0.57 1.96 -2.27 0.00 0.00 179.45 180.26 1xmf h GLN 293 N 0.74 1.29 -0.22 1.90 4.20 -1.50 0.17 115.11 121.69 1xmf h GLN 293 Ca 0.33 -0.12 -0.15 0.00 0.06 0.00 0.00 58.65 58.78 1xmf h GLN 293 Cb 0.23 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1xmf h GLN 293 CO -0.20 0.90 -0.43 0.78 -0.67 0.00 0.00 178.83 179.21 1xmf h GLY 294 N 1.31 0.74 1.00 3.46 0.00 -1.34 -2.26 103.07 105.97 1xmf h GLY 294 Ca 0.34 -0.88 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1xmf h GLY 294 CO -0.06 0.79 0.32 -2.08 0.00 0.00 0.00 176.54 175.51 1xmf h VAL 295 N 0.38 1.14 -0.50 4.60 2.07 -0.25 -1.72 116.25 121.97 1xmf h VAL 295 Ca 0.01 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1xmf h VAL 295 Cb 1.03 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1xmf h VAL 295 CO 0.10 0.14 0.21 1.56 0.02 0.00 0.00 177.57 179.60 1xmf h GLN 296 N 0.68 0.74 -0.71 1.57 4.20 -0.66 -1.54 115.11 119.39 1xmf h GLN 296 Ca 0.18 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1xmf h GLN 296 Cb -0.05 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 1xmf h GLN 296 CO -0.04 0.65 0.40 0.22 -0.67 0.00 0.00 178.83 179.38 1xmf h ASP 297 N 0.67 0.88 0.15 1.46 1.82 -1.07 0.52 116.42 120.85 1xmf h ASP 297 Ca 0.17 -0.09 -0.01 0.00 -0.39 0.00 0.00 57.03 56.71 1xmf h ASP 297 Cb 0.17 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 39.96 1xmf h ASP 297 CO -0.02 0.72 -0.07 0.25 -1.61 0.00 0.00 179.24 178.51 1xmf h LEU 298 N 0.98 -0.17 0.00 2.28 5.85 -1.19 0.11 115.31 123.17 1xmf h LEU 298 Ca 0.25 -0.38 -0.09 0.00 0.84 0.00 0.00 57.88 58.51 1xmf h LEU 298 Cb 0.03 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1xmf h LEU 298 CO -0.04 0.38 -0.48 1.88 -0.34 0.00 0.00 178.44 179.84 1xmf h TYR 299 N -0.81 0.00 0.00 1.25 -1.99 -1.32 -0.80 116.97 113.30 1xmf h TYR 299 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1xmf h TYR 299 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 1xmf h TYR 299 CO 0.09 0.40 -0.47 0.66 -0.00 0.00 0.00 178.16 178.84 1xmf n TYR 300 N -3.17 0.00 -0.20 4.88 0.53 0.13 0.08 117.16 119.41 1xmf n TYR 300 Ca 0.02 0.00 -0.04 0.00 -1.02 0.00 0.00 57.90 56.86 1xmf n TYR 300 Cb 0.70 -0.23 0.06 0.00 -1.03 0.00 0.00 39.34 38.84 1xmf n TYR 300 CO 0.00 0.00 0.00 -0.97 -1.02 0.00 0.00 176.86 174.87 1xmf h ASN 301 N -0.47 0.54 0.00 7.72 -0.00 -1.31 0.14 115.58 122.20 1xmf h ASN 301 Ca 0.00 0.01 -0.13 0.00 -0.00 0.00 0.00 56.30 56.18 1xmf h ASN 301 Cb 0.47 -0.10 -0.02 0.00 -0.00 0.00 0.00 38.32 38.66 1xmf h ASN 301 CO 0.00 0.37 -0.91 0.00 -0.00 0.00 0.00 177.43 176.90 1xmf h LEU 303 N -1.00 0.00 -2.42 0.00 3.38 -1.27 -2.93 115.31 111.07 1xmf h LEU 303 Ca -0.20 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.20 1xmf h LEU 303 Cb 0.97 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 1xmf h LEU 303 CO -0.12 1.33 -0.02 1.23 0.09 0.00 0.00 178.44 180.95 1xmf h GLY 304 N -1.00 0.00 -0.75 0.83 0.00 0.00 -1.96 103.07 100.19 1xmf h GLY 304 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1xmf h GLY 304 CO -0.15 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.61 1xmf n ASP 305 N -3.77 3.03 -4.68 0.19 10.43 0.45 -4.61 116.55 117.59 1xmf n ASP 305 Ca -0.03 -2.97 -0.45 0.00 2.57 0.00 0.00 54.79 53.92 1xmf n ASP 305 Cb 0.11 -0.45 -0.04 0.00 1.84 0.00 0.00 41.12 42.58 1xmf n ASP 305 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1xmf n ASP 306 N -0.91 3.17 -0.16 -2.24 -0.08 -0.73 -4.81 116.55 110.79 1xmf n ASP 306 Ca 0.17 1.10 0.24 0.00 -1.51 0.00 0.00 54.79 54.79 1xmf n ASP 306 Cb 0.72 -1.45 0.66 0.00 2.34 0.00 0.00 41.12 43.39 1xmf n ASP 306 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xmf h PRO 307 N 5.57 0.11 0.00 -0.67 0.11 -1.91 -0.03 132.00 135.18 1xmf h PRO 307 Ca -0.45 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 1xmf h PRO 307 Cb 1.25 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1xmf h PRO 307 CO 0.86 0.07 -1.34 -1.91 -0.21 0.00 0.00 178.00 175.48 1xmf n GLU 308 N -4.36 0.89 -0.07 1.05 2.13 -1.26 -4.73 120.64 114.29 1xmf n GLU 308 Ca 0.17 -0.05 0.08 0.00 0.66 0.00 0.00 57.16 58.02 1xmf n GLU 308 Cb 0.81 -1.16 0.11 0.00 0.27 0.00 0.00 31.44 31.46 1xmf n GLU 308 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1xmf n PHE 309 N -1.86 0.00 0.01 4.31 3.01 -1.17 -4.80 117.46 116.97 1xmf n PHE 309 Ca -0.03 -0.86 -0.10 0.00 1.01 0.00 0.00 57.45 57.47 1xmf n PHE 309 Cb 0.31 -0.13 -0.04 0.00 -0.01 0.00 0.00 39.48 39.61 1xmf n PHE 309 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1xmf h SER 310 N 0.00 -0.79 -0.38 4.37 0.87 -1.19 0.12 113.55 116.56 1xmf h SER 310 Ca 0.00 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.66 1xmf h SER 310 Cb 0.92 0.34 -0.02 0.00 -0.44 0.00 0.00 62.40 63.20 1xmf h SER 310 CO 0.00 -0.31 0.16 -0.78 -0.53 0.00 0.00 176.83 175.37 1xmf h ASP 311 N -0.34 0.51 0.38 6.23 3.58 -1.84 -2.04 116.42 122.89 1xmf h ASP 311 Ca 0.09 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.38 1xmf h ASP 311 Cb 0.48 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 1xmf h ASP 311 CO -0.30 0.52 -0.24 0.22 -2.88 0.00 0.00 179.24 176.57 1xmf h TYR 312 N 0.47 -0.63 -0.73 0.28 3.20 -1.81 -2.34 116.97 115.40 1xmf h TYR 312 Ca 0.13 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1xmf h TYR 312 Cb 0.16 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 1xmf h TYR 312 CO -0.01 -0.37 0.48 -0.91 -1.64 0.00 0.00 178.16 175.71 1xmf h ASN 313 N -0.60 0.80 -0.57 -2.11 2.35 -0.73 -1.75 115.58 112.96 1xmf h ASN 313 Ca -0.04 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.61 1xmf h ASN 313 Cb 0.50 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1xmf h ASN 313 CO 0.03 0.56 0.05 0.03 -1.65 0.00 0.00 177.43 176.46 1xmf h ARG 314 N 0.94 1.01 -0.35 0.81 3.08 -1.26 -0.40 114.38 118.20 1xmf h ARG 314 Ca 0.28 -0.28 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1xmf h ARG 314 Cb -0.03 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1xmf h ARG 314 CO -0.07 0.96 0.19 1.15 -1.07 0.00 0.00 179.97 181.13 1xmf h THR 315 N 0.94 1.00 -0.12 2.04 2.02 -0.78 0.26 112.91 118.27 1xmf h THR 315 Ca 0.18 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 1xmf h THR 315 Cb 0.47 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1xmf h THR 315 CO 0.02 0.07 0.04 0.58 0.37 0.00 0.00 175.52 176.60 1xmf h VAL 316 N 0.39 1.18 -0.39 3.16 2.07 -0.96 0.93 116.25 122.62 1xmf h VAL 316 Ca 0.15 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 1xmf h VAL 316 Cb 0.04 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1xmf h VAL 316 CO -0.09 0.17 -0.09 0.24 0.02 0.00 0.00 177.57 177.82 1xmf h MET 317 N 0.01 0.68 -0.82 1.57 2.07 -0.96 0.26 114.93 117.75 1xmf h MET 317 Ca 0.04 -0.20 -0.01 0.00 -2.07 0.00 0.00 59.70 57.45 1xmf h MET 317 Cb 0.23 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.85 1xmf h MET 317 CO -0.00 0.76 0.46 -0.09 1.07 0.00 0.00 176.91 179.11 1xmf h ARG 318 N 0.63 1.13 -0.02 1.72 2.43 -0.28 0.46 114.38 120.45 1xmf h ARG 318 Ca 0.11 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1xmf h ARG 318 Cb 0.52 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1xmf h ARG 318 CO 0.03 0.83 0.01 -0.97 -1.51 0.00 0.00 179.97 178.35 1xmf h ASN 319 N 1.13 0.03 -0.90 -3.80 -0.73 0.28 -2.21 115.58 109.39 1xmf h ASN 319 Ca 0.29 -0.19 0.02 0.00 1.87 0.00 0.00 56.30 58.29 1xmf h ASN 319 Cb 0.01 -0.01 -0.05 0.00 0.27 0.00 0.00 38.32 38.55 1xmf h ASN 319 CO -0.05 0.21 0.59 -0.50 -0.37 0.00 0.00 177.43 177.31 1xmf h TRP 320 N -0.15 1.12 -0.68 0.67 6.55 0.06 -0.32 115.95 123.20 1xmf h TRP 320 Ca 0.01 0.03 0.01 0.00 0.95 0.00 0.00 58.89 59.89 1xmf h TRP 320 Cb 0.19 -0.38 -0.04 0.00 -0.86 0.00 0.00 29.16 28.08 1xmf h TRP 320 CO -0.01 0.69 0.44 1.15 -1.05 0.00 0.00 178.44 179.66 1xmf h THR 321 N 1.19 1.16 -0.50 1.49 2.02 0.07 -0.25 112.91 118.10 1xmf h THR 321 Ca 0.34 -0.31 -0.11 0.00 0.77 0.00 0.00 66.41 67.10 1xmf h THR 321 Cb -0.10 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.47 1xmf h THR 321 CO -0.08 0.16 -0.13 1.23 0.37 0.00 0.00 175.52 177.08 1xmf h GLY 322 N 0.90 1.01 1.00 2.16 0.00 -0.85 0.10 103.07 107.40 1xmf h GLY 322 Ca 0.25 -0.81 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 1xmf h GLY 322 CO -0.06 0.74 0.35 1.70 0.00 0.00 0.00 176.54 179.27 1xmf h LYS 323 N 0.83 0.91 0.00 4.80 3.64 -0.35 -3.25 116.57 123.15 1xmf h LYS 323 Ca 0.13 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1xmf h LYS 323 Cb 0.66 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1xmf h LYS 323 CO 0.05 0.69 -1.03 0.91 -2.27 0.00 0.00 179.45 177.79 1xmf n TRP 324 N -4.53 0.02 -0.27 1.91 7.02 -0.17 -4.29 117.44 117.13 1xmf n TRP 324 Ca 0.05 0.01 -0.06 0.00 -1.02 0.00 0.00 57.50 56.47 1xmf n TRP 324 Cb 0.09 -0.12 0.06 0.00 -2.42 0.00 0.00 31.31 28.92 1xmf n TRP 324 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1xmf h LEU 325 N 0.00 1.07 0.02 -0.99 5.85 -0.82 -2.12 115.31 118.33 1xmf h LEU 325 Ca 0.00 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 1xmf h LEU 325 Cb 0.57 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1xmf h LEU 325 CO 0.00 0.98 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.99 1xmf h GLU 326 N 1.11 -0.03 -0.11 1.25 4.81 -1.75 0.39 114.58 120.26 1xmf h GLU 326 Ca 0.25 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1xmf h GLU 326 Cb 0.28 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1xmf h GLU 326 CO -0.01 0.13 -0.05 -1.35 -0.73 0.00 0.00 179.01 177.00 1xmf h PRO 327 N -0.18 0.15 -0.28 0.92 0.11 -1.76 -1.29 132.00 129.67 1xmf h PRO 327 Ca -0.00 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 1xmf h PRO 327 Cb 0.17 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.24 1xmf h PRO 327 CO 0.00 0.22 -0.15 1.15 -0.21 0.00 0.00 178.00 179.01 1xmf h THR 328 N 0.15 1.30 -0.66 -1.15 2.02 -0.98 -0.79 112.91 112.80 1xmf h THR 328 Ca 0.04 -1.25 0.01 0.00 0.77 0.00 0.00 66.41 65.97 1xmf h THR 328 Cb 0.19 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1xmf h THR 328 CO 0.01 0.40 0.43 0.40 0.37 0.00 0.00 175.52 177.13 1xmf h ILE 329 N 0.34 1.15 -0.75 3.11 2.04 -0.42 -0.49 117.51 122.48 1xmf h ILE 329 Ca 0.06 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1xmf h ILE 329 Cb 0.67 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1xmf h ILE 329 CO 0.04 0.16 0.49 0.00 0.00 0.00 0.00 178.15 178.84 1xmf h ALA 330 N 1.25 0.97 -0.73 1.87 0.00 -1.06 0.14 119.26 121.70 1xmf h ALA 330 Ca 0.25 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1xmf h ALA 330 Cb -0.08 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 1xmf h ALA 330 CO -0.06 0.33 0.48 0.00 0.00 0.00 0.00 179.25 180.00 1xmf h ALA 331 N 1.30 0.93 -0.38 0.00 0.00 -0.23 -0.74 119.26 120.15 1xmf h ALA 331 Ca 0.29 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1xmf h ALA 331 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1xmf h ALA 331 CO -0.08 0.35 0.01 -0.07 0.00 0.00 0.00 179.25 179.46 1xmf h LEU 332 N 0.99 0.64 0.11 0.00 3.38 -0.47 -2.19 115.31 117.77 1xmf h LEU 332 Ca 0.27 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1xmf h LEU 332 Cb -0.11 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 1xmf h LEU 332 CO -0.06 0.78 -0.23 -0.09 0.09 0.00 0.00 178.44 178.94 1xmf h ARG 333 N 0.48 -0.40 -0.59 1.13 2.43 -0.27 -1.30 114.38 115.85 1xmf h ARG 333 Ca 0.11 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 1xmf h ARG 333 Cb 0.44 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 1xmf h ARG 333 CO 0.02 -0.27 0.39 -0.44 -1.51 0.00 0.00 179.97 178.16 1xmf h ASP 334 N -0.42 0.58 0.48 -3.80 5.19 -1.15 -1.48 116.42 115.82 1xmf h ASP 334 Ca 0.03 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.39 1xmf h ASP 334 Cb 0.44 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1xmf h ASP 334 CO -0.13 0.40 -0.20 0.15 -3.12 0.00 0.00 179.24 176.34 1xmf h PHE 335 N 0.68 0.00 -0.15 4.55 3.57 -0.61 -2.51 116.94 122.47 1xmf h PHE 335 Ca 0.24 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.78 1xmf h PHE 335 Cb 0.11 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1xmf h PHE 335 CO -0.00 0.20 0.15 0.52 -2.23 0.00 0.00 178.31 176.95 1xmf h MET 336 N 0.00 0.00 0.00 1.11 2.86 -0.24 -1.48 114.93 117.18 1xmf h MET 336 Ca -0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1xmf h MET 336 Cb 0.49 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1xmf h MET 336 CO 0.03 0.00 -0.02 0.78 1.06 0.00 0.00 176.91 178.76 1xmf h GLY 337 N 0.00 0.00 2.00 8.32 0.00 -1.52 -2.35 103.07 109.52 1xmf h GLY 337 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 1xmf h GLY 337 CO -0.00 0.00 -0.16 -2.00 0.00 0.00 0.00 176.54 174.38 1xmf h LEU 338 N 0.00 0.00 -1.40 3.11 5.85 -1.47 -2.73 115.31 118.67 1xmf h LEU 338 Ca -0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1xmf h LEU 338 Cb 0.08 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1xmf h LEU 338 CO 0.00 0.16 -0.17 -0.26 -0.34 0.00 0.00 178.44 177.84 1xmf h PHE 339 N 0.00 0.20 0.00 1.25 -1.00 -1.62 -2.09 116.94 113.68 1xmf h PHE 339 Ca -0.00 -0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.71 1xmf h PHE 339 Cb 0.37 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 1xmf h PHE 339 CO 0.00 0.36 -0.20 0.00 -1.61 0.00 0.00 178.31 176.85 1xmf h ALA 340 N 1.65 1.29 -0.01 2.45 0.00 -1.67 -2.63 119.26 120.35 1xmf h ALA 340 Ca 0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1xmf h ALA 340 Cb 0.41 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1xmf h ALA 340 CO 0.03 0.25 -0.70 0.87 0.00 0.00 0.00 179.25 179.70 1xmf h LYS 341 N 0.00 0.06 -7.04 0.00 1.79 -1.49 -3.46 116.57 106.43 1xmf h LYS 341 Ca -0.00 -0.05 -0.54 0.00 -2.18 0.00 0.00 60.65 57.88 1xmf h LYS 341 Cb 0.48 0.01 0.19 0.00 -1.58 0.00 0.00 32.23 31.34 1xmf h LYS 341 CO 0.03 0.74 0.03 1.28 -1.08 0.00 0.00 179.45 180.45 1xmf n LEU 342 N -3.73 2.85 -4.77 2.94 4.77 -0.99 -4.94 117.00 113.13 1xmf n LEU 342 Ca -0.01 0.52 -0.38 0.00 -0.03 0.00 0.00 56.01 56.11 1xmf n LEU 342 Cb 0.69 -1.40 -0.00 0.00 -2.33 0.00 0.00 43.42 40.38 1xmf n LEU 342 CO 0.44 -2.34 0.88 -2.84 -1.33 0.00 0.00 177.39 172.20 1xmf s PRO 343 N -3.86 3.72 0.36 3.23 0.02 -1.26 -4.92 135.00 132.28 1xmf s PRO 343 Ca 0.68 1.94 -0.26 0.00 0.02 0.00 0.00 61.00 63.38 1xmf s PRO 343 Cb -0.28 -2.48 -0.12 0.00 0.02 0.00 0.00 34.50 31.64 1xmf s PRO 343 CO 0.56 -0.63 1.07 0.00 -0.33 0.00 0.00 177.00 177.67 1xmf n ALA 344 N -0.40 0.29 0.00 -1.55 0.00 -1.26 -2.24 120.51 115.35 1xmf n ALA 344 Ca 0.07 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1xmf n ALA 344 Cb 0.46 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1xmf n ALA 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xmf n GLY 345 N 1.10 2.44 0.22 0.00 0.00 -1.26 -4.91 105.19 102.78 1xmf n GLY 345 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 1xmf n GLY 345 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xmf h THR 346 N 0.00 0.75 -2.74 2.61 2.02 -1.82 -3.45 112.91 110.29 1xmf h THR 346 Ca 0.00 -0.12 0.03 0.00 0.77 0.00 0.00 66.41 67.09 1xmf h THR 346 Cb 0.00 0.37 -0.13 0.00 -1.74 0.00 0.00 68.15 66.65 1xmf h THR 346 CO 0.00 0.06 0.31 0.28 0.37 0.00 0.00 175.52 176.55 1xmf s THR 347 N -6.11 0.00 0.44 3.16 -1.32 -1.26 -5.12 115.64 105.43 1xmf s THR 347 Ca -0.13 -0.03 0.06 0.00 -1.21 0.00 0.00 61.69 60.38 1xmf s THR 347 Cb 0.16 -1.03 -0.05 0.00 -1.51 0.00 0.00 72.50 70.07 1xmf s THR 347 CO 0.74 0.00 0.06 1.51 -2.21 0.00 0.00 174.62 174.72 1xmf s ASP 348 N -2.66 4.09 0.56 8.08 3.84 -1.26 -5.03 116.67 124.29 1xmf s ASP 348 Ca 0.03 -1.37 0.24 0.00 -0.00 0.00 0.00 52.55 51.45 1xmf s ASP 348 Cb -0.01 -0.17 1.51 0.00 -1.38 0.00 0.00 42.92 42.87 1xmf s ASP 348 CO -0.11 -0.59 2.11 0.50 -0.00 0.00 0.00 175.17 177.08 1xmf h LYS 349 N 1.55 0.00 -0.22 2.11 3.64 -2.03 -2.34 116.57 119.29 1xmf h LYS 349 Ca -0.43 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.87 1xmf h LYS 349 Cb 1.26 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1xmf h LYS 349 CO 0.76 0.00 -0.17 1.49 -2.27 0.00 0.00 179.45 179.26 1xmf h GLU 350 N 0.00 0.50 -0.40 1.90 4.81 -1.99 -1.55 114.58 117.85 1xmf h GLU 350 Ca 0.09 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 1xmf h GLU 350 Cb 0.40 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1xmf h GLU 350 CO -0.00 0.82 0.10 0.93 -0.73 0.00 0.00 179.01 180.12 1xmf h GLU 351 N 0.19 0.64 -0.06 1.92 5.08 -1.86 -0.91 114.58 119.58 1xmf h GLU 351 Ca 0.04 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1xmf h GLU 351 Cb 0.71 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1xmf h GLU 351 CO 0.05 0.66 -0.27 0.82 -1.00 0.00 0.00 179.01 179.27 1xmf h ILE 352 N 0.50 0.38 -0.92 3.13 1.08 -1.41 0.60 117.51 120.88 1xmf h ILE 352 Ca 0.13 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.65 1xmf h ILE 352 Cb 0.31 0.38 -0.06 0.00 -3.07 0.00 0.00 36.82 34.38 1xmf h ILE 352 CO 0.00 0.00 0.59 0.74 -0.69 0.00 0.00 178.15 178.79 1xmf h THR 353 N -0.38 1.08 -0.45 -0.27 2.02 -1.06 -0.12 112.91 113.73 1xmf h THR 353 Ca 0.08 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 1xmf h THR 353 Cb 0.49 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1xmf h THR 353 CO -0.27 0.20 0.15 0.00 0.37 0.00 0.00 175.52 175.96 1xmf h ALA 354 N 1.42 0.58 -0.45 6.16 0.00 -0.41 -0.33 119.26 126.22 1xmf h ALA 354 Ca 0.40 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 1xmf h ALA 354 Cb 0.14 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xmf h ALA 354 CO -0.16 0.22 -0.00 0.66 0.00 0.00 0.00 179.25 179.96 1xmf h SER 355 N 0.58 0.70 0.13 0.00 4.64 -0.36 -1.30 113.55 117.96 1xmf h SER 355 Ca 0.15 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1xmf h SER 355 Cb 0.24 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1xmf h SER 355 CO -0.01 0.78 -0.06 -0.07 -0.87 0.00 0.00 176.83 176.59 1xmf h LEU 356 N 0.69 -0.15 -1.77 5.97 -0.00 -0.65 -2.41 115.31 116.99 1xmf h LEU 356 Ca 0.14 -0.14 0.11 0.00 -0.00 0.00 0.00 57.88 57.98 1xmf h LEU 356 Cb 0.43 0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.10 1xmf h LEU 356 CO 0.02 0.05 0.37 1.88 -0.00 0.00 0.00 178.44 180.76 1xmf h TYR 357 N -0.35 0.28 -0.02 1.13 -1.99 -0.75 -1.13 116.97 114.14 1xmf h TYR 357 Ca -0.02 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.72 1xmf h TYR 357 Cb 0.28 -0.09 -0.00 0.00 2.00 0.00 0.00 36.73 38.92 1xmf h TYR 357 CO -0.01 0.13 0.00 0.00 -0.00 0.00 0.00 178.16 178.28 1xmf h ARG 358 N 0.26 0.03 -0.19 4.88 3.08 -0.91 0.99 114.38 122.51 1xmf h ARG 358 Ca 0.25 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1xmf h ARG 358 Cb 0.65 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1xmf h ARG 358 CO -0.05 0.29 0.13 0.28 -1.07 0.00 0.00 179.97 179.54 1xmf h VAL 359 N -0.24 1.05 -0.30 2.04 2.07 -0.87 -0.96 116.25 119.05 1xmf h VAL 359 Ca 0.00 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1xmf h VAL 359 Cb 0.27 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1xmf h VAL 359 CO 0.00 0.05 0.09 0.58 0.02 0.00 0.00 177.57 178.31 1xmf h VAL 360 N 0.26 1.21 -0.90 2.57 2.07 -1.22 -0.53 116.25 119.71 1xmf h VAL 360 Ca 0.07 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 1xmf h VAL 360 Cb -0.03 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1xmf h VAL 360 CO -0.02 0.23 0.51 0.44 0.02 0.00 0.00 177.57 178.75 1xmf h ASP 361 N 0.33 1.11 -0.36 0.57 3.45 -0.68 0.12 116.42 120.95 1xmf h ASP 361 Ca 0.10 -0.09 -0.05 0.00 0.43 0.00 0.00 57.03 57.42 1xmf h ASP 361 Cb 0.26 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 1xmf h ASP 361 CO -0.00 0.87 0.02 0.44 -1.57 0.00 0.00 179.24 179.00 1xmf h ASP 362 N 1.25 0.61 -0.74 6.45 3.32 -1.04 -2.20 116.42 124.07 1xmf h ASP 362 Ca 0.32 -0.29 0.02 0.00 0.02 0.00 0.00 57.03 57.10 1xmf h ASP 362 Cb -0.00 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 1xmf h ASP 362 CO -0.05 0.75 0.48 -0.25 -1.72 0.00 0.00 179.24 178.45 1xmf h TRP 363 N 0.45 0.91 -0.54 4.55 7.01 -0.34 0.27 115.95 128.25 1xmf h TRP 363 Ca 0.11 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.05 1xmf h TRP 363 Cb 0.43 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 1xmf h TRP 363 CO 0.03 0.54 0.04 0.82 -2.79 0.00 0.00 178.44 177.08 1xmf h ILE 364 N 0.96 1.26 -0.07 2.65 2.04 -0.67 0.18 117.51 123.87 1xmf h ILE 364 Ca 0.29 -1.05 -0.22 0.00 1.00 0.00 0.00 64.86 64.87 1xmf h ILE 364 Cb -0.04 0.88 0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1xmf h ILE 364 CO -0.09 0.38 -0.83 -0.33 0.00 0.00 0.00 178.15 177.28 1xmf h GLU 365 N 0.81 0.68 0.00 2.37 5.08 -1.11 -0.29 114.58 122.13 1xmf h GLU 365 Ca 0.16 -0.64 -0.21 0.00 -1.00 0.00 0.00 59.36 57.67 1xmf h GLU 365 Cb 0.48 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 1xmf h GLU 365 CO 0.02 1.24 -1.00 -0.44 -1.00 0.00 0.00 179.01 177.83 1xmf h ASP 366 N 0.36 0.00 0.00 1.42 5.19 -0.45 -3.43 116.42 119.51 1xmf h ASP 366 Ca -0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 1xmf h ASP 366 Cb 1.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.99 1xmf h ASP 366 CO 0.17 0.96 0.00 -1.22 -3.12 0.00 0.00 179.24 176.03 1xmf n TYR 367 N -3.32 -0.40 -0.30 4.55 4.02 0.60 -4.79 117.16 117.52 1xmf n TYR 367 Ca -0.01 0.07 0.12 0.00 -0.01 0.00 0.00 57.90 58.07 1xmf n TYR 367 Cb 0.93 0.17 0.29 0.00 -0.02 0.00 0.00 39.34 40.71 1xmf n TYR 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xmf h ALA 368 N 0.00 1.33 0.00 -0.72 0.00 -1.49 -0.04 119.26 118.34 1xmf h ALA 368 Ca 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xmf h ALA 368 Cb 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xmf h ALA 368 CO 0.00 -0.38 -0.03 0.66 0.00 0.00 0.00 179.25 179.50 1xmf h SER 369 N 0.33 0.00 0.61 0.00 4.64 -1.27 -0.02 113.55 117.84 1xmf h SER 369 Ca 0.54 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.80 1xmf h SER 369 Cb 1.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1xmf h SER 369 CO -0.56 0.03 -0.27 0.03 -0.87 0.00 0.00 176.83 175.19 1xmf h ARG 370 N 0.00 0.00 -0.20 4.77 2.47 -1.25 -2.83 114.38 117.35 1xmf h ARG 370 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1xmf h ARG 370 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.89 1xmf h ARG 370 CO 0.00 0.27 0.00 0.44 0.56 0.00 0.00 179.97 181.24 1xmf n ILE 371 N -3.65 1.35 -2.12 2.04 -5.35 -1.16 -4.97 119.36 105.49 1xmf n ILE 371 Ca -0.01 -1.31 -0.17 0.00 -0.27 0.00 0.00 62.75 60.99 1xmf n ILE 371 Cb 0.39 0.27 -0.02 0.00 -1.74 0.00 0.00 39.64 38.54 1xmf n ILE 371 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1xmf n ASP 372 N -0.18 -4.95 -4.65 7.28 8.00 -1.07 -4.84 116.55 116.15 1xmf n ASP 372 Ca 0.11 0.09 -0.43 0.00 0.71 0.00 0.00 54.79 55.27 1xmf n ASP 372 Cb 0.49 -4.02 -0.02 0.00 -0.02 0.00 0.00 41.12 37.55 1xmf n ASP 372 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1xmf s PHE 373 N -2.78 2.48 -0.81 1.24 5.36 -0.04 -4.92 117.98 118.51 1xmf s PHE 373 Ca 0.00 0.73 -0.25 0.00 -0.96 0.00 0.00 56.93 56.44 1xmf s PHE 373 Cb 0.00 -3.78 0.01 0.00 -0.34 0.00 0.00 43.02 38.91 1xmf s PHE 373 CO 0.00 -2.37 1.59 0.15 -1.46 0.00 0.00 175.22 173.14 1xmf s LYS 374 N 4.03 3.03 -0.08 10.12 -0.14 -1.26 -4.50 119.74 130.94 1xmf s LYS 374 Ca 0.62 -0.25 -0.08 0.00 -1.36 0.00 0.00 55.97 54.89 1xmf s LYS 374 Cb -0.23 -4.69 -0.04 0.00 -1.68 0.00 0.00 37.83 31.18 1xmf s LYS 374 CO 0.23 -2.55 0.21 0.00 -0.76 0.00 0.00 175.35 172.48 1xmf s ALA 375 N 7.22 3.84 -0.44 5.17 0.00 -1.26 -5.06 121.76 131.23 1xmf s ALA 375 Ca 0.52 -0.55 -0.06 0.00 0.00 0.00 0.00 51.96 51.88 1xmf s ALA 375 Cb -0.07 -2.07 0.11 0.00 0.00 0.00 0.00 23.12 21.10 1xmf s ALA 375 CO 0.07 0.60 0.27 0.34 0.00 0.00 0.00 175.76 177.04 1xmf s ASP 376 N -1.13 5.48 0.23 0.00 -1.08 -1.26 -4.98 116.67 113.94 1xmf s ASP 376 Ca 0.18 -1.96 -0.06 0.00 -0.52 0.00 0.00 52.55 50.20 1xmf s ASP 376 Cb -0.13 -1.92 0.40 0.00 -1.46 0.00 0.00 42.92 39.81 1xmf s ASP 376 CO 0.08 -0.62 1.71 0.08 0.52 0.00 0.00 175.17 176.94 1xmf h ARG 377 N 8.25 0.34 0.08 4.34 0.11 -1.97 -1.47 114.38 124.06 1xmf h ARG 377 Ca -0.17 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.88 1xmf h ARG 377 Cb 1.06 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.06 1xmf h ARG 377 CO 0.78 0.23 -0.04 -0.44 0.10 0.00 0.00 179.97 180.60 1xmf h ASP 378 N 0.35 -0.09 -0.86 0.08 3.32 -1.99 -1.44 116.42 115.78 1xmf h ASP 378 Ca 0.38 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 1xmf h ASP 378 Cb 0.59 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.12 1xmf h ASP 378 CO -0.42 0.03 0.51 1.56 -1.72 0.00 0.00 179.24 179.19 1xmf h GLN 379 N -0.20 1.18 0.25 3.56 1.08 -1.90 0.12 115.11 119.20 1xmf h GLN 379 Ca -0.01 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 1xmf h GLN 379 Cb 0.17 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1xmf h GLN 379 CO 0.02 0.84 -0.12 0.82 -0.95 0.00 0.00 178.83 179.43 1xmf h ILE 380 N 1.19 0.81 -0.57 2.54 2.04 -1.21 -1.45 117.51 120.87 1xmf h ILE 380 Ca 0.31 -0.41 0.05 0.00 1.00 0.00 0.00 64.86 65.81 1xmf h ILE 380 Cb -0.03 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1xmf h ILE 380 CO -0.06 0.09 0.30 0.58 0.00 0.00 0.00 178.15 179.06 1xmf h VAL 381 N -0.55 0.96 -0.38 1.67 2.07 -1.10 -2.34 116.25 116.59 1xmf h VAL 381 Ca -0.03 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1xmf h VAL 381 Cb 0.40 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1xmf h VAL 381 CO 0.06 0.10 0.17 0.50 0.02 0.00 0.00 177.57 178.42 1xmf h LYS 382 N 0.57 0.34 -0.70 1.57 3.64 -0.69 -1.23 116.57 120.06 1xmf h LYS 382 Ca 0.25 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.65 1xmf h LYS 382 Cb 0.15 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 1xmf h LYS 382 CO -0.17 0.22 0.43 0.00 -2.27 0.00 0.00 179.45 177.67 1xmf h ALA 383 N 1.21 0.92 -0.03 5.00 0.00 -0.82 -3.02 119.26 122.52 1xmf h ALA 383 Ca 0.16 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1xmf h ALA 383 Cb 0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1xmf h ALA 383 CO -0.13 0.19 0.01 0.28 0.00 0.00 0.00 179.25 179.60 1xmf h VAL 384 N 0.84 1.20 -0.51 0.00 2.07 -0.93 -3.04 116.25 115.88 1xmf h VAL 384 Ca 0.29 -0.60 0.15 0.00 0.82 0.00 0.00 66.70 67.35 1xmf h VAL 384 Cb 0.04 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1xmf h VAL 384 CO -0.12 0.16 0.48 -0.07 0.02 0.00 0.00 177.57 178.04 1xmf h LEU 385 N -0.19 0.00 -2.17 2.57 3.38 -1.12 0.29 115.31 118.07 1xmf h LEU 385 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xmf h LEU 385 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1xmf h LEU 385 CO 0.00 0.00 0.17 0.00 0.09 0.00 0.00 178.44 178.70 1xmf h ALA 386 N 1.52 1.16 0.00 1.53 0.00 -1.43 0.12 119.26 122.17 1xmf h ALA 386 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1xmf h ALA 386 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xmf h ALA 386 CO -0.00 -0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.50 1xmf n GLY 387 N -1.19 -1.54 3.57 0.00 0.00 0.10 -4.77 105.19 101.37 1xmf n GLY 387 Ca -0.02 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1xmf n GLY 387 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xmf s LEU 388 N -4.29 3.40 0.00 0.99 1.43 0.42 -3.68 118.68 116.95 1xmf s LEU 388 Ca 0.09 1.04 0.16 0.00 -1.03 0.00 0.00 54.13 54.40 1xmf s LEU 388 Cb 0.12 -2.91 0.98 0.00 0.03 0.00 0.00 46.19 44.42 1xmf s LEU 388 CO 0.52 -2.32 1.39 0.29 0.23 0.00 0.00 176.35 176.47