#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nol h LEU 2 N 0.00 0.59 -1.78 1.09 5.85 -2.00 -2.29 115.31 116.77 1nol h LEU 2 Ca 0.00 -0.28 0.12 0.00 0.84 0.00 0.00 57.88 58.56 1nol h LEU 2 Cb 0.00 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1nol h LEU 2 CO 0.00 0.72 0.38 -0.74 -0.34 0.00 0.00 178.44 178.46 1nol h HIS 3 N 0.44 0.27 0.11 1.25 2.76 -1.99 0.64 115.15 118.63 1nol h HIS 3 Ca 0.11 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.28 1nol h HIS 3 Cb 0.39 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.27 1nol h HIS 3 CO 0.03 0.12 -0.05 -0.44 -1.30 0.00 0.00 177.93 176.29 1nol h ASP 4 N 0.24 -0.12 -0.90 3.26 3.32 -1.93 -2.79 116.42 117.50 1nol h ASP 4 Ca 0.26 -0.34 0.23 0.00 0.02 0.00 0.00 57.03 57.20 1nol h ASP 4 Cb 0.70 0.03 -0.13 0.00 0.22 0.00 0.00 39.33 40.15 1nol h ASP 4 CO -0.05 0.29 0.39 0.11 -1.72 0.00 0.00 179.24 178.26 1nol h LYS 5 N -0.56 0.37 -0.64 3.56 1.57 -0.92 0.52 116.57 120.47 1nol h LYS 5 Ca -0.01 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1nol h LYS 5 Cb 0.45 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1nol h LYS 5 CO 0.02 0.25 0.19 0.37 -0.57 0.00 0.00 179.45 179.71 1nol h GLN 6 N 0.38 0.98 -0.37 3.15 5.75 -0.82 -1.76 115.11 122.43 1nol h GLN 6 Ca 0.57 -0.20 -0.16 0.00 -0.15 0.00 0.00 58.65 58.72 1nol h GLN 6 Cb 1.10 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.49 1nol h GLN 6 CO -0.54 0.84 -0.38 0.82 -2.65 0.00 0.00 178.83 176.93 1nol h ILE 7 N 0.94 1.28 -0.65 2.39 2.04 -0.64 -1.06 117.51 121.81 1nol h ILE 7 Ca 0.21 -1.55 -0.09 0.00 1.00 0.00 0.00 64.86 64.43 1nol h ILE 7 Cb 0.28 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1nol h ILE 7 CO -0.01 0.52 0.06 0.03 0.00 0.00 0.00 178.15 178.75 1nol h ARG 8 N 0.71 1.09 -0.36 2.37 3.08 -1.29 -2.34 114.38 117.65 1nol h ARG 8 Ca 0.06 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 1nol h ARG 8 Cb 0.97 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 1nol h ARG 8 CO 0.09 1.03 0.18 0.82 -1.07 0.00 0.00 179.97 181.02 1nol h ILE 9 N 1.01 1.16 -0.93 2.04 2.04 -1.15 -3.03 117.51 118.65 1nol h ILE 9 Ca 0.19 -0.44 0.17 0.00 1.00 0.00 0.00 64.86 65.78 1nol h ILE 9 Cb 0.49 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.27 1nol h ILE 9 CO 0.02 0.17 0.59 0.00 0.00 0.00 0.00 178.15 178.93 1nol h HIS 11 N 0.63 0.00 0.00 0.00 3.86 -1.33 -1.44 115.15 116.87 1nol h HIS 11 Ca 0.49 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.67 1nol h HIS 11 Cb 0.89 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.36 1nol h HIS 11 CO -0.00 0.10 -0.12 -0.07 0.86 0.00 0.00 177.93 178.70 1nol h LEU 12 N 0.00 0.00 -3.34 2.43 3.38 -1.07 -3.25 115.31 113.46 1nol h LEU 12 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1nol h LEU 12 Cb 0.63 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 1nol h LEU 12 CO 0.01 0.12 0.01 0.49 0.09 0.00 0.00 178.44 179.17 1nol n PHE 13 N -4.06 1.14 -4.73 1.13 3.72 -0.55 -4.93 117.46 109.18 1nol n PHE 13 Ca -0.02 -1.17 -0.33 0.00 -0.05 0.00 0.00 57.45 55.87 1nol n PHE 13 Cb 0.21 -0.42 -0.14 0.00 -0.94 0.00 0.00 39.48 38.19 1nol n PHE 13 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1nol s GLU 14 N -3.00 3.38 -1.43 -1.08 2.12 -1.22 -4.59 118.70 112.90 1nol s GLU 14 Ca 0.44 -0.66 -0.02 0.00 0.36 0.00 0.00 54.97 55.09 1nol s GLU 14 Cb 0.37 -2.66 0.01 0.00 0.26 0.00 0.00 34.13 32.12 1nol s GLU 14 CO 0.06 0.24 0.47 1.04 -0.54 0.00 0.00 175.26 176.53 1nol n GLN 15 N 3.46 -3.43 0.10 4.30 1.13 0.77 -4.84 117.38 118.86 1nol n GLN 15 Ca -0.18 0.42 -0.04 0.00 -1.94 0.00 0.00 57.00 55.26 1nol n GLN 15 Cb 0.53 -4.63 0.03 0.00 0.11 0.00 0.00 30.24 26.27 1nol n GLN 15 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1nol h LEU 16 N -1.82 0.00 -0.99 1.08 5.85 -1.81 0.25 115.31 117.88 1nol h LEU 16 Ca -0.63 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 57.99 1nol h LEU 16 Cb 1.37 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 1nol h LEU 16 CO 0.63 0.80 -0.40 0.28 -0.34 0.00 0.00 178.44 179.41 1nol h SER 17 N 0.00 0.22 1.57 1.25 0.02 -1.88 -2.76 113.55 111.96 1nol h SER 17 Ca -0.01 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1nol h SER 17 Cb 1.44 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.92 1nol h SER 17 CO 0.10 0.60 -0.16 0.28 -1.14 0.00 0.00 176.83 176.52 1nol h SER 18 N 0.18 0.00 -1.44 3.07 0.02 -1.67 -3.39 113.55 110.32 1nol h SER 18 Ca 0.02 -0.02 0.44 0.00 -0.84 0.00 0.00 61.79 61.38 1nol h SER 18 Cb 0.79 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.23 1nol h SER 18 CO 0.06 0.01 0.98 0.00 -1.14 0.00 0.00 176.83 176.75 1nol h ALA 19 N 2.27 3.04 0.01 3.77 0.00 -0.23 0.26 119.26 128.37 1nol h ALA 19 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1nol h ALA 19 Cb 0.87 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1nol h ALA 19 CO 0.00 -1.59 -0.00 1.15 0.00 0.00 0.00 179.25 178.80 1nol h THR 20 N 0.08 1.61 -2.31 0.00 2.02 -1.75 -3.42 112.91 109.15 1nol h THR 20 Ca 0.79 -1.99 -0.81 0.00 0.77 0.00 0.00 66.41 65.18 1nol h THR 20 Cb 2.74 2.94 -0.26 0.00 -1.74 0.00 0.00 68.15 71.83 1nol h THR 20 CO -0.24 0.51 1.08 1.33 0.37 0.00 0.00 175.52 178.56 1nol n VAL 21 N -4.68 5.90 0.00 3.16 0.24 0.90 -5.00 118.33 118.85 1nol n VAL 21 Ca -0.09 -5.87 0.00 0.00 -2.04 0.00 0.00 64.34 56.34 1nol n VAL 21 Cb 0.40 -1.69 0.00 0.00 -1.47 0.00 0.00 33.84 31.08 1nol n VAL 21 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1nol n HIS 30 N 0.36 0.00 0.00 6.34 -0.00 -1.26 -4.96 115.22 115.71 1nol n HIS 30 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.16 1nol n HIS 30 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.26 1nol n HIS 30 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 1nol n SER 31 N -0.12 0.00 0.21 0.26 7.64 -1.26 -4.87 113.62 115.48 1nol n SER 31 Ca 0.00 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.02 1nol n SER 31 Cb 0.00 0.00 0.75 0.00 -1.01 0.00 0.00 64.21 63.95 1nol n SER 31 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1nol h ASP 32 N 0.00 0.00 0.15 6.43 3.04 -2.06 -1.25 116.42 122.73 1nol h ASP 32 Ca 0.00 0.00 -0.12 0.00 -3.24 0.00 0.00 57.03 53.67 1nol h ASP 32 Cb 0.00 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.28 1nol h ASP 32 CO 0.00 0.00 -0.42 0.03 -2.04 0.00 0.00 179.24 176.81 1nol h ARG 33 N 0.00 0.34 -0.82 4.15 3.08 -2.04 -3.17 114.38 115.92 1nol h ARG 33 Ca 0.00 -0.17 -0.52 0.00 0.07 0.00 0.00 59.98 59.36 1nol h ARG 33 Cb 0.04 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 29.81 1nol h ARG 33 CO 0.00 0.71 0.31 1.28 -1.07 0.00 0.00 179.97 181.20 1nol n LEU 34 N -4.01 6.24 0.07 3.04 4.77 -0.48 -4.58 117.00 122.05 1nol n LEU 34 Ca -0.02 -4.13 -0.06 0.00 -0.03 0.00 0.00 56.01 51.78 1nol n LEU 34 Cb 0.50 -0.76 -0.10 0.00 -2.33 0.00 0.00 43.42 40.73 1nol n LEU 34 CO 0.43 1.46 0.16 0.07 -1.33 0.00 0.00 177.39 178.18 1nol h LYS 35 N 1.61 0.00 -0.61 3.23 2.10 -1.52 -3.32 116.57 118.06 1nol h LYS 35 Ca 0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.14 1nol h LYS 35 Cb 1.56 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.89 1nol h LYS 35 CO 1.09 0.90 0.00 0.09 -2.00 0.00 0.00 179.45 179.53 1nol n ASN 36 N -3.32 3.50 -4.33 7.07 3.02 -1.26 -4.90 115.26 115.05 1nol n ASN 36 Ca -0.00 -2.15 -0.18 0.00 -0.03 0.00 0.00 54.58 52.22 1nol n ASN 36 Cb 0.91 -0.45 -0.10 0.00 -0.61 0.00 0.00 39.78 39.54 1nol n ASN 36 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1nol s VAL 37 N -1.44 1.66 0.00 2.41 0.11 -1.25 -4.79 120.40 117.10 1nol s VAL 37 Ca 0.41 -2.19 0.00 0.00 -2.93 0.00 0.00 61.98 57.26 1nol s VAL 37 Cb 0.23 -2.03 0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1nol s VAL 37 CO 0.24 -0.61 0.00 0.61 -3.33 0.00 0.00 175.10 172.01 1nol n GLY 38 N -0.36 1.30 0.15 6.54 0.00 -1.26 -5.01 105.19 106.55 1nol n GLY 38 Ca -0.08 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.45 1nol n GLY 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nol n LYS 39 N -0.64 0.59 -2.55 1.61 5.02 -1.26 -4.89 118.16 116.05 1nol n LYS 39 Ca 0.00 0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 56.08 1nol n LYS 39 Cb 0.15 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 1nol n LYS 39 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1nol s LEU 40 N -7.12 4.10 0.24 -0.35 2.96 -1.26 -4.98 118.68 112.27 1nol s LEU 40 Ca -0.37 1.46 -0.31 0.00 -0.22 0.00 0.00 54.13 54.69 1nol s LEU 40 Cb 0.13 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 43.14 1nol s LEU 40 CO 0.51 -0.75 1.41 0.00 -1.32 0.00 0.00 176.35 176.20 1nol n GLN 41 N 6.54 2.04 -1.59 1.98 3.00 -1.26 -3.06 117.38 125.03 1nol n GLN 41 Ca 0.13 0.73 -0.42 0.00 -0.01 0.00 0.00 57.00 57.43 1nol n GLN 41 Cb 0.46 -2.38 0.01 0.00 0.00 0.00 0.00 30.24 28.32 1nol n GLN 41 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1nol n PRO 42 N 1.99 1.23 0.00 -1.09 -0.02 -1.26 -2.28 135.00 133.56 1nol n PRO 42 Ca 0.11 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1nol n PRO 42 Cb 0.32 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1nol n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nol n GLY 43 N 1.27 2.69 3.75 -1.23 0.00 -1.26 -5.00 105.19 105.42 1nol n GLY 43 Ca 0.10 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1nol n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nol s ALA 44 N -1.42 2.54 0.12 4.61 0.00 -0.97 -4.73 121.76 121.91 1nol s ALA 44 Ca 0.00 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.66 1nol s ALA 44 Cb 0.00 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 1nol s ALA 44 CO 0.00 -1.17 1.17 0.42 0.00 0.00 0.00 175.76 176.19 1nol s ILE 45 N -1.60 3.86 -0.06 0.00 1.01 -1.26 -4.85 121.20 118.30 1nol s ILE 45 Ca 0.77 1.46 -0.20 0.00 0.00 0.00 0.00 60.65 62.69 1nol s ILE 45 Cb -0.30 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.19 1nol s ILE 45 CO 0.33 0.18 0.55 0.12 0.00 0.00 0.00 174.94 176.12 1nol s PHE 46 N 0.43 3.59 -0.16 3.97 5.36 -1.26 -4.98 117.98 124.93 1nol s PHE 46 Ca 0.55 1.06 -0.14 0.00 -0.96 0.00 0.00 56.93 57.43 1nol s PHE 46 Cb -0.30 -2.59 -0.05 0.00 -0.34 0.00 0.00 43.02 39.74 1nol s PHE 46 CO 0.33 0.25 0.30 0.45 -1.46 0.00 0.00 175.22 175.08 1nol s SER 47 N 0.27 6.44 0.00 6.13 0.15 -1.26 -4.59 113.70 120.85 1nol s SER 47 Ca 0.29 0.52 0.27 0.00 0.70 0.00 0.00 55.95 57.73 1nol s SER 47 Cb -0.17 -2.19 1.47 0.00 -1.71 0.00 0.00 66.02 63.43 1nol s SER 47 CO 0.14 0.09 1.96 0.00 1.20 0.00 0.00 173.24 176.64 1nol n PHE 49 N -0.62 0.00 -1.68 0.00 3.72 -1.26 -4.95 117.46 112.67 1nol n PHE 49 Ca 0.20 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.15 1nol n PHE 49 Cb 0.16 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 1nol n PHE 49 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1nol n HIS 50 N -2.20 2.29 -0.13 1.38 -0.00 -1.26 -4.82 115.22 110.48 1nol n HIS 50 Ca 0.00 0.35 -0.05 0.00 0.46 0.00 0.00 57.72 58.49 1nol n HIS 50 Cb 0.42 -2.51 0.04 0.00 -0.12 0.00 0.00 29.99 27.82 1nol n HIS 50 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1nol h PRO 51 N 4.87 0.31 0.00 1.57 0.11 -1.96 -2.28 132.00 134.62 1nol h PRO 51 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1nol h PRO 51 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1nol h PRO 51 CO 0.81 0.20 0.00 -0.44 -0.21 0.00 0.00 178.00 178.36 1nol h ASP 52 N 0.32 0.00 0.17 -2.05 3.32 -1.97 -0.17 116.42 116.03 1nol h ASP 52 Ca 0.20 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.01 1nol h ASP 52 Cb 0.19 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.76 1nol h ASP 52 CO -0.20 0.00 -1.09 0.45 -1.72 0.00 0.00 179.24 176.68 1nol h HIS 53 N 0.00 0.65 0.00 4.55 3.86 -1.82 -3.13 115.15 119.27 1nol h HIS 53 Ca 0.00 -0.48 -0.06 0.00 -1.16 0.00 0.00 60.37 58.68 1nol h HIS 53 Cb 0.62 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 1nol h HIS 53 CO 0.00 1.42 -0.26 -0.07 0.86 0.00 0.00 177.93 179.87 1nol h LEU 54 N -0.22 0.00 -0.25 2.43 3.38 -1.02 -1.30 115.31 118.33 1nol h LEU 54 Ca -0.20 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 1nol h LEU 54 Cb 1.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.55 1nol h LEU 54 CO 0.17 0.26 -0.07 -0.08 0.09 0.00 0.00 178.44 178.82 1nol h GLU 55 N 0.00 0.49 -0.21 1.13 4.81 -1.14 -0.46 114.58 119.19 1nol h GLU 55 Ca -0.00 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 58.92 1nol h GLU 55 Cb 0.53 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1nol h GLU 55 CO 0.03 0.72 -0.34 1.49 -0.73 0.00 0.00 179.01 180.18 1nol h GLU 56 N 0.23 0.45 -0.57 1.92 4.81 -1.42 -0.98 114.58 119.02 1nol h GLU 56 Ca 0.06 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 59.01 1nol h GLU 56 Cb 0.54 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1nol h GLU 56 CO 0.03 0.74 0.01 0.00 -0.73 0.00 0.00 179.01 179.06 1nol h ALA 57 N 1.25 0.94 -0.04 2.92 0.00 -1.04 -1.67 119.26 121.62 1nol h ALA 57 Ca 0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1nol h ALA 57 Cb 0.78 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1nol h ALA 57 CO 0.06 0.64 0.01 -0.09 0.00 0.00 0.00 179.25 179.87 1nol h ARG 58 N 0.90 0.07 -0.69 0.00 2.43 -0.91 -1.26 114.38 114.93 1nol h ARG 58 Ca 0.17 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.45 1nol h ARG 58 Cb 0.51 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.95 1nol h ARG 58 CO 0.02 0.28 0.20 0.45 -1.51 0.00 0.00 179.97 179.42 1nol h HIS 59 N -0.15 0.33 -0.50 2.20 3.86 -1.04 -0.19 115.15 119.66 1nol h HIS 59 Ca 0.01 0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.19 1nol h HIS 59 Cb 0.24 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 1nol h HIS 59 CO 0.01 -0.01 0.04 1.25 0.86 0.00 0.00 177.93 180.07 1nol h LEU 60 N 0.33 0.83 -0.19 2.43 5.85 -0.95 -2.91 115.31 120.71 1nol h LEU 60 Ca 0.37 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1nol h LEU 60 Cb 0.58 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1nol h LEU 60 CO -0.43 0.92 0.00 0.10 -0.34 0.00 0.00 178.44 178.69 1nol h TYR 61 N 0.73 0.00 -0.18 1.25 -0.00 -0.61 -2.45 116.97 115.70 1nol h TYR 61 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.83 1nol h TYR 61 Cb 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.19 1nol h TYR 61 CO 0.03 0.00 -0.06 0.93 -0.00 0.00 0.00 178.16 179.06 1nol h GLU 62 N 0.00 0.36 -0.51 0.10 5.08 -0.89 -0.32 114.58 118.40 1nol h GLU 62 Ca 0.00 -0.14 0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1nol h GLU 62 Cb 0.70 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.86 1nol h GLU 62 CO 0.00 0.64 0.08 0.28 -1.00 0.00 0.00 179.01 179.01 1nol h VAL 63 N 0.06 0.69 -0.65 3.13 2.07 -1.29 -0.29 116.25 119.97 1nol h VAL 63 Ca 0.04 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 1nol h VAL 63 Cb 0.52 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1nol h VAL 63 CO 0.02 0.04 0.16 -0.26 0.02 0.00 0.00 177.57 177.55 1nol h PHE 64 N 0.21 1.06 -0.24 1.57 0.04 -1.38 -2.90 116.94 115.30 1nol h PHE 64 Ca 0.26 -0.11 -0.08 0.00 2.80 0.00 0.00 57.97 60.83 1nol h PHE 64 Cb 0.36 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1nol h PHE 64 CO -0.25 0.87 -0.17 2.35 -0.60 0.00 0.00 178.31 180.51 1nol h TRP 65 N 0.98 0.64 0.00 -0.55 2.91 -0.30 -2.91 115.95 116.72 1nol h TRP 65 Ca 0.21 -0.17 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1nol h TRP 65 Cb 0.34 -0.14 0.00 0.00 -0.51 0.00 0.00 29.16 28.85 1nol h TRP 65 CO 0.02 0.84 0.00 0.39 -1.03 0.00 0.00 178.44 178.66 1nol n GLU 66 N -4.43 0.97 -3.22 2.65 1.02 -0.19 -4.82 120.64 112.62 1nol n GLU 66 Ca -0.04 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.70 1nol n GLU 66 Cb 0.39 -1.04 -0.07 0.00 -0.02 0.00 0.00 31.44 30.70 1nol n GLU 66 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nol s ALA 67 N -0.03 3.56 0.42 0.62 0.00 -1.10 -4.93 121.76 120.30 1nol s ALA 67 Ca 0.00 -0.43 0.27 0.00 0.00 0.00 0.00 51.96 51.80 1nol s ALA 67 Cb 0.00 -2.86 1.35 0.00 0.00 0.00 0.00 23.12 21.61 1nol s ALA 67 CO 0.00 -0.53 1.65 0.78 0.00 0.00 0.00 175.76 177.66 1nol h GLY 68 N 8.18 1.39 -1.28 0.00 0.00 -1.91 -3.45 103.07 106.00 1nol h GLY 68 Ca -0.32 -0.14 0.04 0.00 0.00 0.00 0.00 47.33 46.91 1nol h GLY 68 CO 0.74 -0.39 0.37 0.51 0.00 0.00 0.00 176.54 177.77 1nol s ASP 69 N -4.64 -0.01 0.25 0.19 -4.77 -1.26 -5.03 116.67 101.40 1nol s ASP 69 Ca -0.08 -0.98 -0.03 0.00 -3.30 0.00 0.00 52.55 48.16 1nol s ASP 69 Cb 0.29 0.74 0.43 0.00 -1.09 0.00 0.00 42.92 43.30 1nol s ASP 69 CO 0.81 -1.47 1.82 0.15 0.70 0.00 0.00 175.17 177.18 1nol h PHE 70 N 2.00 0.92 -0.03 2.11 3.57 -1.94 -0.75 116.94 122.82 1nol h PHE 70 Ca -0.30 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.10 1nol h PHE 70 Cb 1.24 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 1nol h PHE 70 CO 1.32 0.37 -0.57 -0.91 -2.23 0.00 0.00 178.31 176.29 1nol h ASN 71 N 0.84 0.12 0.48 0.41 2.35 -1.97 -0.16 115.58 117.64 1nol h ASN 71 Ca 0.42 -0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.98 1nol h ASN 71 Cb 0.39 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 1nol h ASN 71 CO -0.25 0.66 -0.57 -0.78 -1.65 0.00 0.00 177.43 174.84 1nol h ASP 72 N 0.08 0.10 -0.09 5.81 3.58 -1.59 -1.26 116.42 123.06 1nol h ASP 72 Ca -0.00 -0.06 -0.13 0.00 0.42 0.00 0.00 57.03 57.26 1nol h ASP 72 Cb 1.04 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 42.06 1nol h ASP 72 CO 0.08 0.65 -0.47 0.15 -2.88 0.00 0.00 179.24 176.78 1nol h PHE 73 N 0.07 0.63 -0.17 0.28 3.57 -0.17 -2.06 116.94 119.10 1nol h PHE 73 Ca -0.00 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.19 1nol h PHE 73 Cb 1.03 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1nol h PHE 73 CO 0.01 1.06 -0.00 0.82 -2.23 0.00 0.00 178.31 177.96 1nol h ILE 74 N 0.03 1.11 0.35 1.41 1.08 -0.91 -2.42 117.51 118.17 1nol h ILE 74 Ca -0.03 -0.44 -0.02 0.00 -0.39 0.00 0.00 64.86 63.98 1nol h ILE 74 Cb 1.12 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 35.86 1nol h ILE 74 CO 0.10 0.15 -0.17 -0.33 -0.69 0.00 0.00 178.15 177.20 1nol h GLU 75 N 0.24 -0.45 -0.64 2.37 5.08 -1.09 -0.30 114.58 119.80 1nol h GLU 75 Ca 0.06 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1nol h GLU 75 Cb 0.17 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 1nol h GLU 75 CO 0.00 -0.13 0.42 0.97 -1.00 0.00 0.00 179.01 179.28 1nol h ILE 76 N -0.85 1.15 0.11 3.13 6.09 -1.36 -2.03 117.51 123.74 1nol h ILE 76 Ca -0.05 -0.29 -0.01 0.00 -1.37 0.00 0.00 64.86 63.14 1nol h ILE 76 Cb 0.53 0.22 0.00 0.00 0.47 0.00 0.00 36.82 38.05 1nol h ILE 76 CO 0.08 0.16 -0.05 0.00 -3.07 0.00 0.00 178.15 175.26 1nol h ALA 77 N 1.60 -0.14 -0.03 0.18 0.00 -1.39 0.15 119.26 119.63 1nol h ALA 77 Ca 0.24 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1nol h ALA 77 Cb -0.08 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1nol h ALA 77 CO -0.05 -0.52 0.03 0.87 0.00 0.00 0.00 179.25 179.58 1nol h LYS 78 N -0.27 0.00 0.19 0.00 1.57 -0.38 0.07 116.57 117.74 1nol h LYS 78 Ca -0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.45 1nol h LYS 78 Cb 0.22 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.55 1nol h LYS 78 CO 0.02 0.00 -1.50 1.49 -0.57 0.00 0.00 179.45 178.90 1nol h GLU 79 N 0.00 0.39 -0.01 3.15 4.81 -1.16 -3.38 114.58 118.38 1nol h GLU 79 Ca 0.02 -0.67 -0.17 0.00 -0.13 0.00 0.00 59.36 58.40 1nol h GLU 79 Cb 0.07 0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1nol h GLU 79 CO -0.00 1.32 -0.80 0.00 -0.73 0.00 0.00 179.01 178.81 1nol h ALA 80 N 0.08 0.65 0.00 2.92 0.00 0.11 -2.37 119.26 120.66 1nol h ALA 80 Ca -0.29 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 53.93 1nol h ALA 80 Cb 1.99 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1nol h ALA 80 CO 0.18 0.92 0.00 2.89 0.00 0.00 0.00 179.25 183.23 1nol n ARG 81 N -3.67 0.06 0.20 0.00 1.85 -0.22 -1.58 116.66 113.31 1nol n ARG 81 Ca -0.02 0.25 0.09 0.00 -1.00 0.00 0.00 57.85 57.17 1nol n ARG 81 Cb 0.76 -1.50 0.18 0.00 -1.05 0.00 0.00 32.46 30.84 1nol n ARG 81 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1nol h THR 82 N 0.00 0.31 0.00 8.89 1.35 -1.60 -3.39 112.91 118.48 1nol h THR 82 Ca 0.00 -1.36 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 1nol h THR 82 Cb 0.05 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1nol h THR 82 CO 0.00 0.17 -0.19 2.22 -0.25 0.00 0.00 175.52 177.47 1nol n PHE 83 N -3.16 0.00 -1.82 4.73 -1.74 -0.61 -4.41 117.46 110.45 1nol n PHE 83 Ca 0.03 0.00 -0.31 0.00 -0.56 0.00 0.00 57.45 56.61 1nol n PHE 83 Cb 0.57 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.60 1nol n PHE 83 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1nol s VAL 84 N -0.70 4.37 0.26 1.97 -7.23 -0.75 -4.52 120.40 113.79 1nol s VAL 84 Ca 0.00 0.77 -0.30 0.00 -1.81 0.00 0.00 61.98 60.63 1nol s VAL 84 Cb 0.00 -3.71 -0.13 0.00 0.56 0.00 0.00 36.38 33.09 1nol s VAL 84 CO 0.00 -1.01 1.32 -3.20 -0.31 0.00 0.00 175.10 171.91 1nol n ASN 85 N -2.87 2.48 0.19 4.85 2.85 -1.17 -4.64 115.26 116.95 1nol n ASN 85 Ca 0.06 1.16 0.06 0.00 -0.11 0.00 0.00 54.58 55.75 1nol n ASN 85 Cb 0.54 -1.41 0.37 0.00 1.24 0.00 0.00 39.78 40.53 1nol n ASN 85 CO 0.00 0.00 0.00 1.05 -2.11 0.00 0.00 177.26 176.20 1nol h GLU 86 N 3.60 0.00 -0.03 1.20 9.09 -1.89 -1.76 114.58 124.80 1nol h GLU 86 Ca -0.45 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 58.78 1nol h GLU 86 Cb 1.29 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.40 1nol h GLU 86 CO 0.71 0.35 -0.70 0.78 0.05 0.00 0.00 179.01 180.21 1nol h GLY 87 N 1.90 0.58 0.30 1.06 0.00 -1.89 -1.69 103.07 103.33 1nol h GLY 87 Ca -0.00 -0.97 0.06 0.00 0.00 0.00 0.00 47.33 46.42 1nol h GLY 87 CO 0.05 0.86 -0.15 -2.00 0.00 0.00 0.00 176.54 175.29 1nol h LEU 88 N 0.09 -0.50 -0.21 3.11 6.46 -1.92 -1.93 115.31 120.40 1nol h LEU 88 Ca -0.08 0.11 0.04 0.00 -0.12 0.00 0.00 57.88 57.83 1nol h LEU 88 Cb 1.38 0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 41.53 1nol h LEU 88 CO 0.14 -0.19 -0.05 0.15 -0.62 0.00 0.00 178.44 177.87 1nol h PHE 89 N -0.13 -0.11 -0.45 1.25 3.57 -1.24 -0.27 116.94 119.56 1nol h PHE 89 Ca 0.14 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1nol h PHE 89 Cb 0.34 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1nol h PHE 89 CO -0.33 -0.09 0.30 0.00 -2.23 0.00 0.00 178.31 175.97 1nol h ALA 90 N 1.21 1.74 0.16 2.41 0.00 -0.95 -1.54 119.26 122.29 1nol h ALA 90 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1nol h ALA 90 Cb 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1nol h ALA 90 CO -0.22 0.22 -0.08 0.35 0.00 0.00 0.00 179.25 179.53 1nol h PHE 91 N 0.56 -0.20 -0.12 0.00 3.04 -0.50 -2.15 116.94 117.57 1nol h PHE 91 Ca 0.18 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.05 1nol h PHE 91 Cb 0.02 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 38.58 1nol h PHE 91 CO -0.00 0.14 -0.25 0.00 -2.02 0.00 0.00 178.31 176.18 1nol h ALA 92 N 0.21 1.36 0.24 2.41 0.00 -0.85 -2.45 119.26 120.18 1nol h ALA 92 Ca -0.02 -0.29 -0.33 0.00 0.00 0.00 0.00 54.91 54.27 1nol h ALA 92 Cb 0.43 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.16 1nol h ALA 92 CO 0.04 0.44 -1.48 0.00 0.00 0.00 0.00 179.25 178.25 1nol h ALA 93 N 1.55 -0.11 -0.57 0.00 0.00 -1.28 -2.43 119.26 116.42 1nol h ALA 93 Ca 0.03 -0.89 -0.06 0.00 0.00 0.00 0.00 54.91 54.00 1nol h ALA 93 Cb 0.55 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1nol h ALA 93 CO 0.04 0.75 0.12 1.49 0.00 0.00 0.00 179.25 181.64 1nol h GLU 94 N 0.14 0.90 -0.63 0.00 4.81 -1.40 0.58 114.58 118.99 1nol h GLU 94 Ca -0.25 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1nol h GLU 94 Cb 2.15 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 31.37 1nol h GLU 94 CO 0.26 0.83 0.34 0.28 -0.73 0.00 0.00 179.01 179.99 1nol h VAL 95 N 0.86 1.19 -0.22 0.32 2.07 -1.46 -2.19 116.25 116.84 1nol h VAL 95 Ca 0.18 -0.49 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 1nol h VAL 95 Cb 0.35 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1nol h VAL 95 CO 0.00 0.21 -0.10 0.00 0.02 0.00 0.00 177.57 177.71 1nol h ALA 96 N 1.50 0.30 -0.21 1.67 0.00 -0.80 -3.04 119.26 118.67 1nol h ALA 96 Ca 0.22 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1nol h ALA 96 Cb 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1nol h ALA 96 CO -0.04 0.14 -0.23 0.28 0.00 0.00 0.00 179.25 179.40 1nol h VAL 97 N 0.15 1.25 0.00 0.00 2.07 -0.83 -0.25 116.25 118.64 1nol h VAL 97 Ca 0.05 -1.16 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 1nol h VAL 97 Cb 0.59 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1nol h VAL 97 CO 0.03 0.36 -0.24 -0.07 0.02 0.00 0.00 177.57 177.67 1nol h LEU 98 N 0.34 0.00 0.00 2.57 3.38 -1.34 -3.38 115.31 116.88 1nol h LEU 98 Ca 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1nol h LEU 98 Cb 0.59 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1nol h LEU 98 CO 0.04 0.24 -1.16 1.41 0.09 0.00 0.00 178.44 179.06 1nol n HIS 99 N -3.42 0.00 -1.69 1.13 8.25 -0.97 -4.98 115.22 113.54 1nol n HIS 99 Ca 0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.02 1nol n HIS 99 Cb 0.44 -0.12 -0.04 0.00 1.12 0.00 0.00 29.99 31.39 1nol n HIS 99 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1nol n ARG 100 N -2.16 2.48 -0.33 -0.41 1.74 -0.14 -4.92 116.66 112.91 1nol n ARG 100 Ca -0.04 0.90 -0.01 0.00 -0.77 0.00 0.00 57.85 57.93 1nol n ARG 100 Cb 0.57 -2.73 0.12 0.00 -1.02 0.00 0.00 32.46 29.41 1nol n ARG 100 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1nol h ASP 101 N 7.21 0.95 0.42 0.55 3.32 -1.92 -2.49 116.42 124.46 1nol h ASP 101 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1nol h ASP 101 Cb 1.23 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1nol h ASP 101 CO 0.93 0.65 0.00 -0.90 -1.72 0.00 0.00 179.24 178.19 1nol n ASP 102 N -4.53 0.00 -1.16 6.45 5.68 -1.26 -1.57 116.55 120.15 1nol n ASP 102 Ca 0.12 0.20 0.11 0.00 -0.50 0.00 0.00 54.79 54.72 1nol n ASP 102 Cb 0.11 -0.36 0.27 0.00 -1.14 0.00 0.00 41.12 40.00 1nol n ASP 102 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1nol s LYS 104 N -1.30 4.22 0.00 0.00 1.02 -0.61 -0.85 119.74 122.22 1nol s LYS 104 Ca 0.42 2.26 0.00 0.00 0.02 0.00 0.00 55.97 58.67 1nol s LYS 104 Cb 0.23 -3.53 0.00 0.00 -0.52 0.00 0.00 37.83 34.01 1nol s LYS 104 CO 0.31 -0.68 0.00 0.41 -0.92 0.00 0.00 175.35 174.47 1nol n GLY 105 N 3.88 0.36 3.80 -3.33 0.00 -1.26 -5.06 105.19 103.58 1nol n GLY 105 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1nol n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nol s LEU 106 N 0.00 4.34 0.51 0.99 1.43 -0.03 -4.93 118.68 120.98 1nol s LEU 106 Ca 0.00 0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 53.56 1nol s LEU 106 Cb 0.00 -2.31 -0.06 0.00 0.03 0.00 0.00 46.19 43.86 1nol s LEU 106 CO 0.00 0.25 0.92 -0.31 0.23 0.00 0.00 176.35 177.43 1nol s TYR 107 N -0.33 3.53 -0.08 0.29 1.51 -1.26 -4.89 117.35 116.11 1nol s TYR 107 Ca 0.17 1.21 -0.11 0.00 -1.01 0.00 0.00 57.07 57.33 1nol s TYR 107 Cb -0.13 -2.61 -0.05 0.00 -0.11 0.00 0.00 41.96 39.06 1nol s TYR 107 CO 0.05 -0.39 0.25 0.08 -1.11 0.00 0.00 175.55 174.44 1nol s VAL 108 N -2.75 5.31 0.33 0.71 1.01 -1.26 -4.91 120.40 118.85 1nol s VAL 108 Ca 0.54 0.47 -0.25 0.00 0.00 0.00 0.00 61.98 62.73 1nol s VAL 108 Cb -0.10 -3.54 -0.14 0.00 0.00 0.00 0.00 36.38 32.60 1nol s VAL 108 CO 0.40 0.58 0.66 -2.65 0.00 0.00 0.00 175.10 174.09 1nol n PRO 109 N 2.12 0.65 -1.72 2.72 -0.02 -1.26 -4.90 135.00 132.59 1nol n PRO 109 Ca -0.17 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.12 1nol n PRO 109 Cb 0.54 -1.47 -0.03 0.00 -0.02 0.00 0.00 33.50 32.52 1nol n PRO 109 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nol n PRO 110 N 0.75 2.68 0.23 0.52 -0.02 -1.26 -4.87 135.00 133.02 1nol n PRO 110 Ca 0.12 0.96 0.09 0.00 -2.02 0.00 0.00 63.50 62.65 1nol n PRO 110 Cb 0.34 -2.77 0.54 0.00 -0.02 0.00 0.00 33.50 31.59 1nol n PRO 110 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1nol h VAL 111 N 3.58 0.77 0.00 -1.45 3.04 -1.96 -1.59 116.25 118.65 1nol h VAL 111 Ca -0.45 -0.95 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 1nol h VAL 111 Cb 1.22 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 32.08 1nol h VAL 111 CO 0.88 0.23 0.00 0.00 -1.01 0.00 0.00 177.57 177.67 1nol n GLN 112 N -3.69 0.24 -0.05 4.17 0.00 -1.26 -1.09 117.38 115.70 1nol n GLN 112 Ca -0.01 0.33 -0.05 0.00 0.00 0.00 0.00 57.00 57.26 1nol n GLN 112 Cb 0.35 -1.85 -0.14 0.00 0.00 0.00 0.00 30.24 28.59 1nol n GLN 112 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1nol n GLU 113 N -2.28 0.66 -0.00 2.61 1.02 -0.64 -2.90 120.64 119.12 1nol n GLU 113 Ca 0.04 0.07 -0.13 0.00 -0.02 0.00 0.00 57.16 57.13 1nol n GLU 113 Cb 0.33 -1.63 -0.08 0.00 -0.02 0.00 0.00 31.44 30.03 1nol n GLU 113 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1nol h ILE 114 N 0.00 1.26 -2.23 -3.67 2.04 -1.22 -3.01 117.51 110.68 1nol h ILE 114 Ca -0.36 -0.77 -0.59 0.00 1.00 0.00 0.00 64.86 64.14 1nol h ILE 114 Cb 1.93 1.73 -0.42 0.00 -0.74 0.00 0.00 36.82 39.32 1nol h ILE 114 CO 0.04 0.20 -0.62 0.49 0.00 0.00 0.00 178.15 178.26 1nol n PHE 115 N -4.91 3.74 -0.21 1.37 3.72 -0.25 -4.43 117.46 116.49 1nol n PHE 115 Ca -0.08 -4.09 0.19 0.00 -0.05 0.00 0.00 57.45 53.43 1nol n PHE 115 Cb 0.18 -0.53 0.53 0.00 -0.94 0.00 0.00 39.48 38.72 1nol n PHE 115 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1nol h PRO 116 N 3.69 0.36 0.00 -1.08 0.11 -1.74 -1.20 132.00 132.14 1nol h PRO 116 Ca 0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1nol h PRO 116 Cb 0.60 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1nol h PRO 116 CO 0.82 0.24 0.00 -0.40 -0.21 0.00 0.00 178.00 178.45 1nol n ASP 117 N -4.48 0.00 0.01 -2.05 5.75 -1.26 -1.68 116.55 112.83 1nol n ASP 117 Ca 0.18 0.41 0.11 0.00 -0.01 0.00 0.00 54.79 55.48 1nol n ASP 117 Cb 0.67 -0.45 0.09 0.00 -1.03 0.00 0.00 41.12 40.41 1nol n ASP 117 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1nol n LYS 118 N -1.45 0.07 -0.00 0.11 5.02 -0.45 -4.15 118.16 117.31 1nol n LYS 118 Ca 0.03 -0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.33 1nol n LYS 118 Cb 0.11 -1.52 -0.01 0.00 -0.02 0.00 0.00 35.03 33.59 1nol n LYS 118 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1nol n PHE 119 N -1.62 0.00 -4.42 2.13 3.01 -0.68 -4.87 117.46 111.02 1nol n PHE 119 Ca 0.04 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.29 1nol n PHE 119 Cb 0.36 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.68 1nol n PHE 119 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1nol s ILE 120 N -1.48 1.22 0.47 4.37 1.01 -0.78 -4.91 121.20 121.10 1nol s ILE 120 Ca 0.00 -1.03 -0.24 0.00 0.00 0.00 0.00 60.65 59.38 1nol s ILE 120 Cb 0.01 -1.09 -0.07 0.00 0.01 0.00 0.00 42.46 41.32 1nol s ILE 120 CO 0.08 0.05 1.42 -2.84 0.00 0.00 0.00 174.94 173.64 1nol s PRO 121 N -1.12 3.56 0.41 2.79 0.02 -1.26 -4.69 135.00 134.70 1nol s PRO 121 Ca 0.03 2.39 0.26 0.00 0.02 0.00 0.00 61.00 63.69 1nol s PRO 121 Cb -0.08 -2.57 1.34 0.00 0.02 0.00 0.00 34.50 33.22 1nol s PRO 121 CO 0.01 -0.91 1.64 0.77 -0.33 0.00 0.00 177.00 178.18 1nol h SER 122 N 2.12 0.31 0.52 2.53 0.02 -1.65 -2.04 113.55 115.37 1nol h SER 122 Ca -0.51 0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.57 1nol h SER 122 Cb 1.27 0.13 0.01 0.00 0.14 0.00 0.00 62.40 63.95 1nol h SER 122 CO 0.60 -0.18 -0.25 0.00 -1.14 0.00 0.00 176.83 175.86 1nol h ALA 123 N 1.68 -1.02 -0.86 3.77 0.00 -1.91 0.38 119.26 121.31 1nol h ALA 123 Ca 0.79 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 55.74 1nol h ALA 123 Cb 2.32 0.27 -0.11 0.00 0.00 0.00 0.00 17.79 20.27 1nol h ALA 123 CO -0.47 -0.96 0.37 0.00 0.00 0.00 0.00 179.25 178.19 1nol h ALA 124 N -1.57 1.32 -0.31 0.00 0.00 -1.72 0.12 119.26 117.11 1nol h ALA 124 Ca -0.07 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1nol h ALA 124 Cb 0.54 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1nol h ALA 124 CO 0.12 -0.27 -0.01 0.82 0.00 0.00 0.00 179.25 179.91 1nol h ILE 125 N 0.44 1.19 -0.04 0.00 1.08 -1.25 -1.84 117.51 117.09 1nol h ILE 125 Ca 0.51 -0.75 -0.12 0.00 -0.39 0.00 0.00 64.86 64.12 1nol h ILE 125 Cb 0.90 0.97 0.01 0.00 -3.07 0.00 0.00 36.82 35.62 1nol h ILE 125 CO -0.48 0.25 -0.44 -1.13 -0.69 0.00 0.00 178.15 175.67 1nol h ASN 126 N 0.46 0.45 0.41 1.72 -0.73 0.14 -1.79 115.58 116.25 1nol h ASN 126 Ca 0.10 -0.71 -0.01 0.00 1.87 0.00 0.00 56.30 57.56 1nol h ASN 126 Cb 0.31 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 38.75 1nol h ASN 126 CO 0.01 1.09 -0.37 -0.08 -0.37 0.00 0.00 177.43 177.71 1nol h GLU 127 N -0.15 -0.77 -0.76 6.67 4.81 -0.92 0.97 114.58 124.43 1nol h GLU 127 Ca -0.04 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.34 1nol h GLU 127 Cb 1.12 0.17 -0.12 0.00 0.63 0.00 0.00 28.75 30.56 1nol h GLU 127 CO 0.09 -0.51 -0.47 0.00 -0.73 0.00 0.00 179.01 177.38 1nol h ALA 128 N -0.39 -0.31 -0.32 2.92 0.00 -1.41 0.29 119.26 120.04 1nol h ALA 128 Ca -0.04 0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1nol h ALA 128 Cb 0.70 1.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 1nol h ALA 128 CO -0.04 -0.83 0.25 0.74 0.00 0.00 0.00 179.25 179.37 1nol h PHE 129 N -0.14 0.00 0.02 0.00 0.04 -1.04 -1.00 116.94 114.83 1nol h PHE 129 Ca 0.20 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.97 1nol h PHE 129 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 1nol h PHE 129 CO -0.83 0.00 -0.01 -0.22 -0.60 0.00 0.00 178.31 176.66 1nol h LYS 130 N 0.00 -0.03 0.00 1.51 3.64 0.83 -3.29 116.57 119.23 1nol h LYS 130 Ca 0.15 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 1nol h LYS 130 Cb 0.65 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1nol h LYS 130 CO -0.00 0.71 -0.25 0.87 -2.27 0.00 0.00 179.45 178.51 1nol h LYS 131 N -0.93 0.00 -2.48 1.90 1.57 -0.23 -1.85 116.57 114.56 1nol h LYS 131 Ca -0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1nol h LYS 131 Cb 0.74 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 1nol h LYS 131 CO 0.00 0.25 0.10 0.00 -0.57 0.00 0.00 179.45 179.23 1nol n ALA 132 N -2.25 3.15 1.05 3.86 0.00 -0.40 -4.92 120.51 120.99 1nol n ALA 132 Ca -0.00 -0.64 0.12 0.00 0.00 0.00 0.00 53.44 52.92 1nol n ALA 132 Cb 0.42 -2.16 0.11 0.00 0.00 0.00 0.00 19.45 17.83 1nol n ALA 132 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1nol n HIS 133 N 2.62 0.00 0.01 0.00 8.25 -0.70 -4.95 115.22 120.45 1nol n HIS 133 Ca 0.15 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1nol n HIS 133 Cb 0.36 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.46 1nol n HIS 133 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1nol n ASP 139 N 0.87 0.39 0.00 0.41 8.00 -1.26 -5.18 116.55 119.77 1nol n ASP 139 Ca 0.13 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.68 1nol n ASP 139 Cb 0.54 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 1nol n ASP 139 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1nol n GLU 140 N -2.85 0.00 -1.04 -1.24 2.13 -1.20 -4.84 120.64 111.60 1nol n GLU 140 Ca -0.01 0.00 -0.33 0.00 0.66 0.00 0.00 57.16 57.49 1nol n GLU 140 Cb 0.02 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.74 1nol n GLU 140 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1nol n SER 141 N 0.00 -3.21 -4.68 4.31 2.88 -1.26 -1.62 113.62 110.05 1nol n SER 141 Ca 0.00 0.53 -0.43 0.00 -1.33 0.00 0.00 58.87 57.64 1nol n SER 141 Cb 0.00 -0.71 -0.02 0.00 -0.75 0.00 0.00 64.21 62.73 1nol n SER 141 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1nol s PRO 142 N -0.90 4.34 0.21 -1.46 0.05 -1.26 -3.83 135.00 132.15 1nol s PRO 142 Ca 0.47 1.58 -0.23 0.00 0.05 0.00 0.00 61.00 62.87 1nol s PRO 142 Cb -0.40 -3.60 -0.08 0.00 0.05 0.00 0.00 34.50 30.47 1nol s PRO 142 CO 0.56 -0.48 0.78 0.42 0.05 0.00 0.00 177.00 178.33 1nol s ILE 143 N 2.49 4.44 -0.04 0.56 1.01 -0.70 -5.03 121.20 123.93 1nol s ILE 143 Ca 0.53 1.53 0.01 0.00 0.00 0.00 0.00 60.65 62.71 1nol s ILE 143 Cb -0.22 -3.99 0.02 0.00 0.01 0.00 0.00 42.46 38.29 1nol s ILE 143 CO 0.18 0.32 -0.02 -0.22 0.00 0.00 0.00 174.94 175.20 1nol s LEU 144 N -1.66 1.17 -0.12 2.97 2.96 -1.26 -2.29 118.68 120.45 1nol s LEU 144 Ca 0.41 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.27 1nol s LEU 144 Cb -0.19 -0.35 0.01 0.00 0.50 0.00 0.00 46.19 46.15 1nol s LEU 144 CO 0.23 -0.09 -0.22 0.68 -1.32 0.00 0.00 176.35 175.63 1nol s VAL 145 N 1.08 1.99 -0.11 1.68 -7.23 -0.57 -4.96 120.40 112.27 1nol s VAL 145 Ca -0.09 -0.96 -0.26 0.00 -1.81 0.00 0.00 61.98 58.86 1nol s VAL 145 Cb -0.14 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 35.03 1nol s VAL 145 CO -0.01 0.54 0.85 1.51 -0.31 0.00 0.00 175.10 177.67 1nol s ASP 146 N 0.60 7.06 0.60 4.85 1.47 -1.26 -0.99 116.67 129.00 1nol s ASP 146 Ca -0.13 1.29 0.33 0.00 1.18 0.00 0.00 52.55 55.22 1nol s ASP 146 Cb -0.17 -2.47 1.93 0.00 -0.34 0.00 0.00 42.92 41.87 1nol s ASP 146 CO 0.03 -0.32 2.27 0.58 0.68 0.00 0.00 175.17 178.41 1nol h VAL 147 N 5.03 0.41 0.00 2.11 2.07 -1.36 -3.40 116.25 121.11 1nol h VAL 147 Ca -0.34 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1nol h VAL 147 Cb 1.16 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1nol h VAL 147 CO 0.81 0.01 0.04 0.00 0.02 0.00 0.00 177.57 178.45 1nol n GLN 148 N -3.67 0.00 0.00 1.57 1.13 -1.26 -4.86 117.38 110.29 1nol n GLN 148 Ca -0.03 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 1nol n GLN 148 Cb 0.09 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 28.90 1nol n GLN 148 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1nol n ASP 149 N -0.99 0.00 0.00 1.08 10.43 -1.26 -4.97 116.55 120.84 1nol n ASP 149 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 1nol n ASP 149 Cb 0.04 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.00 1nol n ASP 149 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1nol n THR 150 N 0.00 0.00 0.00 -3.53 -1.04 -1.26 -5.19 114.28 103.25 1nol n THR 150 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nol n THR 150 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1nol n THR 150 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nol n GLY 151 N -0.46 1.11 3.62 3.41 0.00 -1.26 -5.06 105.19 106.55 1nol n GLY 151 Ca 0.00 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 1nol n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nol s ASN 152 N 0.00 6.10 -0.75 1.61 -0.87 -1.26 -4.90 114.94 114.87 1nol s ASN 152 Ca 0.00 1.57 -0.26 0.00 -1.57 0.00 0.00 52.86 52.60 1nol s ASN 152 Cb 0.00 -2.53 0.01 0.00 -0.02 0.00 0.00 41.25 38.71 1nol s ASN 152 CO 0.00 -1.49 1.52 -0.63 -2.57 0.00 0.00 177.10 173.93 1nol s ILE 153 N 6.12 3.62 -2.83 0.60 1.09 -1.26 -4.85 121.20 123.69 1nol s ILE 153 Ca 0.78 0.14 0.23 0.00 -1.10 0.00 0.00 60.65 60.71 1nol s ILE 153 Cb -0.26 -4.58 0.17 0.00 -1.06 0.00 0.00 42.46 36.73 1nol s ILE 153 CO 0.32 -1.53 1.22 0.18 -0.10 0.00 0.00 174.94 175.04 1nol n LEU 154 N 10.64 2.86 -4.05 2.97 4.77 -1.26 -4.96 117.00 127.97 1nol n LEU 154 Ca 0.15 -0.98 -0.26 0.00 -0.03 0.00 0.00 56.01 54.88 1nol n LEU 154 Cb 0.50 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.42 1nol n LEU 154 CO 0.70 0.48 -0.48 -0.62 -1.33 0.00 0.00 177.39 176.13 1nol s ASP 155 N -1.97 2.03 0.32 -1.43 2.15 -1.26 -5.01 116.67 111.50 1nol s ASP 155 Ca 0.26 -0.35 0.02 0.00 0.43 0.00 0.00 52.55 52.92 1nol s ASP 155 Cb 0.19 -0.93 0.53 0.00 -0.30 0.00 0.00 42.92 42.40 1nol s ASP 155 CO 0.31 0.05 1.86 -0.65 -0.17 0.00 0.00 175.17 176.57 1nol h PRO 156 N 6.97 0.66 -0.47 4.34 0.11 -2.04 -0.32 132.00 141.25 1nol h PRO 156 Ca -0.29 -0.13 0.14 0.00 0.11 0.00 0.00 66.00 65.83 1nol h PRO 156 Cb 1.19 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1nol h PRO 156 CO 0.47 0.63 0.59 0.93 -0.21 0.00 0.00 178.00 180.41 1nol h GLU 157 N 0.64 0.00 0.00 1.05 4.39 -2.02 -0.65 114.58 117.99 1nol h GLU 157 Ca 0.14 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 1nol h GLU 157 Cb 0.29 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1nol h GLU 157 CO 0.00 0.00 -0.00 -0.92 -1.16 0.00 0.00 179.01 176.93 1nol h TYR 158 N 0.00 0.00 0.00 4.33 3.20 -1.47 -1.47 116.97 121.56 1nol h TYR 158 Ca 0.22 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1nol h TYR 158 Cb 1.40 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.67 1nol h TYR 158 CO 0.00 0.00 -0.07 0.00 -1.64 0.00 0.00 178.16 176.46 1nol h ARG 159 N 0.00 0.00 -0.65 1.82 3.08 -1.30 -2.80 114.38 114.53 1nol h ARG 159 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1nol h ARG 159 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1nol h ARG 159 CO 0.00 0.07 0.00 1.28 -1.07 0.00 0.00 179.97 180.25 1nol n LEU 160 N -3.84 4.48 0.16 3.04 7.99 -0.55 -4.37 117.00 123.91 1nol n LEU 160 Ca -0.02 -2.26 0.02 0.00 -0.01 0.00 0.00 56.01 53.74 1nol n LEU 160 Cb 0.16 -0.56 0.26 0.00 -0.11 0.00 0.00 43.42 43.17 1nol n LEU 160 CO 0.30 0.75 0.59 0.00 -1.51 0.00 0.00 177.39 177.52 1nol h ALA 161 N 4.04 0.98 -0.06 -1.18 0.00 -1.61 -0.33 119.26 121.11 1nol h ALA 161 Ca 0.00 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1nol h ALA 161 Cb 1.38 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1nol h ALA 161 CO 0.22 0.61 0.05 0.10 0.00 0.00 0.00 179.25 180.23 1nol h TYR 162 N 0.00 0.00 0.00 0.00 -0.00 -1.81 -0.23 116.97 114.93 1nol h TYR 162 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 58.73 58.47 1nol h TYR 162 Cb 1.00 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.69 1nol h TYR 162 CO 0.00 0.00 -1.61 0.98 -0.00 0.00 0.00 178.16 177.53 1nol n TYR 163 N -4.19 0.47 0.14 0.10 4.19 -0.29 -3.98 117.16 113.60 1nol n TYR 163 Ca -0.02 0.21 0.04 0.00 3.31 0.00 0.00 57.90 61.44 1nol n TYR 163 Cb 0.15 -0.93 0.44 0.00 0.49 0.00 0.00 39.34 39.49 1nol n TYR 163 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1nol h ARG 164 N -1.00 0.20 -0.34 2.98 3.08 -1.12 -2.77 114.38 115.41 1nol h ARG 164 Ca -0.39 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1nol h ARG 164 Cb 1.27 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1nol h ARG 164 CO -0.23 0.30 0.00 0.39 -1.07 0.00 0.00 179.97 179.36 1nol n GLU 165 N -4.33 3.08 -1.95 0.04 1.02 -0.10 -3.37 120.64 115.03 1nol n GLU 165 Ca -0.01 -2.60 -0.41 0.00 -0.02 0.00 0.00 57.16 54.12 1nol n GLU 165 Cb 0.22 -1.68 -0.02 0.00 -0.02 0.00 0.00 31.44 29.95 1nol n GLU 165 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1nol s ASP 166 N -1.47 6.56 0.17 1.62 2.15 -1.05 -4.92 116.67 119.73 1nol s ASP 166 Ca 0.37 2.80 -0.13 0.00 0.43 0.00 0.00 52.55 56.02 1nol s ASP 166 Cb 0.27 -2.64 0.07 0.00 -0.30 0.00 0.00 42.92 40.32 1nol s ASP 166 CO 0.13 -0.74 1.76 0.58 -0.17 0.00 0.00 175.17 176.73 1nol h VAL 167 N 3.30 1.20 -0.38 1.11 2.07 -1.92 -3.09 116.25 118.54 1nol h VAL 167 Ca -0.48 -0.56 -0.12 0.00 0.82 0.00 0.00 66.70 66.37 1nol h VAL 167 Cb 1.22 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1nol h VAL 167 CO 0.73 0.23 -0.24 1.23 0.02 0.00 0.00 177.57 179.53 1nol h GLY 168 N 0.76 0.84 1.57 2.17 0.00 -1.98 -1.53 103.07 104.89 1nol h GLY 168 Ca 0.19 -0.73 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 1nol h GLY 168 CO -0.03 0.66 -0.39 1.19 0.00 0.00 0.00 176.54 177.98 1nol h ILE 169 N 0.67 1.30 0.14 2.60 2.10 -1.90 -1.65 117.51 120.77 1nol h ILE 169 Ca 0.09 -1.53 -0.29 0.00 1.08 0.00 0.00 64.86 64.21 1nol h ILE 169 Cb 0.76 1.56 0.02 0.00 -1.09 0.00 0.00 36.82 38.07 1nol h ILE 169 CO 0.06 0.48 -1.26 0.78 -1.08 0.00 0.00 178.15 177.13 1nol h ASN 170 N 0.40 0.62 -0.48 2.19 2.35 -1.44 -1.91 115.58 117.31 1nol h ASN 170 Ca 0.04 -0.62 -0.05 0.00 -0.55 0.00 0.00 56.30 55.12 1nol h ASN 170 Cb 0.86 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.01 1nol h ASN 170 CO 0.07 1.46 0.12 0.00 -1.65 0.00 0.00 177.43 177.43 1nol h ALA 171 N 0.46 0.63 -0.08 -0.83 0.00 -1.24 -2.20 119.26 116.00 1nol h ALA 171 Ca -0.16 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.57 1nol h ALA 171 Cb 1.95 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 1nol h ALA 171 CO 0.22 0.32 -0.10 1.25 0.00 0.00 0.00 179.25 180.95 1nol h HIS 172 N 0.65 -0.24 -0.78 0.00 -0.00 -1.22 -1.54 115.15 112.02 1nol h HIS 172 Ca 0.15 0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.57 1nol h HIS 172 Cb 0.33 0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.81 1nol h HIS 172 CO 0.02 -0.15 0.51 1.25 -0.00 0.00 0.00 177.93 179.56 1nol h HIS 173 N -0.13 0.91 0.05 5.26 6.17 -1.17 0.94 115.15 127.18 1nol h HIS 173 Ca 0.06 0.02 -0.00 0.00 0.71 0.00 0.00 60.37 61.17 1nol h HIS 173 Cb 0.22 -0.30 -0.00 0.00 2.52 0.00 0.00 27.41 29.84 1nol h HIS 173 CO -0.20 0.53 -0.03 2.35 0.71 0.00 0.00 177.93 181.29 1nol h TRP 174 N 0.94 -0.09 -0.45 5.26 2.91 -1.02 -3.06 115.95 120.45 1nol h TRP 174 Ca 0.31 -0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.22 1nol h TRP 174 Cb 0.06 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.72 1nol h TRP 174 CO -0.00 -0.05 -0.17 0.45 -1.03 0.00 0.00 178.44 177.64 1nol h HIS 175 N -0.08 0.98 -0.33 2.65 3.86 -0.23 -3.01 115.15 118.99 1nol h HIS 175 Ca -0.00 -0.21 0.02 0.00 -1.16 0.00 0.00 60.37 59.02 1nol h HIS 175 Cb 0.07 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 1nol h HIS 175 CO -0.09 0.97 0.16 2.35 0.86 0.00 0.00 177.93 182.18 1nol h TRP 176 N 0.77 0.29 0.00 2.45 7.01 -0.84 -1.00 115.95 124.62 1nol h TRP 176 Ca 0.11 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.13 1nol h TRP 176 Cb 0.70 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 27.68 1nol h TRP 176 CO 0.04 0.15 0.00 0.72 -2.79 0.00 0.00 178.44 176.56 1nol n HIS 177 N -4.96 0.00 0.05 2.65 8.25 -1.16 -1.43 115.22 118.61 1nol n HIS 177 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.57 1nol n HIS 177 Cb 0.08 -0.43 -0.16 0.00 1.12 0.00 0.00 29.99 30.60 1nol n HIS 177 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1nol n LEU 178 N -1.43 0.06 0.10 2.41 4.77 -0.44 -3.09 117.00 119.37 1nol n LEU 178 Ca 0.04 -0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 55.97 1nol n LEU 178 Cb 0.15 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1nol n LEU 178 CO 0.12 0.01 0.32 0.58 -1.33 0.00 0.00 177.39 177.10 1nol h VAL 179 N 0.00 1.35 -2.16 4.08 2.07 -0.64 -3.39 116.25 117.55 1nol h VAL 179 Ca 0.00 -2.77 -0.57 0.00 0.82 0.00 0.00 66.70 64.18 1nol h VAL 179 Cb 0.95 2.58 -0.41 0.00 -1.52 0.00 0.00 31.29 32.89 1nol h VAL 179 CO 0.00 0.74 -0.80 -1.22 0.02 0.00 0.00 177.57 176.31 1nol n TYR 180 N -3.36 2.56 -1.73 1.57 4.01 -0.52 -5.09 117.16 114.61 1nol n TYR 180 Ca 0.01 -3.95 -0.42 0.00 -0.16 0.00 0.00 57.90 53.37 1nol n TYR 180 Cb 0.81 -0.48 -0.01 0.00 -0.31 0.00 0.00 39.34 39.35 1nol n TYR 180 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1nol n PRO 181 N 0.46 2.40 0.12 -0.72 -0.02 -1.18 -4.73 135.00 131.33 1nol n PRO 181 Ca 0.28 0.85 0.13 0.00 -2.02 0.00 0.00 63.50 62.73 1nol n PRO 181 Cb 0.47 -2.52 0.43 0.00 -0.02 0.00 0.00 33.50 31.85 1nol n PRO 181 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1nol n SER 182 N 1.12 0.81 -0.60 2.55 3.41 -1.26 -1.98 113.62 117.67 1nol n SER 182 Ca 0.05 0.61 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 1nol n SER 182 Cb 0.36 -0.82 0.34 0.00 -0.26 0.00 0.00 64.21 63.84 1nol n SER 182 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nol n THR 183 N -2.30 0.26 -1.68 6.66 -2.24 -1.26 -0.97 114.28 112.76 1nol n THR 183 Ca 0.04 -0.39 -0.48 0.00 -2.27 0.00 0.00 64.05 60.95 1nol n THR 183 Cb 0.37 0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 68.94 1nol n THR 183 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1nol n TRP 184 N 0.41 2.28 -3.84 4.78 -0.00 -0.84 -4.81 117.44 115.43 1nol n TRP 184 Ca 0.16 0.11 -0.36 0.00 -0.00 0.00 0.00 57.50 57.40 1nol n TRP 184 Cb 0.34 -2.62 -0.13 0.00 -0.00 0.00 0.00 31.31 28.90 1nol n TRP 184 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1nol s ASN 185 N 3.23 4.81 0.21 5.87 3.84 -1.26 -4.59 114.94 127.05 1nol s ASN 185 Ca 0.90 -0.79 0.03 0.00 0.21 0.00 0.00 52.86 53.20 1nol s ASN 185 Cb -0.72 -1.79 0.16 0.00 -0.55 0.00 0.00 41.25 38.35 1nol s ASN 185 CO 0.49 -0.17 1.50 -0.65 -2.79 0.00 0.00 177.10 175.48 1nol h PRO 186 N 8.14 0.25 -0.13 0.43 0.11 -1.89 -2.57 132.00 136.34 1nol h PRO 186 Ca -0.31 -0.20 -0.12 0.00 0.11 0.00 0.00 66.00 65.47 1nol h PRO 186 Cb 1.12 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1nol h PRO 186 CO 0.59 0.84 -0.46 1.57 -0.21 0.00 0.00 178.00 180.33 1nol h LYS 187 N 0.18 0.31 0.04 1.05 2.10 -1.83 -0.09 116.57 118.33 1nol h LYS 187 Ca -0.02 -0.16 -0.23 0.00 -2.00 0.00 0.00 60.65 58.24 1nol h LYS 187 Cb 1.23 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1nol h LYS 187 CO 0.11 0.71 -1.02 -0.92 -2.00 0.00 0.00 179.45 176.33 1nol h TYR 188 N 0.25 0.46 -0.01 0.07 5.03 -1.83 -3.18 116.97 117.77 1nol h TYR 188 Ca 0.02 -0.28 0.00 0.00 2.58 0.00 0.00 58.73 61.04 1nol h TYR 188 Cb 0.91 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 39.15 1nol h TYR 188 CO 0.02 1.14 -0.56 1.19 -1.32 0.00 0.00 178.16 178.63 1nol n PHE 189 N -3.64 0.00 0.00 -3.82 3.72 -1.02 -4.94 117.46 107.76 1nol n PHE 189 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1nol n PHE 189 Cb 0.89 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 39.35 1nol n PHE 189 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nol n GLY 190 N 1.44 2.26 2.18 1.37 0.00 -0.08 -4.96 105.19 107.40 1nol n GLY 190 Ca 0.08 -0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1nol n GLY 190 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nol n LYS 191 N 0.00 0.00 -4.28 1.61 5.02 -1.25 -4.46 118.16 114.80 1nol n LYS 191 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 1nol n LYS 191 Cb 0.00 -0.80 -0.09 0.00 -0.02 0.00 0.00 35.03 34.13 1nol n LYS 191 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nol s LYS 192 N -0.30 2.88 -0.63 1.97 1.02 -1.26 -4.35 119.74 119.07 1nol s LYS 192 Ca 0.49 -0.54 -0.19 0.00 0.02 0.00 0.00 55.97 55.75 1nol s LYS 192 Cb -0.70 -2.73 0.10 0.00 -0.52 0.00 0.00 37.83 33.98 1nol s LYS 192 CO 0.36 0.65 0.78 0.15 -0.92 0.00 0.00 175.35 176.36 1nol s LYS 193 N -1.40 3.10 0.13 1.68 -0.14 -1.26 -4.93 119.74 116.93 1nol s LYS 193 Ca 0.18 -1.30 -0.32 0.00 -1.36 0.00 0.00 55.97 53.18 1nol s LYS 193 Cb -0.12 -4.30 -0.11 0.00 -1.68 0.00 0.00 37.83 31.62 1nol s LYS 193 CO 0.09 -1.60 1.81 -3.47 -0.76 0.00 0.00 175.35 171.41 1nol n ASP 194 N 6.51 3.94 -3.79 2.83 2.03 -1.26 -3.02 116.55 123.79 1nol n ASP 194 Ca -0.06 1.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.98 1nol n ASP 194 Cb 0.43 -1.53 0.05 0.00 -0.72 0.00 0.00 41.12 39.35 1nol n ASP 194 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1nol n ARG 195 N 5.28 -6.52 -0.16 -0.67 1.74 -1.26 -4.65 116.66 110.43 1nol n ARG 195 Ca 0.18 0.69 -0.08 0.00 -0.77 0.00 0.00 57.85 57.87 1nol n ARG 195 Cb 0.36 -5.65 0.01 0.00 -1.02 0.00 0.00 32.46 26.16 1nol n ARG 195 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1nol h LYS 196 N -2.34 0.66 -0.82 5.56 3.64 -1.92 0.14 116.57 121.49 1nol h LYS 196 Ca -0.58 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1nol h LYS 196 Cb 1.37 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 1nol h LYS 196 CO 0.63 0.51 0.52 0.78 -2.27 0.00 0.00 179.45 179.62 1nol h GLY 197 N 0.62 1.18 1.43 5.01 0.00 -1.89 0.10 103.07 109.53 1nol h GLY 197 Ca 0.17 -0.46 -0.18 0.00 0.00 0.00 0.00 47.33 46.85 1nol h GLY 197 CO -0.03 0.45 -0.66 -2.09 0.00 0.00 0.00 176.54 174.22 1nol h GLU 198 N 1.12 0.57 -0.02 4.80 4.81 -1.57 -2.47 114.58 121.83 1nol h GLU 198 Ca 0.30 -0.42 -0.15 0.00 -0.13 0.00 0.00 59.36 58.97 1nol h GLU 198 Cb -0.09 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1nol h GLU 198 CO -0.06 1.04 -0.66 1.25 -0.73 0.00 0.00 179.01 179.84 1nol h LEU 199 N 0.42 0.09 -0.19 1.64 5.85 -0.43 -0.70 115.31 122.00 1nol h LEU 199 Ca -0.02 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1nol h LEU 199 Cb 1.23 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1nol h LEU 199 CO 0.12 0.73 -0.25 0.15 -0.34 0.00 0.00 178.44 178.85 1nol h PHE 200 N 0.05 -0.66 -0.21 1.25 3.57 -0.66 -0.47 116.94 119.81 1nol h PHE 200 Ca -0.01 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.58 1nol h PHE 200 Cb 1.18 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 40.18 1nol h PHE 200 CO 0.01 -0.33 -0.17 -0.92 -2.23 0.00 0.00 178.31 174.67 1nol h TYR 201 N -0.29 -0.43 -0.04 0.41 3.20 -1.22 -2.77 116.97 115.84 1nol h TYR 201 Ca 0.12 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 61.82 1nol h TYR 201 Cb 0.47 0.22 0.01 0.00 1.54 0.00 0.00 36.73 38.97 1nol h TYR 201 CO -0.37 -0.24 -0.75 -0.92 -1.64 0.00 0.00 178.16 174.23 1nol h TYR 202 N -0.17 0.83 -0.78 -3.82 3.20 -0.59 -1.39 116.97 114.25 1nol h TYR 202 Ca 0.13 -0.42 0.01 0.00 3.14 0.00 0.00 58.73 61.58 1nol h TYR 202 Cb 0.36 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 1nol h TYR 202 CO -0.32 1.24 0.51 1.98 -1.64 0.00 0.00 178.16 179.93 1nol h MET 203 N 0.17 1.04 0.00 1.82 4.05 -1.14 -0.97 114.93 119.90 1nol h MET 203 Ca -0.08 -0.07 -0.17 0.00 -0.28 0.00 0.00 59.70 59.10 1nol h MET 203 Cb 1.42 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 1nol h MET 203 CO 0.15 0.69 -0.80 0.45 0.23 0.00 0.00 176.91 177.63 1nol h HIS 204 N 1.07 0.00 -0.33 1.39 3.86 -1.44 -2.03 115.15 117.66 1nol h HIS 204 Ca 0.29 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.48 1nol h HIS 204 Cb -0.11 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1nol h HIS 204 CO -0.02 0.80 0.13 0.37 0.86 0.00 0.00 177.93 180.07 1nol h GLN 205 N 0.00 0.50 -0.23 2.45 -0.00 -1.05 -2.13 115.11 114.65 1nol h GLN 205 Ca -0.01 -0.09 -0.08 0.00 -0.00 0.00 0.00 58.65 58.47 1nol h GLN 205 Cb 1.55 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 28.94 1nol h GLN 205 CO 0.10 0.51 -0.19 1.96 0.00 0.00 0.00 178.83 181.21 1nol h GLN 206 N 0.39 0.41 -0.73 1.69 1.08 -1.05 0.41 115.11 117.30 1nol h GLN 206 Ca 0.11 -0.13 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1nol h GLN 206 Cb 0.19 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.55 1nol h GLN 206 CO -0.01 0.58 0.38 0.52 -0.95 0.00 0.00 178.83 179.35 1nol h MET 207 N 0.37 1.04 -0.25 1.46 2.86 -1.22 0.24 114.93 119.44 1nol h MET 207 Ca 0.06 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 1nol h MET 207 Cb 0.54 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1nol h MET 207 CO 0.04 0.80 -0.00 0.00 1.06 0.00 0.00 176.91 178.80 1nol h ALA 209 N 0.81 0.05 -0.74 0.00 0.00 -0.71 0.97 119.26 119.64 1nol h ALA 209 Ca 0.07 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1nol h ALA 209 Cb 0.42 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1nol h ALA 209 CO 0.01 -0.39 0.49 0.00 0.00 0.00 0.00 179.25 179.36 1nol h ARG 210 N -0.07 0.92 -0.53 0.00 3.08 -0.54 -1.71 114.38 115.53 1nol h ARG 210 Ca 0.01 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1nol h ARG 210 Cb 0.13 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1nol h ARG 210 CO -0.00 0.61 0.09 -0.92 -1.07 0.00 0.00 179.97 178.68 1nol h TYR 211 N 0.95 0.93 0.00 3.04 3.20 -0.25 -2.82 116.97 122.02 1nol h TYR 211 Ca 0.28 -0.13 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1nol h TYR 211 Cb -0.02 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 1nol h TYR 211 CO -0.00 0.83 -0.22 -0.44 -1.64 0.00 0.00 178.16 176.69 1nol h ASP 212 N 0.76 0.00 0.64 -2.11 3.32 0.06 -0.52 116.42 118.56 1nol h ASP 212 Ca 0.16 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1nol h ASP 212 Cb 0.40 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1nol h ASP 212 CO 0.01 0.22 -0.32 0.00 -1.72 0.00 0.00 179.24 177.43 1nol h GLU 214 N 0.00 0.70 0.13 0.00 4.39 -0.86 -1.59 114.58 117.34 1nol h GLU 214 Ca -0.00 -0.69 0.01 0.00 0.34 0.00 0.00 59.36 59.01 1nol h GLU 214 Cb 0.72 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 1nol h GLU 214 CO 0.04 1.28 -0.14 0.00 -1.16 0.00 0.00 179.01 179.03 1nol h ARG 215 N 0.42 -0.30 -0.50 2.33 3.08 -1.40 -1.44 114.38 116.58 1nol h ARG 215 Ca -0.10 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.91 1nol h ARG 215 Cb 1.60 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.69 1nol h ARG 215 CO 0.19 -0.20 0.08 -0.07 -1.07 0.00 0.00 179.97 178.91 1nol h LEU 216 N -0.31 0.73 -1.56 3.04 3.38 -1.47 0.77 115.31 119.89 1nol h LEU 216 Ca 0.01 -0.14 0.12 0.00 0.09 0.00 0.00 57.88 57.96 1nol h LEU 216 Cb 0.30 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1nol h LEU 216 CO -0.05 0.74 0.47 0.28 0.09 0.00 0.00 178.44 179.97 1nol h SER 217 N 0.74 0.43 -0.58 -0.43 0.02 -0.75 -2.10 113.55 110.87 1nol h SER 217 Ca 0.16 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1nol h SER 217 Cb 0.33 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1nol h SER 217 CO 0.00 0.24 0.00 0.59 -1.14 0.00 0.00 176.83 176.53 1nol n ASN 218 N -4.48 3.74 0.00 3.07 3.02 -0.10 -4.47 115.26 116.03 1nol n ASN 218 Ca 0.12 -2.20 0.00 0.00 -0.03 0.00 0.00 54.58 52.47 1nol n ASN 218 Cb 0.43 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1nol n ASN 218 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nol n GLY 219 N 1.24 0.50 3.85 7.41 0.00 -0.79 -5.03 105.19 112.36 1nol n GLY 219 Ca 0.21 -0.43 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 1nol n GLY 219 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nol s MET 220 N -0.83 3.08 0.82 1.61 -1.94 0.07 -4.89 119.30 117.23 1nol s MET 220 Ca 0.00 -0.76 -0.11 0.00 -1.71 0.00 0.00 55.69 53.10 1nol s MET 220 Cb 0.00 -2.76 0.09 0.00 2.01 0.00 0.00 34.83 34.17 1nol s MET 220 CO 0.00 0.50 1.14 -1.58 -0.01 0.00 0.00 175.02 175.07 1nol s HIS 221 N -1.72 2.04 0.52 -0.03 2.46 -1.26 -3.30 115.29 113.99 1nol s HIS 221 Ca 0.32 1.68 -0.21 0.00 0.47 0.00 0.00 55.06 57.32 1nol s HIS 221 Cb -0.11 -3.27 -0.06 0.00 -0.13 0.00 0.00 32.58 29.01 1nol s HIS 221 CO 0.25 -2.41 1.20 1.03 -2.47 0.00 0.00 174.74 172.34 1nol s ARG 222 N -4.55 3.39 0.39 2.88 0.52 -1.26 -4.72 118.95 115.61 1nol s ARG 222 Ca 0.67 1.83 -0.26 0.00 -0.52 0.00 0.00 55.73 57.45 1nol s ARG 222 Cb -0.22 -2.19 -0.09 0.00 0.52 0.00 0.00 34.95 32.97 1nol s ARG 222 CO 0.54 -0.87 1.24 -1.64 0.02 0.00 0.00 175.30 174.59 1nol s MET 223 N -3.00 4.05 -0.07 3.54 -1.94 -1.26 -5.02 119.30 115.60 1nol s MET 223 Ca 0.70 2.02 -0.04 0.00 -1.71 0.00 0.00 55.69 56.67 1nol s MET 223 Cb -0.30 -2.76 -0.04 0.00 2.01 0.00 0.00 34.83 33.74 1nol s MET 223 CO 0.35 -0.38 0.10 -0.51 -0.01 0.00 0.00 175.02 174.57 1nol s LEU 224 N -2.37 4.09 0.42 -0.03 1.43 -1.26 -5.03 118.68 115.92 1nol s LEU 224 Ca 0.56 0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.70 1nol s LEU 224 Cb -0.35 -2.13 -0.09 0.00 0.03 0.00 0.00 46.19 43.65 1nol s LEU 224 CO 0.45 0.35 1.35 -2.16 0.23 0.00 0.00 176.35 176.57 1nol s PRO 225 N -1.28 3.90 -1.23 1.29 0.04 -1.26 -4.47 135.00 131.99 1nol s PRO 225 Ca 0.18 2.26 -0.18 0.00 0.04 0.00 0.00 61.00 63.30 1nol s PRO 225 Cb -0.12 -2.75 0.08 0.00 0.04 0.00 0.00 34.50 31.76 1nol s PRO 225 CO 0.08 -0.59 1.63 0.12 0.04 0.00 0.00 177.00 178.28 1nol s PHE 226 N -1.23 2.86 -1.42 0.56 5.36 -0.28 -4.75 117.98 119.08 1nol s PHE 226 Ca 0.58 -1.57 0.16 0.00 -0.96 0.00 0.00 56.93 55.14 1nol s PHE 226 Cb -0.40 -4.67 -0.02 0.00 -0.34 0.00 0.00 43.02 37.59 1nol s PHE 226 CO 0.52 -1.76 0.84 0.27 -1.46 0.00 0.00 175.22 173.64 1nol n ASN 227 N 8.00 1.55 -4.34 6.13 0.23 -1.26 -4.70 115.26 120.86 1nol n ASN 227 Ca 0.44 -1.27 -0.35 0.00 -0.53 0.00 0.00 54.58 52.87 1nol n ASN 227 Cb 0.46 0.53 -0.14 0.00 -2.08 0.00 0.00 39.78 38.55 1nol n ASN 227 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1nol s ASN 228 N -1.98 4.36 0.00 0.53 3.84 -1.26 -4.99 114.94 115.44 1nol s ASN 228 Ca 0.13 -0.35 0.20 0.00 0.21 0.00 0.00 52.86 53.04 1nol s ASN 228 Cb 0.13 -1.74 1.06 0.00 -0.55 0.00 0.00 41.25 40.15 1nol s ASN 228 CO 0.44 0.02 1.70 0.49 -2.79 0.00 0.00 177.10 176.95 1nol n PHE 229 N 4.56 0.05 0.86 0.43 3.01 -1.26 -2.61 117.46 122.49 1nol n PHE 229 Ca -0.18 -0.02 0.11 0.00 1.01 0.00 0.00 57.45 58.37 1nol n PHE 229 Cb 0.51 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 40.09 1nol n PHE 229 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1nol n ASP 230 N -0.54 0.65 -4.79 4.37 8.00 -1.26 -4.46 116.55 118.53 1nol n ASP 230 Ca 0.15 -0.38 -0.36 0.00 0.71 0.00 0.00 54.79 54.91 1nol n ASP 230 Cb 0.13 0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 41.72 1nol n ASP 230 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1nol s GLU 231 N -3.06 4.47 0.37 -1.24 2.56 -1.07 -4.92 118.70 115.80 1nol s GLU 231 Ca 0.08 1.31 -0.25 0.00 0.00 0.00 0.00 54.97 56.11 1nol s GLU 231 Cb 0.16 -2.65 -0.09 0.00 2.00 0.00 0.00 34.13 33.54 1nol s GLU 231 CO 0.77 0.17 1.02 -1.25 -0.56 0.00 0.00 175.26 175.41 1nol s PRO 232 N -2.32 4.34 0.30 4.30 0.04 -1.26 -4.64 135.00 135.76 1nol s PRO 232 Ca 0.53 1.47 -0.21 0.00 0.04 0.00 0.00 61.00 62.83 1nol s PRO 232 Cb -0.17 -2.67 -0.09 0.00 0.04 0.00 0.00 34.50 31.61 1nol s PRO 232 CO 0.22 0.02 0.82 -0.51 0.04 0.00 0.00 177.00 177.60 1nol s LEU 233 N -2.37 4.23 0.75 -3.56 1.02 0.12 -4.87 118.68 114.00 1nol s LEU 233 Ca 0.54 1.56 -0.13 0.00 0.02 0.00 0.00 54.13 56.12 1nol s LEU 233 Cb -0.21 -3.94 0.05 0.00 0.02 0.00 0.00 46.19 42.11 1nol s LEU 233 CO 0.27 -0.10 1.14 0.00 0.02 0.00 0.00 176.35 177.68 1nol s ALA 234 N -1.73 2.14 0.30 4.21 0.00 -1.26 -2.22 121.76 123.20 1nol s ALA 234 Ca 0.50 0.59 0.04 0.00 0.00 0.00 0.00 51.96 53.08 1nol s ALA 234 Cb -0.15 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1nol s ALA 234 CO 0.20 -1.84 0.45 0.20 0.00 0.00 0.00 175.76 174.77 1nol s GLY 235 N -2.63 1.34 -0.25 0.00 0.00 -1.26 -4.84 107.32 99.68 1nol s GLY 235 Ca 0.68 -1.18 -0.12 0.00 0.00 0.00 0.00 44.72 44.09 1nol s GLY 235 CO 0.49 -1.15 0.59 -0.47 0.00 0.00 0.00 173.10 172.56 1nol s TYR 236 N -2.14 -1.01 -0.31 1.90 5.04 0.51 -4.87 117.35 116.47 1nol s TYR 236 Ca 0.38 1.94 -0.12 0.00 -2.44 0.00 0.00 57.07 56.84 1nol s TYR 236 Cb -0.09 0.56 -0.03 0.00 0.35 0.00 0.00 41.96 42.75 1nol s TYR 236 CO 0.32 -0.52 0.20 0.00 -1.34 0.00 0.00 175.55 174.21 1nol s ALA 237 N 1.98 3.48 -0.01 3.97 0.00 -1.26 -1.67 121.76 128.24 1nol s ALA 237 Ca -0.08 -1.26 0.11 0.00 0.00 0.00 0.00 51.96 50.74 1nol s ALA 237 Cb -0.08 -2.54 -0.17 0.00 0.00 0.00 0.00 23.12 20.34 1nol s ALA 237 CO -0.17 -0.78 1.04 -1.00 0.00 0.00 0.00 175.76 174.85 1nol h PRO 238 N 8.42 0.00 -5.63 0.00 0.13 -1.89 -3.49 132.00 129.54 1nol h PRO 238 Ca -0.33 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.48 1nol h PRO 238 Cb 1.17 0.00 0.17 0.00 0.13 0.00 0.00 31.00 32.47 1nol h PRO 238 CO 0.60 0.66 -0.79 0.72 -0.23 0.00 0.00 178.00 178.96 1nol n HIS 239 N -3.17 -2.24 -4.98 1.56 8.25 -1.26 -4.94 115.22 108.44 1nol n HIS 239 Ca -0.06 0.91 -0.29 0.00 -0.26 0.00 0.00 57.72 58.02 1nol n HIS 239 Cb 0.93 -4.83 -0.17 0.00 1.12 0.00 0.00 29.99 27.05 1nol n HIS 239 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1nol s LEU 240 N -6.16 1.93 0.40 2.41 1.43 -1.26 -1.63 118.68 115.80 1nol s LEU 240 Ca 0.11 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1nol s LEU 240 Cb -0.01 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 45.05 1nol s LEU 240 CO 0.74 0.14 0.58 -0.89 0.23 0.00 0.00 176.35 177.14 1nol s THR 241 N 0.28 3.85 -0.57 5.49 2.01 -1.26 -2.94 115.64 122.51 1nol s THR 241 Ca -0.12 -0.79 0.04 0.00 0.31 0.00 0.00 61.69 61.13 1nol s THR 241 Cb -0.15 -3.37 0.14 0.00 0.01 0.00 0.00 72.50 69.13 1nol s THR 241 CO 0.05 -0.20 0.33 -2.28 -0.69 0.00 0.00 174.62 171.84 1nol s HIS 242 N -2.38 3.11 0.62 4.92 2.46 0.17 -4.62 115.29 119.57 1nol s HIS 242 Ca 0.48 -3.12 0.31 0.00 0.47 0.00 0.00 55.06 53.20 1nol s HIS 242 Cb -0.10 -2.63 1.72 0.00 -0.13 0.00 0.00 32.58 31.45 1nol s HIS 242 CO 0.34 -0.69 2.06 -0.39 -2.47 0.00 0.00 174.74 173.60 1nol h VAL 243 N 5.10 0.29 0.00 0.89 -1.51 -1.94 -0.54 116.25 118.55 1nol h VAL 243 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.48 1nol h VAL 243 Cb 0.85 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 30.80 1nol h VAL 243 CO 0.67 0.00 0.02 0.00 -1.23 0.00 0.00 177.57 177.02 1nol n ALA 244 N -2.20 1.17 -0.90 5.19 0.00 -1.26 -3.77 120.51 118.73 1nol n ALA 244 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1nol n ALA 244 Cb 0.36 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1nol n ALA 244 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nol n SER 245 N -1.21 0.00 0.00 0.00 3.41 -0.35 -4.55 113.62 110.92 1nol n SER 245 Ca 0.00 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1nol n SER 245 Cb 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1nol n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nol n GLY 246 N 0.00 0.88 3.86 5.00 0.00 -0.41 -5.03 105.19 109.50 1nol n GLY 246 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1nol n GLY 246 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nol s LYS 247 N -0.08 2.73 0.16 1.61 1.02 -1.22 -4.81 119.74 119.15 1nol s LYS 247 Ca 0.00 0.53 0.03 0.00 0.02 0.00 0.00 55.97 56.54 1nol s LYS 247 Cb 0.00 -2.00 -0.05 0.00 -0.52 0.00 0.00 37.83 35.26 1nol s LYS 247 CO 0.00 -1.14 -0.04 1.52 -0.92 0.00 0.00 175.35 174.77 1nol s TYR 248 N -3.30 1.23 0.03 3.18 -0.85 -1.26 0.42 117.35 116.80 1nol s TYR 248 Ca 0.59 -0.91 -0.30 0.00 -0.52 0.00 0.00 57.07 55.92 1nol s TYR 248 Cb -0.12 -0.68 -0.07 0.00 0.38 0.00 0.00 41.96 41.47 1nol s TYR 248 CO 0.52 -0.09 1.63 0.71 -1.52 0.00 0.00 175.55 176.81 1nol s TYR 249 N -3.52 2.34 0.20 -3.49 2.02 -1.15 -4.49 117.35 109.26 1nol s TYR 249 Ca 0.20 0.33 -0.30 0.00 -0.37 0.00 0.00 57.07 56.93 1nol s TYR 249 Cb 0.05 -3.93 -0.09 0.00 -0.40 0.00 0.00 41.96 37.59 1nol s TYR 249 CO 0.02 -3.75 1.40 -1.12 -1.57 0.00 0.00 175.55 170.53 1nol s SER 250 N 2.61 6.77 0.87 2.29 0.01 -0.93 -4.78 113.70 120.52 1nol s SER 250 Ca 0.73 2.51 -0.11 0.00 1.31 0.00 0.00 55.95 60.39 1nol s SER 250 Cb -0.37 -2.61 0.11 0.00 0.21 0.00 0.00 66.02 63.36 1nol s SER 250 CO 0.31 -0.64 1.09 -2.16 0.41 0.00 0.00 173.24 172.26 1nol s PRO 251 N 0.13 1.49 -0.20 12.44 0.04 -1.26 -4.18 135.00 143.45 1nol s PRO 251 Ca 0.60 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.66 1nol s PRO 251 Cb -0.39 -1.82 0.05 0.00 0.04 0.00 0.00 34.50 32.37 1nol s PRO 251 CO 0.38 -2.13 -0.09 0.50 0.04 0.00 0.00 177.00 175.69 1nol s ARG 252 N -4.88 1.92 0.93 4.56 3.52 -0.67 -4.89 118.95 119.45 1nol s ARG 252 Ca 0.63 -0.85 -0.12 0.00 -0.13 0.00 0.00 55.73 55.26 1nol s ARG 252 Cb -0.18 -2.42 0.15 0.00 -1.56 0.00 0.00 34.95 30.94 1nol s ARG 252 CO 0.57 -0.46 1.10 -1.25 -0.81 0.00 0.00 175.30 174.46 1nol s PRO 253 N 1.41 0.97 0.54 5.12 0.04 -1.26 -0.37 135.00 141.46 1nol s PRO 253 Ca -0.02 0.53 -0.20 0.00 0.04 0.00 0.00 61.00 61.35 1nol s PRO 253 Cb -0.17 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 1nol s PRO 253 CO -0.08 -2.36 1.20 -0.51 0.04 0.00 0.00 177.00 175.29 1nol s ASP 254 N -3.65 5.56 0.00 6.66 1.01 -1.26 -4.02 116.67 120.97 1nol s ASP 254 Ca 0.64 2.37 0.00 0.00 0.71 0.00 0.00 52.55 56.27 1nol s ASP 254 Cb -0.17 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.16 1nol s ASP 254 CO 0.56 -1.34 0.00 0.61 0.21 0.00 0.00 175.17 175.21 1nol n GLY 255 N 0.44 0.63 3.91 0.21 0.00 -0.94 -4.93 105.19 104.51 1nol n GLY 255 Ca 0.11 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 1nol n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nol s LEU 256 N 0.00 3.93 0.14 0.99 1.43 -1.25 -4.79 118.68 119.13 1nol s LEU 256 Ca 0.00 0.75 0.11 0.00 -1.03 0.00 0.00 54.13 53.96 1nol s LEU 256 Cb 0.00 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 1nol s LEU 256 CO 0.00 -0.32 -0.25 -0.54 0.23 0.00 0.00 176.35 175.47 1nol s LYS 257 N -4.00 1.48 0.33 1.70 1.02 -1.26 0.16 119.74 119.17 1nol s LYS 257 Ca 0.45 -1.37 -0.29 0.00 0.02 0.00 0.00 55.97 54.78 1nol s LYS 257 Cb -0.10 -1.92 -0.12 0.00 -0.52 0.00 0.00 37.83 35.17 1nol s LYS 257 CO 0.34 0.44 1.39 1.28 -0.92 0.00 0.00 175.35 177.89 1nol n LEU 258 N 0.75 3.89 -4.25 3.17 4.77 -1.26 -5.00 117.00 119.06 1nol n LEU 258 Ca -0.17 1.20 -0.18 0.00 -0.03 0.00 0.00 56.01 56.83 1nol n LEU 258 Cb 0.54 -1.52 -0.11 0.00 -2.33 0.00 0.00 43.42 39.99 1nol n LEU 258 CO 0.25 -0.25 -0.45 -0.13 -1.33 0.00 0.00 177.39 175.49 1nol s ARG 259 N -1.54 1.06 0.45 3.23 0.52 -1.26 -5.02 118.95 116.39 1nol s ARG 259 Ca 0.58 -1.30 -0.24 0.00 -0.52 0.00 0.00 55.73 54.25 1nol s ARG 259 Cb -0.55 -0.91 -0.07 0.00 0.52 0.00 0.00 34.95 33.94 1nol s ARG 259 CO 0.59 0.17 1.23 -0.51 0.02 0.00 0.00 175.30 176.79 1nol s ASP 260 N -2.61 6.11 0.35 0.23 1.01 -1.26 -4.77 116.67 115.74 1nol s ASP 260 Ca 0.11 2.46 0.07 0.00 0.71 0.00 0.00 52.55 55.90 1nol s ASP 260 Cb -0.04 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 1nol s ASP 260 CO 0.03 -0.97 0.35 -0.76 0.21 0.00 0.00 175.17 174.03 1nol s LEU 261 N -2.89 3.63 0.41 1.23 1.43 -0.02 -4.62 118.68 117.85 1nol s LEU 261 Ca 0.62 -0.48 0.16 0.00 -1.03 0.00 0.00 54.13 53.40 1nol s LEU 261 Cb -0.33 -2.30 1.03 0.00 0.03 0.00 0.00 46.19 44.62 1nol s LEU 261 CO 0.40 -0.43 1.87 1.23 0.23 0.00 0.00 176.35 179.66 1nol h GLY 262 N 1.13 0.89 1.47 -3.19 0.00 -1.94 -2.95 103.07 98.47 1nol h GLY 262 Ca -0.44 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1nol h GLY 262 CO 0.57 0.03 -0.53 -0.55 0.00 0.00 0.00 176.54 176.06 1nol h ASP 263 N 0.46 0.00 -3.72 0.19 3.32 -1.94 -3.46 116.42 111.26 1nol h ASP 263 Ca 0.44 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.39 1nol h ASP 263 Cb 1.01 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.33 1nol h ASP 263 CO -0.17 0.00 -0.15 -0.51 -1.72 0.00 0.00 179.24 176.69 1nol s ILE 264 N -3.28 -0.00 0.07 0.35 1.10 -1.11 -5.16 121.20 113.16 1nol s ILE 264 Ca 0.03 0.02 -0.07 0.00 -0.51 0.00 0.00 60.65 60.12 1nol s ILE 264 Cb 0.08 -0.70 -0.05 0.00 0.15 0.00 0.00 42.46 41.93 1nol s ILE 264 CO 0.73 0.01 0.34 -1.61 -2.11 0.00 0.00 174.94 172.29 1nol s GLU 265 N 0.57 3.64 0.35 3.50 2.02 -1.26 -0.84 118.70 126.69 1nol s GLU 265 Ca -0.03 -0.02 0.03 0.00 0.02 0.00 0.00 54.97 54.98 1nol s GLU 265 Cb -0.04 -2.99 0.65 0.00 0.10 0.00 0.00 34.13 31.85 1nol s GLU 265 CO -0.03 0.57 2.00 0.82 0.02 0.00 0.00 175.26 178.63 1nol h ILE 266 N 2.67 1.13 0.00 -1.63 1.08 -1.94 -0.97 117.51 117.84 1nol h ILE 266 Ca -0.48 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 1nol h ILE 266 Cb 1.19 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 35.14 1nol h ILE 266 CO 0.68 0.15 0.00 0.77 -0.69 0.00 0.00 178.15 179.07 1nol h SER 267 N 0.85 0.00 0.49 1.72 4.64 -2.00 0.14 113.55 119.40 1nol h SER 267 Ca 0.26 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.45 1nol h SER 267 Cb -0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1nol h SER 267 CO -0.07 0.00 -0.56 -0.33 -0.87 0.00 0.00 176.83 175.00 1nol h GLU 268 N 0.00 0.07 -0.15 4.77 5.08 -1.58 -2.38 114.58 120.39 1nol h GLU 268 Ca 0.00 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 1nol h GLU 268 Cb 0.33 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1nol h GLU 268 CO 0.00 0.62 -0.43 0.52 -1.00 0.00 0.00 179.01 178.72 1nol h MET 269 N 0.06 0.55 -0.63 2.33 2.86 -0.67 -2.02 114.93 117.41 1nol h MET 269 Ca -0.00 -0.39 0.09 0.00 -2.06 0.00 0.00 59.70 57.33 1nol h MET 269 Cb 1.01 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 32.67 1nol h MET 269 CO 0.08 1.01 0.27 0.28 1.06 0.00 0.00 176.91 179.61 1nol h VAL 270 N 0.18 0.81 -0.29 -2.22 2.07 -1.49 -0.67 116.25 114.64 1nol h VAL 270 Ca -0.01 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1nol h VAL 270 Cb 1.04 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1nol h VAL 270 CO 0.09 0.09 0.17 -0.09 0.02 0.00 0.00 177.57 177.85 1nol h ARG 271 N 0.47 0.39 -0.53 1.57 2.43 -1.39 -0.91 114.38 116.41 1nol h ARG 271 Ca 0.31 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.51 1nol h ARG 271 Cb 0.36 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 1nol h ARG 271 CO -0.28 0.30 0.23 0.52 -1.51 0.00 0.00 179.97 179.22 1nol h MET 272 N 0.37 0.42 -0.99 0.20 2.86 -1.03 -1.86 114.93 114.89 1nol h MET 272 Ca 0.10 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 1nol h MET 272 Cb 0.01 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 1nol h MET 272 CO -0.02 0.28 0.65 -0.09 1.06 0.00 0.00 176.91 178.79 1nol h ARG 273 N 0.43 1.28 -0.29 1.72 2.43 -0.36 -1.72 114.38 117.88 1nol h ARG 273 Ca 0.25 -0.08 -0.13 0.00 -0.81 0.00 0.00 59.98 59.21 1nol h ARG 273 Cb 0.23 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1nol h ARG 273 CO -0.22 0.85 -0.32 0.93 -1.51 0.00 0.00 179.97 179.70 1nol h GLU 274 N 1.32 0.73 -0.58 0.20 4.39 -0.88 -2.06 114.58 117.70 1nol h GLU 274 Ca 0.37 -0.40 0.02 0.00 0.34 0.00 0.00 59.36 59.69 1nol h GLU 274 Cb -0.12 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.51 1nol h GLU 274 CO -0.09 1.02 0.36 0.00 -1.16 0.00 0.00 179.01 179.14 1nol h ARG 275 N 0.48 0.70 -0.69 2.33 3.08 -1.17 -2.51 114.38 116.60 1nol h ARG 275 Ca 0.04 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1nol h ARG 275 Cb 0.90 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 1nol h ARG 275 CO 0.08 0.47 0.30 0.82 -1.07 0.00 0.00 179.97 180.56 1nol h ILE 276 N 0.73 1.23 0.00 2.04 2.04 -1.13 -3.00 117.51 119.42 1nol h ILE 276 Ca 0.23 -0.69 -0.10 0.00 1.00 0.00 0.00 64.86 65.29 1nol h ILE 276 Cb -0.02 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1nol h ILE 276 CO -0.08 0.28 -0.49 -0.07 0.00 0.00 0.00 178.15 177.79 1nol h LEU 277 N 0.99 0.00 0.44 1.44 3.38 -1.08 -2.30 115.31 118.18 1nol h LEU 277 Ca 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1nol h LEU 277 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1nol h LEU 277 CO -0.03 0.49 -0.25 -0.78 0.09 0.00 0.00 178.44 177.97 1nol h ASP 278 N 0.00 -0.61 -0.11 -0.43 3.58 -1.32 -1.24 116.42 116.28 1nol h ASP 278 Ca -0.00 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 1nol h ASP 278 Cb 0.97 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.19 1nol h ASP 278 CO 0.06 -0.40 0.06 0.28 -2.88 0.00 0.00 179.24 176.36 1nol h SER 279 N -0.65 0.14 -0.87 2.28 0.02 -1.40 0.20 113.55 113.28 1nol h SER 279 Ca -0.05 -0.09 0.16 0.00 -0.84 0.00 0.00 61.79 60.97 1nol h SER 279 Cb 0.52 -0.04 -0.10 0.00 0.14 0.00 0.00 62.40 62.92 1nol h SER 279 CO 0.07 0.19 0.44 0.40 -1.14 0.00 0.00 176.83 176.79 1nol h ILE 280 N 0.08 0.69 0.00 3.27 2.04 -1.45 0.35 117.51 122.49 1nol h ILE 280 Ca 0.04 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1nol h ILE 280 Cb 0.08 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.20 1nol h ILE 280 CO -0.01 0.11 -0.19 0.45 0.00 0.00 0.00 178.15 178.51 1nol h HIS 281 N 0.60 0.00 0.00 1.37 3.86 0.05 -3.18 115.15 117.85 1nol h HIS 281 Ca 0.49 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.66 1nol h HIS 281 Cb 0.73 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.19 1nol h HIS 281 CO -0.09 0.00 -1.05 -0.07 0.86 0.00 0.00 177.93 177.58 1nol h LEU 282 N 0.00 0.00 0.00 2.43 3.38 -0.02 -3.49 115.31 117.61 1nol h LEU 282 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1nol h LEU 282 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1nol h LEU 282 CO 0.00 0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.27 1nol n GLY 283 N 1.22 0.75 3.21 0.83 0.00 0.12 -5.04 105.19 106.28 1nol n GLY 283 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 1nol n GLY 283 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1nol s TYR 284 N -2.31 -0.04 0.48 1.61 -0.85 -1.12 -1.13 117.35 113.98 1nol s TYR 284 Ca 0.00 -0.09 0.07 0.00 -0.52 0.00 0.00 57.07 56.53 1nol s TYR 284 Cb 0.00 0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.39 1nol s TYR 284 CO 0.00 -0.44 0.43 0.14 -1.52 0.00 0.00 175.55 174.16 1nol s VAL 285 N -2.25 2.21 -0.24 -3.49 -7.23 0.47 -4.46 120.40 105.41 1nol s VAL 285 Ca -0.07 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1nol s VAL 285 Cb -0.02 -2.58 0.03 0.00 0.56 0.00 0.00 36.38 34.37 1nol s VAL 285 CO -0.02 0.00 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.03 1nol s ILE 286 N -2.61 2.47 0.97 -0.62 1.01 -1.26 -1.16 121.20 120.00 1nol s ILE 286 Ca 0.44 -1.19 -0.11 0.00 0.00 0.00 0.00 60.65 59.79 1nol s ILE 286 Cb -0.03 -2.26 0.18 0.00 0.01 0.00 0.00 42.46 40.36 1nol s ILE 286 CO 0.26 0.21 1.12 -0.44 0.00 0.00 0.00 174.94 176.09 1nol s SER 287 N 1.25 2.51 0.28 3.58 0.01 0.13 -4.51 113.70 116.94 1nol s SER 287 Ca -0.01 2.02 0.01 0.00 1.31 0.00 0.00 55.95 59.28 1nol s SER 287 Cb -0.17 -2.50 0.61 0.00 0.21 0.00 0.00 66.02 64.17 1nol s SER 287 CO -0.07 -3.33 1.75 -0.33 0.41 0.00 0.00 173.24 171.67 1nol h GLU 288 N -2.03 0.59 -1.50 12.44 5.08 -1.81 -1.23 114.58 126.11 1nol h GLU 288 Ca -0.47 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1nol h GLU 288 Cb 1.28 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1nol h GLU 288 CO 0.44 0.39 0.00 -0.40 -1.00 0.00 0.00 179.01 178.44 1nol n ASP 289 N -4.89 2.61 0.00 1.42 5.68 -1.26 -4.83 116.55 115.28 1nol n ASP 289 Ca 0.19 -1.58 0.00 0.00 -0.50 0.00 0.00 54.79 52.90 1nol n ASP 289 Cb 0.51 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 1nol n ASP 289 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nol n GLY 290 N 0.94 1.00 3.89 6.12 0.00 -0.47 -4.96 105.19 111.72 1nol n GLY 290 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1nol n GLY 290 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nol s SER 291 N -2.64 5.42 -0.20 1.61 1.04 -1.26 -4.83 113.70 112.85 1nol s SER 291 Ca 0.00 1.01 -0.09 0.00 0.48 0.00 0.00 55.95 57.35 1nol s SER 291 Cb 0.00 -1.83 -0.05 0.00 0.10 0.00 0.00 66.02 64.24 1nol s SER 291 CO 0.00 -1.31 0.11 -1.00 0.98 0.00 0.00 173.24 172.02 1nol s HIS 292 N -3.29 3.36 -0.11 5.02 3.76 -1.26 0.21 115.29 122.98 1nol s HIS 292 Ca 0.57 0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.73 1nol s HIS 292 Cb -0.11 -2.14 -0.02 0.00 1.11 0.00 0.00 32.58 31.42 1nol s HIS 292 CO 0.50 0.24 -0.11 0.21 -0.85 0.00 0.00 174.74 174.73 1nol s LYS 293 N 0.38 3.21 0.13 1.40 2.20 -0.31 -4.91 119.74 121.84 1nol s LYS 293 Ca 0.06 -0.64 -0.25 0.00 -0.36 0.00 0.00 55.97 54.78 1nol s LYS 293 Cb -0.11 -2.63 -0.07 0.00 -1.51 0.00 0.00 37.83 33.50 1nol s LYS 293 CO -0.01 0.34 0.77 0.99 -0.36 0.00 0.00 175.35 177.08 1nol s THR 294 N 0.03 4.48 -1.45 3.43 2.01 -1.26 -0.40 115.64 122.48 1nol s THR 294 Ca -0.03 1.67 -0.11 0.00 0.31 0.00 0.00 61.69 63.52 1nol s THR 294 Cb -0.14 -4.13 0.05 0.00 0.01 0.00 0.00 72.50 68.29 1nol s THR 294 CO 0.04 0.48 2.32 0.18 -0.69 0.00 0.00 174.62 176.95 1nol n LEU 295 N 1.93 7.33 -4.70 4.42 4.77 -0.29 -4.81 117.00 125.64 1nol n LEU 295 Ca -0.05 -4.36 -0.31 0.00 -0.03 0.00 0.00 56.01 51.27 1nol n LEU 295 Cb 0.49 -1.58 0.14 0.00 -2.33 0.00 0.00 43.42 40.15 1nol n LEU 295 CO 0.46 1.45 0.67 1.51 -1.33 0.00 0.00 177.39 180.15 1nol s ASP 296 N 2.26 3.44 0.43 -1.43 -4.77 -1.26 -4.63 116.67 110.70 1nol s ASP 296 Ca 0.51 1.87 0.30 0.00 -3.30 0.00 0.00 52.55 51.93 1nol s ASP 296 Cb 0.14 -2.46 1.45 0.00 -1.09 0.00 0.00 42.92 40.96 1nol s ASP 296 CO -0.06 -2.72 1.90 -0.33 0.70 0.00 0.00 175.17 174.65 1nol h GLU 297 N -1.60 0.00 0.00 2.11 5.08 -1.99 0.55 114.58 118.73 1nol h GLU 297 Ca -0.46 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.55 1nol h GLU 297 Cb 1.26 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.45 1nol h GLU 297 CO 0.48 0.00 -2.30 -0.11 -1.00 0.00 0.00 179.01 176.08 1nol n LEU 298 N -2.59 0.91 -0.02 1.33 7.94 -1.26 -4.52 117.00 118.80 1nol n LEU 298 Ca -0.01 -0.04 0.01 0.00 -1.11 0.00 0.00 56.01 54.86 1nol n LEU 298 Cb 0.14 0.06 -0.00 0.00 0.53 0.00 0.00 43.42 44.15 1nol n LEU 298 CO 0.18 0.60 0.12 1.41 -1.11 0.00 0.00 177.39 178.58 1nol n HIS 299 N -2.85 0.00 -0.13 1.96 8.25 -1.11 -4.83 115.22 116.51 1nol n HIS 299 Ca -0.34 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.08 1nol n HIS 299 Cb 1.06 0.00 0.04 0.00 1.12 0.00 0.00 29.99 32.21 1nol n HIS 299 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1nol h GLY 300 N 0.25 0.46 1.49 -1.41 0.00 -0.12 -1.48 103.07 102.26 1nol h GLY 300 Ca 0.00 0.03 -0.12 0.00 0.00 0.00 0.00 47.33 47.23 1nol h GLY 300 CO 0.00 -0.09 -0.35 -0.84 0.00 0.00 0.00 176.54 175.26 1nol h THR 301 N 0.14 1.29 -0.41 4.70 2.02 -1.88 -2.16 112.91 116.61 1nol h THR 301 Ca 0.21 -1.49 -0.10 0.00 0.77 0.00 0.00 66.41 65.80 1nol h THR 301 Cb 0.29 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1nol h THR 301 CO -0.33 0.47 -0.14 -0.78 0.37 0.00 0.00 175.52 175.11 1nol h ASP 302 N 0.48 0.84 -0.74 4.18 3.58 -1.60 0.05 116.42 123.21 1nol h ASP 302 Ca 0.05 -0.38 0.00 0.00 0.42 0.00 0.00 57.03 57.12 1nol h ASP 302 Cb 0.84 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 1nol h ASP 302 CO 0.07 1.03 0.48 0.40 -2.88 0.00 0.00 179.24 178.34 1nol h ILE 303 N 0.64 1.20 -0.46 2.25 2.04 -1.16 -2.27 117.51 119.74 1nol h ILE 303 Ca 0.10 -0.39 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 1nol h ILE 303 Cb 0.69 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1nol h ILE 303 CO 0.05 0.20 -0.19 0.25 0.00 0.00 0.00 178.15 178.46 1nol h LEU 304 N 1.01 0.93 -0.62 1.44 5.85 -1.29 -2.54 115.31 120.08 1nol h LEU 304 Ca 0.27 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.71 1nol h LEU 304 Cb -0.09 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.63 1nol h LEU 304 CO -0.06 1.09 0.33 1.23 -0.34 0.00 0.00 178.44 180.70 1nol h GLY 305 N 0.93 0.90 1.62 3.75 0.00 -0.54 -1.09 103.07 108.64 1nol h GLY 305 Ca 0.11 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1nol h GLY 305 CO 0.06 0.14 -0.12 0.00 0.00 0.00 0.00 176.54 176.61 1nol h ALA 306 N 1.33 1.28 0.00 3.60 0.00 -1.27 -1.88 119.26 122.32 1nol h ALA 306 Ca 0.28 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1nol h ALA 306 Cb 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1nol h ALA 306 CO -0.18 0.48 -0.79 1.47 0.00 0.00 0.00 179.25 180.22 1nol n LEU 307 N -4.21 0.78 0.03 0.00 -0.00 -0.84 -0.03 117.00 112.73 1nol n LEU 307 Ca 0.00 -0.28 -0.21 0.00 -0.00 0.00 0.00 56.01 55.53 1nol n LEU 307 Cb 0.31 -0.11 -0.14 0.00 -0.00 0.00 0.00 43.42 43.49 1nol n LEU 307 CO 0.40 0.19 -0.68 0.58 -0.00 0.00 0.00 177.39 177.88 1nol h VAL 308 N 0.00 0.76 0.35 1.47 2.07 -1.12 -3.41 116.25 116.36 1nol h VAL 308 Ca 0.00 -2.44 -0.02 0.00 0.82 0.00 0.00 66.70 65.06 1nol h VAL 308 Cb 0.50 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1nol h VAL 308 CO 0.00 0.86 -0.18 -0.08 0.02 0.00 0.00 177.57 178.19 1nol h GLU 309 N 0.08 -0.47 -6.14 1.57 4.81 -1.50 -2.33 114.58 110.60 1nol h GLU 309 Ca -0.38 0.03 -0.49 0.00 -0.13 0.00 0.00 59.36 58.39 1nol h GLU 309 Cb 2.05 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 31.52 1nol h GLU 309 CO 0.12 -0.31 -0.45 -1.54 -0.73 0.00 0.00 179.01 176.10 1nol s SER 310 N -4.77 6.30 0.46 1.04 1.04 -1.26 -1.48 113.70 115.04 1nol s SER 310 Ca -0.16 0.10 0.08 0.00 0.48 0.00 0.00 55.95 56.46 1nol s SER 310 Cb 0.05 -1.86 0.02 0.00 0.10 0.00 0.00 66.02 64.33 1nol s SER 310 CO 0.64 -0.02 0.56 -0.94 0.98 0.00 0.00 173.24 174.46 1nol s SER 311 N -3.68 5.32 0.48 7.02 1.04 0.96 -4.90 113.70 119.95 1nol s SER 311 Ca 0.34 -0.65 0.28 0.00 0.48 0.00 0.00 55.95 56.40 1nol s SER 311 Cb -0.10 -0.36 1.35 0.00 0.10 0.00 0.00 66.02 67.02 1nol s SER 311 CO 0.29 -0.88 1.82 0.22 0.98 0.00 0.00 173.24 175.66 1nol h TYR 312 N 0.64 0.26 -0.20 5.02 3.20 -1.30 -2.05 116.97 122.53 1nol h TYR 312 Ca -0.38 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.50 1nol h TYR 312 Cb 1.28 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.47 1nol h TYR 312 CO 0.47 0.03 0.00 0.39 -1.64 0.00 0.00 178.16 177.41 1nol n GLU 313 N -4.37 1.48 -1.60 1.82 1.02 -1.26 -4.92 120.64 112.80 1nol n GLU 313 Ca 0.23 -0.74 -0.47 0.00 -0.02 0.00 0.00 57.16 56.16 1nol n GLU 313 Cb 1.01 -1.18 -0.03 0.00 -0.02 0.00 0.00 31.44 31.21 1nol n GLU 313 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1nol n SER 314 N 0.08 1.67 0.22 1.62 2.88 -0.77 -4.85 113.62 114.47 1nol n SER 314 Ca 0.08 1.15 0.15 0.00 -1.33 0.00 0.00 58.87 58.92 1nol n SER 314 Cb 0.18 -1.27 0.70 0.00 -0.75 0.00 0.00 64.21 63.07 1nol n SER 314 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1nol h VAL 315 N 2.69 0.00 -0.77 2.46 -1.51 -1.90 -3.40 116.25 113.83 1nol h VAL 315 Ca -0.43 -0.22 0.05 0.00 -1.23 0.00 0.00 66.70 64.86 1nol h VAL 315 Cb 1.33 1.02 -0.19 0.00 -2.13 0.00 0.00 31.29 31.31 1nol h VAL 315 CO 0.70 0.00 -0.31 0.21 -1.23 0.00 0.00 177.57 176.95 1nol s ASN 316 N -4.77 -1.23 0.10 4.19 3.84 -1.26 -2.58 114.94 113.23 1nol s ASN 316 Ca 0.00 -0.20 -0.02 0.00 0.21 0.00 0.00 52.86 52.86 1nol s ASN 316 Cb 0.09 1.67 -0.23 0.00 -0.55 0.00 0.00 41.25 42.23 1nol s ASN 316 CO 0.40 -0.18 1.20 -0.74 -2.79 0.00 0.00 177.10 174.98 1nol h HIS 317 N 7.20 0.39 -0.68 0.43 2.76 -1.88 -2.05 115.15 121.33 1nol h HIS 317 Ca -0.01 -0.28 -0.01 0.00 -2.20 0.00 0.00 60.37 57.87 1nol h HIS 317 Cb 1.19 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 30.10 1nol h HIS 317 CO 0.11 1.19 0.37 1.49 -1.30 0.00 0.00 177.93 179.79 1nol h GLU 318 N 0.08 0.95 0.05 5.26 4.57 -1.95 -1.12 114.58 122.41 1nol h GLU 318 Ca -0.10 -0.11 -0.34 0.00 -1.18 0.00 0.00 59.36 57.63 1nol h GLU 318 Cb 1.86 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 30.23 1nol h GLU 318 CO 0.18 0.71 -1.90 0.98 -1.18 0.00 0.00 179.01 177.80 1nol n TYR 319 N -4.51 0.83 0.43 0.92 9.36 -1.22 -4.44 117.16 118.53 1nol n TYR 319 Ca 0.05 0.25 0.12 0.00 3.32 0.00 0.00 57.90 61.64 1nol n TYR 319 Cb 0.09 -1.10 0.11 0.00 -0.63 0.00 0.00 39.34 37.81 1nol n TYR 319 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1nol h TYR 320 N -0.45 0.00 0.00 2.98 0.05 -1.45 -3.46 116.97 114.64 1nol h TYR 320 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.32 1nol h TYR 320 Cb 1.72 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.46 1nol h TYR 320 CO 0.05 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.57 1nol n GLY 321 N 1.29 0.31 2.68 3.88 0.00 -0.42 -4.48 105.19 108.45 1nol n GLY 321 Ca 0.02 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.18 1nol n GLY 321 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nol n ASN 322 N 6.10 -1.77 0.12 1.61 5.15 -1.26 -4.60 115.26 120.61 1nol n ASN 322 Ca 0.00 -3.06 -0.13 0.00 -0.60 0.00 0.00 54.58 50.79 1nol n ASN 322 Cb 0.00 1.25 -0.08 0.00 -0.53 0.00 0.00 39.78 40.42 1nol n ASN 322 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1nol h LEU 323 N 2.55 -0.23 0.12 1.20 5.85 -1.77 -1.66 115.31 121.37 1nol h LEU 323 Ca -0.17 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1nol h LEU 323 Cb 1.19 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 1nol h LEU 323 CO 0.08 0.02 -0.10 -0.74 -0.34 0.00 0.00 178.44 177.37 1nol h HIS 324 N -0.48 -0.25 -0.55 1.25 2.76 -1.42 -1.98 115.15 114.48 1nol h HIS 324 Ca -0.03 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.03 1nol h HIS 324 Cb 0.37 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.40 1nol h HIS 324 CO -0.00 -0.15 -0.09 -0.91 -1.30 0.00 0.00 177.93 175.47 1nol h ASN 325 N -0.22 1.03 0.17 3.26 2.35 -1.28 -1.53 115.58 119.36 1nol h ASN 325 Ca -0.00 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.40 1nol h ASN 325 Cb 0.21 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 1nol h ASN 325 CO -0.01 1.13 -0.06 -0.50 -1.65 0.00 0.00 177.43 176.34 1nol h TRP 326 N 0.92 0.00 -0.41 1.19 -0.00 -1.22 -2.40 115.95 114.04 1nol h TRP 326 Ca 0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 58.89 59.00 1nol h TRP 326 Cb 0.66 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.80 1nol h TRP 326 CO 0.04 0.06 0.13 0.78 -0.00 0.00 0.00 178.44 179.46 1nol h GLY 327 N 0.41 0.68 0.74 1.49 0.00 -0.49 0.11 103.07 106.01 1nol h GLY 327 Ca -0.00 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 46.97 1nol h GLY 327 CO 0.01 0.37 0.23 0.45 0.00 0.00 0.00 176.54 177.60 1nol h HIS 328 N 0.52 0.42 -0.27 5.60 3.86 -1.23 -1.83 115.15 122.22 1nol h HIS 328 Ca 0.13 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.25 1nol h HIS 328 Cb 0.25 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.59 1nol h HIS 328 CO 0.01 0.21 -0.26 0.28 0.86 0.00 0.00 177.93 179.03 1nol h VAL 329 N 0.45 1.31 0.00 2.45 2.07 -1.04 -1.88 116.25 119.62 1nol h VAL 329 Ca 0.20 -1.42 -0.14 0.00 0.82 0.00 0.00 66.70 66.17 1nol h VAL 329 Cb 0.12 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1nol h VAL 329 CO -0.15 0.45 -0.66 0.71 0.02 0.00 0.00 177.57 177.94 1nol h THR 330 N 0.37 1.46 -0.14 2.57 1.35 -0.75 -2.01 112.91 115.77 1nol h THR 330 Ca 0.04 -2.27 -0.14 0.00 -0.55 0.00 0.00 66.41 63.49 1nol h THR 330 Cb 0.82 2.23 -0.01 0.00 -1.73 0.00 0.00 68.15 69.46 1nol h THR 330 CO 0.06 0.65 -0.52 0.24 -0.25 0.00 0.00 175.52 175.70 1nol h MET 331 N 0.00 0.38 0.00 4.72 2.86 -1.30 -3.02 114.93 118.57 1nol h MET 331 Ca -0.01 -0.23 -0.06 0.00 -2.06 0.00 0.00 59.70 57.35 1nol h MET 331 Cb 1.18 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.85 1nol h MET 331 CO 0.09 0.81 -0.28 0.00 1.06 0.00 0.00 176.91 178.59 1nol h ALA 332 N 1.15 0.93 -0.60 6.32 0.00 -1.12 -3.19 119.26 122.75 1nol h ALA 332 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1nol h ALA 332 Cb 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1nol h ALA 332 CO 0.09 0.34 0.00 0.54 0.00 0.00 0.00 179.25 180.22 1nol n ARG 333 N -3.32 3.03 0.28 0.00 1.74 -0.77 -1.12 116.66 116.50 1nol n ARG 333 Ca 0.01 -2.59 0.13 0.00 -0.77 0.00 0.00 57.85 54.63 1nol n ARG 333 Cb 0.52 -1.59 0.81 0.00 -1.02 0.00 0.00 32.46 31.18 1nol n ARG 333 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1nol h ILE 334 N 3.58 0.66 0.00 0.55 2.10 -1.52 0.53 117.51 123.42 1nol h ILE 334 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 1nol h ILE 334 Cb 1.07 1.07 0.00 0.00 -1.09 0.00 0.00 36.82 37.87 1nol h ILE 334 CO 0.07 0.03 0.00 1.12 -1.08 0.00 0.00 178.15 178.29 1nol h HIS 335 N 0.00 0.00 -0.82 2.19 2.07 -1.86 -3.37 115.15 113.36 1nol h HIS 335 Ca -0.00 0.00 -0.34 0.00 -2.85 0.00 0.00 60.37 57.18 1nol h HIS 335 Cb 0.07 0.00 -0.25 0.00 2.57 0.00 0.00 27.41 29.80 1nol h HIS 335 CO 0.00 0.00 -0.75 -3.47 -3.07 0.00 0.00 177.93 170.64 1nol n ASP 336 N -2.57 -1.12 0.08 3.10 2.03 0.11 -5.00 116.55 113.16 1nol n ASP 336 Ca 0.03 -3.37 0.15 0.00 0.52 0.00 0.00 54.79 52.12 1nol n ASP 336 Cb 0.38 0.88 0.65 0.00 -0.72 0.00 0.00 41.12 42.31 1nol n ASP 336 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1nol h PRO 337 N 3.13 0.05 -0.39 -0.67 0.13 -1.53 -1.04 132.00 131.67 1nol h PRO 337 Ca -0.02 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1nol h PRO 337 Cb 1.04 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1nol h PRO 337 CO 0.30 0.03 0.00 -0.40 -0.23 0.00 0.00 178.00 177.70 1nol n ASP 338 N -4.44 3.93 0.00 1.44 5.68 -1.26 -4.10 116.55 117.79 1nol n ASP 338 Ca 0.06 -2.59 0.00 0.00 -0.50 0.00 0.00 54.79 51.76 1nol n ASP 338 Cb 0.41 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 1nol n ASP 338 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nol n GLY 339 N 0.23 2.61 0.33 6.12 0.00 -0.40 -4.84 105.19 109.25 1nol n GLY 339 Ca 0.20 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.42 1nol n GLY 339 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1nol h ARG 340 N 2.08 0.00 -0.01 1.61 0.11 -1.94 -1.46 114.38 114.77 1nol h ARG 340 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1nol h ARG 340 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1nol h ARG 340 CO 0.00 0.00 -0.16 1.19 0.10 0.00 0.00 179.97 181.10 1nol n PHE 341 N -3.30 0.00 -4.10 4.08 3.72 -1.26 -4.96 117.46 111.64 1nol n PHE 341 Ca -0.03 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.07 1nol n PHE 341 Cb 0.09 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1nol n PHE 341 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1nol n HIS 342 N -0.47 -1.65 -3.97 1.38 8.25 -0.55 -4.97 115.22 113.24 1nol n HIS 342 Ca 0.14 0.76 -0.31 0.00 -0.26 0.00 0.00 57.72 58.05 1nol n HIS 342 Cb 0.34 -3.32 -0.05 0.00 1.12 0.00 0.00 29.99 28.08 1nol n HIS 342 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1nol s GLU 343 N -6.80 3.23 0.54 -0.41 0.41 -1.26 -5.11 118.70 109.30 1nol s GLU 343 Ca 0.31 -0.53 -0.15 0.00 -0.41 0.00 0.00 54.97 54.19 1nol s GLU 343 Cb -0.17 -2.92 -0.07 0.00 -1.78 0.00 0.00 34.13 29.19 1nol s GLU 343 CO 0.92 0.60 1.00 -1.21 -0.49 0.00 0.00 175.26 176.07 1nol s GLU 344 N -2.42 3.83 0.93 1.61 0.41 -1.26 -5.02 118.70 116.77 1nol s GLU 344 Ca 0.32 0.93 -0.11 0.00 -0.41 0.00 0.00 54.97 55.71 1nol s GLU 344 Cb -0.13 -2.12 0.15 0.00 -1.78 0.00 0.00 34.13 30.26 1nol s GLU 344 CO 0.25 -0.38 1.12 -2.14 -0.49 0.00 0.00 175.26 173.62 1nol s PRO 345 N -4.29 0.93 0.86 0.39 0.02 -1.26 -3.44 135.00 128.21 1nol s PRO 345 Ca 0.58 1.35 -0.15 0.00 0.02 0.00 0.00 61.00 62.81 1nol s PRO 345 Cb -0.11 -1.73 0.20 0.00 0.02 0.00 0.00 34.50 32.88 1nol s PRO 345 CO 0.36 -2.62 1.13 0.41 -0.33 0.00 0.00 177.00 175.95 1nol n GLY 346 N 0.00 -1.56 0.20 0.52 0.00 -0.28 -2.19 105.19 101.88 1nol n GLY 346 Ca 0.10 -1.69 0.14 0.00 0.00 0.00 0.00 46.02 44.57 1nol n GLY 346 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1nol h VAL 347 N -1.74 0.00 0.00 1.61 -1.51 -1.90 -2.29 116.25 110.42 1nol h VAL 347 Ca -0.37 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1nol h VAL 347 Cb 1.02 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 1nol h VAL 347 CO 0.26 0.00 0.00 0.23 -1.23 0.00 0.00 177.57 176.83 1nol n MET 348 N -2.49 0.06 0.00 5.19 2.81 -1.26 -2.29 117.12 119.14 1nol n MET 348 Ca -0.01 0.24 0.11 0.00 -1.81 0.00 0.00 57.70 56.24 1nol n MET 348 Cb 0.10 -1.50 0.49 0.00 -0.71 0.00 0.00 33.22 31.60 1nol n MET 348 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1nol n SER 349 N -1.42 0.00 -3.88 7.83 3.41 -0.86 -4.73 113.62 113.96 1nol n SER 349 Ca 0.04 0.48 -0.19 0.00 -0.26 0.00 0.00 58.87 58.95 1nol n SER 349 Cb 0.13 -0.49 -0.16 0.00 -0.26 0.00 0.00 64.21 63.42 1nol n SER 349 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nol s ASP 350 N -2.99 0.74 0.08 4.04 -1.08 -1.13 -1.05 116.67 115.27 1nol s ASP 350 Ca 0.11 -0.09 0.12 0.00 -0.52 0.00 0.00 52.55 52.17 1nol s ASP 350 Cb 0.15 -0.35 0.54 0.00 -1.46 0.00 0.00 42.92 41.80 1nol s ASP 350 CO 0.42 -0.06 1.38 0.35 0.52 0.00 0.00 175.17 177.77 1nol n THR 351 N 3.97 1.30 1.03 1.71 -2.24 -1.26 -1.62 114.28 117.17 1nol n THR 351 Ca -0.25 0.38 0.12 0.00 -2.27 0.00 0.00 64.05 62.03 1nol n THR 351 Cb 0.51 -1.27 0.29 0.00 -2.10 0.00 0.00 70.33 67.77 1nol n THR 351 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1nol n SER 352 N -1.70 0.51 0.00 3.42 7.64 -1.26 -3.23 113.62 119.00 1nol n SER 352 Ca 0.02 -0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.64 1nol n SER 352 Cb 0.11 0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1nol n SER 352 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1nol n THR 353 N -1.42 0.00 0.31 0.44 -2.24 -1.07 -4.68 114.28 105.63 1nol n THR 353 Ca 0.06 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 62.04 1nol n THR 353 Cb 0.34 0.18 1.03 0.00 -2.10 0.00 0.00 70.33 69.78 1nol n THR 353 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1nol h SER 354 N 0.00 0.00 0.73 3.42 4.64 -0.87 -1.27 113.55 120.19 1nol h SER 354 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nol h SER 354 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1nol h SER 354 CO 0.00 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.16 1nol n LEU 355 N -3.31 0.51 0.15 5.97 4.77 -1.26 -3.08 117.00 120.75 1nol n LEU 355 Ca -0.02 0.62 0.01 0.00 -0.03 0.00 0.00 56.01 56.58 1nol n LEU 355 Cb 0.13 -0.54 0.21 0.00 -2.33 0.00 0.00 43.42 40.88 1nol n LEU 355 CO 0.24 -0.45 0.54 0.03 -1.33 0.00 0.00 177.39 176.41 1nol h ARG 356 N 0.00 0.00 -5.97 3.23 3.08 -1.23 -3.43 114.38 110.05 1nol h ARG 356 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1nol h ARG 356 Cb 0.36 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.35 1nol h ARG 356 CO 0.00 0.55 0.44 0.34 -1.07 0.00 0.00 179.97 180.23 1nol s ASP 357 N -6.69 6.98 0.60 7.04 -1.08 -1.18 -4.81 116.67 117.54 1nol s ASP 357 Ca -0.01 1.21 0.29 0.00 -0.52 0.00 0.00 52.55 53.52 1nol s ASP 357 Cb 0.12 -2.47 1.49 0.00 -1.46 0.00 0.00 42.92 40.60 1nol s ASP 357 CO 0.74 -0.43 1.90 -0.65 0.52 0.00 0.00 175.17 177.25 1nol h PRO 358 N 7.34 0.00 0.00 4.34 0.11 -1.90 -1.39 132.00 140.50 1nol h PRO 358 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1nol h PRO 358 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1nol h PRO 358 CO 0.85 0.00 0.00 0.97 -0.21 0.00 0.00 178.00 179.61 1nol h ILE 359 N 0.00 0.00 -0.74 4.15 6.09 -1.91 -2.84 117.51 122.26 1nol h ILE 359 Ca 0.18 -0.57 0.13 0.00 -1.37 0.00 0.00 64.86 63.23 1nol h ILE 359 Cb 1.08 1.52 -0.09 0.00 0.47 0.00 0.00 36.82 39.80 1nol h ILE 359 CO -0.00 0.00 0.30 0.15 -3.07 0.00 0.00 178.15 175.53 1nol h PHE 360 N 0.00 0.51 0.00 2.19 3.04 -1.50 -1.90 116.94 119.28 1nol h PHE 360 Ca 0.00 0.04 -0.20 0.00 3.98 0.00 0.00 57.97 61.79 1nol h PHE 360 Cb 0.61 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.98 1nol h PHE 360 CO 0.00 0.08 -0.96 1.88 -2.02 0.00 0.00 178.31 177.28 1nol h TYR 361 N 0.45 0.00 -0.29 0.41 0.05 -1.70 -0.78 116.97 115.11 1nol h TYR 361 Ca 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.16 1nol h TYR 361 Cb 0.59 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 1nol h TYR 361 CO -0.16 0.94 0.10 -0.91 -1.05 0.00 0.00 178.16 177.08 1nol h ASN 362 N 0.00 0.40 -0.34 3.88 2.35 -1.53 -0.45 115.58 119.89 1nol h ASN 362 Ca -0.02 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.46 1nol h ASN 362 Cb 1.73 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.99 1nol h ASN 362 CO 0.12 0.48 -0.14 -0.25 -1.65 0.00 0.00 177.43 175.99 1nol h TRP 363 N 0.31 0.80 0.00 1.19 -0.00 -1.11 -0.56 115.95 116.57 1nol h TRP 363 Ca 0.09 -0.19 0.00 0.00 -0.00 0.00 0.00 58.89 58.79 1nol h TRP 363 Cb 0.21 -0.19 0.00 0.00 -0.00 0.00 0.00 29.16 29.18 1nol h TRP 363 CO -0.00 0.89 -0.28 0.45 -0.00 0.00 0.00 178.44 179.50 1nol h HIS 364 N 0.48 0.00 -0.09 2.65 3.86 -1.13 -1.52 115.15 119.40 1nol h HIS 364 Ca 0.08 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.12 1nol h HIS 364 Cb 0.67 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.13 1nol h HIS 364 CO 0.06 0.00 -0.68 0.00 0.86 0.00 0.00 177.93 178.17 1nol h ARG 365 N 0.00 0.39 0.04 2.45 2.47 -1.05 -1.13 114.38 117.54 1nol h ARG 365 Ca 0.00 -0.30 0.03 0.00 -1.26 0.00 0.00 59.98 58.45 1nol h ARG 365 Cb 0.85 0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 29.18 1nol h ARG 365 CO 0.00 0.92 -0.33 0.35 0.56 0.00 0.00 179.97 181.47 1nol h PHE 366 N 0.28 -0.91 -0.27 3.04 3.57 -1.06 -0.77 116.94 120.82 1nol h PHE 366 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1nol h PHE 366 Cb 1.23 0.39 -0.01 0.00 2.79 0.00 0.00 35.95 40.35 1nol h PHE 366 CO 0.04 -0.43 0.17 0.82 -2.23 0.00 0.00 178.31 176.69 1nol h ILE 367 N -0.51 1.08 -1.00 1.41 1.08 -1.30 -2.24 117.51 116.03 1nol h ILE 367 Ca 0.05 -0.15 0.17 0.00 -0.39 0.00 0.00 64.86 64.54 1nol h ILE 367 Cb 0.57 0.70 -0.10 0.00 -3.07 0.00 0.00 36.82 34.92 1nol h ILE 367 CO -0.25 0.07 0.61 -0.78 -0.69 0.00 0.00 178.15 177.12 1nol h ASP 368 N 0.36 0.83 -0.51 1.72 3.58 -1.20 -0.10 116.42 121.09 1nol h ASP 368 Ca 0.10 0.08 0.08 0.00 0.42 0.00 0.00 57.03 57.71 1nol h ASP 368 Cb -0.03 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 40.92 1nol h ASP 368 CO -0.02 0.34 0.35 0.78 -2.88 0.00 0.00 179.24 177.81 1nol h ASN 369 N 0.84 0.30 -0.63 2.28 4.21 -0.53 -1.30 115.58 120.74 1nol h ASN 369 Ca 0.55 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 58.02 1nol h ASN 369 Cb 0.76 -0.06 -0.03 0.00 -1.12 0.00 0.00 38.32 37.87 1nol h ASN 369 CO -0.34 0.19 0.21 0.40 -1.29 0.00 0.00 177.43 176.60 1nol h ILE 370 N 0.34 1.24 -0.04 2.81 2.04 -0.75 -2.18 117.51 120.98 1nol h ILE 370 Ca 0.23 -0.82 -0.10 0.00 1.00 0.00 0.00 64.86 65.18 1nol h ILE 370 Cb 0.48 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1nol h ILE 370 CO -0.06 0.31 -0.44 -0.26 0.00 0.00 0.00 178.15 177.71 1nol h PHE 371 N 0.91 0.09 -0.02 1.37 0.04 -1.23 -2.99 116.94 115.11 1nol h PHE 371 Ca 0.21 -0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.81 1nol h PHE 371 Cb 0.27 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 1nol h PHE 371 CO 0.02 0.51 -0.63 1.25 -0.60 0.00 0.00 178.31 178.86 1nol h HIS 372 N 0.07 0.11 -0.70 -0.55 2.76 -1.04 -0.71 115.15 115.09 1nol h HIS 372 Ca 0.00 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.11 1nol h HIS 372 Cb 0.81 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.72 1nol h HIS 372 CO 0.00 0.68 0.34 0.93 -1.30 0.00 0.00 177.93 178.59 1nol h GLU 373 N 0.06 1.00 -0.10 5.26 4.39 -1.25 -0.77 114.58 123.18 1nol h GLU 373 Ca -0.01 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1nol h GLU 373 Cb 1.12 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 1nol h GLU 373 CO 0.09 0.78 -0.00 -0.92 -1.16 0.00 0.00 179.01 177.80 1nol h TYR 374 N 0.97 0.19 0.00 4.33 3.20 -1.40 -2.93 116.97 121.33 1nol h TYR 374 Ca 0.24 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1nol h TYR 374 Cb 0.11 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1nol h TYR 374 CO 0.00 0.44 -0.07 0.87 -1.64 0.00 0.00 178.16 177.76 1nol h LYS 375 N -0.11 0.00 0.00 1.82 1.79 -0.99 -0.12 116.57 118.96 1nol h LYS 375 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1nol h LYS 375 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1nol h LYS 375 CO 0.01 0.07 0.00 -0.91 -1.08 0.00 0.00 179.45 177.54 1nol h ASN 376 N 0.00 0.00 0.35 0.86 2.35 -0.96 -1.75 115.58 116.43 1nol h ASN 376 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1nol h ASN 376 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1nol h ASN 376 CO 0.01 0.00 -0.11 0.35 -1.65 0.00 0.00 177.43 176.03 1nol n THR 377 N -2.70 0.00 -3.28 2.81 -2.24 -0.06 -4.87 114.28 103.95 1nol n THR 377 Ca 0.02 -0.06 -0.30 0.00 -2.27 0.00 0.00 64.05 61.44 1nol n THR 377 Cb 0.33 -0.09 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 1nol n THR 377 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nol s LEU 378 N -2.47 4.06 0.29 3.22 1.43 -0.66 -5.06 118.68 119.50 1nol s LEU 378 Ca 0.29 0.87 -0.29 0.00 -1.03 0.00 0.00 54.13 53.97 1nol s LEU 378 Cb 0.20 -3.68 -0.09 0.00 0.03 0.00 0.00 46.19 42.65 1nol s LEU 378 CO 0.47 -0.19 1.06 -0.54 0.23 0.00 0.00 176.35 177.39 1nol s LYS 379 N -3.33 4.60 0.54 1.70 1.02 -1.26 -4.68 119.74 118.33 1nol s LYS 379 Ca 0.47 1.69 -0.20 0.00 0.02 0.00 0.00 55.97 57.95 1nol s LYS 379 Cb -0.11 -3.09 -0.07 0.00 -0.52 0.00 0.00 37.83 34.04 1nol s LYS 379 CO 0.27 0.21 0.95 -2.30 -0.92 0.00 0.00 175.35 173.56 1nol n PRO 380 N 1.02 1.04 -1.92 -1.68 -0.02 -1.26 -4.86 135.00 127.33 1nol n PRO 380 Ca -0.00 0.39 -0.41 0.00 -2.02 0.00 0.00 63.50 61.46 1nol n PRO 380 Cb 0.46 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.82 1nol n PRO 380 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1nol s TYR 381 N -1.45 2.82 0.61 6.00 2.02 -1.26 -5.03 117.35 121.06 1nol s TYR 381 Ca 0.71 1.12 0.01 0.00 -0.37 0.00 0.00 57.07 58.54 1nol s TYR 381 Cb -0.46 -3.91 0.07 0.00 -0.40 0.00 0.00 41.96 37.26 1nol s TYR 381 CO 0.51 -2.77 0.85 0.16 -1.57 0.00 0.00 175.55 172.73 1nol s ASP 382 N 0.01 4.96 0.28 2.29 1.47 -1.26 -4.95 116.67 119.47 1nol s ASP 382 Ca 0.55 -0.16 0.01 0.00 1.18 0.00 0.00 52.55 54.13 1nol s ASP 382 Cb -0.44 -0.54 0.61 0.00 -0.34 0.00 0.00 42.92 42.21 1nol s ASP 382 CO 0.53 -1.39 1.75 -0.74 0.68 0.00 0.00 175.17 176.01 1nol h HIS 383 N -0.12 0.80 -0.90 2.11 -0.00 -1.99 0.62 115.15 115.67 1nol h HIS 383 Ca -0.40 0.04 0.24 0.00 -0.00 0.00 0.00 60.37 60.25 1nol h HIS 383 Cb 1.29 -0.22 -0.16 0.00 -0.00 0.00 0.00 27.41 28.32 1nol h HIS 383 CO 0.19 0.14 0.12 0.22 -0.00 0.00 0.00 177.93 178.60 1nol h ASP 384 N 0.60 -0.25 0.96 3.26 3.58 -1.94 0.93 116.42 123.56 1nol h ASP 384 Ca 0.50 0.23 -0.11 0.00 0.42 0.00 0.00 57.03 58.07 1nol h ASP 384 Cb 0.78 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 42.18 1nol h ASP 384 CO -0.40 -0.25 -1.11 0.58 -2.88 0.00 0.00 179.24 175.18 1nol h VAL 385 N 0.10 0.44 0.04 2.25 2.07 -1.25 -3.38 116.25 116.52 1nol h VAL 385 Ca 0.55 -1.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1nol h VAL 385 Cb 1.11 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 1nol h VAL 385 CO -0.76 0.25 -0.02 -0.07 0.02 0.00 0.00 177.57 176.99 1nol h LEU 386 N 0.00 -0.04 -9.56 2.57 3.38 -1.30 -3.49 115.31 106.87 1nol h LEU 386 Ca -0.09 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.29 1nol h LEU 386 Cb 1.40 0.01 0.14 0.00 0.09 0.00 0.00 40.66 42.30 1nol h LEU 386 CO 0.04 0.30 -0.00 -3.20 0.09 0.00 0.00 178.44 175.67 1nol n ASN 387 N -3.97 0.63 -3.73 -0.43 4.05 0.30 -4.91 115.26 107.19 1nol n ASN 387 Ca -0.01 0.99 -0.30 0.00 0.45 0.00 0.00 54.58 55.72 1nol n ASN 387 Cb 0.02 -1.28 -0.15 0.00 1.23 0.00 0.00 39.78 39.60 1nol n ASN 387 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1nol s PHE 388 N -1.33 1.80 0.50 1.20 5.36 -1.26 -4.91 117.98 119.34 1nol s PHE 388 Ca 0.64 -1.89 -0.18 0.00 -0.96 0.00 0.00 56.93 54.54 1nol s PHE 388 Cb -0.57 -1.77 -0.08 0.00 -0.34 0.00 0.00 43.02 40.26 1nol s PHE 388 CO 0.57 -0.87 1.00 -2.14 -1.46 0.00 0.00 175.22 172.32 1nol s PRO 389 N 1.39 3.90 0.00 10.12 0.02 -1.26 -2.75 135.00 146.42 1nol s PRO 389 Ca 0.11 1.11 0.00 0.00 0.02 0.00 0.00 61.00 62.24 1nol s PRO 389 Cb -0.19 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.21 1nol s PRO 389 CO -0.20 -0.32 0.00 -0.25 -0.33 0.00 0.00 177.00 175.90 1nol n ASP 390 N -1.29 0.00 -4.69 2.53 8.00 -1.26 -4.92 116.55 114.93 1nol n ASP 390 Ca 0.07 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.18 1nol n ASP 390 Cb 0.54 -0.34 -0.05 0.00 -0.02 0.00 0.00 41.12 41.24 1nol n ASP 390 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1nol s ILE 391 N -1.20 5.04 -0.07 0.53 -1.09 -1.11 -0.44 121.20 122.86 1nol s ILE 391 Ca 0.00 1.28 0.03 0.00 -2.23 0.00 0.00 60.65 59.73 1nol s ILE 391 Cb 0.00 -3.98 0.01 0.00 -1.58 0.00 0.00 42.46 36.91 1nol s ILE 391 CO 0.00 0.17 -0.15 -1.58 -1.23 0.00 0.00 174.94 172.15 1nol s GLN 392 N 1.44 1.95 -0.10 2.79 0.74 -0.40 -4.22 119.66 121.86 1nol s GLN 392 Ca 0.32 -0.53 -0.18 0.00 0.05 0.00 0.00 55.36 55.01 1nol s GLN 392 Cb -0.16 -1.59 -0.04 0.00 1.10 0.00 0.00 33.01 32.32 1nol s GLN 392 CO 0.13 0.09 0.50 0.08 -0.55 0.00 0.00 175.29 175.54 1nol s VAL 393 N 0.49 5.14 -0.07 1.34 1.01 -0.27 -0.68 120.40 127.36 1nol s VAL 393 Ca -0.13 1.00 0.06 0.00 0.00 0.00 0.00 61.98 62.91 1nol s VAL 393 Cb -0.15 -3.83 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 1nol s VAL 393 CO 0.04 0.35 0.16 0.00 0.00 0.00 0.00 175.10 175.65 1nol n GLN 394 N 3.47 1.39 -3.60 2.72 6.02 -0.11 -4.91 117.38 122.35 1nol n GLN 394 Ca -0.07 -0.04 -0.08 0.00 -0.01 0.00 0.00 57.00 56.79 1nol n GLN 394 Cb 0.52 -1.05 -0.05 0.00 1.02 0.00 0.00 30.24 30.67 1nol n GLN 394 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1nol s ASP 395 N -2.42 -0.30 0.03 1.08 2.15 -1.21 -4.96 116.67 111.04 1nol s ASP 395 Ca -0.01 0.38 0.05 0.00 0.43 0.00 0.00 52.55 53.40 1nol s ASP 395 Cb 0.04 0.32 -0.02 0.00 -0.30 0.00 0.00 42.92 42.96 1nol s ASP 395 CO 0.25 -0.24 -0.14 -0.69 -0.17 0.00 0.00 175.17 174.17 1nol s VAL 396 N -0.86 1.14 0.03 1.11 1.01 -1.26 -1.11 120.40 120.46 1nol s VAL 396 Ca 0.01 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1nol s VAL 396 Cb -0.01 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1nol s VAL 396 CO -0.02 0.05 -0.08 -0.89 0.00 0.00 0.00 175.10 174.16 1nol s THR 397 N -0.79 0.60 -0.18 3.92 2.01 -0.80 -4.92 115.64 115.49 1nol s THR 397 Ca 0.02 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 1nol s THR 397 Cb -0.08 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 1nol s THR 397 CO 0.01 -0.13 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.55 1nol s LEU 398 N -0.98 3.12 -0.17 4.42 0.20 -1.26 -0.93 118.68 123.08 1nol s LEU 398 Ca -0.04 -0.23 -0.05 0.00 0.69 0.00 0.00 54.13 54.50 1nol s LEU 398 Cb -0.07 -1.77 -0.03 0.00 -0.43 0.00 0.00 46.19 43.89 1nol s LEU 398 CO 0.00 0.09 0.00 -1.00 -0.29 0.00 0.00 176.35 175.16 1nol s HIS 399 N 0.81 3.12 0.00 5.38 3.76 0.21 -0.30 115.29 128.26 1nol s HIS 399 Ca -0.01 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.76 1nol s HIS 399 Cb -0.15 -2.01 0.00 0.00 1.11 0.00 0.00 32.58 31.54 1nol s HIS 399 CO 0.02 0.05 0.00 0.00 -0.85 0.00 0.00 174.74 173.96 1nol n ALA 400 N 3.52 0.00 0.06 -1.40 0.00 -1.26 -1.30 120.51 120.13 1nol n ALA 400 Ca -0.17 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.28 1nol n ALA 400 Cb 0.52 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.33 1nol n ALA 400 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1nol h ARG 401 N 0.00 0.37 -3.99 0.00 2.43 -1.85 -3.39 114.38 107.95 1nol h ARG 401 Ca 0.00 -0.08 -0.43 0.00 -0.81 0.00 0.00 59.98 58.66 1nol h ARG 401 Cb 0.00 -0.05 -0.35 0.00 -0.42 0.00 0.00 29.97 29.14 1nol h ARG 401 CO 0.00 0.45 -0.78 0.08 -1.51 0.00 0.00 179.97 178.21 1nol s VAL 402 N -4.87 0.56 0.16 0.20 1.01 -1.26 -5.11 120.40 111.10 1nol s VAL 402 Ca -0.06 -0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.52 1nol s VAL 402 Cb 0.16 -0.61 -0.09 0.00 0.00 0.00 0.00 36.38 35.83 1nol s VAL 402 CO 0.75 0.25 1.41 -1.81 0.00 0.00 0.00 175.10 175.69 1nol s ASP 403 N 1.22 6.77 -1.77 3.32 1.11 -1.26 -1.77 116.67 124.29 1nol s ASP 403 Ca -0.06 2.45 0.00 0.00 0.18 0.00 0.00 52.55 55.12 1nol s ASP 403 Cb -0.14 -2.60 0.00 0.00 1.07 0.00 0.00 42.92 41.25 1nol s ASP 403 CO -0.02 -0.66 0.00 0.59 1.18 0.00 0.00 175.17 176.26 1nol n ASN 404 N 3.37 -5.24 -4.16 0.27 3.02 0.58 -4.95 115.26 108.14 1nol n ASN 404 Ca 0.10 0.41 -0.28 0.00 -0.03 0.00 0.00 54.58 54.78 1nol n ASN 404 Cb 0.41 -4.21 -0.16 0.00 -0.61 0.00 0.00 39.78 35.21 1nol n ASN 404 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1nol s VAL 405 N -2.54 1.59 -0.04 2.41 1.01 -0.73 -1.66 120.40 120.44 1nol s VAL 405 Ca 0.00 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 1nol s VAL 405 Cb 0.00 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1nol s VAL 405 CO 0.00 0.45 0.02 -0.69 0.00 0.00 0.00 175.10 174.88 1nol s VAL 406 N 0.08 4.34 -0.12 2.92 1.01 -0.20 -4.50 120.40 123.93 1nol s VAL 406 Ca -0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 1nol s VAL 406 Cb -0.13 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 1nol s VAL 406 CO 0.03 0.48 -0.07 -1.00 0.00 0.00 0.00 175.10 174.54 1nol s HIS 407 N -1.01 2.94 0.32 5.22 3.76 -1.26 -1.90 115.29 123.36 1nol s HIS 407 Ca 0.17 -0.25 0.09 0.00 -0.15 0.00 0.00 55.06 54.92 1nol s HIS 407 Cb -0.11 -1.84 -0.05 0.00 1.11 0.00 0.00 32.58 31.69 1nol s HIS 407 CO 0.07 0.06 0.02 0.95 -0.85 0.00 0.00 174.74 174.99 1nol s THR 408 N -0.09 2.80 0.13 1.30 -4.23 -0.97 -1.11 115.64 113.47 1nol s THR 408 Ca 0.01 -1.95 -0.26 0.00 -1.18 0.00 0.00 61.69 58.31 1nol s THR 408 Cb -0.13 -2.80 0.07 0.00 1.34 0.00 0.00 72.50 70.98 1nol s THR 408 CO 0.03 -0.24 1.00 0.72 -0.54 0.00 0.00 174.62 175.59 1nol s PHE 409 N -2.48 -0.12 0.24 3.99 -0.12 -0.16 -0.04 117.98 119.29 1nol s PHE 409 Ca 0.34 -0.16 0.05 0.00 -0.05 0.00 0.00 56.93 57.12 1nol s PHE 409 Cb -0.02 0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 42.97 1nol s PHE 409 CO 0.20 -0.76 0.31 -1.64 -0.05 0.00 0.00 175.22 173.28 1nol s MET 410 N -3.18 3.31 -0.06 1.99 -1.94 -1.26 -0.32 119.30 117.84 1nol s MET 410 Ca 0.12 -0.83 -0.15 0.00 -1.71 0.00 0.00 55.69 53.13 1nol s MET 410 Cb -0.01 -2.81 0.03 0.00 2.01 0.00 0.00 34.83 34.05 1nol s MET 410 CO 0.01 0.43 0.35 0.50 -0.01 0.00 0.00 175.02 176.30 1nol s ARG 411 N -3.89 0.61 0.19 2.03 3.52 -0.57 -4.89 118.95 115.94 1nol s ARG 411 Ca 0.34 0.06 -0.18 0.00 -0.13 0.00 0.00 55.73 55.82 1nol s ARG 411 Cb -0.09 0.28 -0.08 0.00 -1.56 0.00 0.00 34.95 33.50 1nol s ARG 411 CO 0.28 -0.15 0.66 -1.83 -0.81 0.00 0.00 175.30 173.45 1nol s GLU 412 N -0.81 4.18 0.21 5.12 4.04 -1.26 -0.58 118.70 129.60 1nol s GLU 412 Ca -0.09 0.76 -0.04 0.00 0.04 0.00 0.00 54.97 55.64 1nol s GLU 412 Cb -0.04 -2.94 -0.03 0.00 0.02 0.00 0.00 34.13 31.14 1nol s GLU 412 CO 0.03 0.45 0.23 -1.14 -1.84 0.00 0.00 175.26 172.99 1nol s GLN 413 N -1.87 1.30 0.02 -4.83 0.74 0.55 -4.96 119.66 110.62 1nol s GLN 413 Ca 0.40 -1.53 0.04 0.00 0.05 0.00 0.00 55.36 54.32 1nol s GLN 413 Cb -0.17 0.33 -0.02 0.00 1.10 0.00 0.00 33.01 34.25 1nol s GLN 413 CO 0.20 -0.46 -0.12 -1.21 -0.55 0.00 0.00 175.29 173.15 1nol s GLU 414 N -4.11 0.82 -0.08 1.67 2.02 -1.26 -0.66 118.70 117.11 1nol s GLU 414 Ca 0.34 -0.62 0.04 0.00 0.02 0.00 0.00 54.97 54.76 1nol s GLU 414 Cb 0.05 -0.79 -0.01 0.00 0.10 0.00 0.00 34.13 33.48 1nol s GLU 414 CO 0.11 0.20 -0.20 -1.17 0.02 0.00 0.00 175.26 174.22 1nol s LEU 415 N -0.89 2.36 -0.20 1.80 2.96 1.00 -4.92 118.68 120.79 1nol s LEU 415 Ca 0.01 -0.41 -0.27 0.00 -0.22 0.00 0.00 54.13 53.24 1nol s LEU 415 Cb -0.07 -1.47 -0.00 0.00 0.50 0.00 0.00 46.19 45.15 1nol s LEU 415 CO 0.01 0.24 0.91 -0.70 -1.32 0.00 0.00 176.35 175.49 1nol s GLU 416 N -0.12 4.27 0.01 1.98 2.56 -1.26 -0.62 118.70 125.52 1nol s GLU 416 Ca -0.04 1.14 0.23 0.00 0.00 0.00 0.00 54.97 56.31 1nol s GLU 416 Cb -0.14 -3.61 0.21 0.00 2.00 0.00 0.00 34.13 32.60 1nol s GLU 416 CO 0.04 -0.46 1.20 1.28 -0.56 0.00 0.00 175.26 176.76 1nol n LEU 417 N 5.71 0.67 0.14 2.70 4.77 0.15 -4.55 117.00 126.59 1nol n LEU 417 Ca 0.07 -0.14 0.12 0.00 -0.03 0.00 0.00 56.01 56.03 1nol n LEU 417 Cb 0.48 -0.15 0.51 0.00 -2.33 0.00 0.00 43.42 41.92 1nol n LEU 417 CO 0.50 0.14 0.85 2.29 -1.33 0.00 0.00 177.39 179.84 1nol n LYS 418 N -1.59 0.19 0.00 3.23 2.85 -1.26 -1.25 118.16 120.33 1nol n LYS 418 Ca 0.04 0.45 0.12 0.00 -1.05 0.00 0.00 58.31 57.88 1nol n LYS 418 Cb 0.35 -1.89 0.22 0.00 -0.65 0.00 0.00 35.03 33.06 1nol n LYS 418 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1nol n HIS 419 N -2.26 0.00 -0.04 5.58 8.25 -1.26 -4.39 115.22 121.10 1nol n HIS 419 Ca 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.43 1nol n HIS 419 Cb 0.21 -0.18 -0.04 0.00 1.12 0.00 0.00 29.99 31.10 1nol n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nol n GLY 420 N 1.46 -0.13 3.74 -1.41 0.00 -0.65 -0.17 105.19 108.03 1nol n GLY 420 Ca 0.07 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1nol n GLY 420 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nol s ILE 421 N -2.15 4.13 0.06 -0.61 -4.36 -0.38 -4.53 121.20 113.35 1nol s ILE 421 Ca -0.10 -1.32 -0.31 0.00 -0.26 0.00 0.00 60.65 58.67 1nol s ILE 421 Cb 0.03 -3.12 -0.07 0.00 1.25 0.00 0.00 42.46 40.55 1nol s ILE 421 CO 0.19 -0.17 1.36 0.21 0.24 0.00 0.00 174.94 176.77 1nol s ASN 422 N -3.21 6.88 -0.02 4.36 3.84 -1.26 -4.55 114.94 120.98 1nol s ASN 422 Ca 0.30 2.19 0.19 0.00 0.21 0.00 0.00 52.86 55.75 1nol s ASN 422 Cb -0.09 -2.57 -0.27 0.00 -0.55 0.00 0.00 41.25 37.76 1nol s ASN 422 CO 0.22 -0.65 0.54 -0.81 -2.79 0.00 0.00 177.10 173.61 1nol n PRO 423 N 4.51 0.64 0.00 0.43 -0.04 -1.26 -4.99 135.00 134.29 1nol n PRO 423 Ca 0.12 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1nol n PRO 423 Cb 0.43 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1nol n PRO 423 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nol n GLY 424 N 1.41 0.28 0.00 0.55 0.00 -1.26 -2.37 105.19 103.80 1nol n GLY 424 Ca -0.01 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1nol n GLY 424 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nol n ASN 425 N 7.44 0.23 -4.75 1.61 4.13 -1.26 -4.98 115.26 117.68 1nol n ASN 425 Ca 0.00 -0.57 -0.36 0.00 1.68 0.00 0.00 54.58 55.33 1nol n ASN 425 Cb 0.00 0.36 0.03 0.00 -1.54 0.00 0.00 39.78 38.63 1nol n ASN 425 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1nol s ALA 426 N -0.36 2.59 -1.29 5.41 0.00 -1.00 -3.21 121.76 123.90 1nol s ALA 426 Ca 0.00 1.03 0.26 0.00 0.00 0.00 0.00 51.96 53.25 1nol s ALA 426 Cb 0.00 -3.46 0.60 0.00 0.00 0.00 0.00 23.12 20.26 1nol s ALA 426 CO 0.00 -1.15 1.47 2.89 0.00 0.00 0.00 175.76 178.98 1nol n ARG 427 N -1.47 0.32 -3.53 0.00 0.00 -0.64 -4.92 116.66 106.42 1nol n ARG 427 Ca 0.13 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.85 57.79 1nol n ARG 427 Cb 0.49 -1.50 -0.05 0.00 -0.00 0.00 0.00 32.46 31.40 1nol n ARG 427 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1nol s SER 428 N -2.81 -0.51 -0.26 2.89 0.15 -1.26 -5.01 113.70 106.89 1nol s SER 428 Ca 0.16 0.76 0.02 0.00 0.70 0.00 0.00 55.95 57.59 1nol s SER 428 Cb 0.18 1.40 0.05 0.00 -1.71 0.00 0.00 66.02 65.95 1nol s SER 428 CO 0.63 -0.11 -0.10 -0.63 1.20 0.00 0.00 173.24 174.23 1nol s ILE 429 N 1.85 2.29 -0.03 6.45 1.09 -1.26 -1.71 121.20 129.87 1nol s ILE 429 Ca -0.06 -1.52 0.01 0.00 -1.10 0.00 0.00 60.65 57.98 1nol s ILE 429 Cb -0.05 -2.31 -0.03 0.00 -1.06 0.00 0.00 42.46 39.01 1nol s ILE 429 CO -0.16 0.02 -0.04 -0.54 -0.10 0.00 0.00 174.94 174.12 1nol s LYS 430 N 1.15 2.74 -0.04 2.79 -0.14 -0.97 -0.67 119.74 124.58 1nol s LYS 430 Ca -0.07 -0.59 -0.00 0.00 -1.36 0.00 0.00 55.97 53.94 1nol s LYS 430 Cb -0.19 -2.62 -0.03 0.00 -1.68 0.00 0.00 37.83 33.31 1nol s LYS 430 CO -0.05 0.64 0.01 0.00 -0.76 0.00 0.00 175.35 175.19 1nol s ALA 431 N -0.95 3.31 -0.12 5.17 0.00 0.21 -1.52 121.76 127.85 1nol s ALA 431 Ca 0.16 -0.87 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 1nol s ALA 431 Cb -0.11 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 1nol s ALA 431 CO 0.06 0.62 -0.05 0.50 0.00 0.00 0.00 175.76 176.89 1nol s ARG 432 N -1.23 3.34 0.30 0.00 3.52 -0.16 -0.00 118.95 124.73 1nol s ARG 432 Ca 0.17 -0.53 0.03 0.00 -0.13 0.00 0.00 55.73 55.26 1nol s ARG 432 Cb -0.11 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.43 1nol s ARG 432 CO 0.06 0.40 0.13 1.52 -0.81 0.00 0.00 175.30 176.60 1nol s TYR 433 N -0.07 1.62 0.11 5.12 -0.85 0.17 -0.89 117.35 122.56 1nol s TYR 433 Ca 0.01 -1.26 0.09 0.00 -0.52 0.00 0.00 57.07 55.39 1nol s TYR 433 Cb -0.13 -0.93 -0.04 0.00 0.38 0.00 0.00 41.96 41.24 1nol s TYR 433 CO 0.03 -0.39 -0.22 0.71 -1.52 0.00 0.00 175.55 174.15 1nol s TYR 434 N -3.60 1.90 0.04 -3.49 1.51 -1.26 -0.33 117.35 112.11 1nol s TYR 434 Ca 0.35 -0.41 -0.11 0.00 -1.01 0.00 0.00 57.07 55.90 1nol s TYR 434 Cb 0.06 -1.03 0.01 0.00 -0.11 0.00 0.00 41.96 40.88 1nol s TYR 434 CO 0.16 0.24 0.22 -3.38 -1.11 0.00 0.00 175.55 171.68 1nol s HIS 435 N -1.18 0.00 0.68 2.71 -3.43 0.25 -4.90 115.29 109.42 1nol s HIS 435 Ca 0.08 -0.18 -0.17 0.00 -0.80 0.00 0.00 55.06 54.00 1nol s HIS 435 Cb -0.10 0.01 0.01 0.00 -1.43 0.00 0.00 32.58 31.07 1nol s HIS 435 CO 0.05 -0.44 1.24 -1.17 -2.00 0.00 0.00 174.74 172.42 1nol s LEU 436 N -2.00 3.47 0.25 5.38 2.96 -1.26 -1.51 118.68 125.96 1nol s LEU 436 Ca -0.06 2.46 -0.19 0.00 -0.22 0.00 0.00 54.13 56.12 1nol s LEU 436 Cb -0.02 -4.60 0.02 0.00 0.50 0.00 0.00 46.19 42.09 1nol s LEU 436 CO -0.03 -2.06 0.62 -0.62 -1.32 0.00 0.00 176.35 172.94 1nol s ASP 437 N -1.73 -0.25 0.05 3.68 -1.08 0.57 -4.59 116.67 113.31 1nol s ASP 437 Ca 0.78 -0.60 0.02 0.00 -0.52 0.00 0.00 52.55 52.23 1nol s ASP 437 Cb -0.32 0.66 -0.03 0.00 -1.46 0.00 0.00 42.92 41.77 1nol s ASP 437 CO 0.41 -1.21 -0.07 -1.38 0.52 0.00 0.00 175.17 173.44 1nol s HIS 438 N -3.92 0.65 0.56 -5.34 -3.43 -1.26 -0.99 115.29 101.57 1nol s HIS 438 Ca 0.12 -0.58 -0.20 0.00 -0.80 0.00 0.00 55.06 53.60 1nol s HIS 438 Cb -0.03 -0.39 -0.04 0.00 -1.43 0.00 0.00 32.58 30.68 1nol s HIS 438 CO 0.04 -0.11 1.25 -1.83 -2.00 0.00 0.00 174.74 172.08 1nol s GLU 439 N -1.94 3.10 0.43 -0.38 -1.05 -0.27 -4.99 118.70 113.59 1nol s GLU 439 Ca -0.07 1.95 -0.24 0.00 -0.15 0.00 0.00 54.97 56.46 1nol s GLU 439 Cb -0.07 -2.08 -0.10 0.00 -0.44 0.00 0.00 34.13 31.43 1nol s GLU 439 CO -0.01 -1.14 0.97 -2.30 0.95 0.00 0.00 175.26 173.74 1nol n PRO 440 N -1.29 1.27 -4.02 -4.83 -0.02 -1.26 -4.78 135.00 120.06 1nol n PRO 440 Ca 0.12 0.46 -0.10 0.00 -2.02 0.00 0.00 63.50 61.96 1nol n PRO 440 Cb 0.48 -2.00 -0.06 0.00 -0.02 0.00 0.00 33.50 31.90 1nol n PRO 440 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1nol s PHE 441 N -1.30 0.46 0.05 6.00 -0.12 -1.26 -4.72 117.98 117.09 1nol s PHE 441 Ca 0.64 -0.81 -0.02 0.00 -0.05 0.00 0.00 56.93 56.70 1nol s PHE 441 Cb -0.56 0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 41.92 1nol s PHE 441 CO 0.56 -0.98 -0.01 -1.54 -0.05 0.00 0.00 175.22 173.20 1nol s SER 442 N -3.04 0.44 0.17 1.98 1.04 -0.42 -0.84 113.70 113.03 1nol s SER 442 Ca 0.24 -0.92 0.06 0.00 0.48 0.00 0.00 55.95 55.81 1nol s SER 442 Cb -0.00 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 1nol s SER 442 CO 0.10 -0.58 0.07 -0.31 0.98 0.00 0.00 173.24 173.49 1nol s TYR 443 N -3.68 3.00 -0.18 5.02 2.02 -0.46 -0.62 117.35 122.45 1nol s TYR 443 Ca 0.05 -0.07 -0.02 0.00 -0.37 0.00 0.00 57.07 56.65 1nol s TYR 443 Cb 0.06 -1.45 0.05 0.00 -0.40 0.00 0.00 41.96 40.23 1nol s TYR 443 CO -0.09 0.52 0.01 0.00 -1.57 0.00 0.00 175.55 174.41 1nol s ALA 444 N -1.73 1.15 -0.26 3.71 0.00 -0.11 -2.60 121.76 121.92 1nol s ALA 444 Ca 0.29 -0.72 -0.10 0.00 0.00 0.00 0.00 51.96 51.43 1nol s ALA 444 Cb -0.10 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1nol s ALA 444 CO 0.21 -1.02 0.15 0.08 0.00 0.00 0.00 175.76 175.18 1nol s VAL 445 N 1.78 4.99 -0.33 0.00 1.01 0.12 -1.90 120.40 126.06 1nol s VAL 445 Ca -0.00 0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 1nol s VAL 445 Cb -0.16 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1nol s VAL 445 CO -0.07 0.29 0.85 0.20 0.00 0.00 0.00 175.10 176.37 1nol s ASN 446 N 1.60 6.67 -0.03 3.32 -0.87 -0.26 -0.45 114.94 124.91 1nol s ASN 446 Ca 0.07 0.61 0.04 0.00 -1.57 0.00 0.00 52.86 52.01 1nol s ASN 446 Cb -0.15 -2.43 -0.01 0.00 -0.02 0.00 0.00 41.25 38.64 1nol s ASN 446 CO 0.08 -0.72 -0.16 -0.69 -2.57 0.00 0.00 177.10 173.03 1nol s VAL 447 N 3.18 1.32 -0.25 1.60 1.01 -0.62 -0.94 120.40 125.70 1nol s VAL 447 Ca 0.35 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.57 1nol s VAL 447 Cb -0.13 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1nol s VAL 447 CO 0.15 0.38 0.10 -1.58 0.00 0.00 0.00 175.10 174.15 1nol s GLN 448 N -0.06 3.77 -0.50 2.72 2.00 0.14 -0.55 119.66 127.17 1nol s GLN 448 Ca -0.01 -0.42 -0.12 0.00 -2.00 0.00 0.00 55.36 52.80 1nol s GLN 448 Cb -0.10 -3.39 0.12 0.00 0.80 0.00 0.00 33.01 30.44 1nol s GLN 448 CO 0.01 -0.13 0.41 1.21 -0.50 0.00 0.00 175.29 176.30 1nol s ASN 449 N 1.49 5.94 -0.04 6.67 2.47 -0.37 -1.28 114.94 129.82 1nol s ASN 449 Ca 0.06 -1.83 0.12 0.00 0.42 0.00 0.00 52.86 51.63 1nol s ASN 449 Cb -0.15 -2.11 0.40 0.00 -1.45 0.00 0.00 41.25 37.94 1nol s ASN 449 CO 0.05 -0.76 1.28 0.59 -3.72 0.00 0.00 177.10 174.54 1nol n ASN 450 N 5.07 2.67 -2.12 -4.21 3.02 0.42 -1.02 115.26 119.08 1nol n ASN 450 Ca -0.11 -2.15 0.00 0.00 -0.03 0.00 0.00 54.58 52.29 1nol n ASN 450 Cb 0.41 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1nol n ASN 450 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1nol n SER 451 N 0.63 -0.16 -0.36 6.41 3.41 -1.26 -4.97 113.62 117.31 1nol n SER 451 Ca 0.15 -0.88 0.08 0.00 -0.26 0.00 0.00 58.87 57.95 1nol n SER 451 Cb 0.48 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.60 1nol n SER 451 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nol n ALA 452 N -3.00 2.97 -2.39 7.33 0.00 -1.26 -4.62 120.51 119.53 1nol n ALA 452 Ca 0.00 -2.94 -0.20 0.00 0.00 0.00 0.00 53.44 50.29 1nol n ALA 452 Cb 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.98 1nol n ALA 452 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1nol s SER 453 N -3.02 2.86 0.13 0.00 0.01 -1.26 -4.92 113.70 107.51 1nol s SER 453 Ca 0.35 -1.00 -0.31 0.00 1.31 0.00 0.00 55.95 56.29 1nol s SER 453 Cb 0.32 -0.18 -0.09 0.00 0.21 0.00 0.00 66.02 66.28 1nol s SER 453 CO -0.02 -0.10 1.45 -1.81 0.41 0.00 0.00 173.24 173.17 1nol s ASP 454 N -3.29 6.74 0.38 2.44 1.11 -1.26 -4.10 116.67 118.70 1nol s ASP 454 Ca 0.24 2.43 0.08 0.00 0.18 0.00 0.00 52.55 55.47 1nol s ASP 454 Cb -0.03 -2.59 -0.03 0.00 1.07 0.00 0.00 42.92 41.34 1nol s ASP 454 CO 0.09 -0.71 0.26 -0.54 1.18 0.00 0.00 175.17 175.45 1nol s LYS 455 N 1.10 2.46 -0.07 8.23 -0.14 0.23 -4.91 119.74 126.64 1nol s LYS 455 Ca 0.66 -1.56 0.02 0.00 -1.36 0.00 0.00 55.97 53.73 1nol s LYS 455 Cb -0.39 -2.26 0.01 0.00 -1.68 0.00 0.00 37.83 33.52 1nol s LYS 455 CO 0.31 -0.04 -0.12 -1.01 -0.76 0.00 0.00 175.35 173.73 1nol s HIS 456 N -2.45 1.48 -0.03 3.18 3.76 -1.26 -0.55 115.29 119.41 1nol s HIS 456 Ca 0.42 -0.57 0.06 0.00 -0.15 0.00 0.00 55.06 54.82 1nol s HIS 456 Cb -0.02 -1.10 -0.02 0.00 1.11 0.00 0.00 32.58 32.55 1nol s HIS 456 CO 0.25 -0.31 -0.22 0.00 -0.85 0.00 0.00 174.74 173.61 1nol s ALA 457 N 0.80 2.33 -0.11 -1.40 0.00 0.13 -1.18 121.76 122.33 1nol s ALA 457 Ca -0.12 -1.07 -0.22 0.00 0.00 0.00 0.00 51.96 50.55 1nol s ALA 457 Cb -0.15 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1nol s ALA 457 CO 0.02 0.53 0.66 0.99 0.00 0.00 0.00 175.76 177.97 1nol s THR 458 N -0.64 5.05 -0.25 0.00 2.01 -0.82 -0.58 115.64 120.41 1nol s THR 458 Ca 0.10 1.33 -0.10 0.00 0.31 0.00 0.00 61.69 63.33 1nol s THR 458 Cb -0.10 -4.00 -0.05 0.00 0.01 0.00 0.00 72.50 68.36 1nol s THR 458 CO -0.00 0.21 0.15 -0.69 -0.69 0.00 0.00 174.62 173.60 1nol s VAL 459 N 1.14 5.23 -0.18 3.82 1.01 0.05 -1.41 120.40 130.06 1nol s VAL 459 Ca 0.34 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.45 1nol s VAL 459 Cb -0.17 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1nol s VAL 459 CO 0.15 0.33 -0.12 -0.13 0.00 0.00 0.00 175.10 175.33 1nol s ARG 460 N 1.20 3.22 -0.09 2.72 0.52 -0.14 -1.51 118.95 124.87 1nol s ARG 460 Ca 0.07 -0.72 0.03 0.00 -0.52 0.00 0.00 55.73 54.58 1nol s ARG 460 Cb -0.14 -2.75 0.01 0.00 0.52 0.00 0.00 34.95 32.59 1nol s ARG 460 CO 0.06 -0.11 -0.16 0.42 0.02 0.00 0.00 175.30 175.52 1nol s ILE 461 N 1.16 1.51 0.09 1.52 1.01 0.29 -0.78 121.20 125.99 1nol s ILE 461 Ca 0.01 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 60.02 1nol s ILE 461 Cb -0.14 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 1nol s ILE 461 CO -0.05 0.44 -0.10 -0.36 0.00 0.00 0.00 174.94 174.87 1nol s PHE 462 N 0.69 1.03 -0.02 3.97 0.40 -0.48 -0.61 117.98 122.95 1nol s PHE 462 Ca -0.13 -0.64 0.07 0.00 -0.60 0.00 0.00 56.93 55.63 1nol s PHE 462 Cb -0.16 -0.57 -0.02 0.00 0.51 0.00 0.00 43.02 42.79 1nol s PHE 462 CO 0.03 -0.01 -0.24 -1.17 0.70 0.00 0.00 175.22 174.54 1nol s LEU 463 N -2.33 2.04 -0.06 -0.37 2.96 -0.17 -1.18 118.68 119.58 1nol s LEU 463 Ca 0.04 -0.43 -0.03 0.00 -0.22 0.00 0.00 54.13 53.48 1nol s LEU 463 Cb -0.04 -1.23 0.03 0.00 0.50 0.00 0.00 46.19 45.46 1nol s LEU 463 CO 0.00 0.28 0.14 0.00 -1.32 0.00 0.00 176.35 175.45 1nol s ALA 464 N -0.48 -0.29 0.62 5.97 0.00 -0.20 -1.24 121.76 126.15 1nol s ALA 464 Ca 0.07 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.41 1nol s ALA 464 Cb -0.10 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1nol s ALA 464 CO -0.00 -0.12 1.29 -0.35 0.00 0.00 0.00 175.76 176.58 1nol n PRO 465 N 3.79 1.24 -0.04 0.00 -0.04 -1.26 -0.08 135.00 138.60 1nol n PRO 465 Ca -0.22 0.48 -0.13 0.00 -0.04 0.00 0.00 63.50 63.59 1nol n PRO 465 Cb 0.54 -2.52 -0.14 0.00 -0.04 0.00 0.00 33.50 31.34 1nol n PRO 465 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1nol n LYS 466 N -1.65 0.68 -4.30 0.54 4.81 -0.89 -4.57 118.16 112.78 1nol n LYS 466 Ca 0.15 0.21 -0.19 0.00 -0.87 0.00 0.00 58.31 57.60 1nol n LYS 466 Cb 0.47 -1.68 -0.11 0.00 0.02 0.00 0.00 35.03 33.73 1nol n LYS 466 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1nol s TYR 467 N -2.56 1.61 0.87 5.64 2.02 -1.26 -1.93 117.35 121.74 1nol s TYR 467 Ca -0.14 -0.56 -0.10 0.00 -0.37 0.00 0.00 57.07 55.90 1nol s TYR 467 Cb 0.07 -0.79 0.17 0.00 -0.40 0.00 0.00 41.96 41.01 1nol s TYR 467 CO 0.78 0.26 1.19 0.16 -1.57 0.00 0.00 175.55 176.38 1nol s ASP 468 N -2.88 3.62 0.34 2.29 1.47 0.26 -4.82 116.67 116.94 1nol s ASP 468 Ca 0.16 0.02 0.18 0.00 1.18 0.00 0.00 52.55 54.10 1nol s ASP 468 Cb -0.03 -0.20 1.01 0.00 -0.34 0.00 0.00 42.92 43.35 1nol s ASP 468 CO 0.05 -2.38 1.52 1.05 0.68 0.00 0.00 175.17 176.09 1nol h GLU 469 N -1.20 0.00 -0.35 2.11 9.09 -1.87 0.51 114.58 122.88 1nol h GLU 469 Ca -0.41 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.00 1nol h GLU 469 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1nol h GLU 469 CO 0.39 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.73 1nol n LEU 470 N -2.20 3.77 0.00 3.06 4.77 -1.26 -4.95 117.00 120.19 1nol n LEU 470 Ca -0.01 -2.61 0.00 0.00 -0.03 0.00 0.00 56.01 53.36 1nol n LEU 470 Cb 0.17 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1nol n LEU 470 CO 0.08 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 1nol n GLY 471 N 0.08 0.81 3.80 -0.72 0.00 0.17 -5.02 105.19 104.31 1nol n GLY 471 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1nol n GLY 471 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nol s ASN 472 N -2.65 6.97 0.10 1.61 0.01 -1.26 -4.77 114.94 114.95 1nol s ASN 472 Ca 0.00 1.79 -0.31 0.00 -0.71 0.00 0.00 52.86 53.63 1nol s ASN 472 Cb 0.00 -2.56 -0.07 0.00 0.41 0.00 0.00 41.25 39.03 1nol s ASN 472 CO 0.00 -0.34 1.28 -0.70 -1.51 0.00 0.00 177.10 175.83 1nol s GLU 473 N -2.81 4.39 -0.24 -0.60 2.12 -1.26 -0.57 118.70 119.72 1nol s GLU 473 Ca 0.59 1.91 -0.28 0.00 0.36 0.00 0.00 54.97 57.55 1nol s GLU 473 Cb -0.14 -3.29 0.01 0.00 0.26 0.00 0.00 34.13 30.97 1nol s GLU 473 CO 0.18 -0.31 1.02 0.42 -0.54 0.00 0.00 175.26 176.02 1nol s ILE 474 N 0.94 4.68 0.86 -3.70 1.01 -0.81 -4.87 121.20 119.30 1nol s ILE 474 Ca 0.60 1.92 -0.11 0.00 0.00 0.00 0.00 60.65 63.07 1nol s ILE 474 Cb -0.33 -4.30 0.11 0.00 0.01 0.00 0.00 42.46 37.95 1nol s ILE 474 CO 0.31 -0.21 1.09 -0.54 0.00 0.00 0.00 174.94 175.59 1nol s LYS 475 N 3.21 1.57 0.20 2.79 -0.14 -1.26 -4.76 119.74 121.35 1nol s LYS 475 Ca 0.43 0.98 -0.17 0.00 -1.36 0.00 0.00 55.97 55.85 1nol s LYS 475 Cb -0.15 -1.83 0.18 0.00 -1.68 0.00 0.00 37.83 34.35 1nol s LYS 475 CO 0.07 -2.07 1.60 0.00 -0.76 0.00 0.00 175.35 174.20 1nol h ALA 476 N -1.43 0.16 -0.63 5.17 0.00 -1.49 -0.32 119.26 120.71 1nol h ALA 476 Ca -0.47 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1nol h ALA 476 Cb 1.26 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.66 1nol h ALA 476 CO 0.53 -0.56 0.32 0.22 0.00 0.00 0.00 179.25 179.75 1nol h ASP 477 N -0.10 0.82 0.29 0.00 3.58 -1.77 -2.74 116.42 116.50 1nol h ASP 477 Ca 0.26 -0.12 -0.08 0.00 0.42 0.00 0.00 57.03 57.51 1nol h ASP 477 Cb 0.52 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 1nol h ASP 477 CO -0.66 0.70 -0.35 -0.33 -2.88 0.00 0.00 179.24 175.72 1nol h GLU 478 N 0.87 0.09 -0.10 0.28 5.08 -1.48 -2.44 114.58 116.87 1nol h GLU 478 Ca 0.22 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1nol h GLU 478 Cb 0.09 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1nol h GLU 478 CO -0.03 0.43 0.15 -0.07 -1.00 0.00 0.00 179.01 178.49 1nol h LEU 479 N 0.08 0.00 -1.57 1.33 3.38 -0.87 -2.59 115.31 115.07 1nol h LEU 479 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1nol h LEU 479 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1nol h LEU 479 CO 0.05 0.00 -0.22 0.03 0.09 0.00 0.00 178.44 178.39 1nol h ARG 480 N 0.00 0.00 0.00 1.13 3.08 -1.46 -1.31 114.38 115.82 1nol h ARG 480 Ca 0.05 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1nol h ARG 480 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 1nol h ARG 480 CO -0.00 0.22 -0.69 0.00 -1.07 0.00 0.00 179.97 178.43 1nol h ARG 481 N 0.00 0.00 -0.15 0.04 2.47 -1.65 -3.35 114.38 111.74 1nol h ARG 481 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1nol h ARG 481 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1nol h ARG 481 CO 0.03 0.07 0.00 0.25 0.56 0.00 0.00 179.97 180.88 1nol n THR 482 N -2.87 0.85 -2.71 2.04 -2.24 -0.97 -4.32 114.28 104.06 1nol n THR 482 Ca 0.00 -0.93 -0.42 0.00 -2.27 0.00 0.00 64.05 60.43 1nol n THR 482 Cb 0.59 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.38 1nol n THR 482 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nol s ALA 483 N -0.92 3.53 -0.04 6.98 0.00 -0.53 -4.60 121.76 126.17 1nol s ALA 483 Ca 0.11 0.24 -0.01 0.00 0.00 0.00 0.00 51.96 52.30 1nol s ALA 483 Cb 0.06 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1nol s ALA 483 CO 0.08 -0.78 0.05 0.96 0.00 0.00 0.00 175.76 176.07 1nol s ILE 484 N 2.49 4.60 -0.01 0.00 -4.36 -0.37 -4.89 121.20 118.66 1nol s ILE 484 Ca 0.45 -0.31 -0.29 0.00 -0.26 0.00 0.00 60.65 60.24 1nol s ILE 484 Cb -0.17 -3.03 -0.03 0.00 1.25 0.00 0.00 42.46 40.48 1nol s ILE 484 CO 0.12 0.47 0.94 -0.70 0.24 0.00 0.00 174.94 176.02 1nol s GLU 485 N -1.34 4.54 -0.14 0.37 2.12 -1.26 -1.00 118.70 121.99 1nol s GLU 485 Ca 0.18 1.35 0.16 0.00 0.36 0.00 0.00 54.97 57.02 1nol s GLU 485 Cb -0.12 -3.46 -0.23 0.00 0.26 0.00 0.00 34.13 30.58 1nol s GLU 485 CO 0.08 -0.04 0.14 1.28 -0.54 0.00 0.00 175.26 176.18 1nol n LEU 486 N 3.90 0.00 -3.62 2.70 4.77 0.23 -4.91 117.00 120.06 1nol n LEU 486 Ca 0.05 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.99 1nol n LEU 486 Cb 0.51 0.33 -0.04 0.00 -2.33 0.00 0.00 43.42 41.89 1nol n LEU 486 CO 0.51 0.33 1.06 -0.62 -1.33 0.00 0.00 177.39 177.34 1nol s ASP 487 N -4.88 -0.11 -0.18 -1.43 -1.08 -1.08 -4.41 116.67 103.50 1nol s ASP 487 Ca -0.08 0.09 -0.06 0.00 -0.52 0.00 0.00 52.55 51.98 1nol s ASP 487 Cb 0.07 0.10 0.08 0.00 -1.46 0.00 0.00 42.92 41.71 1nol s ASP 487 CO 0.72 -0.13 0.37 -0.75 0.52 0.00 0.00 175.17 175.90 1nol s LYS 488 N -1.44 0.27 0.03 4.34 2.20 -1.25 -0.55 119.74 123.34 1nol s LYS 488 Ca 0.07 0.94 -0.20 0.00 -0.36 0.00 0.00 55.97 56.43 1nol s LYS 488 Cb -0.01 0.22 0.04 0.00 -1.51 0.00 0.00 37.83 36.57 1nol s LYS 488 CO -0.05 -0.26 0.44 -0.59 -0.36 0.00 0.00 175.35 174.53 1nol s PHE 489 N 2.52 -0.32 0.15 4.03 -0.71 -0.57 -4.67 117.98 118.42 1nol s PHE 489 Ca -0.01 0.35 -0.25 0.00 -1.04 0.00 0.00 56.93 55.98 1nol s PHE 489 Cb -0.12 0.24 -0.08 0.00 -1.21 0.00 0.00 43.02 41.86 1nol s PHE 489 CO -0.11 -0.57 0.76 0.21 -1.34 0.00 0.00 175.22 174.17 1nol s LYS 490 N -2.24 4.54 -0.02 1.99 2.20 -1.26 -0.77 119.74 124.18 1nol s LYS 490 Ca -0.07 1.13 -0.02 0.00 -0.36 0.00 0.00 55.97 56.66 1nol s LYS 490 Cb -0.01 -3.27 0.01 0.00 -1.51 0.00 0.00 37.83 33.05 1nol s LYS 490 CO -0.01 0.56 0.06 -0.08 -0.36 0.00 0.00 175.35 175.52 1nol s THR 491 N -1.08 -0.01 0.03 3.43 -1.32 0.25 -4.96 115.64 111.98 1nol s THR 491 Ca 0.36 0.02 -0.16 0.00 -1.21 0.00 0.00 61.69 60.70 1nol s THR 491 Cb -0.23 -0.09 -0.06 0.00 -1.51 0.00 0.00 72.50 70.61 1nol s THR 491 CO 0.26 0.01 0.45 -1.81 -2.21 0.00 0.00 174.62 171.32 1nol s ASP 492 N 0.14 6.87 -0.09 8.08 1.01 -1.26 -0.69 116.67 130.73 1nol s ASP 492 Ca -0.01 1.04 0.03 0.00 0.71 0.00 0.00 52.55 54.32 1nol s ASP 492 Cb -0.02 -2.28 -0.01 0.00 1.01 0.00 0.00 42.92 41.62 1nol s ASP 492 CO -0.00 0.30 -0.18 -0.76 0.21 0.00 0.00 175.17 174.73 1nol s LEU 493 N -1.15 2.46 0.41 1.23 1.43 0.29 -4.95 118.68 118.40 1nol s LEU 493 Ca 0.26 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1nol s LEU 493 Cb -0.17 -1.51 -0.00 0.00 0.03 0.00 0.00 46.19 44.54 1nol s LEU 493 CO 0.15 0.23 0.60 -1.00 0.23 0.00 0.00 176.35 176.55 1nol s HIS 494 N -0.03 3.13 0.65 0.29 3.76 -1.26 -0.61 115.29 121.22 1nol s HIS 494 Ca -0.05 0.01 -0.17 0.00 -0.15 0.00 0.00 55.06 54.69 1nol s HIS 494 Cb -0.14 -2.23 -0.01 0.00 1.11 0.00 0.00 32.58 31.31 1nol s HIS 494 CO 0.04 -0.27 1.20 -2.14 -0.85 0.00 0.00 174.74 172.73 1nol s PRO 495 N -4.41 2.65 1.56 8.40 0.02 -1.26 -4.52 135.00 137.44 1nol s PRO 495 Ca 0.48 1.78 0.00 0.00 0.02 0.00 0.00 61.00 63.28 1nol s PRO 495 Cb -0.10 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.53 1nol s PRO 495 CO 0.35 -1.44 0.00 0.41 -0.33 0.00 0.00 177.00 175.99 1nol n GLY 496 N 0.40 -1.51 3.75 0.52 0.00 -0.19 -4.87 105.19 103.29 1nol n GLY 496 Ca 0.13 -1.47 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 1nol n GLY 496 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nol s LYS 497 N 0.00 4.56 0.12 1.61 1.02 -1.26 -1.23 119.74 124.55 1nol s LYS 497 Ca 0.00 1.89 0.05 0.00 0.02 0.00 0.00 55.97 57.92 1nol s LYS 497 Cb 0.00 -3.18 -0.04 0.00 -0.52 0.00 0.00 37.83 34.09 1nol s LYS 497 CO 0.00 0.07 -0.12 -0.80 -0.92 0.00 0.00 175.35 173.59 1nol s ASN 498 N -0.55 1.73 -0.13 2.83 0.01 0.28 -4.93 114.94 114.18 1nol s ASN 498 Ca 0.47 -0.84 -0.01 0.00 -0.71 0.00 0.00 52.86 51.77 1nol s ASN 498 Cb -0.33 -0.03 0.04 0.00 0.41 0.00 0.00 41.25 41.34 1nol s ASN 498 CO 0.42 -0.22 -0.01 -0.89 -1.51 0.00 0.00 177.10 174.88 1nol s THR 499 N -2.45 0.65 -0.04 1.60 2.01 -1.26 -1.60 115.64 114.56 1nol s THR 499 Ca 0.09 -0.28 -0.19 0.00 0.31 0.00 0.00 61.69 61.61 1nol s THR 499 Cb -0.03 -0.90 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 1nol s THR 499 CO 0.01 0.11 0.53 -0.69 -0.69 0.00 0.00 174.62 173.89 1nol s VAL 500 N 1.84 5.01 -0.01 3.82 1.01 0.40 -4.89 120.40 127.57 1nol s VAL 500 Ca 0.02 1.09 0.07 0.00 0.00 0.00 0.00 61.98 63.17 1nol s VAL 500 Cb -0.14 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 1nol s VAL 500 CO -0.07 0.42 -0.23 -0.69 0.00 0.00 0.00 175.10 174.53 1nol s VAL 501 N -0.10 1.79 -0.07 2.92 1.01 -1.26 -0.70 120.40 123.99 1nol s VAL 501 Ca 0.28 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 1nol s VAL 501 Cb -0.17 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.73 1nol s VAL 501 CO 0.15 0.48 0.19 -0.60 0.00 0.00 0.00 175.10 175.32 1nol s ARG 502 N -0.60 0.23 -0.10 2.72 6.06 -1.07 -4.97 118.95 121.21 1nol s ARG 502 Ca 0.09 0.26 -0.04 0.00 -2.50 0.00 0.00 55.73 53.54 1nol s ARG 502 Cb -0.09 0.11 -0.04 0.00 0.06 0.00 0.00 34.95 35.00 1nol s ARG 502 CO -0.01 -0.03 0.05 -1.01 -2.50 0.00 0.00 175.30 171.80 1nol s HIS 503 N 0.09 3.30 0.45 5.12 3.76 -1.26 -1.35 115.29 125.39 1nol s HIS 503 Ca -0.00 0.28 0.31 0.00 -0.15 0.00 0.00 55.06 55.49 1nol s HIS 503 Cb -0.01 -1.86 1.42 0.00 1.11 0.00 0.00 32.58 33.24 1nol s HIS 503 CO 0.00 0.52 1.64 0.66 -0.85 0.00 0.00 174.74 176.71 1nol h SER 504 N 5.23 0.23 0.67 1.40 4.64 -1.36 0.67 113.55 125.03 1nol h SER 504 Ca -0.51 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1nol h SER 504 Cb 1.20 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1nol h SER 504 CO 0.57 -0.14 0.00 -0.07 -0.87 0.00 0.00 176.83 176.32 1nol h LEU 505 N 0.10 0.00 -0.41 5.97 4.07 -1.94 -2.07 115.31 121.03 1nol h LEU 505 Ca 0.80 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.76 1nol h LEU 505 Cb 2.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 44.29 1nol h LEU 505 CO -0.36 0.00 -0.19 0.47 -1.08 0.00 0.00 178.44 177.28 1nol n ASP 506 N -3.06 0.83 -2.68 -0.43 8.00 0.23 -4.89 116.55 114.55 1nol n ASP 506 Ca -0.01 -0.79 -0.36 0.00 0.71 0.00 0.00 54.79 54.34 1nol n ASP 506 Cb 0.22 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.32 1nol n ASP 506 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1nol n SER 507 N -0.73 0.27 -0.26 -2.24 2.88 -0.78 -4.87 113.62 107.89 1nol n SER 507 Ca 0.13 0.68 0.13 0.00 -1.33 0.00 0.00 58.87 58.49 1nol n SER 507 Cb 0.32 -0.53 0.64 0.00 -0.75 0.00 0.00 64.21 63.89 1nol n SER 507 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1nol n SER 508 N 1.45 0.81 -0.10 -3.46 3.41 -1.26 -2.90 113.62 111.57 1nol n SER 508 Ca 0.14 -1.37 0.11 0.00 -0.26 0.00 0.00 58.87 57.50 1nol n SER 508 Cb 0.01 -0.02 0.13 0.00 -0.26 0.00 0.00 64.21 64.08 1nol n SER 508 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1nol n VAL 509 N -0.33 0.00 -4.44 -3.33 0.24 -1.26 -2.14 118.33 107.08 1nol n VAL 509 Ca 0.19 -0.05 -0.32 0.00 -2.04 0.00 0.00 64.34 62.12 1nol n VAL 509 Cb 0.23 0.62 -0.10 0.00 -1.47 0.00 0.00 33.84 33.11 1nol n VAL 509 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1nol s THR 510 N -2.86 3.58 -0.08 3.34 -4.23 -1.14 -1.37 115.64 112.88 1nol s THR 510 Ca 0.13 -0.86 -0.30 0.00 -1.18 0.00 0.00 61.69 59.48 1nol s THR 510 Cb 0.17 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 71.41 1nol s THR 510 CO 0.71 0.35 1.42 -0.22 -0.54 0.00 0.00 174.62 176.34 1nol s LEU 511 N -1.54 4.27 0.43 4.79 2.96 0.51 -4.05 118.68 126.05 1nol s LEU 511 Ca 0.18 1.99 0.30 0.00 -0.22 0.00 0.00 54.13 56.37 1nol s LEU 511 Cb -0.11 -3.54 1.26 0.00 0.50 0.00 0.00 46.19 44.29 1nol s LEU 511 CO 0.08 -0.79 1.88 0.28 -1.32 0.00 0.00 176.35 176.48 1nol h SER 512 N 8.50 0.00 -1.04 3.68 0.02 -1.89 -3.37 113.55 119.45 1nol h SER 512 Ca -0.34 0.00 0.20 0.00 -0.84 0.00 0.00 61.79 60.81 1nol h SER 512 Cb 1.15 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.42 1nol h SER 512 CO 0.94 0.00 0.41 -2.28 -1.14 0.00 0.00 176.83 174.76 1nol s HIS 513 N -3.54 -0.40 -0.33 3.45 5.65 -1.26 -5.08 115.29 113.78 1nol s HIS 513 Ca 0.02 0.72 -0.12 0.00 0.25 0.00 0.00 55.06 55.93 1nol s HIS 513 Cb 0.09 0.24 -0.02 0.00 -1.18 0.00 0.00 32.58 31.71 1nol s HIS 513 CO 0.46 -0.20 0.22 -1.14 -0.65 0.00 0.00 174.74 173.43 1nol s GLN 514 N 2.02 3.55 0.29 2.88 0.74 -1.26 -5.07 119.66 122.82 1nol s GLN 514 Ca -0.03 -0.60 -0.29 0.00 0.05 0.00 0.00 55.36 54.49 1nol s GLN 514 Cb -0.04 -3.75 -0.10 0.00 1.10 0.00 0.00 33.01 30.23 1nol s GLN 514 CO -0.16 -0.39 1.43 -1.25 -0.55 0.00 0.00 175.29 174.37 1nol s PRO 515 N 1.71 4.25 0.91 1.67 0.04 -1.26 -5.06 135.00 137.26 1nol s PRO 515 Ca 0.06 2.35 -0.12 0.00 0.04 0.00 0.00 61.00 63.33 1nol s PRO 515 Cb -0.17 -3.07 0.13 0.00 0.04 0.00 0.00 34.50 31.44 1nol s PRO 515 CO 0.10 -0.40 1.12 0.95 0.04 0.00 0.00 177.00 178.81 1nol s THR 516 N -0.48 2.20 0.23 1.26 -4.23 -1.26 -4.44 115.64 108.92 1nol s THR 516 Ca 0.56 0.06 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 1nol s THR 516 Cb -0.43 -2.77 0.22 0.00 1.34 0.00 0.00 72.50 70.87 1nol s THR 516 CO 0.49 -0.08 1.68 -0.26 -0.54 0.00 0.00 174.62 175.91 1nol h PHE 517 N -1.49 0.19 -0.36 3.99 0.04 -1.96 -2.00 116.94 115.34 1nol h PHE 517 Ca -0.51 0.04 -0.13 0.00 2.80 0.00 0.00 57.97 60.18 1nol h PHE 517 Cb 1.32 0.03 -0.01 0.00 2.20 0.00 0.00 35.95 39.49 1nol h PHE 517 CO 0.32 -0.11 -0.31 1.49 -0.60 0.00 0.00 178.31 179.11 1nol h GLU 518 N 0.23 0.78 -0.84 1.51 4.57 -1.99 -1.00 114.58 117.83 1nol h GLU 518 Ca 0.39 -0.36 0.14 0.00 -1.18 0.00 0.00 59.36 58.35 1nol h GLU 518 Cb 0.65 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 29.13 1nol h GLU 518 CO -0.51 0.98 0.43 -0.44 -1.18 0.00 0.00 179.01 178.28 1nol h ASP 519 N 0.66 0.51 0.48 1.04 3.32 -1.87 -2.66 116.42 117.90 1nol h ASP 519 Ca 0.07 0.09 -0.30 0.00 0.02 0.00 0.00 57.03 56.91 1nol h ASP 519 Cb 0.84 0.01 0.02 0.00 0.22 0.00 0.00 39.33 40.42 1nol h ASP 519 CO 0.07 0.22 -1.35 -0.07 -1.72 0.00 0.00 179.24 176.39 1nol h LEU 520 N 0.61 0.60 -0.53 1.55 3.38 -0.89 0.29 115.31 120.32 1nol h LEU 520 Ca 0.45 -0.64 -0.16 0.00 0.09 0.00 0.00 57.88 57.62 1nol h LEU 520 Cb 0.64 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1nol h LEU 520 CO -0.36 1.50 -0.53 -0.07 0.09 0.00 0.00 178.44 179.07 1nol h LEU 521 N 0.10 0.62 0.00 1.67 3.38 -1.23 -3.42 115.31 116.45 1nol h LEU 521 Ca -0.19 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1nol h LEU 521 Cb 2.06 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.63 1nol h LEU 521 CO 0.23 1.04 0.00 1.41 0.09 0.00 0.00 178.44 181.21 1nol n HIS 522 N -3.97 -2.89 -3.29 1.13 8.25 -1.00 -4.92 115.22 108.53 1nol n HIS 522 Ca -0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.12 1nol n HIS 522 Cb 0.60 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.65 1nol n HIS 522 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nol n GLY 523 N 3.69 4.97 0.00 -1.41 0.00 -1.24 -4.63 105.19 106.56 1nol n GLY 523 Ca 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 46.02 43.27 1nol n GLY 523 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nol n VAL 524 N 0.87 0.00 -2.74 1.61 0.31 0.77 -4.28 118.33 114.87 1nol n VAL 524 Ca 0.29 -0.21 -0.42 0.00 -0.01 0.00 0.00 64.34 63.99 1nol n VAL 524 Cb 0.39 0.76 0.01 0.00 -0.91 0.00 0.00 33.84 34.09 1nol n VAL 524 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nol n GLY 525 N 1.01 5.34 2.80 2.92 0.00 0.14 -4.86 105.19 112.53 1nol n GLY 525 Ca 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 46.02 43.50 1nol n GLY 525 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nol n LEU 526 N 1.43 0.00 0.00 0.99 4.77 -1.26 -4.75 117.00 118.18 1nol n LEU 526 Ca 0.35 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1nol n LEU 526 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1nol n LEU 526 CO 0.69 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.55 1nol n SER 531 N -1.60 0.00 -3.42 -1.43 7.64 -1.26 -5.08 113.62 108.47 1nol n SER 531 Ca 0.00 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.62 1nol n SER 531 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.11 1nol n SER 531 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1nol n GLU 532 N -1.88 1.19 -0.41 1.43 -0.58 -1.26 -0.96 120.64 118.17 1nol n GLU 532 Ca 0.00 -3.77 0.07 0.00 -0.42 0.00 0.00 57.16 53.04 1nol n GLU 532 Cb 0.00 -1.76 0.22 0.00 -0.57 0.00 0.00 31.44 29.32 1nol n GLU 532 CO 0.00 0.00 0.00 2.48 -0.48 0.00 0.00 177.13 179.13 1nol n TYR 533 N 1.75 0.70 -4.12 -0.32 0.18 -1.26 -4.97 117.16 109.11 1nol n TYR 533 Ca 0.25 -1.03 -0.23 0.00 1.88 0.00 0.00 57.90 58.77 1nol n TYR 533 Cb 0.46 -0.30 -0.05 0.00 -0.38 0.00 0.00 39.34 39.07 1nol n TYR 533 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1nol n SER 535 N -0.96 1.55 -4.76 0.00 7.64 -1.26 -4.94 113.62 110.90 1nol n SER 535 Ca -0.08 -1.28 -0.41 0.00 1.01 0.00 0.00 58.87 58.11 1nol n SER 535 Cb 0.57 0.70 -0.02 0.00 -1.01 0.00 0.00 64.21 64.45 1nol n SER 535 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nol n GLY 537 N 1.61 3.45 3.77 0.00 0.00 -1.26 -4.74 105.19 108.02 1nol n GLY 537 Ca 0.04 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.96 1nol n GLY 537 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1nol s TRP 538 N -2.00 2.91 0.15 1.61 -0.11 -0.47 -4.32 118.94 116.71 1nol s TRP 538 Ca 0.00 1.48 -0.31 0.00 1.22 0.00 0.00 56.10 58.48 1nol s TRP 538 Cb 0.00 -3.55 -0.10 0.00 -1.50 0.00 0.00 33.47 28.32 1nol s TRP 538 CO 0.00 -1.77 1.71 -1.25 -4.62 0.00 0.00 176.95 171.02 1nol s PRO 539 N -2.30 4.16 0.32 5.86 0.04 -1.26 -0.36 135.00 141.46 1nol s PRO 539 Ca 0.58 2.51 0.09 0.00 0.04 0.00 0.00 61.00 64.21 1nol s PRO 539 Cb -0.35 -3.34 0.84 0.00 0.04 0.00 0.00 34.50 31.69 1nol s PRO 539 CO 0.44 -0.75 1.75 0.77 0.04 0.00 0.00 177.00 179.25 1nol h SER 540 N 7.63 0.71 0.62 6.66 0.02 -1.94 -0.83 113.55 126.42 1nol h SER 540 Ca -0.44 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1nol h SER 540 Cb 1.21 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1nol h SER 540 CO 0.94 0.17 0.00 1.12 -1.14 0.00 0.00 176.83 177.93 1nol h HIS 541 N 0.64 0.00 -0.53 3.45 -0.00 -1.91 -2.52 115.15 114.28 1nol h HIS 541 Ca 0.61 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.80 1nol h HIS 541 Cb 1.11 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 28.41 1nol h HIS 541 CO -0.01 0.00 0.14 1.28 -0.00 0.00 0.00 177.93 179.35 1nol n LEU 542 N -2.45 5.02 -0.17 6.12 4.77 -0.32 -3.83 117.00 126.14 1nol n LEU 542 Ca 0.01 -3.38 -0.08 0.00 -0.03 0.00 0.00 56.01 52.53 1nol n LEU 542 Cb 0.20 -0.67 0.01 0.00 -2.33 0.00 0.00 43.42 40.63 1nol n LEU 542 CO 0.19 0.93 1.02 0.25 -1.33 0.00 0.00 177.39 178.46 1nol h LEU 543 N 1.77 0.62 -9.56 2.23 5.85 -1.49 -3.44 115.31 111.29 1nol h LEU 543 Ca 0.23 -0.09 -0.56 0.00 0.84 0.00 0.00 57.88 58.29 1nol h LEU 543 Cb 1.97 -0.16 -0.10 0.00 0.37 0.00 0.00 40.66 42.75 1nol h LEU 543 CO 0.55 0.53 -0.64 0.68 -0.34 0.00 0.00 178.44 179.22 1nol s VAL 544 N -5.85 3.30 1.15 1.05 -7.23 -1.26 -4.97 120.40 106.58 1nol s VAL 544 Ca -0.13 -1.93 -0.12 0.00 -1.81 0.00 0.00 61.98 57.99 1nol s VAL 544 Cb 0.12 -2.82 0.27 0.00 0.56 0.00 0.00 36.38 34.51 1nol s VAL 544 CO 0.75 -0.35 1.04 -2.84 -0.31 0.00 0.00 175.10 173.40 1nol s PRO 545 N -3.68 -0.79 0.20 4.82 0.02 -1.26 -4.96 135.00 129.35 1nol s PRO 545 Ca 0.32 0.95 -0.02 0.00 0.02 0.00 0.00 61.00 62.27 1nol s PRO 545 Cb -0.06 -1.56 0.14 0.00 0.02 0.00 0.00 34.50 33.04 1nol s PRO 545 CO 0.20 -3.67 1.51 -0.22 -0.33 0.00 0.00 177.00 174.49 1nol h LYS 546 N -2.59 0.48 0.00 5.54 3.64 -1.94 -3.48 116.57 118.22 1nol h LYS 546 Ca -0.60 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 58.47 1nol h LYS 546 Cb 1.33 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1nol h LYS 546 CO 0.49 0.92 0.00 0.41 -2.27 0.00 0.00 179.45 179.00 1nol n GLY 547 N 0.27 0.10 3.64 5.01 0.00 -1.26 -4.03 105.19 108.93 1nol n GLY 547 Ca -0.03 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.97 1nol n GLY 547 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nol s ASN 548 N -4.00 -0.15 0.11 1.61 2.20 -1.22 -4.60 114.94 108.89 1nol s ASN 548 Ca 0.00 -0.79 0.21 0.00 -0.94 0.00 0.00 52.86 51.34 1nol s ASN 548 Cb 0.00 0.62 0.84 0.00 -2.00 0.00 0.00 41.25 40.71 1nol s ASN 548 CO 0.00 -1.18 1.64 2.30 -2.94 0.00 0.00 177.10 176.93 1nol n ILE 549 N -0.39 0.77 0.33 0.54 -5.35 -1.26 -0.94 119.36 113.06 1nol n ILE 549 Ca -0.03 0.15 0.12 0.00 -0.27 0.00 0.00 62.75 62.72 1nol n ILE 549 Cb 0.61 -0.94 0.13 0.00 -1.74 0.00 0.00 39.64 37.70 1nol n ILE 549 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1nol h LYS 550 N 0.00 0.00 -0.55 6.28 1.79 -1.90 -3.43 116.57 118.76 1nol h LYS 550 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1nol h LYS 550 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1nol h LYS 550 CO 0.00 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.78 1nol n GLY 551 N 1.23 -0.29 3.72 3.86 0.00 -0.12 -4.95 105.19 108.64 1nol n GLY 551 Ca 0.02 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 1nol n GLY 551 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1nol s MET 552 N -0.45 4.60 -0.05 1.61 1.75 0.16 -4.79 119.30 122.12 1nol s MET 552 Ca 0.00 1.33 -0.25 0.00 -1.25 0.00 0.00 55.69 55.51 1nol s MET 552 Cb 0.00 -3.41 -0.03 0.00 2.84 0.00 0.00 34.83 34.23 1nol s MET 552 CO 0.00 0.13 0.78 -1.21 -0.65 0.00 0.00 175.02 174.07 1nol s GLU 553 N 0.38 4.47 0.03 4.11 2.02 -1.26 -1.25 118.70 127.20 1nol s GLU 553 Ca 0.46 1.03 0.08 0.00 0.02 0.00 0.00 54.97 56.56 1nol s GLU 553 Cb -0.22 -3.45 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 1nol s GLU 553 CO 0.27 0.02 -0.25 0.71 0.02 0.00 0.00 175.26 176.04 1nol s TYR 554 N 0.89 2.18 0.08 1.61 1.51 -1.00 -2.10 117.35 120.53 1nol s TYR 554 Ca 0.41 -0.40 -0.31 0.00 -1.01 0.00 0.00 57.07 55.76 1nol s TYR 554 Cb -0.19 -1.33 -0.06 0.00 -0.11 0.00 0.00 41.96 40.27 1nol s TYR 554 CO 0.21 0.07 1.27 -1.01 -1.11 0.00 0.00 175.55 174.97 1nol s HIS 555 N -0.74 3.37 -0.25 2.71 3.76 0.88 -2.20 115.29 122.83 1nol s HIS 555 Ca 0.10 1.18 -0.08 0.00 -0.15 0.00 0.00 55.06 56.11 1nol s HIS 555 Cb -0.10 -3.51 -0.04 0.00 1.11 0.00 0.00 32.58 30.05 1nol s HIS 555 CO 0.01 -1.66 0.10 -1.17 -0.85 0.00 0.00 174.74 171.17 1nol s LEU 556 N 1.10 3.62 -0.14 0.89 2.96 -0.29 -1.03 118.68 125.79 1nol s LEU 556 Ca 0.61 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.37 1nol s LEU 556 Cb -0.32 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.37 1nol s LEU 556 CO 0.29 -0.02 -0.10 0.12 -1.32 0.00 0.00 176.35 175.33 1nol s PHE 557 N 1.53 2.89 -0.07 5.38 5.36 -0.32 -0.56 117.98 132.19 1nol s PHE 557 Ca 0.06 -0.54 0.05 0.00 -0.96 0.00 0.00 56.93 55.54 1nol s PHE 557 Cb -0.15 -1.89 -0.01 0.00 -0.34 0.00 0.00 43.02 40.63 1nol s PHE 557 CO 0.05 -0.17 -0.23 0.08 -1.46 0.00 0.00 175.22 173.49 1nol s VAL 558 N 0.40 1.95 -0.04 3.12 1.01 -0.55 -1.38 120.40 124.91 1nol s VAL 558 Ca -0.08 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1nol s VAL 558 Cb -0.15 -1.67 -0.00 0.00 0.00 0.00 0.00 36.38 34.56 1nol s VAL 558 CO 0.04 0.54 -0.14 -0.32 0.00 0.00 0.00 175.10 175.22 1nol s MET 559 N 0.07 1.51 -0.11 2.72 1.75 0.04 0.09 119.30 125.36 1nol s MET 559 Ca -0.09 -0.51 -0.02 0.00 -1.25 0.00 0.00 55.69 53.83 1nol s MET 559 Cb -0.15 -1.33 -0.03 0.00 2.84 0.00 0.00 34.83 36.16 1nol s MET 559 CO 0.05 0.20 -0.05 -0.51 -0.65 0.00 0.00 175.02 174.07 1nol s LEU 560 N 0.10 3.25 0.28 4.11 1.02 0.03 -0.97 118.68 126.50 1nol s LEU 560 Ca -0.04 -0.05 0.06 0.00 0.02 0.00 0.00 54.13 54.13 1nol s LEU 560 Cb -0.11 -1.75 -0.06 0.00 0.02 0.00 0.00 46.19 44.30 1nol s LEU 560 CO 0.02 0.28 -0.05 0.42 0.02 0.00 0.00 176.35 177.04 1nol s THR 561 N -0.29 1.58 -0.28 5.49 -4.23 -0.50 -4.69 115.64 112.73 1nol s THR 561 Ca 0.05 -2.11 -0.29 0.00 -1.18 0.00 0.00 61.69 58.16 1nol s THR 561 Cb -0.13 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.23 1nol s THR 561 CO 0.02 -0.28 1.50 -0.62 -0.54 0.00 0.00 174.62 174.70 1nol s ASP 562 N -3.44 6.43 0.48 3.99 -1.08 -1.26 -1.95 116.67 119.84 1nol s ASP 562 Ca 0.30 1.35 0.32 0.00 -0.52 0.00 0.00 52.55 54.00 1nol s ASP 562 Cb 0.04 -2.54 1.50 0.00 -1.46 0.00 0.00 42.92 40.46 1nol s ASP 562 CO 0.12 -1.26 1.97 -0.25 0.52 0.00 0.00 175.17 176.27 1nol h TRP 563 N 10.41 0.00 0.00 -5.34 7.01 -1.44 0.34 115.95 126.93 1nol h TRP 563 Ca -0.30 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.70 1nol h TRP 563 Cb 1.13 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.19 1nol h TRP 563 CO 0.91 0.00 -0.04 -0.44 -2.79 0.00 0.00 178.44 176.08 1nol h ASP 564 N 0.00 0.00 0.72 2.65 3.32 -1.90 -0.80 116.42 120.41 1nol h ASP 564 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1nol h ASP 564 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1nol h ASP 564 CO 0.00 0.00 -0.77 0.29 -1.72 0.00 0.00 179.24 177.04 1nol n LYS 565 N -2.92 0.30 -0.01 3.56 5.02 0.03 -4.42 118.16 119.73 1nol n LYS 565 Ca 0.04 0.06 -0.11 0.00 -2.02 0.00 0.00 58.31 56.28 1nol n LYS 565 Cb 0.51 -1.66 -0.14 0.00 -0.02 0.00 0.00 35.03 33.72 1nol n LYS 565 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1nol h ASP 566 N 0.00 0.09 -3.94 4.39 3.32 -0.52 -3.43 116.42 116.33 1nol h ASP 566 Ca 0.00 -0.19 -0.53 0.00 0.02 0.00 0.00 57.03 56.33 1nol h ASP 566 Cb 0.75 -0.03 0.09 0.00 0.22 0.00 0.00 39.33 40.36 1nol h ASP 566 CO 0.00 1.17 0.68 -1.59 -1.72 0.00 0.00 179.24 177.78 1nol s LYS 567 N -2.60 4.07 -0.01 3.56 -2.85 -0.38 -0.35 119.74 121.18 1nol s LYS 567 Ca -0.07 2.34 -0.00 0.00 -1.00 0.00 0.00 55.97 57.24 1nol s LYS 567 Cb 0.08 -2.89 -0.00 0.00 -2.06 0.00 0.00 37.83 32.96 1nol s LYS 567 CO 0.82 -0.48 -0.01 0.28 0.10 0.00 0.00 175.35 176.06 1nol n VAL 568 N 0.35 0.05 -1.23 1.79 0.31 -1.26 -4.77 118.33 113.57 1nol n VAL 568 Ca 0.02 -0.01 -0.08 0.00 -0.01 0.00 0.00 64.34 64.26 1nol n VAL 568 Cb 0.41 -1.27 -0.03 0.00 -0.91 0.00 0.00 33.84 32.04 1nol n VAL 568 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1nol n SER 573 N -2.91 -4.89 -4.53 4.52 3.41 -1.26 -4.78 113.62 103.17 1nol n SER 573 Ca -0.02 0.19 -0.40 0.00 -0.26 0.00 0.00 58.87 58.38 1nol n SER 573 Cb 0.51 -3.09 -0.10 0.00 -0.26 0.00 0.00 64.21 61.27 1nol n SER 573 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1nol s VAL 574 N -1.98 5.27 0.66 -3.33 1.01 -1.26 -5.04 120.40 115.74 1nol s VAL 574 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 1nol s VAL 574 Cb 0.00 -3.73 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 1nol s VAL 574 CO 0.00 -0.02 1.07 0.00 0.00 0.00 0.00 175.10 176.15 1nol s ALA 575 N 1.78 2.64 -1.17 5.51 0.00 -1.26 -4.45 121.76 124.81 1nol s ALA 575 Ca 0.07 0.26 -0.03 0.00 0.00 0.00 0.00 51.96 52.26 1nol s ALA 575 Cb -0.17 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1nol s ALA 575 CO 0.11 -1.13 0.91 0.00 0.00 0.00 0.00 175.76 175.65 1nol n VAL 577 N -3.87 2.26 0.22 0.00 0.24 -1.26 -3.75 118.33 112.17 1nol n VAL 577 Ca -0.21 -1.96 0.08 0.00 -2.04 0.00 0.00 64.34 60.21 1nol n VAL 577 Cb 0.65 -0.26 0.51 0.00 -1.47 0.00 0.00 33.84 33.27 1nol n VAL 577 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 1nol h ASP 578 N 1.57 0.00 -0.85 -1.34 3.58 -1.89 -2.86 116.42 114.62 1nol h ASP 578 Ca 0.01 0.00 -0.41 0.00 0.42 0.00 0.00 57.03 57.05 1nol h ASP 578 Cb 1.41 0.00 -0.41 0.00 1.72 0.00 0.00 39.33 42.05 1nol h ASP 578 CO 0.21 0.25 -0.99 0.00 -2.88 0.00 0.00 179.24 175.83 1nol n ALA 579 N -2.33 3.85 -0.33 -0.78 0.00 -1.25 -4.04 120.51 115.63 1nol n ALA 579 Ca -0.01 -3.39 0.12 0.00 0.00 0.00 0.00 53.44 50.16 1nol n ALA 579 Cb 0.37 -0.70 0.34 0.00 0.00 0.00 0.00 19.45 19.46 1nol n ALA 579 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1nol h VAL 580 N 3.56 0.77 -0.80 0.00 -1.51 -1.19 -0.71 116.25 116.37 1nol h VAL 580 Ca 0.08 -0.26 0.08 0.00 -1.23 0.00 0.00 66.70 65.37 1nol h VAL 580 Cb 1.25 -0.05 -0.05 0.00 -2.13 0.00 0.00 31.29 30.30 1nol h VAL 580 CO 0.53 0.14 0.52 0.28 -1.23 0.00 0.00 177.57 177.80 1nol h SER 581 N 0.75 0.70 0.00 4.19 0.02 -1.74 0.29 113.55 117.77 1nol h SER 581 Ca 0.53 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 1nol h SER 581 Cb 0.83 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1nol h SER 581 CO -0.30 0.43 -1.31 -1.22 -1.14 0.00 0.00 176.83 173.29 1nol n TYR 582 N -4.50 0.00 0.07 3.45 4.01 -0.95 -4.68 117.16 114.56 1nol n TYR 582 Ca 0.13 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.88 1nol n TYR 582 Cb 0.28 -0.21 -0.00 0.00 -0.31 0.00 0.00 39.34 39.10 1nol n TYR 582 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1nol n GLY 584 N 0.76 0.13 3.02 0.00 0.00 0.10 -4.90 105.19 104.30 1nol n GLY 584 Ca 0.01 -0.95 -0.18 0.00 0.00 0.00 0.00 46.02 44.89 1nol n GLY 584 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nol s ALA 585 N -1.60 0.72 0.14 4.61 0.00 -1.26 -4.12 121.76 120.25 1nol s ALA 585 Ca 0.00 -0.37 -0.31 0.00 0.00 0.00 0.00 51.96 51.27 1nol s ALA 585 Cb 0.00 -0.18 -0.09 0.00 0.00 0.00 0.00 23.12 22.85 1nol s ALA 585 CO 0.00 0.18 1.50 0.50 0.00 0.00 0.00 175.76 177.94 1nol s ARG 586 N -0.20 4.26 -1.47 0.00 3.52 -0.68 -3.15 118.95 121.22 1nol s ARG 586 Ca 0.03 2.24 -0.06 0.00 -0.13 0.00 0.00 55.73 57.81 1nol s ARG 586 Cb -0.03 -3.22 0.05 0.00 -1.56 0.00 0.00 34.95 30.18 1nol s ARG 586 CO -0.00 -0.55 0.66 -3.47 -0.81 0.00 0.00 175.30 171.13 1nol n ASP 587 N 4.06 -1.92 -3.55 -2.12 2.03 -1.26 -4.57 116.55 109.22 1nol n ASP 587 Ca 0.13 -0.92 -0.12 0.00 0.52 0.00 0.00 54.79 54.40 1nol n ASP 587 Cb 0.40 -3.38 -0.04 0.00 -0.72 0.00 0.00 41.12 37.38 1nol n ASP 587 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1nol s HIS 588 N -3.65 -0.36 0.50 -0.67 2.46 -1.19 -5.08 115.29 107.30 1nol s HIS 588 Ca 0.27 0.17 -0.20 0.00 0.47 0.00 0.00 55.06 55.77 1nol s HIS 588 Cb -0.14 0.37 -0.08 0.00 -0.13 0.00 0.00 32.58 32.60 1nol s HIS 588 CO 0.87 -0.73 1.05 0.15 -2.47 0.00 0.00 174.74 173.60 1nol s LYS 589 N -3.45 3.74 0.00 2.88 1.02 -1.26 -4.59 119.74 118.07 1nol s LYS 589 Ca 0.00 1.38 -0.30 0.00 0.02 0.00 0.00 55.97 57.08 1nol s LYS 589 Cb 0.00 -2.08 -0.08 0.00 -0.52 0.00 0.00 37.83 35.15 1nol s LYS 589 CO -0.10 -0.49 1.86 -0.47 -0.92 0.00 0.00 175.35 175.23 1nol s TYR 590 N -1.98 1.52 0.00 3.18 5.04 -1.26 -4.76 117.35 119.09 1nol s TYR 590 Ca 0.68 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 55.07 1nol s TYR 590 Cb -0.17 -4.13 0.00 0.00 0.35 0.00 0.00 41.96 38.01 1nol s TYR 590 CO 0.21 -4.98 0.63 -2.30 -1.34 0.00 0.00 175.55 167.77 1nol n PRO 591 N 7.40 0.61 -3.70 4.97 -0.02 -1.26 -4.64 135.00 138.37 1nol n PRO 591 Ca 0.19 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.56 1nol n PRO 591 Cb 0.42 -1.20 -0.12 0.00 -0.02 0.00 0.00 33.50 32.58 1nol n PRO 591 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1nol s ASP 592 N 1.04 -0.25 0.43 2.55 -1.08 -1.26 -4.28 116.67 113.81 1nol s ASP 592 Ca 0.00 0.72 0.23 0.00 -0.52 0.00 0.00 52.55 52.97 1nol s ASP 592 Cb 0.00 0.68 0.37 0.00 -1.46 0.00 0.00 42.92 42.51 1nol s ASP 592 CO 0.00 -0.19 1.61 0.11 0.52 0.00 0.00 175.17 177.22 1nol h LYS 593 N 7.45 0.00 -7.21 4.34 1.57 -0.95 -3.47 116.57 118.31 1nol h LYS 593 Ca -0.32 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.94 1nol h LYS 593 Cb 1.15 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.58 1nol h LYS 593 CO 0.28 0.05 0.37 0.15 -0.57 0.00 0.00 179.45 179.73 1nol s LYS 594 N -3.21 2.59 0.54 3.15 -0.14 -1.26 -4.94 119.74 116.46 1nol s LYS 594 Ca 0.06 1.44 -0.22 0.00 -1.36 0.00 0.00 55.97 55.90 1nol s LYS 594 Cb 0.05 -1.92 -0.06 0.00 -1.68 0.00 0.00 37.83 34.23 1nol s LYS 594 CO 0.67 -1.42 1.24 -2.30 -0.76 0.00 0.00 175.35 172.78 1nol n PRO 595 N -2.61 1.51 -2.20 -1.68 -0.02 -1.26 -4.86 135.00 123.87 1nol n PRO 595 Ca 0.11 0.56 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 1nol n PRO 595 Cb 0.52 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.54 1nol n PRO 595 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1nol s MET 596 N -2.74 4.25 0.00 -0.52 -1.94 -1.26 -1.21 119.30 115.87 1nol s MET 596 Ca 0.71 1.97 0.00 0.00 -1.71 0.00 0.00 55.69 56.66 1nol s MET 596 Cb -0.44 -3.71 0.00 0.00 2.01 0.00 0.00 34.83 32.70 1nol s MET 596 CO 0.50 -0.67 0.00 0.41 -0.01 0.00 0.00 175.02 175.25 1nol n GLY 597 N 3.76 0.29 3.64 -0.03 0.00 -1.26 -4.85 105.19 106.74 1nol n GLY 597 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1nol n GLY 597 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nol n PHE 598 N -1.93 1.68 1.82 1.61 7.35 -0.35 -0.74 117.46 126.90 1nol n PHE 598 Ca 0.00 0.62 0.00 0.00 -0.76 0.00 0.00 57.45 57.31 1nol n PHE 598 Cb 0.00 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 37.51 1nol n PHE 598 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1nol n PRO 599 N 0.58 1.00 -0.48 -7.13 -0.04 -1.26 -4.93 135.00 122.73 1nol n PRO 599 Ca 0.07 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.62 1nol n PRO 599 Cb 0.35 -1.09 0.30 0.00 -0.04 0.00 0.00 33.50 33.02 1nol n PRO 599 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1nol n PHE 600 N -0.41 1.15 0.16 0.54 3.72 0.08 -4.45 117.46 118.25 1nol n PHE 600 Ca 0.00 -0.61 0.11 0.00 -0.05 0.00 0.00 57.45 56.90 1nol n PHE 600 Cb 0.04 -0.18 0.01 0.00 -0.94 0.00 0.00 39.48 38.41 1nol n PHE 600 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1nol n ASP 601 N 0.85 0.78 -4.72 4.37 5.75 -1.24 -4.79 116.55 117.55 1nol n ASP 601 Ca 0.22 0.26 -0.24 0.00 -0.01 0.00 0.00 54.79 55.03 1nol n ASP 601 Cb 0.77 0.53 -0.06 0.00 -1.03 0.00 0.00 41.12 41.33 1nol n ASP 601 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1nol s ARG 602 N -3.35 2.57 0.17 0.11 0.52 -1.26 -4.82 118.95 112.89 1nol s ARG 602 Ca -0.00 -1.20 -0.33 0.00 -0.52 0.00 0.00 55.73 53.68 1nol s ARG 602 Cb 0.10 -2.37 -0.15 0.00 0.52 0.00 0.00 34.95 33.06 1nol s ARG 602 CO 0.79 0.40 1.35 -2.30 0.02 0.00 0.00 175.30 175.57 1nol n PRO 603 N -0.79 1.62 -3.77 3.54 -0.02 -1.26 -4.97 135.00 129.34 1nol n PRO 603 Ca -0.08 0.58 -0.37 0.00 -2.02 0.00 0.00 63.50 61.61 1nol n PRO 603 Cb 0.58 -2.21 -0.13 0.00 -0.02 0.00 0.00 33.50 31.72 1nol n PRO 603 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1nol s ILE 604 N 0.21 3.94 -0.17 4.25 1.01 -1.26 -4.36 121.20 124.82 1nol s ILE 604 Ca 0.75 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 1nol s ILE 604 Cb -0.78 -3.02 0.15 0.00 0.01 0.00 0.00 42.46 38.82 1nol s ILE 604 CO 0.47 0.10 1.76 1.41 0.00 0.00 0.00 174.94 178.68 1nol n HIS 605 N 4.86 0.89 -4.26 3.97 8.25 -1.26 -4.29 115.22 123.38 1nol n HIS 605 Ca -0.15 -1.34 -0.22 0.00 -0.26 0.00 0.00 57.72 55.75 1nol n HIS 605 Cb 0.48 -0.66 -0.12 0.00 1.12 0.00 0.00 29.99 30.81 1nol n HIS 605 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1nol s THR 606 N -1.21 1.56 0.04 1.59 -1.32 -1.26 -5.03 115.64 110.01 1nol s THR 606 Ca 0.17 -1.57 -0.17 0.00 -1.21 0.00 0.00 61.69 58.91 1nol s THR 606 Cb 0.14 -1.50 -0.22 0.00 -1.51 0.00 0.00 72.50 69.41 1nol s THR 606 CO 0.01 -0.17 1.17 -0.08 -2.21 0.00 0.00 174.62 173.33 1nol h GLU 607 N 3.92 0.56 -6.11 7.08 4.81 -1.98 -3.38 114.58 119.48 1nol h GLU 607 Ca -0.44 -0.56 -0.68 0.00 -0.13 0.00 0.00 59.36 57.55 1nol h GLU 607 Cb 1.19 0.15 -0.19 0.00 0.63 0.00 0.00 28.75 30.52 1nol h GLU 607 CO 0.43 1.18 -0.70 -1.01 -0.73 0.00 0.00 179.01 178.18 1nol s HIS 608 N -3.37 2.93 0.42 0.92 3.76 -1.26 -1.64 115.29 117.04 1nol s HIS 608 Ca -0.12 -0.00 0.14 0.00 -0.15 0.00 0.00 55.06 54.93 1nol s HIS 608 Cb 0.05 -1.72 0.92 0.00 1.11 0.00 0.00 32.58 32.95 1nol s HIS 608 CO 0.86 0.31 1.93 0.97 -0.85 0.00 0.00 174.74 177.96 1nol h ILE 609 N 4.30 1.15 0.00 0.60 6.09 -1.89 -2.19 117.51 125.56 1nol h ILE 609 Ca -0.48 -0.86 -0.00 0.00 -1.37 0.00 0.00 64.86 62.14 1nol h ILE 609 Cb 1.17 1.47 -0.00 0.00 0.47 0.00 0.00 36.82 39.93 1nol h ILE 609 CO 0.53 0.24 -0.02 0.77 -3.07 0.00 0.00 178.15 176.60 1nol h SER 610 N 0.00 0.00 0.10 2.19 4.64 -1.99 -1.22 113.55 117.26 1nol h SER 610 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nol h SER 610 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1nol h SER 610 CO 0.03 0.02 -0.03 0.47 -0.87 0.00 0.00 176.83 176.46 1nol n ASP 611 N -4.14 0.55 0.16 4.97 8.00 -0.82 -2.84 116.55 122.42 1nol n ASP 611 Ca -0.03 -1.02 0.12 0.00 0.71 0.00 0.00 54.79 54.57 1nol n ASP 611 Cb 0.11 -0.03 0.13 0.00 -0.02 0.00 0.00 41.12 41.31 1nol n ASP 611 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1nol h PHE 612 N 0.82 0.00 -3.02 1.24 3.57 -1.28 -3.48 116.94 114.79 1nol h PHE 612 Ca 0.00 0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.95 1nol h PHE 612 Cb 0.24 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1nol h PHE 612 CO 0.00 0.00 0.77 -0.51 -2.23 0.00 0.00 178.31 176.34 1nol s LEU 613 N -5.66 4.27 0.79 0.59 1.43 -1.13 -5.04 118.68 113.93 1nol s LEU 613 Ca 0.05 1.84 -0.06 0.00 -1.03 0.00 0.00 54.13 54.93 1nol s LEU 613 Cb 0.08 -3.55 0.14 0.00 0.03 0.00 0.00 46.19 42.89 1nol s LEU 613 CO 0.71 -0.65 1.09 0.42 0.23 0.00 0.00 176.35 178.15 1nol s THR 614 N 2.53 2.11 0.30 5.49 -4.23 -1.26 -4.98 115.64 115.60 1nol s THR 614 Ca 0.57 -0.40 0.38 0.00 -1.18 0.00 0.00 61.69 61.06 1nol s THR 614 Cb -0.25 -2.71 0.41 0.00 1.34 0.00 0.00 72.50 71.29 1nol s THR 614 CO 0.21 0.00 2.12 0.78 -0.54 0.00 0.00 174.62 177.20 1nol h ASN 615 N -0.85 0.00 -0.53 3.99 -0.26 -1.95 -2.61 115.58 113.37 1nol h ASN 615 Ca -0.39 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.34 1nol h ASN 615 Cb 1.26 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.51 1nol h ASN 615 CO 0.41 0.00 0.01 -0.46 -1.06 0.00 0.00 177.43 176.33 1nol n ASN 616 N -3.07 5.31 -4.35 5.81 6.94 -1.26 -1.11 115.26 123.53 1nol n ASN 616 Ca -0.01 -2.87 -0.22 0.00 -0.02 0.00 0.00 54.58 51.46 1nol n ASN 616 Cb 0.22 -0.68 -0.11 0.00 -2.36 0.00 0.00 39.78 36.85 1nol n ASN 616 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1nol s MET 617 N -2.62 1.33 -0.04 -3.83 -1.94 -0.98 -0.79 119.30 110.42 1nol s MET 617 Ca 0.50 -1.45 -0.14 0.00 -1.71 0.00 0.00 55.69 52.90 1nol s MET 617 Cb 0.38 -1.41 0.02 0.00 2.01 0.00 0.00 34.83 35.83 1nol s MET 617 CO 0.14 0.29 0.31 0.12 -0.01 0.00 0.00 175.02 175.87 1nol s PHE 618 N -2.05 -0.21 -0.06 -0.03 5.36 0.11 -4.74 117.98 116.36 1nol s PHE 618 Ca 0.17 0.38 0.05 0.00 -0.96 0.00 0.00 56.93 56.58 1nol s PHE 618 Cb -0.06 0.10 -0.01 0.00 -0.34 0.00 0.00 43.02 42.71 1nol s PHE 618 CO 0.07 -0.34 -0.22 0.42 -1.46 0.00 0.00 175.22 173.69 1nol s ILE 619 N -1.01 2.34 -0.11 3.12 1.01 -1.26 -1.48 121.20 123.80 1nol s ILE 619 Ca -0.11 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.60 1nol s ILE 619 Cb -0.05 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.54 1nol s ILE 619 CO 0.03 0.57 -0.21 -0.75 0.00 0.00 0.00 174.94 174.59 1nol s LYS 620 N -0.19 3.14 -0.26 2.79 2.47 0.28 -4.93 119.74 123.04 1nol s LYS 620 Ca -0.02 -0.82 -0.20 0.00 -1.56 0.00 0.00 55.97 53.37 1nol s LYS 620 Cb -0.13 -2.41 -0.02 0.00 -1.46 0.00 0.00 37.83 33.81 1nol s LYS 620 CO 0.03 0.17 0.61 -0.51 0.16 0.00 0.00 175.35 175.82 1nol s ASP 621 N 0.39 6.56 0.56 1.43 1.01 -1.26 -1.13 116.67 124.22 1nol s ASP 621 Ca -0.16 0.67 0.05 0.00 0.71 0.00 0.00 52.55 53.83 1nol s ASP 621 Cb -0.17 -2.33 0.05 0.00 1.01 0.00 0.00 42.92 41.48 1nol s ASP 621 CO 0.07 -0.36 0.39 0.27 0.21 0.00 0.00 175.17 175.75 1nol s ILE 622 N 2.48 1.47 0.00 0.77 -4.36 -0.93 -4.98 121.20 115.65 1nol s ILE 622 Ca 0.25 -1.53 0.03 0.00 -0.26 0.00 0.00 60.65 59.14 1nol s ILE 622 Cb -0.15 -2.00 -0.01 0.00 1.25 0.00 0.00 42.46 41.54 1nol s ILE 622 CO 0.09 0.00 -0.09 -0.54 0.24 0.00 0.00 174.94 174.64 1nol s LYS 623 N -4.29 0.70 -0.12 0.37 1.02 -0.67 -2.37 119.74 114.38 1nol s LYS 623 Ca 0.30 -0.40 -0.01 0.00 0.02 0.00 0.00 55.97 55.87 1nol s LYS 623 Cb -0.02 -0.66 -0.02 0.00 -0.52 0.00 0.00 37.83 36.61 1nol s LYS 623 CO 0.19 0.17 -0.10 0.42 -0.92 0.00 0.00 175.35 175.12 1nol s ILE 624 N -0.40 3.39 -0.13 2.17 1.01 -0.38 -1.03 121.20 125.83 1nol s ILE 624 Ca 0.02 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 1nol s ILE 624 Cb -0.04 -2.43 0.04 0.00 0.01 0.00 0.00 42.46 40.03 1nol s ILE 624 CO -0.00 0.53 0.01 -0.75 0.00 0.00 0.00 174.94 174.73 1nol s LYS 625 N 0.13 0.73 0.38 2.79 2.20 -0.80 0.36 119.74 125.53 1nol s LYS 625 Ca -0.04 -0.15 -0.18 0.00 -0.36 0.00 0.00 55.97 55.23 1nol s LYS 625 Cb -0.14 -1.51 -0.10 0.00 -1.51 0.00 0.00 37.83 34.56 1nol s LYS 625 CO 0.04 -0.44 0.86 0.12 -0.36 0.00 0.00 175.35 175.57 1nol s PHE 626 N 1.90 3.34 -0.20 4.03 5.36 -0.34 -2.30 117.98 129.76 1nol s PHE 626 Ca 0.02 1.44 -0.02 0.00 -0.96 0.00 0.00 56.93 57.42 1nol s PHE 626 Cb -0.14 -2.71 0.00 0.00 -0.34 0.00 0.00 43.02 39.83 1nol s PHE 626 CO -0.07 -0.03 -0.12 -1.58 -1.46 0.00 0.00 175.22 171.97 1nol s HIS 627 N -2.10 2.87 -2.00 10.12 5.65 0.94 -4.11 115.29 126.66 1nol s HIS 627 Ca 0.59 -1.26 0.21 0.00 0.25 0.00 0.00 55.06 54.85 1nol s HIS 627 Cb -0.10 -2.02 1.27 0.00 -1.18 0.00 0.00 32.58 30.56 1nol s HIS 627 CO 0.15 -0.66 1.65 -1.91 -0.65 0.00 0.00 174.74 173.32