#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mbf s ASP 3 N 0.00 3.75 0.22 6.12 1.47 -1.26 -4.86 116.67 122.11 3mbf s ASP 3 Ca 0.00 -0.31 -0.10 0.00 1.18 0.00 0.00 52.55 53.32 3mbf s ASP 3 Cb 0.00 0.14 0.31 0.00 -0.34 0.00 0.00 42.92 43.03 3mbf s ASP 3 CO 0.00 -2.28 1.67 0.00 0.68 0.00 0.00 175.17 175.24 3mbf h ASP 5 N 0.14 0.58 -0.58 0.00 3.32 -1.99 -1.15 116.42 116.73 3mbf h ASP 5 Ca 0.33 -0.26 0.09 0.00 0.02 0.00 0.00 57.03 57.22 3mbf h ASP 5 Cb 0.54 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 39.86 3mbf h ASP 5 CO -0.52 0.69 0.19 -0.74 -1.72 0.00 0.00 179.24 177.14 3mbf h HIS 6 N 0.44 0.33 -0.38 4.55 2.76 -1.80 -0.85 115.15 120.21 3mbf h HIS 6 Ca 0.11 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 58.16 3mbf h HIS 6 Cb 0.36 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 3mbf h HIS 6 CO 0.02 0.06 -0.36 -0.07 -1.30 0.00 0.00 177.93 176.29 3mbf h LEU 7 N 0.36 0.94 -0.79 0.26 3.38 -0.86 -2.83 115.31 115.76 3mbf h LEU 7 Ca 0.30 -0.42 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3mbf h LEU 7 Cb 0.38 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3mbf h LEU 7 CO -0.32 1.19 0.10 -0.07 0.09 0.00 0.00 178.44 179.44 3mbf h LEU 8 N 0.73 0.97 -0.35 1.67 3.38 -0.80 -1.51 115.31 119.39 3mbf h LEU 8 Ca 0.07 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.87 3mbf h LEU 8 Cb 0.94 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.38 3mbf h LEU 8 CO 0.09 0.97 0.03 0.03 0.09 0.00 0.00 178.44 179.65 3mbf h ARG 9 N 0.96 0.13 -0.38 1.13 3.08 -1.03 0.18 114.38 118.46 3mbf h ARG 9 Ca 0.19 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.27 3mbf h ARG 9 Cb 0.41 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 3mbf h ARG 9 CO 0.01 0.09 0.18 -0.07 -1.07 0.00 0.00 179.97 179.11 3mbf h LEU 10 N 0.14 0.25 -0.74 3.04 3.38 -1.17 -0.96 115.31 119.26 3mbf h LEU 10 Ca 0.17 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.20 3mbf h LEU 10 Cb 0.22 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 3mbf h LEU 10 CO -0.26 0.18 0.46 1.23 0.09 0.00 0.00 178.44 180.15 3mbf h GLY 11 N 0.36 1.07 1.08 0.83 0.00 -0.80 -1.85 103.07 103.77 3mbf h GLY 11 Ca 0.16 -0.34 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 3mbf h GLY 11 CO -0.13 0.28 -0.08 -0.33 0.00 0.00 0.00 176.54 176.29 3mbf h MET 12 N 0.89 1.03 -0.10 4.80 2.86 -0.62 -1.48 114.93 122.31 3mbf h MET 12 Ca 0.30 -0.37 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3mbf h MET 12 Cb 0.04 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 3mbf h MET 12 CO -0.12 1.06 0.05 1.15 1.06 0.00 0.00 176.91 180.10 3mbf h THR 13 N 0.91 1.12 -0.72 2.22 2.02 -0.92 0.20 112.91 117.74 3mbf h THR 13 Ca 0.15 -0.36 0.13 0.00 0.77 0.00 0.00 66.41 67.10 3mbf h THR 13 Cb 0.65 1.18 -0.09 0.00 -1.74 0.00 0.00 68.15 68.15 3mbf h THR 13 CO 0.04 0.11 0.27 0.00 0.37 0.00 0.00 175.52 176.31 3mbf h ALA 14 N 0.91 0.98 -0.10 6.16 0.00 -1.07 -1.60 119.26 124.53 3mbf h ALA 14 Ca 0.03 0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 3mbf h ALA 14 Cb 0.13 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3mbf h ALA 14 CO -0.00 -0.22 -0.76 0.87 0.00 0.00 0.00 179.25 179.14 3mbf h LYS 15 N 0.41 0.55 -0.86 0.00 1.79 -0.75 -3.10 116.57 114.61 3mbf h LYS 15 Ca 0.39 -0.45 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 3mbf h LYS 15 Cb 0.58 0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 31.29 3mbf h LYS 15 CO -0.40 1.08 0.43 -0.22 -1.08 0.00 0.00 179.45 179.26 3mbf h LYS 16 N 0.37 1.23 -0.86 3.15 3.64 0.09 -0.74 116.57 123.45 3mbf h LYS 16 Ca -0.04 -0.17 0.05 0.00 -1.27 0.00 0.00 60.65 59.21 3mbf h LYS 16 Cb 1.35 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 3mbf h LYS 16 CO 0.14 0.93 0.57 0.82 -2.27 0.00 0.00 179.45 179.64 3mbf h ILE 17 N 1.22 1.11 -0.03 2.00 2.04 -1.24 -3.11 117.51 119.51 3mbf h ILE 17 Ca 0.30 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.80 3mbf h ILE 17 Cb 0.10 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 3mbf h ILE 17 CO -0.04 0.19 -0.09 0.18 0.00 0.00 0.00 178.15 178.39 3mbf n LEU 18 N -4.46 2.72 -4.51 1.44 4.32 -0.95 -3.82 117.00 111.74 3mbf n LEU 18 Ca 0.12 -0.95 -0.45 0.00 -0.02 0.00 0.00 56.01 54.71 3mbf n LEU 18 Cb 0.14 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.93 3mbf n LEU 18 CO 0.34 0.46 0.31 -0.62 -1.22 0.00 0.00 177.39 176.67 3mbf n GLU 19 N 1.02 0.83 -3.87 3.23 1.02 -0.32 -3.33 120.64 119.22 3mbf n GLU 19 Ca 0.12 0.29 -0.28 0.00 -0.02 0.00 0.00 57.16 57.28 3mbf n GLU 19 Cb 0.55 -1.56 0.03 0.00 -0.02 0.00 0.00 31.44 30.44 3mbf n GLU 19 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3mbf n ASN 20 N 1.42 -3.86 -0.66 1.62 3.02 -1.26 -1.69 115.26 113.85 3mbf n ASN 20 Ca 0.12 -0.79 -0.09 0.00 -0.03 0.00 0.00 54.58 53.79 3mbf n ASN 20 Cb 0.32 -3.90 -0.04 0.00 -0.61 0.00 0.00 39.78 35.55 3mbf n ASN 20 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3mbf n GLY 21 N -1.68 1.01 3.87 7.41 0.00 -1.21 -5.00 105.19 109.59 3mbf n GLY 21 Ca -0.05 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 3mbf n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mbf s LYS 22 N -2.52 3.00 0.00 1.61 1.02 -0.68 -4.45 119.74 117.72 3mbf s LYS 22 Ca 0.00 0.58 0.00 0.00 0.02 0.00 0.00 55.97 56.57 3mbf s LYS 22 Cb 0.00 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 3mbf s LYS 22 CO 0.00 -0.96 0.00 0.41 -0.92 0.00 0.00 175.35 173.88 3mbf n GLY 23 N -2.81 3.83 3.57 -3.33 0.00 -0.99 -4.52 105.19 100.95 3mbf n GLY 23 Ca 0.07 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 3mbf n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mbf s ILE 24 N -2.05 4.28 -0.43 -0.61 1.01 0.11 -0.23 121.20 123.29 3mbf s ILE 24 Ca 0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 60.65 60.21 3mbf s ILE 24 Cb 0.00 -2.89 0.02 0.00 0.01 0.00 0.00 42.46 39.60 3mbf s ILE 24 CO 0.00 0.49 0.71 -0.22 0.00 0.00 0.00 174.94 175.93 3mbf s LEU 25 N 0.21 4.34 -0.28 2.97 2.96 -0.18 -1.97 118.68 126.74 3mbf s LEU 25 Ca 0.01 -0.14 -0.26 0.00 -0.22 0.00 0.00 54.13 53.52 3mbf s LEU 25 Cb -0.13 -2.85 0.00 0.00 0.50 0.00 0.00 46.19 43.71 3mbf s LEU 25 CO 0.02 -0.81 0.89 0.00 -1.32 0.00 0.00 176.35 175.13 3mbf s ALA 26 N 3.02 3.58 -0.16 5.97 0.00 0.63 -1.09 121.76 133.72 3mbf s ALA 26 Ca 0.26 -0.18 0.14 0.00 0.00 0.00 0.00 51.96 52.19 3mbf s ALA 26 Cb -0.13 -3.41 0.39 0.00 0.00 0.00 0.00 23.12 19.97 3mbf s ALA 26 CO 0.20 -1.15 1.19 0.00 0.00 0.00 0.00 175.76 176.00 3mbf n ALA 27 N 6.29 3.18 0.91 0.00 0.00 -0.03 -3.93 120.51 126.93 3mbf n ALA 27 Ca 0.07 -2.96 0.12 0.00 0.00 0.00 0.00 53.44 50.67 3mbf n ALA 27 Cb 0.47 -0.42 0.27 0.00 0.00 0.00 0.00 19.45 19.77 3mbf n ALA 27 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3mbf n ASP 28 N -0.87 2.61 -4.55 0.00 5.75 -0.85 -3.72 116.55 114.92 3mbf n ASP 28 Ca 0.16 -1.85 -0.54 0.00 -0.01 0.00 0.00 54.79 52.54 3mbf n ASP 28 Cb 0.76 -0.11 -0.06 0.00 -1.03 0.00 0.00 41.12 40.67 3mbf n ASP 28 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3mbf n GLU 29 N 0.97 0.66 -0.90 0.11 4.71 -1.26 -4.10 120.64 120.83 3mbf n GLU 29 Ca 0.17 0.24 -0.33 0.00 -0.01 0.00 0.00 57.16 57.23 3mbf n GLU 29 Cb 0.50 -1.79 0.14 0.00 -1.01 0.00 0.00 31.44 29.29 3mbf n GLU 29 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3mbf n THR 30 N 1.92 0.99 -0.32 2.62 -2.24 -1.26 -4.67 114.28 111.33 3mbf n THR 30 Ca 0.19 -0.13 0.16 0.00 -2.27 0.00 0.00 64.05 61.99 3mbf n THR 30 Cb 0.16 -1.04 0.35 0.00 -2.10 0.00 0.00 70.33 67.69 3mbf n THR 30 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3mbf h PRO 31 N -1.36 0.39 -0.37 -0.78 0.11 -1.99 -0.17 132.00 127.84 3mbf h PRO 31 Ca -0.45 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 3mbf h PRO 31 Cb 1.29 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3mbf h PRO 31 CO 0.43 0.26 0.04 -0.22 -0.21 0.00 0.00 178.00 178.30 3mbf h LYS 32 N 0.41 0.62 -0.18 1.05 3.64 -1.98 0.96 116.57 121.08 3mbf h LYS 32 Ca 0.60 -0.18 -0.04 0.00 -1.27 0.00 0.00 60.65 59.76 3mbf h LYS 32 Cb 1.19 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 3mbf h LYS 32 CO -0.54 0.70 -0.06 1.15 -2.27 0.00 0.00 179.45 178.43 3mbf h THR 33 N 0.45 1.30 -0.12 1.00 2.02 -1.69 -2.82 112.91 113.05 3mbf h THR 33 Ca 0.11 -1.06 -0.10 0.00 0.77 0.00 0.00 66.41 66.13 3mbf h THR 33 Cb 0.39 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 3mbf h THR 33 CO 0.01 0.32 -0.39 0.25 0.37 0.00 0.00 175.52 176.08 3mbf h LEU 34 N 0.06 0.28 -0.49 2.58 5.85 -1.05 -3.04 115.31 119.49 3mbf h LEU 34 Ca 0.04 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.68 3mbf h LEU 34 Cb 0.51 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3mbf h LEU 34 CO 0.02 0.65 0.28 1.23 -0.34 0.00 0.00 178.44 180.28 3mbf h GLY 35 N 1.18 0.69 1.01 3.75 0.00 -0.76 0.48 103.07 109.41 3mbf h GLY 35 Ca 0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 3mbf h GLY 35 CO 0.06 0.17 0.46 -0.09 0.00 0.00 0.00 176.54 177.14 3mbf h ARG 36 N 0.56 1.01 -0.59 4.80 2.43 -1.39 0.71 114.38 121.92 3mbf h ARG 36 Ca 0.20 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.21 3mbf h ARG 36 Cb 0.04 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 3mbf h ARG 36 CO -0.10 0.71 0.05 0.00 -1.51 0.00 0.00 179.97 179.11 3mbf h ARG 37 N 1.03 1.00 -0.36 0.20 3.08 -1.36 -2.90 114.38 115.06 3mbf h ARG 37 Ca 0.27 -0.29 0.03 0.00 0.07 0.00 0.00 59.98 60.06 3mbf h ARG 37 Cb -0.05 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3mbf h ARG 37 CO -0.05 0.97 0.16 0.74 -1.07 0.00 0.00 179.97 180.72 3mbf h PHE 38 N 0.90 0.30 -0.52 3.04 -1.00 -0.50 -3.22 116.94 115.93 3mbf h PHE 38 Ca 0.17 0.02 -0.06 0.00 2.81 0.00 0.00 57.97 60.90 3mbf h PHE 38 Cb 0.49 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 39.94 3mbf h PHE 38 CO 0.04 0.15 0.06 0.93 -1.61 0.00 0.00 178.31 177.88 3mbf h GLU 39 N 0.34 0.83 -0.81 1.51 5.08 -0.78 -0.80 114.58 119.95 3mbf h GLU 39 Ca 0.15 -0.20 0.13 0.00 -1.00 0.00 0.00 59.36 58.44 3mbf h GLU 39 Cb 0.08 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.16 3mbf h GLU 39 CO -0.12 0.79 0.53 -0.22 -1.00 0.00 0.00 179.01 179.00 3mbf h LYS 40 N 0.79 0.61 -0.45 2.33 1.63 -1.52 -2.15 116.57 117.81 3mbf h LYS 40 Ca 0.16 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 3mbf h LYS 40 Cb 0.38 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 3mbf h LYS 40 CO 0.01 0.41 0.00 1.28 -3.45 0.00 0.00 179.45 177.70 3mbf n LEU 41 N -4.52 3.51 0.00 5.20 4.77 -0.80 -4.95 117.00 120.21 3mbf n LEU 41 Ca 0.15 -1.56 0.00 0.00 -0.03 0.00 0.00 56.01 54.57 3mbf n LEU 41 Cb 0.43 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3mbf n LEU 41 CO 0.31 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.76 3mbf n GLY 42 N 1.53 0.82 3.69 -0.72 0.00 -0.81 -4.96 105.19 104.74 3mbf n GLY 42 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3mbf n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mbf s ILE 43 N -3.21 4.90 0.44 -0.61 1.01 -0.37 -4.97 121.20 118.38 3mbf s ILE 43 Ca 0.00 1.79 -0.23 0.00 0.00 0.00 0.00 60.65 62.20 3mbf s ILE 43 Cb 0.00 -4.20 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 3mbf s ILE 43 CO 0.00 0.11 1.13 -0.89 0.00 0.00 0.00 174.94 175.29 3mbf s THR 44 N 1.52 3.30 -1.26 2.92 2.01 -1.26 -3.72 115.64 119.14 3mbf s THR 44 Ca 0.44 0.98 -0.08 0.00 0.31 0.00 0.00 61.69 63.34 3mbf s THR 44 Cb -0.18 -3.50 0.18 0.00 0.01 0.00 0.00 72.50 69.00 3mbf s THR 44 CO 0.19 -0.00 1.92 -3.20 -0.69 0.00 0.00 174.62 172.84 3mbf n ASN 45 N -0.33 5.81 -4.92 3.53 5.15 -1.26 -4.75 115.26 118.49 3mbf n ASN 45 Ca 0.06 -3.17 -0.27 0.00 -0.60 0.00 0.00 54.58 50.61 3mbf n ASN 45 Cb 0.48 -1.43 -0.02 0.00 -0.53 0.00 0.00 39.78 38.28 3mbf n ASN 45 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3mbf s THR 46 N -0.37 5.08 0.25 -0.44 -4.23 -1.26 -4.99 115.64 109.69 3mbf s THR 46 Ca 0.41 -0.20 -0.04 0.00 -1.18 0.00 0.00 61.69 60.69 3mbf s THR 46 Cb 0.11 -3.78 0.23 0.00 1.34 0.00 0.00 72.50 70.39 3mbf s THR 46 CO -0.00 -0.40 1.82 -0.08 -0.54 0.00 0.00 174.62 175.42 3mbf h GLU 47 N 1.36 0.84 -0.36 3.99 4.81 -1.99 -2.34 114.58 120.89 3mbf h GLU 47 Ca -0.48 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.73 3mbf h GLU 47 Cb 1.20 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.35 3mbf h GLU 47 CO 0.65 0.56 0.14 1.49 -0.73 0.00 0.00 179.01 181.11 3mbf h GLU 48 N 0.87 0.29 -0.35 1.92 4.57 -1.96 0.59 114.58 120.50 3mbf h GLU 48 Ca 0.41 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.52 3mbf h GLU 48 Cb 0.34 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.85 3mbf h GLU 48 CO -0.23 0.19 -0.00 -0.91 -1.18 0.00 0.00 179.01 176.87 3mbf h ASN 49 N 0.29 0.51 -0.36 1.04 2.35 -1.75 -0.17 115.58 117.49 3mbf h ASN 49 Ca 0.16 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.70 3mbf h ASN 49 Cb 0.12 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3mbf h ASN 49 CO -0.15 0.58 -0.22 0.03 -1.65 0.00 0.00 177.43 176.02 3mbf h ARG 50 N 0.52 0.78 -0.52 0.81 3.08 -0.91 -0.97 114.38 117.17 3mbf h ARG 50 Ca 0.11 -0.36 0.02 0.00 0.07 0.00 0.00 59.98 59.82 3mbf h ARG 50 Cb 0.34 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 3mbf h ARG 50 CO 0.01 0.98 0.31 -0.09 -1.07 0.00 0.00 179.97 180.12 3mbf h ARG 51 N 0.57 0.61 -0.41 0.04 2.43 -0.56 -2.21 114.38 114.86 3mbf h ARG 51 Ca 0.07 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 3mbf h ARG 51 Cb 0.77 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 3mbf h ARG 51 CO 0.06 0.40 -0.27 -0.22 -1.51 0.00 0.00 179.97 178.43 3mbf h LYS 52 N 0.63 0.87 0.15 0.20 3.64 -0.87 -0.36 116.57 120.84 3mbf h LYS 52 Ca 0.21 -0.39 0.01 0.00 -1.27 0.00 0.00 60.65 59.21 3mbf h LYS 52 Cb 0.01 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 3mbf h LYS 52 CO -0.09 1.03 -0.20 0.35 -2.27 0.00 0.00 179.45 178.28 3mbf h PHE 53 N 0.74 -0.53 -0.78 1.91 3.57 -1.08 0.22 116.94 121.00 3mbf h PHE 53 Ca 0.09 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.62 3mbf h PHE 53 Cb 0.83 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 3mbf h PHE 53 CO 0.05 -0.29 0.50 0.00 -2.23 0.00 0.00 178.31 176.34 3mbf h ARG 54 N -0.41 0.97 -0.87 1.11 -0.00 -1.11 -0.27 114.38 113.80 3mbf h ARG 54 Ca 0.01 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 3mbf h ARG 54 Cb 0.40 -0.22 -0.04 0.00 0.00 0.00 0.00 29.97 30.11 3mbf h ARG 54 CO -0.08 0.64 0.55 1.49 0.00 0.00 0.00 179.97 182.58 3mbf h GLU 55 N 1.00 1.17 -0.85 0.04 4.81 -0.76 0.29 114.58 120.28 3mbf h GLU 55 Ca 0.30 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.46 3mbf h GLU 55 Cb -0.05 -0.25 -0.05 0.00 0.63 0.00 0.00 28.75 29.03 3mbf h GLU 55 CO -0.09 0.80 0.55 0.82 -0.73 0.00 0.00 179.01 180.36 3mbf h ILE 56 N 1.19 1.17 0.32 2.32 2.04 0.77 0.20 117.51 125.52 3mbf h ILE 56 Ca 0.32 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 3mbf h ILE 56 Cb -0.09 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 35.97 3mbf h ILE 56 CO -0.06 0.20 -0.15 -0.07 0.00 0.00 0.00 178.15 178.06 3mbf h LEU 57 N 1.10 -0.37 -1.15 1.44 3.38 -0.20 -3.27 115.31 116.24 3mbf h LEU 57 Ca 0.33 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3mbf h LEU 57 Cb -0.05 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3mbf h LEU 57 CO -0.10 0.01 -0.19 -0.26 0.09 0.00 0.00 178.44 177.99 3mbf h PHE 58 N -0.79 0.00 -0.32 1.13 0.04 -0.22 -2.44 116.94 114.34 3mbf h PHE 58 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3mbf h PHE 58 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3mbf h PHE 58 CO 0.02 0.19 0.00 -1.13 -0.60 0.00 0.00 178.31 176.79 3mbf n SER 59 N -3.35 2.04 -4.69 2.17 3.41 0.04 -4.72 113.62 108.52 3mbf n SER 59 Ca 0.00 -1.90 -0.42 0.00 -0.26 0.00 0.00 58.87 56.29 3mbf n SER 59 Cb 0.41 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 3mbf n SER 59 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3mbf s THR 60 N -1.58 3.23 0.12 6.66 2.01 -0.92 -4.92 115.64 120.24 3mbf s THR 60 Ca 0.29 0.64 -0.31 0.00 0.31 0.00 0.00 61.69 62.62 3mbf s THR 60 Cb 0.16 -3.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.18 3mbf s THR 60 CO 0.22 -0.01 1.37 -0.75 -0.69 0.00 0.00 174.62 174.76 3mbf s LYS 61 N 2.70 4.33 0.00 4.92 2.20 -1.26 -2.97 119.74 129.66 3mbf s LYS 61 Ca 0.72 2.06 0.00 0.00 -0.36 0.00 0.00 55.97 58.38 3mbf s LYS 61 Cb -0.37 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 3mbf s LYS 61 CO 0.31 -0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 3mbf n GLY 62 N 3.40 0.93 0.24 5.54 0.00 -1.26 -4.93 105.19 109.11 3mbf n GLY 62 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.20 3mbf n GLY 62 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3mbf h ILE 63 N 0.00 1.05 0.00 -0.61 6.09 -1.94 -2.50 117.51 119.60 3mbf h ILE 63 Ca 0.00 -0.47 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3mbf h ILE 63 Cb 0.00 1.26 0.00 0.00 0.47 0.00 0.00 36.82 38.55 3mbf h ILE 63 CO 0.00 0.13 0.00 1.05 -3.07 0.00 0.00 178.15 176.26 3mbf h GLU 64 N 0.00 0.00 0.00 2.19 9.09 -1.85 -0.68 114.58 123.32 3mbf h GLU 64 Ca -0.00 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.34 3mbf h GLU 64 Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.33 3mbf h GLU 64 CO 0.02 0.00 -0.34 -0.09 0.05 0.00 0.00 179.01 178.64 3mbf h ARG 65 N 0.00 0.00 0.00 1.06 2.43 -1.83 -3.35 114.38 112.70 3mbf h ARG 65 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3mbf h ARG 65 Cb 0.07 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3mbf h ARG 65 CO 0.00 0.34 -1.26 0.66 -1.51 0.00 0.00 179.97 178.21 3mbf n TYR 66 N -3.58 0.00 -3.95 2.20 4.01 -0.55 -4.85 117.16 110.45 3mbf n TYR 66 Ca -0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.39 3mbf n TYR 66 Cb 0.47 -0.14 -0.14 0.00 -0.31 0.00 0.00 39.34 39.22 3mbf n TYR 66 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3mbf s ILE 67 N -2.32 2.91 -0.36 -0.72 -1.09 -0.37 -2.33 121.20 116.92 3mbf s ILE 67 Ca -0.02 -1.08 0.23 0.00 -2.23 0.00 0.00 60.65 57.55 3mbf s ILE 67 Cb 0.03 -2.51 0.02 0.00 -1.58 0.00 0.00 42.46 38.42 3mbf s ILE 67 CO 0.22 0.15 1.14 1.23 -1.23 0.00 0.00 174.94 176.44 3mbf h GLY 68 N 8.01 0.00 -3.72 6.18 0.00 -0.71 -3.41 103.07 109.43 3mbf h GLY 68 Ca -0.31 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.97 3mbf h GLY 68 CO 0.57 0.00 0.18 -0.32 0.00 0.00 0.00 176.54 176.96 3mbf s GLY 69 N -4.16 -0.57 -0.08 4.60 0.00 -1.22 -2.10 107.32 103.79 3mbf s GLY 69 Ca 0.02 1.04 0.02 0.00 0.00 0.00 0.00 44.72 45.80 3mbf s GLY 69 CO 0.77 0.69 -0.15 0.14 0.00 0.00 0.00 173.10 174.55 3mbf s VAL 70 N -1.95 1.39 -0.32 1.40 1.01 0.00 -1.01 120.40 120.93 3mbf s VAL 70 Ca -0.08 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 3mbf s VAL 70 Cb -0.00 -1.26 -0.00 0.00 0.00 0.00 0.00 36.38 35.12 3mbf s VAL 70 CO 0.03 0.41 0.73 -0.63 0.00 0.00 0.00 175.10 175.65 3mbf s ILE 71 N 0.69 4.83 0.06 2.22 1.01 -0.25 -0.97 121.20 128.78 3mbf s ILE 71 Ca -0.13 1.00 -0.09 0.00 0.00 0.00 0.00 60.65 61.43 3mbf s ILE 71 Cb -0.16 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 3mbf s ILE 71 CO 0.03 -0.26 0.36 -0.76 0.00 0.00 0.00 174.94 174.32 3mbf s LEU 72 N 2.87 4.35 0.48 2.97 1.02 0.58 -0.85 118.68 130.11 3mbf s LEU 72 Ca 0.30 0.71 -0.22 0.00 0.02 0.00 0.00 54.13 54.94 3mbf s LEU 72 Cb -0.14 -2.91 -0.07 0.00 0.02 0.00 0.00 46.19 43.08 3mbf s LEU 72 CO 0.13 0.19 1.15 0.21 0.02 0.00 0.00 176.35 178.05 3mbf s ASN 73 N -1.79 6.05 0.35 2.29 3.84 -1.24 -1.90 114.94 122.54 3mbf s ASN 73 Ca 0.32 2.26 0.08 0.00 0.21 0.00 0.00 52.86 55.73 3mbf s ASN 73 Cb -0.14 -2.60 0.80 0.00 -0.55 0.00 0.00 41.25 38.77 3mbf s ASN 73 CO 0.18 -1.00 1.87 0.06 -2.79 0.00 0.00 177.10 175.42 3mbf h GLN 74 N 1.80 0.69 0.00 0.43 3.07 -1.88 -1.16 115.11 118.06 3mbf h GLN 74 Ca -0.50 -0.04 -0.04 0.00 0.09 0.00 0.00 58.65 58.17 3mbf h GLN 74 Cb 1.25 -0.16 -0.01 0.00 0.08 0.00 0.00 27.48 28.65 3mbf h GLN 74 CO 0.59 0.46 -0.18 1.05 0.09 0.00 0.00 178.83 180.84 3mbf h GLU 75 N 0.71 0.00 0.00 0.06 4.11 -1.98 -2.66 114.58 114.82 3mbf h GLU 75 Ca 0.45 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.85 3mbf h GLU 75 Cb 0.70 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 3mbf h GLU 75 CO -0.21 0.18 -0.15 1.15 0.07 0.00 0.00 179.01 180.05 3mbf h THR 76 N 0.00 0.40 0.00 -1.06 2.02 -1.59 -2.42 112.91 110.25 3mbf h THR 76 Ca -0.00 -0.91 -0.01 0.00 0.77 0.00 0.00 66.41 66.26 3mbf h THR 76 Cb 0.38 1.67 -0.00 0.00 -1.74 0.00 0.00 68.15 68.46 3mbf h THR 76 CO 0.02 0.15 -0.04 -0.26 0.37 0.00 0.00 175.52 175.76 3mbf h PHE 77 N 0.00 0.00 -0.17 3.16 0.04 -1.54 -2.56 116.94 115.87 3mbf h PHE 77 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3mbf h PHE 77 Cb 0.65 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.80 3mbf h PHE 77 CO 0.00 0.04 0.00 0.39 -0.60 0.00 0.00 178.31 178.14 3mbf n GLU 78 N -3.22 2.14 -4.11 1.51 -0.58 -0.91 -4.90 120.64 110.56 3mbf n GLU 78 Ca -0.01 -1.69 -0.29 0.00 -0.42 0.00 0.00 57.16 54.76 3mbf n GLU 78 Cb 0.24 -1.47 -0.07 0.00 -0.57 0.00 0.00 31.44 29.57 3mbf n GLU 78 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3mbf s GLN 79 N -1.79 2.67 0.26 3.49 -0.21 -0.96 -5.04 119.66 118.07 3mbf s GLN 79 Ca 0.34 -0.87 0.11 0.00 0.02 0.00 0.00 55.36 54.97 3mbf s GLN 79 Cb 0.20 -2.57 -0.05 0.00 1.00 0.00 0.00 33.01 31.60 3mbf s GLN 79 CO 0.30 0.51 -0.18 0.95 -2.12 0.00 0.00 175.29 174.76 3mbf s THR 80 N -1.52 2.62 0.92 -0.19 -4.23 -1.26 -1.43 115.64 110.55 3mbf s THR 80 Ca 0.28 -2.23 -0.11 0.00 -1.18 0.00 0.00 61.69 58.44 3mbf s THR 80 Cb -0.11 -2.35 0.14 0.00 1.34 0.00 0.00 72.50 71.52 3mbf s THR 80 CO 0.20 -0.33 1.09 -0.94 -0.54 0.00 0.00 174.62 174.11 3mbf s SER 81 N -3.34 3.24 0.46 3.99 1.04 0.16 -4.78 113.70 114.47 3mbf s SER 81 Ca 0.28 1.54 0.25 0.00 0.48 0.00 0.00 55.95 58.50 3mbf s SER 81 Cb -0.06 -2.21 1.27 0.00 0.10 0.00 0.00 66.02 65.12 3mbf s SER 81 CO 0.15 -2.79 1.81 1.23 0.98 0.00 0.00 173.24 174.62 3mbf h GLY 82 N -1.65 0.67 1.12 7.32 0.00 -1.97 0.39 103.07 108.95 3mbf h GLY 82 Ca -0.50 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.71 3mbf h GLY 82 CO 0.53 -0.06 0.00 -1.14 0.00 0.00 0.00 176.54 175.87 3mbf n SER 83 N -4.44 0.00 0.00 0.19 3.41 -1.26 -4.92 113.62 106.60 3mbf n SER 83 Ca 0.23 -0.79 0.00 0.00 -0.26 0.00 0.00 58.87 58.05 3mbf n SER 83 Cb 0.95 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 3mbf n SER 83 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mbf n GLY 84 N 0.97 1.09 3.66 5.00 0.00 0.13 -5.05 105.19 110.99 3mbf n GLY 84 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 3mbf n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mbf s VAL 85 N -2.73 4.59 0.10 1.61 1.01 -1.26 -4.70 120.40 119.02 3mbf s VAL 85 Ca 0.00 1.92 -0.34 0.00 0.00 0.00 0.00 61.98 63.56 3mbf s VAL 85 Cb 0.00 -4.24 -0.18 0.00 0.00 0.00 0.00 36.38 31.96 3mbf s VAL 85 CO 0.00 -0.16 0.82 -2.65 0.00 0.00 0.00 175.10 173.12 3mbf n PRO 86 N 6.30 0.07 -0.04 2.72 -0.02 -1.26 0.36 135.00 143.12 3mbf n PRO 86 Ca 0.12 0.02 0.03 0.00 -2.02 0.00 0.00 63.50 61.65 3mbf n PRO 86 Cb 0.46 -1.30 0.37 0.00 -0.02 0.00 0.00 33.50 33.02 3mbf n PRO 86 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3mbf h LEU 87 N 2.11 0.55 -1.83 2.45 3.38 -1.52 -1.13 115.31 119.33 3mbf h LEU 87 Ca -0.40 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 3mbf h LEU 87 Cb 1.43 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 3mbf h LEU 87 CO 0.62 0.42 0.05 0.71 0.09 0.00 0.00 178.44 180.33 3mbf h THR 88 N 0.64 1.05 -0.02 0.22 1.35 -1.84 -2.23 112.91 112.09 3mbf h THR 88 Ca 0.17 -0.15 -0.07 0.00 -0.55 0.00 0.00 66.41 65.81 3mbf h THR 88 Cb -0.03 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 67.29 3mbf h THR 88 CO -0.03 0.06 -0.31 -0.33 -0.25 0.00 0.00 175.52 174.65 3mbf h GLU 89 N 0.16 0.03 -0.91 4.72 4.39 -1.54 -0.82 114.58 120.60 3mbf h GLU 89 Ca 0.04 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.76 3mbf h GLU 89 Cb 0.03 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.63 3mbf h GLU 89 CO -0.01 0.34 0.60 -0.07 -1.16 0.00 0.00 179.01 178.71 3mbf h LEU 90 N 0.03 0.99 0.20 1.33 3.38 -1.40 -1.67 115.31 118.18 3mbf h LEU 90 Ca 0.00 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 3mbf h LEU 90 Cb 0.57 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 41.10 3mbf h LEU 90 CO 0.04 0.69 -1.53 -0.07 0.09 0.00 0.00 178.44 177.66 3mbf h LEU 91 N 1.15 0.66 -0.72 1.67 3.38 -1.47 -3.18 115.31 116.81 3mbf h LEU 91 Ca 0.36 -0.80 0.03 0.00 0.09 0.00 0.00 57.88 57.55 3mbf h LEU 91 Cb -0.01 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3mbf h LEU 91 CO -0.10 1.65 0.46 0.11 0.09 0.00 0.00 178.44 180.64 3mbf h LYS 92 N 0.12 0.88 -0.36 1.13 1.57 -1.02 -1.54 116.57 117.35 3mbf h LYS 92 Ca -0.26 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.42 3mbf h LYS 92 Cb 2.10 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 34.20 3mbf h LYS 92 CO 0.22 0.58 0.02 0.87 -0.57 0.00 0.00 179.45 180.58 3mbf h LYS 93 N 0.91 0.55 0.00 3.15 1.79 -1.41 -2.15 116.57 119.41 3mbf h LYS 93 Ca 0.28 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 3mbf h LYS 93 Cb -0.01 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.56 3mbf h LYS 93 CO -0.10 0.56 0.00 1.63 -1.08 0.00 0.00 179.45 180.46 3mbf n LYS 94 N -4.29 0.12 -1.02 3.15 5.02 -1.00 -4.92 118.16 115.22 3mbf n LYS 94 Ca 0.02 0.03 -0.01 0.00 -2.02 0.00 0.00 58.31 56.34 3mbf n LYS 94 Cb 0.23 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.74 3mbf n LYS 94 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mbf n GLY 95 N 1.21 0.45 3.76 0.72 0.00 -0.81 -4.83 105.19 105.69 3mbf n GLY 95 Ca 0.08 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.94 3mbf n GLY 95 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mbf s ILE 96 N -2.01 4.81 0.31 -0.61 1.01 -0.64 -5.02 121.20 119.06 3mbf s ILE 96 Ca 0.00 1.41 -0.29 0.00 0.00 0.00 0.00 60.65 61.77 3mbf s ILE 96 Cb 0.00 -4.01 -0.10 0.00 0.01 0.00 0.00 42.46 38.36 3mbf s ILE 96 CO 0.00 0.41 1.26 -1.61 0.00 0.00 0.00 174.94 175.00 3mbf s GLU 97 N -0.23 4.42 -0.16 2.79 0.41 -0.89 -4.36 118.70 120.68 3mbf s GLU 97 Ca 0.34 2.12 -0.07 0.00 -0.41 0.00 0.00 54.97 56.94 3mbf s GLU 97 Cb -0.19 -3.10 -0.04 0.00 -1.78 0.00 0.00 34.13 29.01 3mbf s GLU 97 CO 0.20 -0.10 0.08 0.42 -0.49 0.00 0.00 175.26 175.37 3mbf s ILE 98 N -1.09 4.95 0.18 -1.63 1.01 -1.26 -0.82 121.20 122.55 3mbf s ILE 98 Ca 0.48 0.02 0.07 0.00 0.00 0.00 0.00 60.65 61.22 3mbf s ILE 98 Cb -0.38 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 3mbf s ILE 98 CO 0.50 0.51 -0.14 -0.83 0.00 0.00 0.00 174.94 174.97 3mbf s GLY 99 N -0.05 1.30 -0.10 6.18 0.00 -0.15 -0.77 107.32 113.74 3mbf s GLY 99 Ca 0.07 -1.56 0.03 0.00 0.00 0.00 0.00 44.72 43.26 3mbf s GLY 99 CO 0.01 -1.65 -0.19 -1.50 0.00 0.00 0.00 173.10 169.78 3mbf s ILE 100 N -2.82 1.69 -0.20 0.90 1.10 -0.73 -0.31 121.20 120.82 3mbf s ILE 100 Ca 0.19 -0.78 -0.29 0.00 -0.51 0.00 0.00 60.65 59.25 3mbf s ILE 100 Cb -0.01 -1.50 0.00 0.00 0.15 0.00 0.00 42.46 41.10 3mbf s ILE 100 CO 0.05 0.48 1.12 -0.75 -2.11 0.00 0.00 174.94 173.73 3mbf s LYS 101 N 0.65 4.26 0.00 3.50 2.36 -0.80 -1.46 119.74 128.25 3mbf s LYS 101 Ca -0.13 1.47 0.12 0.00 -2.55 0.00 0.00 55.97 54.88 3mbf s LYS 101 Cb -0.16 -3.68 -0.03 0.00 -1.05 0.00 0.00 37.83 32.90 3mbf s LYS 101 CO 0.04 -0.64 0.67 1.28 1.55 0.00 0.00 175.35 178.24 3mbf n LEU 102 N 6.36 1.18 -4.79 5.43 4.77 0.52 -4.61 117.00 125.86 3mbf n LEU 102 Ca 0.13 -0.70 -0.33 0.00 -0.03 0.00 0.00 56.01 55.07 3mbf n LEU 102 Cb 0.46 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3mbf n LEU 102 CO 0.53 0.24 0.73 1.51 -1.33 0.00 0.00 177.39 179.07 3mbf s ASP 103 N -1.70 5.87 -0.43 -1.43 1.47 -1.25 -4.91 116.67 114.29 3mbf s ASP 103 Ca 0.09 1.92 0.05 0.00 1.18 0.00 0.00 52.55 55.79 3mbf s ASP 103 Cb 0.10 -2.55 0.56 0.00 -0.34 0.00 0.00 42.92 40.68 3mbf s ASP 103 CO 0.35 -1.11 1.73 0.29 0.68 0.00 0.00 175.17 177.11 3mbf n LYS 104 N -1.65 2.30 0.00 2.11 5.02 0.11 -5.02 118.16 121.04 3mbf n LYS 104 Ca 0.09 -3.23 0.00 0.00 -2.02 0.00 0.00 58.31 53.16 3mbf n LYS 104 Cb 0.52 -2.09 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 3mbf n LYS 104 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mbf n GLY 105 N -1.06 -1.79 3.31 0.72 0.00 -1.26 -4.79 105.19 100.32 3mbf n GLY 105 Ca 0.50 -1.78 -0.27 0.00 0.00 0.00 0.00 46.02 44.47 3mbf n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mbf s LEU 106 N 0.00 2.24 0.28 0.99 1.43 -1.26 -1.29 118.68 121.07 3mbf s LEU 106 Ca 0.00 -0.63 0.06 0.00 -1.03 0.00 0.00 54.13 52.53 3mbf s LEU 106 Cb 0.00 -1.06 -0.06 0.00 0.03 0.00 0.00 46.19 45.10 3mbf s LEU 106 CO 0.00 0.15 -0.04 0.27 0.23 0.00 0.00 176.35 176.96 3mbf s ILE 107 N -0.96 1.58 0.49 -0.59 -4.36 -0.17 -4.97 121.20 112.23 3mbf s ILE 107 Ca 0.09 -2.11 -0.23 0.00 -0.26 0.00 0.00 60.65 58.15 3mbf s ILE 107 Cb -0.10 -2.49 -0.06 0.00 1.25 0.00 0.00 42.46 41.06 3mbf s ILE 107 CO 0.03 -0.27 1.31 -1.81 0.24 0.00 0.00 174.94 174.45 3mbf s ASP 108 N -3.45 5.73 -0.07 4.36 1.01 -1.26 -1.42 116.67 121.57 3mbf s ASP 108 Ca 0.30 2.66 -0.03 0.00 0.71 0.00 0.00 52.55 56.19 3mbf s ASP 108 Cb 0.04 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.39 3mbf s ASP 108 CO 0.12 -1.25 0.14 -0.47 0.21 0.00 0.00 175.17 173.93 3mbf s TYR 109 N -1.34 -0.14 0.00 4.23 5.04 -0.04 -4.67 117.35 120.43 3mbf s TYR 109 Ca 0.66 0.51 0.00 0.00 -2.44 0.00 0.00 57.07 55.80 3mbf s TYR 109 Cb -0.38 -0.20 0.00 0.00 0.35 0.00 0.00 41.96 41.73 3mbf s TYR 109 CO 0.46 -0.21 0.00 1.63 -1.34 0.00 0.00 175.55 176.09 3mbf n LYS 110 N 4.80 0.00 -3.76 4.97 5.02 -1.26 -2.13 118.16 125.79 3mbf n LYS 110 Ca -0.15 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.77 3mbf n LYS 110 Cb 0.51 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.39 3mbf n LYS 110 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3mbf s GLU 111 N 0.00 2.83 0.00 1.97 -1.05 -1.26 -4.60 118.70 116.58 3mbf s GLU 111 Ca 0.00 -1.03 0.00 0.00 -0.15 0.00 0.00 54.97 53.79 3mbf s GLU 111 Cb 0.00 -3.40 0.00 0.00 -0.44 0.00 0.00 34.13 30.29 3mbf s GLU 111 CO 0.00 -0.56 0.00 0.36 0.95 0.00 0.00 175.26 176.01 3mbf n LYS 112 N 4.83 -0.05 -4.27 -4.83 2.85 -1.26 -5.00 118.16 110.43 3mbf n LYS 112 Ca -0.14 0.01 -0.28 0.00 -1.05 0.00 0.00 58.31 56.86 3mbf n LYS 112 Cb 0.46 -2.82 -0.06 0.00 -0.65 0.00 0.00 35.03 31.96 3mbf n LYS 112 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3mbf n GLU 113 N -2.30 0.95 -3.98 -1.58 1.02 -0.90 -4.83 120.64 109.02 3mbf n GLU 113 Ca 0.00 -3.16 -0.10 0.00 -0.02 0.00 0.00 57.16 53.89 3mbf n GLU 113 Cb 0.01 0.83 -0.11 0.00 -0.02 0.00 0.00 31.44 32.15 3mbf n GLU 113 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3mbf s LYS 114 N -3.57 0.29 0.17 3.49 -0.14 -1.26 -0.86 119.74 117.87 3mbf s LYS 114 Ca 0.00 -0.54 0.09 0.00 -1.36 0.00 0.00 55.97 54.17 3mbf s LYS 114 Cb -0.00 0.05 -0.04 0.00 -1.68 0.00 0.00 37.83 36.16 3mbf s LYS 114 CO 0.00 -0.03 -0.20 0.96 -0.76 0.00 0.00 175.35 175.32 3mbf s ILE 115 N -1.26 1.97 0.32 2.17 -4.36 -0.51 -4.80 121.20 114.74 3mbf s ILE 115 Ca -0.13 -1.94 -0.07 0.00 -0.26 0.00 0.00 60.65 58.24 3mbf s ILE 115 Cb -0.09 -1.92 -0.06 0.00 1.25 0.00 0.00 42.46 41.65 3mbf s ILE 115 CO -0.01 -0.25 0.62 -0.94 0.24 0.00 0.00 174.94 174.60 3mbf s SER 116 N -2.65 6.48 0.11 4.36 1.04 -1.26 -1.00 113.70 120.78 3mbf s SER 116 Ca 0.17 0.86 0.03 0.00 0.48 0.00 0.00 55.95 57.48 3mbf s SER 116 Cb -0.06 -2.20 -0.04 0.00 0.10 0.00 0.00 66.02 63.81 3mbf s SER 116 CO 0.08 -0.25 -0.07 0.68 0.98 0.00 0.00 173.24 174.65 3mbf s VAL 117 N -2.16 0.84 0.00 5.02 -7.23 -0.41 -4.89 120.40 111.56 3mbf s VAL 117 Ca 0.46 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 3mbf s VAL 117 Cb -0.11 -1.74 0.00 0.00 0.56 0.00 0.00 36.38 35.09 3mbf s VAL 117 CO 0.30 -0.83 0.00 0.61 -0.31 0.00 0.00 175.10 174.87 3mbf n GLY 118 N -0.10 0.04 0.25 2.32 0.00 -1.26 -0.71 105.19 105.73 3mbf n GLY 118 Ca -0.11 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.01 3mbf n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3mbf h LEU 119 N 0.00 0.00 -1.02 0.99 3.38 -1.93 -3.16 115.31 113.57 3mbf h LEU 119 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3mbf h LEU 119 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3mbf h LEU 119 CO 0.00 0.13 -0.43 -0.33 0.09 0.00 0.00 178.44 177.90 3mbf h GLU 120 N 0.00 0.12 -0.09 1.13 3.07 -2.02 -2.55 114.58 114.23 3mbf h GLU 120 Ca -0.00 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 3mbf h GLU 120 Cb 0.31 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3mbf h GLU 120 CO 0.02 0.53 -0.01 -0.40 -1.40 0.00 0.00 179.01 177.75 3mbf n ASP 121 N -4.01 2.86 -0.36 1.42 5.75 -1.24 -4.80 116.55 116.17 3mbf n ASP 121 Ca -0.02 -3.09 -0.02 0.00 -0.01 0.00 0.00 54.79 51.65 3mbf n ASP 121 Cb 0.48 -0.47 0.10 0.00 -1.03 0.00 0.00 41.12 40.20 3mbf n ASP 121 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3mbf h LEU 122 N 0.63 1.09 0.10 -2.12 5.85 -1.42 -1.40 115.31 118.05 3mbf h LEU 122 Ca 0.00 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3mbf h LEU 122 Cb 1.16 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.92 3mbf h LEU 122 CO 0.08 0.79 -0.05 -0.78 -0.34 0.00 0.00 178.44 178.14 3mbf h ASP 123 N 1.29 -0.12 -0.49 1.25 3.58 -1.87 -0.41 116.42 119.65 3mbf h ASP 123 Ca 0.35 -0.07 0.10 0.00 0.42 0.00 0.00 57.03 57.83 3mbf h ASP 123 Cb -0.14 0.03 -0.09 0.00 1.72 0.00 0.00 39.33 40.86 3mbf h ASP 123 CO -0.08 -0.00 -0.05 -0.07 -2.88 0.00 0.00 179.24 176.16 3mbf h LEU 124 N -0.23 -0.31 -0.84 2.28 3.38 -1.88 -2.86 115.31 114.86 3mbf h LEU 124 Ca -0.01 0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3mbf h LEU 124 Cb 0.18 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3mbf h LEU 124 CO 0.02 -0.11 -0.12 0.03 0.09 0.00 0.00 178.44 178.35 3mbf h ARG 125 N 0.06 0.74 -0.89 1.13 3.08 -1.03 -2.18 114.38 115.28 3mbf h ARG 125 Ca 0.24 -0.24 0.14 0.00 0.07 0.00 0.00 59.98 60.19 3mbf h ARG 125 Cb 0.37 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 3mbf h ARG 125 CO -0.45 0.83 0.57 0.00 -1.07 0.00 0.00 179.97 179.85 3mbf n LYS 127 N -4.56 0.84 -1.95 0.00 5.02 -0.83 -4.92 118.16 111.75 3mbf n LYS 127 Ca 0.17 -0.13 -0.39 0.00 -2.02 0.00 0.00 58.31 55.94 3mbf n LYS 127 Cb 0.46 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.98 3mbf n LYS 127 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3mbf s SER 128 N -2.25 6.08 0.44 4.39 0.15 -0.58 -4.90 113.70 117.03 3mbf s SER 128 Ca 0.38 2.74 0.19 0.00 0.70 0.00 0.00 55.95 59.96 3mbf s SER 128 Cb 0.21 -2.64 1.02 0.00 -1.71 0.00 0.00 66.02 62.90 3mbf s SER 128 CO 0.41 -1.02 1.93 0.77 1.20 0.00 0.00 173.24 176.53 3mbf h SER 129 N 2.44 0.00 -0.85 5.45 4.64 -1.92 -2.58 113.55 120.73 3mbf h SER 129 Ca -0.50 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 60.93 3mbf h SER 129 Cb 1.26 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 3mbf h SER 129 CO 0.62 0.25 0.55 0.00 -0.87 0.00 0.00 176.83 177.37 3mbf h ALA 130 N 1.75 1.78 -0.55 5.18 0.00 -1.95 -2.43 119.26 123.04 3mbf h ALA 130 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mbf h ALA 130 Cb 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3mbf h ALA 130 CO 0.03 0.02 0.00 1.19 0.00 0.00 0.00 179.25 180.50 3mbf n PHE 131 N -4.53 1.97 -0.26 0.00 3.72 -0.97 -4.66 117.46 112.74 3mbf n PHE 131 Ca 0.15 -0.69 0.12 0.00 -0.05 0.00 0.00 57.45 56.98 3mbf n PHE 131 Cb 0.38 -0.49 0.39 0.00 -0.94 0.00 0.00 39.48 38.82 3mbf n PHE 131 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3mbf h LYS 132 N 3.82 0.65 -0.00 -1.08 1.57 -1.47 -0.80 116.57 119.26 3mbf h LYS 132 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3mbf h LYS 132 Cb 1.90 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 34.06 3mbf h LYS 132 CO 0.46 0.43 -0.26 -0.25 -0.57 0.00 0.00 179.45 179.26 3mbf n ASP 133 N -4.55 0.52 -4.77 0.86 8.00 -1.26 -4.88 116.55 110.46 3mbf n ASP 133 Ca 0.17 -0.35 -0.41 0.00 0.71 0.00 0.00 54.79 54.91 3mbf n ASP 133 Cb 0.46 0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.56 3mbf n ASP 133 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mbf s ALA 134 N -2.76 3.51 0.00 2.24 0.00 -0.31 -4.57 121.76 119.88 3mbf s ALA 134 Ca 0.19 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.42 3mbf s ALA 134 Cb 0.19 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3mbf s ALA 134 CO 0.57 -0.66 0.41 0.25 0.00 0.00 0.00 175.76 176.34 3mbf n THR 135 N 0.89 0.00 -4.05 0.00 -2.24 0.06 -4.99 114.28 103.95 3mbf n THR 135 Ca 0.00 -0.46 -0.11 0.00 -2.27 0.00 0.00 64.05 61.22 3mbf n THR 135 Cb 0.42 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.65 3mbf n THR 135 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 3mbf s PHE 136 N -0.10 0.63 0.22 4.78 -0.12 -1.17 -2.50 117.98 119.72 3mbf s PHE 136 Ca 0.00 -0.95 -0.02 0.00 -0.05 0.00 0.00 56.93 55.91 3mbf s PHE 136 Cb 0.00 -0.00 -0.03 0.00 -0.63 0.00 0.00 43.02 42.36 3mbf s PHE 136 CO 0.00 -0.95 0.21 0.00 -0.05 0.00 0.00 175.22 174.44 3mbf s ALA 137 N -3.88 0.97 0.02 1.99 0.00 -0.27 -1.78 121.76 118.80 3mbf s ALA 137 Ca 0.27 -1.58 -0.01 0.00 0.00 0.00 0.00 51.96 50.64 3mbf s ALA 137 Cb 0.01 1.33 -0.02 0.00 0.00 0.00 0.00 23.12 24.45 3mbf s ALA 137 CO 0.11 -0.65 -0.02 0.21 0.00 0.00 0.00 175.76 175.42 3mbf s LYS 138 N -4.05 0.33 -0.13 0.00 2.20 -0.54 -0.30 119.74 117.26 3mbf s LYS 138 Ca 0.36 -0.60 -0.06 0.00 -0.36 0.00 0.00 55.97 55.31 3mbf s LYS 138 Cb 0.05 0.12 0.05 0.00 -1.51 0.00 0.00 37.83 36.54 3mbf s LYS 138 CO 0.13 -0.06 0.29 -0.46 -0.36 0.00 0.00 175.35 174.89 3mbf s TRP 139 N -1.48 -0.42 -0.15 4.03 -0.11 -1.02 -0.35 118.94 119.44 3mbf s TRP 139 Ca -0.16 0.95 -0.03 0.00 1.22 0.00 0.00 56.10 58.09 3mbf s TRP 139 Cb -0.10 0.09 -0.02 0.00 -1.50 0.00 0.00 33.47 31.93 3mbf s TRP 139 CO -0.01 -0.29 -0.06 0.50 -4.62 0.00 0.00 176.95 172.47 3mbf s ARG 140 N 1.57 3.60 0.23 5.86 3.52 -1.26 -1.54 118.95 130.92 3mbf s ARG 140 Ca -0.07 -0.56 0.07 0.00 -0.13 0.00 0.00 55.73 55.04 3mbf s ARG 140 Cb -0.10 -2.85 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 3mbf s ARG 140 CO -0.10 0.22 0.14 -1.12 -0.81 0.00 0.00 175.30 173.64 3mbf s SER 141 N 0.39 5.34 -0.06 -2.12 0.01 0.03 -4.68 113.70 112.61 3mbf s SER 141 Ca -0.06 -0.29 0.01 0.00 1.31 0.00 0.00 55.95 56.93 3mbf s SER 141 Cb -0.15 -1.31 0.02 0.00 0.21 0.00 0.00 66.02 64.80 3mbf s SER 141 CO 0.04 -0.00 -0.06 -0.22 0.41 0.00 0.00 173.24 173.40 3mbf s LEU 142 N -3.60 1.32 -0.41 2.44 2.96 -1.26 -1.72 118.68 118.42 3mbf s LEU 142 Ca 0.32 -0.19 -0.08 0.00 -0.22 0.00 0.00 54.13 53.96 3mbf s LEU 142 Cb -0.08 -0.59 0.08 0.00 0.50 0.00 0.00 46.19 46.10 3mbf s LEU 142 CO 0.23 -0.05 0.24 -0.36 -1.32 0.00 0.00 176.35 175.09 3mbf s PHE 143 N 1.05 3.35 0.47 5.38 0.08 0.02 -4.50 117.98 123.82 3mbf s PHE 143 Ca -0.09 -1.59 -0.22 0.00 0.12 0.00 0.00 56.93 55.15 3mbf s PHE 143 Cb -0.14 -2.92 -0.07 0.00 -0.57 0.00 0.00 43.02 39.31 3mbf s PHE 143 CO -0.00 -0.85 1.12 0.71 -0.10 0.00 0.00 175.22 176.10 3mbf s TYR 144 N 1.40 2.91 -0.16 0.36 2.02 -1.26 -1.94 117.35 120.68 3mbf s TYR 144 Ca 0.03 1.56 0.01 0.00 -0.37 0.00 0.00 57.07 58.30 3mbf s TYR 144 Cb -0.23 -3.28 0.01 0.00 -0.40 0.00 0.00 41.96 38.06 3mbf s TYR 144 CO 0.02 -1.29 -0.17 -0.06 -1.57 0.00 0.00 175.55 172.48 3mbf s PHE 145 N -1.67 2.77 0.19 2.71 0.08 -1.26 -3.39 117.98 117.41 3mbf s PHE 145 Ca 0.65 -1.27 0.00 0.00 0.12 0.00 0.00 56.93 56.43 3mbf s PHE 145 Cb -0.25 -1.90 -0.00 0.00 -0.57 0.00 0.00 43.02 40.30 3mbf s PHE 145 CO 0.30 -0.61 0.23 0.66 -0.10 0.00 0.00 175.22 175.71 3mbf n TYR 146 N 4.28 -0.83 -2.10 0.36 4.01 -1.08 -4.31 117.16 117.49 3mbf n TYR 146 Ca -0.20 -1.34 -0.42 0.00 -0.16 0.00 0.00 57.90 55.79 3mbf n TYR 146 Cb 0.51 0.26 -0.03 0.00 -0.31 0.00 0.00 39.34 39.77 3mbf n TYR 146 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 3mbf s ASP 147 N -2.20 6.75 0.00 7.72 1.47 -1.26 -2.18 116.67 126.98 3mbf s ASP 147 Ca 0.17 2.51 0.00 0.00 1.18 0.00 0.00 52.55 56.42 3mbf s ASP 147 Cb -0.00 -2.61 0.00 0.00 -0.34 0.00 0.00 42.92 39.97 3mbf s ASP 147 CO 0.12 -0.65 0.00 0.61 0.68 0.00 0.00 175.17 175.93 3mbf n GLY 148 N 2.66 0.71 2.90 2.12 0.00 -1.26 -5.00 105.19 107.33 3mbf n GLY 148 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 3mbf n GLY 148 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mbf s ILE 149 N -2.96 0.20 0.26 -0.61 1.01 -0.92 -4.02 121.20 114.16 3mbf s ILE 149 Ca 0.00 -0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.26 3mbf s ILE 149 Cb 0.00 -0.18 -0.10 0.00 0.01 0.00 0.00 42.46 42.18 3mbf s ILE 149 CO 0.00 0.06 1.44 -2.84 0.00 0.00 0.00 174.94 173.61 3mbf s PRO 150 N 0.04 4.26 0.51 2.79 0.02 -1.22 -2.62 135.00 138.78 3mbf s PRO 150 Ca -0.00 2.33 -0.18 0.00 0.02 0.00 0.00 61.00 63.17 3mbf s PRO 150 Cb -0.02 -3.09 -0.08 0.00 0.02 0.00 0.00 34.50 31.33 3mbf s PRO 150 CO -0.00 -0.42 1.00 -1.54 -0.33 0.00 0.00 177.00 175.71 3mbf s SER 151 N 0.28 6.44 0.34 2.53 1.04 -1.26 -4.93 113.70 118.15 3mbf s SER 151 Ca 0.59 1.72 0.08 0.00 0.48 0.00 0.00 55.95 58.81 3mbf s SER 151 Cb -0.42 -2.53 0.78 0.00 0.10 0.00 0.00 66.02 63.94 3mbf s SER 151 CO 0.45 -0.71 1.84 -0.08 0.98 0.00 0.00 173.24 175.72 3mbf h GLU 152 N 1.12 0.72 -0.59 4.02 4.57 -2.00 -1.78 114.58 120.64 3mbf h GLU 152 Ca -0.48 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 57.68 3mbf h GLU 152 Cb 1.20 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 29.59 3mbf h GLU 152 CO 0.60 0.48 0.37 -0.44 -1.18 0.00 0.00 179.01 178.83 3mbf h ASP 153 N 0.74 0.60 -0.27 1.04 3.32 -1.99 -1.20 116.42 118.66 3mbf h ASP 153 Ca 0.49 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.41 3mbf h ASP 153 Cb 0.75 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 3mbf h ASP 153 CO -0.25 0.42 -0.28 0.00 -1.72 0.00 0.00 179.24 177.42 3mbf h ILE 155 N 0.66 1.11 0.04 0.00 2.04 -1.11 -1.33 117.51 118.91 3mbf h ILE 155 Ca 0.08 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 3mbf h ILE 155 Cb 0.80 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3mbf h ILE 155 CO 0.07 0.08 -0.02 0.78 0.00 0.00 0.00 178.15 179.06 3mbf h ASN 156 N -0.10 -0.04 -0.47 1.72 2.35 -1.09 -1.09 115.58 116.85 3mbf h ASN 156 Ca 0.01 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3mbf h ASN 156 Cb 0.13 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3mbf h ASN 156 CO -0.00 0.01 0.26 -0.08 -1.65 0.00 0.00 177.43 175.96 3mbf h GLU 157 N -0.09 0.66 -0.34 0.81 4.57 -1.04 0.40 114.58 119.56 3mbf h GLU 157 Ca -0.01 -0.08 -0.12 0.00 -1.18 0.00 0.00 59.36 57.98 3mbf h GLU 157 Cb 0.08 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 3mbf h GLU 157 CO 0.01 0.52 -0.28 -0.91 -1.18 0.00 0.00 179.01 177.17 3mbf h ASN 158 N 0.62 0.72 -0.28 1.04 2.35 -1.20 -0.97 115.58 117.87 3mbf h ASN 158 Ca 0.17 -0.28 -0.15 0.00 -0.55 0.00 0.00 56.30 55.49 3mbf h ASN 158 Cb 0.06 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3mbf h ASN 158 CO -0.03 0.96 -0.37 0.00 -1.65 0.00 0.00 177.43 176.34 3mbf h SER 160 N 0.68 0.77 -0.62 0.00 0.87 -0.68 -1.04 113.55 113.52 3mbf h SER 160 Ca 0.06 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 3mbf h SER 160 Cb 0.94 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.66 3mbf h SER 160 CO 0.09 0.78 0.40 0.40 -0.53 0.00 0.00 176.83 177.97 3mbf h ILE 161 N 0.72 1.17 -0.72 2.23 2.04 -0.97 -1.41 117.51 120.56 3mbf h ILE 161 Ca 0.17 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 3mbf h ILE 161 Cb 0.30 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3mbf h ILE 161 CO -0.00 0.17 0.40 -0.07 0.00 0.00 0.00 178.15 178.64 3mbf h LEU 162 N 0.84 0.90 -0.48 1.44 3.38 -0.64 -1.76 115.31 118.99 3mbf h LEU 162 Ca 0.23 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 3mbf h LEU 162 Cb -0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 3mbf h LEU 162 CO -0.05 0.74 -0.31 0.00 0.09 0.00 0.00 178.44 178.92 3mbf h ALA 163 N 1.20 0.67 -0.52 1.53 0.00 -1.01 0.04 119.26 121.17 3mbf h ALA 163 Ca 0.25 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3mbf h ALA 163 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3mbf h ALA 163 CO -0.04 0.67 -0.04 0.87 0.00 0.00 0.00 179.25 180.71 3mbf h LYS 164 N 0.77 0.92 -0.76 0.00 1.57 -1.10 -2.11 116.57 115.87 3mbf h LYS 164 Ca 0.08 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 3mbf h LYS 164 Cb 0.88 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 3mbf h LYS 164 CO 0.08 0.94 0.50 -0.92 -0.57 0.00 0.00 179.45 179.48 3mbf h TYR 165 N 0.84 0.95 -0.14 -1.35 3.20 -1.08 -2.42 116.97 116.97 3mbf h TYR 165 Ca 0.15 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 3mbf h TYR 165 Cb 0.56 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 3mbf h TYR 165 CO 0.03 0.59 0.07 0.00 -1.64 0.00 0.00 178.16 177.22 3mbf h ALA 166 N 1.28 0.18 -0.55 1.82 0.00 -0.39 -1.02 119.26 120.58 3mbf h ALA 166 Ca 0.28 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 3mbf h ALA 166 Cb -0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3mbf h ALA 166 CO -0.06 -0.26 -0.11 0.97 0.00 0.00 0.00 179.25 179.79 3mbf h ILE 167 N 0.11 1.27 -0.34 0.00 6.09 -1.40 -1.35 117.51 121.87 3mbf h ILE 167 Ca 0.05 -1.27 -0.01 0.00 -1.37 0.00 0.00 64.86 62.27 3mbf h ILE 167 Cb 0.11 0.96 -0.02 0.00 0.47 0.00 0.00 36.82 38.34 3mbf h ILE 167 CO -0.01 0.45 0.19 0.40 -3.07 0.00 0.00 178.15 176.11 3mbf h ILE 168 N 0.92 1.13 -0.16 2.19 2.04 -1.25 -0.40 117.51 121.98 3mbf h ILE 168 Ca 0.14 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.70 3mbf h ILE 168 Cb 0.68 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 3mbf h ILE 168 CO 0.05 0.14 -0.13 0.00 0.00 0.00 0.00 178.15 178.20 3mbf h GLN 170 N -0.15 0.62 -0.09 0.00 4.20 -0.93 -0.18 115.11 118.57 3mbf h GLN 170 Ca 0.10 -0.09 0.03 0.00 0.06 0.00 0.00 58.65 58.75 3mbf h GLN 170 Cb 0.30 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 3mbf h GLN 170 CO -0.25 0.53 0.16 0.87 -0.67 0.00 0.00 178.83 179.47 3mbf h LYS 171 N 0.55 0.00 -0.53 1.46 1.57 -0.94 -0.19 116.57 118.49 3mbf h LYS 171 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3mbf h LYS 171 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3mbf h LYS 171 CO -0.02 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.95 3mbf n ASN 172 N -3.49 3.18 0.00 0.86 3.02 -0.22 -4.93 115.26 113.67 3mbf n ASN 172 Ca -0.00 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 3mbf n ASN 172 Cb 0.25 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 3mbf n ASN 172 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3mbf n GLY 173 N 1.45 0.60 3.49 7.41 0.00 -0.08 -5.00 105.19 113.06 3mbf n GLY 173 Ca 0.20 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 3mbf n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mbf s LEU 174 N 0.00 3.00 -0.27 0.99 1.43 -0.36 -4.86 118.68 118.61 3mbf s LEU 174 Ca 0.00 -0.16 -0.28 0.00 -1.03 0.00 0.00 54.13 52.66 3mbf s LEU 174 Cb 0.00 -1.67 0.01 0.00 0.03 0.00 0.00 46.19 44.56 3mbf s LEU 174 CO 0.00 0.26 1.01 -0.69 0.23 0.00 0.00 176.35 177.16 3mbf s VAL 175 N -0.20 4.64 0.06 -1.59 1.01 -1.04 -2.75 120.40 120.54 3mbf s VAL 175 Ca 0.02 1.81 -0.24 0.00 0.00 0.00 0.00 61.98 63.57 3mbf s VAL 175 Cb -0.13 -4.32 -0.06 0.00 0.00 0.00 0.00 36.38 31.87 3mbf s VAL 175 CO 0.03 -0.29 0.74 -2.16 0.00 0.00 0.00 175.10 173.42 3mbf s PRO 176 N 3.32 4.48 -0.21 2.72 0.04 -1.25 -1.11 135.00 142.99 3mbf s PRO 176 Ca 0.43 1.03 -0.14 0.00 0.04 0.00 0.00 61.00 62.37 3mbf s PRO 176 Cb -0.14 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 3mbf s PRO 176 CO 0.10 0.36 0.30 0.42 0.04 0.00 0.00 177.00 178.22 3mbf s ILE 177 N -0.32 5.27 -0.19 0.56 1.01 0.59 -1.59 121.20 126.53 3mbf s ILE 177 Ca 0.37 0.50 -0.07 0.00 0.00 0.00 0.00 60.65 61.44 3mbf s ILE 177 Cb -0.21 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 3mbf s ILE 177 CO 0.23 0.30 0.06 0.68 0.00 0.00 0.00 174.94 176.21 3mbf s VAL 178 N 1.10 4.70 -0.54 2.92 -7.23 -0.47 -2.42 120.40 118.45 3mbf s VAL 178 Ca 0.15 -0.06 0.04 0.00 -1.81 0.00 0.00 61.98 60.29 3mbf s VAL 178 Cb -0.14 -3.13 0.14 0.00 0.56 0.00 0.00 36.38 33.81 3mbf s VAL 178 CO 0.06 0.44 0.31 -0.70 -0.31 0.00 0.00 175.10 174.90 3mbf s GLU 179 N 0.54 1.94 -1.32 4.82 2.12 -0.59 -0.02 118.70 126.18 3mbf s GLU 179 Ca 0.03 -2.67 -0.14 0.00 0.36 0.00 0.00 54.97 52.56 3mbf s GLU 179 Cb -0.13 -3.14 0.11 0.00 0.26 0.00 0.00 34.13 31.23 3mbf s GLU 179 CO 0.01 -1.16 1.85 -0.35 -0.54 0.00 0.00 175.26 175.07 3mbf n PRO 180 N 2.93 3.26 -2.22 4.30 -0.04 -1.22 -0.79 135.00 141.21 3mbf n PRO 180 Ca 0.09 -3.28 -0.42 0.00 -0.04 0.00 0.00 63.50 59.86 3mbf n PRO 180 Cb 0.33 -3.18 -0.03 0.00 -0.04 0.00 0.00 33.50 30.58 3mbf n PRO 180 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3mbf s GLU 181 N 2.30 4.33 -0.36 0.54 2.12 -0.70 -4.60 118.70 122.34 3mbf s GLU 181 Ca 0.46 2.00 -0.20 0.00 0.36 0.00 0.00 54.97 57.58 3mbf s GLU 181 Cb 0.07 -3.34 0.00 0.00 0.26 0.00 0.00 34.13 31.13 3mbf s GLU 181 CO -0.01 -0.44 0.62 0.08 -0.54 0.00 0.00 175.26 174.98 3mbf s VAL 182 N 1.38 4.90 -0.02 3.70 1.01 -1.26 -0.80 120.40 129.31 3mbf s VAL 182 Ca 0.63 0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.85 3mbf s VAL 182 Cb -0.34 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 31.92 3mbf s VAL 182 CO 0.29 -0.32 1.36 0.12 0.00 0.00 0.00 175.10 176.56 3mbf s PHE 183 N 2.68 2.91 0.32 5.22 5.36 -0.82 -4.90 117.98 128.76 3mbf s PHE 183 Ca 0.24 0.90 0.05 0.00 -0.96 0.00 0.00 56.93 57.16 3mbf s PHE 183 Cb -0.15 -3.61 0.56 0.00 -0.34 0.00 0.00 43.02 39.48 3mbf s PHE 183 CO 0.15 -2.21 1.81 1.25 -1.46 0.00 0.00 175.22 174.75 3mbf h LEU 184 N 8.38 0.39 -8.07 6.12 5.85 -1.91 -3.39 115.31 122.68 3mbf h LEU 184 Ca -0.37 -0.11 -0.58 0.00 0.84 0.00 0.00 57.88 57.67 3mbf h LEU 184 Cb 1.17 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 42.01 3mbf h LEU 184 CO 0.90 0.58 1.55 -1.61 -0.34 0.00 0.00 178.44 179.52 3mbf s GLU 185 N -4.63 3.54 0.09 1.25 2.02 -1.26 -0.84 118.70 118.86 3mbf s GLU 185 Ca -0.06 -1.21 -0.26 0.00 0.02 0.00 0.00 54.97 53.46 3mbf s GLU 185 Cb 0.15 -5.36 0.09 0.00 0.10 0.00 0.00 34.13 29.10 3mbf s GLU 185 CO 0.77 -2.38 1.15 0.20 0.02 0.00 0.00 175.26 175.01 3mbf s GLY 186 N 5.17 -0.10 -0.33 -1.39 0.00 -1.26 -4.79 107.32 104.63 3mbf s GLY 186 Ca 0.51 0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.20 3mbf s GLY 186 CO -0.05 2.61 0.07 -0.35 0.00 0.00 0.00 173.10 175.37 3mbf s ASP 187 N -3.38 5.14 -0.14 1.64 2.15 -1.26 -1.86 116.67 118.95 3mbf s ASP 187 Ca 0.21 -1.25 -0.30 0.00 0.43 0.00 0.00 52.55 51.65 3mbf s ASP 187 Cb -0.00 -1.80 0.11 0.00 -0.30 0.00 0.00 42.92 40.92 3mbf s ASP 187 CO 0.01 -0.31 0.90 -0.72 -0.17 0.00 0.00 175.17 174.89 3mbf s TYR 188 N 1.33 -0.47 0.80 -5.34 -0.85 -1.26 -4.75 117.35 106.80 3mbf s TYR 188 Ca -0.03 0.86 -0.12 0.00 -0.52 0.00 0.00 57.07 57.26 3mbf s TYR 188 Cb -0.20 0.43 0.07 0.00 0.38 0.00 0.00 41.96 42.64 3mbf s TYR 188 CO 0.01 -0.41 1.10 -1.54 -1.52 0.00 0.00 175.55 173.19 3mbf s SER 189 N -0.97 4.51 0.25 -0.18 1.04 -1.26 -0.94 113.70 116.15 3mbf s SER 189 Ca -0.04 1.25 0.00 0.00 0.48 0.00 0.00 55.95 57.65 3mbf s SER 189 Cb -0.01 -1.97 0.30 0.00 0.10 0.00 0.00 66.02 64.44 3mbf s SER 189 CO 0.03 -1.95 1.65 -0.03 0.98 0.00 0.00 173.24 173.92 3mbf h MET 190 N -1.08 0.52 -0.33 4.02 4.05 -1.92 -2.20 114.93 117.99 3mbf h MET 190 Ca -0.47 -0.23 -0.00 0.00 -0.28 0.00 0.00 59.70 58.71 3mbf h MET 190 Cb 1.27 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 32.05 3mbf h MET 190 CO 0.60 0.79 0.19 -0.22 0.23 0.00 0.00 176.91 178.50 3mbf h LYS 191 N 0.45 0.46 -0.45 0.39 3.64 -1.93 0.12 116.57 119.25 3mbf h LYS 191 Ca 0.05 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3mbf h LYS 191 Cb 0.80 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 3mbf h LYS 191 CO 0.06 0.37 0.18 -0.09 -2.27 0.00 0.00 179.45 177.70 3mbf h ARG 192 N 0.42 0.64 -0.31 1.90 9.65 -1.92 -1.53 114.38 123.23 3mbf h ARG 192 Ca 0.12 -0.09 -0.16 0.00 -1.10 0.00 0.00 59.98 58.75 3mbf h ARG 192 Cb 0.04 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.50 3mbf h ARG 192 CO -0.02 0.53 -0.42 1.03 2.80 0.00 0.00 179.97 183.89 3mbf h SER 193 N 0.63 0.91 -0.32 -3.80 0.87 -0.91 -1.06 113.55 109.87 3mbf h SER 193 Ca 0.15 -0.50 0.07 0.00 -1.23 0.00 0.00 61.79 60.29 3mbf h SER 193 Cb 0.13 -0.26 -0.07 0.00 -0.44 0.00 0.00 62.40 61.76 3mbf h SER 193 CO -0.01 1.23 -0.19 0.22 -0.53 0.00 0.00 176.83 177.55 3mbf h TYR 194 N 0.61 -0.47 -0.38 2.24 3.20 -0.49 0.98 116.97 122.67 3mbf h TYR 194 Ca 0.04 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 3mbf h TYR 194 Cb 1.02 0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.53 3mbf h TYR 194 CO 0.07 -0.26 0.01 0.93 -1.64 0.00 0.00 178.16 177.27 3mbf h GLU 195 N -0.15 0.66 -0.09 1.82 5.08 -1.11 -2.19 114.58 118.60 3mbf h GLU 195 Ca 0.16 -0.20 -0.19 0.00 -1.00 0.00 0.00 59.36 58.13 3mbf h GLU 195 Cb 0.40 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 3mbf h GLU 195 CO -0.41 0.75 -0.74 0.28 -1.00 0.00 0.00 179.01 177.90 3mbf h VAL 196 N 0.48 1.36 -0.86 3.13 2.07 -1.07 -1.87 116.25 119.49 3mbf h VAL 196 Ca 0.11 -2.11 0.08 0.00 0.82 0.00 0.00 66.70 65.60 3mbf h VAL 196 Cb 0.45 2.09 -0.07 0.00 -1.52 0.00 0.00 31.29 32.23 3mbf h VAL 196 CO 0.02 0.64 0.52 0.74 0.02 0.00 0.00 177.57 179.51 3mbf h THR 197 N 0.32 0.99 -0.35 2.57 2.02 -0.67 0.83 112.91 118.61 3mbf h THR 197 Ca -0.03 -0.31 -0.10 0.00 0.77 0.00 0.00 66.41 66.73 3mbf h THR 197 Cb 1.32 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 3mbf h THR 197 CO 0.13 0.17 -0.19 0.03 0.37 0.00 0.00 175.52 176.03 3mbf h ARG 198 N 0.92 0.65 -0.31 6.66 3.08 -1.03 0.40 114.38 124.74 3mbf h ARG 198 Ca 0.39 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3mbf h ARG 198 Cb 0.26 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 3mbf h ARG 198 CO -0.21 0.81 0.20 1.96 -1.07 0.00 0.00 179.97 181.66 3mbf h GLN 199 N 0.58 0.42 -0.02 0.04 4.20 -0.54 -2.77 115.11 117.01 3mbf h GLN 199 Ca 0.09 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 3mbf h GLN 199 Cb 0.65 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 3mbf h GLN 199 CO 0.05 0.29 -0.03 0.82 -0.67 0.00 0.00 178.83 179.29 3mbf h ILE 200 N 0.41 1.42 -0.50 2.54 2.04 -0.49 -2.19 117.51 120.74 3mbf h ILE 200 Ca 0.11 -1.29 -0.05 0.00 1.00 0.00 0.00 64.86 64.64 3mbf h ILE 200 Cb -0.03 2.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 3mbf h ILE 200 CO -0.02 0.34 0.13 -0.07 0.00 0.00 0.00 178.15 178.52 3mbf h LEU 201 N -0.45 0.75 -0.79 1.44 3.38 -1.04 0.55 115.31 119.15 3mbf h LEU 201 Ca 0.00 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 3mbf h LEU 201 Cb 0.57 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3mbf h LEU 201 CO 0.01 0.78 0.08 0.77 0.09 0.00 0.00 178.44 180.17 3mbf h SER 202 N 0.68 0.95 -0.20 -0.43 4.64 -1.56 -1.69 113.55 115.94 3mbf h SER 202 Ca 0.16 -0.22 -0.13 0.00 -0.47 0.00 0.00 61.79 61.12 3mbf h SER 202 Cb 0.32 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3mbf h SER 202 CO 0.00 0.96 -0.34 0.74 -0.87 0.00 0.00 176.83 177.32 3mbf h THR 203 N 0.93 1.28 -0.18 2.95 2.02 -1.15 -1.48 112.91 117.28 3mbf h THR 203 Ca 0.18 -1.49 0.02 0.00 0.77 0.00 0.00 66.41 65.89 3mbf h THR 203 Cb 0.43 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 3mbf h THR 203 CO 0.01 0.49 0.06 0.25 0.37 0.00 0.00 175.52 176.69 3mbf h LEU 204 N 0.60 0.06 -1.60 2.58 5.85 -0.51 -0.80 115.31 121.48 3mbf h LEU 204 Ca 0.06 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3mbf h LEU 204 Cb 0.87 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 3mbf h LEU 204 CO 0.08 0.06 -0.08 0.24 -0.34 0.00 0.00 178.44 178.39 3mbf h MET 205 N 0.14 0.15 0.04 1.25 2.86 -1.18 0.25 114.93 118.44 3mbf h MET 205 Ca 0.08 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3mbf h MET 205 Cb 0.05 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.69 3mbf h MET 205 CO -0.09 0.24 -0.02 -0.22 1.06 0.00 0.00 176.91 177.89 3mbf h LYS 206 N 0.15 -0.05 -0.44 1.72 3.64 -0.30 -2.18 116.57 119.11 3mbf h LYS 206 Ca 0.03 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 3mbf h LYS 206 Cb 0.25 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3mbf h LYS 206 CO 0.01 0.02 -0.28 1.88 -2.27 0.00 0.00 179.45 178.81 3mbf h TYR 207 N -0.11 1.12 -0.95 1.91 0.05 -0.32 -0.56 116.97 118.12 3mbf h TYR 207 Ca -0.01 -0.30 0.12 0.00 0.05 0.00 0.00 58.73 58.60 3mbf h TYR 207 Cb 0.09 -0.25 -0.08 0.00 1.01 0.00 0.00 36.73 37.50 3mbf h TYR 207 CO -0.06 1.12 0.58 -0.07 -1.05 0.00 0.00 178.16 178.68 3mbf h LEU 208 N 0.81 0.84 -0.36 3.88 3.38 -0.96 -1.79 115.31 121.10 3mbf h LEU 208 Ca 0.09 0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.93 3mbf h LEU 208 Cb 0.86 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 3mbf h LEU 208 CO 0.08 0.44 -0.56 0.78 0.09 0.00 0.00 178.44 179.27 3mbf h ASN 209 N 0.92 0.87 0.06 -0.43 2.35 -0.90 -1.73 115.58 116.72 3mbf h ASN 209 Ca 0.47 -0.47 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3mbf h ASN 209 Cb 0.47 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 3mbf h ASN 209 CO -0.27 1.25 -0.13 1.88 -1.65 0.00 0.00 177.43 178.51 3mbf h TYR 210 N 0.60 0.16 -0.03 1.19 0.05 -0.66 -1.38 116.97 116.89 3mbf h TYR 210 Ca 0.01 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3mbf h TYR 210 Cb 1.15 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.84 3mbf h TYR 210 CO 0.06 0.29 0.00 0.39 -1.05 0.00 0.00 178.16 177.85 3mbf n GLU 211 N -4.31 1.46 -3.35 4.88 -0.58 -0.72 -4.92 120.64 113.11 3mbf n GLU 211 Ca -0.01 -0.68 -0.23 0.00 -0.42 0.00 0.00 57.16 55.81 3mbf n GLU 211 Cb 0.24 -1.46 0.06 0.00 -0.57 0.00 0.00 31.44 29.72 3mbf n GLU 211 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3mbf n LEU 212 N -0.16 -3.07 -4.77 -4.62 4.77 -0.52 -4.92 117.00 103.71 3mbf n LEU 212 Ca 0.19 -0.43 -0.39 0.00 -0.03 0.00 0.00 56.01 55.35 3mbf n LEU 212 Cb 0.27 -3.01 -0.01 0.00 -2.33 0.00 0.00 43.42 38.35 3mbf n LEU 212 CO 0.16 0.47 0.93 -0.69 -1.33 0.00 0.00 177.39 176.93 3mbf s VAL 213 N -3.26 2.73 -0.63 4.08 1.01 -0.68 -4.94 120.40 118.72 3mbf s VAL 213 Ca 0.47 0.64 -0.28 0.00 0.00 0.00 0.00 61.98 62.81 3mbf s VAL 213 Cb -0.21 -3.37 0.03 0.00 0.00 0.00 0.00 36.38 32.83 3mbf s VAL 213 CO 0.58 0.08 1.27 -0.47 0.00 0.00 0.00 175.10 176.55 3mbf s TYR 214 N -1.30 2.44 0.28 5.22 5.04 -1.26 -4.85 117.35 122.91 3mbf s TYR 214 Ca 0.58 0.29 -0.01 0.00 -2.44 0.00 0.00 57.07 55.49 3mbf s TYR 214 Cb -0.36 -4.52 0.40 0.00 0.35 0.00 0.00 41.96 37.82 3mbf s TYR 214 CO 0.46 -1.81 1.81 0.82 -1.34 0.00 0.00 175.55 175.49 3mbf h ILE 215 N 6.17 1.23 0.00 3.14 1.08 -1.92 -0.70 117.51 126.51 3mbf h ILE 215 Ca -0.26 -0.87 0.00 0.00 -0.39 0.00 0.00 64.86 63.34 3mbf h ILE 215 Cb 1.06 0.75 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 3mbf h ILE 215 CO 1.21 0.32 0.00 -2.65 -0.69 0.00 0.00 178.15 176.34 3mbf n PRO 216 N -4.26 0.12 -0.78 2.37 -0.02 -1.21 -2.51 135.00 128.72 3mbf n PRO 216 Ca 0.03 0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.68 3mbf n PRO 216 Cb 0.25 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.43 3mbf n PRO 216 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mbf n GLY 217 N -0.51 4.82 3.14 -1.23 0.00 -0.27 -4.37 105.19 106.76 3mbf n GLY 217 Ca 0.04 -1.21 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 3mbf n GLY 217 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mbf s VAL 218 N -3.21 1.37 -0.05 1.61 1.01 -1.04 -3.91 120.40 116.17 3mbf s VAL 218 Ca 0.45 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.75 3mbf s VAL 218 Cb 0.40 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 3mbf s VAL 218 CO 0.01 0.39 -0.12 -0.76 0.00 0.00 0.00 175.10 174.62 3mbf s LEU 219 N -0.10 2.87 -0.20 3.92 1.43 -0.62 -4.07 118.68 121.90 3mbf s LEU 219 Ca -0.00 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.91 3mbf s LEU 219 Cb -0.10 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 3mbf s LEU 219 CO 0.01 0.35 -0.01 -0.63 0.23 0.00 0.00 176.35 176.30 3mbf s ILE 220 N -0.76 3.78 -0.40 -0.59 1.01 -1.07 -1.37 121.20 121.79 3mbf s ILE 220 Ca 0.12 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.30 3mbf s ILE 220 Cb -0.11 -2.71 0.05 0.00 0.01 0.00 0.00 42.46 39.71 3mbf s ILE 220 CO 0.01 0.43 0.24 -0.75 0.00 0.00 0.00 174.94 174.87 3mbf s LYS 221 N 1.09 2.73 0.16 2.79 2.20 0.97 -0.62 119.74 129.05 3mbf s LYS 221 Ca 0.02 -1.27 0.09 0.00 -0.36 0.00 0.00 55.97 54.45 3mbf s LYS 221 Cb -0.14 -3.77 -0.04 0.00 -1.51 0.00 0.00 37.83 32.37 3mbf s LYS 221 CO 0.01 -0.83 -0.20 0.00 -0.36 0.00 0.00 175.35 173.97 3mbf s ALA 222 N 1.50 2.07 0.28 3.13 0.00 -1.08 -3.45 121.76 124.20 3mbf s ALA 222 Ca 0.02 -1.47 -0.26 0.00 0.00 0.00 0.00 51.96 50.26 3mbf s ALA 222 Cb -0.21 -0.22 -0.09 0.00 0.00 0.00 0.00 23.12 22.59 3mbf s ALA 222 CO 0.05 0.30 0.89 -1.12 0.00 0.00 0.00 175.76 175.87 3mbf s SER 223 N -2.52 7.35 0.57 0.00 0.01 -1.26 -1.81 113.70 116.04 3mbf s SER 223 Ca 0.15 1.77 -0.21 0.00 1.31 0.00 0.00 55.95 58.97 3mbf s SER 223 Cb -0.07 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 3mbf s SER 223 CO 0.07 0.01 1.33 -0.31 0.41 0.00 0.00 173.24 174.75 3mbf s TYR 224 N -1.48 2.27 -0.41 2.43 2.02 -1.26 -4.97 117.35 115.95 3mbf s TYR 224 Ca 0.46 1.41 -0.26 0.00 -0.37 0.00 0.00 57.07 58.31 3mbf s TYR 224 Cb -0.20 -3.74 0.02 0.00 -0.40 0.00 0.00 41.96 37.64 3mbf s TYR 224 CO 0.25 -2.80 0.96 0.08 -1.57 0.00 0.00 175.55 172.47 3mbf s VAL 225 N -1.35 4.49 0.23 0.71 1.01 -1.26 -4.98 120.40 119.25 3mbf s VAL 225 Ca 0.74 1.09 -0.07 0.00 0.00 0.00 0.00 61.98 63.74 3mbf s VAL 225 Cb -0.39 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 31.57 3mbf s VAL 225 CO 0.45 -0.69 0.33 0.42 0.00 0.00 0.00 175.10 175.61 3mbf s THR 226 N 3.71 0.00 0.79 3.92 -4.23 -1.26 -4.62 115.64 113.95 3mbf s THR 226 Ca 0.40 -1.67 -0.11 0.00 -1.18 0.00 0.00 61.69 59.12 3mbf s THR 226 Cb -0.11 -2.36 0.07 0.00 1.34 0.00 0.00 72.50 71.44 3mbf s THR 226 CO 0.23 0.00 1.10 -0.94 -0.54 0.00 0.00 174.62 174.46 3mbf s SER 227 N -3.10 4.56 0.53 3.99 1.04 -1.26 -4.48 113.70 114.98 3mbf s SER 227 Ca 0.30 1.31 -0.18 0.00 0.48 0.00 0.00 55.95 57.87 3mbf s SER 227 Cb 0.03 -2.05 -0.07 0.00 0.10 0.00 0.00 66.02 64.02 3mbf s SER 227 CO 0.11 -1.93 1.02 -0.83 0.98 0.00 0.00 173.24 172.60 3mbf s GLY 228 N -3.92 2.23 0.44 7.32 0.00 -0.12 -4.92 107.32 108.36 3mbf s GLY 228 Ca 0.61 0.39 0.17 0.00 0.00 0.00 0.00 44.72 45.89 3mbf s GLY 228 CO 0.54 0.69 1.94 -1.61 0.00 0.00 0.00 173.10 174.67 3mbf h GLN 229 N 0.97 0.34 -0.02 2.90 4.15 -0.83 -1.27 115.11 121.35 3mbf h GLN 229 Ca -0.48 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.92 3mbf h GLN 229 Cb 1.21 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.82 3mbf h GLN 229 CO 0.59 0.22 0.00 1.28 -1.93 0.00 0.00 178.83 178.99 3mbf n LEU 230 N -4.46 1.17 -4.84 -2.39 4.77 -0.78 -4.83 117.00 105.65 3mbf n LEU 230 Ca 0.13 -0.40 -0.32 0.00 -0.03 0.00 0.00 56.01 55.39 3mbf n LEU 230 Cb 0.52 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 3mbf n LEU 230 CO 0.34 0.20 0.64 -0.55 -1.33 0.00 0.00 177.39 176.69 3mbf s SER 231 N -1.98 6.73 -0.22 -1.43 0.15 -0.48 -4.84 113.70 111.64 3mbf s SER 231 Ca 0.40 1.57 0.09 0.00 0.70 0.00 0.00 55.95 58.70 3mbf s SER 231 Cb 0.21 -2.50 0.59 0.00 -1.71 0.00 0.00 66.02 62.61 3mbf s SER 231 CO 0.34 -0.48 1.50 0.59 1.20 0.00 0.00 173.24 176.39 3mbf n ASN 232 N -1.19 4.35 -4.75 5.45 3.02 -1.26 -4.93 115.26 115.94 3mbf n ASN 232 Ca 0.06 -2.82 -0.39 0.00 -0.03 0.00 0.00 54.58 51.40 3mbf n ASN 232 Cb 0.54 -0.67 -0.05 0.00 -0.61 0.00 0.00 39.78 38.99 3mbf n ASN 232 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3mbf s GLU 233 N -2.36 4.37 0.10 3.52 2.12 -1.26 -5.06 118.70 120.13 3mbf s GLU 233 Ca 0.42 0.81 -0.01 0.00 0.36 0.00 0.00 54.97 56.55 3mbf s GLU 233 Cb 0.32 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 31.32 3mbf s GLU 233 CO 0.11 0.33 0.28 -1.59 -0.54 0.00 0.00 175.26 173.84 3mbf s LYS 234 N -0.08 3.49 0.18 4.30 0.00 -1.26 -4.89 119.74 121.48 3mbf s LYS 234 Ca 0.33 -0.36 -0.02 0.00 0.00 0.00 0.00 55.97 55.92 3mbf s LYS 234 Cb -0.19 -2.97 -0.04 0.00 0.00 0.00 0.00 37.83 34.64 3mbf s LYS 234 CO 0.18 0.55 0.12 1.52 0.00 0.00 0.00 175.35 177.72 3mbf s TYR 235 N -1.61 1.04 0.29 1.78 -0.85 -1.26 -5.03 117.35 111.71 3mbf s TYR 235 Ca 0.37 -1.31 0.07 0.00 -0.52 0.00 0.00 57.07 55.68 3mbf s TYR 235 Cb -0.12 -0.51 -0.06 0.00 0.38 0.00 0.00 41.96 41.65 3mbf s TYR 235 CO 0.27 -0.62 -0.07 0.95 -1.52 0.00 0.00 175.55 174.56 3mbf s THR 236 N -4.12 1.75 0.33 -3.49 -4.23 -1.26 -5.03 115.64 99.58 3mbf s THR 236 Ca 0.34 -2.14 0.08 0.00 -1.18 0.00 0.00 61.69 58.79 3mbf s THR 236 Cb 0.07 -2.46 0.32 0.00 1.34 0.00 0.00 72.50 71.76 3mbf s THR 236 CO 0.09 -0.30 1.81 -0.65 -0.54 0.00 0.00 174.62 175.03 3mbf h PRO 237 N 2.25 0.68 -0.38 3.99 0.11 -1.97 -1.42 132.00 135.27 3mbf h PRO 237 Ca -0.40 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 3mbf h PRO 237 Cb 1.24 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3mbf h PRO 237 CO 0.67 0.45 0.02 -0.22 -0.21 0.00 0.00 178.00 178.72 3mbf h LYS 238 N 0.71 0.66 -0.53 1.05 1.63 -1.95 0.09 116.57 118.23 3mbf h LYS 238 Ca 0.54 -0.20 -0.06 0.00 -0.85 0.00 0.00 60.65 60.08 3mbf h LYS 238 Cb 0.91 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.46 3mbf h LYS 238 CO -0.31 0.75 0.11 -0.22 -3.45 0.00 0.00 179.45 176.32 3mbf h LYS 239 N 0.49 0.85 -0.49 1.90 3.64 -1.85 0.13 116.57 121.25 3mbf h LYS 239 Ca 0.11 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3mbf h LYS 239 Cb 0.43 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3mbf h LYS 239 CO 0.02 0.82 0.32 0.28 -2.27 0.00 0.00 179.45 178.62 3mbf h VAL 240 N 0.74 1.13 -0.29 2.00 2.07 -1.12 -0.85 116.25 119.92 3mbf h VAL 240 Ca 0.16 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.46 3mbf h VAL 240 Cb 0.37 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 3mbf h VAL 240 CO 0.01 0.13 0.13 0.00 0.02 0.00 0.00 177.57 177.85 3mbf h ALA 241 N 1.17 0.35 0.07 1.67 0.00 -0.64 0.12 119.26 122.00 3mbf h ALA 241 Ca 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3mbf h ALA 241 Cb -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3mbf h ALA 241 CO -0.04 -0.26 -0.03 1.15 0.00 0.00 0.00 179.25 180.07 3mbf h THR 242 N 0.28 1.01 -0.44 0.00 2.02 -0.49 -0.33 112.91 114.96 3mbf h THR 242 Ca 0.13 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.96 3mbf h THR 242 Cb 0.06 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3mbf h THR 242 CO -0.10 0.07 -0.05 -0.26 0.37 0.00 0.00 175.52 175.54 3mbf h PHE 243 N -0.20 0.90 -0.00 3.16 -1.00 -1.09 -0.59 116.94 118.11 3mbf h PHE 243 Ca -0.01 -0.18 -0.00 0.00 2.81 0.00 0.00 57.97 60.59 3mbf h PHE 243 Cb 0.18 -0.23 -0.00 0.00 3.61 0.00 0.00 35.95 39.51 3mbf h PHE 243 CO -0.04 0.89 -0.01 1.15 -1.61 0.00 0.00 178.31 178.70 3mbf h THR 244 N 0.65 1.43 -0.69 -1.55 2.02 -0.71 -1.88 112.91 112.18 3mbf h THR 244 Ca 0.12 -1.26 0.07 0.00 0.77 0.00 0.00 66.41 66.10 3mbf h THR 244 Cb 0.57 2.27 -0.06 0.00 -1.74 0.00 0.00 68.15 69.19 3mbf h THR 244 CO 0.03 0.33 0.38 0.25 0.37 0.00 0.00 175.52 176.88 3mbf h LEU 245 N -0.52 0.55 -0.98 2.58 5.85 -1.05 -1.75 115.31 119.99 3mbf h LEU 245 Ca 0.00 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3mbf h LEU 245 Cb 0.54 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 3mbf h LEU 245 CO 0.00 0.34 0.47 0.03 -0.34 0.00 0.00 178.44 178.95 3mbf h ARG 246 N 0.68 1.19 -0.84 1.25 3.08 -1.00 0.75 114.38 119.49 3mbf h ARG 246 Ca 0.31 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3mbf h ARG 246 Cb 0.23 -0.24 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 3mbf h ARG 246 CO -0.20 0.87 0.53 0.00 -1.07 0.00 0.00 179.97 180.09 3mbf h ALA 247 N 1.32 1.07 -0.03 0.04 0.00 -0.79 -1.45 119.26 119.42 3mbf h ALA 247 Ca 0.30 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3mbf h ALA 247 Cb 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3mbf h ALA 247 CO -0.05 0.51 -0.19 -0.07 0.00 0.00 0.00 179.25 179.45 3mbf h LEU 248 N 1.15 0.22 -1.92 0.00 3.38 -0.70 -2.76 115.31 114.67 3mbf h LEU 248 Ca 0.30 -0.68 0.10 0.00 0.09 0.00 0.00 57.88 57.70 3mbf h LEU 248 Cb -0.08 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3mbf h LEU 248 CO -0.06 0.86 0.29 -0.07 0.09 0.00 0.00 178.44 179.55 3mbf h LEU 249 N -0.40 0.08 -0.39 1.67 3.38 -0.87 0.45 115.31 119.22 3mbf h LEU 249 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3mbf h LEU 249 Cb 0.86 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3mbf h LEU 249 CO 0.04 0.05 0.00 0.28 0.09 0.00 0.00 178.44 178.90 3mbf h SER 250 N 0.09 0.00 0.00 -0.43 0.02 -1.09 -3.40 113.55 108.73 3mbf h SER 250 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 3mbf h SER 250 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 3mbf h SER 250 CO -0.02 0.00 -0.47 0.35 -1.14 0.00 0.00 176.83 175.56 3mbf n THR 251 N -2.77 0.00 -3.47 -2.27 -2.24 -0.78 -5.02 114.28 97.74 3mbf n THR 251 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.41 3mbf n THR 251 Cb 0.42 -0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 68.32 3mbf n THR 251 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3mbf s ILE 252 N -1.28 5.24 0.84 2.28 -1.09 0.08 -4.67 121.20 122.59 3mbf s ILE 252 Ca 0.00 -0.16 -0.13 0.00 -2.23 0.00 0.00 60.65 58.14 3mbf s ILE 252 Cb 0.00 -3.78 0.08 0.00 -1.58 0.00 0.00 42.46 37.18 3mbf s ILE 252 CO 0.00 -0.07 1.04 -2.65 -1.23 0.00 0.00 174.94 172.03 3mbf n PRO 253 N 5.22 0.02 0.13 2.79 -0.02 -1.26 -4.86 135.00 137.02 3mbf n PRO 253 Ca -0.11 0.08 0.15 0.00 -2.02 0.00 0.00 63.50 61.59 3mbf n PRO 253 Cb 0.49 -2.31 0.67 0.00 -0.02 0.00 0.00 33.50 32.34 3mbf n PRO 253 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mbf h GLY 255 N 0.00 0.00 -4.42 0.00 0.00 -1.92 -3.42 103.07 93.31 3mbf h GLY 255 Ca 0.13 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.94 3mbf h GLY 255 CO -0.00 0.00 0.77 -0.42 0.00 0.00 0.00 176.54 176.89 3mbf s ILE 256 N -3.49 2.87 -0.01 2.60 -1.09 -1.01 -3.28 121.20 117.78 3mbf s ILE 256 Ca 0.03 0.67 0.11 0.00 -2.23 0.00 0.00 60.65 59.24 3mbf s ILE 256 Cb 0.08 -3.43 -0.10 0.00 -1.58 0.00 0.00 42.46 37.43 3mbf s ILE 256 CO 0.57 0.08 1.28 1.55 -1.23 0.00 0.00 174.94 177.19 3mbf h PRO 257 N 6.00 0.00 -2.09 2.79 0.13 -1.77 -3.37 132.00 133.69 3mbf h PRO 257 Ca -0.44 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.74 3mbf h PRO 257 Cb 1.21 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.16 3mbf h PRO 257 CO 0.84 0.73 0.41 0.20 -0.23 0.00 0.00 178.00 179.95 3mbf s GLY 258 N -4.64 -0.45 -0.12 1.56 0.00 -1.26 -1.43 107.32 100.98 3mbf s GLY 258 Ca 0.02 1.33 -0.02 0.00 0.00 0.00 0.00 44.72 46.04 3mbf s GLY 258 CO 0.79 0.66 -0.04 -0.42 0.00 0.00 0.00 173.10 174.09 3mbf s ILE 259 N -2.17 3.92 -0.24 0.90 1.09 -0.10 -2.61 121.20 121.98 3mbf s ILE 259 Ca -0.01 -0.36 0.02 0.00 -1.10 0.00 0.00 60.65 59.20 3mbf s ILE 259 Cb -0.01 -2.68 0.06 0.00 -1.06 0.00 0.00 42.46 38.77 3mbf s ILE 259 CO -0.02 0.53 -0.09 0.68 -0.10 0.00 0.00 174.94 175.94 3mbf s VAL 260 N -0.10 1.88 0.25 2.92 -7.23 0.21 -1.01 120.40 117.33 3mbf s VAL 260 Ca 0.02 -1.41 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 3mbf s VAL 260 Cb -0.13 -2.04 -0.09 0.00 0.56 0.00 0.00 36.38 34.68 3mbf s VAL 260 CO 0.02 -0.03 1.20 -0.36 -0.31 0.00 0.00 175.10 175.62 3mbf s PHE 261 N 1.24 3.39 0.27 2.82 0.08 -0.12 -2.63 117.98 123.03 3mbf s PHE 261 Ca -0.07 1.49 -0.18 0.00 0.12 0.00 0.00 56.93 58.30 3mbf s PHE 261 Cb -0.19 -3.45 -0.09 0.00 -0.57 0.00 0.00 43.02 38.73 3mbf s PHE 261 CO -0.06 -1.18 0.73 -0.48 -0.10 0.00 0.00 175.22 174.14 3mbf s LEU 262 N -0.93 4.22 0.11 -0.37 0.05 -0.75 -0.04 118.68 120.98 3mbf s LEU 262 Ca 0.50 1.37 0.04 0.00 0.05 0.00 0.00 54.13 56.08 3mbf s LEU 262 Cb -0.34 -3.81 -0.21 0.00 -2.05 0.00 0.00 46.19 39.78 3mbf s LEU 262 CO 0.41 -0.08 1.26 0.77 -0.55 0.00 0.00 176.35 178.16 3mbf h SER 263 N 2.90 0.12 -0.02 1.48 4.64 -1.91 -3.42 113.55 117.34 3mbf h SER 263 Ca -0.48 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 60.70 3mbf h SER 263 Cb 1.18 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3mbf h SER 263 CO 0.65 1.08 -0.01 0.61 -0.87 0.00 0.00 176.83 178.30 3mbf n GLY 264 N 1.35 0.24 0.00 -0.77 0.00 -1.26 -0.85 105.19 103.89 3mbf n GLY 264 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3mbf n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mbf n GLY 265 N -0.58 0.53 3.83 -0.02 0.00 -1.26 -4.49 105.19 103.20 3mbf n GLY 265 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3mbf n GLY 265 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3mbf s HIS 266 N -2.00 3.13 0.43 1.61 3.76 -0.03 -4.99 115.29 117.20 3mbf s HIS 266 Ca 0.00 1.28 -0.23 0.00 -0.15 0.00 0.00 55.06 55.96 3mbf s HIS 266 Cb 0.00 -2.95 -0.11 0.00 1.11 0.00 0.00 32.58 30.63 3mbf s HIS 266 CO 0.00 -1.30 0.79 0.41 -0.85 0.00 0.00 174.74 173.78 3mbf n GLY 267 N -2.26 -0.83 0.28 -2.22 0.00 -1.26 -4.73 105.19 94.17 3mbf n GLY 267 Ca 0.07 0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 3mbf n GLY 267 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3mbf h SER 268 N 1.11 -0.79 -0.25 1.61 0.87 -1.88 0.53 113.55 114.74 3mbf h SER 268 Ca -0.43 0.21 0.05 0.00 -1.23 0.00 0.00 61.79 60.40 3mbf h SER 268 Cb 1.37 0.46 -0.05 0.00 -0.44 0.00 0.00 62.40 63.74 3mbf h SER 268 CO 0.54 -0.25 -0.09 -0.08 -0.53 0.00 0.00 176.83 176.42 3mbf h GLU 269 N -0.06 -0.04 -0.30 2.24 4.81 -1.90 -1.28 114.58 118.05 3mbf h GLU 269 Ca 0.29 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.38 3mbf h GLU 269 Cb 0.51 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3mbf h GLU 269 CO -0.69 -0.03 -0.42 -0.44 -0.73 0.00 0.00 179.01 176.71 3mbf h ASP 270 N -0.04 0.80 -0.59 1.04 3.32 -1.82 -0.94 116.42 118.19 3mbf h ASP 270 Ca 0.13 -0.38 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 3mbf h ASP 270 Cb 0.24 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3mbf h ASP 270 CO -0.29 1.12 0.17 0.00 -1.72 0.00 0.00 179.24 178.52 3mbf h ALA 271 N 0.92 0.78 -0.22 3.45 0.00 0.25 0.16 119.26 124.60 3mbf h ALA 271 Ca 0.04 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 3mbf h ALA 271 Cb 0.98 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3mbf h ALA 271 CO 0.09 0.46 -0.55 0.82 0.00 0.00 0.00 179.25 180.07 3mbf h ILE 272 N 0.85 1.30 -0.38 0.00 2.04 -1.21 -2.57 117.51 117.54 3mbf h ILE 272 Ca 0.19 -1.76 -0.10 0.00 1.00 0.00 0.00 64.86 64.19 3mbf h ILE 272 Cb 0.31 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 3mbf h ILE 272 CO -0.00 0.56 -0.18 1.23 0.00 0.00 0.00 178.15 179.76 3mbf h GLY 273 N 0.49 0.76 1.05 5.37 0.00 -0.92 -1.37 103.07 108.46 3mbf h GLY 273 Ca -0.01 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 3mbf h GLY 273 CO 0.12 0.56 0.55 0.74 0.00 0.00 0.00 176.54 178.50 3mbf h PHE 274 N 0.63 1.22 -0.41 5.60 0.04 -0.71 -0.57 116.94 122.74 3mbf h PHE 274 Ca 0.10 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.82 3mbf h PHE 274 Cb 0.65 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 3mbf h PHE 274 CO 0.03 0.82 0.08 1.25 -0.60 0.00 0.00 178.31 179.89 3mbf h LEU 275 N 1.27 0.64 -0.24 1.54 5.85 -1.00 -0.27 115.31 123.11 3mbf h LEU 275 Ca 0.33 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3mbf h LEU 275 Cb -0.04 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3mbf h LEU 275 CO -0.06 0.73 0.03 -1.13 -0.34 0.00 0.00 178.44 177.67 3mbf h ASN 276 N 0.53 0.38 -0.23 1.25 -1.24 -1.06 -2.09 115.58 113.12 3mbf h ASN 276 Ca 0.13 -0.27 0.04 0.00 0.71 0.00 0.00 56.30 56.90 3mbf h ASN 276 Cb 0.35 -0.10 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 3mbf h ASN 276 CO 0.01 0.55 0.02 0.00 -1.29 0.00 0.00 177.43 176.72 3mbf h ALA 277 N 0.84 0.22 -0.60 1.57 0.00 -0.99 -1.30 119.26 119.00 3mbf h ALA 277 Ca 0.07 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3mbf h ALA 277 Cb 0.34 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3mbf h ALA 277 CO 0.01 -0.41 0.30 0.97 0.00 0.00 0.00 179.25 180.12 3mbf h ILE 278 N 0.10 1.19 0.00 0.00 2.10 -0.90 -1.70 117.51 118.30 3mbf h ILE 278 Ca 0.11 -0.52 0.00 0.00 1.08 0.00 0.00 64.86 65.53 3mbf h ILE 278 Cb 0.12 0.42 0.00 0.00 -1.09 0.00 0.00 36.82 36.27 3mbf h ILE 278 CO -0.17 0.22 0.00 0.59 -1.08 0.00 0.00 178.15 177.72 3mbf n ASN 279 N -4.37 0.40 0.15 2.19 3.02 -0.80 -2.58 115.26 113.27 3mbf n ASN 279 Ca 0.05 0.57 0.11 0.00 -0.03 0.00 0.00 54.58 55.28 3mbf n ASN 279 Cb 0.12 -0.66 0.06 0.00 -0.61 0.00 0.00 39.78 38.69 3mbf n ASN 279 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 3mbf h MET 280 N 0.00 0.00 -7.00 3.52 2.86 -0.31 -3.41 114.93 110.60 3mbf h MET 280 Ca 0.00 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.10 3mbf h MET 280 Cb 0.46 0.00 0.11 0.00 0.06 0.00 0.00 31.60 32.23 3mbf h MET 280 CO 0.00 0.04 0.62 -1.21 1.06 0.00 0.00 176.91 177.42 3mbf s GLU 281 N -3.27 3.59 0.54 1.72 0.41 -1.05 -5.03 118.70 115.61 3mbf s GLU 281 Ca 0.02 2.21 -0.07 0.00 -0.41 0.00 0.00 54.97 56.72 3mbf s GLU 281 Cb 0.08 -2.52 -0.03 0.00 -1.78 0.00 0.00 34.13 29.88 3mbf s GLU 281 CO 0.74 -0.82 0.87 -0.98 -0.49 0.00 0.00 175.26 174.58 3mbf s ARG 282 N -2.57 3.45 0.00 1.61 1.70 -1.26 -5.01 118.95 116.87 3mbf s ARG 282 Ca 0.64 0.31 0.00 0.00 -0.47 0.00 0.00 55.73 56.21 3mbf s ARG 282 Cb -0.39 -2.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.71 3mbf s ARG 282 CO 0.49 -0.38 0.00 0.41 -1.08 0.00 0.00 175.30 174.73 3mbf n GLY 283 N -2.44 2.92 3.74 3.88 0.00 -1.26 -5.09 105.19 106.94 3mbf n GLY 283 Ca 0.03 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 3mbf n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mbf s ARG 285 N 0.16 0.70 -0.17 0.00 1.70 -1.26 -5.06 118.95 115.01 3mbf s ARG 285 Ca 0.68 -0.20 0.18 0.00 -0.47 0.00 0.00 55.73 55.92 3mbf s ARG 285 Cb -0.49 0.31 -0.26 0.00 -0.57 0.00 0.00 34.95 33.94 3mbf s ARG 285 CO 0.42 -0.20 0.15 0.25 -1.08 0.00 0.00 175.30 174.84 3mbf n THR 286 N 1.20 1.22 -2.98 4.99 -2.24 -1.26 -4.98 114.28 110.23 3mbf n THR 286 Ca -0.21 -0.81 -0.35 0.00 -2.27 0.00 0.00 64.05 60.41 3mbf n THR 286 Cb 0.56 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.30 3mbf n THR 286 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3mbf s TRP 287 N -2.63 3.53 0.63 4.78 1.48 -1.26 -4.96 118.94 120.52 3mbf s TRP 287 Ca -0.09 1.49 -0.16 0.00 -1.06 0.00 0.00 56.10 56.27 3mbf s TRP 287 Cb 0.07 -2.72 -0.01 0.00 -1.16 0.00 0.00 33.47 29.65 3mbf s TRP 287 CO 0.84 0.17 1.11 -1.12 -4.06 0.00 0.00 176.95 173.89 3mbf s SER 288 N -1.88 5.24 -0.31 -2.66 0.01 -0.52 -4.88 113.70 108.70 3mbf s SER 288 Ca 0.51 2.04 0.03 0.00 1.31 0.00 0.00 55.95 59.84 3mbf s SER 288 Cb -0.14 -2.56 0.09 0.00 0.21 0.00 0.00 66.02 63.62 3mbf s SER 288 CO 0.19 -1.54 0.02 -0.76 0.41 0.00 0.00 173.24 171.56 3mbf s LEU 289 N -4.63 4.02 0.00 2.44 1.43 -1.26 -0.93 118.68 119.75 3mbf s LEU 289 Ca 0.68 -1.88 0.00 0.00 -1.03 0.00 0.00 54.13 51.91 3mbf s LEU 289 Cb -0.21 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.53 3mbf s LEU 289 CO 0.38 -0.34 0.00 -0.24 0.23 0.00 0.00 176.35 176.38 3mbf n SER 290 N 4.40 0.34 -4.04 2.29 2.88 -0.18 -4.62 113.62 114.70 3mbf n SER 290 Ca -0.01 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.41 3mbf n SER 290 Cb 0.42 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.77 3mbf n SER 290 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3mbf s PHE 291 N 0.70 0.56 -0.40 0.66 -0.12 -1.26 -0.94 117.98 117.17 3mbf s PHE 291 Ca 0.00 -0.51 0.02 0.00 -0.05 0.00 0.00 56.93 56.39 3mbf s PHE 291 Cb 0.00 -0.34 0.16 0.00 -0.63 0.00 0.00 43.02 42.20 3mbf s PHE 291 CO 0.00 -0.11 0.29 0.45 -0.05 0.00 0.00 175.22 175.79 3mbf s SER 292 N -1.55 2.35 -0.11 1.98 0.15 0.95 0.07 113.70 117.54 3mbf s SER 292 Ca -0.12 -2.71 -0.05 0.00 0.70 0.00 0.00 55.95 53.78 3mbf s SER 292 Cb -0.10 -0.51 -0.04 0.00 -1.71 0.00 0.00 66.02 63.66 3mbf s SER 292 CO 0.00 -0.23 0.08 -0.36 1.20 0.00 0.00 173.24 173.93 3mbf s PHE 293 N 0.43 3.39 0.00 3.44 0.08 -0.83 -4.16 117.98 120.33 3mbf s PHE 293 Ca 0.25 0.35 0.00 0.00 0.12 0.00 0.00 56.93 57.66 3mbf s PHE 293 Cb -0.10 -1.89 0.00 0.00 -0.57 0.00 0.00 43.02 40.47 3mbf s PHE 293 CO -0.10 0.58 0.00 0.00 -0.10 0.00 0.00 175.22 175.60 3mbf n ALA 294 N 2.18 0.55 -0.14 5.36 0.00 -1.25 -0.27 120.51 126.93 3mbf n ALA 294 Ca -0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 53.44 53.04 3mbf n ALA 294 Cb 0.54 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.04 3mbf n ALA 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mbf h ARG 295 N 0.00 0.26 -0.04 0.00 3.08 -1.95 0.11 114.38 115.84 3mbf h ARG 295 Ca 0.00 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.05 3mbf h ARG 295 Cb 0.00 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3mbf h ARG 295 CO 0.00 0.17 0.04 0.00 -1.07 0.00 0.00 179.97 179.11 3mbf h ALA 296 N 1.33 1.89 0.00 0.04 0.00 -1.88 -0.78 119.26 119.85 3mbf h ALA 296 Ca 0.22 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.82 3mbf h ALA 296 Cb 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 3mbf h ALA 296 CO -0.26 -0.06 -2.00 1.28 0.00 0.00 0.00 179.25 178.21 3mbf n LEU 297 N -4.30 0.46 0.00 0.00 4.77 -0.49 -4.70 117.00 112.74 3mbf n LEU 297 Ca -0.02 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3mbf n LEU 297 Cb 0.13 0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3mbf n LEU 297 CO 0.32 0.41 -0.04 0.35 -1.33 0.00 0.00 177.39 177.10 3mbf n THR 298 N -2.88 0.00 -0.26 -5.08 -2.24 0.25 -4.56 114.28 99.50 3mbf n THR 298 Ca -0.23 -0.45 0.02 0.00 -2.27 0.00 0.00 64.05 61.12 3mbf n THR 298 Cb 1.07 0.96 0.15 0.00 -2.10 0.00 0.00 70.33 70.41 3mbf n THR 298 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3mbf h ASP 299 N 0.00 0.53 -0.03 3.42 3.32 -1.34 -0.58 116.42 121.74 3mbf h ASP 299 Ca 0.00 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 3mbf h ASP 299 Cb 0.00 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3mbf h ASP 299 CO 0.00 0.30 -0.14 1.23 -1.72 0.00 0.00 179.24 178.92 3mbf h GLY 300 N 0.67 0.37 0.69 2.75 0.00 -1.80 -0.75 103.07 104.99 3mbf h GLY 300 Ca 0.37 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 3mbf h GLY 300 CO -0.26 0.22 -0.05 -2.08 0.00 0.00 0.00 176.54 174.37 3mbf h VAL 301 N 0.32 1.32 -0.48 4.60 2.07 -1.61 -1.05 116.25 121.43 3mbf h VAL 301 Ca 0.06 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.50 3mbf h VAL 301 Cb 0.44 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 3mbf h VAL 301 CO 0.03 0.31 0.30 -0.07 0.02 0.00 0.00 177.57 178.16 3mbf h LEU 302 N -0.15 0.57 -0.59 2.57 3.38 -0.86 0.11 115.31 120.33 3mbf h LEU 302 Ca 0.02 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 3mbf h LEU 302 Cb 0.51 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3mbf h LEU 302 CO 0.02 0.44 0.03 -0.33 0.09 0.00 0.00 178.44 178.68 3mbf h GLU 303 N 0.65 1.02 -0.25 1.13 5.08 -1.12 -1.51 114.58 119.58 3mbf h GLU 303 Ca 0.17 -0.31 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 3mbf h GLU 303 Cb -0.04 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 3mbf h GLU 303 CO -0.03 1.00 -0.26 1.15 -1.00 0.00 0.00 179.01 179.86 3mbf h THR 304 N 0.92 1.31 0.38 1.13 2.02 -1.04 -3.38 112.91 114.25 3mbf h THR 304 Ca 0.17 -1.43 -0.02 0.00 0.77 0.00 0.00 66.41 65.90 3mbf h THR 304 Cb 0.52 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3mbf h THR 304 CO 0.02 0.45 -0.18 -0.25 0.37 0.00 0.00 175.52 175.93 3mbf h TRP 305 N 0.33 -0.47 -2.93 3.16 7.01 -0.69 -3.45 115.95 118.91 3mbf h TRP 305 Ca 0.04 -0.01 -0.40 0.00 2.11 0.00 0.00 58.89 60.63 3mbf h TRP 305 Cb 0.82 0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 28.02 3mbf h TRP 305 CO 0.08 -0.29 -0.52 0.54 -2.79 0.00 0.00 178.44 175.46 3mbf n ARG 306 N -4.62 -1.79 -1.02 2.65 1.74 -0.58 -1.83 116.66 111.22 3mbf n ARG 306 Ca -0.06 0.96 -0.01 0.00 -0.77 0.00 0.00 57.85 57.97 3mbf n ARG 306 Cb 0.20 -5.58 -0.00 0.00 -1.02 0.00 0.00 32.46 26.06 3mbf n ARG 306 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mbf n GLY 307 N -1.05 0.41 3.17 -0.13 0.00 -1.26 -4.81 105.19 101.52 3mbf n GLY 307 Ca -0.23 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 3mbf n GLY 307 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mbf s ASP 308 N -2.11 5.30 0.49 1.61 3.68 -0.76 -4.97 116.67 119.91 3mbf s ASP 308 Ca 0.00 -1.78 0.35 0.00 2.13 0.00 0.00 52.55 53.25 3mbf s ASP 308 Cb 0.00 -1.85 1.49 0.00 -1.45 0.00 0.00 42.92 41.10 3mbf s ASP 308 CO 0.00 -0.50 1.69 0.44 0.13 0.00 0.00 175.17 176.92 3mbf h ASP 309 N 8.14 0.15 -0.17 -0.34 5.19 -1.94 0.27 116.42 127.72 3mbf h ASP 309 Ca -0.17 0.06 0.05 0.00 -0.62 0.00 0.00 57.03 56.35 3mbf h ASP 309 Cb 1.06 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.60 3mbf h ASP 309 CO 0.69 -0.05 0.15 0.77 -3.12 0.00 0.00 179.24 177.68 3mbf h SER 310 N 0.09 0.00 0.06 6.45 4.64 -1.93 -2.04 113.55 120.82 3mbf h SER 310 Ca 0.74 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.06 3mbf h SER 310 Cb 2.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.70 3mbf h SER 310 CO -0.19 0.00 -0.06 0.59 -0.87 0.00 0.00 176.83 176.30 3mbf n ASN 311 N -4.17 1.29 -0.17 4.97 3.02 0.96 -4.53 115.26 116.62 3mbf n ASN 311 Ca 0.01 -1.31 -0.07 0.00 -0.03 0.00 0.00 54.58 53.18 3mbf n ASN 311 Cb 0.27 0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.49 3mbf n ASN 311 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3mbf h ILE 312 N 1.92 1.15 -0.49 2.41 2.04 -1.45 -1.13 117.51 121.97 3mbf h ILE 312 Ca 0.00 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 3mbf h ILE 312 Cb 0.47 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3mbf h ILE 312 CO 0.00 0.15 0.23 -0.08 0.00 0.00 0.00 178.15 178.45 3mbf h GLU 313 N 0.66 0.70 -0.51 2.37 4.81 -1.81 0.13 114.58 120.93 3mbf h GLU 313 Ca 0.18 -0.11 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 3mbf h GLU 313 Cb -0.02 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 29.18 3mbf h GLU 313 CO -0.03 0.59 0.20 1.49 -0.73 0.00 0.00 179.01 180.53 3mbf h GLU 314 N 0.64 0.37 -0.70 1.92 4.81 -1.83 -0.87 114.58 118.92 3mbf h GLU 314 Ca 0.17 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.42 3mbf h GLU 314 Cb 0.13 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 3mbf h GLU 314 CO -0.02 0.25 0.42 0.00 -0.73 0.00 0.00 179.01 178.93 3mbf h ALA 315 N 1.33 0.94 -0.19 2.92 0.00 0.12 -1.66 119.26 122.73 3mbf h ALA 315 Ca 0.25 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3mbf h ALA 315 Cb 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3mbf h ALA 315 CO -0.24 0.15 -0.46 1.96 0.00 0.00 0.00 179.25 180.66 3mbf h GLN 316 N 0.79 0.48 -0.41 0.00 4.20 -0.15 -2.13 115.11 117.89 3mbf h GLN 316 Ca 0.30 -0.26 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 3mbf h GLN 316 Cb 0.11 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 3mbf h GLN 316 CO -0.15 0.84 -0.14 -0.22 -0.67 0.00 0.00 178.83 178.49 3mbf h LYS 317 N 0.38 0.75 -0.64 1.46 3.64 -0.95 0.10 116.57 121.31 3mbf h LYS 317 Ca 0.02 -0.26 -0.08 0.00 -1.27 0.00 0.00 60.65 59.06 3mbf h LYS 317 Cb 0.96 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.70 3mbf h LYS 317 CO 0.08 0.85 0.09 0.82 -2.27 0.00 0.00 179.45 179.03 3mbf h ILE 318 N 0.67 1.26 -0.32 2.00 1.08 -1.02 -1.03 117.51 120.16 3mbf h ILE 318 Ca 0.11 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.52 3mbf h ILE 318 Cb 0.62 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 3mbf h ILE 318 CO 0.04 0.39 0.15 0.25 -0.69 0.00 0.00 178.15 178.29 3mbf h LEU 319 N 0.99 0.42 -0.93 1.44 5.85 -0.94 -0.33 115.31 121.81 3mbf h LEU 319 Ca 0.19 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 3mbf h LEU 319 Cb 0.45 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 3mbf h LEU 319 CO 0.02 0.43 -0.00 0.25 -0.34 0.00 0.00 178.44 178.79 3mbf h LEU 320 N 0.38 0.75 -0.23 2.25 5.85 -0.86 0.82 115.31 124.27 3mbf h LEU 320 Ca 0.11 -0.18 -0.16 0.00 0.84 0.00 0.00 57.88 58.49 3mbf h LEU 320 Cb 0.12 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3mbf h LEU 320 CO -0.01 0.82 -0.46 -0.33 -0.34 0.00 0.00 178.44 178.11 3mbf h GLU 321 N 0.73 0.71 -0.41 1.25 5.08 -0.99 -1.88 114.58 119.07 3mbf h GLU 321 Ca 0.14 -0.47 -0.14 0.00 -1.00 0.00 0.00 59.36 57.89 3mbf h GLU 321 Cb 0.45 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3mbf h GLU 321 CO 0.02 1.09 -0.31 1.15 -1.00 0.00 0.00 179.01 179.96 3mbf h THR 322 N 0.43 1.27 -0.74 1.13 2.02 -0.91 -2.13 112.91 113.99 3mbf h THR 322 Ca 0.01 -1.48 0.03 0.00 0.77 0.00 0.00 66.41 65.74 3mbf h THR 322 Cb 1.07 1.28 -0.05 0.00 -1.74 0.00 0.00 68.15 68.71 3mbf h THR 322 CO 0.10 0.50 0.47 0.28 0.37 0.00 0.00 175.52 177.24 3mbf h SER 323 N 0.77 0.77 -0.53 4.18 0.02 -0.82 -0.89 113.55 117.05 3mbf h SER 323 Ca 0.08 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3mbf h SER 323 Cb 0.89 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 3mbf h SER 323 CO 0.08 0.53 0.34 0.15 -1.14 0.00 0.00 176.83 176.79 3mbf h PHE 324 N 0.91 0.65 -0.53 3.45 3.57 -1.19 -0.59 116.94 123.21 3mbf h PHE 324 Ca 0.30 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 3mbf h PHE 324 Cb 0.02 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 3mbf h PHE 324 CO -0.04 0.40 0.13 0.87 -2.23 0.00 0.00 178.31 177.44 3mbf h LYS 325 N 0.69 0.85 -0.61 1.11 1.57 -0.87 -0.50 116.57 118.82 3mbf h LYS 325 Ca 0.20 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 3mbf h LYS 325 Cb -0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 3mbf h LYS 325 CO -0.06 0.81 0.06 0.00 -0.57 0.00 0.00 179.45 179.70 3mbf h ALA 326 N 1.01 0.96 -0.31 3.86 0.00 -0.97 0.30 119.26 124.11 3mbf h ALA 326 Ca 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3mbf h ALA 326 Cb 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3mbf h ALA 326 CO 0.00 0.64 0.11 0.00 0.00 0.00 0.00 179.25 180.00 3mbf h ARG 328 N 0.35 0.93 -0.31 0.00 2.47 -0.87 -2.11 114.38 114.84 3mbf h ARG 328 Ca 0.10 -0.06 -0.07 0.00 -1.26 0.00 0.00 59.98 58.69 3mbf h ARG 328 Cb 0.23 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.32 3mbf h ARG 328 CO -0.00 0.62 -0.12 0.78 0.56 0.00 0.00 179.97 181.81 3mbf h GLY 329 N 0.96 0.57 2.00 0.04 0.00 -0.74 0.28 103.07 106.18 3mbf h GLY 329 Ca 0.28 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3mbf h GLY 329 CO -0.08 0.37 0.00 0.00 0.00 0.00 0.00 176.54 176.83 3mbf h ALA 330 N 1.39 1.00 -0.51 3.60 0.00 -0.12 -1.66 119.26 122.96 3mbf h ALA 330 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mbf h ALA 330 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3mbf h ALA 330 CO 0.03 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.67 3mbf n GLU 331 N -2.97 2.85 -1.92 0.00 1.02 -0.76 -4.69 120.64 114.15 3mbf n GLU 331 Ca -0.01 -2.34 -0.15 0.00 -0.02 0.00 0.00 57.16 54.63 3mbf n GLU 331 Cb 0.15 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.12 3mbf n GLU 331 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3mbf n GLY 332 N 0.97 0.53 0.68 0.62 0.00 -0.63 -4.92 105.19 102.45 3mbf n GLY 332 Ca 0.17 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.98 3mbf n GLY 332 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mbf n LYS 333 N -2.51 2.01 0.16 1.61 5.02 0.02 -4.74 118.16 119.74 3mbf n LYS 333 Ca -0.17 -2.91 0.01 0.00 -2.02 0.00 0.00 58.31 53.23 3mbf n LYS 333 Cb 0.58 -1.71 0.32 0.00 -0.02 0.00 0.00 35.03 34.19 3mbf n LYS 333 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3mbf h LEU 334 N 0.98 0.04 -0.59 -0.35 5.85 -1.91 -1.27 115.31 118.07 3mbf h LEU 334 Ca 0.05 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3mbf h LEU 334 Cb 1.32 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 3mbf h LEU 334 CO 0.17 0.44 -0.06 -0.50 -0.34 0.00 0.00 178.44 178.15 3mbf h TRP 335 N 0.04 0.00 -3.21 1.25 4.06 -1.95 -3.45 115.95 112.69 3mbf h TRP 335 Ca 0.00 0.00 -0.58 0.00 2.06 0.00 0.00 58.89 60.37 3mbf h TRP 335 Cb 0.72 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.83 3mbf h TRP 335 CO 0.00 0.06 -0.09 -0.51 -3.56 0.00 0.00 178.44 174.34 3mbf s ASP 336 N -6.06 6.92 -0.07 -3.49 1.01 -0.48 -5.06 116.67 109.44 3mbf s ASP 336 Ca 0.04 1.09 -0.28 0.00 0.71 0.00 0.00 52.55 54.12 3mbf s ASP 336 Cb 0.07 -2.32 -0.02 0.00 1.01 0.00 0.00 42.92 41.65 3mbf s ASP 336 CO 0.63 0.21 0.90 -1.58 0.21 0.00 0.00 175.17 175.54 3mbf s GLN 337 N -0.63 4.46 0.00 8.23 0.74 -1.26 -5.01 119.66 126.19 3mbf s GLN 337 Ca 0.28 1.22 0.00 0.00 0.05 0.00 0.00 55.36 56.91 3mbf s GLN 337 Cb -0.18 -3.49 0.00 0.00 1.10 0.00 0.00 33.01 30.44 3mbf s GLN 337 CO 0.16 -0.13 0.25 -0.85 -0.55 0.00 0.00 175.29 174.16