#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aor s TYR 2 N 0.00 1.12 0.00 1.12 2.02 -1.26 -4.89 117.35 115.45 1aor s TYR 2 Ca 0.00 -0.95 0.00 0.00 -0.37 0.00 0.00 57.07 55.75 1aor s TYR 2 Cb 0.00 -0.63 0.00 0.00 -0.40 0.00 0.00 41.96 40.93 1aor s TYR 2 CO 0.00 -0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.24 1aor n GLY 3 N -0.17 1.67 3.78 0.71 0.00 -0.12 -4.74 105.19 106.32 1aor n GLY 3 Ca -0.09 0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1aor n GLY 3 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1aor s ASN 4 N -2.30 6.87 0.02 1.61 0.01 -1.26 -4.73 114.94 115.16 1aor s ASN 4 Ca 0.00 2.05 0.04 0.00 -0.71 0.00 0.00 52.86 54.23 1aor s ASN 4 Cb 0.00 -2.59 -0.25 0.00 0.41 0.00 0.00 41.25 38.82 1aor s ASN 4 CO 0.00 -0.41 0.90 -0.50 -1.51 0.00 0.00 177.10 175.58 1aor h TRP 5 N 2.71 0.22 0.00 2.20 4.06 -1.91 -3.46 115.95 119.77 1aor h TRP 5 Ca -0.48 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 60.31 1aor h TRP 5 Cb 1.21 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.36 1aor h TRP 5 CO 0.58 1.20 0.00 0.41 -3.56 0.00 0.00 178.44 177.07 1aor n GLY 6 N 1.57 0.66 3.05 1.49 0.00 -1.26 -4.99 105.19 105.71 1aor n GLY 6 Ca -0.13 -0.62 -0.15 0.00 0.00 0.00 0.00 46.02 45.12 1aor n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1aor s ARG 7 N -1.20 0.56 -0.10 1.61 0.52 -1.26 -1.27 118.95 117.80 1aor s ARG 7 Ca 0.00 -0.64 -0.21 0.00 -0.52 0.00 0.00 55.73 54.36 1aor s ARG 7 Cb 0.00 -0.41 0.05 0.00 0.52 0.00 0.00 34.95 35.11 1aor s ARG 7 CO 0.00 0.09 0.52 -0.59 0.02 0.00 0.00 175.30 175.34 1aor s PHE 8 N -1.03 -0.49 0.22 -0.53 -0.12 0.78 -1.18 117.98 115.63 1aor s PHE 8 Ca -0.06 1.01 -0.19 0.00 -0.05 0.00 0.00 56.93 57.64 1aor s PHE 8 Cb -0.08 0.24 -0.08 0.00 -0.63 0.00 0.00 43.02 42.46 1aor s PHE 8 CO 0.00 -0.42 0.72 0.42 -0.05 0.00 0.00 175.22 175.90 1aor s ILE 9 N -0.64 4.58 -0.13 -4.49 1.01 -0.60 0.48 121.20 121.40 1aor s ILE 9 Ca -0.07 1.27 -0.00 0.00 0.00 0.00 0.00 60.65 61.84 1aor s ILE 9 Cb -0.03 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.62 1aor s ILE 9 CO 0.05 0.20 -0.08 -0.60 0.00 0.00 0.00 174.94 174.50 1aor s ARG 10 N -2.00 1.59 -0.13 2.79 3.52 0.23 -0.47 118.95 124.48 1aor s ARG 10 Ca 0.43 -0.34 0.03 0.00 -0.13 0.00 0.00 55.73 55.72 1aor s ARG 10 Cb -0.16 -1.73 0.01 0.00 -1.56 0.00 0.00 34.95 31.50 1aor s ARG 10 CO 0.21 -0.30 -0.22 0.08 -0.81 0.00 0.00 175.30 174.26 1aor s VAL 11 N 1.67 2.06 -0.55 7.11 1.01 0.10 -0.64 120.40 131.17 1aor s VAL 11 Ca 0.04 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 60.91 1aor s VAL 11 Cb -0.13 -1.81 0.14 0.00 0.00 0.00 0.00 36.38 34.57 1aor s VAL 11 CO -0.08 0.55 0.47 0.21 0.00 0.00 0.00 175.10 176.24 1aor s ASN 12 N 0.76 6.02 0.64 3.32 3.84 0.15 -0.59 114.94 129.08 1aor s ASN 12 Ca -0.08 -1.98 0.41 0.00 0.21 0.00 0.00 52.86 51.41 1aor s ASN 12 Cb -0.16 -2.12 2.15 0.00 -0.55 0.00 0.00 41.25 40.57 1aor s ASN 12 CO -0.01 -0.74 2.27 -0.07 -2.79 0.00 0.00 177.10 175.76 1aor h LEU 13 N 8.52 0.00 -0.44 3.21 3.38 -1.27 0.33 115.31 129.04 1aor h LEU 13 Ca -0.21 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.60 1aor h LEU 13 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1aor h LEU 13 CO 0.92 0.00 -0.49 0.28 0.09 0.00 0.00 178.44 179.25 1aor h SER 14 N 0.00 0.83 0.00 -0.43 0.02 -1.72 -3.29 113.55 108.96 1aor h SER 14 Ca -0.00 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1aor h SER 14 Cb 0.13 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 1aor h SER 14 CO 0.00 1.17 -1.58 0.35 -1.14 0.00 0.00 176.83 175.63 1aor n THR 15 N -4.01 0.04 -0.55 -2.27 -2.24 -1.06 -4.85 114.28 99.35 1aor n THR 15 Ca -0.03 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1aor n THR 15 Cb 0.58 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1aor n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aor n GLY 16 N 1.81 0.69 3.72 3.38 0.00 0.11 -5.04 105.19 109.87 1aor n GLY 16 Ca -0.03 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1aor n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aor s ASP 17 N -2.31 7.17 -0.07 1.61 2.15 -1.07 -4.87 116.67 119.29 1aor s ASP 17 Ca 0.00 1.96 0.05 0.00 0.43 0.00 0.00 52.55 54.99 1aor s ASP 17 Cb 0.00 -2.58 -0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1aor s ASP 17 CO 0.00 -0.38 -0.22 -0.63 -0.17 0.00 0.00 175.17 173.77 1aor s ILE 18 N 0.78 1.83 -0.01 4.11 1.01 -1.26 -0.68 121.20 126.99 1aor s ILE 18 Ca 0.55 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 60.29 1aor s ILE 18 Cb -0.28 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.63 1aor s ILE 18 CO 0.30 0.51 -0.00 -0.54 0.00 0.00 0.00 174.94 175.21 1aor s LYS 19 N 0.14 0.11 -0.24 2.79 1.02 0.19 -4.98 119.74 118.77 1aor s LYS 19 Ca -0.10 0.03 -0.09 0.00 0.02 0.00 0.00 55.97 55.83 1aor s LYS 19 Cb -0.15 -0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 36.91 1aor s LYS 19 CO 0.05 -0.05 0.11 0.08 -0.92 0.00 0.00 175.35 174.62 1aor s VAL 20 N 0.41 4.80 0.29 3.17 1.01 -1.26 0.78 120.40 129.60 1aor s VAL 20 Ca -0.04 -0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.03 1aor s VAL 20 Cb -0.06 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1aor s VAL 20 CO -0.01 0.35 -0.03 -1.61 0.00 0.00 0.00 175.10 173.80 1aor s GLU 21 N 1.27 2.13 0.26 2.72 2.02 0.18 -4.90 118.70 122.37 1aor s GLU 21 Ca 0.06 -1.58 0.06 0.00 0.02 0.00 0.00 54.97 53.53 1aor s GLU 21 Cb -0.14 -2.03 -0.06 0.00 0.10 0.00 0.00 34.13 32.00 1aor s GLU 21 CO 0.05 0.28 -0.06 -1.21 0.02 0.00 0.00 175.26 174.34 1aor s GLU 22 N -3.67 1.49 0.06 1.61 2.02 -1.26 -0.15 118.70 118.80 1aor s GLU 22 Ca 0.32 -1.74 -0.12 0.00 0.02 0.00 0.00 54.97 53.45 1aor s GLU 22 Cb -0.04 -1.07 0.02 0.00 0.10 0.00 0.00 34.13 33.14 1aor s GLU 22 CO 0.19 0.04 0.28 1.52 0.02 0.00 0.00 175.26 177.30 1aor s TYR 23 N -3.07 -0.05 0.53 1.61 1.13 -0.40 -4.96 117.35 112.15 1aor s TYR 23 Ca 0.28 -0.15 -0.00 0.00 -1.41 0.00 0.00 57.07 55.79 1aor s TYR 23 Cb 0.03 0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.98 1aor s TYR 23 CO 0.11 -0.51 0.77 0.16 -2.51 0.00 0.00 175.55 173.57 1aor s ASP 24 N -2.23 5.45 0.60 -0.18 1.47 -1.26 -4.72 116.67 115.79 1aor s ASP 24 Ca -0.03 0.19 0.35 0.00 1.18 0.00 0.00 52.55 54.24 1aor s ASP 24 Cb 0.00 -1.19 1.90 0.00 -0.34 0.00 0.00 42.92 43.30 1aor s ASP 24 CO -0.05 -1.03 2.22 -0.08 0.68 0.00 0.00 175.17 176.91 1aor h GLU 25 N 0.10 0.00 -0.53 2.11 4.81 -1.99 -1.98 114.58 117.10 1aor h GLU 25 Ca -0.44 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 1aor h GLU 25 Cb 1.28 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 1aor h GLU 25 CO 0.55 0.03 0.09 0.93 -0.73 0.00 0.00 179.01 179.89 1aor h GLU 26 N 0.00 0.83 -0.27 1.92 5.08 -1.99 -0.72 114.58 119.43 1aor h GLU 26 Ca -0.00 -0.19 -0.17 0.00 -1.00 0.00 0.00 59.36 58.01 1aor h GLU 26 Cb 0.15 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1aor h GLU 26 CO 0.00 0.77 -0.48 1.25 -1.00 0.00 0.00 179.01 179.55 1aor h LEU 27 N 0.79 0.89 -1.46 1.33 7.12 -1.76 -3.02 115.31 119.20 1aor h LEU 27 Ca 0.17 -0.53 -0.05 0.00 0.13 0.00 0.00 57.88 57.60 1aor h LEU 27 Cb 0.35 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.21 1aor h LEU 27 CO 0.01 1.25 -0.17 0.00 -0.13 0.00 0.00 178.44 179.40 1aor h ALA 28 N 0.66 1.56 0.00 1.25 0.00 -1.38 -1.61 119.26 119.74 1aor h ALA 28 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1aor h ALA 28 Cb 1.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1aor h ALA 28 CO 0.11 0.32 0.00 1.63 0.00 0.00 0.00 179.25 181.31 1aor n LYS 29 N -4.28 0.03 -0.10 0.00 5.02 -0.31 -0.02 118.16 118.50 1aor n LYS 29 Ca -0.01 0.09 -0.13 0.00 -2.02 0.00 0.00 58.31 56.24 1aor n LYS 29 Cb 0.27 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.67 1aor n LYS 29 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1aor n LYS 30 N -1.48 0.73 0.00 1.97 4.81 -0.77 -4.73 118.16 118.70 1aor n LYS 30 Ca 0.06 0.09 0.03 0.00 -0.87 0.00 0.00 58.31 57.62 1aor n LYS 30 Cb 0.27 -1.43 -0.04 0.00 0.02 0.00 0.00 35.03 33.85 1aor n LYS 30 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1aor n TRP 31 N -2.99 0.00 0.00 5.64 7.02 -0.68 -4.80 117.44 121.63 1aor n TRP 31 Ca -0.35 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.13 1aor n TRP 31 Cb 0.94 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.83 1aor n TRP 31 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1aor n LEU 32 N -1.10 0.00 0.00 -0.99 7.94 0.97 -3.89 117.00 119.92 1aor n LEU 32 Ca 0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 1aor n LEU 32 Cb 0.12 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.07 1aor n LEU 32 CO 0.14 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.03 1aor n GLY 33 N 0.00 -2.54 7.00 -3.96 0.00 -1.26 -4.62 105.19 99.81 1aor n GLY 33 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1aor n GLY 33 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aor n SER 34 N 3.00 0.00 -0.19 1.61 2.88 -0.87 -1.12 113.62 118.92 1aor n SER 34 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aor n SER 34 Cb 0.00 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 63.56 1aor n SER 34 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1aor h ARG 35 N 0.00 0.24 0.03 -1.46 2.43 -1.82 -0.16 114.38 113.65 1aor h ARG 35 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1aor h ARG 35 Cb 0.00 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1aor h ARG 35 CO 0.00 0.16 -0.02 0.78 -1.51 0.00 0.00 179.97 179.38 1aor h GLY 36 N 0.25 -0.05 0.99 2.80 0.00 -1.29 -2.36 103.07 103.41 1aor h GLY 36 Ca 0.31 0.02 0.03 0.00 0.00 0.00 0.00 47.33 47.68 1aor h GLY 36 CO -0.40 -0.02 0.61 -2.00 0.00 0.00 0.00 176.54 174.74 1aor h LEU 37 N -0.13 1.03 -0.55 3.11 5.85 -1.35 -2.69 115.31 120.58 1aor h LEU 37 Ca -0.00 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 1aor h LEU 37 Cb 0.11 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1aor h LEU 37 CO 0.01 0.71 0.15 0.00 -0.34 0.00 0.00 178.44 178.97 1aor h ALA 38 N 1.45 0.72 -0.23 1.25 0.00 -0.80 -2.26 119.26 119.39 1aor h ALA 38 Ca 0.36 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1aor h ALA 38 Cb -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1aor h ALA 38 CO -0.10 0.41 -0.29 0.97 0.00 0.00 0.00 179.25 180.24 1aor h ILE 39 N 0.77 1.27 -0.40 0.00 6.09 -1.18 -2.15 117.51 121.91 1aor h ILE 39 Ca 0.17 -1.34 -0.04 0.00 -1.37 0.00 0.00 64.86 62.28 1aor h ILE 39 Cb 0.32 1.42 -0.02 0.00 0.47 0.00 0.00 36.82 39.02 1aor h ILE 39 CO -0.00 0.42 0.09 0.22 -3.07 0.00 0.00 178.15 175.81 1aor h TYR 40 N 0.40 0.68 -0.66 2.19 3.20 -1.35 -1.36 116.97 120.06 1aor h TYR 40 Ca 0.05 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 1aor h TYR 40 Cb 0.72 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 1aor h TYR 40 CO 0.02 0.66 0.31 -0.07 -1.64 0.00 0.00 178.16 177.44 1aor h LEU 41 N 0.51 0.85 -0.08 2.82 3.38 -1.11 -1.12 115.31 120.57 1aor h LEU 41 Ca 0.13 -0.09 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1aor h LEU 41 Cb 0.32 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.86 1aor h LEU 41 CO 0.00 0.73 -0.56 -0.07 0.09 0.00 0.00 178.44 178.63 1aor h LEU 42 N 0.94 0.63 -1.05 1.67 3.38 -1.21 -0.04 115.31 119.62 1aor h LEU 42 Ca 0.23 -0.67 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 1aor h LEU 42 Cb 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1aor h LEU 42 CO -0.03 1.20 0.25 -0.07 0.09 0.00 0.00 178.44 179.89 1aor h LEU 43 N 0.10 0.85 -0.02 1.67 3.38 -1.15 0.24 115.31 120.37 1aor h LEU 43 Ca -0.05 -0.11 -0.23 0.00 0.09 0.00 0.00 57.88 57.57 1aor h LEU 43 Cb 1.22 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 41.77 1aor h LEU 43 CO 0.11 0.76 -0.90 0.50 0.09 0.00 0.00 178.44 179.01 1aor h LYS 44 N 0.91 0.64 0.00 1.13 3.64 -1.22 -3.40 116.57 118.27 1aor h LYS 44 Ca 0.21 -0.66 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1aor h LYS 44 Cb 0.18 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1aor h LYS 44 CO -0.02 1.26 -1.29 0.39 -2.27 0.00 0.00 179.45 177.53 1aor n GLU 45 N -3.96 1.16 -5.10 1.90 1.02 -0.03 -5.03 120.64 110.59 1aor n GLU 45 Ca -0.10 -0.08 -0.30 0.00 -0.02 0.00 0.00 57.16 56.65 1aor n GLU 45 Cb 0.81 -1.28 -0.15 0.00 -0.02 0.00 0.00 31.44 30.79 1aor n GLU 45 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1aor s MET 46 N -2.76 1.95 -0.30 3.49 1.75 0.83 -5.03 119.30 119.21 1aor s MET 46 Ca -0.01 -1.02 -0.29 0.00 -1.25 0.00 0.00 55.69 53.12 1aor s MET 46 Cb 0.10 -2.00 0.00 0.00 2.84 0.00 0.00 34.83 35.77 1aor s MET 46 CO 0.60 0.53 1.28 0.34 -0.65 0.00 0.00 175.02 177.13 1aor s ASP 47 N -0.93 6.70 0.00 1.11 2.15 -1.26 -4.67 116.67 119.76 1aor s ASP 47 Ca 0.11 1.20 0.00 0.00 0.43 0.00 0.00 52.55 54.28 1aor s ASP 47 Cb -0.10 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 1aor s ASP 47 CO 0.01 -1.06 0.93 -2.65 -0.17 0.00 0.00 175.17 172.22 1aor n PRO 48 N 7.27 0.00 0.01 4.34 -0.02 -1.26 -1.73 135.00 143.61 1aor n PRO 48 Ca 0.14 0.43 0.11 0.00 -2.02 0.00 0.00 63.50 62.17 1aor n PRO 48 Cb 0.47 -1.56 0.11 0.00 -0.02 0.00 0.00 33.50 32.50 1aor n PRO 48 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1aor n THR 49 N -1.43 0.05 -1.43 3.45 -1.04 -1.26 -4.35 114.28 108.27 1aor n THR 49 Ca 0.00 -0.06 -0.36 0.00 -2.04 0.00 0.00 64.05 61.58 1aor n THR 49 Cb 0.06 0.40 0.07 0.00 -1.82 0.00 0.00 70.33 69.04 1aor n THR 49 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1aor n VAL 50 N -1.62 2.94 -2.26 12.58 0.24 -0.71 -4.91 118.33 124.59 1aor n VAL 50 Ca 0.04 -0.42 -0.42 0.00 -2.04 0.00 0.00 64.34 61.50 1aor n VAL 50 Cb 0.36 -1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 31.66 1aor n VAL 50 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1aor s ASP 51 N -1.48 6.90 0.45 -1.34 2.15 -1.26 -4.90 116.67 117.19 1aor s ASP 51 Ca 0.73 2.11 0.22 0.00 0.43 0.00 0.00 52.55 56.04 1aor s ASP 51 Cb -0.37 -2.57 1.22 0.00 -0.30 0.00 0.00 42.92 40.90 1aor s ASP 51 CO 0.50 -0.66 1.85 -0.65 -0.17 0.00 0.00 175.17 176.05 1aor h PRO 52 N 7.46 0.26 -0.65 4.34 0.11 -1.88 -0.72 132.00 140.92 1aor h PRO 52 Ca -0.39 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1aor h PRO 52 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1aor h PRO 52 CO 0.88 0.17 0.00 1.28 -0.21 0.00 0.00 178.00 180.12 1aor n LEU 53 N -4.45 3.85 -4.90 2.35 4.77 -1.26 -4.76 117.00 112.61 1aor n LEU 53 Ca 0.20 -1.87 -0.28 0.00 -0.03 0.00 0.00 56.01 54.03 1aor n LEU 53 Cb 0.82 -0.43 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1aor n LEU 53 CO 0.33 0.93 0.46 -0.94 -1.33 0.00 0.00 177.39 176.84 1aor s SER 54 N -1.13 6.33 0.00 -1.43 1.04 -0.28 -4.94 113.70 113.29 1aor s SER 54 Ca 0.47 1.02 0.12 0.00 0.48 0.00 0.00 55.95 58.04 1aor s SER 54 Cb 0.25 -2.28 0.68 0.00 0.10 0.00 0.00 66.02 64.77 1aor s SER 54 CO 0.33 -0.55 1.24 -0.81 0.98 0.00 0.00 173.24 174.43 1aor n PRO 55 N -2.04 0.28 0.17 4.02 -0.04 -1.26 -2.37 135.00 133.76 1aor n PRO 55 Ca 0.01 0.09 0.07 0.00 -0.04 0.00 0.00 63.50 63.63 1aor n PRO 55 Cb 0.55 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.59 1aor n PRO 55 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1aor h GLU 56 N 0.00 0.00 -7.15 0.54 3.07 -1.87 -2.26 114.58 106.92 1aor h GLU 56 Ca 0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.34 1aor h GLU 56 Cb 0.06 0.00 0.11 0.00 -0.84 0.00 0.00 28.75 28.07 1aor h GLU 56 CO 0.00 0.24 0.41 1.21 -1.40 0.00 0.00 179.01 179.47 1aor s ASN 57 N -6.28 5.12 0.02 1.42 3.04 -1.00 -4.92 114.94 112.35 1aor s ASN 57 Ca 0.05 2.18 0.09 0.00 0.04 0.00 0.00 52.86 55.22 1aor s ASN 57 Cb 0.06 -2.57 -0.03 0.00 -1.54 0.00 0.00 41.25 37.17 1aor s ASN 57 CO 0.71 -1.63 -0.26 -0.54 -3.04 0.00 0.00 177.10 172.34 1aor s LYS 58 N -3.71 1.89 -0.19 0.43 1.02 -1.26 -4.46 119.74 113.47 1aor s LYS 58 Ca 0.72 -1.05 -0.03 0.00 0.02 0.00 0.00 55.97 55.63 1aor s LYS 58 Cb -0.25 -1.99 -0.02 0.00 -0.52 0.00 0.00 37.83 35.06 1aor s LYS 58 CO 0.37 0.52 -0.05 -1.17 -0.92 0.00 0.00 175.35 174.10 1aor s LEU 59 N -1.04 3.00 -0.22 3.17 2.96 -0.77 -4.50 118.68 121.28 1aor s LEU 59 Ca 0.11 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 1aor s LEU 59 Cb -0.10 -1.74 0.04 0.00 0.50 0.00 0.00 46.19 44.89 1aor s LEU 59 CO 0.01 0.07 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.32 1aor s ILE 60 N 0.97 2.11 -0.33 6.68 1.01 -0.57 -0.88 121.20 130.19 1aor s ILE 60 Ca -0.00 -1.30 -0.11 0.00 0.00 0.00 0.00 60.65 59.24 1aor s ILE 60 Cb -0.15 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 1aor s ILE 60 CO 0.01 0.24 0.20 -0.63 0.00 0.00 0.00 174.94 174.76 1aor s ILE 61 N 1.19 4.92 -0.03 2.92 1.09 -0.72 -0.47 121.20 130.11 1aor s ILE 61 Ca -0.02 -0.33 0.01 0.00 -1.10 0.00 0.00 60.65 59.20 1aor s ILE 61 Cb -0.17 -3.53 0.02 0.00 -1.06 0.00 0.00 42.46 37.73 1aor s ILE 61 CO -0.09 0.02 -0.01 0.00 -0.10 0.00 0.00 174.94 174.76 1aor s ALA 62 N 1.66 0.37 0.75 9.38 0.00 0.25 -1.12 121.76 133.06 1aor s ALA 62 Ca 0.05 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.04 1aor s ALA 62 Cb -0.17 -0.30 0.10 0.00 0.00 0.00 0.00 23.12 22.75 1aor s ALA 62 CO 0.08 -0.04 1.06 0.00 0.00 0.00 0.00 175.76 176.86 1aor s ALA 63 N 0.87 3.13 0.44 0.00 0.00 0.43 -1.25 121.76 125.39 1aor s ALA 63 Ca -0.09 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 50.73 1aor s ALA 63 Cb -0.12 -2.47 -0.04 0.00 0.00 0.00 0.00 23.12 20.49 1aor s ALA 63 CO -0.01 -1.55 0.13 0.20 0.00 0.00 0.00 175.76 174.53 1aor s GLY 64 N -4.64 2.51 0.39 0.00 0.00 -1.26 -2.06 107.32 102.26 1aor s GLY 64 Ca 0.64 -1.77 0.13 0.00 0.00 0.00 0.00 44.72 43.72 1aor s GLY 64 CO 0.46 -2.01 1.88 -0.56 0.00 0.00 0.00 173.10 172.87 1aor h PRO 65 N 1.43 0.52 -0.02 2.90 0.13 -1.68 -1.80 132.00 133.48 1aor h PRO 65 Ca -0.43 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1aor h PRO 65 Cb 1.27 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1aor h PRO 65 CO 0.72 0.34 -0.02 1.28 -0.23 0.00 0.00 178.00 180.10 1aor n LEU 66 N -4.52 1.52 -4.69 1.56 4.77 -0.09 -4.20 117.00 111.34 1aor n LEU 66 Ca 0.17 -0.50 -0.42 0.00 -0.03 0.00 0.00 56.01 55.22 1aor n LEU 66 Cb 0.53 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1aor n LEU 66 CO 0.31 0.25 1.05 -0.89 -1.33 0.00 0.00 177.39 176.78 1aor s THR 67 N -2.03 3.90 0.00 -5.08 2.01 -0.68 -2.65 115.64 111.11 1aor s THR 67 Ca 0.37 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.64 1aor s THR 67 Cb 0.21 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.90 1aor s THR 67 CO 0.35 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.89 1aor n GLY 68 N 3.52 0.74 1.78 4.40 0.00 0.79 -4.87 105.19 111.56 1aor n GLY 68 Ca 0.12 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1aor n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aor n THR 69 N -2.49 0.00 0.94 2.61 -2.24 -1.08 -4.46 114.28 107.56 1aor n THR 69 Ca 0.00 -1.09 0.10 0.00 -2.27 0.00 0.00 64.05 60.79 1aor n THR 69 Cb 0.00 -0.04 0.30 0.00 -2.10 0.00 0.00 70.33 68.50 1aor n THR 69 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1aor n SER 70 N -1.56 2.12 -4.71 3.42 3.41 -1.26 -4.63 113.62 110.41 1aor n SER 70 Ca -0.05 -1.82 -0.42 0.00 -0.26 0.00 0.00 58.87 56.31 1aor n SER 70 Cb 0.30 -0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1aor n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aor n ALA 71 N 0.63 1.60 -1.65 7.33 0.00 -1.26 -4.80 120.51 122.35 1aor n ALA 71 Ca 0.16 0.36 -0.49 0.00 0.00 0.00 0.00 53.44 53.48 1aor n ALA 71 Cb 0.39 -2.31 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 1aor n ALA 71 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1aor n PRO 72 N 0.87 1.93 -1.01 0.00 -0.02 -1.26 -0.96 135.00 134.55 1aor n PRO 72 Ca 0.05 0.68 -0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1aor n PRO 72 Cb 0.36 -2.61 -0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1aor n PRO 72 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1aor n THR 73 N 5.54 0.00 -1.32 3.45 -1.04 -0.12 -4.76 114.28 116.03 1aor n THR 73 Ca 0.26 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.89 1aor n THR 73 Cb 0.28 -0.27 -0.02 0.00 -1.82 0.00 0.00 70.33 68.50 1aor n THR 73 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aor n GLY 74 N -2.94 3.69 0.79 3.41 0.00 -0.14 -3.89 105.19 106.10 1aor n GLY 74 Ca -0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1aor n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aor n GLY 75 N 4.04 0.73 3.92 -0.02 0.00 -1.17 -0.14 105.19 112.54 1aor n GLY 75 Ca 0.56 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 46.09 1aor n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1aor s ARG 76 N 0.00 3.52 0.18 1.61 1.81 -0.88 -4.38 118.95 120.82 1aor s ARG 76 Ca 0.08 -0.30 -0.09 0.00 -1.72 0.00 0.00 55.73 53.70 1aor s ARG 76 Cb 0.09 -2.91 -0.01 0.00 -0.45 0.00 0.00 34.95 31.67 1aor s ARG 76 CO -0.04 0.49 0.29 1.52 -0.68 0.00 0.00 175.30 176.88 1aor s TYR 77 N -1.68 0.47 0.16 -0.53 1.13 -0.85 -4.07 117.35 111.98 1aor s TYR 77 Ca 0.38 -0.82 0.08 0.00 -1.41 0.00 0.00 57.07 55.30 1aor s TYR 77 Cb -0.12 -0.08 -0.04 0.00 -1.10 0.00 0.00 41.96 40.62 1aor s TYR 77 CO 0.27 -0.74 -0.18 -0.80 -2.51 0.00 0.00 175.55 171.59 1aor s ASN 78 N -2.99 2.67 -0.14 -0.18 0.01 -0.38 -1.24 114.94 112.69 1aor s ASN 78 Ca 0.20 -0.84 0.03 0.00 -0.71 0.00 0.00 52.86 51.53 1aor s ASN 78 Cb 0.03 -0.16 0.01 0.00 0.41 0.00 0.00 41.25 41.55 1aor s ASN 78 CO 0.02 -0.03 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.68 1aor s VAL 79 N -1.96 2.04 -0.03 1.60 1.01 0.47 -0.58 120.40 122.95 1aor s VAL 79 Ca 0.15 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.19 1aor s VAL 79 Cb -0.06 -1.80 -0.00 0.00 0.00 0.00 0.00 36.38 34.52 1aor s VAL 79 CO 0.06 0.55 -0.13 -0.69 0.00 0.00 0.00 175.10 174.89 1aor s VAL 80 N 0.78 1.10 0.11 2.92 1.01 0.38 -0.49 120.40 126.21 1aor s VAL 80 Ca -0.08 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 1aor s VAL 80 Cb -0.16 -0.95 0.08 0.00 0.00 0.00 0.00 36.38 35.35 1aor s VAL 80 CO -0.01 0.33 1.11 0.28 0.00 0.00 0.00 175.10 176.81 1aor s THR 81 N 0.06 0.00 -0.05 3.92 -1.32 -0.97 -1.52 115.64 115.76 1aor s THR 81 Ca -0.02 -0.46 -0.24 0.00 -1.21 0.00 0.00 61.69 59.75 1aor s THR 81 Cb -0.09 -2.63 -0.04 0.00 -1.51 0.00 0.00 72.50 68.23 1aor s THR 81 CO 0.01 0.00 0.74 -0.75 -2.21 0.00 0.00 174.62 172.41 1aor s LYS 82 N -2.35 4.46 0.08 7.08 2.20 -1.26 -1.59 119.74 128.36 1aor s LYS 82 Ca 0.21 0.97 -0.30 0.00 -0.36 0.00 0.00 55.97 56.48 1aor s LYS 82 Cb -0.01 -3.44 -0.06 0.00 -1.51 0.00 0.00 37.83 32.81 1aor s LYS 82 CO 0.02 0.06 1.09 0.45 -0.36 0.00 0.00 175.35 176.61 1aor s SER 83 N 0.79 7.25 0.34 1.43 0.15 0.78 -4.81 113.70 119.64 1aor s SER 83 Ca 0.40 1.92 0.18 0.00 0.70 0.00 0.00 55.95 59.14 1aor s SER 83 Cb -0.18 -2.58 0.45 0.00 -1.71 0.00 0.00 66.02 62.00 1aor s SER 83 CO 0.20 -0.30 1.62 -0.65 1.20 0.00 0.00 173.24 175.31 1aor h PRO 84 N 6.18 0.00 0.03 5.44 0.11 -1.84 -0.04 132.00 141.88 1aor h PRO 84 Ca -0.42 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1aor h PRO 84 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1aor h PRO 84 CO 0.76 0.43 -0.02 1.25 -0.21 0.00 0.00 178.00 180.21 1aor h LEU 85 N 0.00 -0.04 0.00 2.35 5.85 -1.73 -3.40 115.31 118.34 1aor h LEU 85 Ca -0.00 -0.62 -0.22 0.00 0.84 0.00 0.00 57.88 57.87 1aor h LEU 85 Cb 1.09 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1aor h LEU 85 CO 0.06 0.73 -1.92 0.35 -0.34 0.00 0.00 178.44 177.31 1aor n THR 86 N -4.73 1.05 -0.70 1.05 -2.24 -1.25 -4.87 114.28 102.60 1aor n THR 86 Ca -0.07 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 60.98 1aor n THR 86 Cb 0.32 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1aor n THR 86 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aor n GLY 87 N 1.51 0.79 2.01 3.38 0.00 -0.03 -4.89 105.19 107.96 1aor n GLY 87 Ca -0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 1aor n GLY 87 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1aor n PHE 88 N -2.21 0.30 -2.19 1.61 3.72 -1.26 -4.78 117.46 112.65 1aor n PHE 88 Ca 0.00 -1.35 -0.36 0.00 -0.05 0.00 0.00 57.45 55.70 1aor n PHE 88 Cb 0.00 -0.20 0.01 0.00 -0.94 0.00 0.00 39.48 38.35 1aor n PHE 88 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1aor s ILE 89 N -1.89 3.00 -0.06 4.37 1.10 -1.26 -0.15 121.20 126.31 1aor s ILE 89 Ca 0.04 0.64 -0.04 0.00 -0.51 0.00 0.00 60.65 60.77 1aor s ILE 89 Cb -0.00 -3.26 0.02 0.00 0.15 0.00 0.00 42.46 39.37 1aor s ILE 89 CO 0.02 -0.12 0.14 0.28 -2.11 0.00 0.00 174.94 173.15 1aor s THR 90 N -1.69 -0.02 -0.15 4.00 -1.32 -0.62 -4.28 115.64 111.55 1aor s THR 90 Ca 0.73 0.08 -0.00 0.00 -1.21 0.00 0.00 61.69 61.29 1aor s THR 90 Cb -0.26 -0.22 0.03 0.00 -1.51 0.00 0.00 72.50 70.54 1aor s THR 90 CO 0.30 0.03 -0.08 0.00 -2.21 0.00 0.00 174.62 172.66 1aor s MET 91 N 0.56 1.63 -0.19 7.08 0.23 -1.26 -2.29 119.30 125.07 1aor s MET 91 Ca -0.04 -0.48 -0.03 0.00 -1.03 0.00 0.00 55.69 54.11 1aor s MET 91 Cb -0.06 -1.95 -0.01 0.00 -1.53 0.00 0.00 34.83 31.29 1aor s MET 91 CO -0.03 -0.36 -0.07 0.00 -2.03 0.00 0.00 175.02 172.54 1aor s ALA 92 N 1.61 2.79 0.02 3.16 0.00 0.35 -4.93 121.76 124.76 1aor s ALA 92 Ca 0.02 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.87 1aor s ALA 92 Cb -0.14 -1.55 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 1aor s ALA 92 CO -0.08 -0.17 0.29 1.21 0.00 0.00 0.00 175.76 177.01 1aor s ASN 93 N 1.03 6.52 -0.01 0.00 3.84 -1.26 -0.40 114.94 124.66 1aor s ASN 93 Ca 0.00 0.59 -0.09 0.00 0.21 0.00 0.00 52.86 53.57 1aor s ASN 93 Cb -0.15 -2.10 0.01 0.00 -0.55 0.00 0.00 41.25 38.46 1aor s ASN 93 CO -0.00 0.23 0.19 -0.55 -2.79 0.00 0.00 177.10 174.18 1aor s SER 94 N -1.75 -0.05 0.00 -4.21 0.15 -0.38 -4.21 113.70 103.25 1aor s SER 94 Ca 0.29 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1aor s SER 94 Cb -0.13 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.43 1aor s SER 94 CO 0.17 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.86 1aor n GLY 95 N 1.57 2.63 4.73 9.45 0.00 -1.26 -2.00 105.19 120.30 1aor n GLY 95 Ca -0.21 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1aor n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aor n GLY 96 N 5.00 0.54 0.00 -0.02 0.00 -1.26 -4.43 105.19 105.02 1aor n GLY 96 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1aor n GLY 96 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1aor n TYR 97 N 8.10 0.00 -0.05 1.61 4.02 -1.26 -1.25 117.16 128.33 1aor n TYR 97 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 1aor n TYR 97 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 1aor n TYR 97 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1aor h PHE 98 N 0.00 0.20 -0.68 -0.72 3.57 -1.89 -2.44 116.94 114.98 1aor h PHE 98 Ca 0.00 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.63 1aor h PHE 98 Cb 0.00 -0.06 -0.09 0.00 2.79 0.00 0.00 35.95 38.59 1aor h PHE 98 CO 0.00 0.12 0.24 0.78 -2.23 0.00 0.00 178.31 177.21 1aor h GLY 99 N 0.23 0.97 1.00 2.40 0.00 -1.83 -1.67 103.07 104.17 1aor h GLY 99 Ca 0.09 -0.11 -0.11 0.00 0.00 0.00 0.00 47.33 47.20 1aor h GLY 99 CO -0.06 -0.08 -0.19 0.00 0.00 0.00 0.00 176.54 176.22 1aor h ALA 100 N 1.50 0.53 -0.93 3.60 0.00 -1.73 -3.05 119.26 119.18 1aor h ALA 100 Ca 0.36 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1aor h ALA 100 Cb 0.52 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 1aor h ALA 100 CO -0.38 0.47 0.59 1.49 0.00 0.00 0.00 179.25 181.42 1aor h GLU 101 N 0.58 1.03 -0.71 0.00 4.57 -0.85 0.97 114.58 120.16 1aor h GLU 101 Ca 0.08 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1aor h GLU 101 Cb 0.74 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 1aor h GLU 101 CO 0.06 0.68 0.35 1.25 -1.18 0.00 0.00 179.01 180.16 1aor h LEU 102 N 1.06 0.91 -0.54 1.64 5.85 -1.28 -1.16 115.31 121.79 1aor h LEU 102 Ca 0.41 -0.10 -0.15 0.00 0.84 0.00 0.00 57.88 58.88 1aor h LEU 102 Cb 0.19 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1aor h LEU 102 CO -0.18 0.77 -0.51 0.11 -0.34 0.00 0.00 178.44 178.29 1aor h LYS 103 N 1.01 0.59 0.00 1.25 1.79 -0.99 -2.63 116.57 117.58 1aor h LYS 103 Ca 0.25 -0.35 -0.05 0.00 -2.18 0.00 0.00 60.65 58.32 1aor h LYS 103 Cb 0.09 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1aor h LYS 103 CO -0.03 0.95 -0.22 0.74 -1.08 0.00 0.00 179.45 179.81 1aor h PHE 104 N 0.46 0.00 0.00 -1.35 0.04 -0.30 -0.34 116.94 115.45 1aor h PHE 104 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1aor h PHE 104 Cb 1.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.19 1aor h PHE 104 CO 0.04 0.22 0.00 0.00 -0.60 0.00 0.00 178.31 177.97 1aor n ALA 105 N -2.43 2.05 -0.23 2.45 0.00 -0.49 -0.50 120.51 121.36 1aor n ALA 105 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1aor n ALA 105 Cb 0.29 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1aor n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aor n GLY 106 N 0.83 0.95 3.27 0.00 0.00 -0.14 -4.42 105.19 105.68 1aor n GLY 106 Ca 0.05 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1aor n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aor s TYR 107 N -2.00 1.61 -0.18 1.61 2.02 -1.09 -4.78 117.35 114.54 1aor s TYR 107 Ca 0.00 -0.47 0.14 0.00 -0.37 0.00 0.00 57.07 56.36 1aor s TYR 107 Cb 0.00 -0.85 -0.24 0.00 -0.40 0.00 0.00 41.96 40.47 1aor s TYR 107 CO 0.00 0.20 0.15 -0.25 -1.57 0.00 0.00 175.55 174.08 1aor n ASP 108 N 0.78 0.55 -3.70 2.29 8.00 -0.33 -3.83 116.55 120.31 1aor n ASP 108 Ca -0.17 0.07 -0.10 0.00 0.71 0.00 0.00 54.79 55.30 1aor n ASP 108 Cb 0.55 0.51 -0.04 0.00 -0.02 0.00 0.00 41.12 42.13 1aor n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1aor s ALA 109 N -2.52 -0.29 -0.04 2.24 0.00 -1.26 -0.43 121.76 119.47 1aor s ALA 109 Ca -0.13 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 50.93 1aor s ALA 109 Cb 0.07 1.00 0.03 0.00 0.00 0.00 0.00 23.12 24.21 1aor s ALA 109 CO 0.79 -0.89 0.03 0.42 0.00 0.00 0.00 175.76 176.12 1aor s ILE 110 N -3.60 0.04 -0.33 0.00 1.01 -0.28 -1.56 121.20 116.48 1aor s ILE 110 Ca 0.21 0.28 -0.07 0.00 0.00 0.00 0.00 60.65 61.08 1aor s ILE 110 Cb -0.02 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.24 1aor s ILE 110 CO 0.11 0.18 0.11 -0.69 0.00 0.00 0.00 174.94 174.64 1aor s VAL 111 N 1.80 3.89 -0.23 2.92 1.01 0.38 -1.76 120.40 128.41 1aor s VAL 111 Ca 0.01 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 1aor s VAL 111 Cb -0.12 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 1aor s VAL 111 CO -0.03 -0.11 0.19 -0.69 0.00 0.00 0.00 175.10 174.46 1aor s VAL 112 N 1.44 5.34 0.26 2.92 1.01 -0.06 -0.72 120.40 130.60 1aor s VAL 112 Ca -0.00 0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.32 1aor s VAL 112 Cb -0.19 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1aor s VAL 112 CO 0.03 0.33 -0.13 -1.61 0.00 0.00 0.00 175.10 173.73 1aor s GLU 113 N 1.09 1.54 3.31 2.72 2.02 0.24 -1.84 118.70 127.78 1aor s GLU 113 Ca 0.09 -1.74 0.00 0.00 0.02 0.00 0.00 54.97 53.34 1aor s GLU 113 Cb -0.14 -1.36 0.00 0.00 0.10 0.00 0.00 34.13 32.73 1aor s GLU 113 CO 0.05 0.17 0.00 0.41 0.02 0.00 0.00 175.26 175.91 1aor n GLY 114 N -0.55 0.12 3.56 -1.39 0.00 -0.85 -0.82 105.19 105.27 1aor n GLY 114 Ca -0.06 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 1aor n GLY 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1aor s LYS 115 N 0.00 0.67 0.47 1.61 2.20 -1.26 -4.69 119.74 118.74 1aor s LYS 115 Ca 0.00 1.09 -0.21 0.00 -0.36 0.00 0.00 55.97 56.49 1aor s LYS 115 Cb 0.00 0.16 -0.08 0.00 -1.51 0.00 0.00 37.83 36.40 1aor s LYS 115 CO 0.00 -0.14 1.06 0.00 -0.36 0.00 0.00 175.35 175.91 1aor s ALA 116 N 1.33 2.91 0.31 3.13 0.00 -0.53 -2.97 121.76 125.93 1aor s ALA 116 Ca -0.08 0.68 0.06 0.00 0.00 0.00 0.00 51.96 52.62 1aor s ALA 116 Cb -0.05 -3.28 0.51 0.00 0.00 0.00 0.00 23.12 20.29 1aor s ALA 116 CO -0.14 -0.36 1.76 1.49 0.00 0.00 0.00 175.76 178.50 1aor h GLU 117 N 1.79 0.33 -4.40 0.00 4.57 -1.89 -3.42 114.58 111.56 1aor h GLU 117 Ca -0.49 -0.13 -0.18 0.00 -1.18 0.00 0.00 59.36 57.39 1aor h GLU 117 Cb 1.23 -0.02 -0.15 0.00 -0.16 0.00 0.00 28.75 29.65 1aor h GLU 117 CO 0.60 0.60 -0.64 0.15 -1.18 0.00 0.00 179.01 178.53 1aor s LYS 118 N -4.41 0.91 0.18 1.92 3.01 -1.26 -5.09 119.74 114.99 1aor s LYS 118 Ca -0.06 -1.41 -0.33 0.00 -1.01 0.00 0.00 55.97 53.16 1aor s LYS 118 Cb 0.14 0.24 -0.14 0.00 -1.01 0.00 0.00 37.83 37.07 1aor s LYS 118 CO 0.77 -0.25 1.56 -2.30 0.51 0.00 0.00 175.35 175.63 1aor n PRO 119 N -0.08 2.16 -4.19 -1.68 -0.02 -1.26 -4.88 135.00 125.06 1aor n PRO 119 Ca -0.06 0.78 -0.12 0.00 -2.02 0.00 0.00 63.50 62.08 1aor n PRO 119 Cb 0.63 -2.53 -0.10 0.00 -0.02 0.00 0.00 33.50 31.48 1aor n PRO 119 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1aor s VAL 120 N 0.75 0.02 0.01 -1.45 -7.23 -0.60 -0.80 120.40 111.10 1aor s VAL 120 Ca 0.77 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.97 1aor s VAL 120 Cb -0.67 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 33.84 1aor s VAL 120 CO 0.40 -0.08 -0.02 -0.72 -0.31 0.00 0.00 175.10 174.37 1aor s TYR 121 N -4.14 0.20 -0.11 2.82 -0.85 0.10 -1.24 117.35 114.13 1aor s TYR 121 Ca 0.36 -0.34 -0.15 0.00 -0.52 0.00 0.00 57.07 56.42 1aor s TYR 121 Cb 0.07 -0.14 -0.05 0.00 0.38 0.00 0.00 41.96 42.22 1aor s TYR 121 CO 0.10 -0.12 0.36 0.42 -1.52 0.00 0.00 175.55 174.79 1aor s ILE 122 N -0.93 5.23 -0.13 -3.49 1.01 -0.10 -0.59 121.20 122.19 1aor s ILE 122 Ca -0.10 0.70 0.01 0.00 0.00 0.00 0.00 60.65 61.26 1aor s ILE 122 Cb -0.06 -3.69 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 1aor s ILE 122 CO -0.01 0.42 -0.17 -0.47 0.00 0.00 0.00 174.94 174.72 1aor s TYR 123 N 0.11 2.73 -0.05 3.97 5.04 0.11 -0.20 117.35 129.06 1aor s TYR 123 Ca 0.20 -0.92 0.02 0.00 -2.44 0.00 0.00 57.07 53.94 1aor s TYR 123 Cb -0.14 -1.82 0.01 0.00 0.35 0.00 0.00 41.96 40.36 1aor s TYR 123 CO 0.08 -0.37 -0.10 0.42 -1.34 0.00 0.00 175.55 174.23 1aor s ILE 124 N 0.53 0.95 -0.36 3.14 1.01 0.32 -0.17 121.20 126.61 1aor s ILE 124 Ca -0.11 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.16 1aor s ILE 124 Cb -0.16 -0.88 0.14 0.00 0.01 0.00 0.00 42.46 41.58 1aor s ILE 124 CO 0.04 0.31 0.23 -0.75 0.00 0.00 0.00 174.94 174.77 1aor s LYS 125 N 0.59 0.60 6.97 2.79 2.20 0.40 -0.81 119.74 132.48 1aor s LYS 125 Ca -0.11 -1.44 0.00 0.00 -0.36 0.00 0.00 55.97 54.06 1aor s LYS 125 Cb -0.14 -1.31 0.00 0.00 -1.51 0.00 0.00 37.83 34.87 1aor s LYS 125 CO 0.02 -1.24 0.00 -0.25 -0.36 0.00 0.00 175.35 173.53 1aor n ASP 126 N 3.87 0.00 0.17 1.43 8.00 -0.58 -1.10 116.55 128.34 1aor n ASP 126 Ca 0.15 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.78 1aor n ASP 126 Cb 0.39 0.00 0.45 0.00 -0.02 0.00 0.00 41.12 41.93 1aor n ASP 126 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1aor h GLU 127 N 0.00 0.00 -6.24 -1.24 4.39 -1.93 -3.43 114.58 106.13 1aor h GLU 127 Ca 0.00 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.11 1aor h GLU 127 Cb 0.00 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 1aor h GLU 127 CO 0.00 0.00 0.66 -1.58 -1.16 0.00 0.00 179.01 176.93 1aor s HIS 128 N -3.31 2.97 -0.15 4.33 2.46 -0.26 -5.02 115.29 116.31 1aor s HIS 128 Ca 0.06 0.62 0.01 0.00 0.47 0.00 0.00 55.06 56.22 1aor s HIS 128 Cb 0.09 -3.93 0.00 0.00 -0.13 0.00 0.00 32.58 28.62 1aor s HIS 128 CO 0.54 -1.02 -0.17 0.42 -2.47 0.00 0.00 174.74 172.04 1aor s ILE 129 N 3.77 2.49 -0.03 0.89 1.01 -1.26 -0.46 121.20 127.62 1aor s ILE 129 Ca 0.40 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 1aor s ILE 129 Cb -0.10 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.35 1aor s ILE 129 CO 0.24 0.52 0.07 -0.70 0.00 0.00 0.00 174.94 175.08 1aor s GLU 130 N 0.86 0.05 -0.38 2.79 2.12 0.76 -5.00 118.70 119.89 1aor s GLU 130 Ca -0.05 0.18 -0.16 0.00 0.36 0.00 0.00 54.97 55.30 1aor s GLU 130 Cb -0.15 -0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.15 1aor s GLU 130 CO -0.01 -0.09 0.40 0.42 -0.54 0.00 0.00 175.26 175.43 1aor s ILE 131 N 0.57 5.13 0.21 -3.70 1.01 -1.26 0.07 121.20 123.23 1aor s ILE 131 Ca -0.04 -0.17 0.07 0.00 0.00 0.00 0.00 60.65 60.51 1aor s ILE 131 Cb -0.06 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 1aor s ILE 131 CO -0.02 -0.26 0.05 -0.13 0.00 0.00 0.00 174.94 174.58 1aor s ARG 132 N 2.06 2.53 0.31 2.79 0.52 0.24 -4.93 118.95 122.47 1aor s ARG 132 Ca 0.12 -1.14 -0.29 0.00 -0.52 0.00 0.00 55.73 53.90 1aor s ARG 132 Cb -0.17 -2.39 -0.10 0.00 0.52 0.00 0.00 34.95 32.82 1aor s ARG 132 CO 0.12 0.43 1.23 0.34 0.02 0.00 0.00 175.30 177.45 1aor s ASP 133 N -3.28 6.96 -0.07 0.23 2.15 -1.26 0.03 116.67 121.42 1aor s ASP 133 Ca 0.30 2.52 0.10 0.00 0.43 0.00 0.00 52.55 55.90 1aor s ASP 133 Cb -0.08 -2.64 0.16 0.00 -0.30 0.00 0.00 42.92 40.06 1aor s ASP 133 CO 0.21 -0.39 1.08 0.00 -0.17 0.00 0.00 175.17 175.90 1aor n ALA 134 N 1.03 2.19 0.33 3.66 0.00 0.02 -4.68 120.51 123.05 1aor n ALA 134 Ca -0.00 -1.88 0.21 0.00 0.00 0.00 0.00 53.44 51.77 1aor n ALA 134 Cb 0.43 -0.45 1.15 0.00 0.00 0.00 0.00 19.45 20.59 1aor n ALA 134 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1aor h SER 135 N 0.06 0.00 0.36 0.00 0.02 -1.91 0.00 113.55 112.08 1aor h SER 135 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1aor h SER 135 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1aor h SER 135 CO 0.00 0.00 -1.32 0.00 -1.14 0.00 0.00 176.83 174.37 1aor n HIS 136 N -3.21 0.29 -0.03 3.45 1.44 -1.26 -4.09 115.22 111.81 1aor n HIS 136 Ca -0.03 0.08 -0.09 0.00 -2.01 0.00 0.00 57.72 55.68 1aor n HIS 136 Cb 0.09 -0.51 -0.14 0.00 0.12 0.00 0.00 29.99 29.55 1aor n HIS 136 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 1aor n ILE 137 N -2.14 1.58 -1.70 0.61 2.08 -0.35 -4.90 119.36 114.55 1aor n ILE 137 Ca -0.00 -0.80 -0.53 0.00 0.56 0.00 0.00 62.75 61.97 1aor n ILE 137 Cb 0.49 -0.97 -0.06 0.00 -0.75 0.00 0.00 39.64 38.35 1aor n ILE 137 CO 0.00 0.00 0.00 1.87 0.56 0.00 0.00 176.55 178.98 1aor n TRP 138 N -3.01 2.18 0.00 1.39 -0.00 -0.16 -1.05 117.44 116.79 1aor n TRP 138 Ca -0.19 0.28 0.00 0.00 -0.00 0.00 0.00 57.50 57.59 1aor n TRP 138 Cb 1.07 -2.56 0.00 0.00 -0.00 0.00 0.00 31.31 29.82 1aor n TRP 138 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1aor n GLY 139 N 4.28 0.73 3.89 5.87 0.00 -1.26 -5.02 105.19 113.69 1aor n GLY 139 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 1aor n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aor s LYS 140 N -0.57 3.69 0.85 1.61 1.02 -0.22 -4.75 119.74 121.37 1aor s LYS 140 Ca 0.00 0.08 -0.11 0.00 0.02 0.00 0.00 55.97 55.96 1aor s LYS 140 Cb 0.00 -2.67 0.10 0.00 -0.52 0.00 0.00 37.83 34.75 1aor s LYS 140 CO 0.00 0.27 1.09 0.15 -0.92 0.00 0.00 175.35 175.95 1aor s LYS 141 N -3.22 1.60 0.19 1.68 1.02 -1.26 -4.32 119.74 115.44 1aor s LYS 141 Ca 0.45 0.78 -0.15 0.00 0.02 0.00 0.00 55.97 57.07 1aor s LYS 141 Cb -0.11 -1.85 0.18 0.00 -0.52 0.00 0.00 37.83 35.53 1aor s LYS 141 CO 0.27 -1.99 1.65 0.28 -0.92 0.00 0.00 175.35 174.64 1aor h VAL 142 N -1.36 0.49 -0.44 3.17 2.07 -1.55 1.00 116.25 119.64 1aor h VAL 142 Ca -0.48 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1aor h VAL 142 Cb 1.28 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1aor h VAL 142 CO 0.56 0.00 0.28 0.77 0.02 0.00 0.00 177.57 179.20 1aor h SER 143 N 0.02 0.51 -0.40 0.57 4.64 -1.90 -1.13 113.55 115.86 1aor h SER 143 Ca 0.26 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.51 1aor h SER 143 Cb 0.39 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1aor h SER 143 CO -0.52 0.39 0.09 -0.33 -0.87 0.00 0.00 176.83 175.59 1aor h GLU 144 N 0.58 0.64 -0.52 4.77 5.08 -1.77 -1.21 114.58 122.15 1aor h GLU 144 Ca 0.16 -0.15 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1aor h GLU 144 Cb -0.04 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.07 1aor h GLU 144 CO -0.03 0.66 0.22 1.15 -1.00 0.00 0.00 179.01 180.01 1aor h THR 145 N 0.50 0.87 -0.38 1.13 2.02 -0.53 -0.45 112.91 116.07 1aor h THR 145 Ca 0.12 -0.14 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 1aor h THR 145 Cb 0.31 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 1aor h THR 145 CO 0.00 0.08 -0.00 -0.33 0.37 0.00 0.00 175.52 175.64 1aor h GLU 146 N 0.42 0.67 -0.49 6.66 5.08 -1.01 -1.93 114.58 123.98 1aor h GLU 146 Ca 0.25 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1aor h GLU 146 Cb 0.23 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1aor h GLU 146 CO -0.22 0.77 0.29 0.00 -1.00 0.00 0.00 179.01 178.85 1aor h ALA 147 N 0.87 0.62 -0.23 3.43 0.00 -0.80 -1.66 119.26 121.50 1aor h ALA 147 Ca 0.11 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1aor h ALA 147 Cb 0.47 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1aor h ALA 147 CO 0.02 0.11 0.13 1.15 0.00 0.00 0.00 179.25 180.66 1aor h THR 148 N 0.65 1.10 -0.66 0.00 2.02 -1.02 -2.05 112.91 112.95 1aor h THR 148 Ca 0.17 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 1aor h THR 148 Cb -0.00 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1aor h THR 148 CO -0.03 0.10 0.25 0.40 0.37 0.00 0.00 175.52 176.60 1aor h ILE 149 N 0.27 1.23 -0.27 3.11 2.04 -1.14 -0.74 117.51 122.02 1aor h ILE 149 Ca 0.08 -0.75 -0.11 0.00 1.00 0.00 0.00 64.86 65.09 1aor h ILE 149 Cb 0.04 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1aor h ILE 149 CO -0.01 0.30 -0.27 0.03 0.00 0.00 0.00 178.15 178.19 1aor h ARG 150 N 0.95 0.55 -0.31 2.37 3.08 -1.12 -0.69 114.38 119.20 1aor h ARG 150 Ca 0.22 -0.22 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 1aor h ARG 150 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1aor h ARG 150 CO -0.02 0.77 -0.38 0.87 -1.07 0.00 0.00 179.97 180.15 1aor h LYS 151 N 0.48 0.73 0.14 0.04 1.57 -0.82 -1.97 116.57 116.73 1aor h LYS 151 Ca 0.06 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 1aor h LYS 151 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1aor h LYS 151 CO 0.06 0.98 -0.07 0.93 -0.57 0.00 0.00 179.45 180.78 1aor h GLU 152 N 0.60 -0.18 0.00 3.15 5.08 -0.76 -3.07 114.58 119.40 1aor h GLU 152 Ca 0.05 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1aor h GLU 152 Cb 0.91 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1aor h GLU 152 CO 0.08 0.23 0.00 1.33 -1.00 0.00 0.00 179.01 179.65 1aor n VAL 153 N -4.97 0.23 -2.25 3.13 0.24 -0.30 -4.89 118.33 109.53 1aor n VAL 153 Ca -0.09 0.06 -0.18 0.00 -2.04 0.00 0.00 64.34 62.09 1aor n VAL 153 Cb 0.25 -0.68 -0.02 0.00 -1.47 0.00 0.00 33.84 31.92 1aor n VAL 153 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aor n GLY 154 N 0.63 -0.11 2.80 7.63 0.00 -0.78 -4.99 105.19 110.37 1aor n GLY 154 Ca 0.12 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 1aor n GLY 154 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aor s SER 155 N -2.25 0.51 0.00 1.61 0.15 -0.96 -4.99 113.70 107.78 1aor s SER 155 Ca 0.00 -0.02 0.27 0.00 0.70 0.00 0.00 55.95 56.91 1aor s SER 155 Cb 0.00 -0.22 0.97 0.00 -1.71 0.00 0.00 66.02 65.06 1aor s SER 155 CO 0.00 -0.12 1.71 -0.62 1.20 0.00 0.00 173.24 175.42 1aor n GLU 156 N 4.27 0.38 0.15 5.44 -0.58 -1.26 -3.82 120.64 125.21 1aor n GLU 156 Ca -0.24 -0.15 0.11 0.00 -0.42 0.00 0.00 57.16 56.45 1aor n GLU 156 Cb 0.50 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.94 1aor n GLU 156 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1aor h LYS 157 N 0.38 0.00 -6.77 3.49 3.64 -1.96 -3.47 116.57 111.88 1aor h LYS 157 Ca 0.00 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.83 1aor h LYS 157 Cb 0.44 0.00 0.09 0.00 -0.41 0.00 0.00 32.23 32.36 1aor h LYS 157 CO 0.00 0.03 0.75 1.33 -2.27 0.00 0.00 179.45 179.28 1aor n VAL 158 N -2.87 1.33 -4.23 2.00 0.24 -1.25 -4.87 118.33 108.68 1aor n VAL 158 Ca 0.01 -0.33 -0.35 0.00 -2.04 0.00 0.00 64.34 61.63 1aor n VAL 158 Cb 0.56 -1.80 -0.09 0.00 -1.47 0.00 0.00 33.84 31.04 1aor n VAL 158 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1aor s LYS 159 N -0.98 3.18 -0.02 7.34 -0.14 -0.31 -4.92 119.74 123.89 1aor s LYS 159 Ca 0.62 -0.34 0.06 0.00 -1.36 0.00 0.00 55.97 54.95 1aor s LYS 159 Cb -0.54 -2.92 -0.01 0.00 -1.68 0.00 0.00 37.83 32.68 1aor s LYS 159 CO 0.54 0.68 -0.20 0.42 -0.76 0.00 0.00 175.35 176.03 1aor s ILE 160 N -0.81 1.61 -0.16 2.17 1.01 -1.26 -1.56 121.20 122.19 1aor s ILE 160 Ca 0.13 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.92 1aor s ILE 160 Cb -0.12 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 41.02 1aor s ILE 160 CO 0.03 0.46 -0.18 0.00 0.00 0.00 0.00 174.94 175.24 1aor s ALA 161 N -0.43 2.38 0.32 9.38 0.00 -0.63 -2.64 121.76 130.15 1aor s ALA 161 Ca 0.07 -1.13 -0.05 0.00 0.00 0.00 0.00 51.96 50.85 1aor s ALA 161 Cb -0.08 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1aor s ALA 161 CO -0.00 -0.16 0.47 -1.54 0.00 0.00 0.00 175.76 174.52 1aor s SER 162 N 1.01 0.67 0.22 0.00 1.04 0.23 -0.69 113.70 116.18 1aor s SER 162 Ca -0.02 -1.37 0.10 0.00 0.48 0.00 0.00 55.95 55.14 1aor s SER 162 Cb -0.15 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1aor s SER 162 CO -0.05 -1.26 -0.15 0.27 0.98 0.00 0.00 173.24 173.03 1aor s ILE 163 N -3.25 2.83 0.00 -1.02 -4.36 -0.99 -0.92 121.20 113.49 1aor s ILE 163 Ca 0.29 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.72 1aor s ILE 163 Cb -0.00 -2.42 0.00 0.00 1.25 0.00 0.00 42.46 41.29 1aor s ILE 163 CO 0.18 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 175.76 1aor n GLY 164 N -0.15 3.14 0.44 6.27 0.00 -1.25 -4.75 105.19 108.89 1aor n GLY 164 Ca -0.10 -2.11 0.25 0.00 0.00 0.00 0.00 46.02 44.07 1aor n GLY 164 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1aor h PRO 165 N 0.00 0.25 -0.57 1.61 0.11 -1.73 -1.36 132.00 130.31 1aor h PRO 165 Ca 0.00 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 1aor h PRO 165 Cb 0.00 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.03 1aor h PRO 165 CO 0.00 0.16 0.26 0.00 -0.21 0.00 0.00 178.00 178.22 1aor h ALA 166 N 1.57 0.73 -0.24 -0.75 0.00 -1.47 -0.17 119.26 118.93 1aor h ALA 166 Ca 0.54 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.25 1aor h ALA 166 Cb 1.62 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1aor h ALA 166 CO -0.17 0.31 -0.09 0.78 0.00 0.00 0.00 179.25 180.07 1aor h GLY 167 N 0.77 0.54 1.34 0.00 0.00 -1.46 -0.80 103.07 103.45 1aor h GLY 167 Ca 0.19 -0.47 0.05 0.00 0.00 0.00 0.00 47.33 47.10 1aor h GLY 167 CO -0.02 0.43 0.33 0.83 0.00 0.00 0.00 176.54 178.10 1aor h GLU 168 N 0.22 0.45 -0.44 4.80 5.08 -1.22 -1.03 114.58 122.44 1aor h GLU 168 Ca 0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1aor h GLU 168 Cb 0.58 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1aor h GLU 168 CO 0.03 0.30 0.00 0.09 -1.00 0.00 0.00 179.01 178.43 1aor n ASN 169 N -4.48 2.49 -3.38 1.42 3.02 -0.09 -4.91 115.26 109.32 1aor n ASN 169 Ca 0.06 -1.97 -0.24 0.00 -0.03 0.00 0.00 54.58 52.40 1aor n ASN 169 Cb 0.21 -0.29 0.05 0.00 -0.61 0.00 0.00 39.78 39.14 1aor n ASN 169 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1aor n LEU 170 N 0.86 -2.95 -4.69 3.41 4.32 -0.39 -4.94 117.00 112.62 1aor n LEU 170 Ca 0.16 -0.45 -0.42 0.00 -0.02 0.00 0.00 56.01 55.27 1aor n LEU 170 Cb 0.40 -2.93 -0.03 0.00 -1.62 0.00 0.00 43.42 39.24 1aor n LEU 170 CO 0.11 0.45 1.25 -0.69 -1.22 0.00 0.00 177.39 177.29 1aor s VAL 171 N -3.25 3.29 0.54 4.08 1.01 -0.34 -4.86 120.40 120.88 1aor s VAL 171 Ca 0.47 0.71 0.27 0.00 0.00 0.00 0.00 61.98 63.43 1aor s VAL 171 Cb -0.21 -3.46 0.27 0.00 0.00 0.00 0.00 36.38 32.98 1aor s VAL 171 CO 0.59 -0.00 1.80 0.11 0.00 0.00 0.00 175.10 177.59 1aor h LYS 172 N 8.18 0.00 -0.41 2.72 1.79 -1.67 -0.63 116.57 126.53 1aor h LYS 172 Ca -0.41 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 57.76 1aor h LYS 172 Cb 1.19 0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 31.60 1aor h LYS 172 CO 0.92 0.00 -0.69 1.97 -1.08 0.00 0.00 179.45 180.57 1aor n PHE 173 N -2.73 1.51 -2.58 -1.35 -1.74 -1.26 -3.48 117.46 105.84 1aor n PHE 173 Ca -0.02 -1.89 -0.40 0.00 -0.56 0.00 0.00 57.45 54.58 1aor n PHE 173 Cb 0.37 -0.30 -0.05 0.00 1.52 0.00 0.00 39.48 41.03 1aor n PHE 173 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1aor s ALA 174 N -3.41 3.37 0.41 1.98 0.00 -0.24 -1.69 121.76 122.17 1aor s ALA 174 Ca 0.45 0.78 0.08 0.00 0.00 0.00 0.00 51.96 53.26 1aor s ALA 174 Cb 0.39 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.19 1aor s ALA 174 CO -0.01 -0.07 0.38 0.00 0.00 0.00 0.00 175.76 176.06 1aor s ALA 175 N -0.78 4.06 -0.21 0.00 0.00 -0.23 -0.75 121.76 123.85 1aor s ALA 175 Ca 0.45 -1.86 -0.05 0.00 0.00 0.00 0.00 51.96 50.50 1aor s ALA 175 Cb -0.29 -1.05 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 1aor s ALA 175 CO 0.36 -0.21 0.01 0.42 0.00 0.00 0.00 175.76 176.34 1aor s ILE 176 N -2.46 4.03 0.04 0.00 1.01 -0.89 -4.21 121.20 118.72 1aor s ILE 176 Ca 0.48 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.87 1aor s ILE 176 Cb -0.04 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 1aor s ILE 176 CO 0.28 0.41 0.02 -0.04 0.00 0.00 0.00 174.94 175.61 1aor s MET 177 N 1.11 2.74 0.01 2.79 -1.94 -0.10 -0.79 119.30 123.11 1aor s MET 177 Ca 0.03 -0.69 -0.02 0.00 -1.71 0.00 0.00 55.69 53.30 1aor s MET 177 Cb -0.14 -2.65 -0.01 0.00 2.01 0.00 0.00 34.83 34.04 1aor s MET 177 CO 0.02 0.59 0.02 0.54 -0.01 0.00 0.00 175.02 176.17 1aor s ASN 178 N -1.94 0.14 -1.48 3.03 2.20 0.52 -0.60 114.94 116.80 1aor s ASN 178 Ca 0.23 -0.32 -0.12 0.00 -0.94 0.00 0.00 52.86 51.71 1aor s ASN 178 Cb -0.12 0.12 0.06 0.00 -2.00 0.00 0.00 41.25 39.31 1aor s ASN 178 CO 0.15 -0.25 0.97 0.47 -2.94 0.00 0.00 177.10 175.49 1aor n ASP 179 N 1.88 -5.22 0.00 3.54 8.00 -1.08 -1.40 116.55 122.26 1aor n ASP 179 Ca -0.21 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.63 1aor n ASP 179 Cb 0.56 -4.16 0.00 0.00 -0.02 0.00 0.00 41.12 37.50 1aor n ASP 179 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aor n GLY 180 N -1.72 0.80 0.12 0.44 0.00 -1.26 -4.16 105.19 99.41 1aor n GLY 180 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 1aor n GLY 180 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1aor n HIS 181 N 0.00 0.00 -3.70 1.61 8.25 -1.21 -4.74 115.22 115.43 1aor n HIS 181 Ca 0.00 -0.31 -0.35 0.00 -0.26 0.00 0.00 57.72 56.79 1aor n HIS 181 Cb 0.00 -0.05 -0.08 0.00 1.12 0.00 0.00 29.99 30.98 1aor n HIS 181 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1aor s ARG 182 N -0.78 4.14 -0.04 -0.41 1.81 -0.50 -4.94 118.95 118.23 1aor s ARG 182 Ca 0.06 -0.14 0.06 0.00 -1.72 0.00 0.00 55.73 53.98 1aor s ARG 182 Cb 0.05 -3.40 -0.01 0.00 -0.45 0.00 0.00 34.95 31.14 1aor s ARG 182 CO 0.01 0.33 -0.22 0.00 -0.68 0.00 0.00 175.30 174.74 1aor s ALA 183 N 0.25 1.88 -1.07 2.13 0.00 -1.26 -0.35 121.76 123.33 1aor s ALA 183 Ca 0.10 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 51.07 1aor s ALA 183 Cb -0.12 -0.55 0.28 0.00 0.00 0.00 0.00 23.12 22.73 1aor s ALA 183 CO -0.00 0.40 1.15 0.00 0.00 0.00 0.00 175.76 177.30 1aor n ALA 184 N 2.83 4.38 0.11 0.00 0.00 0.03 -4.27 120.51 123.58 1aor n ALA 184 Ca -0.17 -4.69 -0.16 0.00 0.00 0.00 0.00 53.44 48.42 1aor n ALA 184 Cb 0.52 -2.31 -0.14 0.00 0.00 0.00 0.00 19.45 17.53 1aor n ALA 184 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1aor h GLY 185 N 6.25 0.33 -4.24 0.00 0.00 -1.79 -2.37 103.07 101.25 1aor h GLY 185 Ca 0.18 -0.83 -0.60 0.00 0.00 0.00 0.00 47.33 46.08 1aor h GLY 185 CO 1.06 0.73 -0.57 0.50 0.00 0.00 0.00 176.54 178.26 1aor s ARG 186 N -2.67 2.94 0.00 4.80 0.52 -1.26 -4.38 118.95 118.90 1aor s ARG 186 Ca -0.04 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.41 1aor s ARG 186 Cb 0.07 -2.72 0.00 0.00 0.52 0.00 0.00 34.95 32.82 1aor s ARG 186 CO 0.89 0.53 0.00 0.41 0.02 0.00 0.00 175.30 177.15 1aor n GLY 187 N 0.04 0.18 1.14 -3.53 0.00 -1.26 -4.40 105.19 97.35 1aor n GLY 187 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1aor n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aor n GLY 188 N -1.85 0.71 0.35 -0.02 0.00 -1.23 -3.66 105.19 99.50 1aor n GLY 188 Ca 0.00 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.54 1aor n GLY 188 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1aor h VAL 189 N 0.00 0.89 0.00 1.61 -1.51 -1.76 0.74 116.25 116.22 1aor h VAL 189 Ca 0.00 -0.12 -0.10 0.00 -1.23 0.00 0.00 66.70 65.26 1aor h VAL 189 Cb 0.09 0.52 -0.01 0.00 -2.13 0.00 0.00 31.29 29.75 1aor h VAL 189 CO 0.00 0.06 -0.46 1.23 -1.23 0.00 0.00 177.57 177.17 1aor h GLY 190 N 0.34 0.00 1.79 5.19 0.00 -1.11 -2.11 103.07 107.17 1aor h GLY 190 Ca 0.26 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.40 1aor h GLY 190 CO -0.06 0.00 -0.84 0.00 0.00 0.00 0.00 176.54 175.64 1aor h ALA 191 N 1.54 0.57 -0.01 3.60 0.00 -0.95 -1.33 119.26 122.68 1aor h ALA 191 Ca -0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1aor h ALA 191 Cb 0.90 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1aor h ALA 191 CO 0.06 0.90 -0.00 0.28 0.00 0.00 0.00 179.25 180.48 1aor h VAL 192 N 0.11 1.31 -0.47 0.00 2.07 -1.23 -1.21 116.25 116.84 1aor h VAL 192 Ca -0.04 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 66.62 1aor h VAL 192 Cb 1.45 1.92 -0.06 0.00 -1.52 0.00 0.00 31.29 33.09 1aor h VAL 192 CO 0.13 0.24 0.16 -0.03 0.02 0.00 0.00 177.57 178.09 1aor h MET 193 N -0.37 0.32 0.00 1.57 -1.53 -1.38 -1.42 114.93 112.12 1aor h MET 193 Ca 0.00 -0.02 -0.04 0.00 -3.44 0.00 0.00 59.70 56.20 1aor h MET 193 Cb 0.40 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.37 1aor h MET 193 CO 0.00 0.21 -0.21 0.78 0.14 0.00 0.00 176.91 177.83 1aor h GLY 194 N 0.33 0.00 2.00 1.39 0.00 -1.19 -2.03 103.07 103.57 1aor h GLY 194 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1aor h GLY 194 CO -0.24 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.16 1aor n SER 195 N -3.85 0.21 -1.06 0.19 3.41 -0.46 -2.21 113.62 109.85 1aor n SER 195 Ca -0.02 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.23 1aor n SER 195 Cb 0.31 -0.59 0.23 0.00 -0.26 0.00 0.00 64.21 63.90 1aor n SER 195 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1aor n LYS 196 N -1.72 2.56 -1.86 4.33 5.02 -0.77 -4.87 118.16 120.84 1aor n LYS 196 Ca 0.04 -2.31 -0.21 0.00 -2.02 0.00 0.00 58.31 53.82 1aor n LYS 196 Cb 0.25 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1aor n LYS 196 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1aor n ASN 197 N 1.25 -5.63 -4.48 4.39 3.02 -0.94 -1.46 115.26 111.42 1aor n ASN 197 Ca 0.19 0.34 -0.43 0.00 -0.03 0.00 0.00 54.58 54.64 1aor n ASN 197 Cb 0.55 -4.86 -0.08 0.00 -0.61 0.00 0.00 39.78 34.78 1aor n ASN 197 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1aor s LEU 198 N -5.14 4.88 0.02 3.41 2.96 -1.14 -1.56 118.68 122.12 1aor s LEU 198 Ca 0.00 -0.71 -0.15 0.00 -0.22 0.00 0.00 54.13 53.05 1aor s LEU 198 Cb 0.00 -2.42 -0.35 0.00 0.50 0.00 0.00 46.19 43.91 1aor s LEU 198 CO 0.00 -0.65 0.96 0.50 -1.32 0.00 0.00 176.35 175.84 1aor h LYS 199 N 8.78 0.53 -2.71 1.98 1.63 -1.48 -3.38 116.57 121.93 1aor h LYS 199 Ca -0.27 -0.91 0.12 0.00 -0.85 0.00 0.00 60.65 58.74 1aor h LYS 199 Cb 1.11 0.34 -0.06 0.00 -0.60 0.00 0.00 32.23 33.01 1aor h LYS 199 CO 0.83 1.44 0.34 0.00 -3.45 0.00 0.00 179.45 178.61 1aor s ALA 200 N -2.60 -1.42 -0.11 5.00 0.00 -1.26 -2.33 121.76 119.05 1aor s ALA 200 Ca -0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 51.75 1aor s ALA 200 Cb 0.04 0.76 0.03 0.00 0.00 0.00 0.00 23.12 23.95 1aor s ALA 200 CO 0.94 -1.04 -0.02 0.42 0.00 0.00 0.00 175.76 176.06 1aor s ILE 201 N -3.64 0.64 -0.19 0.00 1.01 0.14 -0.93 121.20 118.23 1aor s ILE 201 Ca 0.11 -0.14 -0.03 0.00 0.00 0.00 0.00 60.65 60.60 1aor s ILE 201 Cb -0.04 -0.80 -0.01 0.00 0.01 0.00 0.00 42.46 41.62 1aor s ILE 201 CO 0.05 0.22 -0.07 0.00 0.00 0.00 0.00 174.94 175.13 1aor s ALA 202 N 1.85 2.74 0.11 9.38 0.00 0.73 -1.60 121.76 134.98 1aor s ALA 202 Ca 0.04 -1.09 0.09 0.00 0.00 0.00 0.00 51.96 51.00 1aor s ALA 202 Cb -0.13 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 1aor s ALA 202 CO -0.07 -0.23 -0.22 0.54 0.00 0.00 0.00 175.76 175.79 1aor s VAL 203 N 1.14 1.81 -0.15 0.00 0.11 -0.60 -0.52 120.40 122.18 1aor s VAL 203 Ca 0.01 -1.62 -0.07 0.00 -2.93 0.00 0.00 61.98 57.38 1aor s VAL 203 Cb -0.14 -1.66 0.06 0.00 -1.53 0.00 0.00 36.38 33.11 1aor s VAL 203 CO -0.02 -0.07 0.34 -0.70 -3.33 0.00 0.00 175.10 171.33 1aor s GLU 204 N -2.03 0.29 0.10 1.54 2.12 0.01 -1.16 118.70 119.57 1aor s GLU 204 Ca 0.09 0.74 0.01 0.00 0.36 0.00 0.00 54.97 56.17 1aor s GLU 204 Cb -0.10 -0.01 -0.04 0.00 0.26 0.00 0.00 34.13 34.24 1aor s GLU 204 CO 0.05 -0.19 -0.05 0.20 -0.54 0.00 0.00 175.26 174.73 1aor s GLY 205 N 1.66 0.78 0.00 -1.50 0.00 -1.26 -1.53 107.32 105.48 1aor s GLY 205 Ca -0.07 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.29 1aor s GLY 205 CO -0.11 -1.44 0.39 -1.14 0.00 0.00 0.00 173.10 170.80 1aor n SER 206 N -0.04 0.40 -4.54 1.64 3.41 -1.02 -4.71 113.62 108.76 1aor n SER 206 Ca -0.12 -1.13 -0.26 0.00 -0.26 0.00 0.00 58.87 57.10 1aor n SER 206 Cb 0.61 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.69 1aor n SER 206 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1aor s LYS 207 N -0.13 1.42 -0.07 4.33 1.02 0.34 -5.05 119.74 121.60 1aor s LYS 207 Ca 0.00 -0.83 0.05 0.00 0.02 0.00 0.00 55.97 55.22 1aor s LYS 207 Cb 0.00 -2.17 -0.01 0.00 -0.52 0.00 0.00 37.83 35.13 1aor s LYS 207 CO 0.00 -1.71 -0.24 0.99 -0.92 0.00 0.00 175.35 173.47 1aor s THR 208 N -3.37 1.99 0.07 2.17 2.01 -1.26 -4.63 115.64 112.62 1aor s THR 208 Ca 0.68 -1.02 -0.31 0.00 0.31 0.00 0.00 61.69 61.36 1aor s THR 208 Cb -0.05 -1.69 -0.08 0.00 0.01 0.00 0.00 72.50 70.69 1aor s THR 208 CO 0.47 0.55 1.50 -0.69 -0.69 0.00 0.00 174.62 175.76 1aor s VAL 209 N -0.02 3.24 -0.09 3.82 1.01 -1.26 -4.95 120.40 122.15 1aor s VAL 209 Ca -0.07 0.77 -0.30 0.00 0.00 0.00 0.00 61.98 62.38 1aor s VAL 209 Cb -0.15 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1aor s VAL 209 CO 0.05 0.02 1.39 -2.16 0.00 0.00 0.00 175.10 174.40 1aor s PRO 210 N 1.98 4.24 -0.02 2.72 0.04 -1.26 -4.92 135.00 137.78 1aor s PRO 210 Ca 0.68 1.87 -0.02 0.00 0.04 0.00 0.00 61.00 63.56 1aor s PRO 210 Cb -0.37 -3.77 -0.04 0.00 0.04 0.00 0.00 34.50 30.36 1aor s PRO 210 CO 0.30 -0.70 0.14 0.42 0.04 0.00 0.00 177.00 177.20 1aor s ILE 211 N 3.32 5.17 0.02 0.56 -1.09 -1.26 -0.94 121.20 126.97 1aor s ILE 211 Ca 0.62 -0.21 -0.24 0.00 -2.23 0.00 0.00 60.65 58.59 1aor s ILE 211 Cb -0.27 -3.37 -0.13 0.00 -1.58 0.00 0.00 42.46 37.11 1aor s ILE 211 CO 0.22 0.38 1.12 0.00 -1.23 0.00 0.00 174.94 175.42 1aor h ALA 212 N 4.09 -0.99 -3.48 9.38 0.00 -1.09 -3.40 119.26 123.76 1aor h ALA 212 Ca -0.50 -0.19 -0.64 0.00 0.00 0.00 0.00 54.91 53.59 1aor h ALA 212 Cb 1.19 0.33 -0.40 0.00 0.00 0.00 0.00 17.79 18.91 1aor h ALA 212 CO 0.65 -0.93 -0.71 0.34 0.00 0.00 0.00 179.25 178.60 1aor s ASP 213 N -3.98 4.47 0.16 0.00 -1.08 -1.15 -5.02 116.67 110.07 1aor s ASP 213 Ca -0.12 -2.26 -0.16 0.00 -0.52 0.00 0.00 52.55 49.49 1aor s ASP 213 Cb 0.01 -1.45 0.07 0.00 -1.46 0.00 0.00 42.92 40.09 1aor s ASP 213 CO 0.37 -0.35 1.77 0.07 0.52 0.00 0.00 175.17 177.55 1aor h LYS 214 N 7.42 0.36 -0.10 4.34 5.09 -1.87 0.66 116.57 132.47 1aor h LYS 214 Ca -0.06 -0.02 -0.17 0.00 0.09 0.00 0.00 60.65 60.49 1aor h LYS 214 Cb 0.99 -0.08 -0.01 0.00 0.10 0.00 0.00 32.23 33.23 1aor h LYS 214 CO 0.54 0.24 -0.66 1.96 -2.09 0.00 0.00 179.45 179.44 1aor h GLN 215 N 0.37 0.39 0.12 0.07 4.20 -1.98 -1.20 115.11 117.07 1aor h GLN 215 Ca 0.17 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1aor h GLN 215 Cb 0.10 0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1aor h GLN 215 CO -0.14 0.91 -0.06 -0.22 -0.67 0.00 0.00 178.83 178.66 1aor h LYS 216 N 0.28 -0.16 -0.55 1.46 1.63 -1.93 -2.86 116.57 114.43 1aor h LYS 216 Ca -0.02 0.01 0.09 0.00 -0.85 0.00 0.00 60.65 59.88 1aor h LYS 216 Cb 1.21 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.80 1aor h LYS 216 CO 0.11 0.13 0.16 0.35 -3.45 0.00 0.00 179.45 176.76 1aor h PHE 217 N -0.45 0.28 -0.99 1.91 3.57 -0.80 -0.76 116.94 119.70 1aor h PHE 217 Ca -0.02 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.62 1aor h PHE 217 Cb 0.36 -0.04 -0.08 0.00 2.79 0.00 0.00 35.95 38.98 1aor h PHE 217 CO 0.02 0.05 0.63 0.52 -2.23 0.00 0.00 178.31 177.30 1aor h MET 218 N 0.32 0.98 -0.01 1.11 2.86 -1.17 0.45 114.93 119.47 1aor h MET 218 Ca 0.28 -0.06 -0.23 0.00 -2.06 0.00 0.00 59.70 57.63 1aor h MET 218 Cb 0.36 -0.22 0.01 0.00 0.06 0.00 0.00 31.60 31.80 1aor h MET 218 CO -0.32 0.65 -0.94 -0.07 1.06 0.00 0.00 176.91 177.29 1aor h LEU 219 N 1.01 0.63 -0.34 1.22 3.38 -1.02 -2.23 115.31 117.96 1aor h LEU 219 Ca 0.48 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1aor h LEU 219 Cb 0.44 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1aor h LEU 219 CO -0.24 1.29 0.09 0.58 0.09 0.00 0.00 178.44 180.24 1aor h VAL 220 N 0.29 1.22 -0.39 1.22 2.07 -0.49 -2.55 116.25 117.62 1aor h VAL 220 Ca -0.08 -0.73 0.02 0.00 0.82 0.00 0.00 66.70 66.72 1aor h VAL 220 Cb 1.57 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1aor h VAL 220 CO 0.17 0.25 0.22 0.58 0.02 0.00 0.00 177.57 178.81 1aor h VAL 221 N 0.39 1.02 -0.47 2.57 2.07 -0.95 -1.59 116.25 119.29 1aor h VAL 221 Ca 0.11 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.56 1aor h VAL 221 Cb 0.29 0.53 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 1aor h VAL 221 CO 0.00 0.08 0.04 -0.09 0.02 0.00 0.00 177.57 177.62 1aor h ARG 222 N 0.45 0.15 -0.23 1.57 2.43 -1.21 0.18 114.38 117.71 1aor h ARG 222 Ca 0.16 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1aor h ARG 222 Cb 0.03 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1aor h ARG 222 CO -0.09 0.10 0.14 1.49 -1.51 0.00 0.00 179.97 180.11 1aor h GLU 223 N 0.15 0.29 -0.33 0.20 4.81 -0.99 -0.43 114.58 118.28 1aor h GLU 223 Ca 0.23 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1aor h GLU 223 Cb 0.33 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1aor h GLU 223 CO -0.36 0.19 0.17 0.87 -0.73 0.00 0.00 179.01 179.15 1aor h LYS 224 N 0.30 0.47 -0.49 1.92 1.79 -0.73 -2.29 116.57 117.54 1aor h LYS 224 Ca 0.09 -0.06 0.05 0.00 -2.18 0.00 0.00 60.65 58.54 1aor h LYS 224 Cb -0.02 -0.09 -0.05 0.00 -1.58 0.00 0.00 32.23 30.50 1aor h LYS 224 CO -0.03 0.42 0.23 0.28 -1.08 0.00 0.00 179.45 179.27 1aor h VAL 225 N 0.40 0.92 0.00 0.50 2.07 -0.46 -0.26 116.25 119.43 1aor h VAL 225 Ca 0.11 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1aor h VAL 225 Cb 0.10 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1aor h VAL 225 CO -0.02 0.08 -0.03 0.78 0.02 0.00 0.00 177.57 178.40 1aor h ASN 226 N 0.44 0.00 -0.14 0.57 -0.26 -0.81 -0.80 115.58 114.58 1aor h ASN 226 Ca 0.22 0.00 -0.12 0.00 -0.56 0.00 0.00 56.30 55.84 1aor h ASN 226 Cb 0.16 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.42 1aor h ASN 226 CO -0.18 0.03 -0.38 0.11 -1.06 0.00 0.00 177.43 175.96 1aor h LYS 227 N 0.00 0.51 -0.19 0.81 1.57 -0.49 -2.70 116.57 116.08 1aor h LYS 227 Ca -0.00 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.41 1aor h LYS 227 Cb 0.07 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1aor h LYS 227 CO 0.00 0.98 0.07 -0.07 -0.57 0.00 0.00 179.45 179.86 1aor h LEU 228 N 0.13 0.26 -1.91 2.94 3.38 -0.71 -2.80 115.31 116.60 1aor h LEU 228 Ca -0.01 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.83 1aor h LEU 228 Cb 1.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1aor h LEU 228 CO 0.08 0.36 0.13 0.03 0.09 0.00 0.00 178.44 179.13 1aor h ARG 229 N 0.15 0.11 -0.00 1.13 3.08 -1.20 -1.70 114.38 115.95 1aor h ARG 229 Ca 0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1aor h ARG 229 Cb 0.18 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1aor h ARG 229 CO -0.00 0.07 -0.26 0.09 -1.07 0.00 0.00 179.97 178.80 1aor n ASN 230 N -4.50 0.73 -4.74 7.04 3.02 -1.02 -4.49 115.26 111.30 1aor n ASN 230 Ca 0.01 -0.61 -0.40 0.00 -0.03 0.00 0.00 54.58 53.54 1aor n ASN 230 Cb 0.18 0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1aor n ASN 230 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1aor s ASP 231 N -2.62 7.42 0.45 6.41 2.15 -0.65 -4.94 116.67 124.89 1aor s ASP 231 Ca 0.22 1.69 0.14 0.00 0.43 0.00 0.00 52.55 55.03 1aor s ASP 231 Cb 0.19 -2.54 1.01 0.00 -0.30 0.00 0.00 42.92 41.29 1aor s ASP 231 CO 0.55 0.04 2.01 1.55 -0.17 0.00 0.00 175.17 179.15 1aor h PRO 232 N 5.18 0.05 0.00 4.34 0.13 -1.89 0.60 132.00 140.40 1aor h PRO 232 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1aor h PRO 232 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1aor h PRO 232 CO 0.70 0.18 -0.03 0.28 -0.23 0.00 0.00 178.00 178.90 1aor h VAL 233 N 0.05 0.00 0.00 1.56 2.07 -1.92 -1.03 116.25 116.99 1aor h VAL 233 Ca 0.01 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 1aor h VAL 233 Cb 0.26 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1aor h VAL 233 CO 0.02 0.00 -0.02 0.00 0.02 0.00 0.00 177.57 177.59 1aor h ALA 234 N -1.51 1.19 0.00 1.67 0.00 -1.73 -1.67 119.26 117.21 1aor h ALA 234 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1aor h ALA 234 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1aor h ALA 234 CO 0.00 0.02 -1.06 0.41 0.00 0.00 0.00 179.25 178.62 1aor n GLY 235 N -0.99 -0.59 1.68 0.00 0.00 0.21 -4.65 105.19 100.84 1aor n GLY 235 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1aor n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aor n GLY 236 N 1.43 -0.20 0.46 -0.02 0.00 -0.79 -4.86 105.19 101.21 1aor n GLY 236 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 1aor n GLY 236 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aor h GLY 237 N 0.00 -1.23 0.46 -0.02 0.00 -0.83 -2.34 103.07 99.11 1aor h GLY 237 Ca 0.00 0.57 0.02 0.00 0.00 0.00 0.00 47.33 47.92 1aor h GLY 237 CO 0.00 -0.37 -0.32 1.41 0.00 0.00 0.00 176.54 177.26 1aor h LEU 238 N -0.94 -0.91 -1.38 3.11 3.38 -1.57 0.80 115.31 117.81 1aor h LEU 238 Ca -0.06 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1aor h LEU 238 Cb 0.81 0.34 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 1aor h LEU 238 CO -0.05 -0.41 0.43 1.55 0.09 0.00 0.00 178.44 180.05 1aor h PRO 239 N -0.55 0.80 -0.01 1.13 0.13 -1.70 0.21 132.00 132.02 1aor h PRO 239 Ca 0.03 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.09 1aor h PRO 239 Cb 0.57 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.52 1aor h PRO 239 CO -0.18 0.53 -0.08 0.87 -0.23 0.00 0.00 178.00 178.91 1aor h LYS 240 N 0.83 0.07 -0.00 0.86 1.57 -1.04 -3.40 116.57 115.45 1aor h LYS 240 Ca 0.25 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1aor h LYS 240 Cb -0.00 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1aor h LYS 240 CO -0.06 0.78 -0.04 0.66 -0.57 0.00 0.00 179.45 180.22 1aor n TYR 241 N -4.66 0.00 -2.88 -1.35 4.01 0.24 -4.94 117.16 107.58 1aor n TYR 241 Ca -0.09 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.68 1aor n TYR 241 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.42 1aor n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aor n GLY 242 N 0.45 -1.85 0.26 2.72 0.00 0.74 -3.69 105.19 103.82 1aor n GLY 242 Ca 0.02 -1.32 0.18 0.00 0.00 0.00 0.00 46.02 44.91 1aor n GLY 242 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1aor h THR 243 N -0.20 0.00 0.00 2.61 1.35 -1.82 -2.41 112.91 112.43 1aor h THR 243 Ca 0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 1aor h THR 243 Cb 0.19 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 1aor h THR 243 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1aor n ALA 244 N -1.98 1.44 0.23 6.62 0.00 -1.24 -2.28 120.51 123.30 1aor n ALA 244 Ca -0.01 -0.03 0.15 0.00 0.00 0.00 0.00 53.44 53.54 1aor n ALA 244 Cb 0.13 -1.14 0.80 0.00 0.00 0.00 0.00 19.45 19.24 1aor n ALA 244 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1aor h VAL 245 N 0.00 0.63 0.00 0.00 -1.51 -1.53 -2.14 116.25 111.70 1aor h VAL 245 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1aor h VAL 245 Cb 0.14 0.92 -0.00 0.00 -2.13 0.00 0.00 31.29 30.21 1aor h VAL 245 CO 0.00 0.00 -0.02 -0.07 -1.23 0.00 0.00 177.57 176.25 1aor h LEU 246 N 0.00 0.00 -0.13 4.19 3.38 -1.73 -3.32 115.31 117.70 1aor h LEU 246 Ca 0.05 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1aor h LEU 246 Cb 0.27 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1aor h LEU 246 CO -0.00 0.02 -0.48 0.58 0.09 0.00 0.00 178.44 178.65 1aor h VAL 247 N 0.00 0.00 -0.60 1.22 2.07 -1.66 0.27 116.25 117.55 1aor h VAL 247 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1aor h VAL 247 Cb 0.06 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.80 1aor h VAL 247 CO 0.00 0.00 0.40 0.78 0.02 0.00 0.00 177.57 178.77 1aor h ASN 248 N -0.51 0.68 0.26 0.57 -0.26 -1.82 -0.23 115.58 114.28 1aor h ASN 248 Ca 0.03 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.74 1aor h ASN 248 Cb 0.59 -0.17 0.00 0.00 -1.06 0.00 0.00 38.32 37.69 1aor h ASN 248 CO -0.39 0.49 -0.13 0.40 -1.06 0.00 0.00 177.43 176.75 1aor h ILE 249 N 0.80 0.74 -0.19 2.81 2.04 -1.53 -1.88 117.51 120.30 1aor h ILE 249 Ca 0.22 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 1aor h ILE 249 Cb -0.08 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1aor h ILE 249 CO -0.05 0.14 -0.09 0.40 0.00 0.00 0.00 178.15 178.56 1aor h ILE 250 N -0.78 1.17 -0.26 -0.67 1.08 -0.34 -2.35 117.51 115.37 1aor h ILE 250 Ca -0.04 -0.74 -0.10 0.00 -0.39 0.00 0.00 64.86 63.59 1aor h ILE 250 Cb 0.51 1.13 -0.00 0.00 -3.07 0.00 0.00 36.82 35.38 1aor h ILE 250 CO 0.06 0.24 -0.25 -1.13 -0.69 0.00 0.00 178.15 176.38 1aor h ASN 251 N 0.29 0.66 0.89 1.72 -0.00 -1.05 -2.73 115.58 115.36 1aor h ASN 251 Ca 0.06 -0.47 -0.04 0.00 -0.00 0.00 0.00 56.30 55.85 1aor h ASN 251 Cb 0.34 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.47 1aor h ASN 251 CO 0.02 1.00 -0.18 1.05 -0.00 0.00 0.00 177.43 179.31 1aor h GLU 252 N 0.34 0.00 -0.00 6.67 4.11 -1.13 -1.61 114.58 122.95 1aor h GLU 252 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 1aor h GLU 252 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1aor h GLU 252 CO 0.06 0.18 -0.02 0.09 0.07 0.00 0.00 179.01 179.39 1aor n ASN 253 N -3.36 0.06 -1.60 3.06 3.02 -0.90 -4.81 115.26 110.72 1aor n ASN 253 Ca 0.00 -0.23 -0.10 0.00 -0.03 0.00 0.00 54.58 54.22 1aor n ASN 253 Cb 0.39 -0.24 0.02 0.00 -0.61 0.00 0.00 39.78 39.34 1aor n ASN 253 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aor n GLY 254 N 1.28 0.18 1.89 7.41 0.00 -0.61 -4.53 105.19 110.80 1aor n GLY 254 Ca 0.15 -0.34 0.02 0.00 0.00 0.00 0.00 46.02 45.85 1aor n GLY 254 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1aor n LEU 255 N -2.11 1.36 -4.37 0.99 -0.00 -1.05 -4.51 117.00 107.31 1aor n LEU 255 Ca -0.04 -2.48 -0.45 0.00 -0.00 0.00 0.00 56.01 53.04 1aor n LEU 255 Cb 0.55 0.12 -0.06 0.00 -0.00 0.00 0.00 43.42 44.03 1aor n LEU 255 CO 0.23 0.75 0.22 -0.47 -0.00 0.00 0.00 177.39 178.12 1aor s TYR 256 N -1.44 3.15 0.14 1.47 5.04 -0.51 -1.24 117.35 123.96 1aor s TYR 256 Ca 0.32 -0.97 -0.32 0.00 -2.44 0.00 0.00 57.07 53.66 1aor s TYR 256 Cb 0.37 -3.65 -0.12 0.00 0.35 0.00 0.00 41.96 38.91 1aor s TYR 256 CO -0.12 -1.04 1.74 -2.30 -1.34 0.00 0.00 175.55 172.49 1aor n PRO 257 N 5.69 2.56 -5.27 4.97 -0.02 -1.26 -3.57 135.00 138.10 1aor n PRO 257 Ca -0.11 0.93 -0.31 0.00 -2.02 0.00 0.00 63.50 61.98 1aor n PRO 257 Cb 0.43 -2.77 -0.16 0.00 -0.02 0.00 0.00 33.50 30.97 1aor n PRO 257 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1aor s VAL 258 N 1.92 2.05 -0.94 -1.45 1.01 0.10 -3.79 120.40 119.30 1aor s VAL 258 Ca 0.80 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.63 1aor s VAL 258 Cb -0.56 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 1aor s VAL 258 CO 0.37 0.57 0.73 0.29 0.00 0.00 0.00 175.10 177.06 1aor n LYS 259 N 2.94 -1.39 -3.62 2.72 5.02 -1.05 -1.22 118.16 121.55 1aor n LYS 259 Ca -0.17 0.87 -0.20 0.00 -2.02 0.00 0.00 58.31 56.78 1aor n LYS 259 Cb 0.52 -4.30 0.05 0.00 -0.02 0.00 0.00 35.03 31.28 1aor n LYS 259 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1aor n ASN 260 N -2.43 -1.55 -2.05 4.39 5.15 -0.91 -2.91 115.26 114.95 1aor n ASN 260 Ca -0.12 -0.76 -0.19 0.00 -0.60 0.00 0.00 54.58 52.91 1aor n ASN 260 Cb 0.59 -4.39 -0.03 0.00 -0.53 0.00 0.00 39.78 35.42 1aor n ASN 260 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1aor n PHE 261 N -4.25 -0.71 0.09 1.20 3.01 -1.14 -4.90 117.46 110.78 1aor n PHE 261 Ca -0.29 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.12 1aor n PHE 261 Cb 0.67 -3.66 0.07 0.00 -0.01 0.00 0.00 39.48 36.55 1aor n PHE 261 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1aor h GLN 262 N 0.00 0.15 -4.01 -1.08 4.20 -1.03 -3.47 115.11 109.87 1aor h GLN 262 Ca -0.45 -0.13 -0.13 0.00 0.06 0.00 0.00 58.65 58.00 1aor h GLN 262 Cb 1.33 0.03 -0.12 0.00 0.30 0.00 0.00 27.48 29.02 1aor h GLN 262 CO 0.56 0.82 -0.32 -0.08 -0.67 0.00 0.00 178.83 179.14 1aor s THR 263 N -3.44 0.01 -0.42 -0.54 -1.32 -1.17 -4.63 115.64 104.12 1aor s THR 263 Ca -0.03 -1.61 0.09 0.00 -1.21 0.00 0.00 61.69 58.93 1aor s THR 263 Cb 0.11 -2.26 0.23 0.00 -1.51 0.00 0.00 72.50 69.08 1aor s THR 263 CO 0.80 -0.04 1.18 0.61 -2.21 0.00 0.00 174.62 174.96 1aor n GLY 264 N -0.32 3.24 2.94 6.08 0.00 -1.26 -0.72 105.19 115.15 1aor n GLY 264 Ca -0.01 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1aor n GLY 264 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aor s VAL 265 N -1.45 0.87 -0.28 1.61 1.01 -1.23 -1.43 120.40 119.50 1aor s VAL 265 Ca 0.19 -0.28 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1aor s VAL 265 Cb 0.13 -0.86 0.04 0.00 0.00 0.00 0.00 36.38 35.69 1aor s VAL 265 CO 0.08 0.31 -0.02 -0.47 0.00 0.00 0.00 175.10 175.01 1aor s TYR 266 N 1.08 3.17 0.51 5.22 5.04 -1.26 -4.90 117.35 126.22 1aor s TYR 266 Ca -0.08 -1.66 0.23 0.00 -2.44 0.00 0.00 57.07 53.13 1aor s TYR 266 Cb -0.14 -2.10 1.33 0.00 0.35 0.00 0.00 41.96 41.39 1aor s TYR 266 CO -0.01 -0.75 1.98 -1.00 -1.34 0.00 0.00 175.55 174.43 1aor h PRO 267 N 8.03 0.08 -0.51 4.97 0.13 -2.00 -2.11 132.00 140.59 1aor h PRO 267 Ca -0.27 -0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.76 1aor h PRO 267 Cb 1.09 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.14 1aor h PRO 267 CO 0.56 0.05 0.09 0.66 -0.23 0.00 0.00 178.00 179.13 1aor n TYR 268 N -4.40 1.74 -0.29 1.56 4.01 -1.26 -4.68 117.16 113.85 1aor n TYR 268 Ca 0.11 -1.06 0.15 0.00 -0.16 0.00 0.00 57.90 56.93 1aor n TYR 268 Cb 0.59 -0.51 0.41 0.00 -0.31 0.00 0.00 39.34 39.52 1aor n TYR 268 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1aor h ALA 269 N 2.42 1.92 -0.75 -0.72 0.00 -1.79 -2.35 119.26 117.99 1aor h ALA 269 Ca 0.13 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1aor h ALA 269 Cb 1.91 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.57 1aor h ALA 269 CO 0.49 -0.21 0.49 -0.92 0.00 0.00 0.00 179.25 179.10 1aor h TYR 270 N 0.62 0.81 0.00 0.00 3.20 -1.85 -1.61 116.97 118.14 1aor h TYR 270 Ca 0.49 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.38 1aor h TYR 270 Cb 0.93 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.93 1aor h TYR 270 CO -0.00 0.43 0.00 0.93 -1.64 0.00 0.00 178.16 177.88 1aor h GLU 271 N 0.80 0.00 0.00 1.82 5.08 -1.76 -2.37 114.58 118.15 1aor h GLU 271 Ca 0.32 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1aor h GLU 271 Cb 0.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1aor h GLU 271 CO -0.11 0.00 -0.24 0.00 -1.00 0.00 0.00 179.01 177.66 1aor n GLN 272 N -2.93 1.41 -2.60 2.33 10.64 -0.62 -4.44 117.38 121.17 1aor n GLN 272 Ca -0.02 -2.91 -0.25 0.00 -1.83 0.00 0.00 57.00 52.00 1aor n GLN 272 Cb 0.14 -1.54 0.03 0.00 -0.86 0.00 0.00 30.24 28.00 1aor n GLN 272 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 1aor s SER 273 N -3.03 5.63 0.43 2.61 1.04 -0.89 -4.91 113.70 114.57 1aor s SER 273 Ca 0.35 0.52 0.09 0.00 0.48 0.00 0.00 55.95 57.38 1aor s SER 273 Cb 0.32 -1.58 0.92 0.00 0.10 0.00 0.00 66.02 65.78 1aor s SER 273 CO -0.02 -0.97 2.05 1.23 0.98 0.00 0.00 173.24 176.52 1aor h GLY 274 N 0.02 0.42 0.71 7.32 0.00 -1.68 0.22 103.07 110.08 1aor h GLY 274 Ca -0.45 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 46.69 1aor h GLY 274 CO 0.59 0.17 -0.02 0.83 0.00 0.00 0.00 176.54 178.11 1aor h GLU 275 N 0.40 0.17 -0.62 4.80 3.07 -1.86 -0.41 114.58 120.13 1aor h GLU 275 Ca 0.10 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.86 1aor h GLU 275 Cb 0.03 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 27.90 1aor h GLU 275 CO -0.02 0.49 0.23 0.00 -1.40 0.00 0.00 179.01 178.31 1aor h ALA 276 N 0.68 0.80 -0.82 3.43 0.00 -1.63 -1.61 119.26 120.11 1aor h ALA 276 Ca 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1aor h ALA 276 Cb 0.42 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1aor h ALA 276 CO 0.01 0.43 0.42 1.98 0.00 0.00 0.00 179.25 182.09 1aor h MET 277 N 0.86 1.15 -0.46 0.00 1.85 -0.92 0.18 114.93 117.59 1aor h MET 277 Ca 0.20 -0.15 -0.07 0.00 -0.61 0.00 0.00 59.70 59.08 1aor h MET 277 Cb 0.23 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 32.02 1aor h MET 277 CO -0.01 0.86 0.00 0.00 -0.40 0.00 0.00 176.91 177.36 1aor h ALA 278 N 1.31 1.13 0.00 0.39 0.00 -0.64 -0.93 119.26 120.52 1aor h ALA 278 Ca 0.28 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 1aor h ALA 278 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1aor h ALA 278 CO -0.04 0.56 -0.87 0.00 0.00 0.00 0.00 179.25 178.89 1aor h ALA 279 N 1.29 0.44 0.01 0.00 0.00 -0.59 -3.36 119.26 117.05 1aor h ALA 279 Ca 0.14 -0.79 -0.41 0.00 0.00 0.00 0.00 54.91 53.85 1aor h ALA 279 Cb 0.44 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 1aor h ALA 279 CO 0.02 1.08 -2.38 1.63 0.00 0.00 0.00 179.25 179.60 1aor n LYS 280 N -3.31 0.63 0.00 0.00 5.02 0.56 -4.89 118.16 116.17 1aor n LYS 280 Ca 0.00 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 1aor n LYS 280 Cb 0.88 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 1aor n LYS 280 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1aor n TYR 281 N -3.78 0.00 -1.73 2.13 4.01 -0.55 -5.04 117.16 112.20 1aor n TYR 281 Ca -0.48 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 56.84 1aor n TYR 281 Cb 0.93 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.93 1aor n TYR 281 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1aor s LEU 282 N -2.09 4.39 -0.22 7.72 2.96 -0.46 -2.36 118.68 128.63 1aor s LEU 282 Ca 0.00 2.76 -0.17 0.00 -0.22 0.00 0.00 54.13 56.50 1aor s LEU 282 Cb 0.00 -3.57 -0.13 0.00 0.50 0.00 0.00 46.19 42.99 1aor s LEU 282 CO 0.00 -0.99 -0.09 0.52 -1.32 0.00 0.00 176.35 174.47 1aor n VAL 283 N 4.63 1.51 -3.79 1.68 0.31 0.68 -4.96 118.33 118.39 1aor n VAL 283 Ca 0.17 -0.07 -0.04 0.00 -0.01 0.00 0.00 64.34 64.39 1aor n VAL 283 Cb 0.38 -2.09 -0.01 0.00 -0.91 0.00 0.00 33.84 31.21 1aor n VAL 283 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1aor s ARG 284 N -2.45 1.37 0.20 5.55 1.70 -1.13 -5.04 118.95 119.15 1aor s ARG 284 Ca -0.30 -0.78 0.05 0.00 -0.47 0.00 0.00 55.73 54.23 1aor s ARG 284 Cb 0.08 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.88 1aor s ARG 284 CO 0.48 -0.63 0.26 0.54 -1.08 0.00 0.00 175.30 174.87 1aor s ASN 285 N -2.99 6.00 -0.05 -2.89 6.03 -1.26 -0.99 114.94 118.80 1aor s ASN 285 Ca 0.13 -0.01 -0.02 0.00 -1.03 0.00 0.00 52.86 51.94 1aor s ASN 285 Cb -0.03 -1.70 0.04 0.00 -3.03 0.00 0.00 41.25 36.53 1aor s ASN 285 CO 0.04 -0.00 0.09 -0.75 -2.03 0.00 0.00 177.10 174.45 1aor s LYS 286 N -3.56 -0.00 0.25 3.55 2.20 0.97 -4.89 119.74 118.26 1aor s LYS 286 Ca 0.33 0.34 -0.06 0.00 -0.36 0.00 0.00 55.97 56.23 1aor s LYS 286 Cb -0.10 -0.29 -0.06 0.00 -1.51 0.00 0.00 37.83 35.88 1aor s LYS 286 CO 0.27 -0.23 0.53 -1.25 -0.36 0.00 0.00 175.35 174.31 1aor s PRO 287 N 1.54 3.67 0.93 4.03 0.04 -1.26 -1.73 135.00 142.21 1aor s PRO 287 Ca -0.04 0.04 -0.14 0.00 0.04 0.00 0.00 61.00 60.91 1aor s PRO 287 Cb -0.12 -2.68 0.19 0.00 0.04 0.00 0.00 34.50 31.93 1aor s PRO 287 CO -0.04 0.27 1.28 0.00 0.04 0.00 0.00 177.00 178.55 1aor n TYR 289 N -3.64 2.06 -1.57 0.00 9.36 -0.38 -2.27 117.16 120.71 1aor n TYR 289 Ca 0.15 0.39 -0.19 0.00 3.32 0.00 0.00 57.90 61.57 1aor n TYR 289 Cb 0.60 -2.47 -0.08 0.00 -0.63 0.00 0.00 39.34 36.75 1aor n TYR 289 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1aor n ALA 290 N 2.91 -0.30 -2.65 2.98 0.00 -1.26 -3.89 120.51 118.30 1aor n ALA 290 Ca 0.16 0.31 -0.39 0.00 0.00 0.00 0.00 53.44 53.53 1aor n ALA 290 Cb 0.27 -1.92 -0.08 0.00 0.00 0.00 0.00 19.45 17.72 1aor n ALA 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aor n PRO 292 N 4.85 1.03 -0.10 0.00 -0.04 -1.26 -4.27 135.00 135.20 1aor n PRO 292 Ca -0.07 -0.49 -0.22 0.00 -0.04 0.00 0.00 63.50 62.68 1aor n PRO 292 Cb 0.51 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 1aor n PRO 292 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1aor h ILE 293 N 1.20 0.90 -5.54 0.52 2.04 -1.92 -3.49 117.51 111.22 1aor h ILE 293 Ca 0.00 -2.18 -0.22 0.00 1.00 0.00 0.00 64.86 63.46 1aor h ILE 293 Cb 0.41 2.22 0.14 0.00 -0.74 0.00 0.00 36.82 38.85 1aor h ILE 293 CO 0.00 0.33 -0.68 0.61 0.00 0.00 0.00 178.15 178.41 1aor n GLY 294 N 1.45 -1.17 0.04 5.37 0.00 -1.26 -4.03 105.19 105.59 1aor n GLY 294 Ca -0.32 0.55 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1aor n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aor n GLY 296 N 1.41 0.98 3.88 0.00 0.00 -0.71 -4.25 105.19 106.50 1aor n GLY 296 Ca 0.04 0.36 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 1aor n GLY 296 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1aor s ARG 297 N -1.56 3.45 -0.23 1.61 1.81 -1.26 -0.02 118.95 122.74 1aor s ARG 297 Ca 0.57 -0.12 0.01 0.00 -1.72 0.00 0.00 55.73 54.47 1aor s ARG 297 Cb -0.53 -3.19 0.05 0.00 -0.45 0.00 0.00 34.95 30.84 1aor s ARG 297 CO 0.59 0.78 -0.08 0.08 -0.68 0.00 0.00 175.30 175.98 1aor s VAL 298 N -1.04 1.73 0.38 3.52 1.01 -0.16 -1.63 120.40 124.22 1aor s VAL 298 Ca 0.15 -1.26 0.08 0.00 0.00 0.00 0.00 61.98 60.96 1aor s VAL 298 Cb -0.12 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1aor s VAL 298 CO 0.04 0.01 0.16 0.20 0.00 0.00 0.00 175.10 175.51 1aor s ASN 299 N 1.32 4.48 -0.12 3.32 0.01 0.00 -0.23 114.94 123.72 1aor s ASN 299 Ca -0.05 -0.97 -0.06 0.00 -0.71 0.00 0.00 52.86 51.07 1aor s ASN 299 Cb -0.18 -0.55 0.05 0.00 0.41 0.00 0.00 41.25 40.98 1aor s ASN 299 CO -0.07 -0.44 0.28 -0.60 -1.51 0.00 0.00 177.10 174.76 1aor s ARG 300 N -3.87 0.22 0.07 -0.60 6.06 -0.99 -0.38 118.95 119.45 1aor s ARG 300 Ca 0.40 0.64 0.09 0.00 -2.50 0.00 0.00 55.73 54.35 1aor s ARG 300 Cb 0.01 -0.07 -0.03 0.00 0.06 0.00 0.00 34.95 34.93 1aor s ARG 300 CO 0.22 -0.20 -0.23 -0.51 -2.50 0.00 0.00 175.30 172.08 1aor s LEU 301 N 1.66 2.21 0.47 -0.88 1.43 -0.58 -4.79 118.68 118.19 1aor s LEU 301 Ca -0.06 -0.60 0.18 0.00 -1.03 0.00 0.00 54.13 52.62 1aor s LEU 301 Cb -0.11 -1.08 1.16 0.00 0.03 0.00 0.00 46.19 46.19 1aor s LEU 301 CO -0.09 0.17 1.99 -0.65 0.23 0.00 0.00 176.35 178.00 1aor h PRO 302 N 4.58 0.26 0.17 1.29 0.11 -2.02 -0.20 132.00 136.19 1aor h PRO 302 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1aor h PRO 302 Cb 1.16 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1aor h PRO 302 CO 0.42 0.17 -0.08 1.79 -0.21 0.00 0.00 178.00 180.09 1aor h THR 303 N 0.26 0.00 0.00 -1.15 1.35 -2.01 -3.39 112.91 107.97 1aor h THR 303 Ca 0.26 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1aor h THR 303 Cb 0.69 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 1aor h THR 303 CO -0.06 0.00 -0.64 1.33 -0.25 0.00 0.00 175.52 175.91 1aor n VAL 304 N -3.89 0.04 -2.28 6.82 0.24 -1.22 -5.07 118.33 112.97 1aor n VAL 304 Ca -0.03 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1aor n VAL 304 Cb 0.09 0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 1aor n VAL 304 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aor n GLY 305 N 1.48 -0.51 3.76 7.63 0.00 -0.09 -4.89 105.19 112.57 1aor n GLY 305 Ca 0.05 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.22 1aor n GLY 305 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1aor s GLU 306 N 0.00 4.64 0.30 1.61 2.12 -1.26 -1.52 118.70 124.58 1aor s GLU 306 Ca 0.00 1.58 -0.12 0.00 0.36 0.00 0.00 54.97 56.79 1aor s GLU 306 Cb 0.00 -3.07 0.01 0.00 0.26 0.00 0.00 34.13 31.34 1aor s GLU 306 CO 0.00 0.28 0.57 -0.08 -0.54 0.00 0.00 175.26 175.48 1aor s THR 307 N -1.31 0.00 0.12 -1.70 -1.32 0.49 -4.97 115.64 106.94 1aor s THR 307 Ca 0.46 -1.31 0.09 0.00 -1.21 0.00 0.00 61.69 59.72 1aor s THR 307 Cb -0.26 -2.39 -0.04 0.00 -1.51 0.00 0.00 72.50 68.30 1aor s THR 307 CO 0.33 0.00 -0.23 -1.61 -2.21 0.00 0.00 174.62 170.91 1aor s GLU 308 N -3.49 1.22 0.42 7.08 2.02 -1.26 -0.82 118.70 123.86 1aor s GLU 308 Ca 0.21 -1.24 0.00 0.00 0.02 0.00 0.00 54.97 53.97 1aor s GLU 308 Cb -0.02 -1.54 0.00 0.00 0.10 0.00 0.00 34.13 32.67 1aor s GLU 308 CO 0.12 0.36 0.00 0.41 0.02 0.00 0.00 175.26 176.16 1aor n GLY 309 N 0.97 -2.28 3.87 -1.39 0.00 -0.64 -4.85 105.19 100.88 1aor n GLY 309 Ca -0.19 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 43.81 1aor n GLY 309 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1aor s PRO 310 N -0.28 3.71 0.70 1.61 0.04 -1.26 -4.55 135.00 134.98 1aor s PRO 310 Ca 0.00 0.59 -0.07 0.00 0.04 0.00 0.00 61.00 61.56 1aor s PRO 310 Cb 0.00 -2.25 0.06 0.00 0.04 0.00 0.00 34.50 32.35 1aor s PRO 310 CO 0.00 -0.27 1.02 -1.21 0.04 0.00 0.00 177.00 176.58 1aor s GLU 311 N -4.46 2.21 0.16 4.56 0.41 -1.26 -4.74 118.70 115.57 1aor s GLU 311 Ca 0.53 -0.24 -0.22 0.00 -0.41 0.00 0.00 54.97 54.63 1aor s GLU 311 Cb -0.10 -2.17 0.05 0.00 -1.78 0.00 0.00 34.13 30.13 1aor s GLU 311 CO 0.41 -1.24 1.62 -0.92 -0.49 0.00 0.00 175.26 174.64 1aor h TYR 312 N -0.60 -0.70 -0.70 1.61 3.20 -1.93 -1.92 116.97 115.93 1aor h TYR 312 Ca -0.44 0.05 0.07 0.00 3.14 0.00 0.00 58.73 61.54 1aor h TYR 312 Cb 1.32 0.36 -0.04 0.00 1.54 0.00 0.00 36.73 39.90 1aor h TYR 312 CO 0.34 -0.33 0.46 1.49 -1.64 0.00 0.00 178.16 178.47 1aor h GLU 313 N -0.23 0.67 -0.21 1.82 4.57 -1.94 -1.40 114.58 117.85 1aor h GLU 313 Ca 0.16 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 58.17 1aor h GLU 313 Cb 0.48 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1aor h GLU 313 CO -0.45 0.44 -0.39 0.77 -1.18 0.00 0.00 179.01 178.19 1aor h SER 314 N 0.69 0.71 -0.80 1.04 0.02 -1.75 -0.04 113.55 113.42 1aor h SER 314 Ca 0.31 -0.54 0.01 0.00 -0.84 0.00 0.00 61.79 60.73 1aor h SER 314 Cb 0.32 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1aor h SER 314 CO -0.10 1.12 0.52 0.58 -1.14 0.00 0.00 176.83 177.81 1aor h VAL 315 N 0.34 1.19 0.65 2.27 2.07 -0.88 -2.41 116.25 119.48 1aor h VAL 315 Ca 0.01 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 1aor h VAL 315 Cb 0.99 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1aor h VAL 315 CO 0.09 0.19 -0.31 -0.25 0.02 0.00 0.00 177.57 177.31 1aor h TRP 316 N 1.06 -0.81 -0.97 1.57 7.01 -1.17 -0.58 115.95 122.06 1aor h TRP 316 Ca 0.30 -0.02 0.25 0.00 2.11 0.00 0.00 58.89 61.53 1aor h TRP 316 Cb -0.10 0.27 -0.07 0.00 -2.10 0.00 0.00 29.16 27.16 1aor h TRP 316 CO -0.02 -0.51 0.66 0.00 -2.79 0.00 0.00 178.44 175.78 1aor h ALA 317 N -1.24 2.44 -0.02 2.65 0.00 -0.98 -0.45 119.26 121.67 1aor h ALA 317 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1aor h ALA 317 Cb 0.67 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1aor h ALA 317 CO 0.15 -0.76 -0.26 1.28 0.00 0.00 0.00 179.25 179.66 1aor n LEU 318 N -4.46 1.93 0.00 0.00 4.77 -0.91 -4.27 117.00 114.06 1aor n LEU 318 Ca 0.22 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1aor n LEU 318 Cb 0.86 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.95 1aor n LEU 318 CO 0.32 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1aor n GLY 319 N 1.15 0.77 0.41 -0.72 0.00 -0.22 -4.71 105.19 101.86 1aor n GLY 319 Ca 0.08 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.33 1aor n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aor h ALA 320 N -0.04 2.22 -0.71 4.61 0.00 -1.45 0.15 119.26 124.04 1aor h ALA 320 Ca 0.00 0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.09 1aor h ALA 320 Cb 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1aor h ALA 320 CO 0.00 -0.62 0.47 -0.97 0.00 0.00 0.00 179.25 178.13 1aor h ASN 321 N 0.40 0.43 -0.37 0.00 -0.00 -1.49 -0.15 115.58 114.40 1aor h ASN 321 Ca 0.59 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.91 1aor h ASN 321 Cb 1.49 -0.07 0.00 0.00 -0.00 0.00 0.00 38.32 39.74 1aor h ASN 321 CO -0.30 0.24 0.00 0.18 -0.00 0.00 0.00 177.43 177.56 1aor n LEU 322 N -4.48 3.29 -0.38 0.34 4.77 0.38 -2.14 117.00 118.78 1aor n LEU 322 Ca 0.13 -1.55 -0.04 0.00 -0.03 0.00 0.00 56.01 54.51 1aor n LEU 322 Cb 0.44 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1aor n LEU 322 CO 0.33 0.73 -0.05 0.61 -1.33 0.00 0.00 177.39 177.68 1aor n GLY 323 N 1.30 0.58 3.65 -0.72 0.00 -0.09 -1.08 105.19 108.82 1aor n GLY 323 Ca 0.17 -0.83 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 1aor n GLY 323 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aor s ILE 324 N -2.18 4.61 -0.16 -0.61 1.01 -0.40 -3.74 121.20 119.74 1aor s ILE 324 Ca 0.00 -0.11 0.16 0.00 0.00 0.00 0.00 60.65 60.71 1aor s ILE 324 Cb 0.00 -3.03 -0.23 0.00 0.01 0.00 0.00 42.46 39.20 1aor s ILE 324 CO 0.00 0.51 0.11 -0.46 0.00 0.00 0.00 174.94 175.10 1aor n ASN 325 N 3.07 0.57 -4.53 3.58 6.94 -1.26 -2.82 115.26 120.80 1aor n ASN 325 Ca -0.17 0.00 -0.39 0.00 -0.02 0.00 0.00 54.58 54.00 1aor n ASN 325 Cb 0.53 1.06 -0.06 0.00 -2.36 0.00 0.00 39.78 38.95 1aor n ASN 325 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1aor n ASP 326 N -2.60 1.86 0.21 0.53 -0.08 -1.26 -4.42 116.55 110.79 1aor n ASP 326 Ca -0.26 -0.25 0.05 0.00 -1.51 0.00 0.00 54.79 52.82 1aor n ASP 326 Cb 1.01 -1.40 0.47 0.00 2.34 0.00 0.00 41.12 43.54 1aor n ASP 326 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1aor h LEU 327 N 17.10 0.00 -0.16 -2.67 5.85 -1.93 -2.07 115.31 131.42 1aor h LEU 327 Ca -0.20 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.47 1aor h LEU 327 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 1aor h LEU 327 CO 1.20 0.24 -0.08 0.00 -0.34 0.00 0.00 178.44 179.46 1aor h ALA 328 N 1.76 0.22 -0.57 1.25 0.00 -1.93 -1.05 119.26 118.94 1aor h ALA 328 Ca -0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1aor h ALA 328 Cb 0.44 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1aor h ALA 328 CO 0.03 0.03 0.22 0.77 0.00 0.00 0.00 179.25 180.31 1aor h SER 329 N 0.00 0.75 -0.27 0.00 0.02 -1.92 -1.45 113.55 110.69 1aor h SER 329 Ca 0.03 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1aor h SER 329 Cb 0.56 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1aor h SER 329 CO 0.02 0.68 0.08 0.40 -1.14 0.00 0.00 176.83 176.87 1aor h ILE 330 N 0.81 1.20 -0.60 3.27 2.04 -1.25 0.17 117.51 123.16 1aor h ILE 330 Ca 0.19 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 1aor h ILE 330 Cb 0.17 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1aor h ILE 330 CO -0.02 0.21 0.20 0.40 0.00 0.00 0.00 178.15 178.95 1aor h ILE 331 N 0.27 1.22 -0.29 -0.67 2.04 -0.88 0.85 117.51 120.05 1aor h ILE 331 Ca 0.09 -0.75 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1aor h ILE 331 Cb 0.25 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1aor h ILE 331 CO -0.00 0.29 0.04 -0.33 0.00 0.00 0.00 178.15 178.15 1aor h GLU 332 N 0.87 0.48 -0.56 2.37 5.08 -1.03 -0.70 114.58 121.08 1aor h GLU 332 Ca 0.20 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1aor h GLU 332 Cb 0.23 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1aor h GLU 332 CO -0.01 0.59 0.31 0.00 -1.00 0.00 0.00 179.01 178.90 1aor h ALA 333 N 0.87 0.72 -0.27 3.43 0.00 -0.48 -1.11 119.26 122.42 1aor h ALA 333 Ca 0.09 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1aor h ALA 333 Cb 0.35 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1aor h ALA 333 CO 0.01 0.23 0.17 -0.97 0.00 0.00 0.00 179.25 178.69 1aor h ASN 334 N 0.76 0.29 -0.62 0.00 -1.24 -0.74 -1.70 115.58 112.33 1aor h ASN 334 Ca 0.20 -0.00 0.09 0.00 0.71 0.00 0.00 56.30 57.29 1aor h ASN 334 Cb 0.04 -0.07 -0.07 0.00 0.73 0.00 0.00 38.32 38.95 1aor h ASN 334 CO -0.03 0.21 0.25 -0.74 -1.29 0.00 0.00 177.43 175.83 1aor h HIS 335 N 0.35 0.45 0.00 0.67 2.76 -0.63 -1.25 115.15 117.49 1aor h HIS 335 Ca 0.10 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.22 1aor h HIS 335 Cb -0.03 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1aor h HIS 335 CO -0.07 0.14 -0.39 0.52 -1.30 0.00 0.00 177.93 176.83 1aor h MET 336 N 0.45 0.00 -0.22 5.26 2.86 -0.86 -1.36 114.93 121.06 1aor h MET 336 Ca 0.31 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.77 1aor h MET 336 Cb 0.35 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 1aor h MET 336 CO -0.28 0.39 -0.58 0.00 1.06 0.00 0.00 176.91 177.50 1aor h ASP 338 N 0.54 0.65 -0.36 0.00 3.32 -1.05 0.32 116.42 119.83 1aor h ASP 338 Ca 0.00 -0.33 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 1aor h ASP 338 Cb 1.16 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 1aor h ASP 338 CO 0.12 0.82 -0.00 -0.33 -1.72 0.00 0.00 179.24 178.13 1aor h GLU 339 N 0.46 0.64 0.00 3.56 4.39 -1.19 -3.12 114.58 119.32 1aor h GLU 339 Ca 0.10 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1aor h GLU 339 Cb 0.51 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1aor h GLU 339 CO 0.02 0.75 -0.19 1.28 -1.16 0.00 0.00 179.01 179.71 1aor n LEU 340 N -4.49 0.48 -1.27 1.33 4.77 -0.06 -1.53 117.00 116.23 1aor n LEU 340 Ca -0.02 0.40 -0.01 0.00 -0.03 0.00 0.00 56.01 56.35 1aor n LEU 340 Cb 0.28 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1aor n LEU 340 CO 0.40 -0.05 0.01 0.61 -1.33 0.00 0.00 177.39 177.03 1aor n GLY 341 N 1.41 0.42 3.27 -0.72 0.00 0.02 -1.90 105.19 107.69 1aor n GLY 341 Ca 0.06 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 1aor n GLY 341 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aor s LEU 342 N -2.48 2.08 0.02 0.99 1.43 0.90 -1.07 118.68 120.55 1aor s LEU 342 Ca 0.00 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.34 1aor s LEU 342 Cb -0.00 -1.17 -0.06 0.00 0.03 0.00 0.00 46.19 44.99 1aor s LEU 342 CO 0.06 0.26 1.39 -0.62 0.23 0.00 0.00 176.35 177.67 1aor s ASP 343 N -0.75 6.86 0.25 2.29 2.15 -0.68 -4.49 116.67 122.30 1aor s ASP 343 Ca 0.09 2.14 -0.05 0.00 0.43 0.00 0.00 52.55 55.16 1aor s ASP 343 Cb -0.09 -2.57 0.28 0.00 -0.30 0.00 0.00 42.92 40.25 1aor s ASP 343 CO -0.00 -0.69 1.84 0.71 -0.17 0.00 0.00 175.17 176.85 1aor h THR 344 N 4.80 1.24 0.08 1.71 1.35 -1.91 -1.60 112.91 118.59 1aor h THR 344 Ca -0.39 -0.71 -0.00 0.00 -0.55 0.00 0.00 66.41 64.76 1aor h THR 344 Cb 1.18 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1aor h THR 344 CO 0.89 0.30 -0.04 0.40 -0.25 0.00 0.00 175.52 176.82 1aor h ILE 345 N 1.08 1.14 0.00 6.82 2.04 -1.91 -0.34 117.51 126.34 1aor h ILE 345 Ca 0.26 -0.90 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 1aor h ILE 345 Cb 0.14 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1aor h ILE 345 CO -0.03 0.22 -0.25 0.28 0.00 0.00 0.00 178.15 178.37 1aor h SER 346 N -0.53 0.00 0.13 1.72 0.02 -1.88 -0.13 113.55 112.89 1aor h SER 346 Ca -0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1aor h SER 346 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1aor h SER 346 CO 0.02 0.25 -0.06 0.74 -1.14 0.00 0.00 176.83 176.64 1aor h THR 347 N 0.00 1.01 -0.76 -2.27 2.02 -1.12 -1.59 112.91 110.21 1aor h THR 347 Ca -0.00 -0.66 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 1aor h THR 347 Cb 0.54 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 1aor h THR 347 CO 0.03 0.15 0.33 1.23 0.37 0.00 0.00 175.52 177.64 1aor h GLY 348 N -0.49 1.19 1.12 2.16 0.00 -0.78 -1.90 103.07 104.36 1aor h GLY 348 Ca -0.02 -0.61 -0.09 0.00 0.00 0.00 0.00 47.33 46.62 1aor h GLY 348 CO 0.03 0.58 0.05 -1.33 0.00 0.00 0.00 176.54 175.87 1aor h GLY 349 N 1.13 1.15 1.07 4.60 0.00 -1.02 -0.45 103.07 109.55 1aor h GLY 349 Ca 0.26 -0.79 -0.12 0.00 0.00 0.00 0.00 47.33 46.67 1aor h GLY 349 CO -0.03 0.73 -0.19 -0.84 0.00 0.00 0.00 176.54 176.22 1aor h THR 350 N 0.98 1.27 -0.49 4.70 2.02 -1.09 -1.38 112.91 118.92 1aor h THR 350 Ca 0.19 -1.34 -0.07 0.00 0.77 0.00 0.00 66.41 65.96 1aor h THR 350 Cb 0.49 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 1aor h THR 350 CO 0.02 0.46 0.03 -0.07 0.37 0.00 0.00 175.52 176.33 1aor h LEU 351 N 0.77 0.76 -0.62 2.58 3.38 -1.15 -2.12 115.31 118.90 1aor h LEU 351 Ca 0.10 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1aor h LEU 351 Cb 0.76 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1aor h LEU 351 CO 0.06 0.81 -0.14 0.00 0.09 0.00 0.00 178.44 179.26 1aor h ALA 352 N 1.28 0.82 -0.69 1.53 0.00 -0.84 -1.32 119.26 120.04 1aor h ALA 352 Ca 0.15 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.72 1aor h ALA 352 Cb 0.41 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1aor h ALA 352 CO 0.01 0.66 0.45 1.15 0.00 0.00 0.00 179.25 181.52 1aor h THR 353 N 0.84 1.14 -0.59 0.00 2.02 -0.88 -1.61 112.91 113.82 1aor h THR 353 Ca 0.13 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1aor h THR 353 Cb 0.68 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 1aor h THR 353 CO 0.05 0.17 0.37 0.00 0.37 0.00 0.00 175.52 176.48 1aor h ALA 354 N 1.27 0.76 -0.28 6.16 0.00 -0.97 0.12 119.26 126.32 1aor h ALA 354 Ca 0.26 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1aor h ALA 354 Cb -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1aor h ALA 354 CO -0.08 0.22 -0.15 0.52 0.00 0.00 0.00 179.25 179.76 1aor h MET 355 N 0.80 0.47 0.07 0.00 2.86 -0.80 0.79 114.93 119.13 1aor h MET 355 Ca 0.22 -0.14 -0.25 0.00 -2.06 0.00 0.00 59.70 57.47 1aor h MET 355 Cb -0.05 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 1aor h MET 355 CO -0.04 0.62 -1.10 1.49 1.06 0.00 0.00 176.91 178.93 1aor h GLU 356 N 0.44 0.25 -0.59 1.72 4.81 -0.83 -1.01 114.58 119.37 1aor h GLU 356 Ca 0.08 -0.37 -0.08 0.00 -0.13 0.00 0.00 59.36 58.86 1aor h GLU 356 Cb 0.52 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1aor h GLU 356 CO 0.03 1.13 0.06 -0.07 -0.73 0.00 0.00 179.01 179.43 1aor h LEU 357 N 0.10 0.93 -0.04 1.64 3.38 -0.74 -1.18 115.31 119.41 1aor h LEU 357 Ca -0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1aor h LEU 357 Cb 1.80 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 1aor h LEU 357 CO 0.18 0.96 -0.00 0.22 0.09 0.00 0.00 178.44 179.88 1aor h TYR 358 N 0.91 0.09 -0.88 1.13 3.20 -0.84 0.38 116.97 120.96 1aor h TYR 358 Ca 0.18 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.11 1aor h TYR 358 Cb 0.45 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.63 1aor h TYR 358 CO 0.03 0.39 0.54 1.49 -1.64 0.00 0.00 178.16 178.97 1aor h GLU 359 N -0.24 0.91 -0.72 1.82 4.81 -1.04 -0.99 114.58 119.13 1aor h GLU 359 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1aor h GLU 359 Cb 0.36 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1aor h GLU 359 CO 0.00 0.60 0.00 1.63 -0.73 0.00 0.00 179.01 180.51 1aor n LYS 360 N -4.65 1.99 -1.17 1.92 5.02 -0.46 -4.89 118.16 115.93 1aor n LYS 360 Ca 0.14 -0.89 -0.06 0.00 -2.02 0.00 0.00 58.31 55.48 1aor n LYS 360 Cb 0.24 -1.59 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 1aor n LYS 360 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aor n GLY 361 N 0.35 0.73 0.08 0.72 0.00 -0.38 -4.89 105.19 101.80 1aor n GLY 361 Ca 0.08 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1aor n GLY 361 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1aor h HIS 362 N 0.00 0.19 -3.59 1.61 3.86 -0.43 -3.42 115.15 113.38 1aor h HIS 362 Ca -0.12 -0.14 -0.65 0.00 -1.16 0.00 0.00 60.37 58.31 1aor h HIS 362 Cb 0.70 -0.01 -0.22 0.00 1.06 0.00 0.00 27.41 28.94 1aor h HIS 362 CO 0.37 1.13 -0.62 0.42 0.86 0.00 0.00 177.93 180.08 1aor s ILE 363 N -2.67 4.30 0.11 2.45 1.01 -1.08 -4.95 121.20 120.37 1aor s ILE 363 Ca -0.03 -0.18 0.04 0.00 0.00 0.00 0.00 60.65 60.48 1aor s ILE 363 Cb 0.09 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1aor s ILE 363 CO 0.84 0.36 0.09 -0.54 0.00 0.00 0.00 174.94 175.69 1aor s LYS 364 N 1.43 2.86 0.38 2.79 1.02 -1.26 -4.51 119.74 122.44 1aor s LYS 364 Ca 0.05 -0.76 0.10 0.00 0.02 0.00 0.00 55.97 55.39 1aor s LYS 364 Cb -0.15 -2.69 0.86 0.00 -0.52 0.00 0.00 37.83 35.34 1aor s LYS 364 CO 0.03 0.54 1.91 -0.44 -0.92 0.00 0.00 175.35 176.47 1aor h ASP 365 N 3.04 0.59 -0.39 2.83 5.19 -1.98 0.16 116.42 125.85 1aor h ASP 365 Ca -0.47 0.03 0.11 0.00 -0.62 0.00 0.00 57.03 56.08 1aor h ASP 365 Cb 1.17 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 1aor h ASP 365 CO 0.65 0.32 0.39 -0.33 -3.12 0.00 0.00 179.24 177.15 1aor h GLU 366 N 0.63 0.00 0.00 3.56 3.07 -1.94 0.25 114.58 120.15 1aor h GLU 366 Ca 0.39 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 59.05 1aor h GLU 366 Cb 0.63 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.51 1aor h GLU 366 CO -0.15 0.00 -1.20 1.49 -1.40 0.00 0.00 179.01 177.75 1aor h GLU 367 N 0.00 0.00 0.14 2.33 4.81 -1.09 -3.35 114.58 117.42 1aor h GLU 367 Ca 0.19 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.12 1aor h GLU 367 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1aor h GLU 367 CO -0.00 0.57 -1.39 -0.07 -0.73 0.00 0.00 179.01 177.39 1aor h LEU 368 N 0.00 0.46 0.00 1.64 3.38 -0.48 -3.49 115.31 116.82 1aor h LEU 368 Ca -0.12 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.30 1aor h LEU 368 Cb 1.71 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1aor h LEU 368 CO 0.08 1.44 0.00 0.61 0.09 0.00 0.00 178.44 180.66 1aor n GLY 369 N 1.61 1.35 0.93 0.83 0.00 -0.56 -3.18 105.19 106.17 1aor n GLY 369 Ca -0.13 -0.64 0.12 0.00 0.00 0.00 0.00 46.02 45.38 1aor n GLY 369 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aor n ASP 370 N 7.33 2.86 -4.77 1.61 8.00 -1.26 -4.93 116.55 125.39 1aor n ASP 370 Ca 0.00 -1.92 -0.37 0.00 0.71 0.00 0.00 54.79 53.21 1aor n ASP 370 Cb 0.00 -0.08 -0.01 0.00 -0.02 0.00 0.00 41.12 41.01 1aor n ASP 370 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1aor s ALA 371 N -1.84 3.02 0.10 2.24 0.00 -1.19 -4.93 121.76 119.16 1aor s ALA 371 Ca 0.33 0.96 -0.36 0.00 0.00 0.00 0.00 51.96 52.89 1aor s ALA 371 Cb 0.21 -3.39 -0.17 0.00 0.00 0.00 0.00 23.12 19.77 1aor s ALA 371 CO 0.31 -0.66 1.31 -2.30 0.00 0.00 0.00 175.76 174.42 1aor n PRO 372 N -0.36 1.12 -2.15 0.00 -0.02 -1.26 -4.93 135.00 127.41 1aor n PRO 372 Ca 0.07 0.41 -0.39 0.00 -2.02 0.00 0.00 63.50 61.56 1aor n PRO 372 Cb 0.47 -2.03 -0.01 0.00 -0.02 0.00 0.00 33.50 31.92 1aor n PRO 372 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1aor s PRO 373 N 0.36 3.98 -1.55 0.52 0.02 -1.26 -4.90 135.00 132.18 1aor s PRO 373 Ca 0.83 2.01 -0.11 0.00 0.02 0.00 0.00 61.00 63.76 1aor s PRO 373 Cb -0.95 -2.70 -0.07 0.00 0.02 0.00 0.00 34.50 30.80 1aor s PRO 373 CO 0.48 -0.44 2.78 1.19 -0.33 0.00 0.00 177.00 180.68 1aor n PHE 374 N 0.07 2.56 -3.49 6.54 3.72 -1.26 -4.87 117.46 120.72 1aor n PHE 374 Ca 0.04 -3.00 -0.38 0.00 -0.05 0.00 0.00 57.45 54.06 1aor n PHE 374 Cb 0.45 -2.46 -0.06 0.00 -0.94 0.00 0.00 39.48 36.47 1aor n PHE 374 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1aor s ARG 375 N 2.46 4.06 0.22 -1.08 3.52 -1.26 -4.37 118.95 122.50 1aor s ARG 375 Ca 0.64 0.32 -0.32 0.00 -0.13 0.00 0.00 55.73 56.24 1aor s ARG 375 Cb 0.17 -3.32 -0.14 0.00 -1.56 0.00 0.00 34.95 30.11 1aor s ARG 375 CO -0.06 0.47 1.43 0.91 -0.81 0.00 0.00 175.30 177.24 1aor n TRP 376 N 2.66 2.14 -0.65 5.12 7.02 -1.26 -1.72 117.44 130.75 1aor n TRP 376 Ca -0.12 0.41 0.00 0.00 -1.02 0.00 0.00 57.50 56.77 1aor n TRP 376 Cb 0.52 -2.47 0.00 0.00 -2.42 0.00 0.00 31.31 26.94 1aor n TRP 376 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1aor n GLY 377 N 2.42 1.04 3.55 6.99 0.00 -0.24 -4.98 105.19 113.97 1aor n GLY 377 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1aor n GLY 377 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1aor s ASN 378 N -3.06 6.15 0.64 1.61 3.04 -0.70 -4.81 114.94 117.81 1aor s ASN 378 Ca 0.00 -0.45 0.39 0.00 0.04 0.00 0.00 52.86 52.85 1aor s ASN 378 Cb 0.00 -2.56 2.21 0.00 -1.54 0.00 0.00 41.25 39.36 1aor s ASN 378 CO 0.00 -1.85 2.33 0.71 -3.04 0.00 0.00 177.10 175.26 1aor h THR 379 N 6.05 0.19 0.00 -5.21 1.35 -1.94 -1.60 112.91 111.74 1aor h THR 379 Ca -0.27 -0.01 -0.01 0.00 -0.55 0.00 0.00 66.41 65.56 1aor h THR 379 Cb 1.05 1.01 -0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1aor h THR 379 CO 1.28 0.00 -0.06 -0.08 -0.25 0.00 0.00 175.52 176.41 1aor h GLU 380 N 0.00 0.00 -0.71 4.72 4.81 -1.97 -2.05 114.58 119.39 1aor h GLU 380 Ca -0.00 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1aor h GLU 380 Cb 0.01 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 1aor h GLU 380 CO 0.00 0.06 0.46 0.28 -0.73 0.00 0.00 179.01 179.08 1aor h VAL 381 N 0.00 1.14 -0.44 0.32 2.07 -1.62 0.34 116.25 118.05 1aor h VAL 381 Ca -0.00 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 1aor h VAL 381 Cb 0.17 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 1aor h VAL 381 CO 0.01 0.17 0.08 -0.07 0.02 0.00 0.00 177.57 177.77 1aor h LEU 382 N 0.91 0.69 -0.65 2.57 3.38 -1.55 -1.16 115.31 119.50 1aor h LEU 382 Ca 0.27 -0.25 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 1aor h LEU 382 Cb -0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1aor h LEU 382 CO -0.08 0.77 -0.41 0.45 0.09 0.00 0.00 178.44 179.26 1aor h HIS 383 N 0.59 0.71 0.00 1.13 3.86 -1.32 -3.36 115.15 116.75 1aor h HIS 383 Ca 0.13 -0.21 -0.23 0.00 -1.16 0.00 0.00 60.37 58.91 1aor h HIS 383 Cb 0.37 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.65 1aor h HIS 383 CO 0.03 0.90 -1.37 0.98 0.86 0.00 0.00 177.93 179.33 1aor n TYR 384 N -4.03 0.75 0.12 2.45 4.19 0.07 -4.72 117.16 115.99 1aor n TYR 384 Ca -0.02 0.32 -0.03 0.00 3.31 0.00 0.00 57.90 61.49 1aor n TYR 384 Cb 0.52 -0.99 0.14 0.00 0.49 0.00 0.00 39.34 39.50 1aor n TYR 384 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1aor h TYR 385 N -1.00 0.11 -0.31 2.98 0.05 -1.41 -3.34 116.97 114.06 1aor h TYR 385 Ca -0.34 -0.04 0.07 0.00 0.05 0.00 0.00 58.73 58.47 1aor h TYR 385 Cb 1.21 -0.02 -0.07 0.00 1.01 0.00 0.00 36.73 38.86 1aor h TYR 385 CO -0.02 0.69 -0.16 0.82 -1.05 0.00 0.00 178.16 178.43 1aor h ILE 386 N 0.06 0.51 -0.64 -2.88 2.04 -1.72 0.00 117.51 114.88 1aor h ILE 386 Ca -0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 1aor h ILE 386 Cb 1.13 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1aor h ILE 386 CO 0.09 0.00 0.26 -0.08 0.00 0.00 0.00 178.15 178.42 1aor h GLU 387 N -0.12 0.93 -0.65 2.37 4.81 -1.87 -2.36 114.58 117.69 1aor h GLU 387 Ca 0.16 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1aor h GLU 387 Cb 0.37 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1aor h GLU 387 CO -0.38 0.76 0.30 0.87 -0.73 0.00 0.00 179.01 179.83 1aor h LYS 388 N 0.92 0.92 -0.13 1.92 1.79 -1.35 -0.96 116.57 119.68 1aor h LYS 388 Ca 0.22 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 1aor h LYS 388 Cb 0.17 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1aor h LYS 388 CO -0.02 0.71 0.03 0.82 -1.08 0.00 0.00 179.45 179.92 1aor h ILE 389 N 0.91 1.20 -0.83 1.86 2.04 -0.54 0.25 117.51 122.41 1aor h ILE 389 Ca 0.22 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.50 1aor h ILE 389 Cb 0.10 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 1aor h ILE 389 CO -0.03 0.18 0.54 0.00 0.00 0.00 0.00 178.15 178.84 1aor h ALA 390 N 0.83 1.06 -0.01 1.87 0.00 -1.07 -1.78 119.26 120.16 1aor h ALA 390 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1aor h ALA 390 Cb 0.25 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1aor h ALA 390 CO 0.00 0.41 -0.08 1.63 0.00 0.00 0.00 179.25 181.21 1aor n LYS 391 N -4.54 1.17 -3.81 0.00 4.76 -0.40 -3.76 118.16 111.58 1aor n LYS 391 Ca 0.09 -0.56 -0.24 0.00 -2.87 0.00 0.00 58.31 54.72 1aor n LYS 391 Cb 0.05 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 31.77 1aor n LYS 391 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1aor n ARG 392 N -0.42 -4.75 -4.25 1.97 1.74 -0.25 -4.97 116.66 105.73 1aor n ARG 392 Ca 0.17 0.57 -0.35 0.00 -0.77 0.00 0.00 57.85 57.47 1aor n ARG 392 Cb 0.30 -5.14 -0.09 0.00 -1.02 0.00 0.00 32.46 26.51 1aor n ARG 392 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1aor s GLU 393 N -6.25 3.26 5.41 5.56 2.02 -0.09 -4.28 118.70 124.33 1aor s GLU 393 Ca 0.18 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1aor s GLU 393 Cb -0.09 -2.92 0.00 0.00 0.10 0.00 0.00 34.13 31.22 1aor s GLU 393 CO 0.83 0.61 0.00 0.41 0.02 0.00 0.00 175.26 177.13 1aor n GLY 394 N 2.44 3.18 0.31 -1.39 0.00 -1.26 -0.46 105.19 108.02 1aor n GLY 394 Ca -0.18 -0.10 0.20 0.00 0.00 0.00 0.00 46.02 45.93 1aor n GLY 394 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1aor h PHE 395 N 0.00 0.00 -0.02 1.61 3.57 -1.94 -1.97 116.94 118.19 1aor h PHE 395 Ca 0.00 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1aor h PHE 395 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1aor h PHE 395 CO 0.00 0.00 0.02 0.78 -2.23 0.00 0.00 178.31 176.89 1aor h GLY 396 N 0.85 0.00 1.61 2.40 0.00 -0.97 -0.49 103.07 106.47 1aor h GLY 396 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1aor h GLY 396 CO 0.00 0.00 -0.36 -1.80 0.00 0.00 0.00 176.54 174.38 1aor h ASP 397 N 0.00 0.46 0.37 0.19 3.58 -1.43 -0.67 116.42 118.92 1aor h ASP 397 Ca 0.01 -0.18 -0.27 0.00 0.42 0.00 0.00 57.03 57.01 1aor h ASP 397 Cb 0.06 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 40.99 1aor h ASP 397 CO -0.00 0.78 -1.15 0.11 -2.88 0.00 0.00 179.24 176.10 1aor h LYS 398 N 0.38 0.43 0.00 0.28 1.57 -1.29 -3.20 116.57 114.74 1aor h LYS 398 Ca 0.04 -0.58 -0.05 0.00 -1.87 0.00 0.00 60.65 58.19 1aor h LYS 398 Cb 0.80 0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1aor h LYS 398 CO 0.06 1.23 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.85 1aor h LEU 399 N 0.19 0.00 -0.18 2.94 3.38 -1.22 -2.97 115.31 117.45 1aor h LEU 399 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1aor h LEU 399 Cb 1.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.58 1aor h LEU 399 CO 0.20 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.99 1aor n ALA 400 N -2.33 1.44 0.93 1.53 0.00 -0.27 -2.23 120.51 119.57 1aor n ALA 400 Ca -0.01 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1aor n ALA 400 Cb 0.37 -1.19 0.34 0.00 0.00 0.00 0.00 19.45 18.96 1aor n ALA 400 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1aor n GLU 401 N -1.64 0.04 0.00 0.00 -0.58 -1.12 -1.75 120.64 115.60 1aor n GLU 401 Ca 0.02 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 1aor n GLU 401 Cb 0.12 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 1aor n GLU 401 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1aor n GLY 402 N 1.47 0.63 0.21 0.62 0.00 -0.95 -4.41 105.19 102.77 1aor n GLY 402 Ca 0.06 -1.84 -0.07 0.00 0.00 0.00 0.00 46.02 44.16 1aor n GLY 402 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1aor h SER 403 N 0.00 -0.53 0.60 1.61 0.87 -1.86 -2.07 113.55 112.16 1aor h SER 403 Ca 0.00 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 1aor h SER 403 Cb 0.00 0.28 0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1aor h SER 403 CO 0.00 -0.20 -0.29 0.22 -0.53 0.00 0.00 176.83 176.03 1aor h TYR 404 N -0.15 -0.74 -0.66 2.24 3.20 -1.86 -0.94 116.97 118.07 1aor h TYR 404 Ca 0.14 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.02 1aor h TYR 404 Cb 0.36 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.84 1aor h TYR 404 CO -0.34 -0.46 0.44 0.00 -1.64 0.00 0.00 178.16 176.16 1aor h ARG 405 N -0.81 0.78 -0.04 1.82 3.08 -1.76 0.13 114.38 117.58 1aor h ARG 405 Ca -0.08 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1aor h ARG 405 Cb 0.62 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1aor h ARG 405 CO 0.13 0.51 0.00 1.25 -1.07 0.00 0.00 179.97 180.80 1aor h LEU 406 N 0.80 0.07 -0.77 3.04 5.85 -1.24 -1.78 115.31 121.28 1aor h LEU 406 Ca 0.26 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1aor h LEU 406 Cb 0.05 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1aor h LEU 406 CO -0.07 0.35 0.26 0.00 -0.34 0.00 0.00 178.44 178.64 1aor h ALA 407 N 0.73 1.00 -0.91 1.25 0.00 -0.76 -2.84 119.26 117.73 1aor h ALA 407 Ca 0.01 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1aor h ALA 407 Cb 0.31 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1aor h ALA 407 CO 0.00 0.67 0.55 1.49 0.00 0.00 0.00 179.25 181.96 1aor h GLU 408 N 1.14 1.23 0.00 0.00 4.81 -0.68 -0.15 114.58 120.94 1aor h GLU 408 Ca 0.25 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1aor h GLU 408 Cb 0.29 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1aor h GLU 408 CO -0.01 0.86 0.00 0.66 -0.73 0.00 0.00 179.01 179.79 1aor h SER 409 N 1.25 0.00 -0.36 1.04 4.64 -1.07 -1.14 113.55 117.91 1aor h SER 409 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1aor h SER 409 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1aor h SER 409 CO -0.06 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.68 1aor n TYR 410 N -2.60 0.47 -1.69 4.77 4.01 -0.96 -4.96 117.16 116.20 1aor n TYR 410 Ca 0.01 -0.25 -0.05 0.00 -0.16 0.00 0.00 57.90 57.45 1aor n TYR 410 Cb 0.21 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.23 1aor n TYR 410 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aor n GLY 411 N 1.39 0.42 2.22 2.72 0.00 -0.43 -4.99 105.19 106.52 1aor n GLY 411 Ca 0.18 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1aor n GLY 411 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1aor n HIS 412 N -3.52 -0.36 0.29 1.61 8.25 -0.11 -4.95 115.22 116.44 1aor n HIS 412 Ca -0.05 -3.55 0.17 0.00 -0.26 0.00 0.00 57.72 54.02 1aor n HIS 412 Cb 0.38 -0.27 0.89 0.00 1.12 0.00 0.00 29.99 32.11 1aor n HIS 412 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1aor h PRO 413 N 3.70 0.00 0.00 -0.41 0.11 -1.87 -1.99 132.00 131.54 1aor h PRO 413 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1aor h PRO 413 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1aor h PRO 413 CO 0.46 0.05 0.00 1.05 -0.21 0.00 0.00 178.00 179.35 1aor h GLU 414 N 0.00 0.00 -0.00 1.05 9.09 -1.92 -1.72 114.58 121.08 1aor h GLU 414 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1aor h GLU 414 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.32 1aor h GLU 414 CO 0.01 0.00 -0.15 1.28 0.05 0.00 0.00 179.01 180.20 1aor n LEU 415 N -2.42 0.54 -4.52 3.06 4.77 -0.75 -4.75 117.00 112.94 1aor n LEU 415 Ca 0.02 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 1aor n LEU 415 Cb 0.23 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.06 1aor n LEU 415 CO 0.21 0.10 0.37 -0.55 -1.33 0.00 0.00 177.39 176.19 1aor s SER 416 N -2.53 6.32 -1.33 -1.43 0.15 -0.65 -4.80 113.70 109.43 1aor s SER 416 Ca 0.26 -0.34 -0.14 0.00 0.70 0.00 0.00 55.95 56.43 1aor s SER 416 Cb 0.20 -2.32 0.10 0.00 -1.71 0.00 0.00 66.02 62.29 1aor s SER 416 CO 0.50 -0.77 1.86 0.23 1.20 0.00 0.00 173.24 176.26 1aor n MET 417 N 6.23 3.20 -4.21 5.44 2.81 -1.26 -4.89 117.12 124.44 1aor n MET 417 Ca -0.02 -3.21 -0.14 0.00 -1.81 0.00 0.00 57.70 52.52 1aor n MET 417 Cb 0.48 -3.25 -0.10 0.00 -0.71 0.00 0.00 33.22 29.63 1aor n MET 417 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1aor s THR 418 N 2.76 1.00 -0.12 2.03 -4.23 -1.26 -1.90 115.64 113.91 1aor s THR 418 Ca 0.47 -1.85 -0.01 0.00 -1.18 0.00 0.00 61.69 59.12 1aor s THR 418 Cb 0.07 -1.61 0.03 0.00 1.34 0.00 0.00 72.50 72.34 1aor s THR 418 CO 0.00 -0.68 -0.03 -0.69 -0.54 0.00 0.00 174.62 172.68 1aor s VAL 419 N -2.97 0.77 -1.64 2.29 1.01 -0.78 -4.44 120.40 114.64 1aor s VAL 419 Ca 0.11 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 1aor s VAL 419 Cb 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1aor s VAL 419 CO -0.00 0.21 0.34 0.29 0.00 0.00 0.00 175.10 175.94 1aor n LYS 420 N 5.01 -3.47 -0.97 2.72 5.02 -1.26 -1.03 118.16 124.18 1aor n LYS 420 Ca -0.10 0.95 0.00 0.00 -2.02 0.00 0.00 58.31 57.13 1aor n LYS 420 Cb 0.49 -5.70 0.00 0.00 -0.02 0.00 0.00 35.03 29.80 1aor n LYS 420 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1aor n LYS 421 N -3.56 -0.77 -3.58 1.97 5.02 -1.26 -4.41 118.16 111.57 1aor n LYS 421 Ca -0.17 0.19 -0.37 0.00 -2.02 0.00 0.00 58.31 55.94 1aor n LYS 421 Cb 0.65 -3.83 -0.09 0.00 -0.02 0.00 0.00 35.03 31.75 1aor n LYS 421 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1aor s LEU 422 N 0.00 4.15 0.21 -0.35 2.96 -0.74 -4.73 118.68 120.17 1aor s LEU 422 Ca 0.00 0.27 -0.32 0.00 -0.22 0.00 0.00 54.13 53.86 1aor s LEU 422 Cb 0.00 -2.24 -0.12 0.00 0.50 0.00 0.00 46.19 44.32 1aor s LEU 422 CO 0.00 0.04 1.66 -0.62 -1.32 0.00 0.00 176.35 176.10 1aor n GLU 423 N 4.21 2.59 -2.15 1.98 4.71 -1.26 -1.87 120.64 128.84 1aor n GLU 423 Ca -0.13 0.93 -0.36 0.00 -0.01 0.00 0.00 57.16 57.59 1aor n GLU 423 Cb 0.52 -2.74 0.01 0.00 -1.01 0.00 0.00 31.44 28.22 1aor n GLU 423 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1aor s LEU 424 N 0.80 3.82 0.00 -4.62 1.43 -0.80 -4.81 118.68 114.50 1aor s LEU 424 Ca 0.74 2.32 -0.07 0.00 -1.03 0.00 0.00 54.13 56.09 1aor s LEU 424 Cb -0.55 -4.45 0.14 0.00 0.03 0.00 0.00 46.19 41.35 1aor s LEU 424 CO 0.37 -1.25 0.86 -0.81 0.23 0.00 0.00 176.35 175.74 1aor n PRO 425 N -1.10 -0.50 -0.17 1.29 -0.05 -1.26 -4.92 135.00 128.29 1aor n PRO 425 Ca 0.11 -1.70 -0.00 0.00 -0.05 0.00 0.00 63.50 61.86 1aor n PRO 425 Cb 0.49 -0.77 -0.00 0.00 -0.05 0.00 0.00 33.50 33.17 1aor n PRO 425 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1aor n ALA 426 N -3.32 2.31 -3.67 0.55 0.00 -1.26 -4.69 120.51 110.43 1aor n ALA 426 Ca -0.14 -0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 1aor n ALA 426 Cb 0.42 -1.72 -0.11 0.00 0.00 0.00 0.00 19.45 18.04 1aor n ALA 426 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1aor s TYR 427 N 1.43 -0.63 -0.24 0.00 2.02 -1.26 -4.67 117.35 114.00 1aor s TYR 427 Ca 0.01 1.28 -0.29 0.00 -0.37 0.00 0.00 57.07 57.71 1aor s TYR 427 Cb 0.01 0.18 0.01 0.00 -0.40 0.00 0.00 41.96 41.76 1aor s TYR 427 CO 0.00 -0.41 1.04 0.34 -1.57 0.00 0.00 175.55 174.95 1aor s ASP 428 N 2.31 7.07 0.66 2.29 -1.08 -0.37 -4.92 116.67 122.62 1aor s ASP 428 Ca -0.02 1.32 0.43 0.00 -0.52 0.00 0.00 52.55 53.76 1aor s ASP 428 Cb -0.11 -2.54 2.33 0.00 -1.46 0.00 0.00 42.92 41.14 1aor s ASP 428 CO -0.11 -0.70 2.35 1.55 0.52 0.00 0.00 175.17 178.78 1aor h PRO 429 N 7.55 0.00 0.00 4.34 0.13 -1.91 -1.90 132.00 140.21 1aor h PRO 429 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1aor h PRO 429 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1aor h PRO 429 CO 0.99 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.30 1aor n ARG 430 N -3.17 0.09 -0.05 0.86 1.74 -1.26 -1.36 116.66 113.51 1aor n ARG 430 Ca -0.03 0.40 0.06 0.00 -0.77 0.00 0.00 57.85 57.51 1aor n ARG 430 Cb 0.08 -1.70 0.08 0.00 -1.02 0.00 0.00 32.46 29.90 1aor n ARG 430 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1aor n GLY 431 N -0.37 0.48 2.96 -0.13 0.00 -0.71 -4.62 105.19 102.80 1aor n GLY 431 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 46.02 45.65 1aor n GLY 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aor s ALA 432 N -1.03 -2.46 0.29 4.61 0.00 -0.46 -4.82 121.76 117.89 1aor s ALA 432 Ca 0.17 -0.00 -0.02 0.00 0.00 0.00 0.00 51.96 52.11 1aor s ALA 432 Cb 0.11 -2.76 0.40 0.00 0.00 0.00 0.00 23.12 20.88 1aor s ALA 432 CO 0.16 -2.26 1.90 0.93 0.00 0.00 0.00 175.76 176.50 1aor h GLU 433 N 5.88 1.01 -0.51 0.00 5.08 -1.01 -1.71 114.58 123.32 1aor h GLU 433 Ca 0.05 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1aor h GLU 433 Cb 1.15 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 1aor h GLU 433 CO 0.04 0.75 -0.00 0.78 -1.00 0.00 0.00 179.01 179.58 1aor h GLY 434 N 1.06 0.94 1.51 -3.84 0.00 -1.84 -1.66 103.07 99.23 1aor h GLY 434 Ca 0.26 -0.64 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 1aor h GLY 434 CO -0.04 0.59 0.17 0.84 0.00 0.00 0.00 176.54 178.10 1aor h HIS 435 N 0.81 0.63 -0.45 5.60 6.17 -1.69 -1.60 115.15 124.63 1aor h HIS 435 Ca 0.15 -0.03 -0.00 0.00 0.71 0.00 0.00 60.37 61.20 1aor h HIS 435 Cb 0.48 -0.20 -0.02 0.00 2.52 0.00 0.00 27.41 30.19 1aor h HIS 435 CO 0.03 0.51 0.27 0.78 0.71 0.00 0.00 177.93 180.22 1aor h GLY 436 N 0.79 0.65 1.51 5.26 0.00 -0.46 0.01 103.07 110.83 1aor h GLY 436 Ca 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1aor h GLY 436 CO -0.01 0.26 0.27 -2.00 0.00 0.00 0.00 176.54 175.05 1aor h LEU 437 N 0.59 0.57 -0.24 3.11 6.46 -0.73 -1.79 115.31 123.28 1aor h LEU 437 Ca 0.16 -0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1aor h LEU 437 Cb -0.00 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 1aor h LEU 437 CO -0.03 0.46 0.15 1.23 -0.62 0.00 0.00 178.44 179.63 1aor h GLY 438 N 0.72 0.33 0.82 3.75 0.00 -0.12 -0.60 103.07 107.98 1aor h GLY 438 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 47.33 47.40 1aor h GLY 438 CO -0.03 0.11 -0.01 -0.97 0.00 0.00 0.00 176.54 175.64 1aor h TYR 439 N 0.30 -0.02 -0.71 5.60 0.05 -0.41 0.96 116.97 122.75 1aor h TYR 439 Ca 0.09 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.89 1aor h TYR 439 Cb -0.02 0.03 -0.04 0.00 1.01 0.00 0.00 36.73 37.71 1aor h TYR 439 CO -0.07 -0.03 0.47 0.00 -1.05 0.00 0.00 178.16 177.49 1aor h ALA 440 N 1.09 1.51 0.00 3.88 0.00 -1.07 -3.28 119.26 121.40 1aor h ALA 440 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aor h ALA 440 Cb 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1aor h ALA 440 CO -0.09 0.44 -1.43 0.25 0.00 0.00 0.00 179.25 178.42 1aor n THR 441 N -4.43 0.00 -1.64 0.00 -2.24 -0.26 -4.08 114.28 101.63 1aor n THR 441 Ca 0.08 -0.26 -0.51 0.00 -2.27 0.00 0.00 64.05 61.09 1aor n THR 441 Cb 0.05 0.51 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1aor n THR 441 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aor n ASN 442 N -1.84 2.30 0.27 3.42 2.85 0.32 -4.85 115.26 117.72 1aor n ASN 442 Ca -0.00 1.09 0.18 0.00 -0.11 0.00 0.00 54.58 55.74 1aor n ASN 442 Cb 0.42 -1.26 0.93 0.00 1.24 0.00 0.00 39.78 41.10 1aor n ASN 442 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 1aor h ASN 443 N 5.69 0.00 -0.08 1.20 2.35 -1.93 -2.25 115.58 120.57 1aor h ASN 443 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1aor h ASN 443 Cb 1.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.68 1aor h ASN 443 CO 0.85 0.00 0.00 -2.11 -1.65 0.00 0.00 177.43 174.52 1aor n ARG 444 N -3.48 2.26 0.00 0.81 1.85 -1.26 -4.44 116.66 112.40 1aor n ARG 444 Ca -0.00 -1.94 0.00 0.00 -1.00 0.00 0.00 57.85 54.91 1aor n ARG 444 Cb 0.26 -1.45 0.00 0.00 -1.05 0.00 0.00 32.46 30.21 1aor n ARG 444 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1aor n GLY 445 N 1.33 -0.32 3.57 2.89 0.00 -0.85 -4.85 105.19 106.96 1aor n GLY 445 Ca 0.14 -2.23 -0.18 0.00 0.00 0.00 0.00 46.02 43.76 1aor n GLY 445 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aor s GLY 446 N 0.00 -0.66 0.09 -0.02 0.00 -0.19 -4.50 107.32 102.03 1aor s GLY 446 Ca 0.00 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 43.44 1aor s GLY 446 CO 0.00 4.06 -0.12 0.00 0.00 0.00 0.00 173.10 177.04 1aor n HIS 448 N 0.90 0.00 0.52 0.00 1.44 -1.26 -4.36 115.22 112.46 1aor n HIS 448 Ca -0.18 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.64 1aor n HIS 448 Cb 0.56 -0.94 0.46 0.00 0.12 0.00 0.00 29.99 30.19 1aor n HIS 448 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1aor n ILE 449 N -3.30 0.71 1.45 0.61 -6.64 -1.26 -1.95 119.36 108.99 1aor n ILE 449 Ca -0.44 0.05 0.15 0.00 -1.77 0.00 0.00 62.75 60.74 1aor n ILE 449 Cb 0.95 -0.92 0.71 0.00 -1.44 0.00 0.00 39.64 38.94 1aor n ILE 449 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 1aor n LYS 450 N -2.12 0.57 -2.74 6.28 4.76 -1.26 -4.21 118.16 119.45 1aor n LYS 450 Ca 0.04 -0.10 -0.07 0.00 -2.87 0.00 0.00 58.31 55.31 1aor n LYS 450 Cb 0.29 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.04 1aor n LYS 450 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1aor n ASN 451 N -1.13 -2.66 -4.02 4.39 0.23 -1.13 -4.38 115.26 106.56 1aor n ASN 451 Ca 0.15 -2.98 -0.39 0.00 -0.53 0.00 0.00 54.58 50.83 1aor n ASN 451 Cb 0.25 1.62 -0.04 0.00 -2.08 0.00 0.00 39.78 39.53 1aor n ASN 451 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1aor n TYR 452 N 1.75 2.67 0.51 -2.53 9.36 -0.82 -4.77 117.16 123.34 1aor n TYR 452 Ca 0.09 -1.99 0.06 0.00 3.32 0.00 0.00 57.90 59.37 1aor n TYR 452 Cb 0.64 -2.19 0.29 0.00 -0.63 0.00 0.00 39.34 37.44 1aor n TYR 452 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1aor n MET 453 N 7.40 0.11 0.20 2.98 2.81 -1.26 -2.38 117.12 126.98 1aor n MET 453 Ca 0.49 0.22 0.05 0.00 -1.81 0.00 0.00 57.70 56.64 1aor n MET 453 Cb 0.43 -1.50 0.42 0.00 -0.71 0.00 0.00 33.22 31.86 1aor n MET 453 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1aor h ILE 454 N 0.00 1.08 0.74 2.02 1.08 -1.93 -1.42 117.51 119.07 1aor h ILE 454 Ca 0.00 -1.18 -0.04 0.00 -0.39 0.00 0.00 64.86 63.26 1aor h ILE 454 Cb 0.15 1.66 0.01 0.00 -3.07 0.00 0.00 36.82 35.57 1aor h ILE 454 CO 0.00 0.32 -0.37 0.28 -0.69 0.00 0.00 178.15 177.69 1aor h SER 455 N 0.00 -0.88 -0.11 1.72 0.02 -1.71 0.53 113.55 113.12 1aor h SER 455 Ca -0.00 0.03 -0.20 0.00 -0.84 0.00 0.00 61.79 60.78 1aor h SER 455 Cb 0.64 0.23 0.01 0.00 0.14 0.00 0.00 62.40 63.42 1aor h SER 455 CO 0.04 -0.61 -0.73 1.55 -1.14 0.00 0.00 176.83 175.94 1aor h PRO 456 N -1.01 0.69 -0.04 3.45 0.13 -0.90 0.59 132.00 134.92 1aor h PRO 456 Ca -0.10 -0.59 -0.09 0.00 -0.87 0.00 0.00 66.00 64.34 1aor h PRO 456 Cb 0.78 0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1aor h PRO 456 CO 0.16 1.20 -0.41 0.93 -0.23 0.00 0.00 178.00 179.65 1aor h GLU 457 N 0.38 0.08 0.00 0.86 5.08 -1.29 -1.37 114.58 118.32 1aor h GLU 457 Ca -0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1aor h GLU 457 Cb 1.37 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1aor h GLU 457 CO 0.15 0.48 -0.90 -0.89 -1.00 0.00 0.00 179.01 176.85 1aor n ILE 458 N -4.04 0.00 0.08 3.13 -0.00 0.09 -4.16 119.36 114.47 1aor n ILE 458 Ca -0.02 0.00 0.05 0.00 -0.00 0.00 0.00 62.75 62.78 1aor n ILE 458 Cb 0.46 -0.56 -0.02 0.00 -0.00 0.00 0.00 39.64 39.51 1aor n ILE 458 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1aor h LEU 459 N 0.00 0.00 0.00 1.39 3.38 -0.68 -3.49 115.31 115.91 1aor h LEU 459 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1aor h LEU 459 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1aor h LEU 459 CO 0.00 0.34 0.00 0.61 0.09 0.00 0.00 178.44 179.48 1aor n GLY 460 N 1.28 1.06 3.07 0.83 0.00 0.19 -4.91 105.19 106.71 1aor n GLY 460 Ca -0.04 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1aor n GLY 460 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aor s TYR 461 N -2.00 2.19 0.46 1.61 1.51 -0.41 -2.54 117.35 118.18 1aor s TYR 461 Ca 0.00 -1.13 0.13 0.00 -1.01 0.00 0.00 57.07 55.06 1aor s TYR 461 Cb 0.00 -1.57 1.05 0.00 -0.11 0.00 0.00 41.96 41.33 1aor s TYR 461 CO 0.00 -0.58 2.05 -1.35 -1.11 0.00 0.00 175.55 174.57 1aor h PRO 462 N 7.62 0.13 -2.29 -1.71 0.11 -1.92 0.18 132.00 134.13 1aor h PRO 462 Ca -0.34 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.79 1aor h PRO 462 Cb 1.16 -0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.08 1aor h PRO 462 CO 0.52 0.17 0.37 1.52 -0.21 0.00 0.00 178.00 180.37 1aor s TYR 463 N -4.97 -0.46 0.05 0.65 -0.85 -1.05 -5.11 117.35 105.60 1aor s TYR 463 Ca -0.05 0.50 -0.30 0.00 -0.52 0.00 0.00 57.07 56.69 1aor s TYR 463 Cb 0.16 0.50 -0.08 0.00 0.38 0.00 0.00 41.96 42.93 1aor s TYR 463 CO 0.70 -0.60 1.69 0.21 -1.52 0.00 0.00 175.55 176.03 1aor s LYS 464 N -2.55 4.19 0.32 -3.49 2.47 -1.24 -4.60 119.74 114.83 1aor s LYS 464 Ca -0.00 2.35 0.09 0.00 -1.56 0.00 0.00 55.97 56.85 1aor s LYS 464 Cb -0.01 -3.70 -0.05 0.00 -1.46 0.00 0.00 37.83 32.61 1aor s LYS 464 CO -0.04 -0.78 0.00 -1.64 0.16 0.00 0.00 175.35 173.05 1aor s MET 465 N 3.00 2.09 -0.05 4.03 -1.94 -0.51 -5.02 119.30 120.90 1aor s MET 465 Ca 0.75 -1.69 -0.25 0.00 -1.71 0.00 0.00 55.69 52.79 1aor s MET 465 Cb -0.39 -1.96 -0.04 0.00 2.01 0.00 0.00 34.83 34.45 1aor s MET 465 CO 0.33 0.18 0.76 0.34 -0.01 0.00 0.00 175.02 176.62 1aor s ASP 466 N -3.70 7.08 0.41 3.03 2.15 -1.26 -4.48 116.67 119.90 1aor s ASP 466 Ca 0.34 1.30 0.29 0.00 0.43 0.00 0.00 52.55 54.91 1aor s ASP 466 Cb -0.01 -2.45 1.46 0.00 -0.30 0.00 0.00 42.92 41.61 1aor s ASP 466 CO 0.19 -0.14 1.87 1.55 -0.17 0.00 0.00 175.17 178.47 1aor h PRO 467 N 6.73 0.00 -0.32 4.34 0.13 -1.88 -1.52 132.00 139.48 1aor h PRO 467 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1aor h PRO 467 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1aor h PRO 467 CO 0.75 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.24 1aor n HIS 468 N -2.53 0.75 -2.92 1.56 8.25 -1.26 -1.68 115.22 117.38 1aor n HIS 468 Ca -0.01 -0.68 -0.42 0.00 -0.26 0.00 0.00 57.72 56.34 1aor n HIS 468 Cb 0.11 -0.18 -0.05 0.00 1.12 0.00 0.00 29.99 30.99 1aor n HIS 468 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1aor s ASP 469 N -1.43 6.59 -0.25 0.41 2.15 -0.57 -4.91 116.67 118.65 1aor s ASP 469 Ca 0.33 0.41 0.12 0.00 0.43 0.00 0.00 52.55 53.85 1aor s ASP 469 Cb 0.24 -2.41 0.51 0.00 -0.30 0.00 0.00 42.92 40.95 1aor s ASP 469 CO 0.13 -0.76 1.45 1.33 -0.17 0.00 0.00 175.17 177.14 1aor n VAL 470 N 5.83 2.45 -1.66 1.11 0.24 -1.26 -4.70 118.33 120.34 1aor n VAL 470 Ca 0.04 -2.38 -0.28 0.00 -2.04 0.00 0.00 64.34 59.68 1aor n VAL 470 Cb 0.48 -0.30 0.21 0.00 -1.47 0.00 0.00 33.84 32.76 1aor n VAL 470 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1aor n SER 471 N -0.91 -0.46 0.25 -1.34 3.41 -1.26 -4.84 113.62 108.47 1aor n SER 471 Ca 0.29 -1.38 0.08 0.00 -0.26 0.00 0.00 58.87 57.60 1aor n SER 471 Cb 0.98 -0.97 0.61 0.00 -0.26 0.00 0.00 64.21 64.58 1aor n SER 471 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1aor h ASP 472 N -1.93 0.00 -0.38 4.04 3.32 -1.99 -1.37 116.42 118.11 1aor h ASP 472 Ca -0.41 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.55 1aor h ASP 472 Cb 1.15 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 1aor h ASP 472 CO 0.28 0.09 -0.11 0.44 -1.72 0.00 0.00 179.24 178.23 1aor h ASP 473 N 0.00 0.82 -0.33 6.45 5.19 -1.97 0.16 116.42 126.74 1aor h ASP 473 Ca -0.00 -0.25 -0.04 0.00 -0.62 0.00 0.00 57.03 56.12 1aor h ASP 473 Cb 0.17 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 1aor h ASP 473 CO 0.01 0.95 0.06 0.50 -3.12 0.00 0.00 179.24 177.64 1aor h LYS 474 N 0.75 0.54 -0.22 3.56 1.63 -1.56 -2.11 116.57 119.17 1aor h LYS 474 Ca 0.13 -0.14 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 1aor h LYS 474 Cb 0.60 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 1aor h LYS 474 CO 0.04 0.62 0.03 0.82 -3.45 0.00 0.00 179.45 177.51 1aor h ILE 475 N 0.38 1.12 -0.10 2.00 2.04 -1.06 -1.89 117.51 120.00 1aor h ILE 475 Ca 0.10 -0.44 -0.13 0.00 1.00 0.00 0.00 64.86 65.39 1aor h ILE 475 Cb 0.34 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1aor h ILE 475 CO 0.01 0.15 -0.51 0.11 0.00 0.00 0.00 178.15 177.91 1aor h LYS 476 N 0.31 0.27 -0.62 2.37 1.57 -0.53 -2.76 116.57 117.17 1aor h LYS 476 Ca 0.07 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 1aor h LYS 476 Cb 0.16 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1aor h LYS 476 CO -0.00 0.72 0.17 0.52 -0.57 0.00 0.00 179.45 180.28 1aor h MET 477 N 0.21 0.99 0.19 3.15 2.86 -0.69 -1.50 114.93 120.14 1aor h MET 477 Ca 0.01 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 1aor h MET 477 Cb 0.97 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1aor h MET 477 CO 0.08 0.89 -0.09 1.25 1.06 0.00 0.00 176.91 180.10 1aor h LEU 478 N 0.91 -0.22 -0.61 1.22 5.85 -1.31 -0.00 115.31 121.15 1aor h LEU 478 Ca 0.20 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1aor h LEU 478 Cb 0.33 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 1aor h LEU 478 CO -0.00 -0.12 0.36 0.40 -0.34 0.00 0.00 178.44 178.74 1aor h ILE 479 N -0.31 1.04 -0.26 4.05 2.04 -1.44 0.24 117.51 122.88 1aor h ILE 479 Ca -0.03 -0.24 0.03 0.00 1.00 0.00 0.00 64.86 65.62 1aor h ILE 479 Cb 0.24 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1aor h ILE 479 CO 0.04 0.13 0.07 0.25 0.00 0.00 0.00 178.15 178.64 1aor h LEU 480 N 0.70 0.05 -1.05 1.44 5.85 -1.08 -0.40 115.31 120.82 1aor h LEU 480 Ca 0.25 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 1aor h LEU 480 Cb 0.06 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1aor h LEU 480 CO -0.12 0.06 0.21 -0.26 -0.34 0.00 0.00 178.44 177.99 1aor h PHE 481 N 0.17 0.91 -0.29 1.25 -1.00 -0.16 0.60 116.94 118.41 1aor h PHE 481 Ca 0.12 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.79 1aor h PHE 481 Cb 0.10 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.38 1aor h PHE 481 CO -0.15 0.72 0.03 1.96 -1.61 0.00 0.00 178.31 179.26 1aor h GLN 482 N 0.88 0.49 -0.16 1.51 4.20 0.19 -1.53 115.11 120.70 1aor h GLN 482 Ca 0.20 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 1aor h GLN 482 Cb 0.21 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 1aor h GLN 482 CO -0.01 0.61 -0.21 -0.44 -0.67 0.00 0.00 178.83 178.11 1aor h ASP 483 N 0.30 0.45 -0.81 1.46 3.32 -0.89 -2.70 116.42 117.55 1aor h ASP 483 Ca 0.09 -0.51 -0.04 0.00 0.02 0.00 0.00 57.03 56.59 1aor h ASP 483 Cb 0.37 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.75 1aor h ASP 483 CO 0.01 0.88 0.36 0.25 -1.72 0.00 0.00 179.24 179.02 1aor h LEU 484 N 0.04 1.09 -1.17 1.55 5.85 -0.92 -1.89 115.31 119.87 1aor h LEU 484 Ca 0.02 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 1aor h LEU 484 Cb 0.77 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1aor h LEU 484 CO 0.05 0.94 -0.41 0.74 -0.34 0.00 0.00 178.44 179.42 1aor h THR 485 N 1.17 1.29 -0.32 1.05 2.02 -1.30 -0.47 112.91 116.36 1aor h THR 485 Ca 0.28 -1.40 -0.12 0.00 0.77 0.00 0.00 66.41 65.93 1aor h THR 485 Cb 0.16 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 1aor h THR 485 CO -0.03 0.40 -0.29 0.00 0.37 0.00 0.00 175.52 175.97 1aor h ALA 486 N 1.58 0.89 0.62 6.16 0.00 -1.06 -0.52 119.26 126.92 1aor h ALA 486 Ca -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1aor h ALA 486 Cb 0.73 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1aor h ALA 486 CO 0.05 0.63 -0.30 1.25 0.00 0.00 0.00 179.25 180.88 1aor h LEU 487 N 0.57 -0.71 -0.92 0.00 5.85 -0.78 -1.64 115.31 117.69 1aor h LEU 487 Ca 0.07 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.89 1aor h LEU 487 Cb 0.79 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.92 1aor h LEU 487 CO 0.06 -0.35 0.55 0.40 -0.34 0.00 0.00 178.44 178.76 1aor h ILE 488 N -1.11 0.86 -0.33 4.05 2.04 -1.08 0.18 117.51 122.12 1aor h ILE 488 Ca -0.09 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1aor h ILE 488 Cb 0.68 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1aor h ILE 488 CO 0.14 0.15 0.16 0.44 0.00 0.00 0.00 178.15 179.04 1aor h ASP 489 N 0.85 0.43 -0.23 1.72 3.32 -1.08 -2.75 116.42 118.69 1aor h ASP 489 Ca 0.47 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 57.32 1aor h ASP 489 Cb 0.51 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1aor h ASP 489 CO -0.29 0.44 -0.08 0.28 -1.72 0.00 0.00 179.24 177.88 1aor h SER 490 N 0.40 0.57 0.15 6.45 0.02 -0.25 -3.05 113.55 117.83 1aor h SER 490 Ca 0.11 -0.14 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 1aor h SER 490 Cb 0.13 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1aor h SER 490 CO -0.01 0.69 -0.26 0.00 -1.14 0.00 0.00 176.83 176.10 1aor h ALA 491 N 1.37 1.36 0.00 3.77 0.00 -0.48 -3.31 119.26 121.97 1aor h ALA 491 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1aor h ALA 491 Cb 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1aor h ALA 491 CO 0.02 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.13 1aor n GLY 492 N -0.58 1.03 4.01 0.00 0.00 -1.06 -0.92 105.19 107.68 1aor n GLY 492 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1aor n GLY 492 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aor s LEU 493 N 0.00 3.57 -0.05 0.99 1.02 -1.13 -2.06 118.68 121.03 1aor s LEU 493 Ca 0.00 -0.44 -0.07 0.00 0.02 0.00 0.00 54.13 53.65 1aor s LEU 493 Cb 0.00 -2.56 -0.04 0.00 0.02 0.00 0.00 46.19 43.60 1aor s LEU 493 CO 0.00 -0.85 0.22 0.00 0.02 0.00 0.00 176.35 175.73 1aor h LEU 495 N 4.42 0.00 -0.20 0.00 5.85 -1.97 -2.89 115.31 120.52 1aor h LEU 495 Ca -0.52 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1aor h LEU 495 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1aor h LEU 495 CO 0.63 0.02 0.00 0.49 -0.34 0.00 0.00 178.44 179.24 1aor n PHE 496 N -3.16 0.22 0.38 1.25 3.72 -1.26 -1.73 117.46 116.87 1aor n PHE 496 Ca -0.01 0.09 0.12 0.00 -0.05 0.00 0.00 57.45 57.60 1aor n PHE 496 Cb 0.20 -0.64 0.51 0.00 -0.94 0.00 0.00 39.48 38.61 1aor n PHE 496 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1aor n THR 497 N -1.70 0.82 0.33 4.37 -2.24 -1.09 -2.00 114.28 112.76 1aor n THR 497 Ca 0.03 0.25 0.05 0.00 -2.27 0.00 0.00 64.05 62.11 1aor n THR 497 Cb 0.18 -1.19 0.23 0.00 -2.10 0.00 0.00 70.33 67.44 1aor n THR 497 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aor n THR 498 N -2.29 1.31 -2.42 4.28 -2.24 -0.71 -1.08 114.28 111.14 1aor n THR 498 Ca 0.02 0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.72 1aor n THR 498 Cb 0.23 -1.19 0.01 0.00 -2.10 0.00 0.00 70.33 67.27 1aor n THR 498 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1aor n PHE 499 N -1.55 2.75 0.00 4.78 3.72 -0.85 -4.06 117.46 122.25 1aor n PHE 499 Ca 0.02 -2.74 0.00 0.00 -0.05 0.00 0.00 57.45 54.68 1aor n PHE 499 Cb 0.12 -1.80 0.00 0.00 -0.94 0.00 0.00 39.48 36.86 1aor n PHE 499 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aor n GLY 500 N 2.36 3.57 3.80 1.37 0.00 -1.22 -4.20 105.19 110.87 1aor n GLY 500 Ca 0.40 -0.51 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1aor n GLY 500 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aor s LEU 501 N 0.00 3.78 0.39 0.99 1.43 -0.24 -4.82 118.68 120.21 1aor s LEU 501 Ca 0.00 -0.19 0.06 0.00 -1.03 0.00 0.00 54.13 52.97 1aor s LEU 501 Cb 0.00 -2.37 -0.02 0.00 0.03 0.00 0.00 46.19 43.83 1aor s LEU 501 CO 0.00 0.03 0.20 -0.83 0.23 0.00 0.00 176.35 175.99 1aor s GLY 502 N -3.34 2.59 0.31 -3.19 0.00 -1.26 -4.42 107.32 98.02 1aor s GLY 502 Ca 0.31 -1.51 0.08 0.00 0.00 0.00 0.00 44.72 43.60 1aor s GLY 502 CO 0.24 -1.69 1.67 0.00 0.00 0.00 0.00 173.10 173.31 1aor h ALA 503 N 1.88 1.63 -0.62 3.20 0.00 -2.00 -0.17 119.26 123.18 1aor h ALA 503 Ca -0.30 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1aor h ALA 503 Cb 1.26 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1aor h ALA 503 CO 0.46 -0.47 0.16 -0.44 0.00 0.00 0.00 179.25 178.96 1aor h ASP 504 N 0.32 0.89 0.39 0.00 3.32 -1.96 -2.51 116.42 116.87 1aor h ASP 504 Ca 0.64 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.45 1aor h ASP 504 Cb 1.35 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 1aor h ASP 504 CO -0.60 0.86 -0.35 0.44 -1.72 0.00 0.00 179.24 177.87 1aor h ASP 505 N 0.92 0.00 0.37 6.45 3.32 -1.43 -1.21 116.42 124.85 1aor h ASP 505 Ca 0.20 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.04 1aor h ASP 505 Cb 0.31 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1aor h ASP 505 CO -0.00 0.35 -0.90 1.88 -1.72 0.00 0.00 179.24 178.85 1aor h TYR 506 N 0.00 0.54 -0.48 4.55 0.05 -1.34 -1.73 116.97 118.55 1aor h TYR 506 Ca -0.00 -0.28 -0.04 0.00 0.05 0.00 0.00 58.73 58.45 1aor h TYR 506 Cb 0.64 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.29 1aor h TYR 506 CO 0.00 1.09 0.14 -0.09 -1.05 0.00 0.00 178.16 178.26 1aor h ARG 507 N 0.21 0.75 0.09 4.88 2.43 -1.00 0.16 114.38 121.90 1aor h ARG 507 Ca -0.06 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1aor h ARG 507 Cb 1.52 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.96 1aor h ARG 507 CO 0.15 0.72 -0.04 -0.44 -1.51 0.00 0.00 179.97 178.85 1aor h ASP 508 N 0.65 -0.10 -0.68 -3.80 3.32 -1.17 0.13 116.42 114.77 1aor h ASP 508 Ca 0.15 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1aor h ASP 508 Cb 0.28 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1aor h ASP 508 CO -0.00 0.00 0.44 -0.07 -1.72 0.00 0.00 179.24 177.89 1aor h LEU 509 N -0.19 0.80 -0.42 1.55 3.38 -1.12 -2.18 115.31 117.13 1aor h LEU 509 Ca -0.01 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 1aor h LEU 509 Cb 0.16 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1aor h LEU 509 CO 0.02 0.60 -0.53 -0.07 0.09 0.00 0.00 178.44 178.54 1aor h LEU 510 N 0.93 0.80 -0.33 1.67 3.38 -0.53 -2.87 115.31 118.37 1aor h LEU 510 Ca 0.25 -0.42 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 1aor h LEU 510 Cb -0.08 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1aor h LEU 510 CO -0.05 1.18 -0.18 0.78 0.09 0.00 0.00 178.44 180.26 1aor h ASN 511 N 0.56 0.72 -0.31 -0.43 -0.26 -0.64 -1.67 115.58 113.55 1aor h ASN 511 Ca 0.02 -0.42 -0.07 0.00 -0.56 0.00 0.00 56.30 55.27 1aor h ASN 511 Cb 1.11 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 38.15 1aor h ASN 511 CO 0.11 0.98 -0.02 0.00 -1.06 0.00 0.00 177.43 177.44 1aor h ALA 512 N 0.76 1.18 0.20 -0.83 0.00 -1.44 -1.34 119.26 117.80 1aor h ALA 512 Ca 0.07 -0.25 -0.30 0.00 0.00 0.00 0.00 54.91 54.43 1aor h ALA 512 Cb 0.72 -0.17 0.03 0.00 0.00 0.00 0.00 17.79 18.36 1aor h ALA 512 CO 0.05 0.53 -1.37 0.00 0.00 0.00 0.00 179.25 178.47 1aor h ALA 513 N 1.34 -0.06 0.00 0.00 0.00 -1.52 -3.05 119.26 115.96 1aor h ALA 513 Ca 0.13 -0.89 -0.16 0.00 0.00 0.00 0.00 54.91 53.99 1aor h ALA 513 Cb 0.44 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1aor h ALA 513 CO 0.02 0.69 -1.09 -0.07 0.00 0.00 0.00 179.25 178.80 1aor h LEU 514 N -0.03 0.00 -0.01 0.00 3.38 -1.34 0.26 115.31 117.57 1aor h LEU 514 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1aor h LEU 514 Cb 2.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.75 1aor h LEU 514 CO 0.21 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.96 1aor n GLY 515 N 1.34 0.99 3.90 0.83 0.00 -0.51 -4.39 105.19 107.35 1aor n GLY 515 Ca -0.05 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 1aor n GLY 515 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1aor s TRP 516 N -2.01 2.74 -0.14 1.61 0.51 -1.18 -5.04 118.94 115.42 1aor s TRP 516 Ca 0.00 -0.47 0.15 0.00 -2.12 0.00 0.00 56.10 53.66 1aor s TRP 516 Cb 0.00 -2.20 0.37 0.00 -0.81 0.00 0.00 33.47 30.83 1aor s TRP 516 CO 0.00 -0.17 1.18 -3.47 -0.51 0.00 0.00 176.95 173.98 1aor n ASP 517 N -1.60 1.61 -4.71 2.95 -0.08 -1.26 -4.68 116.55 108.78 1aor n ASP 517 Ca 0.04 -3.29 -0.34 0.00 -1.51 0.00 0.00 54.79 49.69 1aor n ASP 517 Cb 0.61 -0.45 0.11 0.00 2.34 0.00 0.00 41.12 43.73 1aor n ASP 517 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1aor s PHE 518 N -2.39 1.91 0.47 -0.67 0.40 -1.26 -5.04 117.98 111.40 1aor s PHE 518 Ca 0.34 1.62 0.05 0.00 -0.60 0.00 0.00 56.93 58.33 1aor s PHE 518 Cb 0.33 -3.53 0.02 0.00 0.51 0.00 0.00 43.02 40.35 1aor s PHE 518 CO -0.06 -2.82 0.65 0.95 0.70 0.00 0.00 175.22 174.63 1aor s THR 519 N -1.95 2.99 0.28 0.64 -4.23 -1.26 -4.96 115.64 107.16 1aor s THR 519 Ca 0.75 -0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 60.40 1aor s THR 519 Cb -0.31 -3.05 0.27 0.00 1.34 0.00 0.00 72.50 70.75 1aor s THR 519 CO 0.47 -0.03 1.94 0.74 -0.54 0.00 0.00 174.62 177.20 1aor h THR 520 N 0.42 1.18 -0.30 3.99 2.02 -1.95 -1.46 112.91 116.81 1aor h THR 520 Ca -0.42 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 1aor h THR 520 Cb 1.28 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 1aor h THR 520 CO 0.49 0.21 -0.03 -0.33 0.37 0.00 0.00 175.52 176.24 1aor h GLU 521 N 1.17 0.46 -0.34 6.66 3.07 -1.97 0.39 114.58 124.02 1aor h GLU 521 Ca 0.35 -0.10 -0.05 0.00 -0.50 0.00 0.00 59.36 59.06 1aor h GLU 521 Cb -0.03 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1aor h GLU 521 CO -0.10 0.51 0.01 -0.44 -1.40 0.00 0.00 179.01 177.59 1aor h ASP 522 N 0.44 0.59 -0.19 1.42 3.32 -1.65 -1.98 116.42 118.37 1aor h ASP 522 Ca 0.09 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 1aor h ASP 522 Cb 0.34 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1aor h ASP 522 CO 0.01 0.75 -0.00 1.88 -1.72 0.00 0.00 179.24 180.16 1aor h TYR 523 N 0.41 0.37 0.00 4.55 0.05 -1.06 -2.92 116.97 118.38 1aor h TYR 523 Ca 0.10 -0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 1aor h TYR 523 Cb 0.44 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.09 1aor h TYR 523 CO 0.04 0.54 -0.01 -0.07 -1.05 0.00 0.00 178.16 177.60 1aor h LEU 524 N 0.10 0.00 -0.59 3.88 3.38 -0.87 -0.47 115.31 120.75 1aor h LEU 524 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1aor h LEU 524 Cb 0.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1aor h LEU 524 CO 0.01 0.01 -0.56 0.50 0.09 0.00 0.00 178.44 178.50 1aor h LYS 525 N 0.00 0.00 -0.55 1.13 3.64 -1.18 -1.73 116.57 117.88 1aor h LYS 525 Ca -0.00 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1aor h LYS 525 Cb 0.03 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1aor h LYS 525 CO 0.00 0.56 -0.08 0.82 -2.27 0.00 0.00 179.45 178.48 1aor h ILE 526 N 0.00 1.27 -0.62 2.00 2.04 -0.93 0.22 117.51 121.49 1aor h ILE 526 Ca -0.01 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 1aor h ILE 526 Cb 1.17 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 1aor h ILE 526 CO 0.07 0.44 0.35 1.23 0.00 0.00 0.00 178.15 180.24 1aor h GLY 527 N 0.90 0.93 1.01 5.37 0.00 -1.18 -1.00 103.07 109.10 1aor h GLY 527 Ca 0.14 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 47.02 1aor h GLY 527 CO 0.04 0.40 0.21 -2.09 0.00 0.00 0.00 176.54 175.10 1aor h GLU 528 N 0.85 0.96 -0.28 4.80 4.81 -0.99 -1.37 114.58 123.36 1aor h GLU 528 Ca 0.22 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1aor h GLU 528 Cb 0.03 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 1aor h GLU 528 CO -0.04 0.84 0.11 -0.09 -0.73 0.00 0.00 179.01 179.11 1aor h ARG 529 N 0.89 0.24 -0.65 1.92 2.43 -0.49 -0.99 114.38 117.74 1aor h ARG 529 Ca 0.20 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1aor h ARG 529 Cb 0.27 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1aor h ARG 529 CO -0.01 0.16 0.40 0.82 -1.51 0.00 0.00 179.97 179.83 1aor h ILE 530 N 0.25 1.19 -0.41 1.20 2.04 -0.97 -0.84 117.51 119.97 1aor h ILE 530 Ca 0.12 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1aor h ILE 530 Cb 0.07 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1aor h ILE 530 CO -0.11 0.19 0.23 -0.25 0.00 0.00 0.00 178.15 178.22 1aor h TRP 531 N 0.88 0.56 -0.43 1.37 2.91 -0.75 -1.32 115.95 119.17 1aor h TRP 531 Ca 0.23 -0.01 -0.10 0.00 1.13 0.00 0.00 58.89 60.14 1aor h TRP 531 Cb -0.03 -0.18 -0.02 0.00 -0.51 0.00 0.00 29.16 28.42 1aor h TRP 531 CO -0.02 0.43 -0.13 -0.91 -1.03 0.00 0.00 178.44 176.78 1aor h ASN 532 N 0.54 0.78 -0.22 2.65 2.35 -0.96 -1.50 115.58 119.22 1aor h ASN 532 Ca 0.15 -0.24 0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1aor h ASN 532 Cb 0.04 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 1aor h ASN 532 CO -0.02 0.92 0.10 0.00 -1.65 0.00 0.00 177.43 176.78 1aor h ALA 533 N 1.15 0.26 -0.47 -0.83 0.00 -0.83 0.25 119.26 118.79 1aor h ALA 533 Ca 0.12 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1aor h ALA 533 Cb 0.62 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1aor h ALA 533 CO 0.04 -0.31 0.25 0.93 0.00 0.00 0.00 179.25 180.16 1aor h GLU 534 N 0.22 0.66 -0.31 0.00 5.08 -1.07 0.21 114.58 119.37 1aor h GLU 534 Ca 0.09 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1aor h GLU 534 Cb 0.04 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1aor h GLU 534 CO -0.07 0.53 0.15 -0.09 -1.00 0.00 0.00 179.01 178.53 1aor h ARG 535 N 0.62 0.31 -0.66 2.33 1.12 -0.83 -1.47 114.38 115.79 1aor h ARG 535 Ca 0.16 -0.02 0.04 0.00 -1.11 0.00 0.00 59.98 59.06 1aor h ARG 535 Cb 0.07 -0.07 -0.05 0.00 -0.01 0.00 0.00 29.97 29.91 1aor h ARG 535 CO -0.03 0.21 0.40 1.25 -3.11 0.00 0.00 179.97 178.69 1aor h LEU 536 N 0.32 0.63 -0.56 3.80 5.85 -0.12 -0.86 115.31 124.37 1aor h LEU 536 Ca 0.13 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1aor h LEU 536 Cb 0.04 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 1aor h LEU 536 CO -0.09 0.43 0.33 0.15 -0.34 0.00 0.00 178.44 178.92 1aor h PHE 537 N 0.76 0.62 -0.64 1.25 3.04 -0.32 -1.53 116.94 120.12 1aor h PHE 537 Ca 0.28 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.22 1aor h PHE 537 Cb 0.08 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.36 1aor h PHE 537 CO -0.06 0.35 0.30 -0.91 -2.02 0.00 0.00 178.31 175.97 1aor h ASN 538 N 0.65 0.84 -0.61 0.41 -0.26 -0.49 0.39 115.58 116.52 1aor h ASN 538 Ca 0.23 -0.13 0.02 0.00 -0.56 0.00 0.00 56.30 55.85 1aor h ASN 538 Cb 0.04 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.05 1aor h ASN 538 CO -0.11 0.74 0.39 -0.07 -1.06 0.00 0.00 177.43 177.33 1aor h LEU 539 N 0.89 0.66 -1.14 1.61 3.38 -0.80 0.31 115.31 120.22 1aor h LEU 539 Ca 0.22 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 1aor h LEU 539 Cb 0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1aor h LEU 539 CO -0.03 0.47 -0.30 0.11 0.09 0.00 0.00 178.44 178.78 1aor h LYS 540 N 0.79 0.21 0.00 1.13 1.57 -0.99 -1.57 116.57 117.71 1aor h LYS 540 Ca 0.24 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1aor h LYS 540 Cb -0.04 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1aor h LYS 540 CO -0.07 0.50 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 1aor n ALA 541 N -2.48 2.14 0.00 3.86 0.00 0.10 -4.60 120.51 119.53 1aor n ALA 541 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1aor n ALA 541 Cb 0.39 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1aor n ALA 541 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aor n GLY 542 N 1.05 1.53 3.72 0.00 0.00 -0.06 -4.88 105.19 106.54 1aor n GLY 542 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1aor n GLY 542 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1aor n LEU 543 N 0.00 3.91 -4.02 0.99 7.94 0.91 -4.96 117.00 121.77 1aor n LEU 543 Ca 0.00 1.13 -0.31 0.00 -1.11 0.00 0.00 56.01 55.72 1aor n LEU 543 Cb 0.00 -1.54 -0.15 0.00 0.53 0.00 0.00 43.42 42.26 1aor n LEU 543 CO 0.00 -0.03 -0.31 -0.62 -1.11 0.00 0.00 177.39 175.32 1aor s ASP 544 N 0.58 4.74 0.15 1.96 -1.08 -1.26 -4.70 116.67 117.06 1aor s ASP 544 Ca 0.68 -2.25 -0.32 0.00 -0.52 0.00 0.00 52.55 50.15 1aor s ASP 544 Cb -0.55 -1.64 -0.08 0.00 -1.46 0.00 0.00 42.92 39.19 1aor s ASP 544 CO 0.45 -0.37 1.55 -0.65 0.52 0.00 0.00 175.17 176.67 1aor h PRO 545 N 7.51 -0.18 -1.00 4.34 0.11 -1.90 0.41 132.00 141.28 1aor h PRO 545 Ca -0.05 0.01 0.23 0.00 0.11 0.00 0.00 66.00 66.31 1aor h PRO 545 Cb 1.01 0.04 -0.12 0.00 0.11 0.00 0.00 31.00 32.04 1aor h PRO 545 CO 0.54 -0.12 0.60 0.00 -0.21 0.00 0.00 178.00 178.81 1aor h ALA 546 N 0.27 1.76 0.12 -0.75 0.00 -1.90 0.78 119.26 119.54 1aor h ALA 546 Ca 0.12 0.12 -0.35 0.00 0.00 0.00 0.00 54.91 54.80 1aor h ALA 546 Cb 0.50 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1aor h ALA 546 CO -0.78 -0.22 -1.86 -0.09 0.00 0.00 0.00 179.25 176.30 1aor h ARG 547 N 0.62 0.25 0.00 0.00 2.43 -1.78 -3.41 114.38 112.49 1aor h ARG 547 Ca 0.63 -0.43 -0.16 0.00 -0.81 0.00 0.00 59.98 59.21 1aor h ARG 547 Cb 1.15 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.84 1aor h ARG 547 CO -0.46 1.12 -1.50 -0.25 -1.51 0.00 0.00 179.97 177.37 1aor n ASP 548 N -3.44 0.73 -4.31 -3.80 8.00 0.14 -4.58 116.55 109.29 1aor n ASP 548 Ca -0.27 0.32 -0.44 0.00 0.71 0.00 0.00 54.79 55.11 1aor n ASP 548 Cb 1.05 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 42.52 1aor n ASP 548 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1aor n ASP 549 N -2.82 5.40 -0.92 -2.24 8.00 0.23 -4.52 116.55 119.69 1aor n ASP 549 Ca -0.10 -3.05 0.00 0.00 0.71 0.00 0.00 54.79 52.35 1aor n ASP 549 Cb 0.83 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 1aor n ASP 549 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1aor n THR 550 N 3.58 0.00 -4.15 -3.53 -2.24 -1.26 -4.88 114.28 101.80 1aor n THR 550 Ca 0.32 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.98 1aor n THR 550 Cb 0.40 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.52 1aor n THR 550 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1aor s LEU 551 N 0.00 2.42 0.68 3.22 1.02 -1.26 -4.28 118.68 120.47 1aor s LEU 551 Ca 0.00 -0.84 -0.17 0.00 0.02 0.00 0.00 54.13 53.14 1aor s LEU 551 Cb 0.00 -0.17 0.01 0.00 0.02 0.00 0.00 46.19 46.05 1aor s LEU 551 CO 0.00 -0.34 1.27 -2.84 0.02 0.00 0.00 176.35 174.46 1aor s PRO 552 N -2.99 2.37 0.35 1.29 0.02 -1.26 -4.87 135.00 129.91 1aor s PRO 552 Ca 0.05 2.00 0.10 0.00 0.02 0.00 0.00 61.00 63.16 1aor s PRO 552 Cb -0.01 -1.83 0.86 0.00 0.02 0.00 0.00 34.50 33.54 1aor s PRO 552 CO -0.02 -1.72 1.82 0.87 -0.33 0.00 0.00 177.00 177.62 1aor h LYS 553 N 0.25 0.63 -0.93 5.54 1.57 -1.96 -1.61 116.57 120.06 1aor h LYS 553 Ca -0.50 -0.04 0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1aor h LYS 553 Cb 1.33 -0.14 -0.15 0.00 0.08 0.00 0.00 32.23 33.35 1aor h LYS 553 CO 0.52 0.42 0.36 -0.09 -0.57 0.00 0.00 179.45 180.08 1aor h ARG 554 N 0.65 0.24 0.00 3.15 2.43 -1.89 0.54 114.38 119.50 1aor h ARG 554 Ca 0.52 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.54 1aor h ARG 554 Cb 0.96 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 1aor h ARG 554 CO -0.28 0.16 -0.65 0.74 -1.51 0.00 0.00 179.97 178.43 1aor h PHE 555 N 0.25 0.00 0.00 2.20 0.04 -1.55 -0.90 116.94 116.97 1aor h PHE 555 Ca 0.62 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 61.23 1aor h PHE 555 Cb 1.33 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.45 1aor h PHE 555 CO -0.17 0.65 -1.24 -0.07 -0.60 0.00 0.00 178.31 176.87 1aor h LEU 556 N 0.00 0.00 0.00 1.54 3.38 -0.80 -1.26 115.31 118.17 1aor h LEU 556 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1aor h LEU 556 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1aor h LEU 556 CO 0.08 0.60 -0.49 -0.62 0.09 0.00 0.00 178.44 178.10 1aor n GLU 557 N -2.97 2.94 -3.71 1.13 1.02 0.16 -4.64 120.64 114.57 1aor n GLU 557 Ca -0.07 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.69 1aor n GLU 557 Cb 0.83 -0.71 -0.12 0.00 -0.02 0.00 0.00 31.44 31.42 1aor n GLU 557 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1aor s GLU 558 N -1.30 3.45 0.39 3.49 2.02 -0.34 -5.03 118.70 121.38 1aor s GLU 558 Ca 0.00 -0.63 -0.26 0.00 0.02 0.00 0.00 54.97 54.10 1aor s GLU 558 Cb 0.00 -3.44 -0.09 0.00 0.10 0.00 0.00 34.13 30.71 1aor s GLU 558 CO 0.00 -0.32 1.24 -2.14 0.02 0.00 0.00 175.26 174.07 1aor s PRO 559 N 1.60 4.05 -0.17 0.39 0.02 -1.26 -4.65 135.00 134.98 1aor s PRO 559 Ca 0.05 2.02 -0.35 0.00 0.02 0.00 0.00 61.00 62.74 1aor s PRO 559 Cb -0.16 -2.76 -0.12 0.00 0.02 0.00 0.00 34.50 31.47 1aor s PRO 559 CO 0.05 -0.38 1.90 -0.12 -0.33 0.00 0.00 177.00 178.12 1aor n MET 560 N 0.19 1.83 -0.14 5.54 0.00 -0.45 -4.69 117.12 119.40 1aor n MET 560 Ca 0.03 0.65 0.11 0.00 -0.00 0.00 0.00 57.70 58.50 1aor n MET 560 Cb 0.45 -2.53 0.45 0.00 0.00 0.00 0.00 33.22 31.59 1aor n MET 560 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 1aor h PRO 561 N 9.37 0.51 0.00 2.12 0.11 -1.91 0.18 132.00 142.39 1aor h PRO 561 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1aor h PRO 561 Cb 1.29 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1aor h PRO 561 CO 0.96 0.34 0.21 -0.85 -0.21 0.00 0.00 178.00 178.45 1aor n GLU 562 N -4.48 0.68 0.00 1.05 0.28 -1.26 -4.83 120.64 112.07 1aor n GLU 562 Ca 0.11 -1.35 0.00 0.00 -0.16 0.00 0.00 57.16 55.77 1aor n GLU 562 Cb 0.37 1.70 0.00 0.00 1.43 0.00 0.00 31.44 34.94 1aor n GLU 562 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1aor n GLY 563 N -0.36 -2.27 0.35 -1.84 0.00 -1.26 -3.76 105.19 96.05 1aor n GLY 563 Ca -0.05 -1.56 0.18 0.00 0.00 0.00 0.00 46.02 44.59 1aor n GLY 563 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1aor h PRO 564 N 0.00 0.00 -0.50 1.61 0.11 -1.85 -1.93 132.00 129.44 1aor h PRO 564 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1aor h PRO 564 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1aor h PRO 564 CO 0.00 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.88 1aor n ASN 565 N -3.68 4.49 -4.56 -2.05 3.02 -1.26 -5.03 115.26 106.20 1aor n ASN 565 Ca 0.03 -2.62 -0.51 0.00 -0.03 0.00 0.00 54.58 51.44 1aor n ASN 565 Cb 0.41 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 38.99 1aor n ASN 565 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1aor n LYS 566 N 0.53 0.91 -0.42 3.52 4.81 -0.73 -1.68 118.16 125.10 1aor n LYS 566 Ca 0.23 0.33 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 1aor n LYS 566 Cb 0.89 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 34.11 1aor n LYS 566 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aor n GLY 567 N 2.07 1.49 3.84 3.14 0.00 0.64 -4.88 105.19 111.49 1aor n GLY 567 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1aor n GLY 567 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1aor s HIS 568 N -3.18 3.36 0.07 1.61 3.76 -0.68 -4.60 115.29 115.64 1aor s HIS 568 Ca 0.00 1.36 0.01 0.00 -0.15 0.00 0.00 55.06 56.28 1aor s HIS 568 Cb 0.00 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 31.00 1aor s HIS 568 CO 0.00 -0.03 -0.06 0.99 -0.85 0.00 0.00 174.74 174.79 1aor s THR 569 N -2.13 0.52 -0.35 1.30 2.01 -1.26 -1.34 115.64 114.38 1aor s THR 569 Ca 0.57 -1.65 -0.22 0.00 0.31 0.00 0.00 61.69 60.70 1aor s THR 569 Cb -0.10 -1.31 0.00 0.00 0.01 0.00 0.00 72.50 71.11 1aor s THR 569 CO 0.18 -0.77 0.74 -0.69 -0.69 0.00 0.00 174.62 173.39 1aor s VAL 570 N -3.04 4.80 -1.50 3.82 1.01 -0.48 -4.90 120.40 120.12 1aor s VAL 570 Ca 0.04 0.86 -0.09 0.00 0.00 0.00 0.00 61.98 62.79 1aor s VAL 570 Cb 0.01 -4.15 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 1aor s VAL 570 CO -0.04 -0.35 2.79 0.54 0.00 0.00 0.00 175.10 178.03 1aor n ARG 571 N 6.25 3.39 0.10 2.72 3.00 -1.26 -4.64 116.66 126.22 1aor n ARG 571 Ca 0.02 -2.08 -0.13 0.00 -0.01 0.00 0.00 57.85 55.64 1aor n ARG 571 Cb 0.48 -2.76 -0.08 0.00 0.00 0.00 0.00 32.46 30.11 1aor n ARG 571 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1aor h LEU 572 N 7.37 -0.19 -0.99 0.55 5.85 -1.94 -3.27 115.31 122.68 1aor h LEU 572 Ca 0.80 -0.15 0.38 0.00 0.84 0.00 0.00 57.88 59.75 1aor h LEU 572 Cb 0.27 0.05 -0.17 0.00 0.37 0.00 0.00 40.66 41.18 1aor h LEU 572 CO 1.73 0.04 0.48 0.07 -0.34 0.00 0.00 178.44 180.42 1aor h LYS 573 N -0.42 0.07 0.00 1.25 -0.00 -2.00 0.16 116.57 115.64 1aor h LYS 573 Ca -0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.62 1aor h LYS 573 Cb 0.33 -0.02 0.00 0.00 -0.00 0.00 0.00 32.23 32.54 1aor h LYS 573 CO 0.04 0.05 -0.66 1.05 -0.00 0.00 0.00 179.45 179.93 1aor h GLU 574 N 0.08 0.00 0.13 0.07 4.11 -1.96 -3.38 114.58 113.63 1aor h GLU 574 Ca 0.79 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.86 1aor h GLU 574 Cb 1.97 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.21 1aor h GLU 574 CO -0.75 0.00 -1.90 0.52 0.07 0.00 0.00 179.01 176.95 1aor h MET 575 N 0.00 0.28 -0.35 1.06 2.86 -1.06 -3.40 114.93 114.32 1aor h MET 575 Ca 0.00 -0.47 0.07 0.00 -2.06 0.00 0.00 59.70 57.24 1aor h MET 575 Cb 0.75 0.18 -0.09 0.00 0.06 0.00 0.00 31.60 32.50 1aor h MET 575 CO 0.00 1.23 -0.36 1.25 1.06 0.00 0.00 176.91 180.08 1aor h LEU 576 N 0.02 -1.19 -1.63 1.22 5.85 -1.43 -1.03 115.31 117.10 1aor h LEU 576 Ca -0.40 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1aor h LEU 576 Cb 2.00 0.53 -0.01 0.00 0.37 0.00 0.00 40.66 43.56 1aor h LEU 576 CO 0.09 -0.35 -0.19 1.55 -0.34 0.00 0.00 178.44 179.20 1aor h PRO 577 N -0.31 0.00 -0.19 5.25 0.13 -1.79 -2.22 132.00 132.86 1aor h PRO 577 Ca 0.15 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.13 1aor h PRO 577 Cb 0.56 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 1aor h PRO 577 CO -0.52 0.19 -0.48 0.00 -0.23 0.00 0.00 178.00 176.96 1aor h ARG 578 N 0.00 0.52 -0.57 0.86 3.08 -1.50 -2.49 114.38 114.28 1aor h ARG 578 Ca -0.00 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 1aor h ARG 578 Cb 0.35 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 1aor h ARG 578 CO 0.03 0.89 0.31 -0.92 -1.07 0.00 0.00 179.97 179.20 1aor h TYR 579 N 0.41 0.78 -0.32 3.04 3.20 -0.64 -0.71 116.97 122.74 1aor h TYR 579 Ca 0.02 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1aor h TYR 579 Cb 1.00 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 1aor h TYR 579 CO 0.04 0.57 0.21 1.88 -1.64 0.00 0.00 178.16 179.22 1aor h TYR 580 N 0.76 0.41 -0.44 -3.82 0.05 -1.34 -0.97 116.97 111.62 1aor h TYR 580 Ca 0.20 0.01 0.02 0.00 0.05 0.00 0.00 58.73 59.00 1aor h TYR 580 Cb 0.05 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 1aor h TYR 580 CO -0.01 0.26 0.27 0.87 -1.05 0.00 0.00 178.16 178.50 1aor h LYS 581 N 0.43 0.52 0.00 4.88 6.56 -1.15 0.40 116.57 128.22 1aor h LYS 581 Ca 0.12 -0.03 -0.06 0.00 -1.06 0.00 0.00 60.65 59.62 1aor h LYS 581 Cb -0.04 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.49 1aor h LYS 581 CO -0.02 0.35 -0.28 -0.07 -2.06 0.00 0.00 179.45 177.36 1aor h LEU 582 N 0.54 0.00 -0.45 2.94 3.38 -0.88 -1.74 115.31 119.10 1aor h LEU 582 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1aor h LEU 582 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1aor h LEU 582 CO -0.07 0.28 0.00 0.03 0.09 0.00 0.00 178.44 178.76 1aor h ARG 583 N 0.00 0.00 0.00 1.13 2.47 -0.57 -3.46 114.38 113.95 1aor h ARG 583 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1aor h ARG 583 Cb 0.52 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 1aor h ARG 583 CO 0.04 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.98 1aor n GLY 584 N 0.62 0.68 3.97 0.04 0.00 -0.65 -5.06 105.19 104.79 1aor n GLY 584 Ca 0.03 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.16 1aor n GLY 584 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1aor s TRP 585 N -2.00 2.37 0.71 1.61 0.51 0.08 -4.66 118.94 117.55 1aor s TRP 585 Ca 0.00 -0.53 -0.11 0.00 -2.12 0.00 0.00 56.10 53.33 1aor s TRP 585 Cb 0.00 -2.25 0.01 0.00 -0.81 0.00 0.00 33.47 30.42 1aor s TRP 585 CO 0.00 -0.51 1.09 0.95 -0.51 0.00 0.00 176.95 177.97 1aor s THR 586 N -2.49 3.53 0.58 2.01 -4.23 -0.49 -4.24 115.64 110.31 1aor s THR 586 Ca 0.53 0.50 0.28 0.00 -1.18 0.00 0.00 61.69 61.82 1aor s THR 586 Cb -0.07 -3.48 0.37 0.00 1.34 0.00 0.00 72.50 70.67 1aor s THR 586 CO 0.32 -0.65 2.00 1.05 -0.54 0.00 0.00 174.62 176.80 1aor h GLU 587 N -0.65 0.00 -0.57 3.99 9.09 -1.93 -0.54 114.58 123.97 1aor h GLU 587 Ca -0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.96 1aor h GLU 587 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1aor h GLU 587 CO 0.64 0.00 0.00 -0.40 0.05 0.00 0.00 179.01 179.30 1aor n ASP 588 N -3.83 5.59 -0.54 3.06 5.68 -1.26 -4.93 116.55 120.32 1aor n ASP 588 Ca 0.05 -2.89 -0.07 0.00 -0.50 0.00 0.00 54.79 51.39 1aor n ASP 588 Cb 0.51 -0.67 -0.03 0.00 -1.14 0.00 0.00 41.12 39.79 1aor n ASP 588 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1aor n GLY 589 N 0.63 0.84 3.99 6.12 0.00 -0.21 -4.62 105.19 111.93 1aor n GLY 589 Ca 0.27 -0.74 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 1aor n GLY 589 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aor s LYS 590 N -2.70 3.15 -0.29 1.61 -0.14 -1.26 -4.87 119.74 115.24 1aor s LYS 590 Ca 0.00 -0.99 -0.08 0.00 -1.36 0.00 0.00 55.97 53.55 1aor s LYS 590 Cb 0.00 -2.82 -0.00 0.00 -1.68 0.00 0.00 37.83 33.32 1aor s LYS 590 CO 0.00 0.11 0.09 0.42 -0.76 0.00 0.00 175.35 175.21 1aor s ILE 591 N -2.15 4.19 0.63 2.17 1.01 -1.26 -1.40 121.20 124.39 1aor s ILE 591 Ca 0.44 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 60.42 1aor s ILE 591 Cb -0.09 -3.10 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 1aor s ILE 591 CO 0.31 0.14 1.12 -2.16 0.00 0.00 0.00 174.94 174.35 1aor s PRO 592 N 1.55 2.92 0.34 2.79 0.04 -1.26 -4.91 135.00 136.47 1aor s PRO 592 Ca 0.04 1.47 0.09 0.00 0.04 0.00 0.00 61.00 62.64 1aor s PRO 592 Cb -0.17 -1.96 0.81 0.00 0.04 0.00 0.00 34.50 33.23 1aor s PRO 592 CO 0.03 -1.17 1.82 -0.22 0.04 0.00 0.00 177.00 177.50 1aor h LYS 593 N 0.33 0.68 -0.73 4.56 3.64 -1.99 -1.56 116.57 121.49 1aor h LYS 593 Ca -0.48 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 1aor h LYS 593 Cb 1.25 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.89 1aor h LYS 593 CO 0.55 0.45 0.42 1.05 -2.27 0.00 0.00 179.45 179.64 1aor h GLU 594 N 0.70 1.01 -0.21 1.90 9.09 -1.99 -0.99 114.58 124.08 1aor h GLU 594 Ca 0.52 -0.10 -0.08 0.00 0.05 0.00 0.00 59.36 59.75 1aor h GLU 594 Cb 0.88 -0.21 -0.00 0.00 -1.65 0.00 0.00 28.75 27.77 1aor h GLU 594 CO -0.28 0.72 -0.18 -0.22 0.05 0.00 0.00 179.01 179.11 1aor h LYS 595 N 1.02 0.49 -0.89 1.06 1.63 -1.61 -1.16 116.57 117.11 1aor h LYS 595 Ca 0.26 -0.25 0.04 0.00 -0.85 0.00 0.00 60.65 59.86 1aor h LYS 595 Cb -0.00 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.57 1aor h LYS 595 CO -0.05 0.82 0.57 -0.07 -3.45 0.00 0.00 179.45 177.27 1aor h LEU 596 N 0.18 0.93 -0.64 5.20 3.38 -1.24 -0.85 115.31 122.27 1aor h LEU 596 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1aor h LEU 596 Cb 0.71 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1aor h LEU 596 CO 0.05 0.62 0.13 -0.33 0.09 0.00 0.00 178.44 178.99 1aor h GLU 597 N 1.08 1.04 -0.75 1.13 5.08 -1.03 0.18 114.58 121.31 1aor h GLU 597 Ca 0.37 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1aor h GLU 597 Cb 0.07 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 1aor h GLU 597 CO -0.14 0.95 0.49 1.49 -1.00 0.00 0.00 179.01 180.80 1aor h GLU 598 N 0.96 0.99 0.00 2.33 4.81 -0.14 -2.32 114.58 121.22 1aor h GLU 598 Ca 0.20 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1aor h GLU 598 Cb 0.40 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.56 1aor h GLU 598 CO 0.01 0.67 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.46 1aor h LEU 599 N 1.02 0.00 0.00 1.64 3.38 -0.70 -3.48 115.31 117.17 1aor h LEU 599 Ca 0.27 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1aor h LEU 599 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1aor h LEU 599 CO -0.06 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.12 1aor n GLY 600 N 1.25 0.63 0.09 0.83 0.00 0.43 -4.95 105.19 103.47 1aor n GLY 600 Ca 0.03 -0.77 0.06 0.00 0.00 0.00 0.00 46.02 45.34 1aor n GLY 600 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1aor n ILE 601 N -3.21 1.35 0.31 -0.61 -5.35 -0.09 -4.75 119.36 107.02 1aor n ILE 601 Ca 0.00 -1.57 0.20 0.00 -0.27 0.00 0.00 62.75 61.11 1aor n ILE 601 Cb 0.27 0.10 1.05 0.00 -1.74 0.00 0.00 39.64 39.32 1aor n ILE 601 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1aor h ALA 602 N 0.00 1.00 0.00 -1.28 0.00 -1.85 -1.99 119.26 115.13 1aor h ALA 602 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aor h ALA 602 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1aor h ALA 602 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 179.25 180.30 1aor h GLU 603 N 0.00 0.00 -0.02 0.00 9.09 -1.91 -1.45 114.58 120.28 1aor h GLU 603 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1aor h GLU 603 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1aor h GLU 603 CO 0.00 0.00 -0.00 1.19 0.05 0.00 0.00 179.01 180.25 1aor n PHE 604 N -2.69 0.00 0.49 2.06 3.72 -0.75 -5.15 117.46 115.15 1aor n PHE 604 Ca -0.01 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.43 1aor n PHE 604 Cb 0.16 -0.00 0.23 0.00 -0.94 0.00 0.00 39.48 38.93 1aor n PHE 604 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69