#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psd s LYS 8 N 0.00 0.35 0.35 3.49 -0.14 -1.17 -4.98 119.74 117.64 1psd s LYS 8 Ca 0.00 0.18 0.18 0.00 -1.36 0.00 0.00 55.97 54.97 1psd s LYS 8 Cb 0.00 0.16 0.52 0.00 -1.68 0.00 0.00 37.83 36.83 1psd s LYS 8 CO 0.00 -0.06 1.65 -0.44 -0.76 0.00 0.00 175.35 175.74 1psd h ASP 9 N 5.36 0.00 -0.14 2.83 3.32 -2.01 -3.31 116.42 122.47 1psd h ASP 9 Ca -0.27 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.68 1psd h ASP 9 Cb 1.19 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.66 1psd h ASP 9 CO 0.37 0.41 -0.56 1.17 -1.72 0.00 0.00 179.24 178.90 1psd n LYS 10 N -3.43 1.97 -3.45 3.56 3.00 -1.26 -4.28 118.16 114.27 1psd n LYS 10 Ca 0.00 -3.47 -0.44 0.00 -0.00 0.00 0.00 58.31 54.41 1psd n LYS 10 Cb 0.57 -1.74 -0.04 0.00 0.00 0.00 0.00 35.03 33.82 1psd n LYS 10 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 1psd s ILE 11 N -3.48 5.03 0.15 3.15 2.07 -1.25 -5.01 121.20 121.87 1psd s ILE 11 Ca 0.40 -2.63 -0.31 0.00 -1.41 0.00 0.00 60.65 56.70 1psd s ILE 11 Cb 0.38 -4.15 -0.11 0.00 0.13 0.00 0.00 42.46 38.71 1psd s ILE 11 CO -0.05 -0.98 1.74 -0.75 -1.91 0.00 0.00 174.94 172.99 1psd s LYS 12 N 0.09 4.15 -0.23 3.50 2.20 -1.26 -4.52 119.74 123.66 1psd s LYS 12 Ca 0.18 2.54 -0.05 0.00 -0.36 0.00 0.00 55.97 58.28 1psd s LYS 12 Cb -0.13 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.80 1psd s LYS 12 CO -0.07 -0.77 -0.02 -0.06 -0.36 0.00 0.00 175.35 174.07 1psd s PHE 13 N 2.03 3.00 -0.36 4.03 0.40 0.21 -0.64 117.98 126.65 1psd s PHE 13 Ca 0.77 -0.89 -0.10 0.00 -0.60 0.00 0.00 56.93 56.11 1psd s PHE 13 Cb -0.46 -2.14 0.02 0.00 0.51 0.00 0.00 43.02 40.96 1psd s PHE 13 CO 0.34 -0.53 0.19 -1.17 0.70 0.00 0.00 175.22 174.74 1psd s LEU 14 N 1.50 4.56 -0.15 -0.37 2.96 0.15 -0.42 118.68 126.91 1psd s LEU 14 Ca 0.05 -0.93 -0.01 0.00 -0.22 0.00 0.00 54.13 53.03 1psd s LEU 14 Cb -0.15 -2.00 -0.01 0.00 0.50 0.00 0.00 46.19 44.53 1psd s LEU 14 CO -0.02 -0.35 -0.12 -0.76 -1.32 0.00 0.00 176.35 173.78 1psd s LEU 15 N 1.55 2.69 0.38 -0.68 1.43 -0.55 -0.34 118.68 123.16 1psd s LEU 15 Ca 0.02 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1psd s LEU 15 Cb -0.19 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.36 1psd s LEU 15 CO 0.06 0.12 0.05 0.68 0.23 0.00 0.00 176.35 177.49 1psd s VAL 16 N 0.61 1.29 -1.72 -1.59 -7.23 -0.57 -1.28 120.40 109.91 1psd s VAL 16 Ca -0.07 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.09 1psd s VAL 16 Cb -0.15 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1psd s VAL 16 CO 0.03 0.00 0.15 -0.62 -0.31 0.00 0.00 175.10 174.35 1psd n GLU 17 N -0.86 -2.51 -3.38 4.82 1.02 -0.33 -3.97 120.64 115.42 1psd n GLU 17 Ca -0.06 0.98 -0.13 0.00 -0.02 0.00 0.00 57.16 57.93 1psd n GLU 17 Cb 0.66 -5.70 0.01 0.00 -0.02 0.00 0.00 31.44 26.40 1psd n GLU 17 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1psd n GLY 18 N -1.14 -1.21 3.76 0.62 0.00 -0.31 -4.82 105.19 102.09 1psd n GLY 18 Ca -0.21 0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 1psd n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1psd s VAL 19 N -3.11 3.72 0.46 1.61 1.01 -1.26 -4.97 120.40 117.87 1psd s VAL 19 Ca 0.12 1.63 -0.22 0.00 0.00 0.00 0.00 61.98 63.51 1psd s VAL 19 Cb -0.04 -3.99 -0.11 0.00 0.00 0.00 0.00 36.38 32.24 1psd s VAL 19 CO 0.81 0.31 0.64 1.57 0.00 0.00 0.00 175.10 178.43 1psd n HIS 20 N 0.97 -0.18 0.16 5.22 -0.00 -1.26 -4.86 115.22 115.27 1psd n HIS 20 Ca 0.00 0.55 0.18 0.00 0.46 0.00 0.00 57.72 58.91 1psd n HIS 20 Cb 0.47 -2.03 0.79 0.00 -0.12 0.00 0.00 29.99 29.09 1psd n HIS 20 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 1psd h GLN 21 N 0.79 0.00 0.00 1.57 1.08 -1.95 -1.60 115.11 115.00 1psd h GLN 21 Ca -0.43 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.73 1psd h GLN 21 Cb 1.39 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.81 1psd h GLN 21 CO 0.51 0.00 -0.20 0.87 -0.95 0.00 0.00 178.83 179.07 1psd h LYS 22 N 0.00 0.00 -0.00 1.46 1.79 -1.89 -0.09 116.57 117.83 1psd h LYS 22 Ca 0.12 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 1psd h LYS 22 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1psd h LYS 22 CO -0.00 0.20 -0.03 0.00 -1.08 0.00 0.00 179.45 178.54 1psd h ALA 23 N 1.80 0.01 -0.62 3.86 0.00 -1.47 -1.48 119.26 121.36 1psd h ALA 23 Ca -0.00 -0.36 0.10 0.00 0.00 0.00 0.00 54.91 54.64 1psd h ALA 23 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 1psd h ALA 23 CO 0.03 -0.12 0.23 -0.07 0.00 0.00 0.00 179.25 179.31 1psd h LEU 24 N -0.66 0.22 -0.52 0.00 -0.00 -1.56 -1.23 115.31 111.57 1psd h LEU 24 Ca -0.00 0.08 0.01 0.00 -0.00 0.00 0.00 57.88 57.96 1psd h LEU 24 Cb 0.73 0.06 -0.03 0.00 -0.00 0.00 0.00 40.66 41.42 1psd h LEU 24 CO 0.01 0.13 0.34 -0.08 -0.00 0.00 0.00 178.44 178.84 1psd h GLU 25 N 0.41 0.67 0.00 1.13 4.81 -0.98 -2.89 114.58 117.73 1psd h GLU 25 Ca 0.31 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.40 1psd h GLU 25 Cb 0.39 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1psd h GLU 25 CO -0.31 0.45 -0.47 0.66 -0.73 0.00 0.00 179.01 178.60 1psd h SER 26 N 0.69 0.00 0.21 1.04 4.64 -0.22 -2.33 113.55 117.58 1psd h SER 26 Ca 0.19 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1psd h SER 26 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1psd h SER 26 CO -0.04 0.47 -0.10 -0.07 -0.87 0.00 0.00 176.83 176.22 1psd h LEU 27 N 0.00 -0.24 -0.86 5.97 3.38 -1.08 -2.07 115.31 120.41 1psd h LEU 27 Ca -0.00 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.90 1psd h LEU 27 Cb 0.85 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.59 1psd h LEU 27 CO 0.06 0.02 0.51 0.03 0.09 0.00 0.00 178.44 179.15 1psd h ARG 28 N -0.50 0.84 -0.69 1.13 3.08 -1.37 0.20 114.38 117.08 1psd h ARG 28 Ca -0.03 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.03 1psd h ARG 28 Cb 0.37 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 1psd h ARG 28 CO 0.05 0.55 0.46 0.00 -1.07 0.00 0.00 179.97 179.96 1psd h ALA 29 N 1.45 1.71 -0.16 0.04 0.00 -1.23 0.24 119.26 121.33 1psd h ALA 29 Ca 0.40 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 1psd h ALA 29 Cb 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1psd h ALA 29 CO -0.23 0.18 0.05 0.00 0.00 0.00 0.00 179.25 179.25 1psd n ALA 30 N -2.45 2.93 -1.18 0.00 0.00 0.57 -4.82 120.51 115.56 1psd n ALA 30 Ca 0.10 -0.49 -0.06 0.00 0.00 0.00 0.00 53.44 52.99 1psd n ALA 30 Cb 0.21 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1psd n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1psd n GLY 31 N 0.14 0.73 3.35 0.00 0.00 0.86 -3.75 105.19 106.52 1psd n GLY 31 Ca 0.08 -0.17 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 1psd n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1psd s TYR 32 N -1.86 3.11 -0.18 1.61 2.02 -0.34 -3.06 117.35 118.64 1psd s TYR 32 Ca 0.00 -1.07 -0.16 0.00 -0.37 0.00 0.00 57.07 55.47 1psd s TYR 32 Cb 0.00 -3.88 -0.21 0.00 -0.40 0.00 0.00 41.96 37.47 1psd s TYR 32 CO 0.00 -1.16 0.22 2.41 -1.57 0.00 0.00 175.55 175.46 1psd n THR 33 N 5.42 1.62 -1.62 -0.71 -1.04 -1.26 -2.86 114.28 113.83 1psd n THR 33 Ca -0.11 -0.26 -0.15 0.00 -2.04 0.00 0.00 64.05 61.49 1psd n THR 33 Cb 0.42 -1.92 -0.07 0.00 -1.82 0.00 0.00 70.33 66.93 1psd n THR 33 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1psd s ASN 34 N -6.95 3.93 -0.16 8.00 3.04 -1.26 -4.89 114.94 116.65 1psd s ASN 34 Ca -0.27 -0.16 0.01 0.00 0.04 0.00 0.00 52.86 52.47 1psd s ASN 34 Cb 0.07 -2.56 0.02 0.00 -1.54 0.00 0.00 41.25 37.24 1psd s ASN 34 CO 0.64 -3.91 -0.19 -0.63 -3.04 0.00 0.00 177.10 169.97 1psd s ILE 35 N 14.71 1.94 -0.54 -5.21 1.01 -1.26 -0.62 121.20 131.23 1psd s ILE 35 Ca 0.89 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 60.57 1psd s ILE 35 Cb -0.11 -1.76 0.14 0.00 0.01 0.00 0.00 42.46 40.74 1psd s ILE 35 CO 0.09 0.52 0.42 -0.70 0.00 0.00 0.00 174.94 175.27 1psd s GLU 36 N 1.19 2.65 0.32 2.79 2.12 0.44 -4.98 118.70 123.24 1psd s GLU 36 Ca 0.02 -1.98 -0.10 0.00 0.36 0.00 0.00 54.97 53.27 1psd s GLU 36 Cb -0.14 -3.97 -0.07 0.00 0.26 0.00 0.00 34.13 30.21 1psd s GLU 36 CO -0.09 -1.21 0.66 0.12 -0.54 0.00 0.00 175.26 174.20 1psd s PHE 37 N 0.99 3.44 -0.21 5.30 5.36 -1.26 -1.48 117.98 130.12 1psd s PHE 37 Ca 0.09 0.96 -0.04 0.00 -0.96 0.00 0.00 56.93 56.98 1psd s PHE 37 Cb -0.23 -2.35 0.11 0.00 -0.34 0.00 0.00 43.02 40.20 1psd s PHE 37 CO -0.02 0.09 0.33 -1.01 -1.46 0.00 0.00 175.22 173.15 1psd s HIS 38 N -2.08 -0.63 0.53 10.12 3.76 -0.40 -4.95 115.29 121.63 1psd s HIS 38 Ca 0.49 0.83 0.19 0.00 -0.15 0.00 0.00 55.06 56.43 1psd s HIS 38 Cb -0.11 -0.03 1.33 0.00 1.11 0.00 0.00 32.58 34.88 1psd s HIS 38 CO 0.25 -0.60 2.11 -0.22 -0.85 0.00 0.00 174.74 175.43 1psd h LYS 39 N 8.23 0.00 0.00 1.40 3.64 -1.93 -0.70 116.57 127.21 1psd h LYS 39 Ca -0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1psd h LYS 39 Cb 1.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1psd h LYS 39 CO 0.23 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.82 1psd n GLY 40 N -1.56 4.51 3.89 5.01 0.00 -1.26 -1.51 105.19 114.27 1psd n GLY 40 Ca 0.01 -2.16 -0.29 0.00 0.00 0.00 0.00 46.02 43.57 1psd n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1psd s ALA 41 N -2.00 3.07 -0.09 4.61 0.00 -1.26 -1.19 121.76 124.89 1psd s ALA 41 Ca 0.00 -0.35 0.02 0.00 0.00 0.00 0.00 51.96 51.63 1psd s ALA 41 Cb 0.00 -2.93 0.01 0.00 0.00 0.00 0.00 23.12 20.20 1psd s ALA 41 CO 0.00 -0.89 -0.15 -0.51 0.00 0.00 0.00 175.76 174.21 1psd s LEU 42 N -5.19 1.73 0.59 0.00 1.02 -1.26 -4.94 118.68 110.63 1psd s LEU 42 Ca 0.56 -0.40 -0.19 0.00 0.02 0.00 0.00 54.13 54.12 1psd s LEU 42 Cb -0.11 -1.03 -0.03 0.00 0.02 0.00 0.00 46.19 45.03 1psd s LEU 42 CO 0.51 0.04 1.21 1.51 0.02 0.00 0.00 176.35 179.63 1psd s ASP 43 N 0.81 5.17 0.27 2.29 -4.77 -1.26 -4.50 116.67 114.69 1psd s ASP 43 Ca -0.11 2.39 -0.08 0.00 -3.30 0.00 0.00 52.55 51.46 1psd s ASP 43 Cb -0.16 -2.60 0.45 0.00 -1.09 0.00 0.00 42.92 39.52 1psd s ASP 43 CO 0.02 -1.60 1.53 -0.67 0.70 0.00 0.00 175.17 175.14 1psd n ASP 44 N -1.60 -0.36 -0.10 2.11 -0.08 -1.26 0.67 116.55 115.93 1psd n ASP 44 Ca 0.14 1.69 -0.08 0.00 -1.51 0.00 0.00 54.79 55.03 1psd n ASP 44 Cb 0.50 -0.51 0.00 0.00 2.34 0.00 0.00 41.12 43.45 1psd n ASP 44 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1psd h GLU 45 N 0.00 0.35 0.03 -0.67 4.81 -2.01 -2.25 114.58 114.84 1psd h GLU 45 Ca 0.47 -0.02 -0.21 0.00 -0.13 0.00 0.00 59.36 59.46 1psd h GLU 45 Cb 0.72 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1psd h GLU 45 CO -1.01 0.23 -0.97 0.37 -0.73 0.00 0.00 179.01 176.90 1psd h GLN 46 N 0.36 0.15 -0.43 1.92 4.15 -1.23 -3.28 115.11 116.76 1psd h GLN 46 Ca 0.14 -0.20 0.03 0.00 0.77 0.00 0.00 58.65 59.39 1psd h GLN 46 Cb 0.04 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 1psd h GLN 46 CO -0.09 1.01 0.22 1.25 -1.93 0.00 0.00 178.83 179.30 1psd h LEU 47 N 0.07 0.34 -0.36 -2.39 5.85 0.42 -2.88 115.31 116.36 1psd h LEU 47 Ca -0.05 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.71 1psd h LEU 47 Cb 1.66 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.60 1psd h LEU 47 CO 0.15 0.24 0.17 0.11 -0.34 0.00 0.00 178.44 178.76 1psd h LYS 48 N 0.45 0.34 -0.48 1.25 1.57 -1.46 0.57 116.57 118.80 1psd h LYS 48 Ca 0.18 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1psd h LYS 48 Cb 0.07 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1psd h LYS 48 CO -0.11 0.22 0.22 0.93 -0.57 0.00 0.00 179.45 180.14 1psd h GLU 49 N 0.35 0.67 0.01 3.15 4.39 -1.60 -2.06 114.58 119.49 1psd h GLU 49 Ca 0.16 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 1psd h GLU 49 Cb 0.08 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1psd h GLU 49 CO -0.12 0.53 -0.00 0.77 -1.16 0.00 0.00 179.01 179.03 1psd h SER 50 N 0.68 -0.01 0.83 1.42 0.02 -1.24 -3.32 113.55 111.93 1psd h SER 50 Ca 0.17 -0.75 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1psd h SER 50 Cb 0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1psd h SER 50 CO -0.02 0.75 0.00 -0.29 -1.14 0.00 0.00 176.83 176.13 1psd h ILE 51 N -0.78 0.00 0.00 3.27 2.10 -0.86 -3.37 117.51 117.87 1psd h ILE 51 Ca -0.00 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.60 1psd h ILE 51 Cb 0.75 1.18 0.00 0.00 -1.09 0.00 0.00 36.82 37.67 1psd h ILE 51 CO 0.00 0.00 0.00 -1.14 -1.08 0.00 0.00 178.15 175.93 1psd n ARG 52 N -2.60 0.00 -0.39 2.19 0.63 -0.78 -2.11 116.66 113.61 1psd n ARG 52 Ca 0.01 0.69 -0.01 0.00 -0.92 0.00 0.00 57.85 57.62 1psd n ARG 52 Cb 0.26 -1.43 0.13 0.00 0.45 0.00 0.00 32.46 31.86 1psd n ARG 52 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 1psd n ASP 53 N -2.27 2.98 -4.80 6.15 5.75 -1.26 -2.87 116.55 120.22 1psd n ASP 53 Ca 0.00 -2.44 -0.39 0.00 -0.01 0.00 0.00 54.79 51.95 1psd n ASP 53 Cb 0.00 -0.59 -0.06 0.00 -1.03 0.00 0.00 41.12 39.44 1psd n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1psd s ALA 54 N -1.56 3.57 -0.16 2.12 0.00 -0.90 -4.61 121.76 120.23 1psd s ALA 54 Ca 0.21 0.01 -0.15 0.00 0.00 0.00 0.00 51.96 52.03 1psd s ALA 54 Cb 0.17 -2.65 -0.23 0.00 0.00 0.00 0.00 23.12 20.42 1psd s ALA 54 CO 0.06 0.33 0.30 0.45 0.00 0.00 0.00 175.76 176.90 1psd h HIS 55 N 4.90 0.23 -4.06 0.00 3.86 -0.97 -2.74 115.15 116.37 1psd h HIS 55 Ca -0.48 -0.17 -0.59 0.00 -1.16 0.00 0.00 60.37 57.97 1psd h HIS 55 Cb 1.21 -0.01 -0.24 0.00 1.06 0.00 0.00 27.41 29.43 1psd h HIS 55 CO 0.67 1.62 -0.84 -0.06 0.86 0.00 0.00 177.93 180.18 1psd s PHE 56 N -2.45 1.88 -0.03 2.45 0.08 -0.82 0.23 117.98 119.32 1psd s PHE 56 Ca -0.25 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.42 1psd s PHE 56 Cb 0.06 -1.08 0.01 0.00 -0.57 0.00 0.00 43.02 41.45 1psd s PHE 56 CO 0.68 0.16 -0.05 -1.50 -0.10 0.00 0.00 175.22 174.41 1psd s ILE 57 N -0.96 0.55 -0.23 0.64 2.07 -1.21 0.31 121.20 122.36 1psd s ILE 57 Ca 0.08 -0.18 -0.03 0.00 -1.41 0.00 0.00 60.65 59.11 1psd s ILE 57 Cb -0.09 -0.54 0.00 0.00 0.13 0.00 0.00 42.46 41.96 1psd s ILE 57 CO 0.03 0.21 -0.06 -0.83 -1.91 0.00 0.00 174.94 172.38 1psd s GLY 58 N 0.60 1.60 0.30 1.50 0.00 0.53 -0.96 107.32 110.90 1psd s GLY 58 Ca -0.08 -1.26 0.03 0.00 0.00 0.00 0.00 44.72 43.41 1psd s GLY 58 CO 0.00 0.44 0.09 0.48 0.00 0.00 0.00 173.10 174.12 1psd s LEU 59 N 1.42 1.86 0.00 0.66 -0.00 -0.37 -1.51 118.68 120.75 1psd s LEU 59 Ca 0.04 -1.43 0.00 0.00 -0.00 0.00 0.00 54.13 52.74 1psd s LEU 59 Cb -0.15 -0.11 0.00 0.00 -0.00 0.00 0.00 46.19 45.93 1psd s LEU 59 CO -0.04 -0.73 0.00 0.54 -0.00 0.00 0.00 176.35 176.12 1psd n ARG 60 N -0.60 2.30 0.18 1.48 1.74 -1.26 -1.42 116.66 119.08 1psd n ARG 60 Ca -0.01 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.15 1psd n ARG 60 Cb 0.66 0.00 0.45 0.00 -1.02 0.00 0.00 32.46 32.55 1psd n ARG 60 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1psd h SER 61 N 0.00 0.00 0.00 0.55 4.64 -1.90 -3.14 113.55 113.70 1psd h SER 61 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1psd h SER 61 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1psd h SER 61 CO 0.00 0.00 -2.39 0.54 -0.87 0.00 0.00 176.83 174.11 1psd n ARG 62 N -2.18 0.72 -2.21 4.77 1.74 -1.26 -4.94 116.66 113.31 1psd n ARG 62 Ca -0.01 0.06 -0.41 0.00 -0.77 0.00 0.00 57.85 56.72 1psd n ARG 62 Cb 0.27 -1.51 -0.03 0.00 -1.02 0.00 0.00 32.46 30.17 1psd n ARG 62 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1psd s THR 63 N -2.49 3.03 -0.33 0.55 2.01 -1.19 -5.00 115.64 112.23 1psd s THR 63 Ca -0.20 0.95 0.00 0.00 0.31 0.00 0.00 61.69 62.75 1psd s THR 63 Cb 0.07 -3.61 0.08 0.00 0.01 0.00 0.00 72.50 69.05 1psd s THR 63 CO 0.71 0.19 0.04 -1.00 -0.69 0.00 0.00 174.62 173.88 1psd s HIS 64 N -0.61 3.47 -0.93 4.92 3.76 -1.26 -4.76 115.29 119.89 1psd s HIS 64 Ca 0.52 -2.37 -0.19 0.00 -0.15 0.00 0.00 55.06 52.87 1psd s HIS 64 Cb -0.37 -2.55 0.13 0.00 1.11 0.00 0.00 32.58 30.90 1psd s HIS 64 CO 0.45 -0.90 1.13 -0.51 -0.85 0.00 0.00 174.74 174.06 1psd s LEU 65 N 1.11 5.08 0.31 0.89 1.02 -0.58 -4.94 118.68 121.57 1psd s LEU 65 Ca 0.01 -2.07 -0.08 0.00 0.02 0.00 0.00 54.13 52.01 1psd s LEU 65 Cb -0.20 -2.40 -0.06 0.00 0.02 0.00 0.00 46.19 43.55 1psd s LEU 65 CO -0.04 -1.05 0.63 0.28 0.02 0.00 0.00 176.35 176.19 1psd s THR 66 N 2.62 4.90 0.36 5.49 -1.32 -1.26 -0.63 115.64 125.81 1psd s THR 66 Ca 0.33 0.39 0.22 0.00 -1.21 0.00 0.00 61.69 61.41 1psd s THR 66 Cb -0.05 -3.69 0.35 0.00 -1.51 0.00 0.00 72.50 67.60 1psd s THR 66 CO -0.09 -0.31 1.50 1.21 -2.21 0.00 0.00 174.62 174.72 1psd n GLU 67 N -0.80 -0.05 0.13 7.08 2.13 -1.26 0.68 120.64 128.55 1psd n GLU 67 Ca 0.00 1.30 -0.13 0.00 0.66 0.00 0.00 57.16 58.99 1psd n GLU 67 Cb 0.53 -2.36 -0.06 0.00 0.27 0.00 0.00 31.44 29.83 1psd n GLU 67 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1psd h ASP 68 N 0.00 -0.59 -0.28 4.31 3.58 -1.98 0.42 116.42 121.87 1psd h ASP 68 Ca 0.81 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 58.29 1psd h ASP 68 Cb 2.22 0.21 -0.01 0.00 1.72 0.00 0.00 39.33 43.47 1psd h ASP 68 CO -0.69 -0.31 0.05 0.58 -2.88 0.00 0.00 179.24 175.99 1psd h VAL 69 N -0.44 1.23 -0.86 2.25 2.07 -0.11 -2.09 116.25 118.29 1psd h VAL 69 Ca 0.01 -0.77 0.10 0.00 0.82 0.00 0.00 66.70 66.86 1psd h VAL 69 Cb 0.43 1.19 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 1psd h VAL 69 CO -0.08 0.25 0.50 0.40 0.02 0.00 0.00 177.57 178.66 1psd h ILE 70 N 0.29 0.90 0.00 4.57 2.04 -0.98 0.77 117.51 125.10 1psd h ILE 70 Ca 0.09 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1psd h ILE 70 Cb 0.32 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1psd h ILE 70 CO 0.00 0.15 -0.19 0.78 0.00 0.00 0.00 178.15 178.90 1psd h ASN 71 N 0.82 0.00 1.47 1.72 2.35 -0.66 -2.14 115.58 119.14 1psd h ASN 71 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 1psd h ASN 71 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1psd h ASN 71 CO -0.26 0.19 -0.19 0.00 -1.65 0.00 0.00 177.43 175.52 1psd h ALA 72 N 1.81 0.88 -1.96 -0.83 0.00 -0.20 -3.43 119.26 115.53 1psd h ALA 72 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1psd h ALA 72 Cb 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.35 1psd h ALA 72 CO 0.02 0.00 0.75 0.00 0.00 0.00 0.00 179.25 180.02 1psd s ALA 73 N -3.16 3.42 -0.20 0.00 0.00 -0.55 -4.59 121.76 116.67 1psd s ALA 73 Ca 0.08 -0.28 -0.18 0.00 0.00 0.00 0.00 51.96 51.58 1psd s ALA 73 Cb 0.10 -3.64 -0.20 0.00 0.00 0.00 0.00 23.12 19.38 1psd s ALA 73 CO 0.65 -1.63 0.20 -0.85 0.00 0.00 0.00 175.76 174.14 1psd n GLU 74 N 6.94 0.61 -0.45 0.00 0.28 -1.14 -4.37 120.64 122.51 1psd n GLU 74 Ca 0.10 0.49 0.07 0.00 -0.16 0.00 0.00 57.16 57.66 1psd n GLU 74 Cb 0.48 -1.72 0.26 0.00 1.43 0.00 0.00 31.44 31.89 1psd n GLU 74 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1psd n LYS 75 N -4.22 2.99 -1.89 3.44 5.02 -1.17 -4.93 118.16 117.40 1psd n LYS 75 Ca -0.34 -2.09 -0.43 0.00 -2.02 0.00 0.00 58.31 53.43 1psd n LYS 75 Cb 0.77 -1.72 -0.03 0.00 -0.02 0.00 0.00 35.03 34.03 1psd n LYS 75 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1psd s LEU 76 N -1.47 3.54 -0.23 -0.35 2.96 -1.03 -3.80 118.68 118.29 1psd s LEU 76 Ca 0.37 1.53 0.02 0.00 -0.22 0.00 0.00 54.13 55.84 1psd s LEU 76 Cb 0.24 -3.52 -0.19 0.00 0.50 0.00 0.00 46.19 43.22 1psd s LEU 76 CO 0.18 -1.72 -0.12 0.55 -1.32 0.00 0.00 176.35 173.92 1psd n VAL 77 N 7.39 1.53 -3.71 1.68 3.14 0.14 -4.91 118.33 123.58 1psd n VAL 77 Ca 0.24 -0.60 -0.14 0.00 -2.96 0.00 0.00 64.34 60.88 1psd n VAL 77 Cb 0.46 -1.40 -0.08 0.00 -1.06 0.00 0.00 33.84 31.75 1psd n VAL 77 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1psd s ALA 78 N -2.52 -1.02 -0.11 1.55 0.00 -1.19 -4.31 121.76 114.15 1psd s ALA 78 Ca -0.31 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.26 1psd s ALA 78 Cb 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 1psd s ALA 78 CO 0.64 -0.28 -0.06 0.42 0.00 0.00 0.00 175.76 176.48 1psd s ILE 79 N -1.15 3.70 -0.20 0.00 1.01 -0.54 -3.30 121.20 120.73 1psd s ILE 79 Ca -0.12 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1psd s ILE 79 Cb -0.04 -2.56 0.04 0.00 0.01 0.00 0.00 42.46 39.91 1psd s ILE 79 CO 0.05 0.55 -0.09 -0.83 0.00 0.00 0.00 174.94 174.62 1psd s GLY 80 N -0.20 1.23 -0.52 6.18 0.00 -0.13 -1.23 107.32 112.65 1psd s GLY 80 Ca 0.03 -1.17 -0.20 0.00 0.00 0.00 0.00 44.72 43.38 1psd s GLY 80 CO 0.03 0.76 0.67 0.00 0.00 0.00 0.00 173.10 174.56 1psd n PHE 82 N 6.34 2.32 -3.89 0.00 3.01 -0.51 -3.51 117.46 121.22 1psd n PHE 82 Ca -0.06 -2.96 -0.00 0.00 1.01 0.00 0.00 57.45 55.44 1psd n PHE 82 Cb 0.45 -2.40 0.01 0.00 -0.01 0.00 0.00 39.48 37.54 1psd n PHE 82 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1psd h ILE 84 N 2.00 0.00 -3.55 0.00 3.07 -1.85 -1.38 117.51 115.79 1psd h ILE 84 Ca -0.26 -0.84 -0.52 0.00 1.55 0.00 0.00 64.86 64.80 1psd h ILE 84 Cb 1.20 1.38 -0.03 0.00 -0.27 0.00 0.00 36.82 39.10 1psd h ILE 84 CO 0.33 0.00 0.03 -0.83 -1.05 0.00 0.00 178.15 176.63 1psd s GLY 85 N -4.13 2.43 0.00 0.16 0.00 -1.26 -4.80 107.32 99.71 1psd s GLY 85 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.73 1psd s GLY 85 CO 0.76 0.24 0.07 -0.37 0.00 0.00 0.00 173.10 173.80 1psd n THR 86 N 0.20 0.00 0.55 0.90 5.66 -1.26 -4.83 114.28 115.51 1psd n THR 86 Ca -0.00 -0.07 0.07 0.00 -3.05 0.00 0.00 64.05 60.99 1psd n THR 86 Cb 0.52 1.82 0.32 0.00 -1.55 0.00 0.00 70.33 71.44 1psd n THR 86 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1psd n ASN 87 N -0.00 0.00 0.00 1.09 0.23 -1.26 -2.77 115.26 112.55 1psd n ASN 87 Ca 0.00 0.30 0.12 0.00 -0.53 0.00 0.00 54.58 54.47 1psd n ASN 87 Cb 0.21 -0.39 0.64 0.00 -2.08 0.00 0.00 39.78 38.16 1psd n ASN 87 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1psd n GLN 88 N -1.39 0.44 -4.79 -3.83 0.00 -1.26 -4.74 117.38 101.80 1psd n GLN 88 Ca 0.05 0.04 -0.25 0.00 0.00 0.00 0.00 57.00 56.84 1psd n GLN 88 Cb 0.13 -1.50 -0.15 0.00 0.00 0.00 0.00 30.24 28.72 1psd n GLN 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 1psd s VAL 89 N -2.46 1.43 -0.83 -0.39 -7.23 -1.11 -1.53 120.40 108.28 1psd s VAL 89 Ca 0.26 -0.85 -0.25 0.00 -1.81 0.00 0.00 61.98 59.33 1psd s VAL 89 Cb 0.17 -1.21 -0.00 0.00 0.56 0.00 0.00 36.38 35.89 1psd s VAL 89 CO 0.36 0.34 1.69 -0.62 -0.31 0.00 0.00 175.10 176.56 1psd s ASP 90 N -0.59 5.66 0.17 4.85 2.15 0.20 -4.84 116.67 124.27 1psd s ASP 90 Ca 0.07 -0.55 -0.19 0.00 0.43 0.00 0.00 52.55 52.30 1psd s ASP 90 Cb -0.07 -2.55 0.09 0.00 -0.30 0.00 0.00 42.92 40.08 1psd s ASP 90 CO -0.00 -2.21 1.63 -0.07 -0.17 0.00 0.00 175.17 174.35 1psd h LEU 91 N 15.49 -0.67 -0.21 -1.34 4.07 -1.89 -2.36 115.31 128.39 1psd h LEU 91 Ca -0.04 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.08 1psd h LEU 91 Cb 1.05 0.36 -0.01 0.00 1.08 0.00 0.00 40.66 43.14 1psd h LEU 91 CO 1.27 -0.23 0.14 0.44 -1.08 0.00 0.00 178.44 178.98 1psd h ASP 92 N -0.13 0.25 0.21 -0.43 5.19 -1.98 -0.31 116.42 119.22 1psd h ASP 92 Ca 0.19 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 1psd h ASP 92 Cb 0.43 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.87 1psd h ASP 92 CO -0.47 0.18 0.00 0.00 -3.12 0.00 0.00 179.24 175.83 1psd n ALA 93 N -2.15 1.22 -0.07 3.45 0.00 -0.99 -1.89 120.51 120.08 1psd n ALA 93 Ca -0.03 0.17 -0.22 0.00 0.00 0.00 0.00 53.44 53.36 1psd n ALA 93 Cb 0.03 -1.34 -0.12 0.00 0.00 0.00 0.00 19.45 18.01 1psd n ALA 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1psd n ALA 94 N -1.78 0.94 -0.28 0.00 0.00 -0.53 -4.17 120.51 114.69 1psd n ALA 94 Ca -0.00 -0.66 -0.05 0.00 0.00 0.00 0.00 53.44 52.73 1psd n ALA 94 Cb 0.09 -0.47 0.07 0.00 0.00 0.00 0.00 19.45 19.14 1psd n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1psd h ALA 95 N -0.31 0.97 -0.02 0.00 0.00 -0.73 -0.56 119.26 118.61 1psd h ALA 95 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1psd h ALA 95 Cb 1.66 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1psd h ALA 95 CO -0.12 0.39 0.13 0.87 0.00 0.00 0.00 179.25 180.52 1psd h LYS 96 N 1.04 0.00 -0.50 0.00 6.56 -1.56 0.28 116.57 122.38 1psd h LYS 96 Ca 0.28 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.87 1psd h LYS 96 Cb -0.11 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.55 1psd h LYS 96 CO -0.06 0.00 0.00 0.54 -2.06 0.00 0.00 179.45 177.87 1psd n ARG 97 N -3.09 3.12 -3.34 3.15 1.74 -0.71 -4.94 116.66 112.58 1psd n ARG 97 Ca -0.02 -2.54 -0.19 0.00 -0.77 0.00 0.00 57.85 54.33 1psd n ARG 97 Cb 0.20 -1.60 0.06 0.00 -1.02 0.00 0.00 32.46 30.10 1psd n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1psd n GLY 98 N 0.77 -0.24 3.05 -0.13 0.00 0.99 -4.91 105.19 104.72 1psd n GLY 98 Ca 0.20 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 1psd n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1psd s ILE 99 N -3.24 2.15 0.42 -0.61 1.01 -0.30 -4.94 121.20 115.70 1psd s ILE 99 Ca 0.45 -1.76 -0.13 0.00 0.00 0.00 0.00 60.65 59.21 1psd s ILE 99 Cb -0.20 -2.33 -0.07 0.00 0.01 0.00 0.00 42.46 39.86 1psd s ILE 99 CO 0.56 -0.16 0.83 -2.16 0.00 0.00 0.00 174.94 174.01 1psd s PRO 100 N 1.08 3.87 -0.07 2.79 0.04 -1.26 -3.50 135.00 137.95 1psd s PRO 100 Ca -0.05 0.65 0.05 0.00 0.04 0.00 0.00 61.00 61.70 1psd s PRO 100 Cb -0.20 -2.32 -0.00 0.00 0.04 0.00 0.00 34.50 32.02 1psd s PRO 100 CO -0.06 -0.07 -0.23 0.54 0.04 0.00 0.00 177.00 177.22 1psd s VAL 101 N -2.38 1.90 0.28 -0.36 0.11 -1.26 -1.46 120.40 117.22 1psd s VAL 101 Ca 0.54 -0.96 0.09 0.00 -2.93 0.00 0.00 61.98 58.73 1psd s VAL 101 Cb -0.10 -1.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.08 1psd s VAL 101 CO 0.29 0.53 0.03 -0.36 -3.33 0.00 0.00 175.10 172.25 1psd s PHE 102 N 0.10 2.72 0.05 1.54 0.08 -0.37 -2.29 117.98 119.82 1psd s PHE 102 Ca -0.10 -0.25 -0.01 0.00 0.12 0.00 0.00 56.93 56.69 1psd s PHE 102 Cb -0.15 -1.28 0.01 0.00 -0.57 0.00 0.00 43.02 41.02 1psd s PHE 102 CO 0.05 0.57 0.09 0.27 -0.10 0.00 0.00 175.22 176.11 1psd n ASN 103 N -0.95 -0.27 -3.94 1.36 6.94 -1.26 -0.16 115.26 116.97 1psd n ASN 103 Ca -0.06 -1.25 -0.30 0.00 -0.02 0.00 0.00 54.58 52.95 1psd n ASN 103 Cb 0.59 0.47 -0.13 0.00 -2.36 0.00 0.00 39.78 38.35 1psd n ASN 103 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1psd s ALA 104 N -1.43 3.47 0.15 -2.53 0.00 -0.52 -4.73 121.76 116.17 1psd s ALA 104 Ca 0.03 -3.43 -0.31 0.00 0.00 0.00 0.00 51.96 48.25 1psd s ALA 104 Cb -0.00 -2.19 -0.08 0.00 0.00 0.00 0.00 23.12 20.85 1psd s ALA 104 CO 0.02 -2.05 1.54 -1.35 0.00 0.00 0.00 175.76 173.93 1psd h PRO 105 N 6.22 -0.09 -2.08 0.00 0.11 -1.87 -3.28 132.00 131.02 1psd h PRO 105 Ca -0.02 0.01 -0.52 0.00 0.11 0.00 0.00 66.00 65.58 1psd h PRO 105 Cb 0.86 0.02 -0.41 0.00 0.11 0.00 0.00 31.00 31.58 1psd h PRO 105 CO 0.70 -0.06 -1.01 1.19 -0.21 0.00 0.00 178.00 178.61 1psd n PHE 106 N -5.26 1.52 1.65 0.65 3.72 -1.26 -4.85 117.46 113.62 1psd n PHE 106 Ca 0.01 -3.86 0.13 0.00 -0.05 0.00 0.00 57.45 53.68 1psd n PHE 106 Cb 0.28 -0.44 0.61 0.00 -0.94 0.00 0.00 39.48 38.99 1psd n PHE 106 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1psd n SER 107 N 0.09 0.92 -2.76 4.37 3.41 -1.24 -4.43 113.62 113.98 1psd n SER 107 Ca 0.27 -1.40 -0.02 0.00 -0.26 0.00 0.00 58.87 57.46 1psd n SER 107 Cb 0.57 -0.02 0.08 0.00 -0.26 0.00 0.00 64.21 64.58 1psd n SER 107 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1psd n ASN 108 N -0.25 0.33 -0.06 4.04 2.04 -1.26 -4.75 115.26 115.36 1psd n ASN 108 Ca 0.19 -2.18 -0.11 0.00 -0.44 0.00 0.00 54.58 52.04 1psd n ASN 108 Cb 0.24 -0.00 0.03 0.00 -2.53 0.00 0.00 39.78 37.52 1psd n ASN 108 CO 0.00 0.00 0.00 0.71 -0.44 0.00 0.00 177.26 177.53 1psd h THR 109 N 4.60 1.29 -0.32 5.53 1.35 -1.94 -3.16 112.91 120.26 1psd h THR 109 Ca -0.25 -1.62 -0.02 0.00 -0.55 0.00 0.00 66.41 63.96 1psd h THR 109 Cb 1.27 1.53 -0.02 0.00 -1.73 0.00 0.00 68.15 69.20 1psd h THR 109 CO 0.07 0.53 0.09 -0.09 -0.25 0.00 0.00 175.52 175.87 1psd h ARG 110 N 0.61 0.45 0.14 4.72 9.65 -1.94 -1.80 114.38 126.21 1psd h ARG 110 Ca 0.04 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1psd h ARG 110 Cb 1.00 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 1psd h ARG 110 CO 0.10 0.41 -0.07 0.77 2.80 0.00 0.00 179.97 183.98 1psd h SER 111 N 0.45 -0.16 -0.30 -3.80 0.02 -1.79 0.74 113.55 108.72 1psd h SER 111 Ca 0.11 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1psd h SER 111 Cb 0.15 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1psd h SER 111 CO -0.01 0.01 0.07 0.58 -1.14 0.00 0.00 176.83 176.35 1psd h VAL 112 N -0.33 1.18 0.08 2.27 2.07 -1.01 -1.24 116.25 119.28 1psd h VAL 112 Ca -0.02 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1psd h VAL 112 Cb 0.27 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1psd h VAL 112 CO 0.03 0.24 -0.04 0.00 0.02 0.00 0.00 177.57 177.82 1psd h ALA 113 N 1.53 -0.11 -0.58 1.67 0.00 -0.97 -2.32 119.26 118.47 1psd h ALA 113 Ca 0.13 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1psd h ALA 113 Cb 0.25 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1psd h ALA 113 CO 0.00 -0.47 0.34 0.93 0.00 0.00 0.00 179.25 180.05 1psd h GLU 114 N -0.30 0.63 -0.14 0.00 5.08 -0.52 -2.45 114.58 116.88 1psd h GLU 114 Ca -0.01 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1psd h GLU 114 Cb 0.26 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1psd h GLU 114 CO 0.02 0.42 -0.15 1.25 -1.00 0.00 0.00 179.01 179.55 1psd h LEU 115 N 0.65 -0.45 -0.97 1.33 5.85 -1.06 -1.67 115.31 118.99 1psd h LEU 115 Ca 0.24 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.97 1psd h LEU 115 Cb 0.08 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1psd h LEU 115 CO -0.13 -0.19 -0.13 0.58 -0.34 0.00 0.00 178.44 178.23 1psd h VAL 116 N -0.17 1.25 0.46 1.05 2.07 -1.32 0.10 116.25 119.68 1psd h VAL 116 Ca 0.10 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1psd h VAL 116 Cb 0.31 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1psd h VAL 116 CO -0.24 0.37 -0.22 0.40 0.02 0.00 0.00 177.57 177.89 1psd h ILE 117 N 0.55 0.55 -0.91 4.57 1.08 -1.08 -0.55 117.51 121.71 1psd h ILE 117 Ca 0.10 -0.14 0.01 0.00 -0.39 0.00 0.00 64.86 64.43 1psd h ILE 117 Cb 0.55 0.61 -0.05 0.00 -3.07 0.00 0.00 36.82 34.87 1psd h ILE 117 CO 0.03 0.03 0.60 1.23 -0.69 0.00 0.00 178.15 179.35 1psd h GLY 118 N -0.70 1.27 0.74 5.37 0.00 -1.17 -2.45 103.07 106.13 1psd h GLY 118 Ca -0.06 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 1psd h GLY 118 CO 0.10 0.46 -0.02 0.83 0.00 0.00 0.00 176.54 177.92 1psd h GLU 119 N 1.22 0.21 -0.32 4.80 5.08 -0.60 -3.00 114.58 121.98 1psd h GLU 119 Ca 0.33 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1psd h GLU 119 Cb -0.14 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1psd h GLU 119 CO -0.07 0.50 0.20 1.37 -1.00 0.00 0.00 179.01 180.01 1psd h LEU 120 N -0.10 0.38 -0.66 1.33 8.10 -0.98 -0.77 115.31 122.62 1psd h LEU 120 Ca 0.03 -0.04 0.14 0.00 0.11 0.00 0.00 57.88 58.12 1psd h LEU 120 Cb 0.42 -0.10 -0.12 0.00 -0.44 0.00 0.00 40.66 40.43 1psd h LEU 120 CO 0.01 0.31 -0.05 -0.07 -4.11 0.00 0.00 178.44 174.52 1psd h LEU 121 N 0.42 -0.40 -0.29 0.17 3.38 -1.45 0.12 115.31 117.25 1psd h LEU 121 Ca 0.12 0.18 -0.20 0.00 0.09 0.00 0.00 57.88 58.06 1psd h LEU 121 Cb -0.01 0.33 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1psd h LEU 121 CO -0.02 -0.16 -0.86 -0.07 0.09 0.00 0.00 178.44 177.41 1psd h LEU 122 N 0.07 0.34 -0.73 1.67 3.38 -1.36 -3.10 115.31 115.57 1psd h LEU 122 Ca 0.34 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1psd h LEU 122 Cb 0.56 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1psd h LEU 122 CO -0.61 1.05 -0.13 -0.07 0.09 0.00 0.00 178.44 178.77 1psd h LEU 123 N 0.15 0.83 -1.27 1.67 3.38 0.24 -1.61 115.31 118.71 1psd h LEU 123 Ca -0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 1psd h LEU 123 Cb 1.48 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 1psd h LEU 123 CO 0.14 0.97 0.28 0.25 0.09 0.00 0.00 178.44 180.16 1psd h LEU 124 N 0.74 0.70 -0.84 1.67 5.85 -0.87 -2.88 115.31 119.69 1psd h LEU 124 Ca 0.12 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1psd h LEU 124 Cb 0.64 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1psd h LEU 124 CO 0.04 0.59 -0.02 0.54 -0.34 0.00 0.00 178.44 179.26 1psd n ARG 125 N -4.37 1.54 -1.10 1.25 5.12 -0.97 -2.76 116.66 115.37 1psd n ARG 125 Ca 0.05 -0.84 -0.03 0.00 -1.93 0.00 0.00 57.85 55.10 1psd n ARG 125 Cb 0.12 -1.48 -0.01 0.00 -1.16 0.00 0.00 32.46 29.92 1psd n ARG 125 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1psd n GLY 126 N 1.17 0.58 0.34 -0.13 0.00 -0.78 -4.75 105.19 101.62 1psd n GLY 126 Ca 0.19 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 46.00 1psd n GLY 126 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1psd h VAL 127 N 0.00 1.15 -0.68 1.61 2.07 -1.60 -2.29 116.25 116.51 1psd h VAL 127 Ca -0.07 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1psd h VAL 127 Cb 0.49 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1psd h VAL 127 CO 0.10 0.16 0.23 -0.65 0.02 0.00 0.00 177.57 177.43 1psd h PRO 128 N 0.86 1.04 -0.12 1.57 0.11 -1.86 -1.13 132.00 132.46 1psd h PRO 128 Ca 0.25 -0.21 -0.22 0.00 0.11 0.00 0.00 66.00 65.92 1psd h PRO 128 Cb -0.06 -0.16 0.01 0.00 0.11 0.00 0.00 31.00 30.91 1psd h PRO 128 CO -0.06 0.89 -0.81 1.49 -0.21 0.00 0.00 178.00 179.30 1psd h GLU 129 N 0.98 0.72 -0.30 1.05 4.81 -1.53 -2.74 114.58 117.57 1psd h GLU 129 Ca 0.22 -0.61 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1psd h GLU 129 Cb 0.27 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1psd h GLU 129 CO -0.01 1.22 0.11 0.00 -0.73 0.00 0.00 179.01 179.60 1psd h ALA 130 N 0.60 0.39 -0.30 2.92 0.00 -1.32 -1.98 119.26 119.56 1psd h ALA 130 Ca -0.06 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1psd h ALA 130 Cb 1.43 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1psd h ALA 130 CO 0.16 -0.01 0.09 -0.97 0.00 0.00 0.00 179.25 178.52 1psd h ASN 131 N 0.33 0.39 0.23 0.00 -0.00 -1.27 0.65 115.58 115.91 1psd h ASN 131 Ca 0.10 -0.04 -0.01 0.00 -0.00 0.00 0.00 56.30 56.35 1psd h ASN 131 Cb 0.20 -0.10 0.00 0.00 -0.00 0.00 0.00 38.32 38.42 1psd h ASN 131 CO -0.01 0.38 -0.11 0.00 -0.00 0.00 0.00 177.43 177.70 1psd h ALA 132 N 1.68 -0.31 -0.53 1.57 0.00 -1.15 -2.02 119.26 118.50 1psd h ALA 132 Ca 0.10 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1psd h ALA 132 Cb 0.14 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1psd h ALA 132 CO -0.01 -0.57 -0.12 0.87 0.00 0.00 0.00 179.25 179.42 1psd h LYS 133 N -0.52 1.02 -0.89 0.00 1.57 -1.07 -2.73 116.57 113.95 1psd h LYS 133 Ca -0.03 -0.39 0.04 0.00 -1.87 0.00 0.00 60.65 58.40 1psd h LYS 133 Cb 0.39 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 1psd h LYS 133 CO 0.05 1.07 0.58 0.00 -0.57 0.00 0.00 179.45 180.59 1psd h ALA 134 N 0.91 1.45 0.00 3.86 0.00 -0.49 0.34 119.26 125.33 1psd h ALA 134 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1psd h ALA 134 Cb 0.70 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1psd h ALA 134 CO 0.05 0.46 0.00 0.72 0.00 0.00 0.00 179.25 180.49 1psd n HIS 135 N -4.45 0.00 -1.44 0.00 8.25 -0.76 -1.98 115.22 114.84 1psd n HIS 135 Ca 0.12 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.61 1psd n HIS 135 Cb 0.11 -0.18 0.20 0.00 1.12 0.00 0.00 29.99 31.24 1psd n HIS 135 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1psd n ARG 136 N -1.18 1.70 -2.12 -0.41 1.74 0.93 -4.95 116.66 112.37 1psd n ARG 136 Ca 0.11 -3.14 -0.16 0.00 -0.77 0.00 0.00 57.85 53.90 1psd n ARG 136 Cb 0.12 -1.68 -0.02 0.00 -1.02 0.00 0.00 32.46 29.87 1psd n ARG 136 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1psd n GLY 137 N -1.13 0.13 3.17 -0.13 0.00 -0.84 -5.00 105.19 101.40 1psd n GLY 137 Ca 0.23 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1psd n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1psd s VAL 138 N -2.76 2.55 -0.09 1.61 1.01 0.22 -4.98 120.40 117.96 1psd s VAL 138 Ca 0.00 -0.94 -0.25 0.00 0.00 0.00 0.00 61.98 60.78 1psd s VAL 138 Cb 0.00 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1psd s VAL 138 CO 0.00 0.37 0.80 0.86 0.00 0.00 0.00 175.10 177.13 1psd s TRP 139 N 1.32 3.54 -0.43 5.22 -0.11 -1.26 -2.37 118.94 124.86 1psd s TRP 139 Ca 0.03 1.34 0.07 0.00 1.22 0.00 0.00 56.10 58.75 1psd s TRP 139 Cb -0.15 -2.94 0.23 0.00 -1.50 0.00 0.00 33.47 29.11 1psd s TRP 139 CO -0.08 -0.04 0.49 -1.71 -4.62 0.00 0.00 176.95 170.99 1psd n ASN 140 N 4.27 0.37 -0.60 5.86 5.15 -1.26 -4.98 115.26 124.06 1psd n ASN 140 Ca 0.02 -2.68 0.00 0.00 -0.60 0.00 0.00 54.58 51.32 1psd n ASN 140 Cb 0.50 -0.62 0.00 0.00 -0.53 0.00 0.00 39.78 39.13 1psd n ASN 140 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1psd n LYS 141 N 1.77 0.85 -1.78 1.20 5.02 -1.26 -4.79 118.16 119.17 1psd n LYS 141 Ca 0.24 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.33 1psd n LYS 141 Cb 0.50 -1.36 -0.09 0.00 -0.02 0.00 0.00 35.03 34.07 1psd n LYS 141 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1psd s LEU 142 N 0.00 2.69 -0.00 -0.35 1.02 -1.26 -4.74 118.68 116.05 1psd s LEU 142 Ca 0.00 -1.04 0.00 0.00 0.02 0.00 0.00 54.13 53.11 1psd s LEU 142 Cb 0.00 -2.59 0.00 0.00 0.02 0.00 0.00 46.19 43.63 1psd s LEU 142 CO 0.00 -3.99 0.99 0.00 0.02 0.00 0.00 176.35 173.37 1psd n ALA 143 N 17.51 2.50 -0.12 4.21 0.00 -1.26 -4.20 120.51 139.15 1psd n ALA 143 Ca 0.43 -0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.76 1psd n ALA 143 Cb 0.46 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 1psd n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1psd h ALA 144 N 2.99 0.46 -0.07 0.00 0.00 -2.01 -3.11 119.26 117.52 1psd h ALA 144 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1psd h ALA 144 Cb 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1psd h ALA 144 CO 0.00 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1psd n GLY 145 N -0.39 -0.13 3.72 0.00 0.00 -1.26 -4.88 105.19 102.25 1psd n GLY 145 Ca -0.02 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1psd n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1psd s SER 146 N -1.78 7.17 0.22 1.61 0.01 -1.18 -4.78 113.70 114.97 1psd s SER 146 Ca 0.36 2.03 0.04 0.00 1.31 0.00 0.00 55.95 59.69 1psd s SER 146 Cb 0.19 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.78 1psd s SER 146 CO 0.30 -0.36 -0.02 -0.36 0.41 0.00 0.00 173.24 173.20 1psd s PHE 147 N 0.51 1.56 -0.01 2.43 0.08 -1.11 -4.99 117.98 116.45 1psd s PHE 147 Ca 0.54 -0.88 -0.02 0.00 0.12 0.00 0.00 56.93 56.70 1psd s PHE 147 Cb -0.29 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.23 1psd s PHE 147 CO 0.32 0.01 0.15 -1.21 -0.10 0.00 0.00 175.22 174.39 1psd s GLU 148 N -3.83 3.32 0.17 0.44 2.02 -1.26 -4.32 118.70 115.23 1psd s GLU 148 Ca 0.27 -0.38 -0.10 0.00 0.02 0.00 0.00 54.97 54.78 1psd s GLU 148 Cb 0.05 -3.02 0.05 0.00 0.10 0.00 0.00 34.13 31.31 1psd s GLU 148 CO 0.08 0.66 1.62 0.00 0.02 0.00 0.00 175.26 177.64 1psd h ALA 149 N 3.88 0.77 -1.73 5.21 0.00 -1.92 -3.42 119.26 122.05 1psd h ALA 149 Ca -0.49 -0.31 -0.68 0.00 0.00 0.00 0.00 54.91 53.43 1psd h ALA 149 Cb 1.18 -0.21 0.05 0.00 0.00 0.00 0.00 17.79 18.82 1psd h ALA 149 CO 0.67 0.62 0.55 -2.13 0.00 0.00 0.00 179.25 178.96 1psd n ARG 150 N -4.21 1.26 -0.60 0.00 0.63 -1.25 -1.20 116.66 111.29 1psd n ARG 150 Ca 0.02 0.46 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 1psd n ARG 150 Cb 0.35 -2.12 0.00 0.00 0.45 0.00 0.00 32.46 31.14 1psd n ARG 150 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1psd n GLY 151 N 2.83 1.29 3.93 5.14 0.00 0.45 -4.91 105.19 113.93 1psd n GLY 151 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 1psd n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1psd s LYS 152 N -0.19 2.56 -0.22 1.61 -0.14 -0.34 -4.74 119.74 118.28 1psd s LYS 152 Ca 0.00 -0.28 -0.06 0.00 -1.36 0.00 0.00 55.97 54.27 1psd s LYS 152 Cb 0.00 -2.28 -0.03 0.00 -1.68 0.00 0.00 37.83 33.84 1psd s LYS 152 CO 0.00 -0.90 0.04 0.15 -0.76 0.00 0.00 175.35 173.87 1psd s LYS 153 N -5.03 3.67 -0.33 1.68 1.02 -1.26 0.46 119.74 119.94 1psd s LYS 153 Ca 0.57 -0.48 -0.11 0.00 0.02 0.00 0.00 55.97 55.96 1psd s LYS 153 Cb -0.11 -3.20 -0.00 0.00 -0.52 0.00 0.00 37.83 34.00 1psd s LYS 153 CO 0.43 -0.06 0.19 -1.17 -0.92 0.00 0.00 175.35 173.83 1psd s LEU 154 N 1.23 4.38 -0.39 3.17 0.20 0.92 -1.04 118.68 127.16 1psd s LEU 154 Ca 0.04 -0.59 -0.17 0.00 0.69 0.00 0.00 54.13 54.10 1psd s LEU 154 Cb -0.15 -2.05 0.01 0.00 -0.43 0.00 0.00 46.19 43.57 1psd s LEU 154 CO 0.02 -0.25 0.46 -0.83 -0.29 0.00 0.00 176.35 175.46 1psd s GLY 155 N 1.64 1.86 -0.36 7.98 0.00 0.11 -1.50 107.32 117.05 1psd s GLY 155 Ca 0.05 -1.29 -0.13 0.00 0.00 0.00 0.00 44.72 43.35 1psd s GLY 155 CO 0.08 1.18 0.24 -0.42 0.00 0.00 0.00 173.10 174.18 1psd s ILE 156 N 2.24 5.07 -0.56 0.90 1.01 -0.00 -0.96 121.20 128.89 1psd s ILE 156 Ca 0.15 -0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.13 1psd s ILE 156 Cb -0.16 -3.70 0.08 0.00 0.01 0.00 0.00 42.46 38.69 1psd s ILE 156 CO 0.14 -0.12 0.71 -0.63 0.00 0.00 0.00 174.94 175.03 1psd s ILE 157 N 1.67 4.78 0.00 2.92 1.01 -0.58 -1.48 121.20 129.52 1psd s ILE 157 Ca 0.05 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1psd s ILE 157 Cb -0.18 -4.44 0.00 0.00 0.01 0.00 0.00 42.46 37.85 1psd s ILE 157 CO 0.09 -1.04 0.00 0.61 0.00 0.00 0.00 174.94 174.60 1psd n GLY 158 N 5.24 0.81 2.42 6.18 0.00 -0.81 -1.51 105.19 117.52 1psd n GLY 158 Ca -0.08 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 1psd n GLY 158 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1psd n TYR 159 N 0.00 2.61 -0.51 1.61 9.36 -1.26 -4.01 117.16 124.96 1psd n TYR 159 Ca 0.00 -3.01 0.00 0.00 3.32 0.00 0.00 57.90 58.21 1psd n TYR 159 Cb 0.00 -2.32 0.00 0.00 -0.63 0.00 0.00 39.34 36.39 1psd n TYR 159 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1psd n GLY 160 N 3.16 1.81 0.36 2.98 0.00 -1.26 -4.59 105.19 107.65 1psd n GLY 160 Ca 0.70 -1.80 0.03 0.00 0.00 0.00 0.00 46.02 44.96 1psd n GLY 160 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1psd h HIS 161 N 0.00 1.03 0.12 1.61 3.86 -1.91 -2.00 115.15 117.86 1psd h HIS 161 Ca 0.00 0.03 -0.31 0.00 -1.16 0.00 0.00 60.37 58.93 1psd h HIS 161 Cb 0.00 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 1psd h HIS 161 CO 0.00 0.57 -1.59 0.82 0.86 0.00 0.00 177.93 178.59 1psd h ILE 162 N 1.04 0.91 -0.39 2.45 2.04 -1.90 -3.31 117.51 118.35 1psd h ILE 162 Ca 0.36 -2.39 0.08 0.00 1.00 0.00 0.00 64.86 63.91 1psd h ILE 162 Cb 0.11 2.64 -0.07 0.00 -0.74 0.00 0.00 36.82 38.76 1psd h ILE 162 CO -0.12 0.74 -0.08 1.23 0.00 0.00 0.00 178.15 179.93 1psd h GLY 163 N 0.32 0.31 2.00 5.37 0.00 -1.67 0.26 103.07 109.66 1psd h GLY 163 Ca -0.34 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 1psd h GLY 163 CO 0.06 -0.14 -0.07 -0.91 0.00 0.00 0.00 176.54 175.48 1psd h THR 164 N 0.02 0.68 0.04 4.70 1.35 -1.54 0.11 112.91 118.27 1psd h THR 164 Ca 0.19 -0.30 -0.09 0.00 -0.55 0.00 0.00 66.41 65.66 1psd h THR 164 Cb 0.29 1.18 -0.00 0.00 -1.73 0.00 0.00 68.15 67.89 1psd h THR 164 CO -0.39 0.07 -0.45 -0.61 -0.25 0.00 0.00 175.52 173.90 1psd h GLN 165 N 0.00 0.08 -1.00 4.72 5.75 -1.13 -3.13 115.11 120.39 1psd h GLN 165 Ca -0.00 -0.13 0.08 0.00 -0.15 0.00 0.00 58.65 58.45 1psd h GLN 165 Cb 0.17 0.05 -0.07 0.00 1.07 0.00 0.00 27.48 28.70 1psd h GLN 165 CO 0.01 1.06 0.64 1.25 -2.65 0.00 0.00 178.83 179.15 1psd h LEU 166 N -0.83 1.01 -0.29 -2.39 5.85 -0.28 -2.29 115.31 116.09 1psd h LEU 166 Ca -0.10 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1psd h LEU 166 Cb 1.23 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1psd h LEU 166 CO 0.00 0.62 0.16 1.23 -0.34 0.00 0.00 178.44 180.12 1psd h GLY 167 N 1.13 0.43 0.68 3.75 0.00 -1.09 -0.74 103.07 107.23 1psd h GLY 167 Ca 0.45 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.61 1psd h GLY 167 CO -0.19 0.18 -0.09 -2.22 0.00 0.00 0.00 176.54 174.22 1psd h ILE 168 N 0.36 0.75 -0.17 2.60 2.04 -1.36 -0.21 117.51 121.51 1psd h ILE 168 Ca 0.10 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.96 1psd h ILE 168 Cb 0.05 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1psd h ILE 168 CO -0.02 0.00 0.10 -0.07 0.00 0.00 0.00 178.15 178.17 1psd h LEU 169 N -0.12 0.21 -1.00 1.44 3.38 -1.39 -2.15 115.31 115.68 1psd h LEU 169 Ca 0.06 -0.05 0.19 0.00 0.09 0.00 0.00 57.88 58.17 1psd h LEU 169 Cb 0.21 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 40.80 1psd h LEU 169 CO -0.14 0.20 0.60 0.00 0.09 0.00 0.00 178.44 179.18 1psd h ALA 170 N 1.02 1.66 -0.57 1.53 0.00 -0.73 0.95 119.26 123.11 1psd h ALA 170 Ca 0.06 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1psd h ALA 170 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1psd h ALA 170 CO -0.01 -0.06 0.11 0.93 0.00 0.00 0.00 179.25 180.22 1psd h GLU 171 N 0.75 0.90 0.00 0.00 5.08 -0.40 -2.40 114.58 118.51 1psd h GLU 171 Ca 0.58 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.70 1psd h GLU 171 Cb 0.90 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 1psd h GLU 171 CO -0.39 0.83 -0.15 0.77 -1.00 0.00 0.00 179.01 179.07 1psd h SER 172 N 0.86 0.00 0.46 1.42 0.02 -0.41 -1.25 113.55 114.65 1psd h SER 172 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1psd h SER 172 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1psd h SER 172 CO 0.00 0.15 -0.05 0.18 -1.14 0.00 0.00 176.83 175.97 1psd n LEU 173 N -4.30 0.20 0.00 5.07 4.77 -0.98 -4.90 117.00 116.86 1psd n LEU 173 Ca -0.02 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1psd n LEU 173 Cb 0.22 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1psd n LEU 173 CO 0.35 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1psd n GLY 174 N 1.27 0.89 3.90 -0.72 0.00 -0.47 -3.83 105.19 106.23 1psd n GLY 174 Ca 0.15 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1psd n GLY 174 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1psd s MET 175 N -0.73 2.55 -0.17 1.61 -1.94 -0.94 -0.41 119.30 119.26 1psd s MET 175 Ca 0.00 0.12 -0.04 0.00 -1.71 0.00 0.00 55.69 54.06 1psd s MET 175 Cb 0.00 -2.10 -0.03 0.00 2.01 0.00 0.00 34.83 34.71 1psd s MET 175 CO 0.00 -1.11 -0.02 0.71 -0.01 0.00 0.00 175.02 174.59 1psd s TYR 176 N -3.29 3.05 -0.12 -0.03 2.02 0.17 -4.49 117.35 114.66 1psd s TYR 176 Ca 0.58 -0.30 -0.02 0.00 -0.37 0.00 0.00 57.07 56.96 1psd s TYR 176 Cb -0.11 -2.00 -0.03 0.00 -0.40 0.00 0.00 41.96 39.42 1psd s TYR 176 CO 0.48 -0.07 -0.02 0.14 -1.57 0.00 0.00 175.55 174.51 1psd s VAL 177 N 0.52 4.06 -0.01 0.71 -7.23 -1.26 -0.05 120.40 117.13 1psd s VAL 177 Ca -0.02 -0.32 0.02 0.00 -1.81 0.00 0.00 61.98 59.85 1psd s VAL 177 Cb -0.14 -2.74 -0.00 0.00 0.56 0.00 0.00 36.38 34.06 1psd s VAL 177 CO 0.02 0.55 -0.08 -0.31 -0.31 0.00 0.00 175.10 174.97 1psd s TYR 178 N -0.27 0.81 0.09 2.82 2.02 -0.56 -2.58 117.35 119.68 1psd s TYR 178 Ca 0.05 -0.17 0.05 0.00 -0.37 0.00 0.00 57.07 56.63 1psd s TYR 178 Cb -0.12 -0.55 -0.03 0.00 -0.40 0.00 0.00 41.96 40.85 1psd s TYR 178 CO 0.02 -0.05 -0.12 -0.59 -1.57 0.00 0.00 175.55 173.24 1psd s PHE 179 N -0.03 1.18 -0.19 2.71 -0.71 0.13 -0.82 117.98 120.26 1psd s PHE 179 Ca 0.01 -0.54 0.00 0.00 -1.04 0.00 0.00 56.93 55.36 1psd s PHE 179 Cb -0.05 -0.65 0.04 0.00 -1.21 0.00 0.00 43.02 41.15 1psd s PHE 179 CO -0.00 0.05 -0.07 -0.47 -1.34 0.00 0.00 175.22 173.39 1psd s TYR 180 N -1.83 2.05 0.26 3.49 5.04 -0.55 0.11 117.35 125.93 1psd s TYR 180 Ca 0.02 -1.35 0.08 0.00 -2.44 0.00 0.00 57.07 53.38 1psd s TYR 180 Cb -0.07 -1.47 -0.05 0.00 0.35 0.00 0.00 41.96 40.72 1psd s TYR 180 CO 0.02 -0.68 -0.10 0.34 -1.34 0.00 0.00 175.55 173.78 1psd s ASP 181 N 1.52 2.86 0.05 4.32 -1.08 -1.26 -1.92 116.67 121.16 1psd s ASP 181 Ca -0.01 -1.13 0.04 0.00 -0.52 0.00 0.00 52.55 50.93 1psd s ASP 181 Cb -0.16 -0.18 -0.24 0.00 -1.46 0.00 0.00 42.92 40.87 1psd s ASP 181 CO -0.08 -0.24 1.03 0.40 0.52 0.00 0.00 175.17 176.80 1psd h ILE 182 N 2.34 1.37 -3.63 4.11 1.08 -2.00 -3.43 117.51 117.36 1psd h ILE 182 Ca -0.40 -3.07 -0.69 0.00 -0.39 0.00 0.00 64.86 60.32 1psd h ILE 182 Cb 1.23 2.76 -0.24 0.00 -3.07 0.00 0.00 36.82 37.50 1psd h ILE 182 CO 0.65 0.83 -0.55 -0.70 -0.69 0.00 0.00 178.15 177.69 1psd s GLU 183 N -2.66 3.10 -0.12 2.37 2.12 -1.26 -5.04 118.70 117.22 1psd s GLU 183 Ca -0.04 -0.88 -0.35 0.00 0.36 0.00 0.00 54.97 54.07 1psd s GLU 183 Cb 0.08 -3.59 -0.12 0.00 0.26 0.00 0.00 34.13 30.77 1psd s GLU 183 CO 0.84 -0.53 1.88 -1.71 -0.54 0.00 0.00 175.26 175.21 1psd n ASN 184 N 4.96 3.33 -4.40 -1.70 2.85 -1.26 -4.95 115.26 114.09 1psd n ASN 184 Ca -0.13 0.96 -0.20 0.00 -0.11 0.00 0.00 54.58 55.10 1psd n ASN 184 Cb 0.48 -1.35 -0.10 0.00 1.24 0.00 0.00 39.78 40.05 1psd n ASN 184 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 1psd s LYS 185 N 4.14 1.51 -0.34 1.20 0.00 -1.26 -5.11 119.74 119.87 1psd s LYS 185 Ca 0.94 -1.78 -0.29 0.00 0.00 0.00 0.00 55.97 54.84 1psd s LYS 185 Cb -0.73 -0.94 0.00 0.00 0.00 0.00 0.00 37.83 36.16 1psd s LYS 185 CO 0.53 -0.05 1.37 -1.17 0.00 0.00 0.00 175.35 176.03 1psd s LEU 186 N -3.41 3.76 0.01 2.77 1.98 -1.26 -4.99 118.68 117.54 1psd s LEU 186 Ca 0.30 1.07 -0.30 0.00 -2.89 0.00 0.00 54.13 52.31 1psd s LEU 186 Cb 0.05 -3.54 -0.06 0.00 0.66 0.00 0.00 46.19 43.31 1psd s LEU 186 CO 0.12 -1.24 1.40 -2.16 -1.89 0.00 0.00 176.35 172.58 1psd s PRO 187 N 4.53 4.29 0.11 0.98 0.04 -1.26 -5.01 135.00 138.67 1psd s PRO 187 Ca 0.59 1.98 -0.14 0.00 0.04 0.00 0.00 61.00 63.48 1psd s PRO 187 Cb -0.16 -3.54 -0.06 0.00 0.04 0.00 0.00 34.50 30.78 1psd s PRO 187 CO 0.28 -0.56 0.50 -1.17 0.04 0.00 0.00 177.00 176.09 1psd s LEU 188 N 2.25 4.37 0.00 -3.56 2.96 -1.26 -4.82 118.68 118.62 1psd s LEU 188 Ca 0.64 1.01 0.00 0.00 -0.22 0.00 0.00 54.13 55.56 1psd s LEU 188 Cb -0.32 -3.09 0.00 0.00 0.50 0.00 0.00 46.19 43.27 1psd s LEU 188 CO 0.27 0.16 0.00 0.61 -1.32 0.00 0.00 176.35 176.07 1psd n GLY 189 N 1.01 -0.15 1.29 7.98 0.00 -1.26 -3.36 105.19 110.70 1psd n GLY 189 Ca -0.07 -1.04 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 1psd n GLY 189 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1psd n ASN 190 N -1.58 3.10 -4.77 1.61 3.02 -1.26 -4.94 115.26 110.45 1psd n ASN 190 Ca 0.00 -2.43 -0.38 0.00 -0.03 0.00 0.00 54.58 51.74 1psd n ASN 190 Cb 0.00 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 1psd n ASN 190 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1psd s ALA 191 N -1.01 3.01 -0.12 5.41 0.00 -1.21 -4.72 121.76 123.11 1psd s ALA 191 Ca 0.16 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.22 1psd s ALA 191 Cb 0.13 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.82 1psd s ALA 191 CO 0.03 -0.83 -0.18 0.99 0.00 0.00 0.00 175.76 175.77 1psd s THR 192 N -1.43 1.73 0.03 0.00 2.01 -1.06 -4.84 115.64 112.09 1psd s THR 192 Ca 0.63 -0.78 -0.29 0.00 0.31 0.00 0.00 61.69 61.56 1psd s THR 192 Cb -0.33 -1.56 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 1psd s THR 192 CO 0.40 0.49 0.93 -1.58 -0.69 0.00 0.00 174.62 174.17 1psd s GLN 193 N 0.92 4.59 0.01 4.92 0.74 -1.26 -0.69 119.66 128.89 1psd s GLN 193 Ca -0.07 1.35 -0.07 0.00 0.05 0.00 0.00 55.36 56.62 1psd s GLN 193 Cb -0.15 -3.42 -0.05 0.00 1.10 0.00 0.00 33.01 30.49 1psd s GLN 193 CO -0.02 0.08 0.29 0.08 -0.55 0.00 0.00 175.29 175.17 1psd s VAL 194 N 0.57 5.27 0.03 1.34 1.01 0.12 -4.89 120.40 123.84 1psd s VAL 194 Ca 0.48 0.24 -0.21 0.00 0.00 0.00 0.00 61.98 62.48 1psd s VAL 194 Cb -0.21 -3.58 -0.15 0.00 0.00 0.00 0.00 36.38 32.43 1psd s VAL 194 CO 0.27 0.37 1.33 1.56 0.00 0.00 0.00 175.10 178.63 1psd h GLN 195 N 4.00 0.30 -6.10 2.72 4.20 -1.96 -3.43 115.11 114.84 1psd h GLN 195 Ca -0.50 -0.16 -0.59 0.00 0.06 0.00 0.00 58.65 57.46 1psd h GLN 195 Cb 1.20 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 28.85 1psd h GLN 195 CO 0.66 0.71 -0.75 -1.01 -0.67 0.00 0.00 178.83 177.77 1psd s HIS 196 N -4.27 2.24 0.10 2.96 3.76 -1.26 -5.03 115.29 113.79 1psd s HIS 196 Ca -0.14 -0.38 -0.14 0.00 -0.15 0.00 0.00 55.06 54.24 1psd s HIS 196 Cb 0.05 -1.02 -0.09 0.00 1.11 0.00 0.00 32.58 32.62 1psd s HIS 196 CO 0.74 0.66 1.40 -0.07 -0.85 0.00 0.00 174.74 176.62 1psd h LEU 197 N 2.27 0.82 -0.91 0.89 3.38 -2.00 -3.00 115.31 116.77 1psd h LEU 197 Ca -0.40 -0.50 0.14 0.00 0.09 0.00 0.00 57.88 57.21 1psd h LEU 197 Cb 1.25 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.68 1psd h LEU 197 CO 0.62 1.16 0.52 0.77 0.09 0.00 0.00 178.44 181.60 1psd h SER 198 N 0.50 0.69 0.54 -0.43 4.64 -1.96 0.40 113.55 117.94 1psd h SER 198 Ca 0.03 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 1psd h SER 198 Cb 0.97 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1psd h SER 198 CO 0.09 0.32 -0.26 0.44 -0.87 0.00 0.00 176.83 176.55 1psd h ASP 199 N 0.76 -0.62 -0.13 4.97 3.32 -1.93 -1.14 116.42 121.66 1psd h ASP 199 Ca 0.48 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.52 1psd h ASP 199 Cb 0.61 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.29 1psd h ASP 199 CO -0.32 -0.33 -0.04 0.25 -1.72 0.00 0.00 179.24 177.08 1psd h LEU 200 N -0.90 -0.14 -0.51 1.55 6.46 -1.25 -0.88 115.31 119.65 1psd h LEU 200 Ca -0.07 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 57.77 1psd h LEU 200 Cb 0.62 0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.60 1psd h LEU 200 CO 0.12 -0.05 0.27 -0.07 -0.62 0.00 0.00 178.44 178.09 1psd h LEU 201 N -0.01 0.40 -0.64 2.25 4.07 -0.25 0.21 115.31 121.33 1psd h LEU 201 Ca 0.06 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1psd h LEU 201 Cb 0.11 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1psd h LEU 201 CO -0.14 0.28 0.00 -1.13 -1.08 0.00 0.00 178.44 176.37 1psd h ASN 202 N 0.53 0.00 0.00 -0.43 -1.24 -0.16 -2.12 115.58 112.16 1psd h ASN 202 Ca 0.22 0.00 -0.30 0.00 0.71 0.00 0.00 56.30 56.93 1psd h ASN 202 Cb 0.11 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.10 1psd h ASN 202 CO -0.14 0.00 -2.16 0.80 -1.29 0.00 0.00 177.43 174.64 1psd n MET 203 N -2.41 1.19 -2.79 6.67 1.56 -0.36 -4.33 117.12 116.65 1psd n MET 203 Ca 0.03 -0.01 -0.34 0.00 -0.27 0.00 0.00 57.70 57.10 1psd n MET 203 Cb 0.29 -1.44 -0.07 0.00 2.15 0.00 0.00 33.22 34.16 1psd n MET 203 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 1psd s SER 204 N -5.07 7.01 -0.15 6.12 0.01 0.62 -4.89 113.70 117.35 1psd s SER 204 Ca -0.08 1.75 -0.13 0.00 1.31 0.00 0.00 55.95 58.79 1psd s SER 204 Cb 0.05 -2.55 -0.24 0.00 0.21 0.00 0.00 66.02 63.49 1psd s SER 204 CO 0.70 -0.30 0.33 0.44 0.41 0.00 0.00 173.24 174.81 1psd h ASP 205 N 2.26 0.25 -3.35 2.44 3.32 -1.43 -3.39 116.42 116.52 1psd h ASP 205 Ca -0.48 -0.77 -0.61 0.00 0.02 0.00 0.00 57.03 55.19 1psd h ASP 205 Cb 1.19 -0.08 -0.33 0.00 0.22 0.00 0.00 39.33 40.32 1psd h ASP 205 CO 0.62 1.70 -0.85 -0.69 -1.72 0.00 0.00 179.24 178.30 1psd s VAL 206 N -2.48 1.65 -0.15 -1.35 1.01 -0.82 -1.74 120.40 116.52 1psd s VAL 206 Ca -0.25 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 1psd s VAL 206 Cb 0.06 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1psd s VAL 206 CO 0.70 0.47 -0.13 -0.69 0.00 0.00 0.00 175.10 175.45 1psd s VAL 207 N 0.56 2.93 -0.06 2.92 1.01 -0.49 0.09 120.40 127.37 1psd s VAL 207 Ca -0.15 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.18 1psd s VAL 207 Cb -0.17 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1psd s VAL 207 CO 0.05 0.51 -0.17 -0.55 0.00 0.00 0.00 175.10 174.94 1psd s SER 208 N 0.70 2.23 -0.13 3.32 0.15 -0.13 -0.80 113.70 119.04 1psd s SER 208 Ca -0.06 -0.38 -0.10 0.00 0.70 0.00 0.00 55.95 56.11 1psd s SER 208 Cb -0.15 -0.83 -0.05 0.00 -1.71 0.00 0.00 66.02 63.28 1psd s SER 208 CO 0.02 0.12 0.20 -0.76 1.20 0.00 0.00 173.24 174.01 1psd s LEU 209 N 0.29 4.34 -0.35 3.45 1.43 -0.85 -1.53 118.68 125.46 1psd s LEU 209 Ca -0.10 0.49 0.14 0.00 -1.03 0.00 0.00 54.13 53.63 1psd s LEU 209 Cb -0.14 -2.19 0.43 0.00 0.03 0.00 0.00 46.19 44.32 1psd s LEU 209 CO 0.04 0.30 1.15 1.41 0.23 0.00 0.00 176.35 179.48 1psd n HIS 210 N 2.55 -0.46 -4.12 0.29 8.25 -0.57 -4.17 115.22 116.98 1psd n HIS 210 Ca -0.17 -2.37 -0.26 0.00 -0.26 0.00 0.00 57.72 54.66 1psd n HIS 210 Cb 0.53 0.52 -0.06 0.00 1.12 0.00 0.00 29.99 32.10 1psd n HIS 210 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1psd s VAL 211 N -1.66 4.27 0.70 1.59 -7.23 -1.25 -4.51 120.40 112.31 1psd s VAL 211 Ca 0.24 -1.22 -0.11 0.00 -1.81 0.00 0.00 61.98 59.08 1psd s VAL 211 Cb 0.43 -3.19 0.02 0.00 0.56 0.00 0.00 36.38 34.20 1psd s VAL 211 CO -0.02 -0.14 1.07 -2.84 -0.31 0.00 0.00 175.10 172.86 1psd s PRO 212 N -3.14 2.79 -0.04 4.82 0.02 -1.26 -4.61 135.00 133.58 1psd s PRO 212 Ca 0.30 1.05 -0.23 0.00 0.02 0.00 0.00 61.00 62.14 1psd s PRO 212 Cb -0.10 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 1psd s PRO 212 CO 0.22 -1.22 0.69 -2.00 -0.33 0.00 0.00 177.00 174.36 1psd s GLU 213 N -4.88 4.42 0.00 5.54 2.12 -1.26 -4.66 118.70 119.98 1psd s GLU 213 Ca 0.60 0.87 0.00 0.00 0.36 0.00 0.00 54.97 56.80 1psd s GLU 213 Cb -0.15 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.82 1psd s GLU 213 CO 0.53 0.16 0.00 0.27 -0.54 0.00 0.00 175.26 175.68 1psd n ASN 214 N 3.41 0.00 0.14 -1.70 0.23 -1.26 -5.00 115.26 111.08 1psd n ASN 214 Ca -0.03 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.06 1psd n ASN 214 Cb 0.51 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.42 1psd n ASN 214 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1psd n PRO 215 N -0.10 0.06 0.07 -0.53 -0.04 -1.26 -0.66 135.00 132.52 1psd n PRO 215 Ca 0.00 0.48 -0.12 0.00 -0.04 0.00 0.00 63.50 63.82 1psd n PRO 215 Cb 0.00 -2.09 -0.13 0.00 -0.04 0.00 0.00 33.50 31.24 1psd n PRO 215 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1psd h SER 216 N 0.00 0.22 0.01 3.54 0.87 -1.94 -3.33 113.55 112.91 1psd h SER 216 Ca 0.00 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1psd h SER 216 Cb 0.83 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 1psd h SER 216 CO 0.00 1.21 -0.51 0.35 -0.53 0.00 0.00 176.83 177.35 1psd n THR 217 N -3.40 0.00 -1.65 2.23 -2.24 0.16 -4.82 114.28 104.56 1psd n THR 217 Ca -0.08 -0.22 -0.44 0.00 -2.27 0.00 0.00 64.05 61.03 1psd n THR 217 Cb 1.00 1.15 -0.04 0.00 -2.10 0.00 0.00 70.33 70.34 1psd n THR 217 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1psd n LYS 218 N -0.23 2.51 -3.02 -0.78 3.00 -0.93 -1.92 118.16 116.79 1psd n LYS 218 Ca 0.09 0.90 -0.22 0.00 -0.00 0.00 0.00 58.31 59.08 1psd n LYS 218 Cb 0.44 -2.91 0.02 0.00 0.00 0.00 0.00 35.03 32.59 1psd n LYS 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1psd n ASN 219 N 7.79 -5.40 -0.03 3.14 5.03 0.13 -4.90 115.26 121.03 1psd n ASN 219 Ca 0.23 -0.26 -0.09 0.00 0.87 0.00 0.00 54.58 55.32 1psd n ASN 219 Cb 0.37 -4.40 -0.03 0.00 -1.02 0.00 0.00 39.78 34.70 1psd n ASN 219 CO 0.00 0.00 0.00 -0.03 -1.83 0.00 0.00 177.26 175.40 1psd h MET 220 N -1.10 -0.28 -5.81 3.52 4.05 -0.32 -3.20 114.93 111.78 1psd h MET 220 Ca -0.49 0.02 -0.67 0.00 -0.28 0.00 0.00 59.70 58.28 1psd h MET 220 Cb 1.34 0.06 -0.09 0.00 -0.80 0.00 0.00 31.60 32.11 1psd h MET 220 CO 0.55 -0.19 1.96 -1.64 0.23 0.00 0.00 176.91 177.82 1psd s MET 221 N -6.06 3.90 0.56 0.39 -1.94 -0.80 -4.83 119.30 110.53 1psd s MET 221 Ca -0.15 -1.84 -0.07 0.00 -1.71 0.00 0.00 55.69 51.92 1psd s MET 221 Cb 0.11 -5.45 0.12 0.00 2.01 0.00 0.00 34.83 31.63 1psd s MET 221 CO 0.67 -2.20 0.76 0.41 -0.01 0.00 0.00 175.02 174.65 1psd n GLY 222 N 5.64 -0.61 0.26 -0.03 0.00 -1.21 -2.26 105.19 106.97 1psd n GLY 222 Ca 0.44 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.74 1psd n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1psd h ALA 223 N -1.39 1.74 -0.05 4.61 0.00 -1.92 -2.10 119.26 120.16 1psd h ALA 223 Ca -0.25 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1psd h ALA 223 Cb 0.75 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1psd h ALA 223 CO 0.20 0.08 -0.18 -0.22 0.00 0.00 0.00 179.25 179.13 1psd h LYS 224 N 0.00 0.22 -0.52 0.00 3.64 -1.96 -2.83 116.57 115.12 1psd h LYS 224 Ca -0.00 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.23 1psd h LYS 224 Cb 0.13 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 1psd h LYS 224 CO 0.01 0.79 0.32 0.93 -2.27 0.00 0.00 179.45 179.24 1psd h GLU 225 N -0.31 0.63 -0.98 1.90 3.07 -1.79 -0.86 114.58 116.25 1psd h GLU 225 Ca -0.01 -0.04 0.17 0.00 -0.50 0.00 0.00 59.36 58.99 1psd h GLU 225 Cb 0.81 -0.14 -0.09 0.00 -0.84 0.00 0.00 28.75 28.49 1psd h GLU 225 CO 0.04 0.42 0.61 0.82 -1.40 0.00 0.00 179.01 179.50 1psd h ILE 226 N 0.65 0.76 0.09 3.13 1.08 -1.42 -0.87 117.51 120.93 1psd h ILE 226 Ca 0.20 -0.25 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1psd h ILE 226 Cb -0.02 -0.05 0.00 0.00 -3.07 0.00 0.00 36.82 33.68 1psd h ILE 226 CO -0.07 0.13 -0.04 0.28 -0.69 0.00 0.00 178.15 177.76 1psd h SER 227 N 0.74 -0.10 0.00 1.72 0.02 -0.93 -2.87 113.55 112.13 1psd h SER 227 Ca 0.53 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1psd h SER 227 Cb 0.85 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.42 1psd h SER 227 CO -0.30 0.19 0.26 0.18 -1.14 0.00 0.00 176.83 176.02 1psd n LEU 228 N -5.01 0.33 -4.77 5.07 4.32 -0.35 -4.59 117.00 112.00 1psd n LEU 228 Ca -0.08 0.56 -0.39 0.00 -0.02 0.00 0.00 56.01 56.08 1psd n LEU 228 Cb 0.18 -0.52 -0.03 0.00 -1.62 0.00 0.00 43.42 41.44 1psd n LEU 228 CO 0.33 -0.67 0.83 -0.04 -1.22 0.00 0.00 177.39 176.62 1psd s MET 229 N -3.28 4.22 0.27 3.23 -1.94 -1.08 -1.56 119.30 119.15 1psd s MET 229 Ca -0.01 1.82 -0.31 0.00 -1.71 0.00 0.00 55.69 55.48 1psd s MET 229 Cb 0.04 -2.80 -0.12 0.00 2.01 0.00 0.00 34.83 33.96 1psd s MET 229 CO 0.12 -0.17 1.52 1.17 -0.01 0.00 0.00 175.02 177.64 1psd n LYS 230 N 0.34 2.42 -2.09 2.03 4.81 -0.80 -4.85 118.16 120.02 1psd n LYS 230 Ca 0.03 0.86 -0.39 0.00 -0.87 0.00 0.00 58.31 57.94 1psd n LYS 230 Cb 0.46 -2.59 -0.00 0.00 0.02 0.00 0.00 35.03 32.91 1psd n LYS 230 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1psd s PRO 231 N -0.43 3.89 0.00 1.64 0.04 -1.26 -2.53 135.00 136.35 1psd s PRO 231 Ca 0.66 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.77 1psd s PRO 231 Cb -0.56 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.31 1psd s PRO 231 CO 0.49 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.41 1psd n GLY 232 N 0.65 1.07 2.16 0.56 0.00 0.46 -5.00 105.19 105.09 1psd n GLY 232 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1psd n GLY 232 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1psd n SER 233 N 0.00 -1.23 -4.17 1.61 3.41 -1.05 -3.86 113.62 108.33 1psd n SER 233 Ca 0.00 -1.00 -0.19 0.00 -0.26 0.00 0.00 58.87 57.42 1psd n SER 233 Cb 0.00 -0.61 -0.12 0.00 -0.26 0.00 0.00 64.21 63.22 1psd n SER 233 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1psd s LEU 234 N 0.00 2.24 -0.07 1.04 1.43 -0.71 -0.99 118.68 121.61 1psd s LEU 234 Ca 0.43 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 1psd s LEU 234 Cb -0.03 -0.57 0.00 0.00 0.03 0.00 0.00 46.19 45.61 1psd s LEU 234 CO 0.33 -0.03 -0.20 -0.22 0.23 0.00 0.00 176.35 176.45 1psd s LEU 235 N -1.52 1.96 -0.09 1.79 2.96 -1.11 -1.40 118.68 121.27 1psd s LEU 235 Ca -0.00 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.45 1psd s LEU 235 Cb -0.09 -1.20 0.02 0.00 0.50 0.00 0.00 46.19 45.42 1psd s LEU 235 CO 0.02 0.15 -0.05 -0.51 -1.32 0.00 0.00 176.35 174.64 1psd s ILE 236 N 0.27 0.76 -0.28 6.68 1.10 0.02 -1.02 121.20 128.74 1psd s ILE 236 Ca -0.13 -0.15 0.01 0.00 -0.51 0.00 0.00 60.65 59.88 1psd s ILE 236 Cb -0.16 -0.82 0.08 0.00 0.15 0.00 0.00 42.46 41.71 1psd s ILE 236 CO 0.06 0.32 0.01 0.21 -2.11 0.00 0.00 174.94 173.42 1psd s ASN 237 N 1.61 4.10 -0.30 4.50 3.04 -0.51 -2.01 114.94 125.37 1psd s ASN 237 Ca 0.01 -1.51 0.10 0.00 0.04 0.00 0.00 52.86 51.50 1psd s ASN 237 Cb -0.13 -1.20 0.46 0.00 -1.54 0.00 0.00 41.25 38.84 1psd s ASN 237 CO -0.05 -0.31 1.16 0.00 -3.04 0.00 0.00 177.10 174.85 1psd n ALA 238 N 4.62 4.52 -2.00 1.71 0.00 -1.26 -2.49 120.51 125.61 1psd n ALA 238 Ca -0.06 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.75 1psd n ALA 238 Cb 0.43 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.41 1psd n ALA 238 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1psd n SER 239 N -0.64 0.00 -4.12 0.00 3.41 -1.26 -4.96 113.62 106.05 1psd n SER 239 Ca 0.35 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.75 1psd n SER 239 Cb 0.90 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.70 1psd n SER 239 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1psd s ARG 240 N 0.59 1.06 0.10 4.33 1.81 -1.26 -4.86 118.95 120.71 1psd s ARG 240 Ca 0.00 -0.58 0.05 0.00 -1.72 0.00 0.00 55.73 53.48 1psd s ARG 240 Cb 0.00 -1.04 0.27 0.00 -0.45 0.00 0.00 34.95 33.74 1psd s ARG 240 CO 0.00 0.28 1.06 0.41 -0.68 0.00 0.00 175.30 176.37 1psd n GLY 241 N 2.46 -0.49 0.04 -3.53 0.00 -1.25 -2.44 105.19 99.97 1psd n GLY 241 Ca -0.15 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1psd n GLY 241 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1psd n THR 242 N -1.62 0.19 0.19 2.61 -2.24 -1.26 -2.67 114.28 109.48 1psd n THR 242 Ca -0.00 -0.23 0.03 0.00 -2.27 0.00 0.00 64.05 61.58 1psd n THR 242 Cb 0.13 0.17 0.39 0.00 -2.10 0.00 0.00 70.33 68.92 1psd n THR 242 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1psd h VAL 243 N 0.00 1.19 -3.78 2.28 2.07 -1.64 0.38 116.25 116.75 1psd h VAL 243 Ca 0.00 -1.18 -0.68 0.00 0.82 0.00 0.00 66.70 65.66 1psd h VAL 243 Cb 0.72 1.64 -0.25 0.00 -1.52 0.00 0.00 31.29 31.88 1psd h VAL 243 CO 0.00 0.33 -0.78 -0.69 0.02 0.00 0.00 177.57 176.45 1psd s VAL 244 N -4.21 2.98 -0.71 2.57 1.01 -1.26 -0.90 120.40 119.88 1psd s VAL 244 Ca -0.03 -0.73 -0.26 0.00 0.00 0.00 0.00 61.98 60.97 1psd s VAL 244 Cb 0.14 -2.19 0.04 0.00 0.00 0.00 0.00 36.38 34.37 1psd s VAL 244 CO 0.71 0.57 1.19 -0.62 0.00 0.00 0.00 175.10 176.95 1psd s ASP 245 N -0.30 6.18 0.23 3.32 2.15 -0.96 -4.88 116.67 122.41 1psd s ASP 245 Ca 0.02 -0.55 -0.08 0.00 0.43 0.00 0.00 52.55 52.37 1psd s ASP 245 Cb -0.13 -2.52 0.20 0.00 -0.30 0.00 0.00 42.92 40.17 1psd s ASP 245 CO 0.03 -1.71 1.87 0.40 -0.17 0.00 0.00 175.17 175.58 1psd h ILE 246 N 6.02 1.25 -0.22 4.11 2.04 -1.96 -1.36 117.51 127.39 1psd h ILE 246 Ca -0.28 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1psd h ILE 246 Cb 1.06 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1psd h ILE 246 CO 1.25 0.26 0.00 1.55 0.00 0.00 0.00 178.15 181.21 1psd h PRO 247 N 1.21 0.31 -0.26 2.37 0.13 -2.00 0.76 132.00 134.53 1psd h PRO 247 Ca 0.31 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.34 1psd h PRO 247 Cb -0.03 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.04 1psd h PRO 247 CO -0.06 0.34 -0.04 0.00 -0.23 0.00 0.00 178.00 178.01 1psd h ALA 248 N 1.70 0.36 -0.35 -0.56 0.00 -1.85 -2.56 119.26 115.99 1psd h ALA 248 Ca 0.07 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1psd h ALA 248 Cb 0.21 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1psd h ALA 248 CO 0.00 0.14 -0.06 1.25 0.00 0.00 0.00 179.25 180.59 1psd h LEU 249 N 0.25 -0.26 -1.04 0.00 5.85 -0.30 -1.86 115.31 117.94 1psd h LEU 249 Ca 0.07 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.91 1psd h LEU 249 Cb 0.50 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1psd h LEU 249 CO 0.02 -0.09 0.64 0.00 -0.34 0.00 0.00 178.44 178.68 1psd h ASP 251 N 1.28 0.74 -0.71 0.00 5.19 -0.99 -1.94 116.42 119.99 1psd h ASP 251 Ca 0.37 -0.18 0.01 0.00 -0.62 0.00 0.00 57.03 56.62 1psd h ASP 251 Cb -0.07 -0.19 -0.04 0.00 0.18 0.00 0.00 39.33 39.21 1psd h ASP 251 CO -0.10 0.72 0.47 0.00 -3.12 0.00 0.00 179.24 177.21 1psd h ALA 252 N 1.05 0.90 -0.21 3.45 0.00 -0.63 -0.18 119.26 123.65 1psd h ALA 252 Ca 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1psd h ALA 252 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1psd h ALA 252 CO -0.01 0.31 0.04 -0.07 0.00 0.00 0.00 179.25 179.52 1psd h LEU 253 N 0.95 0.32 -1.50 0.00 3.38 -1.12 -1.92 115.31 115.43 1psd h LEU 253 Ca 0.26 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1psd h LEU 253 Cb -0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1psd h LEU 253 CO -0.06 0.48 -0.25 0.00 0.09 0.00 0.00 178.44 178.70 1psd h ALA 254 N 0.85 1.32 -0.01 1.53 0.00 -1.13 -1.78 119.26 120.04 1psd h ALA 254 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1psd h ALA 254 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1psd h ALA 254 CO 0.00 0.31 -0.01 -1.13 0.00 0.00 0.00 179.25 178.42 1psd n SER 255 N -3.85 1.06 0.00 0.00 3.41 -0.10 -4.92 113.62 109.22 1psd n SER 255 Ca -0.02 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1psd n SER 255 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 1psd n SER 255 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1psd n LYS 256 N -0.20 -0.13 0.20 4.33 4.01 -0.67 -4.83 118.16 120.87 1psd n LYS 256 Ca 0.20 0.03 0.12 0.00 -0.51 0.00 0.00 58.31 58.15 1psd n LYS 256 Cb 0.29 -3.62 0.67 0.00 -0.51 0.00 0.00 35.03 31.86 1psd n LYS 256 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1psd h HIS 257 N 0.00 0.00 -4.49 2.13 2.76 -1.63 -3.39 115.15 110.53 1psd h HIS 257 Ca 0.00 0.00 -0.70 0.00 -2.20 0.00 0.00 60.37 57.47 1psd h HIS 257 Cb 0.07 0.00 -0.29 0.00 1.55 0.00 0.00 27.41 28.74 1psd h HIS 257 CO 0.04 0.00 -0.87 -0.51 -1.30 0.00 0.00 177.93 175.29 1psd s LEU 258 N -8.87 2.17 0.12 0.26 1.43 -1.19 -0.40 118.68 112.19 1psd s LEU 258 Ca -0.05 -0.44 0.05 0.00 -1.03 0.00 0.00 54.13 52.65 1psd s LEU 258 Cb 0.17 -1.37 -0.21 0.00 0.03 0.00 0.00 46.19 44.82 1psd s LEU 258 CO 0.67 0.32 1.26 0.00 0.23 0.00 0.00 176.35 178.83 1psd h ALA 259 N 5.38 0.32 -2.03 4.21 0.00 -1.17 -3.42 119.26 122.55 1psd h ALA 259 Ca -0.44 -0.89 0.38 0.00 0.00 0.00 0.00 54.91 53.96 1psd h ALA 259 Cb 1.13 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1psd h ALA 259 CO 0.47 1.18 0.96 0.20 0.00 0.00 0.00 179.25 182.06 1psd s GLY 260 N -4.69 -0.18 0.21 0.00 0.00 -1.25 -4.92 107.32 96.49 1psd s GLY 260 Ca -0.00 0.12 -0.23 0.00 0.00 0.00 0.00 44.72 44.62 1psd s GLY 260 CO 0.83 6.06 0.71 0.00 0.00 0.00 0.00 173.10 180.70 1psd s ALA 261 N -2.02 -1.44 -0.11 3.20 0.00 -1.10 -2.74 121.76 117.54 1psd s ALA 261 Ca 0.30 0.11 -0.04 0.00 0.00 0.00 0.00 51.96 52.34 1psd s ALA 261 Cb 0.00 0.82 0.05 0.00 0.00 0.00 0.00 23.12 23.99 1psd s ALA 261 CO -0.02 -0.92 0.11 0.00 0.00 0.00 0.00 175.76 174.94 1psd s ALA 262 N -3.75 0.14 -0.12 0.00 0.00 -0.19 -1.18 121.76 116.67 1psd s ALA 262 Ca 0.07 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.17 1psd s ALA 262 Cb -0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 1psd s ALA 262 CO -0.02 -0.82 -0.18 0.42 0.00 0.00 0.00 175.76 175.16 1psd s ILE 263 N 2.21 2.58 -0.04 0.00 -1.09 0.30 -1.43 121.20 123.73 1psd s ILE 263 Ca 0.04 -0.83 0.03 0.00 -2.23 0.00 0.00 60.65 57.66 1psd s ILE 263 Cb -0.14 -2.04 -0.05 0.00 -1.58 0.00 0.00 42.46 38.65 1psd s ILE 263 CO -0.07 0.54 0.01 -0.67 -1.23 0.00 0.00 174.94 173.53 1psd n ASP 264 N 3.53 4.09 -4.29 3.58 2.03 -1.04 -1.73 116.55 122.73 1psd n ASP 264 Ca -0.19 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.80 1psd n ASP 264 Cb 0.53 0.61 -0.16 0.00 -0.72 0.00 0.00 41.12 41.38 1psd n ASP 264 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1psd s VAL 265 N -2.09 2.55 0.35 5.18 -7.23 -1.25 -1.54 120.40 116.37 1psd s VAL 265 Ca -0.02 -0.84 0.08 0.00 -1.81 0.00 0.00 61.98 59.40 1psd s VAL 265 Cb 0.01 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 1psd s VAL 265 CO 0.15 0.54 0.15 -0.36 -0.31 0.00 0.00 175.10 175.27 1psd s PHE 266 N 0.43 2.69 0.05 2.82 0.40 -1.26 -4.27 117.98 118.84 1psd s PHE 266 Ca -0.13 -0.41 -0.30 0.00 -0.60 0.00 0.00 56.93 55.48 1psd s PHE 266 Cb -0.17 -1.68 -0.18 0.00 0.51 0.00 0.00 43.02 41.51 1psd s PHE 266 CO 0.06 0.32 1.48 -1.35 0.70 0.00 0.00 175.22 176.43 1psd h PRO 267 N 1.53 -0.78 -5.22 0.24 0.11 -1.89 -3.33 132.00 122.67 1psd h PRO 267 Ca -0.43 0.05 -0.64 0.00 0.11 0.00 0.00 66.00 65.09 1psd h PRO 267 Cb 1.25 0.18 -0.22 0.00 0.11 0.00 0.00 31.00 32.32 1psd h PRO 267 CO 0.64 -0.48 -0.67 0.95 -0.21 0.00 0.00 178.00 178.23 1psd s THR 268 N -5.61 3.88 0.13 -1.15 -4.23 -1.26 -4.85 115.64 102.55 1psd s THR 268 Ca -0.16 -0.35 0.11 0.00 -1.18 0.00 0.00 61.69 60.10 1psd s THR 268 Cb 0.03 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 71.11 1psd s THR 268 CO 0.58 0.47 -0.27 -1.61 -0.54 0.00 0.00 174.62 173.25 1psd s GLU 269 N 0.63 1.38 0.32 3.99 2.02 -1.26 -5.02 118.70 120.76 1psd s GLU 269 Ca -0.02 -1.33 -0.29 0.00 0.02 0.00 0.00 54.97 53.34 1psd s GLU 269 Cb -0.14 -1.86 -0.12 0.00 0.10 0.00 0.00 34.13 32.11 1psd s GLU 269 CO 0.02 0.44 1.51 -2.30 0.02 0.00 0.00 175.26 174.95 1psd n PRO 270 N 0.92 2.56 -0.10 0.39 -0.02 -1.26 -4.91 135.00 132.59 1psd n PRO 270 Ca -0.18 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1psd n PRO 270 Cb 0.53 -2.64 0.28 0.00 -0.02 0.00 0.00 33.50 31.66 1psd n PRO 270 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1psd h ALA 271 N 3.94 1.44 -2.93 3.55 0.00 -1.94 -3.46 119.26 119.86 1psd h ALA 271 Ca -0.48 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.23 1psd h ALA 271 Cb 1.24 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1psd h ALA 271 CO 0.73 0.44 0.01 -0.08 0.00 0.00 0.00 179.25 180.35 1psd s THR 272 N -5.42 0.00 0.01 0.00 -1.32 -1.26 -5.05 115.64 102.60 1psd s THR 272 Ca -0.09 -1.30 0.31 0.00 -1.21 0.00 0.00 61.69 59.41 1psd s THR 272 Cb 0.17 -2.47 0.34 0.00 -1.51 0.00 0.00 72.50 69.02 1psd s THR 272 CO 0.77 0.00 1.94 0.78 -2.21 0.00 0.00 174.62 175.90 1psd h ASN 273 N 2.11 0.00 0.30 8.08 -0.26 -2.03 -2.27 115.58 121.51 1psd h ASN 273 Ca -0.27 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.47 1psd h ASN 273 Cb 1.25 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.51 1psd h ASN 273 CO 0.36 0.00 -0.08 -1.54 -1.06 0.00 0.00 177.43 175.11 1psd n SER 274 N -2.74 0.47 -4.85 5.81 3.41 -1.26 -4.86 113.62 109.60 1psd n SER 274 Ca 0.00 -0.68 -0.33 0.00 -0.26 0.00 0.00 58.87 57.60 1psd n SER 274 Cb 0.20 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 64.02 1psd n SER 274 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1psd s ASP 275 N -2.38 6.81 0.21 4.04 1.11 -0.85 -5.05 116.67 120.55 1psd s ASP 275 Ca 0.32 1.24 -0.30 0.00 0.18 0.00 0.00 52.55 53.99 1psd s ASP 275 Cb 0.20 -2.35 -0.08 0.00 1.07 0.00 0.00 42.92 41.76 1psd s ASP 275 CO 0.45 -0.11 1.14 -2.84 1.18 0.00 0.00 175.17 174.99 1psd s PRO 276 N -2.68 4.56 -0.17 8.23 0.02 -1.26 -4.96 135.00 138.75 1psd s PRO 276 Ca 0.50 1.81 -0.06 0.00 0.02 0.00 0.00 61.00 63.27 1psd s PRO 276 Cb -0.12 -3.24 -0.04 0.00 0.02 0.00 0.00 34.50 31.13 1psd s PRO 276 CO 0.19 0.04 0.03 0.12 -0.33 0.00 0.00 177.00 177.05 1psd s PHE 277 N -0.42 3.19 0.01 6.54 5.36 -1.26 -4.82 117.98 126.58 1psd s PHE 277 Ca 0.49 -0.01 0.02 0.00 -0.96 0.00 0.00 56.93 56.47 1psd s PHE 277 Cb -0.32 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.33 1psd s PHE 277 CO 0.38 0.14 -0.06 0.99 -1.46 0.00 0.00 175.22 175.21 1psd s THR 278 N 0.24 0.43 -0.22 0.12 2.01 -1.26 -5.14 115.64 111.82 1psd s THR 278 Ca 0.02 -0.49 -0.31 0.00 0.31 0.00 0.00 61.69 61.22 1psd s THR 278 Cb -0.13 -0.42 0.16 0.00 0.01 0.00 0.00 72.50 72.12 1psd s THR 278 CO 0.01 -0.05 1.21 -0.55 -0.69 0.00 0.00 174.62 174.54 1psd s SER 279 N -0.59 -0.17 0.27 3.53 0.15 -1.26 -5.04 113.70 110.59 1psd s SER 279 Ca -0.02 0.14 0.11 0.00 0.70 0.00 0.00 55.95 56.88 1psd s SER 279 Cb -0.05 0.15 0.34 0.00 -1.71 0.00 0.00 66.02 64.75 1psd s SER 279 CO -0.00 -0.19 1.60 -0.65 1.20 0.00 0.00 173.24 175.20 1psd h PRO 280 N 2.19 0.00 -0.12 5.44 0.11 -2.01 -3.15 132.00 134.46 1psd h PRO 280 Ca -0.12 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.03 1psd h PRO 280 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1psd h PRO 280 CO 0.25 0.62 0.22 -0.07 -0.21 0.00 0.00 178.00 178.81 1psd h LEU 281 N 0.00 0.00 -2.07 2.35 3.38 -1.96 -2.09 115.31 114.93 1psd h LEU 281 Ca -0.01 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.07 1psd h LEU 281 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1psd h LEU 281 CO 0.08 0.00 0.31 0.00 0.09 0.00 0.00 178.44 178.92 1psd h GLU 283 N 0.00 0.00 -5.92 0.00 4.81 -1.64 -3.43 114.58 108.41 1psd h GLU 283 Ca 0.17 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.83 1psd h GLU 283 Cb 0.79 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.10 1psd h GLU 283 CO -0.00 0.39 0.21 -0.06 -0.73 0.00 0.00 179.01 178.82 1psd s PHE 284 N -3.62 3.47 0.14 0.92 0.08 -0.60 -4.94 117.98 113.43 1psd s PHE 284 Ca -0.00 1.18 0.08 0.00 0.12 0.00 0.00 56.93 58.31 1psd s PHE 284 Cb 0.11 -2.89 -0.08 0.00 -0.57 0.00 0.00 43.02 39.59 1psd s PHE 284 CO 0.69 -0.10 1.35 -0.44 -0.10 0.00 0.00 175.22 176.62 1psd h ASP 285 N 7.15 0.00 0.00 1.36 3.32 -1.85 -3.22 116.42 123.17 1psd h ASP 285 Ca -0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.71 1psd h ASP 285 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1psd h ASP 285 CO 0.79 0.90 0.00 -0.46 -1.72 0.00 0.00 179.24 178.75 1psd n ASN 286 N -3.43 0.92 -4.01 6.45 0.23 -1.26 -3.31 115.26 110.85 1psd n ASN 286 Ca -0.00 -1.99 -0.29 0.00 -0.53 0.00 0.00 54.58 51.77 1psd n ASN 286 Cb 0.87 -0.46 -0.17 0.00 -2.08 0.00 0.00 39.78 37.94 1psd n ASN 286 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1psd s VAL 287 N -1.07 1.45 -0.42 3.53 1.01 -1.22 -2.71 120.40 120.96 1psd s VAL 287 Ca 0.00 -0.57 -0.24 0.00 0.00 0.00 0.00 61.98 61.16 1psd s VAL 287 Cb 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 35.04 1psd s VAL 287 CO 0.00 0.44 0.86 -0.76 0.00 0.00 0.00 175.10 175.64 1psd s LEU 288 N 1.38 4.08 -0.21 3.92 1.43 -0.33 -4.98 118.68 123.98 1psd s LEU 288 Ca 0.02 0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 53.25 1psd s LEU 288 Cb -0.13 -3.12 -0.03 0.00 0.03 0.00 0.00 46.19 42.93 1psd s LEU 288 CO -0.08 -0.92 0.06 -0.76 0.23 0.00 0.00 176.35 174.88 1psd s LEU 289 N 3.47 3.55 -0.01 1.79 1.02 -1.26 -0.54 118.68 126.70 1psd s LEU 289 Ca 0.34 -0.10 0.03 0.00 0.02 0.00 0.00 54.13 54.43 1psd s LEU 289 Cb -0.11 -1.92 -0.01 0.00 0.02 0.00 0.00 46.19 44.17 1psd s LEU 289 CO 0.22 0.06 -0.10 0.42 0.02 0.00 0.00 176.35 176.97 1psd s THR 290 N 1.03 0.79 -0.80 5.49 -4.23 -0.71 -5.02 115.64 112.20 1psd s THR 290 Ca 0.04 -0.44 -0.16 0.00 -1.18 0.00 0.00 61.69 59.95 1psd s THR 290 Cb -0.14 -0.67 -0.12 0.00 1.34 0.00 0.00 72.50 72.92 1psd s THR 290 CO 0.03 0.21 1.97 -0.81 -0.54 0.00 0.00 174.62 175.48 1psd n PRO 291 N 2.80 1.67 -4.07 3.99 -0.04 -1.26 -4.34 135.00 133.76 1psd n PRO 291 Ca -0.14 -1.67 -0.35 0.00 -0.04 0.00 0.00 63.50 61.30 1psd n PRO 291 Cb 0.56 -2.73 -0.02 0.00 -0.04 0.00 0.00 33.50 31.28 1psd n PRO 291 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1psd n HIS 292 N 6.24 -1.47 -3.15 0.54 -0.00 -0.59 -4.98 115.22 111.81 1psd n HIS 292 Ca 0.47 0.43 0.00 0.00 -0.00 0.00 0.00 57.72 58.61 1psd n HIS 292 Cb 0.30 -3.08 0.00 0.00 -0.00 0.00 0.00 29.99 27.21 1psd n HIS 292 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 1psd n ILE 293 N -4.66 0.00 -0.00 3.57 -5.35 -1.26 -4.75 119.36 106.91 1psd n ILE 293 Ca -0.22 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 1psd n ILE 293 Cb 0.63 -0.65 0.00 0.00 -1.74 0.00 0.00 39.64 37.88 1psd n ILE 293 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1psd n GLY 294 N 5.00 0.15 0.00 3.28 0.00 -1.26 -4.65 105.19 107.71 1psd n GLY 294 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1psd n GLY 294 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1psd n GLY 295 N -2.00 0.00 3.56 -0.02 0.00 -1.26 -1.41 105.19 104.06 1psd n GLY 295 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1psd n GLY 295 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1psd s SER 296 N -2.03 5.78 -0.06 1.61 0.01 -1.26 -4.65 113.70 113.10 1psd s SER 296 Ca 0.00 -0.93 -0.06 0.00 1.31 0.00 0.00 55.95 56.27 1psd s SER 296 Cb 0.00 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.68 1psd s SER 296 CO 0.00 -2.15 0.17 -0.89 0.41 0.00 0.00 173.24 170.77 1psd s THR 297 N 7.64 0.01 0.16 1.44 2.01 -1.26 -5.01 115.64 120.62 1psd s THR 297 Ca 0.58 -0.04 -0.16 0.00 0.31 0.00 0.00 61.69 62.37 1psd s THR 297 Cb -0.04 -0.25 0.06 0.00 0.01 0.00 0.00 72.50 72.27 1psd s THR 297 CO -0.03 -0.02 1.70 1.56 -0.69 0.00 0.00 174.62 177.14 1psd h GLN 298 N 5.78 0.11 -0.86 4.92 1.08 -1.99 -0.22 115.11 123.94 1psd h GLN 298 Ca -0.26 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.00 1psd h GLN 298 Cb 1.20 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 28.54 1psd h GLN 298 CO 0.40 0.07 0.53 0.93 -0.95 0.00 0.00 178.83 179.81 1psd h GLU 299 N 0.11 0.93 -0.34 1.46 3.07 -1.97 0.34 114.58 118.18 1psd h GLU 299 Ca 0.18 -0.06 -0.16 0.00 -0.50 0.00 0.00 59.36 58.83 1psd h GLU 299 Cb 0.25 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1psd h GLU 299 CO -0.30 0.61 -0.41 0.00 -1.40 0.00 0.00 179.01 177.51 1psd h ALA 300 N 1.41 0.62 -0.34 3.43 0.00 -1.72 -2.10 119.26 120.57 1psd h ALA 300 Ca 0.38 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1psd h ALA 300 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1psd h ALA 300 CO -0.18 0.67 0.04 1.96 0.00 0.00 0.00 179.25 181.74 1psd h GLN 301 N 0.69 0.57 -0.20 0.00 1.08 -0.10 -0.57 115.11 116.57 1psd h GLN 301 Ca 0.05 -0.16 0.04 0.00 -1.45 0.00 0.00 58.65 57.13 1psd h GLN 301 Cb 0.99 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 28.32 1psd h GLN 301 CO 0.10 0.66 -0.05 1.49 -0.95 0.00 0.00 178.83 180.07 1psd h GLU 302 N 0.39 -0.01 -0.74 1.46 4.81 -0.31 0.27 114.58 120.46 1psd h GLU 302 Ca 0.10 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1psd h GLU 302 Cb 0.38 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1psd h GLU 302 CO 0.01 -0.00 0.24 -0.97 -0.73 0.00 0.00 179.01 177.56 1psd h ASN 303 N -0.01 1.07 -0.45 1.04 -1.24 -1.23 0.00 115.58 114.77 1psd h ASN 303 Ca 0.10 -0.20 -0.05 0.00 0.71 0.00 0.00 56.30 56.85 1psd h ASN 303 Cb 0.15 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 38.91 1psd h ASN 303 CO -0.21 0.99 0.08 0.40 -1.29 0.00 0.00 177.43 177.40 1psd h ILE 304 N 1.10 1.24 -0.51 2.57 2.04 -0.55 0.15 117.51 123.55 1psd h ILE 304 Ca 0.24 -0.87 0.04 0.00 1.00 0.00 0.00 64.86 65.27 1psd h ILE 304 Cb 0.29 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 1psd h ILE 304 CO -0.01 0.31 0.26 1.23 0.00 0.00 0.00 178.15 179.93 1psd h GLY 305 N 0.60 0.71 1.39 5.37 0.00 0.01 -1.69 103.07 109.46 1psd h GLY 305 Ca 0.14 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 47.18 1psd h GLY 305 CO 0.01 0.11 -0.25 -2.00 0.00 0.00 0.00 176.54 174.41 1psd h LEU 306 N 0.50 0.72 0.40 3.11 5.85 -0.63 -2.92 115.31 122.33 1psd h LEU 306 Ca 0.22 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1psd h LEU 306 Cb 0.13 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1psd h LEU 306 CO -0.15 0.94 -0.19 -0.08 -0.34 0.00 0.00 178.44 178.62 1psd h GLU 307 N 0.61 -0.52 -0.91 1.25 4.81 -0.20 -3.05 114.58 116.57 1psd h GLU 307 Ca 0.08 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1psd h GLU 307 Cb 0.75 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.19 1psd h GLU 307 CO 0.06 -0.35 0.59 0.28 -0.73 0.00 0.00 179.01 178.86 1psd h VAL 308 N -0.81 1.16 -0.28 0.32 2.07 -1.45 -2.27 116.25 114.99 1psd h VAL 308 Ca -0.06 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.08 1psd h VAL 308 Cb 0.41 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 1psd h VAL 308 CO 0.09 0.21 0.17 0.00 0.02 0.00 0.00 177.57 178.06 1psd h ALA 309 N 1.37 0.35 -0.59 1.67 0.00 -1.66 -1.72 119.26 118.68 1psd h ALA 309 Ca 0.36 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.36 1psd h ALA 309 Cb -0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1psd h ALA 309 CO -0.11 -0.20 0.40 0.78 0.00 0.00 0.00 179.25 180.11 1psd h GLY 310 N 0.35 0.52 1.85 0.00 0.00 -1.31 0.19 103.07 104.66 1psd h GLY 310 Ca 0.11 -0.15 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1psd h GLY 310 CO -0.04 0.09 -0.48 0.50 0.00 0.00 0.00 176.54 176.61 1psd h LYS 311 N 0.36 0.17 -0.08 4.80 1.57 -0.80 -2.14 116.57 120.46 1psd h LYS 311 Ca 0.27 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 1psd h LYS 311 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1psd h LYS 311 CO -0.07 0.62 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.22 1psd h LEU 312 N 0.14 0.25 0.67 2.94 4.07 -0.02 -2.96 115.31 120.39 1psd h LEU 312 Ca 0.01 -0.55 -0.03 0.00 0.08 0.00 0.00 57.88 57.39 1psd h LEU 312 Cb 0.90 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.56 1psd h LEU 312 CO 0.07 0.75 -0.47 0.40 -1.08 0.00 0.00 178.44 178.11 1psd h ILE 313 N -0.25 0.00 -1.36 1.22 5.03 -1.20 -1.05 117.51 119.91 1psd h ILE 313 Ca 0.00 0.00 0.41 0.00 -0.12 0.00 0.00 64.86 65.15 1psd h ILE 313 Cb 0.71 0.00 -0.09 0.00 -3.03 0.00 0.00 36.82 34.41 1psd h ILE 313 CO 0.03 0.00 0.93 0.11 -0.68 0.00 0.00 178.15 178.54 1psd h LYS 314 N -1.08 0.10 0.19 2.37 1.57 -1.47 0.66 116.57 118.91 1psd h LYS 314 Ca -0.09 -0.01 -0.29 0.00 -1.87 0.00 0.00 60.65 58.40 1psd h LYS 314 Cb 0.89 -0.02 0.03 0.00 0.08 0.00 0.00 32.23 33.21 1psd h LYS 314 CO 0.05 0.07 -1.24 -0.92 -0.57 0.00 0.00 179.45 176.84 1psd h TYR 315 N 0.11 0.89 -0.16 -1.35 3.20 -1.29 -1.73 116.97 116.63 1psd h TYR 315 Ca 0.73 -0.62 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1psd h TYR 315 Cb 2.52 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 40.74 1psd h TYR 315 CO -0.00 1.47 0.02 1.03 -1.64 0.00 0.00 178.16 179.05 1psd h SER 316 N 0.06 0.25 1.62 -2.11 0.87 0.14 0.66 113.55 115.04 1psd h SER 316 Ca -0.21 -0.26 -0.08 0.00 -1.23 0.00 0.00 61.79 60.01 1psd h SER 316 Cb 1.96 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 63.84 1psd h SER 316 CO 0.24 0.45 -0.38 0.44 -0.53 0.00 0.00 176.83 177.05 1psd h ASP 317 N 0.05 0.00 -0.04 6.23 3.32 -0.37 -3.41 116.42 122.20 1psd h ASP 317 Ca 0.05 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.89 1psd h ASP 317 Cb 0.31 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.69 1psd h ASP 317 CO 0.00 0.37 -0.36 -0.46 -1.72 0.00 0.00 179.24 177.07 1psd n ASN 318 N -3.19 -1.57 -1.50 6.45 6.94 -0.66 -4.81 115.26 116.93 1psd n ASN 318 Ca 0.02 -2.37 0.00 0.00 -0.02 0.00 0.00 54.58 52.22 1psd n ASN 318 Cb 0.68 0.82 0.00 0.00 -2.36 0.00 0.00 39.78 38.92 1psd n ASN 318 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1psd n GLY 319 N -0.96 -0.25 3.72 4.83 0.00 0.22 -4.78 105.19 107.97 1psd n GLY 319 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1psd n GLY 319 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1psd s SER 320 N -1.07 7.19 -0.29 1.61 0.15 -1.15 -4.79 113.70 115.35 1psd s SER 320 Ca 0.00 1.98 0.13 0.00 0.70 0.00 0.00 55.95 58.76 1psd s SER 320 Cb 0.00 -2.59 0.48 0.00 -1.71 0.00 0.00 66.02 62.20 1psd s SER 320 CO 0.00 -0.35 1.15 0.35 1.20 0.00 0.00 173.24 175.58 1psd n THR 321 N 3.42 2.02 0.12 6.45 -2.24 -0.50 -4.00 114.28 119.55 1psd n THR 321 Ca 0.06 -3.76 -0.13 0.00 -2.27 0.00 0.00 64.05 57.95 1psd n THR 321 Cb 0.47 -0.22 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 1psd n THR 321 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1psd h LEU 322 N 2.39 -0.96 -2.72 3.22 3.38 -1.88 -3.12 115.31 115.62 1psd h LEU 322 Ca 0.17 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1psd h LEU 322 Cb 1.39 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1psd h LEU 322 CO 0.55 -0.42 0.00 -1.54 0.09 0.00 0.00 178.44 177.12 1psd n SER 323 N -5.43 4.11 -4.70 -0.43 3.41 -1.26 -4.80 113.62 104.52 1psd n SER 323 Ca -0.07 -2.28 -0.41 0.00 -0.26 0.00 0.00 58.87 55.85 1psd n SER 323 Cb 0.34 -0.52 0.01 0.00 -0.26 0.00 0.00 64.21 63.77 1psd n SER 323 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1psd n ALA 324 N 1.14 1.33 1.08 7.33 0.00 -1.18 -4.76 120.51 125.44 1psd n ALA 324 Ca 0.23 0.29 0.12 0.00 0.00 0.00 0.00 53.44 54.08 1psd n ALA 324 Cb 0.74 -2.27 0.15 0.00 0.00 0.00 0.00 19.45 18.07 1psd n ALA 324 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1psd n VAL 325 N -0.05 0.00 0.00 0.00 0.24 -0.97 -4.40 118.33 113.15 1psd n VAL 325 Ca 0.06 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1psd n VAL 325 Cb 0.39 0.72 0.00 0.00 -1.47 0.00 0.00 33.84 33.47 1psd n VAL 325 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1psd n ASN 326 N -0.83 0.99 -4.82 -1.34 6.94 -1.26 -5.05 115.26 109.89 1psd n ASN 326 Ca 0.08 -0.19 -0.22 0.00 -0.02 0.00 0.00 54.58 54.23 1psd n ASN 326 Cb 0.37 0.59 -0.04 0.00 -2.36 0.00 0.00 39.78 38.34 1psd n ASN 326 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1psd s PHE 327 N -0.78 3.03 0.35 -2.53 0.40 -1.26 -4.89 117.98 112.30 1psd s PHE 327 Ca 0.00 -0.16 -0.27 0.00 -0.60 0.00 0.00 56.93 55.90 1psd s PHE 327 Cb 0.00 -1.48 -0.09 0.00 0.51 0.00 0.00 43.02 41.96 1psd s PHE 327 CO 0.00 0.45 1.15 -2.14 0.70 0.00 0.00 175.22 175.38 1psd s PRO 328 N -3.86 4.30 -0.56 0.24 0.02 -1.26 -4.82 135.00 129.04 1psd s PRO 328 Ca 0.35 1.84 -0.21 0.00 0.02 0.00 0.00 61.00 62.99 1psd s PRO 328 Cb -0.07 -2.88 0.06 0.00 0.02 0.00 0.00 34.50 31.63 1psd s PRO 328 CO 0.25 -0.11 0.80 -1.21 -0.33 0.00 0.00 177.00 176.40 1psd s GLU 329 N -1.98 3.17 0.03 5.54 2.02 -1.26 -4.75 118.70 121.48 1psd s GLU 329 Ca 0.52 -0.75 0.04 0.00 0.02 0.00 0.00 54.97 54.80 1psd s GLU 329 Cb -0.31 -4.14 -0.02 0.00 0.10 0.00 0.00 34.13 29.76 1psd s GLU 329 CO 0.40 -1.47 -0.13 0.14 0.02 0.00 0.00 175.26 174.22 1psd s VAL 330 N 3.34 1.04 -0.19 2.63 -7.23 -1.26 -4.90 120.40 113.82 1psd s VAL 330 Ca 0.21 -0.90 -0.14 0.00 -1.81 0.00 0.00 61.98 59.33 1psd s VAL 330 Cb -0.17 -0.94 0.06 0.00 0.56 0.00 0.00 36.38 35.89 1psd s VAL 330 CO 0.13 0.04 0.49 -0.55 -0.31 0.00 0.00 175.10 174.90 1psd s SER 331 N -0.98 -0.58 -0.06 4.85 0.15 -1.26 -1.41 113.70 114.40 1psd s SER 331 Ca 0.02 1.04 0.03 0.00 0.70 0.00 0.00 55.95 57.73 1psd s SER 331 Cb -0.07 0.98 0.01 0.00 -1.71 0.00 0.00 66.02 65.23 1psd s SER 331 CO 0.01 -0.19 -0.14 -0.22 1.20 0.00 0.00 173.24 173.90 1psd s LEU 332 N 0.87 1.74 -0.09 3.45 2.96 -1.26 -5.04 118.68 121.31 1psd s LEU 332 Ca -0.05 -0.33 -0.38 0.00 -0.22 0.00 0.00 54.13 53.15 1psd s LEU 332 Cb -0.05 -0.90 -0.15 0.00 0.50 0.00 0.00 46.19 45.58 1psd s LEU 332 CO -0.07 0.07 1.61 -2.65 -1.32 0.00 0.00 176.35 173.99 1psd n PRO 333 N 3.65 1.38 -2.38 0.98 -0.02 -1.26 -4.85 135.00 132.50 1psd n PRO 333 Ca -0.22 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.38 1psd n PRO 333 Cb 0.52 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 1psd n PRO 333 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1psd s LEU 334 N 2.34 3.27 -0.29 2.45 0.20 -1.26 -4.89 118.68 120.50 1psd s LEU 334 Ca 0.91 -0.57 -0.03 0.00 0.69 0.00 0.00 54.13 55.13 1psd s LEU 334 Cb -0.95 -2.56 0.17 0.00 -0.43 0.00 0.00 46.19 42.43 1psd s LEU 334 CO 0.55 -1.99 0.58 -1.38 -0.29 0.00 0.00 176.35 173.82 1psd s HIS 335 N 6.81 -1.44 0.00 5.38 -3.43 -1.26 -5.14 115.29 116.21 1psd s HIS 335 Ca 0.49 1.73 0.00 0.00 -0.80 0.00 0.00 55.06 56.48 1psd s HIS 335 Cb -0.07 0.54 0.00 0.00 -1.43 0.00 0.00 32.58 31.62 1psd s HIS 335 CO 0.08 -0.81 0.00 0.41 -2.00 0.00 0.00 174.74 172.42 1psd n GLY 336 N 5.42 3.10 3.89 -1.38 0.00 -1.26 -5.05 105.19 109.91 1psd n GLY 336 Ca -0.04 -1.98 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 1psd n GLY 336 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1psd s GLY 337 N 0.00 1.59 -0.12 -0.02 0.00 -1.26 -4.87 107.32 102.63 1psd s GLY 337 Ca 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 44.72 44.28 1psd s GLY 337 CO 0.00 -0.12 0.17 0.54 0.00 0.00 0.00 173.10 173.69 1psd n ARG 338 N -2.56 -4.51 -4.61 2.90 3.00 -1.25 -3.92 116.66 105.70 1psd n ARG 338 Ca 0.04 3.38 -0.26 0.00 -0.01 0.00 0.00 57.85 61.00 1psd n ARG 338 Cb 0.55 -4.72 -0.17 0.00 0.00 0.00 0.00 32.46 28.12 1psd n ARG 338 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1psd s ARG 339 N -0.70 1.97 0.25 5.56 3.52 0.90 -1.75 118.95 128.70 1psd s ARG 339 Ca -0.19 -0.49 0.04 0.00 -0.13 0.00 0.00 55.73 54.96 1psd s ARG 339 Cb 0.01 -1.62 -0.05 0.00 -1.56 0.00 0.00 34.95 31.73 1psd s ARG 339 CO 0.52 0.02 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.51 1psd s LEU 340 N 0.73 2.27 0.07 -0.88 1.43 -0.62 0.31 118.68 122.00 1psd s LEU 340 Ca -0.13 -1.22 -0.08 0.00 -1.03 0.00 0.00 54.13 51.67 1psd s LEU 340 Cb -0.16 -0.38 -0.01 0.00 0.03 0.00 0.00 46.19 45.67 1psd s LEU 340 CO 0.03 -0.47 0.16 0.00 0.23 0.00 0.00 176.35 176.29 1psd s MET 341 N -3.83 0.78 -0.23 1.70 0.23 -0.20 -0.52 119.30 117.23 1psd s MET 341 Ca 0.29 -0.95 -0.04 0.00 -1.03 0.00 0.00 55.69 53.97 1psd s MET 341 Cb 0.05 0.31 0.12 0.00 -1.53 0.00 0.00 34.83 33.79 1psd s MET 341 CO 0.10 -0.23 0.40 -1.58 -2.03 0.00 0.00 175.02 171.68 1psd s HIS 342 N -3.65 -0.84 0.05 3.16 5.04 -0.15 -1.39 115.29 117.51 1psd s HIS 342 Ca 0.04 1.11 -0.16 0.00 -1.54 0.00 0.00 55.06 54.51 1psd s HIS 342 Cb 0.04 0.14 -0.06 0.00 0.04 0.00 0.00 32.58 32.74 1psd s HIS 342 CO -0.10 -0.64 0.48 0.42 -2.34 0.00 0.00 174.74 172.57 1psd s ILE 343 N 2.58 4.91 0.14 0.89 1.09 -0.14 -2.65 121.20 128.03 1psd s ILE 343 Ca 0.08 0.94 -0.25 0.00 -1.10 0.00 0.00 60.65 60.32 1psd s ILE 343 Cb -0.14 -3.77 0.07 0.00 -1.06 0.00 0.00 42.46 37.55 1psd s ILE 343 CO -0.15 0.50 0.90 -1.38 -0.10 0.00 0.00 174.94 174.71 1psd s HIS 344 N -1.17 -0.20 0.40 3.97 -3.43 -0.61 -0.90 115.29 113.35 1psd s HIS 344 Ca 0.28 -0.09 -0.26 0.00 -0.80 0.00 0.00 55.06 54.19 1psd s HIS 344 Cb -0.17 0.63 -0.09 0.00 -1.43 0.00 0.00 32.58 31.52 1psd s HIS 344 CO 0.16 -0.83 1.28 -1.21 -2.00 0.00 0.00 174.74 172.14 1psd s GLU 345 N -3.36 3.99 -1.43 -0.38 2.02 -0.35 -0.06 118.70 119.13 1psd s GLU 345 Ca 0.10 2.11 -0.12 0.00 0.02 0.00 0.00 54.97 57.07 1psd s GLU 345 Cb -0.02 -2.75 0.06 0.00 0.10 0.00 0.00 34.13 31.52 1psd s GLU 345 CO 0.00 -0.46 2.21 -1.71 0.02 0.00 0.00 175.26 175.32 1psd n ASN 346 N 0.14 4.65 -4.43 -0.19 5.15 -0.27 -4.61 115.26 115.70 1psd n ASN 346 Ca 0.04 -2.89 -0.29 0.00 -0.60 0.00 0.00 54.58 50.84 1psd n ASN 346 Cb 0.44 -1.60 -0.12 0.00 -0.53 0.00 0.00 39.78 37.97 1psd n ASN 346 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1psd s ARG 347 N 2.34 1.54 0.48 1.20 1.70 -1.26 -4.91 118.95 120.04 1psd s ARG 347 Ca 0.47 -1.31 -0.24 0.00 -0.47 0.00 0.00 55.73 54.18 1psd s ARG 347 Cb 0.13 -1.96 -0.07 0.00 -0.57 0.00 0.00 34.95 32.48 1psd s ARG 347 CO -0.07 0.45 1.40 -2.14 -1.08 0.00 0.00 175.30 173.87 1psd s PRO 348 N -2.15 3.50 0.00 3.89 0.02 -1.26 -3.56 135.00 135.43 1psd s PRO 348 Ca 0.16 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.53 1psd s PRO 348 Cb -0.10 -2.52 0.00 0.00 0.02 0.00 0.00 34.50 31.90 1psd s PRO 348 CO 0.08 -0.94 0.00 0.41 -0.33 0.00 0.00 177.00 176.22 1psd n GLY 349 N 0.63 3.25 0.34 0.52 0.00 -1.26 -4.94 105.19 103.72 1psd n GLY 349 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 1psd n GLY 349 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1psd h VAL 350 N 0.00 1.23 -0.30 1.61 3.04 -1.90 -2.75 116.25 117.18 1psd h VAL 350 Ca 0.00 -0.65 -0.14 0.00 -1.01 0.00 0.00 66.70 64.90 1psd h VAL 350 Cb 0.00 0.31 -0.00 0.00 -2.01 0.00 0.00 31.29 29.58 1psd h VAL 350 CO 0.00 0.28 -0.36 0.25 -1.01 0.00 0.00 177.57 176.73 1psd h LEU 351 N 1.03 0.83 -0.90 3.16 5.85 -1.92 -1.79 115.31 121.57 1psd h LEU 351 Ca 0.25 -0.49 0.02 0.00 0.84 0.00 0.00 57.88 58.50 1psd h LEU 351 Cb 0.11 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1psd h LEU 351 CO -0.03 1.15 0.59 0.74 -0.34 0.00 0.00 178.44 180.56 1psd h THR 352 N 0.53 1.20 0.00 1.05 2.02 -1.96 0.12 112.91 115.88 1psd h THR 352 Ca 0.04 -0.41 -0.07 0.00 0.77 0.00 0.00 66.41 66.74 1psd h THR 352 Cb 0.94 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1psd h THR 352 CO 0.09 0.22 -0.35 0.00 0.37 0.00 0.00 175.52 175.84 1psd h ALA 353 N 1.35 1.03 -0.01 6.16 0.00 -1.43 -0.81 119.26 125.55 1psd h ALA 353 Ca 0.34 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1psd h ALA 353 Cb -0.09 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.65 1psd h ALA 353 CO -0.09 0.44 -0.33 1.25 0.00 0.00 0.00 179.25 180.52 1psd h LEU 354 N 0.00 0.31 -0.65 0.00 6.46 -0.13 -3.25 115.31 118.04 1psd h LEU 354 Ca -0.00 -0.75 -0.06 0.00 -0.12 0.00 0.00 57.88 56.95 1psd h LEU 354 Cb 0.84 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.65 1psd h LEU 354 CO 0.05 1.01 0.19 0.78 -0.62 0.00 0.00 178.44 179.85 1psd h ASN 355 N -0.37 0.96 -0.97 1.25 -0.26 -0.78 -2.86 115.58 112.56 1psd h ASN 355 Ca -0.04 -0.22 0.23 0.00 -0.56 0.00 0.00 56.30 55.71 1psd h ASN 355 Cb 1.05 -0.25 -0.12 0.00 -1.06 0.00 0.00 38.32 37.94 1psd h ASN 355 CO 0.06 0.92 0.54 0.50 -1.06 0.00 0.00 177.43 178.40 1psd h LYS 356 N 0.95 0.55 -1.01 0.81 3.64 -1.22 0.17 116.57 120.47 1psd h LYS 356 Ca 0.21 -0.03 0.26 0.00 -1.27 0.00 0.00 60.65 59.82 1psd h LYS 356 Cb 0.32 -0.12 -0.13 0.00 -0.41 0.00 0.00 32.23 31.88 1psd h LYS 356 CO -0.00 0.36 0.59 0.82 -2.27 0.00 0.00 179.45 178.95 1psd h ILE 357 N 0.57 0.48 0.13 2.00 2.04 -1.54 -1.47 117.51 119.71 1psd h ILE 357 Ca 0.61 -0.18 -0.33 0.00 1.00 0.00 0.00 64.86 65.95 1psd h ILE 357 Cb 1.11 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1psd h ILE 357 CO -0.47 0.09 -1.74 -0.26 0.00 0.00 0.00 178.15 175.78 1psd h PHE 358 N 0.52 0.49 0.35 1.37 0.04 -1.14 -3.34 116.94 115.23 1psd h PHE 358 Ca 0.67 -0.36 -0.00 0.00 2.80 0.00 0.00 57.97 61.08 1psd h PHE 358 Cb 1.34 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 39.45 1psd h PHE 358 CO -0.01 1.53 -0.32 0.00 -0.60 0.00 0.00 178.31 178.91 1psd h ALA 359 N 0.33 -0.71 0.00 2.45 0.00 -0.79 0.17 119.26 120.72 1psd h ALA 359 Ca -0.33 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1psd h ALA 359 Cb 2.05 0.46 0.00 0.00 0.00 0.00 0.00 17.79 20.29 1psd h ALA 359 CO 0.14 -0.93 0.00 0.93 0.00 0.00 0.00 179.25 179.39 1psd h GLU 360 N -0.69 0.00 -0.02 0.00 5.08 -1.56 0.46 114.58 117.84 1psd h GLU 360 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1psd h GLU 360 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1psd h GLU 360 CO -0.04 0.00 -0.14 0.94 -1.00 0.00 0.00 179.01 178.76 1psd n GLN 361 N -2.48 1.78 -2.76 2.33 7.27 -0.52 -4.94 117.38 118.07 1psd n GLN 361 Ca -0.01 -1.38 -0.18 0.00 0.07 0.00 0.00 57.00 55.50 1psd n GLN 361 Cb 0.09 -1.47 0.02 0.00 2.41 0.00 0.00 30.24 31.29 1psd n GLN 361 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1psd n GLY 362 N 1.33 -0.32 3.68 1.69 0.00 0.16 -4.98 105.19 106.76 1psd n GLY 362 Ca 0.14 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1psd n GLY 362 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1psd s VAL 363 N -3.02 5.25 -0.16 1.61 1.01 0.47 -5.01 120.40 120.55 1psd s VAL 363 Ca 0.19 0.58 -0.24 0.00 0.00 0.00 0.00 61.98 62.52 1psd s VAL 363 Cb -0.09 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1psd s VAL 363 CO 0.24 0.30 0.76 0.21 0.00 0.00 0.00 175.10 176.62 1psd s ASN 364 N 0.90 6.89 -0.25 3.32 2.47 -1.26 -4.33 114.94 122.67 1psd s ASN 364 Ca 0.16 1.09 -0.21 0.00 0.42 0.00 0.00 52.86 54.33 1psd s ASN 364 Cb -0.14 -2.42 -0.02 0.00 -1.45 0.00 0.00 41.25 37.22 1psd s ASN 364 CO 0.06 -0.33 0.65 -0.63 -3.72 0.00 0.00 177.10 173.13 1psd s ILE 365 N 1.93 4.97 -0.00 -5.21 1.01 -1.26 -1.18 121.20 121.46 1psd s ILE 365 Ca 0.36 1.18 -0.14 0.00 0.00 0.00 0.00 60.65 62.05 1psd s ILE 365 Cb -0.16 -3.95 -0.34 0.00 0.01 0.00 0.00 42.46 38.02 1psd s ILE 365 CO 0.13 0.02 0.87 0.00 0.00 0.00 0.00 174.94 175.95 1psd h ALA 366 N 7.85 -0.03 -2.59 9.38 0.00 -1.59 -3.49 119.26 128.81 1psd h ALA 366 Ca -0.27 -0.98 -0.08 0.00 0.00 0.00 0.00 54.91 53.59 1psd h ALA 366 Cb 1.12 0.29 -0.16 0.00 0.00 0.00 0.00 17.79 19.05 1psd h ALA 366 CO 0.78 0.84 -0.18 0.00 0.00 0.00 0.00 179.25 180.69 1psd s ALA 367 N -2.59 -0.79 -0.28 0.00 0.00 -1.18 -5.01 121.76 111.91 1psd s ALA 367 Ca -0.12 0.03 -0.17 0.00 0.00 0.00 0.00 51.96 51.70 1psd s ALA 367 Cb 0.05 0.43 0.09 0.00 0.00 0.00 0.00 23.12 23.69 1psd s ALA 367 CO 0.91 -0.49 0.77 -1.14 0.00 0.00 0.00 175.76 175.81 1psd s GLN 368 N -2.94 0.64 -0.09 0.00 0.74 -1.26 -1.43 119.66 115.32 1psd s GLN 368 Ca -0.02 1.07 0.00 0.00 0.05 0.00 0.00 55.36 56.45 1psd s GLN 368 Cb 0.00 0.15 0.02 0.00 1.10 0.00 0.00 33.01 34.29 1psd s GLN 368 CO -0.06 -0.13 -0.07 -0.47 -0.55 0.00 0.00 175.29 174.02 1psd s TYR 369 N 1.42 1.28 -0.14 1.67 6.14 -1.00 -5.01 117.35 121.70 1psd s TYR 369 Ca -0.09 -0.56 0.00 0.00 0.64 0.00 0.00 57.07 57.07 1psd s TYR 369 Cb -0.05 -1.08 0.02 0.00 0.42 0.00 0.00 41.96 41.27 1psd s TYR 369 CO -0.17 -0.41 -0.13 -1.17 0.64 0.00 0.00 175.55 174.31 1psd s LEU 370 N 1.49 1.63 0.04 6.97 1.98 -1.26 -1.41 118.68 128.12 1psd s LEU 370 Ca 0.00 -0.46 0.08 0.00 -2.89 0.00 0.00 54.13 50.86 1psd s LEU 370 Cb -0.13 -1.13 -0.03 0.00 0.66 0.00 0.00 46.19 45.56 1psd s LEU 370 CO -0.05 -0.06 -0.24 -1.58 -1.89 0.00 0.00 176.35 172.54 1psd s GLN 371 N 1.48 1.61 -0.05 1.98 2.00 -0.19 -5.00 119.66 121.49 1psd s GLN 371 Ca 0.04 -1.02 0.06 0.00 -2.00 0.00 0.00 55.36 52.45 1psd s GLN 371 Cb -0.13 -1.74 -0.01 0.00 0.80 0.00 0.00 33.01 31.93 1psd s GLN 371 CO -0.10 0.45 -0.24 -0.08 -0.50 0.00 0.00 175.29 174.83 1psd s THR 372 N -0.79 1.93 0.84 -0.34 -1.32 -1.26 -1.07 115.64 113.62 1psd s THR 372 Ca 0.10 -1.00 -0.07 0.00 -1.21 0.00 0.00 61.69 59.51 1psd s THR 372 Cb -0.09 -1.63 0.18 0.00 -1.51 0.00 0.00 72.50 69.44 1psd s THR 372 CO 0.02 0.54 1.14 -0.24 -2.21 0.00 0.00 174.62 173.87 1psd n SER 373 N 2.92 0.88 -0.17 8.08 2.88 0.20 -4.95 113.62 123.46 1psd n SER 373 Ca -0.17 -1.90 -0.02 0.00 -1.33 0.00 0.00 58.87 55.45 1psd n SER 373 Cb 0.52 -0.80 0.06 0.00 -0.75 0.00 0.00 64.21 63.24 1psd n SER 373 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1psd h ALA 374 N -1.07 0.45 0.00 -1.46 0.00 -2.00 -3.25 119.26 111.93 1psd h ALA 374 Ca -0.37 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1psd h ALA 374 Cb 1.22 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1psd h ALA 374 CO 0.34 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.17 1psd n GLN 375 N -5.31 0.70 -4.49 0.00 0.00 -1.26 -4.95 117.38 102.07 1psd n GLN 375 Ca 0.06 -0.71 -0.24 0.00 0.00 0.00 0.00 57.00 56.11 1psd n GLN 375 Cb 0.30 -0.76 -0.10 0.00 0.00 0.00 0.00 30.24 29.67 1psd n GLN 375 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.06 178.47 1psd s MET 376 N -0.31 1.71 -0.01 2.61 1.75 -1.23 -1.11 119.30 122.71 1psd s MET 376 Ca 0.00 -1.81 -0.00 0.00 -1.25 0.00 0.00 55.69 52.63 1psd s MET 376 Cb 0.00 -1.72 0.01 0.00 2.84 0.00 0.00 34.83 35.96 1psd s MET 376 CO 0.00 0.27 0.02 0.20 -0.65 0.00 0.00 175.02 174.85 1psd s GLY 377 N -3.53 0.03 -0.07 2.11 0.00 0.92 0.62 107.32 107.40 1psd s GLY 377 Ca 0.30 0.13 0.04 0.00 0.00 0.00 0.00 44.72 45.19 1psd s GLY 377 CO 0.15 0.28 -0.18 -0.47 0.00 0.00 0.00 173.10 172.88 1psd s TYR 378 N 0.41 1.94 0.01 1.90 5.04 -0.24 -1.58 117.35 124.84 1psd s TYR 378 Ca -0.03 -0.70 0.01 0.00 -2.44 0.00 0.00 57.07 53.90 1psd s TYR 378 Cb -0.05 -1.33 -0.01 0.00 0.35 0.00 0.00 41.96 40.92 1psd s TYR 378 CO -0.01 -0.29 -0.03 0.54 -1.34 0.00 0.00 175.55 174.42 1psd s VAL 379 N 0.34 0.20 -0.04 3.14 0.11 -1.08 -1.02 120.40 122.05 1psd s VAL 379 Ca -0.12 -0.48 0.02 0.00 -2.93 0.00 0.00 61.98 58.46 1psd s VAL 379 Cb -0.15 -0.25 0.02 0.00 -1.53 0.00 0.00 36.38 34.47 1psd s VAL 379 CO 0.05 -0.18 -0.07 0.54 -3.33 0.00 0.00 175.10 172.11 1psd s VAL 380 N -0.66 0.68 -0.01 2.04 0.11 -0.50 -0.98 120.40 121.08 1psd s VAL 380 Ca -0.06 -0.24 0.07 0.00 -2.93 0.00 0.00 61.98 58.83 1psd s VAL 380 Cb -0.05 -0.66 -0.02 0.00 -1.53 0.00 0.00 36.38 34.13 1psd s VAL 380 CO -0.00 0.24 -0.23 0.27 -3.33 0.00 0.00 175.10 172.06 1psd s ILE 381 N 0.67 1.78 -0.19 7.04 -4.36 0.32 -2.39 121.20 124.07 1psd s ILE 381 Ca -0.10 -1.00 -0.05 0.00 -0.26 0.00 0.00 60.65 59.23 1psd s ILE 381 Cb -0.13 -1.49 -0.03 0.00 1.25 0.00 0.00 42.46 42.06 1psd s ILE 381 CO 0.01 0.47 0.01 -1.81 0.24 0.00 0.00 174.94 173.86 1psd s ASP 382 N -0.61 5.01 0.08 4.36 1.01 -0.51 -1.59 116.67 124.41 1psd s ASP 382 Ca 0.09 -0.14 0.06 0.00 0.71 0.00 0.00 52.55 53.27 1psd s ASP 382 Cb -0.09 -1.85 -0.03 0.00 1.01 0.00 0.00 42.92 41.96 1psd s ASP 382 CO -0.01 0.09 -0.16 0.27 0.21 0.00 0.00 175.17 175.57 1psd s ILE 383 N 0.84 1.31 -0.92 0.77 -4.36 -0.71 -1.44 121.20 116.69 1psd s ILE 383 Ca 0.01 -1.34 -0.14 0.00 -0.26 0.00 0.00 60.65 58.92 1psd s ILE 383 Cb -0.14 -1.22 0.21 0.00 1.25 0.00 0.00 42.46 42.55 1psd s ILE 383 CO 0.02 -0.14 0.94 -1.61 0.24 0.00 0.00 174.94 174.39 1psd s GLU 384 N -1.71 3.73 0.00 0.37 2.02 -0.32 -4.17 118.70 118.62 1psd s GLU 384 Ca 0.01 -2.44 0.00 0.00 0.02 0.00 0.00 54.97 52.56 1psd s GLU 384 Cb -0.10 -4.60 0.00 0.00 0.10 0.00 0.00 34.13 29.54 1psd s GLU 384 CO 0.03 -1.42 0.00 0.00 0.02 0.00 0.00 175.26 173.89 1psd n ALA 385 N 4.43 0.00 -2.51 5.21 0.00 -1.26 -4.35 120.51 122.04 1psd n ALA 385 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.38 1psd n ALA 385 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.82 1psd n ALA 385 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1psd s ASP 386 N 0.88 2.72 0.31 0.00 1.47 -1.26 -4.78 116.67 116.01 1psd s ASP 386 Ca 0.00 -1.59 0.07 0.00 1.18 0.00 0.00 52.55 52.21 1psd s ASP 386 Cb 0.00 0.34 0.85 0.00 -0.34 0.00 0.00 42.92 43.77 1psd s ASP 386 CO 0.00 -0.84 1.65 -0.33 0.68 0.00 0.00 175.17 176.34 1psd h GLU 387 N 1.86 0.24 0.63 2.11 3.07 -1.98 0.31 114.58 120.83 1psd h GLU 387 Ca -0.37 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.44 1psd h GLU 387 Cb 1.27 -0.05 0.01 0.00 -0.84 0.00 0.00 28.75 29.13 1psd h GLU 387 CO 0.61 0.16 -0.30 -0.44 -1.40 0.00 0.00 179.01 177.64 1psd h ASP 388 N 0.25 -0.72 -0.83 1.42 3.32 -1.99 0.17 116.42 118.04 1psd h ASP 388 Ca 0.62 0.02 0.12 0.00 0.02 0.00 0.00 57.03 57.82 1psd h ASP 388 Cb 1.32 0.19 -0.08 0.00 0.22 0.00 0.00 39.33 40.97 1psd h ASP 388 CO -0.65 -0.49 0.44 0.58 -1.72 0.00 0.00 179.24 177.41 1psd h VAL 389 N -0.90 0.80 0.41 -1.35 2.07 -1.90 0.11 116.25 115.49 1psd h VAL 389 Ca -0.09 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1psd h VAL 389 Cb 0.65 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1psd h VAL 389 CO 0.14 0.12 -0.42 0.00 0.02 0.00 0.00 177.57 177.44 1psd h ALA 390 N 1.51 -1.08 -0.41 1.67 0.00 -0.82 0.70 119.26 120.83 1psd h ALA 390 Ca 0.43 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.27 1psd h ALA 390 Cb 0.53 0.65 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1psd h ALA 390 CO -0.32 -1.11 -0.07 0.93 0.00 0.00 0.00 179.25 178.69 1psd h GLU 391 N -0.82 0.03 -0.68 0.00 4.39 -0.05 0.23 114.58 117.68 1psd h GLU 391 Ca -0.05 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1psd h GLU 391 Cb 0.71 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.32 1psd h GLU 391 CO -0.06 0.02 0.38 0.87 -1.16 0.00 0.00 179.01 179.06 1psd h LYS 392 N 0.03 0.94 0.00 2.33 1.57 -0.60 -1.81 116.57 119.04 1psd h LYS 392 Ca 0.20 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1psd h LYS 392 Cb 0.30 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1psd h LYS 392 CO -0.40 0.69 -0.51 0.00 -0.57 0.00 0.00 179.45 178.66 1psd h ALA 393 N 1.47 0.99 0.32 3.86 0.00 0.25 -3.09 119.26 123.05 1psd h ALA 393 Ca 0.24 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1psd h ALA 393 Cb 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1psd h ALA 393 CO -0.04 0.64 -0.15 1.25 0.00 0.00 0.00 179.25 180.94 1psd h LEU 394 N 0.00 -0.37 -0.70 0.00 5.85 0.22 -2.67 115.31 117.65 1psd h LEU 394 Ca -0.01 -0.05 0.14 0.00 0.84 0.00 0.00 57.88 58.80 1psd h LEU 394 Cb 1.01 0.09 -0.13 0.00 0.37 0.00 0.00 40.66 42.00 1psd h LEU 394 CO 0.07 -0.18 -0.15 1.56 -0.34 0.00 0.00 178.44 179.40 1psd h GLN 395 N -0.53 0.01 -0.23 1.25 4.20 -1.39 -1.16 115.11 117.25 1psd h GLN 395 Ca -0.04 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1psd h GLN 395 Cb 0.40 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1psd h GLN 395 CO 0.07 0.01 0.15 0.00 -0.67 0.00 0.00 178.83 178.39 1psd h ALA 396 N 1.69 0.30 -0.82 3.87 0.00 -1.49 -2.78 119.26 120.02 1psd h ALA 396 Ca 0.34 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.32 1psd h ALA 396 Cb 0.54 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1psd h ALA 396 CO -0.70 -0.22 0.53 0.52 0.00 0.00 0.00 179.25 179.38 1psd h MET 397 N 0.31 0.76 0.00 0.00 2.86 -0.88 0.28 114.93 118.26 1psd h MET 397 Ca 0.09 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1psd h MET 397 Cb -0.03 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.46 1psd h MET 397 CO -0.02 0.50 -0.02 0.87 1.06 0.00 0.00 176.91 179.30 1psd h LYS 398 N 0.78 0.00 -0.96 1.72 1.57 -1.14 -2.81 116.57 115.73 1psd h LYS 398 Ca 0.37 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 58.74 1psd h LYS 398 Cb 0.41 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 32.47 1psd h LYS 398 CO -0.15 0.02 0.53 0.00 -0.57 0.00 0.00 179.45 179.29 1psd n ALA 399 N -2.11 5.13 -2.85 3.86 0.00 0.09 -4.84 120.51 119.79 1psd n ALA 399 Ca -0.01 -2.52 -0.35 0.00 0.00 0.00 0.00 53.44 50.57 1psd n ALA 399 Cb 0.24 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 1psd n ALA 399 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1psd s ILE 400 N -2.93 5.24 -0.31 0.00 1.01 -1.06 -5.02 121.20 118.13 1psd s ILE 400 Ca 0.51 -0.06 -0.33 0.00 0.00 0.00 0.00 60.65 60.77 1psd s ILE 400 Cb 0.43 -3.35 -0.09 0.00 0.01 0.00 0.00 42.46 39.45 1psd s ILE 400 CO 0.10 0.47 2.20 -2.65 0.00 0.00 0.00 174.94 175.07 1psd n PRO 401 N 1.51 1.35 -0.20 2.79 -0.02 -1.26 -1.30 135.00 137.87 1psd n PRO 401 Ca -0.16 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1psd n PRO 401 Cb 0.54 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1psd n PRO 401 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1psd n GLY 402 N 6.31 0.90 3.68 -1.23 0.00 -1.26 -4.89 105.19 108.70 1psd n GLY 402 Ca 0.38 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1psd n GLY 402 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1psd s THR 403 N -2.00 3.91 -0.23 2.61 2.01 -0.42 -1.21 115.64 120.31 1psd s THR 403 Ca 0.00 1.24 -0.01 0.00 0.31 0.00 0.00 61.69 63.23 1psd s THR 403 Cb 0.00 -3.80 -0.19 0.00 0.01 0.00 0.00 72.50 68.52 1psd s THR 403 CO 0.00 -0.03 -0.11 -0.38 -0.69 0.00 0.00 174.62 173.41 1psd n ILE 404 N 4.82 1.55 -3.64 1.82 5.41 -0.08 -4.96 119.36 124.29 1psd n ILE 404 Ca 0.13 -0.57 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 1psd n ILE 404 Cb 0.44 -1.52 -0.03 0.00 -0.71 0.00 0.00 39.64 37.82 1psd n ILE 404 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1psd s ARG 405 N -2.52 1.43 -0.11 0.38 0.52 -0.51 -4.91 118.95 113.23 1psd s ARG 405 Ca -0.33 -0.73 -0.21 0.00 -0.52 0.00 0.00 55.73 53.94 1psd s ARG 405 Cb 0.09 0.57 0.05 0.00 0.52 0.00 0.00 34.95 36.18 1psd s ARG 405 CO 0.63 -0.63 0.51 0.00 0.02 0.00 0.00 175.30 175.83 1psd s ALA 406 N -3.83 -1.29 -0.20 2.13 0.00 -1.26 -0.96 121.76 116.35 1psd s ALA 406 Ca 0.06 1.14 -0.18 0.00 0.00 0.00 0.00 51.96 52.98 1psd s ALA 406 Cb -0.02 -0.39 0.05 0.00 0.00 0.00 0.00 23.12 22.76 1psd s ALA 406 CO -0.05 -0.28 0.53 0.50 0.00 0.00 0.00 175.76 176.46 1psd s ARG 407 N -0.52 0.60 -0.76 0.00 3.52 -0.48 -4.97 118.95 116.34 1psd s ARG 407 Ca -0.06 0.76 -0.17 0.00 -0.13 0.00 0.00 55.73 56.13 1psd s ARG 407 Cb -0.03 0.27 0.16 0.00 -1.56 0.00 0.00 34.95 33.78 1psd s ARG 407 CO 0.04 -0.08 0.81 -1.17 -0.81 0.00 0.00 175.30 174.09 1psd s LEU 408 N 0.44 5.91 0.38 -0.88 2.96 -1.26 -1.03 118.68 125.19 1psd s LEU 408 Ca -0.01 -2.10 0.08 0.00 -0.22 0.00 0.00 54.13 51.87 1psd s LEU 408 Cb -0.04 -2.28 0.75 0.00 0.50 0.00 0.00 46.19 45.11 1psd s LEU 408 CO -0.01 -0.87 1.93 -0.07 -1.32 0.00 0.00 176.35 176.01 1psd h LEU 409 N 9.13 0.35 0.00 -0.68 3.38 -0.49 -3.48 115.31 123.52 1psd h LEU 409 Ca -0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1psd h LEU 409 Cb 1.05 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1psd h LEU 409 CO 0.96 0.43 0.00 0.00 0.09 0.00 0.00 178.44 179.92