#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6m s ARG 2 N 0.00 2.79 -0.24 3.17 3.52 -0.61 -1.22 118.95 126.36 1d6m s ARG 2 Ca 0.00 -0.76 -0.11 0.00 -0.13 0.00 0.00 55.73 54.73 1d6m s ARG 2 Cb 0.00 -2.38 -0.05 0.00 -1.56 0.00 0.00 34.95 30.97 1d6m s ARG 2 CO 0.00 -0.15 0.18 -1.17 -0.81 0.00 0.00 175.30 173.36 1d6m s LEU 3 N 1.17 4.11 -0.46 -0.88 2.96 -0.61 -1.32 118.68 123.65 1d6m s LEU 3 Ca 0.01 0.14 -0.13 0.00 -0.22 0.00 0.00 54.13 53.93 1d6m s LEU 3 Cb -0.14 -2.14 0.08 0.00 0.50 0.00 0.00 46.19 44.49 1d6m s LEU 3 CO -0.08 0.04 0.35 -0.36 -1.32 0.00 0.00 176.35 174.98 1d6m s PHE 4 N 1.13 3.29 -0.71 5.38 0.40 0.11 -0.13 117.98 127.46 1d6m s PHE 4 Ca 0.08 -1.24 -0.19 0.00 -0.60 0.00 0.00 56.93 54.98 1d6m s PHE 4 Cb -0.14 -3.18 0.12 0.00 0.51 0.00 0.00 43.02 40.33 1d6m s PHE 4 CO 0.05 -0.85 0.85 0.42 0.70 0.00 0.00 175.22 176.39 1d6m s ILE 5 N 1.54 4.82 0.73 0.64 1.01 -0.86 -0.33 121.20 128.75 1d6m s ILE 5 Ca 0.04 -1.20 -0.11 0.00 0.00 0.00 0.00 60.65 59.37 1d6m s ILE 5 Cb -0.25 -4.58 0.04 0.00 0.01 0.00 0.00 42.46 37.68 1d6m s ILE 5 CO 0.04 -1.25 1.11 0.00 0.00 0.00 0.00 174.94 174.84 1d6m s ALA 6 N 2.60 2.85 0.04 9.38 0.00 -0.62 -1.39 121.76 134.62 1d6m s ALA 6 Ca 0.19 -0.48 -0.24 0.00 0.00 0.00 0.00 51.96 51.42 1d6m s ALA 6 Cb -0.17 -2.97 -0.17 0.00 0.00 0.00 0.00 23.12 19.82 1d6m s ALA 6 CO 0.01 -1.30 1.52 1.49 0.00 0.00 0.00 175.76 177.49 1d6m h GLU 7 N -0.75 0.03 -3.99 0.00 4.57 -1.80 -1.78 114.58 110.85 1d6m h GLU 7 Ca -0.45 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 57.60 1d6m h GLU 7 Cb 1.28 -0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.75 1d6m h GLU 7 CO 0.64 0.25 -0.30 -1.59 -1.18 0.00 0.00 179.01 176.82 1d6m s LYS 8 N -5.28 1.41 0.12 1.92 -2.85 -1.26 -3.52 119.74 110.27 1d6m s LYS 8 Ca -0.14 -1.38 -0.21 0.00 -1.00 0.00 0.00 55.97 53.24 1d6m s LYS 8 Cb 0.04 0.40 -0.06 0.00 -2.06 0.00 0.00 37.83 36.14 1d6m s LYS 8 CO 0.67 -0.54 1.72 -1.35 0.10 0.00 0.00 175.35 175.95 1d6m h PRO 9 N 2.40 0.01 -0.62 1.78 0.11 -1.92 -1.63 132.00 132.13 1d6m h PRO 9 Ca -0.30 -0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.93 1d6m h PRO 9 Cb 1.25 -0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.26 1d6m h PRO 9 CO 0.42 0.01 0.11 0.66 -0.21 0.00 0.00 178.00 178.99 1d6m h SER 10 N 0.01 -0.06 0.70 -2.05 4.64 -1.98 0.35 113.55 115.16 1d6m h SER 10 Ca 0.07 0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.43 1d6m h SER 10 Cb 0.10 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1d6m h SER 10 CO -0.14 -0.03 -0.40 0.25 -0.87 0.00 0.00 176.83 175.64 1d6m h LEU 11 N 0.23 0.00 -0.45 5.97 5.85 -1.92 -2.72 115.31 122.26 1d6m h LEU 11 Ca 0.33 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.90 1d6m h LEU 11 Cb 0.51 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1d6m h LEU 11 CO -0.45 0.40 -0.31 0.00 -0.34 0.00 0.00 178.44 177.75 1d6m h ALA 12 N 1.60 0.64 0.16 1.25 0.00 0.54 -2.02 119.26 121.43 1d6m h ALA 12 Ca -0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1d6m h ALA 12 Cb 0.86 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1d6m h ALA 12 CO 0.05 0.68 -0.08 0.00 0.00 0.00 0.00 179.25 179.90 1d6m h ARG 13 N 0.80 -0.21 -0.49 0.00 3.08 -0.57 -1.00 114.38 115.98 1d6m h ARG 13 Ca 0.08 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.24 1d6m h ARG 13 Cb 0.89 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.91 1d6m h ARG 13 CO 0.08 -0.08 -0.01 0.00 -1.07 0.00 0.00 179.97 178.89 1d6m h ALA 14 N 0.54 0.46 0.56 0.04 0.00 -1.41 0.41 119.26 119.86 1d6m h ALA 14 Ca -0.02 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1d6m h ALA 14 Cb 0.22 0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1d6m h ALA 14 CO 0.04 -0.39 -0.27 0.82 0.00 0.00 0.00 179.25 179.44 1d6m h ILE 15 N 0.11 0.45 -0.66 0.00 2.04 -1.22 -3.10 117.51 115.12 1d6m h ILE 15 Ca 0.25 -0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.22 1d6m h ILE 15 Cb 0.37 0.45 -0.08 0.00 -0.74 0.00 0.00 36.82 36.82 1d6m h ILE 15 CO -0.42 0.00 0.24 0.00 0.00 0.00 0.00 178.15 177.97 1d6m h ALA 16 N -0.31 0.87 -0.99 1.87 0.00 -0.39 -2.15 119.26 118.16 1d6m h ALA 16 Ca -0.08 0.10 0.32 0.00 0.00 0.00 0.00 54.91 55.25 1d6m h ALA 16 Cb 0.58 0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.30 1d6m h ALA 16 CO 0.13 -0.20 0.54 0.22 0.00 0.00 0.00 179.25 179.94 1d6m h ASP 17 N 0.41 0.47 -0.24 0.00 3.58 -0.15 0.14 116.42 120.63 1d6m h ASP 17 Ca 0.34 0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.99 1d6m h ASP 17 Cb 0.47 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1d6m h ASP 17 CO -0.35 -0.15 0.00 1.33 -2.88 0.00 0.00 179.24 177.19 1d6m n VAL 18 N -5.07 0.30 -2.66 2.25 0.24 -0.82 -4.94 118.33 107.63 1d6m n VAL 18 Ca 0.31 -0.56 -0.23 0.00 -2.04 0.00 0.00 64.34 61.82 1d6m n VAL 18 Cb 0.97 0.89 0.03 0.00 -1.47 0.00 0.00 33.84 34.26 1d6m n VAL 18 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1d6m s LEU 19 N -1.64 3.33 0.67 1.34 1.43 0.48 -4.98 118.68 119.30 1d6m s LEU 19 Ca 0.35 0.26 -0.17 0.00 -1.03 0.00 0.00 54.13 53.54 1d6m s LEU 19 Cb 0.21 -3.10 -0.07 0.00 0.03 0.00 0.00 46.19 43.25 1d6m s LEU 19 CO 0.30 -1.04 0.41 -2.65 0.23 0.00 0.00 176.35 173.59 1d6m n PRO 20 N -2.37 0.33 -0.07 1.29 -0.02 -1.26 -4.91 135.00 127.99 1d6m n PRO 20 Ca 0.05 0.14 -0.02 0.00 -2.02 0.00 0.00 63.50 61.66 1d6m n PRO 20 Cb 0.59 -1.68 -0.02 0.00 -0.02 0.00 0.00 33.50 32.38 1d6m n PRO 20 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1d6m n LYS 21 N -0.17 -0.07 -2.49 -0.52 5.02 -1.26 -3.20 118.16 115.47 1d6m n LYS 21 Ca 0.10 0.50 -0.43 0.00 -2.02 0.00 0.00 58.31 56.46 1d6m n LYS 21 Cb 0.49 -0.75 -0.02 0.00 -0.02 0.00 0.00 35.03 34.73 1d6m n LYS 21 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1d6m s PRO 22 N -3.81 3.61 -0.42 1.97 0.04 -1.26 -4.89 135.00 130.24 1d6m s PRO 22 Ca -0.02 0.66 -0.10 0.00 0.04 0.00 0.00 61.00 61.58 1d6m s PRO 22 Cb 0.02 -3.98 0.07 0.00 0.04 0.00 0.00 34.50 30.65 1d6m s PRO 22 CO 0.10 -1.52 0.27 -1.01 0.04 0.00 0.00 177.00 174.88 1d6m s HIS 23 N 5.00 3.31 -0.48 0.56 3.76 -1.26 -2.40 115.29 123.78 1d6m s HIS 23 Ca 0.53 -1.38 -0.18 0.00 -0.15 0.00 0.00 55.06 53.89 1d6m s HIS 23 Cb -0.10 -2.93 0.06 0.00 1.11 0.00 0.00 32.58 30.72 1d6m s HIS 23 CO 0.31 -0.82 0.51 1.03 -0.85 0.00 0.00 174.74 174.93 1d6m s ARG 24 N 1.47 3.07 -0.16 1.40 1.81 0.31 -4.92 118.95 121.93 1d6m s ARG 24 Ca 0.03 -1.03 -0.29 0.00 -1.72 0.00 0.00 55.73 52.72 1d6m s ARG 24 Cb -0.23 -4.09 -0.05 0.00 -0.45 0.00 0.00 34.95 30.13 1d6m s ARG 24 CO 0.03 -1.09 1.96 0.21 -0.68 0.00 0.00 175.30 175.73 1d6m s LYS 25 N 2.20 3.59 0.00 3.54 2.20 -1.26 0.48 119.74 130.49 1d6m s LYS 25 Ca 0.11 2.04 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 1d6m s LYS 25 Cb -0.21 -4.22 0.00 0.00 -1.51 0.00 0.00 37.83 31.90 1d6m s LYS 25 CO 0.10 -1.57 0.00 0.41 -0.36 0.00 0.00 175.35 173.93 1d6m n GLY 26 N 5.13 2.73 3.29 5.54 0.00 -0.26 -4.93 105.19 116.69 1d6m n GLY 26 Ca 0.24 -2.11 -0.45 0.00 0.00 0.00 0.00 46.02 43.70 1d6m n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d6m s ASP 27 N -0.83 6.34 0.00 1.61 1.01 -1.26 -4.25 116.67 119.28 1d6m s ASP 27 Ca 0.00 -2.36 0.00 0.00 0.71 0.00 0.00 52.55 50.90 1d6m s ASP 27 Cb 0.00 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.78 1d6m s ASP 27 CO 0.00 -0.65 0.00 0.61 0.21 0.00 0.00 175.17 175.34 1d6m n GLY 28 N 4.39 0.76 3.61 0.21 0.00 -1.26 -5.00 105.19 107.90 1d6m n GLY 28 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1d6m n GLY 28 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1d6m s PHE 29 N -2.74 0.49 -0.10 1.61 -0.71 -1.26 -3.73 117.98 111.55 1d6m s PHE 29 Ca 0.00 -0.87 -0.03 0.00 -1.04 0.00 0.00 56.93 54.99 1d6m s PHE 29 Cb 0.00 0.23 0.04 0.00 -1.21 0.00 0.00 43.02 42.09 1d6m s PHE 29 CO 0.00 -1.13 0.09 0.42 -1.34 0.00 0.00 175.22 173.26 1d6m s ILE 30 N -3.51 -0.12 -0.28 -4.49 1.01 -0.66 -1.10 121.20 112.04 1d6m s ILE 30 Ca 0.23 0.19 -0.26 0.00 0.00 0.00 0.00 60.65 60.81 1d6m s ILE 30 Cb -0.01 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 42.13 1d6m s ILE 30 CO 0.12 -0.00 0.92 -1.61 0.00 0.00 0.00 174.94 174.37 1d6m s GLU 31 N 2.17 4.10 0.34 2.79 2.02 0.18 -1.45 118.70 128.86 1d6m s GLU 31 Ca 0.04 0.94 0.09 0.00 0.02 0.00 0.00 54.97 56.06 1d6m s GLU 31 Cb -0.14 -3.69 -0.06 0.00 0.10 0.00 0.00 34.13 30.34 1d6m s GLU 31 CO -0.06 -0.69 -0.03 0.00 0.02 0.00 0.00 175.26 174.51 1d6m s GLY 33 N -3.67 1.52 -1.34 0.00 0.00 -1.01 -3.28 107.32 99.54 1d6m s GLY 33 Ca 0.34 -0.37 -0.02 0.00 0.00 0.00 0.00 44.72 44.67 1d6m s GLY 33 CO 0.18 0.41 0.73 -2.01 0.00 0.00 0.00 173.10 172.40 1d6m n ASN 34 N -4.93 -1.61 -3.68 1.64 5.15 -1.26 -3.09 115.26 107.48 1d6m n ASN 34 Ca 0.05 -0.82 -0.23 0.00 -0.60 0.00 0.00 54.58 52.98 1d6m n ASN 34 Cb 0.56 -4.00 0.01 0.00 -0.53 0.00 0.00 39.78 35.82 1d6m n ASN 34 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1d6m n GLY 35 N -1.61 -1.24 2.67 8.20 0.00 -1.26 -4.84 105.19 107.11 1d6m n GLY 35 Ca -0.26 0.55 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 1d6m n GLY 35 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1d6m s GLN 36 N -4.91 0.10 -0.07 1.61 2.00 -1.18 -1.57 119.66 115.65 1d6m s GLN 36 Ca 0.08 0.05 0.02 0.00 -2.00 0.00 0.00 55.36 53.51 1d6m s GLN 36 Cb -0.04 -1.54 -0.03 0.00 0.80 0.00 0.00 33.01 32.21 1d6m s GLN 36 CO 0.87 -0.64 -0.11 0.08 -0.50 0.00 0.00 175.29 174.99 1d6m s VAL 37 N 2.21 3.34 -0.32 1.34 1.01 -0.43 0.01 120.40 127.56 1d6m s VAL 37 Ca 0.04 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1d6m s VAL 37 Cb -0.16 -2.35 0.07 0.00 0.00 0.00 0.00 36.38 33.95 1d6m s VAL 37 CO -0.10 0.59 0.02 -0.69 0.00 0.00 0.00 175.10 174.92 1d6m s VAL 38 N -0.64 2.73 0.29 2.92 1.01 -0.52 -0.71 120.40 125.47 1d6m s VAL 38 Ca 0.09 -1.73 0.02 0.00 0.00 0.00 0.00 61.98 60.37 1d6m s VAL 38 Cb -0.11 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.59 1d6m s VAL 38 CO 0.01 -0.28 0.21 1.07 0.00 0.00 0.00 175.10 176.11 1d6m n THR 39 N 4.51 0.00 -3.47 3.92 5.66 0.55 -1.66 114.28 123.79 1d6m n THR 39 Ca -0.08 -1.15 -0.15 0.00 -3.05 0.00 0.00 64.05 59.62 1d6m n THR 39 Cb 0.42 -0.23 -0.04 0.00 -1.55 0.00 0.00 70.33 68.93 1d6m n THR 39 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 175.07 170.36 1d6m s TRP 40 N -1.45 -0.59 0.68 1.09 -2.14 -1.24 -1.59 118.94 113.69 1d6m s TRP 40 Ca 0.16 0.71 -0.09 0.00 2.66 0.00 0.00 56.10 59.54 1d6m s TRP 40 Cb -0.01 0.49 0.02 0.00 -3.10 0.00 0.00 33.47 30.86 1d6m s TRP 40 CO 0.10 -0.72 1.04 0.00 -2.66 0.00 0.00 176.95 174.71 1d6m n ILE 42 N -2.90 0.04 -4.34 0.00 5.41 -1.26 -4.18 119.36 112.14 1d6m n ILE 42 Ca 0.06 -4.32 0.00 0.00 1.00 0.00 0.00 62.75 59.49 1d6m n ILE 42 Cb 0.58 -1.90 0.00 0.00 -0.71 0.00 0.00 39.64 37.60 1d6m n ILE 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1d6m n GLY 43 N 1.21 -1.45 3.71 7.39 0.00 -1.26 -4.67 105.19 110.12 1d6m n GLY 43 Ca 0.23 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 1d6m n GLY 43 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1d6m s HIS 44 N 0.00 3.11 0.03 1.61 3.76 -1.26 -4.90 115.29 117.64 1d6m s HIS 44 Ca 0.00 0.90 -0.08 0.00 -0.15 0.00 0.00 55.06 55.73 1d6m s HIS 44 Cb 0.00 -3.68 -0.31 0.00 1.11 0.00 0.00 32.58 29.70 1d6m s HIS 44 CO 0.00 -2.42 0.99 -0.07 -0.85 0.00 0.00 174.74 172.39 1d6m h LEU 45 N 7.30 0.58-10.46 0.89 3.38 -1.91 -3.44 115.31 111.65 1d6m h LEU 45 Ca -0.41 -0.67 -0.46 0.00 0.09 0.00 0.00 57.88 56.43 1d6m h LEU 45 Cb 1.20 -0.19 0.05 0.00 0.09 0.00 0.00 40.66 41.81 1d6m h LEU 45 CO 0.87 1.54 0.05 -0.76 0.09 0.00 0.00 178.44 180.23 1d6m s LEU 46 N -7.27 3.27 0.18 1.67 2.01 -1.26 0.15 118.68 117.42 1d6m s LEU 46 Ca -0.08 0.33 -0.19 0.00 0.01 0.00 0.00 54.13 54.20 1d6m s LEU 46 Cb 0.06 -3.15 0.04 0.00 0.01 0.00 0.00 46.19 43.15 1d6m s LEU 46 CO 0.90 -1.11 0.53 -1.83 1.01 0.00 0.00 176.35 175.86 1d6m s GLU 47 N -4.86 1.34 -0.18 1.70 -1.05 0.17 -4.52 118.70 111.30 1d6m s GLU 47 Ca 0.55 -0.76 -0.23 0.00 -0.15 0.00 0.00 54.97 54.38 1d6m s GLU 47 Cb -0.10 0.53 -0.02 0.00 -0.44 0.00 0.00 34.13 34.10 1d6m s GLU 47 CO 0.41 -0.57 0.72 -1.14 0.95 0.00 0.00 175.26 175.63 1d6m s GLN 48 N -3.84 4.25 0.35 -4.83 0.74 -1.26 0.79 119.66 115.87 1d6m s GLN 48 Ca 0.07 0.80 -0.26 0.00 0.05 0.00 0.00 55.36 56.02 1d6m s GLN 48 Cb -0.01 -3.57 -0.13 0.00 1.10 0.00 0.00 33.01 30.40 1d6m s GLN 48 CO -0.06 -0.27 0.91 0.00 -0.55 0.00 0.00 175.29 175.32 1d6m n ALA 49 N 5.11 -0.40 -1.99 1.58 0.00 -0.93 -4.89 120.51 118.98 1d6m n ALA 49 Ca 0.01 0.30 -0.27 0.00 0.00 0.00 0.00 53.44 53.49 1d6m n ALA 49 Cb 0.49 -1.98 0.05 0.00 0.00 0.00 0.00 19.45 18.01 1d6m n ALA 49 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1d6m s GLN 50 N -1.69 2.59 0.27 0.00 -1.52 -1.26 -4.94 119.66 113.12 1d6m s GLN 50 Ca 0.61 -0.03 -0.01 0.00 -1.95 0.00 0.00 55.36 53.98 1d6m s GLN 50 Cb -0.65 -2.18 0.60 0.00 -0.22 0.00 0.00 33.01 30.56 1d6m s GLN 50 CO 0.59 -0.99 1.68 -1.35 -0.25 0.00 0.00 175.29 174.96 1d6m h PRO 51 N -0.45 0.27 0.00 2.91 0.11 -1.93 0.26 132.00 133.18 1d6m h PRO 51 Ca -0.45 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1d6m h PRO 51 Cb 1.28 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1d6m h PRO 51 CO 0.61 0.18 -0.02 0.38 -0.21 0.00 0.00 178.00 178.94 1d6m h ASP 52 N 0.28 0.00 0.85 -2.05 3.04 -1.74 -2.20 116.42 114.60 1d6m h ASP 52 Ca 0.49 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 54.23 1d6m h ASP 52 Cb 0.91 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.19 1d6m h ASP 52 CO -0.56 0.02 -0.26 0.00 -2.04 0.00 0.00 179.24 176.40 1d6m h ALA 53 N 1.98 1.04 0.22 4.15 0.00 -0.83 -3.09 119.26 122.72 1d6m h ALA 53 Ca -0.00 -0.23 -0.34 0.00 0.00 0.00 0.00 54.91 54.33 1d6m h ALA 53 Cb 0.16 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1d6m h ALA 53 CO 0.00 0.32 -1.62 1.88 0.00 0.00 0.00 179.25 179.84 1d6m h TYR 54 N 0.00 0.84 -2.38 0.00 0.05 -1.48 -3.46 116.97 110.54 1d6m h TYR 54 Ca -0.00 -0.62 -0.05 0.00 0.05 0.00 0.00 58.73 58.11 1d6m h TYR 54 Cb 0.75 -0.03 -0.25 0.00 1.01 0.00 0.00 36.73 38.21 1d6m h TYR 54 CO 0.00 1.61 -0.21 0.34 -1.05 0.00 0.00 178.16 178.85 1d6m s ASP 55 N -7.43 -0.64 0.57 3.88 2.15 -1.19 -5.06 116.67 108.95 1d6m s ASP 55 Ca -0.12 1.15 0.26 0.00 0.43 0.00 0.00 52.55 54.27 1d6m s ASP 55 Cb 0.05 1.22 1.65 0.00 -0.30 0.00 0.00 42.92 45.54 1d6m s ASP 55 CO 0.90 -0.22 2.18 0.77 -0.17 0.00 0.00 175.17 178.64 1d6m h SER 56 N 7.40 0.00 0.89 -0.34 4.64 -1.85 -0.86 113.55 123.43 1d6m h SER 56 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1d6m h SER 56 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1d6m h SER 56 CO 0.20 0.00 0.00 0.03 -0.87 0.00 0.00 176.83 176.19 1d6m h ARG 57 N 0.00 0.00 -0.02 4.77 -0.00 -1.95 -2.80 114.38 114.38 1d6m h ARG 57 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.51 1d6m h ARG 57 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.14 1d6m h ARG 57 CO -0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.97 180.63 1d6m n TYR 58 N -2.32 0.03 0.10 3.04 4.01 -0.33 -3.28 117.16 118.41 1d6m n TYR 58 Ca 0.03 -0.02 -0.01 0.00 -0.16 0.00 0.00 57.90 57.74 1d6m n TYR 58 Cb 0.27 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.27 1d6m n TYR 58 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1d6m h ALA 59 N 3.46 0.56 -3.14 -0.72 0.00 -1.67 -3.37 119.26 114.38 1d6m h ALA 59 Ca 0.00 -0.66 -0.59 0.00 0.00 0.00 0.00 54.91 53.66 1d6m h ALA 59 Cb 0.05 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 17.65 1d6m h ALA 59 CO 0.00 0.89 -0.37 -0.98 0.00 0.00 0.00 179.25 178.79 1d6m s ARG 60 N -2.86 4.24 -0.53 0.00 1.70 -1.21 -5.01 118.95 115.29 1d6m s ARG 60 Ca 0.02 0.02 -0.27 0.00 -0.47 0.00 0.00 55.73 55.03 1d6m s ARG 60 Cb 0.08 -3.43 -0.01 0.00 -0.57 0.00 0.00 34.95 31.03 1d6m s ARG 60 CO 0.78 0.24 1.70 -1.58 -1.08 0.00 0.00 175.30 175.35 1d6m s TRP 61 N 0.48 1.90 -0.06 5.89 0.52 -1.26 -4.97 118.94 121.44 1d6m s TRP 61 Ca 0.14 0.64 -0.00 0.00 0.02 0.00 0.00 56.10 56.90 1d6m s TRP 61 Cb -0.13 -4.20 0.02 0.00 -1.15 0.00 0.00 33.47 28.02 1d6m s TRP 61 CO 0.02 -2.35 -0.02 0.54 0.02 0.00 0.00 176.95 175.16 1d6m s ASN 62 N 6.39 1.25 0.21 2.95 2.20 -1.26 -5.05 114.94 121.63 1d6m s ASN 62 Ca 0.65 -0.11 -0.09 0.00 -0.94 0.00 0.00 52.86 52.37 1d6m s ASN 62 Cb -0.14 -0.45 0.31 0.00 -2.00 0.00 0.00 41.25 38.96 1d6m s ASN 62 CO 0.25 -0.12 1.75 0.25 -2.94 0.00 0.00 177.10 176.29 1d6m h LEU 63 N 7.72 0.26 -1.30 3.54 5.85 -1.96 -3.22 115.31 126.20 1d6m h LEU 63 Ca -0.30 0.08 0.38 0.00 0.84 0.00 0.00 57.88 58.88 1d6m h LEU 63 Cb 1.14 0.05 -0.13 0.00 0.37 0.00 0.00 40.66 42.09 1d6m h LEU 63 CO 0.38 0.15 0.74 0.00 -0.34 0.00 0.00 178.44 179.36 1d6m h ALA 64 N 1.43 2.45 -0.13 1.25 0.00 -2.01 0.24 119.26 122.49 1d6m h ALA 64 Ca 0.32 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.30 1d6m h ALA 64 Cb 0.41 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1d6m h ALA 64 CO -0.31 -1.04 -0.32 -0.40 0.00 0.00 0.00 179.25 177.18 1d6m n ASP 65 N -4.78 2.04 -0.02 0.00 5.68 -1.22 -4.94 116.55 113.32 1d6m n ASP 65 Ca 0.34 -3.81 -0.07 0.00 -0.50 0.00 0.00 54.79 50.75 1d6m n ASP 65 Cb 1.22 -0.56 -0.05 0.00 -1.14 0.00 0.00 41.12 40.59 1d6m n ASP 65 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1d6m h LEU 66 N 0.96 -0.84 -8.56 -2.12 5.85 -0.60 -3.38 115.31 106.62 1d6m h LEU 66 Ca 0.08 0.10 -0.48 0.00 0.84 0.00 0.00 57.88 58.42 1d6m h LEU 66 Cb 1.24 0.33 -0.00 0.00 0.37 0.00 0.00 40.66 42.59 1d6m h LEU 66 CO 0.14 -0.22 1.64 -0.81 -0.34 0.00 0.00 178.44 178.84 1d6m n PRO 67 N -3.94 0.99 -3.31 5.25 -0.05 -1.26 -4.81 135.00 127.87 1d6m n PRO 67 Ca -0.03 0.05 -0.44 0.00 -0.05 0.00 0.00 63.50 63.03 1d6m n PRO 67 Cb 0.18 -3.17 -0.07 0.00 -0.05 0.00 0.00 33.50 30.39 1d6m n PRO 67 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 1d6m s ILE 68 N 11.39 5.11 -0.49 0.52 1.01 -1.26 -5.02 121.20 132.47 1d6m s ILE 68 Ca 1.03 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 60.84 1d6m s ILE 68 Cb -0.34 -4.19 0.12 0.00 0.01 0.00 0.00 42.46 38.06 1d6m s ILE 68 CO 0.30 -0.67 0.22 -0.69 0.00 0.00 0.00 174.94 174.11 1d6m s VAL 69 N 1.98 2.50 0.30 2.92 1.01 -1.26 -4.91 120.40 122.94 1d6m s VAL 69 Ca 0.08 -3.14 -0.26 0.00 0.00 0.00 0.00 61.98 58.66 1d6m s VAL 69 Cb -0.23 -2.76 -0.15 0.00 0.00 0.00 0.00 36.38 33.25 1d6m s VAL 69 CO 0.08 -0.77 0.68 -2.65 0.00 0.00 0.00 175.10 172.44 1d6m n PRO 70 N 3.31 0.62 0.00 2.72 -0.02 -1.26 -4.88 135.00 135.50 1d6m n PRO 70 Ca 0.05 0.22 0.06 0.00 -2.02 0.00 0.00 63.50 61.81 1d6m n PRO 70 Cb 0.34 -1.42 -0.04 0.00 -0.02 0.00 0.00 33.50 32.35 1d6m n PRO 70 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1d6m n GLU 71 N 0.82 2.41 -3.49 -0.52 -0.58 -1.26 -4.76 120.64 113.26 1d6m n GLU 71 Ca 0.13 -0.33 -0.26 0.00 -0.42 0.00 0.00 57.16 56.28 1d6m n GLU 71 Cb 0.32 -1.13 -0.13 0.00 -0.57 0.00 0.00 31.44 29.92 1d6m n GLU 71 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1d6m s LYS 72 N -1.93 0.29 0.26 3.49 2.36 -1.26 -5.13 119.74 117.81 1d6m s LYS 72 Ca 0.08 -0.58 -0.30 0.00 -2.55 0.00 0.00 55.97 52.62 1d6m s LYS 72 Cb 0.10 -1.05 -0.10 0.00 -1.05 0.00 0.00 37.83 35.74 1d6m s LYS 72 CO 0.43 -1.06 1.32 -1.58 1.55 0.00 0.00 175.35 176.01 1d6m s TRP 73 N 1.97 3.17 -0.05 4.03 0.52 -1.26 -5.03 118.94 122.29 1d6m s TRP 73 Ca 0.11 1.29 0.04 0.00 0.02 0.00 0.00 56.10 57.56 1d6m s TRP 73 Cb -0.17 -3.64 -0.02 0.00 -1.15 0.00 0.00 33.47 28.49 1d6m s TRP 73 CO -0.29 -1.91 -0.17 -0.65 0.02 0.00 0.00 176.95 173.95 1d6m s GLN 74 N -0.80 2.50 0.27 4.98 -0.21 -1.26 -5.12 119.66 120.02 1d6m s GLN 74 Ca 0.54 -0.75 0.10 0.00 0.02 0.00 0.00 55.36 55.27 1d6m s GLN 74 Cb -0.38 -2.33 -0.04 0.00 1.00 0.00 0.00 33.01 31.26 1d6m s GLN 74 CO 0.44 0.57 -0.03 -0.51 -2.12 0.00 0.00 175.29 173.64 1d6m s LEU 75 N -0.59 3.12 -0.01 2.90 1.43 -1.26 -2.20 118.68 122.07 1d6m s LEU 75 Ca 0.09 -0.69 0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1d6m s LEU 75 Cb -0.11 -1.64 -0.00 0.00 0.03 0.00 0.00 46.19 44.46 1d6m s LEU 75 CO 0.01 0.01 -0.07 -1.10 0.23 0.00 0.00 176.35 175.43 1d6m s GLN 76 N -3.63 0.58 0.12 1.70 -0.21 0.24 -4.79 119.66 113.67 1d6m s GLN 76 Ca 0.31 -0.23 -0.34 0.00 0.02 0.00 0.00 55.36 55.12 1d6m s GLN 76 Cb -0.06 -0.57 -0.14 0.00 1.00 0.00 0.00 33.01 33.24 1d6m s GLN 76 CO 0.19 0.13 1.57 -2.30 -2.12 0.00 0.00 175.29 172.76 1d6m n PRO 77 N 3.02 1.99 -2.34 2.91 -0.02 -1.26 0.46 135.00 139.76 1d6m n PRO 77 Ca -0.14 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1d6m n PRO 77 Cb 0.57 -2.47 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1d6m n PRO 77 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1d6m s ARG 78 N 1.17 4.32 0.21 -0.52 3.52 0.39 -4.75 118.95 123.31 1d6m s ARG 78 Ca 0.81 1.83 -0.09 0.00 -0.13 0.00 0.00 55.73 58.15 1d6m s ARG 78 Cb -0.73 -3.55 0.31 0.00 -1.56 0.00 0.00 34.95 29.42 1d6m s ARG 78 CO 0.41 -0.50 1.73 -1.00 -0.81 0.00 0.00 175.30 175.13 1d6m h PRO 79 N 7.61 0.37 0.00 5.12 0.13 -1.89 -2.70 132.00 140.64 1d6m h PRO 79 Ca -0.36 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 1d6m h PRO 79 Cb 1.17 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1d6m h PRO 79 CO 0.89 0.24 -0.20 0.66 -0.23 0.00 0.00 178.00 179.36 1d6m h SER 80 N 0.38 0.00 -0.41 1.44 4.64 -1.96 -3.15 113.55 114.48 1d6m h SER 80 Ca 0.33 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.37 1d6m h SER 80 Cb 0.44 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.34 1d6m h SER 80 CO -0.35 0.20 -0.38 1.33 -0.87 0.00 0.00 176.83 176.76 1d6m n VAL 81 N -3.35 2.52 0.15 0.95 0.24 -1.04 -4.70 118.33 113.10 1d6m n VAL 81 Ca 0.00 -3.39 0.01 0.00 -2.04 0.00 0.00 64.34 58.92 1d6m n VAL 81 Cb 0.42 -0.61 0.23 0.00 -1.47 0.00 0.00 33.84 32.41 1d6m n VAL 81 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1d6m h THR 82 N 1.37 1.27 -0.28 3.34 1.35 -1.47 -2.62 112.91 115.88 1d6m h THR 82 Ca 0.23 -1.90 -0.01 0.00 -0.55 0.00 0.00 66.41 64.18 1d6m h THR 82 Cb 1.36 2.05 -0.01 0.00 -1.73 0.00 0.00 68.15 69.82 1d6m h THR 82 CO 0.47 0.52 0.12 0.07 -0.25 0.00 0.00 175.52 176.45 1d6m h LYS 83 N 0.00 0.41 -0.34 4.72 -0.00 -1.86 -2.75 116.57 116.76 1d6m h LYS 83 Ca -0.01 -0.07 -0.06 0.00 -0.00 0.00 0.00 60.65 60.52 1d6m h LYS 83 Cb 1.01 -0.07 -0.02 0.00 -0.00 0.00 0.00 32.23 33.15 1d6m h LYS 83 CO 0.07 0.42 -0.04 0.37 -0.00 0.00 0.00 179.45 180.27 1d6m h GLN 84 N 0.30 0.55 -0.64 0.07 5.75 -1.86 -2.17 115.11 117.12 1d6m h GLN 84 Ca 0.09 -0.13 0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1d6m h GLN 84 Cb 0.16 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 28.59 1d6m h GLN 84 CO -0.01 0.61 0.37 1.25 -2.65 0.00 0.00 178.83 178.40 1d6m h LEU 85 N 0.52 0.58 -1.31 -2.39 5.85 -1.31 -2.07 115.31 115.18 1d6m h LEU 85 Ca 0.11 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 1d6m h LEU 85 Cb 0.40 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1d6m h LEU 85 CO 0.02 0.39 -0.32 0.78 -0.34 0.00 0.00 178.44 178.97 1d6m h ASN 86 N 0.71 0.04 0.30 1.25 4.21 -1.12 -1.05 115.58 119.93 1d6m h ASN 86 Ca 0.27 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.76 1d6m h ASN 86 Cb 0.11 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 1d6m h ASN 86 CO -0.15 0.36 -0.14 0.58 -1.29 0.00 0.00 177.43 176.79 1d6m h VAL 87 N 0.04 0.72 -0.56 2.81 2.07 -0.78 -1.14 116.25 119.40 1d6m h VAL 87 Ca 0.00 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.49 1d6m h VAL 87 Cb 0.59 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 1d6m h VAL 87 CO 0.04 0.02 0.26 0.40 0.02 0.00 0.00 177.57 178.32 1d6m h ILE 88 N -0.46 0.90 -0.21 4.57 2.04 -1.25 -1.35 117.51 121.76 1d6m h ILE 88 Ca -0.04 -0.17 0.06 0.00 1.00 0.00 0.00 64.86 65.70 1d6m h ILE 88 Cb 0.35 0.36 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1d6m h ILE 88 CO 0.07 0.09 -0.28 0.50 0.00 0.00 0.00 178.15 178.53 1d6m h LYS 89 N 0.50 -0.30 0.20 2.37 3.64 -1.03 0.10 116.57 122.05 1d6m h LYS 89 Ca 0.26 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 1d6m h LYS 89 Cb 0.22 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1d6m h LYS 89 CO -0.21 -0.20 -0.42 -0.09 -2.27 0.00 0.00 179.45 176.27 1d6m h ARG 90 N -0.31 -0.68 0.00 1.90 2.43 -0.56 -2.86 114.38 114.31 1d6m h ARG 90 Ca 0.12 0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1d6m h ARG 90 Cb 0.50 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1d6m h ARG 90 CO -0.38 -0.45 -0.16 0.74 -1.51 0.00 0.00 179.97 178.21 1d6m h PHE 91 N -0.70 0.00 -0.65 2.20 0.04 -1.08 -2.96 116.94 113.78 1d6m h PHE 91 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1d6m h PHE 91 Cb 0.70 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.82 1d6m h PHE 91 CO -0.33 0.16 0.27 1.25 -0.60 0.00 0.00 178.31 179.05 1d6m h LEU 92 N 0.00 0.87 0.00 1.54 5.85 -0.56 -0.71 115.31 122.30 1d6m h LEU 92 Ca -0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1d6m h LEU 92 Cb 0.55 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1d6m h LEU 92 CO 0.02 0.77 -0.91 1.41 -0.34 0.00 0.00 178.44 179.39 1d6m n HIS 93 N -4.31 0.25 0.08 1.25 8.25 -1.17 -3.79 115.22 115.78 1d6m n HIS 93 Ca 0.06 0.07 -0.08 0.00 -0.26 0.00 0.00 57.72 57.51 1d6m n HIS 93 Cb 0.17 -0.42 0.03 0.00 1.12 0.00 0.00 29.99 30.90 1d6m n HIS 93 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1d6m h GLU 94 N 0.00 0.25 -7.26 -0.41 5.08 -1.33 -3.46 114.58 107.45 1d6m h GLU 94 Ca 0.00 -0.23 -0.50 0.00 -1.00 0.00 0.00 59.36 57.63 1d6m h GLU 94 Cb 0.69 0.06 0.06 0.00 0.50 0.00 0.00 28.75 30.06 1d6m h GLU 94 CO 0.00 0.91 0.38 0.00 -1.00 0.00 0.00 179.01 179.30 1d6m s ALA 95 N -3.44 2.83 -0.19 3.43 0.00 -0.30 -3.76 121.76 120.32 1d6m s ALA 95 Ca -0.04 0.19 -0.04 0.00 0.00 0.00 0.00 51.96 52.07 1d6m s ALA 95 Cb 0.11 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 1d6m s ALA 95 CO 0.82 -0.82 -0.21 0.43 0.00 0.00 0.00 175.76 175.98 1d6m n SER 96 N -2.40 2.02 -4.18 0.00 7.64 -0.36 -4.76 113.62 111.58 1d6m n SER 96 Ca 0.08 0.06 -0.30 0.00 1.01 0.00 0.00 58.87 59.71 1d6m n SER 96 Cb 0.53 -0.43 -0.17 0.00 -1.01 0.00 0.00 64.21 63.14 1d6m n SER 96 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1d6m s GLU 97 N -2.37 2.64 -0.03 1.43 -1.05 -1.14 -5.01 118.70 113.17 1d6m s GLU 97 Ca -0.26 -0.78 0.01 0.00 -0.15 0.00 0.00 54.97 53.79 1d6m s GLU 97 Cb 0.08 -2.06 -0.03 0.00 -0.44 0.00 0.00 34.13 31.68 1d6m s GLU 97 CO 0.39 0.18 -0.04 0.42 0.95 0.00 0.00 175.26 177.16 1d6m s ILE 98 N 0.32 3.91 -0.23 1.83 1.01 -1.26 -1.58 121.20 125.20 1d6m s ILE 98 Ca -0.15 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 59.95 1d6m s ILE 98 Cb -0.17 -2.67 0.04 0.00 0.01 0.00 0.00 42.46 39.67 1d6m s ILE 98 CO 0.07 0.48 -0.14 -0.69 0.00 0.00 0.00 174.94 174.66 1d6m s VAL 99 N -0.95 2.20 -0.38 2.92 1.01 0.82 -1.44 120.40 124.57 1d6m s VAL 99 Ca 0.16 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.55 1d6m s VAL 99 Cb -0.11 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1d6m s VAL 99 CO 0.06 0.22 1.35 -2.28 0.00 0.00 0.00 175.10 174.45 1d6m s HIS 100 N 1.20 2.53 -0.41 5.22 2.46 0.47 -2.02 115.29 124.73 1d6m s HIS 100 Ca -0.03 0.74 0.06 0.00 0.47 0.00 0.00 55.06 56.31 1d6m s HIS 100 Cb -0.17 -4.18 0.43 0.00 -0.13 0.00 0.00 32.58 28.53 1d6m s HIS 100 CO -0.08 -1.84 1.11 0.00 -2.47 0.00 0.00 174.74 171.46 1d6m n ALA 101 N 8.32 4.96 -1.93 1.58 0.00 -0.49 -1.21 120.51 131.75 1d6m n ALA 101 Ca 0.16 -4.18 -0.27 0.00 0.00 0.00 0.00 53.44 49.15 1d6m n ALA 101 Cb 0.48 -0.53 0.10 0.00 0.00 0.00 0.00 19.45 19.50 1d6m n ALA 101 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1d6m s GLY 102 N -3.53 1.69 0.95 0.00 0.00 -1.25 -2.49 107.32 102.70 1d6m s GLY 102 Ca 0.47 -0.97 -0.13 0.00 0.00 0.00 0.00 44.72 44.09 1d6m s GLY 102 CO -0.14 -0.46 0.31 1.22 0.00 0.00 0.00 173.10 174.03 1d6m n ASP 103 N -3.20 -2.41 -1.81 1.64 8.00 -1.26 -4.77 116.55 112.74 1d6m n ASP 103 Ca 0.10 0.32 -0.13 0.00 0.71 0.00 0.00 54.79 55.79 1d6m n ASP 103 Cb 0.60 -1.17 0.03 0.00 -0.02 0.00 0.00 41.12 40.56 1d6m n ASP 103 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1d6m n PRO 104 N -1.35 1.64 -0.65 -0.24 -0.04 -1.26 -3.93 135.00 129.16 1d6m n PRO 104 Ca 0.06 -1.25 0.00 0.00 -0.04 0.00 0.00 63.50 62.27 1d6m n PRO 104 Cb 0.54 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1d6m n PRO 104 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1d6m n ASP 105 N 0.57 0.18 0.03 3.54 5.68 -1.26 -3.95 116.55 121.35 1d6m n ASP 105 Ca 0.24 -0.33 -0.11 0.00 -0.50 0.00 0.00 54.79 54.09 1d6m n ASP 105 Cb 0.56 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.46 1d6m n ASP 105 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1d6m h ARG 106 N 0.00 -0.16 -0.59 0.11 -0.00 -1.87 -2.60 114.38 109.27 1d6m h ARG 106 Ca 0.00 0.01 0.10 0.00 -0.50 0.00 0.00 59.98 59.59 1d6m h ARG 106 Cb 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 29.97 29.89 1d6m h ARG 106 CO 0.00 0.32 -0.36 0.93 0.00 0.00 0.00 179.97 180.87 1d6m h GLU 107 N -0.81 -0.17 0.00 0.04 3.07 -1.92 0.34 114.58 115.13 1d6m h GLU 107 Ca -0.02 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 1d6m h GLU 107 Cb 0.55 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.50 1d6m h GLU 107 CO 0.03 -0.11 -0.17 0.78 -1.40 0.00 0.00 179.01 178.14 1d6m h GLY 108 N -0.18 0.00 0.85 -3.84 0.00 -1.76 0.74 103.07 98.88 1d6m h GLY 108 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.49 1d6m h GLY 108 CO -0.68 0.00 -0.11 -1.61 0.00 0.00 0.00 176.54 174.14 1d6m h GLN 109 N 0.00 0.50 -0.20 4.80 5.75 -0.07 -3.22 115.11 122.67 1d6m h GLN 109 Ca -0.00 -0.21 -0.04 0.00 -0.15 0.00 0.00 58.65 58.24 1d6m h GLN 109 Cb 0.64 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 1d6m h GLN 109 CO 0.02 0.76 -0.04 1.25 -2.65 0.00 0.00 178.83 178.17 1d6m h LEU 110 N 0.22 0.37 -0.39 -2.39 5.85 -0.00 -2.64 115.31 116.34 1d6m h LEU 110 Ca 0.06 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.46 1d6m h LEU 110 Cb 0.60 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 1d6m h LEU 110 CO 0.03 0.64 -0.28 0.25 -0.34 0.00 0.00 178.44 178.74 1d6m h LEU 111 N 0.10 -1.01 -0.62 2.25 5.85 -0.89 -0.60 115.31 120.40 1d6m h LEU 111 Ca 0.05 0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.79 1d6m h LEU 111 Cb 0.47 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1d6m h LEU 111 CO 0.02 -0.14 -0.26 0.58 -0.34 0.00 0.00 178.44 178.30 1d6m h VAL 112 N -0.07 1.27 0.35 1.05 2.07 -1.69 -3.30 116.25 115.94 1d6m h VAL 112 Ca 0.06 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 1d6m h VAL 112 Cb 0.23 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1d6m h VAL 112 CO -0.40 0.47 -0.26 0.44 0.02 0.00 0.00 177.57 177.84 1d6m h ASP 113 N 0.70 -0.66 -1.00 0.57 3.32 -0.80 -2.37 116.42 116.18 1d6m h ASP 113 Ca 0.09 0.05 0.13 0.00 0.02 0.00 0.00 57.03 57.32 1d6m h ASP 113 Cb 0.79 0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.46 1d6m h ASP 113 CO 0.07 -0.39 0.63 1.05 -1.72 0.00 0.00 179.24 178.87 1d6m h GLU 114 N -0.61 0.93 -0.18 3.56 4.11 -1.28 0.13 114.58 121.25 1d6m h GLU 114 Ca -0.03 -0.06 0.04 0.00 0.07 0.00 0.00 59.36 59.38 1d6m h GLU 114 Cb 0.52 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 1d6m h GLU 114 CO 0.01 0.61 -0.06 0.28 0.07 0.00 0.00 179.01 179.92 1d6m h VAL 115 N 0.96 0.78 -0.70 -1.06 2.07 -1.60 0.36 116.25 117.06 1d6m h VAL 115 Ca 0.50 0.00 0.02 0.00 0.82 0.00 0.00 66.70 68.05 1d6m h VAL 115 Cb 0.55 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1d6m h VAL 115 CO -0.27 0.00 0.46 -0.07 0.02 0.00 0.00 177.57 177.71 1d6m h LEU 116 N -0.03 0.75 0.02 2.57 3.38 -0.31 0.68 115.31 122.36 1d6m h LEU 116 Ca 0.09 -0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.78 1d6m h LEU 116 Cb 0.17 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 40.76 1d6m h LEU 116 CO -0.20 0.53 -1.06 -0.78 0.09 0.00 0.00 178.44 177.02 1d6m h ASP 117 N 0.88 0.91 0.06 -0.43 3.58 -0.43 -3.14 116.42 117.85 1d6m h ASP 117 Ca 0.27 -0.75 -0.13 0.00 0.42 0.00 0.00 57.03 56.84 1d6m h ASP 117 Cb -0.00 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 1d6m h ASP 117 CO -0.07 1.54 -0.45 0.22 -2.88 0.00 0.00 179.24 177.60 1d6m h TYR 118 N 0.37 0.56 -0.01 0.28 5.03 -0.72 -2.96 116.97 119.51 1d6m h TYR 118 Ca -0.14 -0.17 0.00 0.00 2.58 0.00 0.00 58.73 61.00 1d6m h TYR 118 Cb 1.72 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.88 1d6m h TYR 118 CO 0.11 0.83 0.00 1.28 -1.32 0.00 0.00 178.16 179.06 1d6m n LEU 119 N -4.00 0.12 -3.64 2.82 4.77 0.21 -4.94 117.00 112.34 1d6m n LEU 119 Ca -0.02 -0.05 -0.28 0.00 -0.03 0.00 0.00 56.01 55.63 1d6m n LEU 119 Cb 0.53 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.65 1d6m n LEU 119 CO 0.45 0.02 -0.05 0.00 -1.33 0.00 0.00 177.39 176.48 1d6m n GLN 120 N -0.74 -1.22 -1.97 3.23 6.02 -1.12 -4.92 117.38 116.66 1d6m n GLN 120 Ca 0.16 0.60 -0.42 0.00 -0.01 0.00 0.00 57.00 57.32 1d6m n GLN 120 Cb 0.09 -3.98 -0.03 0.00 1.02 0.00 0.00 30.24 27.34 1d6m n GLN 120 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1d6m s LEU 121 N -6.03 4.36 0.44 1.08 2.96 -1.19 -4.93 118.68 115.37 1d6m s LEU 121 Ca 0.36 2.46 -0.22 0.00 -0.22 0.00 0.00 54.13 56.51 1d6m s LEU 121 Cb -0.13 -3.57 -0.12 0.00 0.50 0.00 0.00 46.19 42.87 1d6m s LEU 121 CO 0.86 -0.85 0.64 0.00 -1.32 0.00 0.00 176.35 175.68 1d6m n ALA 122 N 5.25 -1.11 -0.20 5.97 0.00 -1.26 -4.64 120.51 124.52 1d6m n ALA 122 Ca 0.15 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1d6m n ALA 122 Cb 0.41 -1.85 0.10 0.00 0.00 0.00 0.00 19.45 18.11 1d6m n ALA 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1d6m h PRO 123 N 0.88 0.14 -1.00 0.00 0.11 -1.98 -0.05 132.00 130.11 1d6m h PRO 123 Ca -0.42 -0.01 0.19 0.00 0.11 0.00 0.00 66.00 65.87 1d6m h PRO 123 Cb 1.39 -0.03 -0.11 0.00 0.11 0.00 0.00 31.00 32.36 1d6m h PRO 123 CO 0.52 0.09 0.60 1.49 -0.21 0.00 0.00 178.00 180.50 1d6m h GLU 124 N 0.15 0.73 0.00 1.05 4.81 -2.02 -0.86 114.58 118.44 1d6m h GLU 124 Ca 0.31 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1d6m h GLU 124 Cb 0.49 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1d6m h GLU 124 CO -0.48 0.48 -0.48 0.87 -0.73 0.00 0.00 179.01 178.67 1d6m h LYS 125 N 0.76 0.00 0.00 1.92 1.57 -1.39 -3.38 116.57 116.05 1d6m h LYS 125 Ca 0.58 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 1d6m h LYS 125 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1d6m h LYS 125 CO -0.39 0.00 -0.16 -0.09 -0.57 0.00 0.00 179.45 178.24 1d6m h ARG 126 N 0.00 0.00 -0.01 3.15 2.43 -0.03 -3.12 114.38 116.79 1d6m h ARG 126 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1d6m h ARG 126 Cb 0.88 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1d6m h ARG 126 CO 0.00 0.00 -0.33 1.04 -1.51 0.00 0.00 179.97 179.17 1d6m n GLN 127 N -2.34 1.62 -0.05 0.20 1.13 -1.15 -4.07 117.38 112.72 1d6m n GLN 127 Ca 0.05 -0.87 0.09 0.00 -1.94 0.00 0.00 57.00 54.34 1d6m n GLN 127 Cb 0.45 -1.30 0.11 0.00 0.11 0.00 0.00 30.24 29.61 1d6m n GLN 127 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1d6m n GLN 128 N -0.06 1.80 -2.52 -1.09 1.13 -1.21 -4.91 117.38 110.53 1d6m n GLN 128 Ca 0.07 -1.75 -0.41 0.00 -1.94 0.00 0.00 57.00 52.97 1d6m n GLN 128 Cb 0.36 -1.38 -0.04 0.00 0.11 0.00 0.00 30.24 29.29 1d6m n GLN 128 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1d6m s VAL 129 N -1.48 3.71 0.28 5.09 0.11 -1.18 -4.55 120.40 122.38 1d6m s VAL 129 Ca 0.25 1.60 0.11 0.00 -2.93 0.00 0.00 61.98 61.01 1d6m s VAL 129 Cb 0.16 -4.02 -0.05 0.00 -1.53 0.00 0.00 36.38 30.95 1d6m s VAL 129 CO 0.24 0.33 -0.09 -1.10 -3.33 0.00 0.00 175.10 171.15 1d6m s GLN 130 N -0.93 1.99 -0.13 1.54 1.11 -0.52 -2.39 119.66 120.32 1d6m s GLN 130 Ca 0.46 -1.62 -0.03 0.00 0.01 0.00 0.00 55.36 54.18 1d6m s GLN 130 Cb -0.30 -1.95 -0.03 0.00 -1.01 0.00 0.00 33.01 29.71 1d6m s GLN 130 CO 0.37 0.32 -0.02 0.50 0.01 0.00 0.00 175.29 176.48 1d6m s ARG 131 N -3.60 3.40 -0.20 2.91 6.06 0.33 0.18 118.95 128.02 1d6m s ARG 131 Ca 0.31 -0.47 0.01 0.00 -2.50 0.00 0.00 55.73 53.09 1d6m s ARG 131 Cb -0.05 -2.88 0.04 0.00 0.06 0.00 0.00 34.95 32.12 1d6m s ARG 131 CO 0.18 0.43 -0.13 0.00 -2.50 0.00 0.00 175.30 173.28 1d6m s LEU 133 N 1.32 5.00 -0.20 0.00 1.43 -1.26 -4.45 118.68 120.52 1d6m s LEU 133 Ca -0.01 -1.33 -0.11 0.00 -1.03 0.00 0.00 54.13 51.65 1d6m s LEU 133 Cb -0.16 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1d6m s LEU 133 CO -0.09 -0.49 0.16 -0.63 0.23 0.00 0.00 176.35 175.54 1d6m s ILE 134 N 1.47 5.38 -0.01 -0.59 1.01 -1.26 -4.81 121.20 122.39 1d6m s ILE 134 Ca 0.02 0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.93 1d6m s ILE 134 Cb -0.22 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.73 1d6m s ILE 134 CO 0.04 0.41 0.03 0.59 0.00 0.00 0.00 174.94 176.01 1d6m n ASN 135 N 3.69 3.83 -4.11 3.58 3.02 -1.26 -4.62 115.26 119.39 1d6m n ASN 135 Ca -0.15 -0.10 -0.25 0.00 -0.03 0.00 0.00 54.58 54.05 1d6m n ASN 135 Cb 0.52 1.04 -0.16 0.00 -0.61 0.00 0.00 39.78 40.57 1d6m n ASN 135 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1d6m s ASP 136 N -1.93 1.93 0.00 6.41 -1.08 -1.26 -1.07 116.67 119.67 1d6m s ASP 136 Ca -0.00 -0.31 0.25 0.00 -0.52 0.00 0.00 52.55 51.97 1d6m s ASP 136 Cb 0.01 -0.51 0.43 0.00 -1.46 0.00 0.00 42.92 41.39 1d6m s ASP 136 CO 0.05 0.14 1.40 0.18 0.52 0.00 0.00 175.17 177.45 1d6m n LEU 137 N 3.14 2.61 -4.76 -1.34 4.77 -1.26 -4.13 117.00 116.03 1d6m n LEU 137 Ca -0.18 -0.89 -0.39 0.00 -0.03 0.00 0.00 56.01 54.53 1d6m n LEU 137 Cb 0.53 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1d6m n LEU 137 CO 0.25 0.44 0.98 0.20 -1.33 0.00 0.00 177.39 177.93 1d6m s ASN 138 N -1.97 5.98 0.26 -1.43 0.01 -1.26 -4.82 114.94 111.70 1d6m s ASN 138 Ca 0.31 2.71 -0.02 0.00 -0.71 0.00 0.00 52.86 55.15 1d6m s ASN 138 Cb 0.20 -2.64 0.56 0.00 0.41 0.00 0.00 41.25 39.79 1d6m s ASN 138 CO 0.31 -1.08 1.70 -0.65 -1.51 0.00 0.00 177.10 175.87 1d6m h PRO 139 N 2.28 0.35 -0.18 -0.60 0.11 -1.95 -1.92 132.00 130.08 1d6m h PRO 139 Ca -0.50 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.63 1d6m h PRO 139 Cb 1.26 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1d6m h PRO 139 CO 0.61 0.23 -0.05 1.96 -0.21 0.00 0.00 178.00 180.54 1d6m h GLN 140 N 0.36 -0.01 -0.85 1.05 7.50 -1.96 0.68 115.11 121.88 1d6m h GLN 140 Ca 0.47 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.59 1d6m h GLN 140 Cb 0.82 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 28.31 1d6m h GLN 140 CO -0.50 -0.01 0.40 0.00 -1.50 0.00 0.00 178.83 177.23 1d6m h ALA 141 N 1.17 1.10 -0.48 3.87 0.00 -1.70 -0.08 119.26 123.15 1d6m h ALA 141 Ca 0.09 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1d6m h ALA 141 Cb 0.15 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1d6m h ALA 141 CO -0.20 0.67 -0.03 0.28 0.00 0.00 0.00 179.25 179.97 1d6m h VAL 142 N 1.21 1.27 0.10 0.00 2.07 -1.00 0.25 116.25 120.16 1d6m h VAL 142 Ca 0.29 -1.12 0.02 0.00 0.82 0.00 0.00 66.70 66.70 1d6m h VAL 142 Cb 0.13 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1d6m h VAL 142 CO -0.04 0.39 -0.21 -0.33 0.02 0.00 0.00 177.57 177.41 1d6m h GLU 143 N 0.73 -0.38 0.10 1.57 5.08 -0.40 -0.30 114.58 120.98 1d6m h GLU 143 Ca 0.13 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1d6m h GLU 143 Cb 0.56 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 1d6m h GLU 143 CO 0.03 -0.25 -0.33 -0.09 -1.00 0.00 0.00 179.01 177.37 1d6m h ARG 144 N -0.39 -0.52 -0.77 2.33 2.43 -0.83 -2.51 114.38 114.12 1d6m h ARG 144 Ca 0.03 0.04 0.16 0.00 -0.81 0.00 0.00 59.98 59.40 1d6m h ARG 144 Cb 0.42 0.12 -0.14 0.00 -0.42 0.00 0.00 29.97 29.94 1d6m h ARG 144 CO -0.12 -0.35 -0.11 0.00 -1.51 0.00 0.00 179.97 177.87 1d6m h ALA 145 N 0.10 0.63 -0.03 2.80 0.00 -0.04 0.11 119.26 122.82 1d6m h ALA 145 Ca 0.03 0.28 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1d6m h ALA 145 Cb 0.58 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1d6m h ALA 145 CO -0.20 -0.42 -0.14 0.82 0.00 0.00 0.00 179.25 179.31 1d6m h ILE 146 N 0.03 1.12 0.00 0.00 2.04 -0.65 -3.00 117.51 117.05 1d6m h ILE 146 Ca 0.39 -0.54 -0.12 0.00 1.00 0.00 0.00 64.86 65.59 1d6m h ILE 146 Cb 0.64 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 1d6m h ILE 146 CO -0.75 0.16 -0.57 0.44 0.00 0.00 0.00 178.15 177.43 1d6m h ASP 147 N 0.04 0.00 -3.29 1.72 5.19 -0.41 -3.36 116.42 116.32 1d6m h ASP 147 Ca 0.01 0.00 -0.71 0.00 -0.62 0.00 0.00 57.03 55.71 1d6m h ASP 147 Cb 0.27 0.00 -0.35 0.00 0.18 0.00 0.00 39.33 39.43 1d6m h ASP 147 CO 0.02 0.57 -0.05 -2.11 -3.12 0.00 0.00 179.24 174.55 1d6m n ARG 148 N -3.83 2.73 -3.14 3.56 0.00 -1.13 -5.04 116.66 109.81 1d6m n ARG 148 Ca -0.01 -4.48 -0.40 0.00 -0.00 0.00 0.00 57.85 52.95 1d6m n ARG 148 Cb 0.58 -2.42 -0.06 0.00 -0.00 0.00 0.00 32.46 30.56 1d6m n ARG 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1d6m s LEU 149 N -1.44 4.14 0.47 2.89 1.43 -1.26 -4.79 118.68 120.13 1d6m s LEU 149 Ca 0.28 0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 54.15 1d6m s LEU 149 Cb -0.06 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 1d6m s LEU 149 CO -0.12 -0.26 0.75 -0.13 0.23 0.00 0.00 176.35 176.82 1d6m s ARG 150 N 1.87 3.44 0.42 1.70 1.81 -0.21 -4.80 118.95 123.19 1d6m s ARG 150 Ca 0.28 0.04 -0.24 0.00 -1.72 0.00 0.00 55.73 54.09 1d6m s ARG 150 Cb -0.16 -2.43 -0.08 0.00 -0.45 0.00 0.00 34.95 31.83 1d6m s ARG 150 CO 0.10 -0.19 1.14 -1.12 -0.68 0.00 0.00 175.30 174.54 1d6m s SER 151 N -4.12 6.44 0.14 0.23 0.01 -1.26 0.12 113.70 115.26 1d6m s SER 151 Ca 0.47 2.25 -0.12 0.00 1.31 0.00 0.00 55.95 59.86 1d6m s SER 151 Cb -0.10 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.52 1d6m s SER 151 CO 0.43 -0.73 1.55 -1.13 0.41 0.00 0.00 173.24 173.77 1d6m h ASN 152 N 2.36 0.91 -0.89 2.44 -1.24 -1.74 -3.23 115.58 114.19 1d6m h ASN 152 Ca -0.49 -0.37 0.36 0.00 0.71 0.00 0.00 56.30 56.51 1d6m h ASN 152 Cb 1.23 -0.25 -0.16 0.00 0.73 0.00 0.00 38.32 39.87 1d6m h ASN 152 CO 0.61 1.08 0.43 -1.54 -1.29 0.00 0.00 177.43 176.72 1d6m n SER 153 N -4.23 0.27 0.23 1.15 3.41 -1.26 -0.08 113.62 113.11 1d6m n SER 153 Ca -0.00 1.48 0.14 0.00 -0.26 0.00 0.00 58.87 60.23 1d6m n SER 153 Cb 0.40 -0.70 0.76 0.00 -0.26 0.00 0.00 64.21 64.42 1d6m n SER 153 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1d6m h GLU 154 N 0.00 0.00 -0.47 4.33 5.08 -1.97 -3.04 114.58 118.51 1d6m h GLU 154 Ca 0.73 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.09 1d6m h GLU 154 Cb 1.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.15 1d6m h GLU 154 CO -0.70 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.50 1d6m n PHE 155 N -2.51 0.62 -0.28 4.33 3.01 0.89 -4.75 117.46 118.77 1d6m n PHE 155 Ca -0.02 -0.38 -0.10 0.00 1.01 0.00 0.00 57.45 57.96 1d6m n PHE 155 Cb 0.10 -0.01 -0.08 0.00 -0.01 0.00 0.00 39.48 39.48 1d6m n PHE 155 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1d6m h VAL 156 N 3.62 0.00 -0.97 -4.37 2.07 -1.69 -1.03 116.25 113.88 1d6m h VAL 156 Ca 0.00 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.82 1d6m h VAL 156 Cb 0.88 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.50 1d6m h VAL 156 CO 0.00 0.00 0.43 -0.65 0.02 0.00 0.00 177.57 177.37 1d6m h PRO 157 N -0.10 0.23 0.06 1.57 0.11 -1.87 0.51 132.00 132.51 1d6m h PRO 157 Ca 0.11 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.23 1d6m h PRO 157 Cb 0.39 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.41 1d6m h PRO 157 CO -0.70 0.15 -0.27 -0.07 -0.21 0.00 0.00 178.00 176.91 1d6m h LEU 158 N 0.24 -0.77 0.22 2.35 3.38 -1.44 0.27 115.31 119.56 1d6m h LEU 158 Ca 0.68 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.75 1d6m h LEU 158 Cb 1.54 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 42.58 1d6m h LEU 158 CO -0.66 -0.35 -0.29 0.00 0.09 0.00 0.00 178.44 177.24 1d6m h VAL 160 N -0.53 0.55 -0.35 0.00 2.07 -1.07 0.19 116.25 117.11 1d6m h VAL 160 Ca -0.03 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1d6m h VAL 160 Cb 0.47 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 1d6m h VAL 160 CO -0.07 0.07 0.09 -1.28 0.02 0.00 0.00 177.57 176.40 1d6m h SER 161 N 0.39 0.05 -0.36 0.57 0.87 -0.25 -0.35 113.55 114.46 1d6m h SER 161 Ca 0.47 0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 61.02 1d6m h SER 161 Cb 0.82 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 1d6m h SER 161 CO -0.48 0.06 -0.02 0.00 -0.53 0.00 0.00 176.83 175.86 1d6m h ALA 162 N 1.25 0.49 -0.73 6.23 0.00 0.00 -2.53 119.26 123.97 1d6m h ALA 162 Ca 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1d6m h ALA 162 Cb 0.18 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1d6m h ALA 162 CO -0.20 0.28 0.42 1.25 0.00 0.00 0.00 179.25 180.99 1d6m h LEU 163 N 0.46 0.91 -0.68 0.00 5.85 -0.46 -1.06 115.31 120.32 1d6m h LEU 163 Ca 0.10 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1d6m h LEU 163 Cb 0.49 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 1d6m h LEU 163 CO 0.02 0.73 0.38 0.00 -0.34 0.00 0.00 178.44 179.23 1d6m h ALA 164 N 1.21 0.92 -0.06 1.25 0.00 -1.03 -0.12 119.26 121.43 1d6m h ALA 164 Ca 0.26 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1d6m h ALA 164 Cb 0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1d6m h ALA 164 CO -0.04 0.06 0.03 -0.09 0.00 0.00 0.00 179.25 179.21 1d6m h ARG 165 N 0.70 0.08 0.11 0.00 2.43 -0.89 0.17 114.38 116.99 1d6m h ARG 165 Ca 0.30 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1d6m h ARG 165 Cb 0.19 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1d6m h ARG 165 CO -0.18 0.13 -0.05 0.00 -1.51 0.00 0.00 179.97 178.36 1d6m h ALA 166 N 0.94 -0.15 -0.73 2.80 0.00 -0.89 0.93 119.26 122.16 1d6m h ALA 166 Ca 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1d6m h ALA 166 Cb 0.08 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1d6m h ALA 166 CO -0.00 -0.57 0.42 0.00 0.00 0.00 0.00 179.25 179.10 1d6m h ARG 167 N -0.18 1.01 -0.34 0.00 3.08 -0.97 -1.45 114.38 115.53 1d6m h ARG 167 Ca -0.02 -0.10 0.06 0.00 0.07 0.00 0.00 59.98 59.99 1d6m h ARG 167 Cb 0.14 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 29.92 1d6m h ARG 167 CO 0.03 0.73 -0.04 0.00 -1.07 0.00 0.00 179.97 179.62 1d6m h ALA 168 N 1.22 0.26 -0.27 0.04 0.00 -0.35 -0.85 119.26 119.32 1d6m h ALA 168 Ca 0.26 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.34 1d6m h ALA 168 Cb 0.00 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1d6m h ALA 168 CO -0.05 -0.43 -0.08 -0.44 0.00 0.00 0.00 179.25 178.26 1d6m h ASP 169 N 0.05 -0.27 0.46 0.00 5.19 -0.11 -0.01 116.42 121.72 1d6m h ASP 169 Ca 0.16 0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.64 1d6m h ASP 169 Cb 0.24 0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.92 1d6m h ASP 169 CO -0.31 -0.10 -0.28 -0.25 -3.12 0.00 0.00 179.24 175.18 1d6m h TRP 170 N -0.01 -0.73 -0.34 4.55 7.01 -0.67 0.66 115.95 126.42 1d6m h TRP 170 Ca 0.13 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.20 1d6m h TRP 170 Cb 0.21 0.26 -0.08 0.00 -2.10 0.00 0.00 29.16 27.45 1d6m h TRP 170 CO -0.27 -0.43 -0.22 -0.07 -2.79 0.00 0.00 178.44 174.66 1d6m h LEU 171 N -0.70 -0.73 0.36 0.65 3.38 -0.98 0.53 115.31 117.82 1d6m h LEU 171 Ca -0.05 0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1d6m h LEU 171 Cb 0.57 0.37 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1d6m h LEU 171 CO 0.06 -0.25 -0.17 0.22 0.09 0.00 0.00 178.44 178.38 1d6m h TYR 172 N -0.17 -0.45 0.18 1.13 5.03 -0.89 -3.14 116.97 118.66 1d6m h TYR 172 Ca 0.17 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.49 1d6m h TYR 172 Cb 0.44 0.15 -0.03 0.00 1.55 0.00 0.00 36.73 38.84 1d6m h TYR 172 CO -0.43 -0.19 -0.32 0.78 -1.32 0.00 0.00 178.16 176.68 1d6m h GLY 173 N -0.64 -0.66 0.34 1.82 0.00 -0.26 -0.35 103.07 103.31 1d6m h GLY 173 Ca -0.05 0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.64 1d6m h GLY 173 CO 0.08 -0.26 -0.16 -2.22 0.00 0.00 0.00 176.54 173.98 1d6m h ILE 174 N -0.59 0.00 -0.65 2.60 1.08 -1.04 -2.48 117.51 116.43 1d6m h ILE 174 Ca 0.02 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.62 1d6m h ILE 174 Cb 0.59 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.24 1d6m h ILE 174 CO -0.15 0.00 0.13 0.78 -0.69 0.00 0.00 178.15 178.22 1d6m h ASN 175 N -0.46 -0.04 1.08 1.72 2.35 -1.62 -1.91 115.58 116.70 1d6m h ASN 175 Ca -0.05 0.13 -0.16 0.00 -0.55 0.00 0.00 56.30 55.67 1d6m h ASN 175 Cb 0.35 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 1d6m h ASN 175 CO 0.07 -0.03 -0.76 0.24 -1.65 0.00 0.00 177.43 175.31 1d6m h MET 176 N 0.24 0.00 -0.08 0.81 2.86 -1.14 -1.43 114.93 116.20 1d6m h MET 176 Ca 0.35 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.80 1d6m h MET 176 Cb 0.56 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.22 1d6m h MET 176 CO -0.46 0.76 -0.76 1.79 1.06 0.00 0.00 176.91 179.30 1d6m h THR 177 N 0.00 1.37 0.81 2.22 1.35 -0.99 -0.37 112.91 117.30 1d6m h THR 177 Ca -0.01 -2.15 -0.04 0.00 -0.55 0.00 0.00 66.41 63.66 1d6m h THR 177 Cb 1.50 2.13 0.01 0.00 -1.73 0.00 0.00 68.15 70.06 1d6m h THR 177 CO 0.10 0.65 -0.39 0.03 -0.25 0.00 0.00 175.52 175.66 1d6m h ARG 178 N 0.31 -1.04 -0.99 4.72 3.08 -1.39 -1.19 114.38 117.87 1d6m h ARG 178 Ca -0.04 0.07 0.10 0.00 0.07 0.00 0.00 59.98 60.18 1d6m h ARG 178 Cb 1.35 0.24 -0.13 0.00 0.08 0.00 0.00 29.97 31.51 1d6m h ARG 178 CO 0.13 -0.70 -0.55 0.00 -1.07 0.00 0.00 179.97 177.79 1d6m n ALA 179 N -2.66 -0.55 0.25 0.04 0.00 -0.54 -0.49 120.51 116.56 1d6m n ALA 179 Ca -0.13 0.86 0.14 0.00 0.00 0.00 0.00 53.44 54.31 1d6m n ALA 179 Cb 0.43 -0.19 0.56 0.00 0.00 0.00 0.00 19.45 20.25 1d6m n ALA 179 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1d6m h TYR 180 N 0.00 0.00 0.01 0.00 0.05 -1.10 -1.99 116.97 113.94 1d6m h TYR 180 Ca 0.19 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.97 1d6m h TYR 180 Cb 0.44 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.18 1d6m h TYR 180 CO -1.00 0.09 -0.00 1.15 -1.05 0.00 0.00 178.16 177.35 1d6m h THR 181 N 0.00 0.97 -0.06 -2.88 2.02 0.45 -0.88 112.91 112.53 1d6m h THR 181 Ca -0.00 -1.70 0.02 0.00 0.77 0.00 0.00 66.41 65.50 1d6m h THR 181 Cb 0.64 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.83 1d6m h THR 181 CO 0.01 0.32 -0.37 0.40 0.37 0.00 0.00 175.52 176.25 1d6m h ILE 182 N -0.99 0.00 -0.87 3.11 2.04 -0.79 -2.43 117.51 117.57 1d6m h ILE 182 Ca -0.00 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.90 1d6m h ILE 182 Cb 0.54 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.57 1d6m h ILE 182 CO 0.00 0.00 0.55 -0.07 0.00 0.00 0.00 178.15 178.63 1d6m h LEU 183 N -0.43 0.90 0.00 1.44 3.38 -1.51 -3.52 115.31 115.58 1d6m h LEU 183 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1d6m h LEU 183 Cb 0.48 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1d6m h LEU 183 CO -0.28 0.60 0.00 0.61 0.09 0.00 0.00 178.44 179.46 1d6m n GLY 184 N -1.33 0.49 3.21 0.83 0.00 -0.33 -5.08 105.19 102.98 1d6m n GLY 184 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1d6m n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d6m n GLY 191 N 2.49 0.03 3.33 -0.02 0.00 -1.26 -5.05 105.19 104.71 1d6m n GLY 191 Ca 0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1d6m n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d6m s VAL 192 N 0.00 2.88 -0.55 1.61 1.01 -1.26 -4.97 120.40 119.12 1d6m s VAL 192 Ca 0.00 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1d6m s VAL 192 Cb 0.00 -2.20 0.07 0.00 0.00 0.00 0.00 36.38 34.25 1d6m s VAL 192 CO 0.00 0.52 0.72 -0.22 0.00 0.00 0.00 175.10 176.12 1d6m s LEU 193 N 0.47 4.92 -0.28 3.92 2.96 -1.26 -5.04 118.68 124.38 1d6m s LEU 193 Ca -0.10 -1.00 -0.11 0.00 -0.22 0.00 0.00 54.13 52.69 1d6m s LEU 193 Cb -0.16 -2.45 -0.05 0.00 0.50 0.00 0.00 46.19 44.03 1d6m s LEU 193 CO 0.05 -1.05 0.20 -0.55 -1.32 0.00 0.00 176.35 173.67 1d6m s SER 194 N 3.08 6.04 0.15 3.68 0.15 -1.26 -4.58 113.70 120.96 1d6m s SER 194 Ca 0.17 0.02 0.08 0.00 0.70 0.00 0.00 55.95 56.91 1d6m s SER 194 Cb -0.20 -2.12 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 1d6m s SER 194 CO 0.11 -0.05 -0.08 0.68 1.20 0.00 0.00 173.24 175.10 1d6m s VAL 195 N 1.73 3.36 0.04 4.45 -7.23 -1.26 -5.03 120.40 116.46 1d6m s VAL 195 Ca 0.08 -1.46 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 1d6m s VAL 195 Cb -0.16 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.13 1d6m s VAL 195 CO 0.10 -0.02 -0.10 -0.83 -0.31 0.00 0.00 175.10 173.95 1d6m s GLY 196 N -2.60 0.57 0.17 2.32 0.00 -1.26 -4.68 107.32 101.84 1d6m s GLY 196 Ca 0.24 -0.72 -0.18 0.00 0.00 0.00 0.00 44.72 44.06 1d6m s GLY 196 CO 0.15 -0.74 1.66 -0.09 0.00 0.00 0.00 173.10 174.08 1d6m h ARG 197 N 4.80 -0.04 0.00 2.90 2.43 -1.92 -2.25 114.38 120.30 1d6m h ARG 197 Ca -0.36 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.45 1d6m h ARG 197 Cb 1.19 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.69 1d6m h ARG 197 CO 0.43 -0.03 -2.34 0.28 -1.51 0.00 0.00 179.97 176.80 1d6m n VAL 198 N -5.33 1.42 0.15 0.20 0.31 -1.26 -4.47 118.33 109.36 1d6m n VAL 198 Ca 0.02 -0.82 0.03 0.00 -0.01 0.00 0.00 64.34 63.57 1d6m n VAL 198 Cb 0.24 -0.64 0.14 0.00 -0.91 0.00 0.00 33.84 32.67 1d6m n VAL 198 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 1d6m h GLN 199 N 0.00 0.00 0.43 5.55 3.07 -1.96 -1.84 115.11 120.36 1d6m h GLN 199 Ca -0.53 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.19 1d6m h GLN 199 Cb 2.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.75 1d6m h GLN 199 CO 0.02 0.49 -0.20 1.15 0.09 0.00 0.00 178.83 180.38 1d6m h THR 200 N 0.00 0.49 -0.64 1.86 2.02 -1.62 -0.49 112.91 114.52 1d6m h THR 200 Ca -0.00 -0.48 0.02 0.00 0.77 0.00 0.00 66.41 66.72 1d6m h THR 200 Cb 1.22 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 68.28 1d6m h THR 200 CO 0.06 0.07 0.43 1.55 0.37 0.00 0.00 175.52 178.01 1d6m h PRO 201 N -0.89 0.78 -0.22 6.66 0.13 -1.71 0.15 132.00 136.90 1d6m h PRO 201 Ca -0.06 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1d6m h PRO 201 Cb 0.56 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.51 1d6m h PRO 201 CO 0.10 0.51 0.15 0.28 -0.23 0.00 0.00 178.00 178.81 1d6m h VAL 202 N 0.80 1.06 -0.71 1.56 2.07 -1.27 -1.85 116.25 117.92 1d6m h VAL 202 Ca 0.25 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.67 1d6m h VAL 202 Cb 0.02 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 1d6m h VAL 202 CO -0.07 0.06 0.46 0.25 0.02 0.00 0.00 177.57 178.29 1d6m h LEU 203 N 0.30 0.78 -0.42 2.57 5.85 0.60 -2.66 115.31 122.33 1d6m h LEU 203 Ca 0.08 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1d6m h LEU 203 Cb -0.03 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 40.73 1d6m h LEU 203 CO -0.02 0.56 -0.48 1.23 -0.34 0.00 0.00 178.44 179.39 1d6m h GLY 204 N 0.93 -0.72 -0.90 3.75 0.00 -0.31 -2.12 103.07 103.69 1d6m h GLY 204 Ca 0.27 0.61 0.13 0.00 0.00 0.00 0.00 47.33 48.34 1d6m h GLY 204 CO -0.08 -0.16 -0.38 1.04 0.00 0.00 0.00 176.54 176.97 1d6m n LEU 205 N -5.40 -0.64 0.09 3.11 4.77 -0.74 0.25 117.00 118.44 1d6m n LEU 205 Ca -0.02 1.58 0.00 0.00 -0.03 0.00 0.00 56.01 57.54 1d6m n LEU 205 Cb 0.35 -0.34 0.31 0.00 -2.33 0.00 0.00 43.42 41.41 1d6m n LEU 205 CO 0.02 -1.40 0.80 0.58 -1.33 0.00 0.00 177.39 176.07 1d6m h VAL 206 N 0.00 1.23 -0.02 4.08 2.07 -1.46 -2.78 116.25 119.37 1d6m h VAL 206 Ca 0.29 -1.07 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 1d6m h VAL 206 Cb 0.51 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1d6m h VAL 206 CO -0.89 0.33 -0.20 0.58 0.02 0.00 0.00 177.57 177.41 1d6m h VAL 207 N 0.26 1.51 -0.80 2.57 2.07 0.44 -2.58 116.25 119.72 1d6m h VAL 207 Ca 0.04 -1.80 0.06 0.00 0.82 0.00 0.00 66.70 65.83 1d6m h VAL 207 Cb 0.54 2.62 -0.05 0.00 -1.52 0.00 0.00 31.29 32.88 1d6m h VAL 207 CO 0.04 0.49 0.52 0.03 0.02 0.00 0.00 177.57 178.67 1d6m h ARG 208 N -0.46 0.86 -0.33 1.57 3.08 -1.29 -0.42 114.38 117.39 1d6m h ARG 208 Ca -0.02 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 1d6m h ARG 208 Cb 0.91 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1d6m h ARG 208 CO 0.04 0.57 0.14 -0.09 -1.07 0.00 0.00 179.97 179.57 1d6m h ARG 209 N 0.89 0.48 -0.66 0.04 9.65 -1.54 0.79 114.38 124.03 1d6m h ARG 209 Ca 0.34 -0.08 -0.06 0.00 -1.10 0.00 0.00 59.98 59.08 1d6m h ARG 209 Cb 0.21 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 1d6m h ARG 209 CO -0.12 0.47 0.19 -0.44 2.80 0.00 0.00 179.97 182.87 1d6m h ASP 210 N 0.39 0.98 -0.59 -3.80 5.19 -0.84 -0.92 116.42 116.84 1d6m h ASP 210 Ca 0.11 -0.22 -0.09 0.00 -0.62 0.00 0.00 57.03 56.21 1d6m h ASP 210 Cb 0.15 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.39 1d6m h ASP 210 CO -0.01 0.94 0.00 -0.33 -3.12 0.00 0.00 179.24 176.72 1d6m h GLU 211 N 0.97 1.03 0.09 3.56 5.08 -1.10 -1.95 114.58 122.27 1d6m h GLU 211 Ca 0.21 -0.33 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1d6m h GLU 211 Cb 0.32 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1d6m h GLU 211 CO -0.00 1.02 -0.22 0.93 -1.00 0.00 0.00 179.01 179.74 1d6m h GLU 212 N 0.93 -0.38 -0.98 2.33 5.08 -0.37 -1.78 114.58 119.41 1d6m h GLU 212 Ca 0.17 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.61 1d6m h GLU 212 Cb 0.55 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 1d6m h GLU 212 CO 0.03 -0.25 0.63 0.82 -1.00 0.00 0.00 179.01 179.24 1d6m h ILE 213 N -0.39 1.09 -0.39 3.13 2.04 -1.12 -2.56 117.51 119.31 1d6m h ILE 213 Ca 0.03 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.40 1d6m h ILE 213 Cb 0.43 -0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.32 1d6m h ILE 213 CO -0.14 0.21 -0.15 -0.08 0.00 0.00 0.00 178.15 178.00 1d6m h GLU 214 N 1.16 0.71 -0.23 2.37 4.81 -0.83 -3.13 114.58 119.45 1d6m h GLU 214 Ca 0.42 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1d6m h GLU 214 Cb 0.15 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1d6m h GLU 214 CO -0.17 0.83 0.00 0.09 -0.73 0.00 0.00 179.01 179.03 1d6m n ASN 215 N -4.15 1.48 -4.65 1.04 3.02 -0.72 -4.90 115.26 106.38 1d6m n ASN 215 Ca 0.01 -1.85 -0.42 0.00 -0.03 0.00 0.00 54.58 52.29 1d6m n ASN 215 Cb 0.38 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 1d6m n ASN 215 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1d6m s PHE 216 N -1.70 3.32 -0.46 3.10 5.36 -1.10 -5.03 117.98 121.47 1d6m s PHE 216 Ca 0.25 1.31 -0.15 0.00 -0.96 0.00 0.00 56.93 57.38 1d6m s PHE 216 Cb 0.13 -3.19 0.06 0.00 -0.34 0.00 0.00 43.02 39.68 1d6m s PHE 216 CO 0.19 -0.46 0.37 0.08 -1.46 0.00 0.00 175.22 173.94 1d6m s VAL 217 N 3.06 5.24 -0.13 3.12 1.01 -1.26 -5.01 120.40 126.43 1d6m s VAL 217 Ca 0.40 -0.96 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 1d6m s VAL 217 Cb -0.15 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1d6m s VAL 217 CO 0.07 -0.51 1.53 0.00 0.00 0.00 0.00 175.10 176.19 1d6m s ALA 218 N 1.65 3.54 0.27 5.51 0.00 -1.26 -4.99 121.76 126.48 1d6m s ALA 218 Ca 0.04 0.67 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 1d6m s ALA 218 Cb -0.23 -3.74 -0.05 0.00 0.00 0.00 0.00 23.12 19.10 1d6m s ALA 218 CO 0.07 -1.49 0.53 0.15 0.00 0.00 0.00 175.76 175.03 1d6m s LYS 219 N 4.06 3.63 -0.08 0.00 1.02 -1.26 -4.87 119.74 122.24 1d6m s LYS 219 Ca 0.67 -0.01 -0.14 0.00 0.02 0.00 0.00 55.97 56.52 1d6m s LYS 219 Cb -0.28 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.31 1d6m s LYS 219 CO 0.25 0.25 0.34 -0.51 -0.92 0.00 0.00 175.35 174.76 1d6m s ASP 220 N -3.08 6.61 0.02 2.83 1.11 -1.26 -0.81 116.67 122.10 1d6m s ASP 220 Ca 0.44 0.73 0.02 0.00 0.18 0.00 0.00 52.55 53.92 1d6m s ASP 220 Cb -0.11 -2.21 -0.02 0.00 1.07 0.00 0.00 42.92 41.66 1d6m s ASP 220 CO 0.29 0.23 -0.08 0.72 1.18 0.00 0.00 175.17 177.51 1d6m s PHE 221 N -0.39 0.68 0.13 4.23 -0.71 0.64 -4.56 117.98 117.99 1d6m s PHE 221 Ca 0.20 -0.31 0.08 0.00 -1.04 0.00 0.00 56.93 55.87 1d6m s PHE 221 Cb -0.15 -0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 41.21 1d6m s PHE 221 CO 0.09 -0.03 -0.14 -0.06 -1.34 0.00 0.00 175.22 173.73 1d6m s PHE 222 N -0.78 2.62 0.09 3.49 0.08 0.57 -1.07 117.98 122.98 1d6m s PHE 222 Ca -0.03 -0.22 0.05 0.00 0.12 0.00 0.00 56.93 56.84 1d6m s PHE 222 Cb -0.06 -1.36 -0.03 0.00 -0.57 0.00 0.00 43.02 41.00 1d6m s PHE 222 CO 0.00 0.43 -0.12 -1.21 -0.10 0.00 0.00 175.22 174.22 1d6m s GLU 223 N -2.32 0.86 -0.28 0.44 2.02 -0.53 -4.18 118.70 114.72 1d6m s GLU 223 Ca 0.21 -1.09 -0.02 0.00 0.02 0.00 0.00 54.97 54.09 1d6m s GLU 223 Cb -0.10 -0.71 0.04 0.00 0.10 0.00 0.00 34.13 33.45 1d6m s GLU 223 CO 0.12 0.14 -0.03 0.08 0.02 0.00 0.00 175.26 175.59 1d6m s VAL 224 N -1.91 2.97 -0.22 2.63 1.01 -1.26 -0.25 120.40 123.37 1d6m s VAL 224 Ca 0.03 -1.20 -0.06 0.00 0.00 0.00 0.00 61.98 60.75 1d6m s VAL 224 Cb -0.06 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 1d6m s VAL 224 CO 0.02 0.04 0.04 -1.59 0.00 0.00 0.00 175.10 173.60 1d6m s LYS 225 N 1.29 3.69 -0.19 2.72 -2.85 -0.56 -0.99 119.74 122.86 1d6m s LYS 225 Ca -0.03 -0.47 -0.19 0.00 -1.00 0.00 0.00 55.97 54.28 1d6m s LYS 225 Cb -0.18 -3.20 -0.03 0.00 -2.06 0.00 0.00 37.83 32.35 1d6m s LYS 225 CO -0.02 -0.02 0.53 0.00 0.10 0.00 0.00 175.35 175.93 1d6m s ALA 226 N 1.14 3.53 -0.44 0.59 0.00 0.46 -1.21 121.76 125.83 1d6m s ALA 226 Ca 0.04 -0.35 -0.22 0.00 0.00 0.00 0.00 51.96 51.42 1d6m s ALA 226 Cb -0.14 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.18 1d6m s ALA 226 CO 0.02 -0.40 0.74 -1.01 0.00 0.00 0.00 175.76 175.12 1d6m s HIS 227 N 1.53 3.03 0.18 0.00 3.76 -0.26 -1.05 115.29 122.48 1d6m s HIS 227 Ca 0.25 0.13 -0.02 0.00 -0.15 0.00 0.00 55.06 55.27 1d6m s HIS 227 Cb -0.15 -3.53 -0.05 0.00 1.11 0.00 0.00 32.58 29.96 1d6m s HIS 227 CO 0.10 -0.92 0.39 0.42 -0.85 0.00 0.00 174.74 173.88 1d6m s ILE 228 N 3.11 5.19 -0.01 0.60 -1.09 0.13 0.33 121.20 129.46 1d6m s ILE 228 Ca 0.28 -0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.50 1d6m s ILE 228 Cb -0.13 -3.69 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1d6m s ILE 228 CO 0.21 -0.09 0.01 0.54 -1.23 0.00 0.00 174.94 174.37 1d6m s VAL 229 N -1.79 0.03 0.51 2.92 0.11 0.03 -1.93 120.40 120.27 1d6m s VAL 229 Ca 0.40 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.54 1d6m s VAL 229 Cb -0.11 -0.10 0.02 0.00 -1.53 0.00 0.00 36.38 34.66 1d6m s VAL 229 CO 0.27 0.06 0.73 0.42 -3.33 0.00 0.00 175.10 173.26 1d6m s THR 230 N 0.56 3.13 0.58 5.04 -4.23 0.08 -1.11 115.64 119.69 1d6m s THR 230 Ca -0.05 -0.62 0.28 0.00 -1.18 0.00 0.00 61.69 60.12 1d6m s THR 230 Cb -0.07 -3.16 0.34 0.00 1.34 0.00 0.00 72.50 70.95 1d6m s THR 230 CO -0.01 -0.11 2.24 -0.65 -0.54 0.00 0.00 174.62 175.54 1d6m h PRO 231 N 0.21 0.00 0.00 3.99 0.11 -1.89 0.71 132.00 135.13 1d6m h PRO 231 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1d6m h PRO 231 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1d6m h PRO 231 CO 0.54 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.33 1d6m n ALA 232 N -2.35 2.01 -0.52 -0.75 0.00 -1.26 -4.89 120.51 112.74 1d6m n ALA 232 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1d6m n ALA 232 Cb 0.09 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1d6m n ALA 232 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1d6m n ASP 233 N -1.36 -1.06 -4.80 0.00 2.03 0.24 -5.06 116.55 106.53 1d6m n ASP 233 Ca 0.08 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.05 1d6m n ASP 233 Cb 0.19 -0.18 -0.05 0.00 -0.72 0.00 0.00 41.12 40.36 1d6m n ASP 233 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1d6m s GLU 234 N -0.48 4.07 0.07 -0.67 2.02 -1.25 -4.80 118.70 117.66 1d6m s GLU 234 Ca 0.00 1.27 0.06 0.00 0.02 0.00 0.00 54.97 56.32 1d6m s GLU 234 Cb 0.00 -2.22 -0.03 0.00 0.10 0.00 0.00 34.13 31.98 1d6m s GLU 234 CO 0.00 -0.18 -0.17 1.03 0.02 0.00 0.00 175.26 175.96 1d6m s ARG 235 N -3.06 1.03 0.19 1.61 0.52 -1.26 -0.74 118.95 117.23 1d6m s ARG 235 Ca 0.63 -0.97 -0.23 0.00 -0.52 0.00 0.00 55.73 54.64 1d6m s ARG 235 Cb -0.14 -1.13 0.05 0.00 0.52 0.00 0.00 34.95 34.25 1d6m s ARG 235 CO 0.18 0.27 0.76 -0.59 0.02 0.00 0.00 175.30 175.94 1d6m s PHE 236 N -1.06 -0.28 0.15 -0.53 -0.71 -0.81 -4.91 117.98 109.83 1d6m s PHE 236 Ca 0.03 -0.05 0.10 0.00 -1.04 0.00 0.00 56.93 55.97 1d6m s PHE 236 Cb -0.09 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.31 1d6m s PHE 236 CO 0.03 -0.97 -0.18 0.95 -1.34 0.00 0.00 175.22 173.70 1d6m s THR 237 N -3.65 2.78 0.08 -4.49 -4.23 -1.26 0.21 115.64 105.08 1d6m s THR 237 Ca 0.08 -1.68 0.05 0.00 -1.18 0.00 0.00 61.69 58.96 1d6m s THR 237 Cb -0.03 -2.31 -0.03 0.00 1.34 0.00 0.00 72.50 71.47 1d6m s THR 237 CO -0.01 -0.01 -0.14 0.00 -0.54 0.00 0.00 174.62 173.92 1d6m s ALA 238 N -1.40 1.22 -0.21 3.99 0.00 -0.21 -4.68 121.76 120.47 1d6m s ALA 238 Ca 0.20 -1.04 -0.09 0.00 0.00 0.00 0.00 51.96 51.04 1d6m s ALA 238 Cb -0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1d6m s ALA 238 CO 0.11 0.16 0.10 0.42 0.00 0.00 0.00 175.76 176.55 1d6m s ILE 239 N -1.37 4.97 0.28 0.00 -1.09 0.16 -0.40 121.20 123.75 1d6m s ILE 239 Ca -0.01 0.04 -0.30 0.00 -2.23 0.00 0.00 60.65 58.15 1d6m s ILE 239 Cb -0.09 -3.27 -0.11 0.00 -1.58 0.00 0.00 42.46 37.40 1d6m s ILE 239 CO 0.02 0.42 1.62 0.86 -1.23 0.00 0.00 174.94 176.63 1d6m s TRP 240 N 0.65 2.76 -0.50 3.97 -0.00 -0.17 -1.46 118.94 124.20 1d6m s TRP 240 Ca 0.05 0.72 0.04 0.00 -0.00 0.00 0.00 56.10 56.91 1d6m s TRP 240 Cb -0.13 -4.09 0.13 0.00 -0.00 0.00 0.00 33.47 29.38 1d6m s TRP 240 CO 0.01 -3.72 0.24 -0.65 -0.00 0.00 0.00 176.95 172.83 1d6m s GLN 241 N -0.30 1.89 0.56 5.86 -0.21 -0.65 -4.77 119.66 122.03 1d6m s GLN 241 Ca 0.65 -2.52 -0.18 0.00 0.02 0.00 0.00 55.36 53.33 1d6m s GLN 241 Cb -0.48 -3.25 -0.10 0.00 1.00 0.00 0.00 33.01 30.18 1d6m s GLN 241 CO 0.46 -1.10 0.38 -2.30 -2.12 0.00 0.00 175.29 170.61 1d6m n PRO 242 N 3.24 0.39 -0.23 2.91 -0.02 -1.26 -4.54 135.00 135.49 1d6m n PRO 242 Ca 0.05 0.15 -0.29 0.00 -2.02 0.00 0.00 63.50 61.39 1d6m n PRO 242 Cb 0.33 -1.54 0.28 0.00 -0.02 0.00 0.00 33.50 32.55 1d6m n PRO 242 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1d6m n SER 243 N 0.94 -4.11 0.21 2.55 7.64 -1.26 -4.90 113.62 114.68 1d6m n SER 243 Ca 0.11 -0.84 0.11 0.00 1.01 0.00 0.00 58.87 59.26 1d6m n SER 243 Cb 0.47 -0.96 0.19 0.00 -1.01 0.00 0.00 64.21 62.90 1d6m n SER 243 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1d6m h GLU 244 N 0.00 0.00 0.00 1.43 4.81 -2.04 -2.96 114.58 115.81 1d6m h GLU 244 Ca -0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1d6m h GLU 244 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1d6m h GLU 244 CO 0.23 0.08 -0.17 0.00 -0.73 0.00 0.00 179.01 178.42 1d6m n ALA 245 N -2.12 2.45 1.19 2.92 0.00 -1.26 -3.68 120.51 120.01 1d6m n ALA 245 Ca 0.03 -0.08 0.04 0.00 0.00 0.00 0.00 53.44 53.43 1d6m n ALA 245 Cb 0.54 -1.39 0.11 0.00 0.00 0.00 0.00 19.45 18.71 1d6m n ALA 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d6m h GLU 247 N 1.37 0.56 -0.36 0.00 5.08 -1.76 -2.81 114.58 116.67 1d6m h GLU 247 Ca 0.00 -0.09 0.10 0.00 -1.00 0.00 0.00 59.36 58.37 1d6m h GLU 247 Cb 0.36 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1d6m h GLU 247 CO 0.01 0.52 0.43 -1.35 -1.00 0.00 0.00 179.01 177.63 1d6m h PRO 248 N 0.48 0.00 -0.04 2.33 0.11 -1.89 0.33 132.00 133.32 1d6m h PRO 248 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1d6m h PRO 248 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 1d6m h PRO 248 CO -0.01 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.44 1d6m n TYR 249 N -3.61 0.02 -4.06 0.65 4.01 -1.07 -4.99 117.16 108.11 1d6m n TYR 249 Ca 0.06 -0.01 -0.29 0.00 -0.16 0.00 0.00 57.90 57.50 1d6m n TYR 249 Cb 0.59 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.56 1d6m n TYR 249 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1d6m s GLN 250 N -1.98 2.89 1.00 -0.72 -0.21 0.12 0.00 119.66 120.75 1d6m s GLN 250 Ca 0.31 -0.75 -0.17 0.00 0.02 0.00 0.00 55.36 54.77 1d6m s GLN 250 Cb 0.20 -2.70 0.22 0.00 1.00 0.00 0.00 33.01 31.73 1d6m s GLN 250 CO 0.31 0.54 1.34 0.16 -2.12 0.00 0.00 175.29 175.52 1d6m s ASP 251 N -2.62 2.81 0.62 5.90 1.47 0.13 -4.83 116.67 120.15 1d6m s ASP 251 Ca 0.30 0.19 0.37 0.00 1.18 0.00 0.00 52.55 54.59 1d6m s ASP 251 Cb -0.11 -0.16 2.05 0.00 -0.34 0.00 0.00 42.92 44.35 1d6m s ASP 251 CO 0.22 -2.92 2.28 -0.33 0.68 0.00 0.00 175.17 175.10 1d6m h GLU 252 N -1.77 0.00 -0.03 2.11 4.39 -1.97 0.21 114.58 117.52 1d6m h GLU 252 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1d6m h GLU 252 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1d6m h GLU 252 CO 0.33 0.01 0.00 0.39 -1.16 0.00 0.00 179.01 178.59 1d6m n GLU 253 N -3.41 2.13 -0.72 2.33 -0.58 -1.26 -4.96 120.64 114.17 1d6m n GLU 253 Ca -0.03 -1.65 0.00 0.00 -0.42 0.00 0.00 57.16 55.07 1d6m n GLU 253 Cb 0.11 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.51 1d6m n GLU 253 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d6m n GLY 254 N 1.30 0.66 3.72 0.62 0.00 0.74 -5.05 105.19 107.17 1d6m n GLY 254 Ca 0.16 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1d6m n GLY 254 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d6m s ARG 255 N -1.50 4.49 -0.17 1.61 0.52 -1.25 -4.65 118.95 118.00 1d6m s ARG 255 Ca 0.00 1.10 -0.29 0.00 -0.52 0.00 0.00 55.73 56.02 1d6m s ARG 255 Cb 0.00 -3.44 -0.02 0.00 0.52 0.00 0.00 34.95 32.01 1d6m s ARG 255 CO 0.00 0.05 1.37 -1.17 0.02 0.00 0.00 175.30 175.57 1d6m s LEU 256 N 0.77 4.13 -0.07 2.53 2.96 -1.26 0.21 118.68 127.96 1d6m s LEU 256 Ca 0.43 1.70 0.07 0.00 -0.22 0.00 0.00 54.13 56.11 1d6m s LEU 256 Cb -0.19 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.72 1d6m s LEU 256 CO 0.22 -0.89 0.58 0.18 -1.32 0.00 0.00 176.35 175.12 1d6m n LEU 257 N 7.04 1.37 -4.47 -0.68 4.77 0.10 -0.31 117.00 124.82 1d6m n LEU 257 Ca 0.15 0.36 -0.43 0.00 -0.03 0.00 0.00 56.01 56.05 1d6m n LEU 257 Cb 0.45 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 1d6m n LEU 257 CO 0.59 0.52 0.55 -2.28 -1.33 0.00 0.00 177.39 175.44 1d6m s HIS 258 N -2.59 2.90 0.17 -1.77 2.46 -1.24 -4.82 115.29 110.41 1d6m s HIS 258 Ca -0.10 -0.38 -0.20 0.00 0.47 0.00 0.00 55.06 54.85 1d6m s HIS 258 Cb 0.08 -3.87 0.08 0.00 -0.13 0.00 0.00 32.58 28.74 1d6m s HIS 258 CO 0.81 -1.25 1.63 -0.09 -2.47 0.00 0.00 174.74 173.37 1d6m h ARG 259 N 9.20 -0.15 -0.71 2.88 2.43 -1.96 -2.14 114.38 123.93 1d6m h ARG 259 Ca -0.27 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.05 1d6m h ARG 259 Cb 1.08 0.03 -0.13 0.00 -0.42 0.00 0.00 29.97 30.53 1d6m h ARG 259 CO 1.05 -0.10 -0.17 -2.30 -1.51 0.00 0.00 179.97 176.94 1d6m n PRO 260 N -5.38 -0.06 -0.15 0.20 -0.02 -1.26 0.66 135.00 128.99 1d6m n PRO 260 Ca 0.01 1.10 -0.03 0.00 -2.02 0.00 0.00 63.50 62.56 1d6m n PRO 260 Cb 0.29 -1.65 0.04 0.00 -0.02 0.00 0.00 33.50 32.16 1d6m n PRO 260 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1d6m h LEU 261 N 0.00 -0.33 -0.06 2.45 4.07 -1.82 -0.57 115.31 119.04 1d6m h LEU 261 Ca 0.34 0.13 0.02 0.00 0.08 0.00 0.00 57.88 58.45 1d6m h LEU 261 Cb 0.53 0.25 -0.04 0.00 1.08 0.00 0.00 40.66 42.48 1d6m h LEU 261 CO -0.72 -0.12 -0.34 0.00 -1.08 0.00 0.00 178.44 176.17 1d6m h ALA 262 N 1.45 -0.74 -0.63 1.53 0.00 0.08 -2.17 119.26 118.78 1d6m h ALA 262 Ca 0.23 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.21 1d6m h ALA 262 Cb 0.36 0.84 -0.12 0.00 0.00 0.00 0.00 17.79 18.86 1d6m h ALA 262 CO -0.45 -0.86 -0.33 0.93 0.00 0.00 0.00 179.25 178.54 1d6m h GLU 263 N -0.38 -0.14 -0.12 0.00 5.08 -1.21 -1.85 114.58 115.96 1d6m h GLU 263 Ca 0.02 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1d6m h GLU 263 Cb 0.44 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1d6m h GLU 263 CO -0.26 -0.09 -0.26 1.25 -1.00 0.00 0.00 179.01 178.64 1d6m h HIS 264 N -0.14 -0.80 -0.75 4.33 2.76 -0.88 -2.46 115.15 117.21 1d6m h HIS 264 Ca 0.25 0.03 0.16 0.00 -2.20 0.00 0.00 60.37 58.61 1d6m h HIS 264 Cb 0.55 0.36 -0.14 0.00 1.55 0.00 0.00 27.41 29.74 1d6m h HIS 264 CO -0.65 -0.25 -0.10 0.28 -1.30 0.00 0.00 177.93 175.90 1d6m h VAL 265 N -0.24 0.29 -0.85 5.26 2.07 -0.76 0.07 116.25 122.08 1d6m h VAL 265 Ca 0.02 -0.01 0.21 0.00 0.82 0.00 0.00 66.70 67.74 1d6m h VAL 265 Cb 0.31 0.24 -0.12 0.00 -1.52 0.00 0.00 31.29 30.20 1d6m h VAL 265 CO -0.24 0.01 0.31 0.58 0.02 0.00 0.00 177.57 178.24 1d6m h VAL 266 N 0.04 0.46 -0.18 2.57 2.07 -0.97 0.33 116.25 120.57 1d6m h VAL 266 Ca 0.38 -0.11 -0.18 0.00 0.82 0.00 0.00 66.70 67.61 1d6m h VAL 266 Cb 0.64 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1d6m h VAL 266 CO -0.73 0.06 -0.62 0.78 0.02 0.00 0.00 177.57 177.08 1d6m h ASN 267 N 0.33 0.72 -0.48 0.57 2.35 -0.56 -0.29 115.58 118.22 1d6m h ASN 267 Ca 0.52 -0.42 -0.11 0.00 -0.55 0.00 0.00 56.30 55.74 1d6m h ASN 267 Cb 0.97 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.11 1d6m h ASN 267 CO -0.55 1.17 -0.11 0.03 -1.65 0.00 0.00 177.43 176.32 1d6m h ARG 268 N 0.47 0.96 0.22 0.81 2.47 -0.48 -3.29 114.38 115.53 1d6m h ARG 268 Ca -0.01 -0.35 -0.31 0.00 -1.26 0.00 0.00 59.98 58.06 1d6m h ARG 268 Cb 1.20 -0.06 0.03 0.00 -1.65 0.00 0.00 29.97 29.49 1d6m h ARG 268 CO 0.12 1.01 -1.38 0.82 0.56 0.00 0.00 179.97 181.11 1d6m h ILE 269 N 0.86 1.28 -1.53 2.04 1.08 -0.42 -3.45 117.51 117.37 1d6m h ILE 269 Ca 0.13 -2.63 -0.73 0.00 -0.39 0.00 0.00 64.86 61.24 1d6m h ILE 269 Cb 0.66 3.04 0.03 0.00 -3.07 0.00 0.00 36.82 37.47 1d6m h ILE 269 CO 0.05 0.79 0.70 -0.24 -0.69 0.00 0.00 178.15 178.76 1d6m n SER 270 N -3.80 1.94 0.00 1.72 2.88 -0.12 -2.43 113.62 113.81 1d6m n SER 270 Ca -0.18 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 1d6m n SER 270 Cb 1.04 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 1d6m n SER 270 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1d6m n GLY 271 N 3.50 1.14 3.92 0.46 0.00 -0.73 -4.93 105.19 108.55 1d6m n GLY 271 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 1d6m n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d6m s GLN 272 N -0.10 3.17 0.55 1.61 -1.52 -1.02 -4.81 119.66 117.54 1d6m s GLN 272 Ca 0.00 -0.09 -0.20 0.00 -1.95 0.00 0.00 55.36 53.12 1d6m s GLN 272 Cb 0.00 -2.40 -0.06 0.00 -0.22 0.00 0.00 33.01 30.33 1d6m s GLN 272 CO 0.00 -0.39 1.15 -1.25 -0.25 0.00 0.00 175.29 174.55 1d6m s PRO 273 N -4.76 3.31 -0.16 2.91 0.04 -1.26 -1.22 135.00 133.86 1d6m s PRO 273 Ca 0.50 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.21 1d6m s PRO 273 Cb -0.10 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.45 1d6m s PRO 273 CO 0.43 -0.89 -0.11 0.00 0.04 0.00 0.00 177.00 176.46 1d6m s ALA 274 N -1.72 1.81 -0.32 8.56 0.00 0.23 -4.48 121.76 125.84 1d6m s ALA 274 Ca 0.73 -0.95 -0.12 0.00 0.00 0.00 0.00 51.96 51.62 1d6m s ALA 274 Cb -0.25 -1.12 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 1d6m s ALA 274 CO 0.29 -0.57 0.21 0.42 0.00 0.00 0.00 175.76 176.11 1d6m s ILE 275 N 1.50 5.18 0.09 0.00 -1.09 -0.53 0.10 121.20 126.45 1d6m s ILE 275 Ca 0.03 -0.13 -0.31 0.00 -2.23 0.00 0.00 60.65 58.01 1d6m s ILE 275 Cb -0.14 -3.60 -0.09 0.00 -1.58 0.00 0.00 42.46 37.06 1d6m s ILE 275 CO -0.09 0.09 1.63 -0.69 -1.23 0.00 0.00 174.94 174.64 1d6m s VAL 276 N 1.72 2.98 -0.07 2.92 1.01 -0.40 -1.52 120.40 127.04 1d6m s VAL 276 Ca 0.06 0.50 0.09 0.00 0.00 0.00 0.00 61.98 62.63 1d6m s VAL 276 Cb -0.17 -3.32 -0.13 0.00 0.00 0.00 0.00 36.38 32.76 1d6m s VAL 276 CO 0.10 0.01 0.09 0.41 0.00 0.00 0.00 175.10 175.71 1d6m n THR 277 N 4.57 0.45 -3.59 3.92 -1.04 -0.13 -0.42 114.28 118.03 1d6m n THR 277 Ca 0.15 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.05 61.69 1d6m n THR 277 Cb 0.40 -0.44 -0.06 0.00 -1.82 0.00 0.00 70.33 68.41 1d6m n THR 277 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1d6m s SER 278 N -3.85 -0.54 -0.01 8.00 1.04 -1.22 -4.85 113.70 112.27 1d6m s SER 278 Ca -0.04 0.82 0.02 0.00 0.48 0.00 0.00 55.95 57.23 1d6m s SER 278 Cb 0.04 0.75 -0.00 0.00 0.10 0.00 0.00 66.02 66.91 1d6m s SER 278 CO 0.39 -0.34 -0.07 -0.47 0.98 0.00 0.00 173.24 173.73 1d6m s TYR 279 N -0.48 0.71 -0.01 5.02 6.14 -1.26 -1.93 117.35 125.54 1d6m s TYR 279 Ca -0.03 -0.14 0.00 0.00 0.64 0.00 0.00 57.07 57.55 1d6m s TYR 279 Cb -0.02 -0.48 0.01 0.00 0.42 0.00 0.00 41.96 41.89 1d6m s TYR 279 CO 0.02 -0.03 0.00 -0.80 0.64 0.00 0.00 175.55 175.37 1d6m s ASN 280 N -0.06 0.20 -0.33 4.32 0.01 -0.40 -4.96 114.94 113.73 1d6m s ASN 280 Ca 0.01 -0.01 -0.00 0.00 -0.71 0.00 0.00 52.86 52.15 1d6m s ASN 280 Cb -0.04 -0.08 0.13 0.00 0.41 0.00 0.00 41.25 41.67 1d6m s ASN 280 CO -0.00 -0.05 0.25 -0.62 -1.51 0.00 0.00 177.10 175.17 1d6m s ASP 281 N 0.51 2.34 0.20 -1.22 -1.08 -1.26 -1.09 116.67 115.06 1d6m s ASP 281 Ca -0.05 -1.50 0.10 0.00 -0.52 0.00 0.00 52.55 50.58 1d6m s ASP 281 Cb -0.07 0.07 -0.04 0.00 -1.46 0.00 0.00 42.92 41.42 1d6m s ASP 281 CO -0.01 -0.34 -0.14 -1.59 0.52 0.00 0.00 175.17 173.61 1d6m s LYS 282 N 1.69 1.89 -0.25 4.34 0.00 -0.55 -5.00 119.74 121.87 1d6m s LYS 282 Ca 0.14 -1.41 0.03 0.00 0.00 0.00 0.00 55.97 54.73 1d6m s LYS 282 Cb -0.17 -2.03 0.05 0.00 0.00 0.00 0.00 37.83 35.68 1d6m s LYS 282 CO -0.16 0.41 -0.13 1.03 0.00 0.00 0.00 175.35 176.50 1d6m s ARG 283 N -2.93 2.37 0.02 1.78 0.52 -1.26 -0.91 118.95 118.53 1d6m s ARG 283 Ca 0.25 -1.26 0.02 0.00 -0.52 0.00 0.00 55.73 54.22 1d6m s ARG 283 Cb -0.08 -2.83 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 1d6m s ARG 283 CO 0.14 -0.51 -0.01 -1.83 0.02 0.00 0.00 175.30 173.12 1d6m s GLU 284 N 1.13 2.71 -0.04 3.54 -1.05 0.18 -4.92 118.70 120.25 1d6m s GLU 284 Ca -0.07 -0.68 0.04 0.00 -0.15 0.00 0.00 54.97 54.11 1d6m s GLU 284 Cb -0.19 -2.62 -0.03 0.00 -0.44 0.00 0.00 34.13 30.85 1d6m s GLU 284 CO -0.06 0.60 -0.14 -1.54 0.95 0.00 0.00 175.26 175.07 1d6m s SER 285 N -1.73 4.05 -0.15 0.83 1.04 -1.26 0.94 113.70 117.43 1d6m s SER 285 Ca 0.21 -0.20 0.02 0.00 0.48 0.00 0.00 55.95 56.45 1d6m s SER 285 Cb -0.12 -0.85 0.01 0.00 0.10 0.00 0.00 66.02 65.16 1d6m s SER 285 CO 0.12 0.34 -0.19 -1.83 0.98 0.00 0.00 173.24 172.66 1d6m s GLU 286 N -0.78 3.10 0.30 4.02 -1.05 0.62 -4.95 118.70 119.95 1d6m s GLU 286 Ca 0.12 -0.81 -0.13 0.00 -0.15 0.00 0.00 54.97 53.99 1d6m s GLU 286 Cb -0.11 -2.51 -0.08 0.00 -0.44 0.00 0.00 34.13 30.99 1d6m s GLU 286 CO 0.01 -0.00 0.68 -1.54 0.95 0.00 0.00 175.26 175.36 1d6m s SER 287 N 0.82 6.71 0.34 0.83 1.04 -1.26 0.25 113.70 122.43 1d6m s SER 287 Ca -0.06 1.16 -0.28 0.00 0.48 0.00 0.00 55.95 57.25 1d6m s SER 287 Cb -0.15 -2.33 -0.13 0.00 0.10 0.00 0.00 66.02 63.52 1d6m s SER 287 CO -0.01 -0.18 1.18 0.00 0.98 0.00 0.00 173.24 175.21 1d6m n ALA 288 N -0.35 0.76 -1.27 5.32 0.00 -1.26 -4.93 120.51 118.77 1d6m n ALA 288 Ca 0.03 0.35 -0.32 0.00 0.00 0.00 0.00 53.44 53.49 1d6m n ALA 288 Cb 0.53 -2.17 0.09 0.00 0.00 0.00 0.00 19.45 17.90 1d6m n ALA 288 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1d6m s PRO 289 N -1.81 2.19 0.90 0.00 0.02 -1.26 -4.98 135.00 130.06 1d6m s PRO 289 Ca 0.57 1.46 -0.11 0.00 0.02 0.00 0.00 61.00 62.94 1d6m s PRO 289 Cb -0.60 -1.87 0.13 0.00 0.02 0.00 0.00 34.50 32.18 1d6m s PRO 289 CO 0.61 -1.73 1.09 -0.51 -0.33 0.00 0.00 177.00 176.13 1d6m s LEU 290 N -5.49 2.29 0.55 -5.54 1.43 -1.26 -4.76 118.68 105.89 1d6m s LEU 290 Ca 0.67 1.56 -0.21 0.00 -1.03 0.00 0.00 54.13 55.12 1d6m s LEU 290 Cb -0.22 -3.97 -0.05 0.00 0.03 0.00 0.00 46.19 41.98 1d6m s LEU 290 CO 0.49 -2.69 1.30 -2.84 0.23 0.00 0.00 176.35 172.84 1d6m s PRO 291 N -4.89 3.17 0.59 1.29 0.02 -1.25 -4.93 135.00 129.00 1d6m s PRO 291 Ca 0.64 2.09 -0.20 0.00 0.02 0.00 0.00 61.00 63.55 1d6m s PRO 291 Cb -0.18 -2.21 -0.03 0.00 0.02 0.00 0.00 34.50 32.10 1d6m s PRO 291 CO 0.57 -1.12 1.32 -0.06 -0.33 0.00 0.00 177.00 177.38 1d6m s PHE 292 N -1.39 2.22 0.28 6.54 0.08 -1.26 -4.64 117.98 119.81 1d6m s PHE 292 Ca 0.72 1.43 0.08 0.00 0.12 0.00 0.00 56.93 59.28 1d6m s PHE 292 Cb -0.37 -3.74 -0.04 0.00 -0.57 0.00 0.00 43.02 38.30 1d6m s PHE 292 CO 0.43 -2.86 0.10 -1.54 -0.10 0.00 0.00 175.22 171.25 1d6m s SER 293 N -1.16 4.88 0.16 1.36 1.04 -1.26 -0.26 113.70 118.45 1d6m s SER 293 Ca 0.76 -0.56 -0.22 0.00 0.48 0.00 0.00 55.95 56.42 1d6m s SER 293 Cb -0.39 -0.98 0.05 0.00 0.10 0.00 0.00 66.02 64.80 1d6m s SER 293 CO 0.44 -0.09 1.63 0.25 0.98 0.00 0.00 173.24 176.44 1d6m h LEU 294 N 1.67 -0.80 -0.21 2.42 5.85 -1.69 0.33 115.31 122.88 1d6m h LEU 294 Ca -0.45 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.44 1d6m h LEU 294 Cb 1.25 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 42.64 1d6m h LEU 294 CO 0.61 -0.28 0.07 0.77 -0.34 0.00 0.00 178.44 179.27 1d6m h SER 295 N -0.23 0.08 -0.34 1.25 4.64 -1.90 0.63 113.55 117.69 1d6m h SER 295 Ca 0.15 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.57 1d6m h SER 295 Cb 0.47 0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 62.49 1d6m h SER 295 CO -0.42 0.08 -0.22 0.00 -0.87 0.00 0.00 176.83 175.39 1d6m h ALA 296 N 1.13 -0.01 -0.59 5.18 0.00 -1.82 0.31 119.26 123.46 1d6m h ALA 296 Ca 0.09 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1d6m h ALA 296 Cb 0.06 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1d6m h ALA 296 CO -0.09 -0.61 0.14 1.25 0.00 0.00 0.00 179.25 179.93 1d6m h LEU 297 N -0.18 0.89 -0.12 0.00 5.85 -0.60 -1.77 115.31 119.38 1d6m h LEU 297 Ca 0.17 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.69 1d6m h LEU 297 Cb 0.44 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1d6m h LEU 297 CO -0.44 0.90 -0.17 1.56 -0.34 0.00 0.00 178.44 179.95 1d6m h GLN 298 N 0.85 -0.20 -0.69 1.25 4.20 0.14 0.24 115.11 120.89 1d6m h GLN 298 Ca 0.18 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.97 1d6m h GLN 298 Cb 0.36 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.13 1d6m h GLN 298 CO 0.00 -0.14 0.38 0.82 -0.67 0.00 0.00 178.83 179.23 1d6m h ILE 299 N -0.21 0.94 -0.40 2.54 2.04 -0.26 0.22 117.51 122.38 1d6m h ILE 299 Ca 0.09 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.58 1d6m h ILE 299 Cb 0.35 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1d6m h ILE 299 CO -0.24 0.12 -0.31 -0.08 0.00 0.00 0.00 178.15 177.64 1d6m h GLU 300 N 0.68 0.88 -0.40 2.37 4.57 -0.50 0.29 114.58 122.48 1d6m h GLU 300 Ca 0.32 -0.41 -0.05 0.00 -1.18 0.00 0.00 59.36 58.03 1d6m h GLU 300 Cb 0.23 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.80 1d6m h GLU 300 CO -0.20 1.06 0.04 0.00 -1.18 0.00 0.00 179.01 178.73 1d6m h ALA 301 N 0.90 0.53 0.26 2.92 0.00 -0.19 -1.52 119.26 122.16 1d6m h ALA 301 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1d6m h ALA 301 Cb 0.88 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1d6m h ALA 301 CO 0.08 0.27 -0.52 0.00 0.00 0.00 0.00 179.25 179.07 1d6m h ALA 302 N 0.91 -1.06 -0.60 0.00 0.00 -0.45 0.53 119.26 118.60 1d6m h ALA 302 Ca 0.12 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1d6m h ALA 302 Cb 0.41 0.85 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 1d6m h ALA 302 CO 0.01 -1.15 0.40 -0.22 0.00 0.00 0.00 179.25 178.29 1d6m h LYS 303 N -0.85 0.62 0.06 0.00 3.64 -0.82 -0.19 116.57 119.03 1d6m h LYS 303 Ca -0.03 -0.04 -0.38 0.00 -1.27 0.00 0.00 60.65 58.94 1d6m h LYS 303 Cb 0.80 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 1d6m h LYS 303 CO -0.21 0.41 -2.23 0.54 -2.27 0.00 0.00 179.45 175.69 1d6m n ARG 304 N -4.47 0.70 0.00 1.90 1.74 -0.58 -4.67 116.66 111.28 1d6m n ARG 304 Ca 0.08 0.21 0.03 0.00 -0.77 0.00 0.00 57.85 57.40 1d6m n ARG 304 Cb 0.18 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 29.97 1d6m n ARG 304 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1d6m n PHE 305 N -3.42 0.00 -2.95 -1.55 3.72 0.14 -5.02 117.46 108.38 1d6m n PHE 305 Ca -0.39 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 56.89 1d6m n PHE 305 Cb 1.01 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.61 1d6m n PHE 305 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1d6m n GLY 306 N 1.14 -0.08 3.38 1.37 0.00 -0.08 -5.00 105.19 105.91 1d6m n GLY 306 Ca 0.01 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 1d6m n GLY 306 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d6m s LEU 307 N -4.85 3.11 1.14 0.99 1.43 -1.23 -4.97 118.68 114.29 1d6m s LEU 307 Ca 0.02 -0.30 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 1d6m s LEU 307 Cb -0.01 -1.80 0.16 0.00 0.03 0.00 0.00 46.19 44.57 1d6m s LEU 307 CO 0.48 0.00 0.21 -1.54 0.23 0.00 0.00 176.35 175.73 1d6m n SER 308 N 4.64 -2.50 -0.08 2.29 3.41 -1.26 -3.58 113.62 116.55 1d6m n SER 308 Ca -0.17 -0.22 -0.11 0.00 -0.26 0.00 0.00 58.87 58.11 1d6m n SER 308 Cb 0.51 -0.97 -0.04 0.00 -0.26 0.00 0.00 64.21 63.46 1d6m n SER 308 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d6m h ALA 309 N -2.34 0.32 -0.04 7.33 0.00 -1.92 -2.20 119.26 120.39 1d6m h ALA 309 Ca -0.51 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1d6m h ALA 309 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1d6m h ALA 309 CO 0.36 -0.04 0.03 0.37 0.00 0.00 0.00 179.25 179.97 1d6m h GLN 310 N 0.21 0.05 -0.73 0.00 5.75 -1.92 -0.07 115.11 118.41 1d6m h GLN 310 Ca 0.08 -0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.67 1d6m h GLN 310 Cb 0.27 -0.01 -0.12 0.00 1.07 0.00 0.00 27.48 28.69 1d6m h GLN 310 CO -0.00 0.04 -0.48 -0.97 -2.65 0.00 0.00 178.83 174.77 1d6m h ASN 311 N 0.05 -1.70 -0.80 -0.69 -0.00 -1.88 0.14 115.58 110.71 1d6m h ASN 311 Ca 0.02 0.28 0.00 0.00 -0.00 0.00 0.00 56.30 56.60 1d6m h ASN 311 Cb 0.00 0.77 -0.04 0.00 -0.00 0.00 0.00 38.32 39.05 1d6m h ASN 311 CO -0.00 -0.31 0.51 0.58 -0.00 0.00 0.00 177.43 178.21 1d6m h VAL 312 N -0.15 1.21 -0.40 2.57 2.07 -1.14 -1.77 116.25 118.64 1d6m h VAL 312 Ca 0.19 -0.42 -0.13 0.00 0.82 0.00 0.00 66.70 67.16 1d6m h VAL 312 Cb 0.54 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1d6m h VAL 312 CO -0.79 0.21 -0.26 0.25 0.02 0.00 0.00 177.57 177.00 1d6m h LEU 313 N 1.10 0.91 0.62 2.57 5.85 0.40 -0.70 115.31 126.06 1d6m h LEU 313 Ca 0.29 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1d6m h LEU 313 Cb -0.09 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.67 1d6m h LEU 313 CO -0.06 1.15 -0.48 0.44 -0.34 0.00 0.00 178.44 179.14 1d6m h ASP 314 N 0.69 -1.27 -0.95 1.25 3.32 -0.26 -1.20 116.42 118.00 1d6m h ASP 314 Ca 0.08 0.09 0.15 0.00 0.02 0.00 0.00 57.03 57.37 1d6m h ASP 314 Cb 0.83 0.40 -0.10 0.00 0.22 0.00 0.00 39.33 40.69 1d6m h ASP 314 CO 0.07 -0.68 0.55 0.40 -1.72 0.00 0.00 179.24 177.86 1d6m h ILE 315 N -1.06 0.77 -0.38 0.35 2.04 -1.36 -0.29 117.51 117.58 1d6m h ILE 315 Ca -0.08 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.46 1d6m h ILE 315 Cb 0.89 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1d6m h ILE 315 CO 0.02 0.14 0.00 0.00 0.00 0.00 0.00 178.15 178.31 1d6m h GLN 317 N 0.57 0.48 -0.39 0.00 1.08 0.17 -1.00 115.11 116.03 1d6m h GLN 317 Ca 0.12 -0.24 -0.04 0.00 -1.45 0.00 0.00 58.65 57.03 1d6m h GLN 317 Cb 0.36 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 1d6m h GLN 317 CO 0.01 0.81 0.07 -0.22 -0.95 0.00 0.00 178.83 178.56 1d6m h LYS 318 N 0.40 0.63 -0.34 1.46 3.64 -1.12 0.25 116.57 121.49 1d6m h LYS 318 Ca 0.03 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.18 1d6m h LYS 318 Cb 0.89 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 1d6m h LYS 318 CO 0.08 0.68 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.78 1d6m h LEU 319 N 0.48 0.56 0.10 5.20 3.38 -1.17 -1.75 115.31 122.11 1d6m h LEU 319 Ca 0.12 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 1d6m h LEU 319 Cb 0.35 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1d6m h LEU 319 CO 0.01 0.69 -0.72 0.22 0.09 0.00 0.00 178.44 178.72 1d6m h TYR 320 N 0.54 0.37 0.00 1.13 3.20 -0.91 -0.58 116.97 120.73 1d6m h TYR 320 Ca 0.10 -0.27 -0.06 0.00 3.14 0.00 0.00 58.73 61.64 1d6m h TYR 320 Cb 0.48 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1d6m h TYR 320 CO 0.02 1.28 -0.52 0.93 -1.64 0.00 0.00 178.16 178.23 1d6m h GLU 321 N -0.54 0.00 0.00 1.82 5.08 -0.57 -3.31 114.58 117.06 1d6m h GLU 321 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1d6m h GLU 321 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1d6m h GLU 321 CO 0.09 0.36 0.00 2.41 -1.00 0.00 0.00 179.01 180.87 1d6m n THR 322 N -4.61 0.00 0.15 1.13 -1.04 -0.72 -4.30 114.28 104.89 1d6m n THR 322 Ca -0.12 0.47 0.16 0.00 -2.04 0.00 0.00 64.05 62.52 1d6m n THR 322 Cb 0.33 -0.95 0.73 0.00 -1.82 0.00 0.00 70.33 68.62 1d6m n THR 322 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 1d6m h HIS 323 N 0.00 0.00 -2.38 -1.42 3.86 -1.57 -3.47 115.15 110.17 1d6m h HIS 323 Ca 0.00 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.92 1d6m h HIS 323 Cb 0.00 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.47 1d6m h HIS 323 CO 0.01 0.00 -0.39 1.63 0.86 0.00 0.00 177.93 180.04 1d6m n LYS 324 N -4.20 -1.72 -2.94 2.45 4.01 -0.85 -4.95 118.16 109.96 1d6m n LYS 324 Ca 0.03 0.70 -0.22 0.00 -0.51 0.00 0.00 58.31 58.30 1d6m n LYS 324 Cb 0.37 -5.01 -0.03 0.00 -0.51 0.00 0.00 35.03 29.85 1d6m n LYS 324 CO 0.00 0.00 0.00 1.47 -1.11 0.00 0.00 177.40 177.76 1d6m n LEU 325 N -2.30 3.05 -3.62 -0.35 -0.00 -0.28 -4.67 117.00 108.82 1d6m n LEU 325 Ca -0.15 -5.23 -0.06 0.00 -0.00 0.00 0.00 56.01 50.57 1d6m n LEU 325 Cb 0.62 -0.04 -0.05 0.00 -0.00 0.00 0.00 43.42 43.95 1d6m n LEU 325 CO 0.23 2.25 1.00 -0.63 -0.00 0.00 0.00 177.39 180.24 1d6m s ILE 326 N -3.82 0.00 0.62 1.47 -1.09 -1.25 -4.07 121.20 113.06 1d6m s ILE 326 Ca 0.44 0.00 -0.01 0.00 -2.23 0.00 0.00 60.65 58.85 1d6m s ILE 326 Cb 0.33 -1.00 0.06 0.00 -1.58 0.00 0.00 42.46 40.27 1d6m s ILE 326 CO -0.11 0.00 0.87 -0.89 -1.23 0.00 0.00 174.94 173.58 1d6m s THR 327 N -0.86 2.48 -0.39 2.92 2.01 0.13 -4.53 115.64 117.39 1d6m s THR 327 Ca 0.05 -0.58 -0.35 0.00 0.31 0.00 0.00 61.69 61.12 1d6m s THR 327 Cb -0.01 -2.90 -0.15 0.00 0.01 0.00 0.00 72.50 69.44 1d6m s THR 327 CO -0.05 0.00 1.62 0.00 -0.69 0.00 0.00 174.62 175.49 1d6m n TYR 328 N -2.56 0.99 1.21 4.92 9.36 -0.23 -4.74 117.16 126.11 1d6m n TYR 328 Ca 0.10 0.65 0.03 0.00 3.32 0.00 0.00 57.90 62.00 1d6m n TYR 328 Cb 0.60 -1.79 0.10 0.00 -0.63 0.00 0.00 39.34 37.62 1d6m n TYR 328 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1d6m n PRO 329 N 5.46 1.58 -2.40 2.98 -0.04 -1.26 -4.09 135.00 137.23 1d6m n PRO 329 Ca 0.40 -0.81 -0.23 0.00 -0.04 0.00 0.00 63.50 62.82 1d6m n PRO 329 Cb -0.03 -1.23 0.01 0.00 -0.04 0.00 0.00 33.50 32.21 1d6m n PRO 329 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1d6m n ARG 330 N 0.15 3.12 -3.34 0.54 1.85 -1.26 -4.52 116.66 113.21 1d6m n ARG 330 Ca 0.08 -4.21 -0.38 0.00 -1.00 0.00 0.00 57.85 52.33 1d6m n ARG 330 Cb 0.22 -2.10 -0.06 0.00 -1.05 0.00 0.00 32.46 29.47 1d6m n ARG 330 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1d6m s SER 331 N -3.52 6.77 0.16 2.89 0.15 -1.26 -4.63 113.70 114.26 1d6m s SER 331 Ca 0.45 0.92 0.22 0.00 0.70 0.00 0.00 55.95 58.24 1d6m s SER 331 Cb 0.41 -2.29 -0.05 0.00 -1.71 0.00 0.00 66.02 62.37 1d6m s SER 331 CO -0.09 0.10 0.95 -0.90 1.20 0.00 0.00 173.24 174.50 1d6m n ASP 332 N 3.04 0.76 -4.77 5.45 5.68 -1.26 -2.29 116.55 123.17 1d6m n ASP 332 Ca -0.09 0.30 -0.37 0.00 -0.50 0.00 0.00 54.79 54.14 1d6m n ASP 332 Cb 0.52 0.57 0.00 0.00 -1.14 0.00 0.00 41.12 41.07 1d6m n ASP 332 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1d6m n ARG 334 N -0.78 -0.16 -3.40 0.00 1.74 -1.26 -3.81 116.66 108.98 1d6m n ARG 334 Ca 0.09 -0.56 -0.21 0.00 -0.77 0.00 0.00 57.85 56.39 1d6m n ARG 334 Cb 0.48 -0.89 0.01 0.00 -1.02 0.00 0.00 32.46 31.05 1d6m n ARG 334 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1d6m s TYR 335 N -0.15 2.00 0.08 -1.55 1.51 -1.26 -3.75 117.35 114.22 1d6m s TYR 335 Ca 0.00 -0.65 0.02 0.00 -1.01 0.00 0.00 57.07 55.43 1d6m s TYR 335 Cb 0.00 -2.14 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 1d6m s TYR 335 CO 0.00 -0.60 -0.08 -0.51 -1.11 0.00 0.00 175.55 173.25 1d6m s LEU 336 N -4.38 2.39 0.53 -1.29 1.43 -0.79 -2.03 118.68 114.54 1d6m s LEU 336 Ca 0.50 -0.79 -0.22 0.00 -1.03 0.00 0.00 54.13 52.59 1d6m s LEU 336 Cb -0.05 -0.16 -0.05 0.00 0.03 0.00 0.00 46.19 45.96 1d6m s LEU 336 CO 0.30 -0.32 1.30 -2.84 0.23 0.00 0.00 176.35 175.03 1d6m s PRO 337 N -2.73 3.28 0.32 1.29 0.02 -1.26 -0.65 135.00 135.26 1d6m s PRO 337 Ca 0.02 2.10 0.05 0.00 0.02 0.00 0.00 61.00 63.19 1d6m s PRO 337 Cb -0.02 -2.27 0.54 0.00 0.02 0.00 0.00 34.50 32.76 1d6m s PRO 337 CO -0.02 -1.04 1.79 0.93 -0.33 0.00 0.00 177.00 178.34 1d6m h GLU 338 N 1.57 0.41 0.00 5.54 5.08 -1.88 -2.22 114.58 123.07 1d6m h GLU 338 Ca -0.50 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 57.73 1d6m h GLU 338 Cb 1.29 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1d6m h GLU 338 CO 0.58 0.59 0.00 -0.85 -1.00 0.00 0.00 179.01 178.33 1d6m n GLU 339 N -4.18 0.59 0.19 2.33 0.28 -1.26 -2.27 120.64 116.32 1d6m n GLU 339 Ca -0.00 0.02 0.09 0.00 -0.16 0.00 0.00 57.16 57.11 1d6m n GLU 339 Cb 0.35 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 31.85 1d6m n GLU 339 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1d6m h HIS 340 N 0.00 0.00 -0.86 -1.84 3.86 -1.78 -3.35 115.15 111.19 1d6m h HIS 340 Ca 0.00 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.33 1d6m h HIS 340 Cb 0.04 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.43 1d6m h HIS 340 CO 0.00 0.17 0.48 0.35 0.86 0.00 0.00 177.93 179.79 1d6m h PHE 341 N 0.00 0.85 -0.02 2.45 3.57 -1.61 0.10 116.94 122.28 1d6m h PHE 341 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 1d6m h PHE 341 Cb 1.12 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1d6m h PHE 341 CO 0.00 0.28 0.03 0.00 -2.23 0.00 0.00 178.31 176.39 1d6m h ALA 342 N 1.52 1.49 -0.49 2.41 0.00 -1.82 -2.53 119.26 119.84 1d6m h ALA 342 Ca 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1d6m h ALA 342 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1d6m h ALA 342 CO -0.31 -0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.31 1d6m n GLY 343 N -1.30 1.63 0.37 0.00 0.00 0.36 -4.45 105.19 101.80 1d6m n GLY 343 Ca -0.02 -0.57 0.01 0.00 0.00 0.00 0.00 46.02 45.44 1d6m n GLY 343 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1d6m h ARG 344 N 2.95 1.10 -0.11 1.61 0.11 -1.47 -1.19 114.38 117.37 1d6m h ARG 344 Ca 0.00 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 59.98 1d6m h ARG 344 Cb 0.86 -0.25 -0.00 0.00 1.11 0.00 0.00 29.97 31.69 1d6m h ARG 344 CO 0.07 0.73 -0.05 0.45 0.10 0.00 0.00 179.97 181.27 1d6m h HIS 345 N 1.14 0.27 -0.34 4.08 3.86 -1.84 0.78 115.15 123.10 1d6m h HIS 345 Ca 0.36 -0.07 0.04 0.00 -1.16 0.00 0.00 60.37 59.54 1d6m h HIS 345 Cb 0.02 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 1d6m h HIS 345 CO -0.00 0.58 0.12 0.00 0.86 0.00 0.00 177.93 179.49 1d6m h ALA 346 N 0.65 0.39 -0.45 2.45 0.00 -1.82 0.51 119.26 121.00 1d6m h ALA 346 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1d6m h ALA 346 Cb 0.51 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1d6m h ALA 346 CO 0.02 -0.28 0.25 0.28 0.00 0.00 0.00 179.25 179.52 1d6m h VAL 347 N 0.26 1.15 -0.94 0.00 2.07 -1.16 -1.83 116.25 115.81 1d6m h VAL 347 Ca 0.15 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.31 1d6m h VAL 347 Cb 0.13 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 1d6m h VAL 347 CO -0.16 0.16 0.62 0.24 0.02 0.00 0.00 177.57 178.45 1d6m h MET 348 N 0.59 1.21 -0.48 1.57 2.86 0.15 -0.76 114.93 120.07 1d6m h MET 348 Ca 0.16 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1d6m h MET 348 Cb 0.03 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 1d6m h MET 348 CO -0.03 0.80 0.06 -0.97 1.06 0.00 0.00 176.91 177.83 1d6m h ASN 349 N 1.24 0.71 -0.32 1.22 -0.00 0.76 -0.96 115.58 118.23 1d6m h ASN 349 Ca 0.36 -0.14 -0.17 0.00 -0.00 0.00 0.00 56.30 56.35 1d6m h ASN 349 Cb -0.09 -0.19 -0.00 0.00 -0.00 0.00 0.00 38.32 38.04 1d6m h ASN 349 CO -0.09 0.74 -0.46 0.00 -0.00 0.00 0.00 177.43 177.62 1d6m h ALA 350 N 1.35 0.49 -0.95 1.57 0.00 -0.99 -2.97 119.26 117.76 1d6m h ALA 350 Ca 0.15 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.59 1d6m h ALA 350 Cb 0.35 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1d6m h ALA 350 CO 0.01 0.64 0.62 0.82 0.00 0.00 0.00 179.25 181.35 1d6m h ILE 351 N 0.67 1.25 -0.52 0.00 2.04 -0.60 -0.61 117.51 119.73 1d6m h ILE 351 Ca 0.03 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 1d6m h ILE 351 Cb 1.06 -0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1d6m h ILE 351 CO 0.11 0.24 0.20 0.77 0.00 0.00 0.00 178.15 179.47 1d6m h SER 352 N 1.29 0.69 0.46 1.72 4.64 -1.06 0.25 113.55 121.54 1d6m h SER 352 Ca 0.35 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 1d6m h SER 352 Cb -0.14 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.77 1d6m h SER 352 CO -0.07 0.63 -0.22 0.58 -0.87 0.00 0.00 176.83 176.87 1d6m h VAL 353 N 0.75 0.39 0.00 0.95 2.07 -1.18 -3.32 116.25 115.91 1d6m h VAL 353 Ca 0.18 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1d6m h VAL 353 Cb 0.16 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1d6m h VAL 353 CO -0.02 0.06 -0.32 1.41 0.02 0.00 0.00 177.57 178.72 1d6m n HIS 354 N -5.23 0.66 -3.23 1.57 8.25 -0.32 -4.44 115.22 112.47 1d6m n HIS 354 Ca -0.10 0.19 -0.24 0.00 -0.26 0.00 0.00 57.72 57.31 1d6m n HIS 354 Cb 0.30 -0.75 -0.07 0.00 1.12 0.00 0.00 29.99 30.59 1d6m n HIS 354 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1d6m n ALA 355 N -1.78 2.23 1.33 -1.41 0.00 0.87 -4.95 120.51 116.80 1d6m n ALA 355 Ca 0.05 -3.07 0.14 0.00 0.00 0.00 0.00 53.44 50.56 1d6m n ALA 355 Cb 0.43 -0.84 0.69 0.00 0.00 0.00 0.00 19.45 19.72 1d6m n ALA 355 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1d6m n PRO 356 N 2.09 0.38 0.00 0.00 -0.04 -1.25 -2.63 135.00 133.56 1d6m n PRO 356 Ca 0.24 -0.04 0.14 0.00 -0.04 0.00 0.00 63.50 63.79 1d6m n PRO 356 Cb 0.52 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 33.01 1d6m n PRO 356 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1d6m n ASP 357 N -1.27 0.15 -0.06 3.54 9.92 -1.26 -4.19 116.55 123.37 1d6m n ASP 357 Ca 0.13 0.22 -0.06 0.00 -0.53 0.00 0.00 54.79 54.54 1d6m n ASP 357 Cb 0.27 -0.28 -0.08 0.00 -0.64 0.00 0.00 41.12 40.39 1d6m n ASP 357 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1d6m n LEU 358 N -1.45 0.51 -0.01 0.64 4.77 -1.08 -4.96 117.00 115.42 1d6m n LEU 358 Ca 0.08 -0.01 0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1d6m n LEU 358 Cb 0.33 0.14 -0.16 0.00 -2.33 0.00 0.00 43.42 41.40 1d6m n LEU 358 CO 0.29 0.35 -0.63 -0.11 -1.33 0.00 0.00 177.39 175.96 1d6m n LEU 359 N -2.50 0.18 -0.08 2.23 7.94 -1.25 -4.30 117.00 119.22 1d6m n LEU 359 Ca -0.19 -0.09 -0.12 0.00 -1.11 0.00 0.00 56.01 54.49 1d6m n LEU 359 Cb 0.84 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.71 1d6m n LEU 359 CO 0.22 0.04 0.50 -0.65 -1.11 0.00 0.00 177.39 176.39 1d6m h PRO 360 N 0.00 -0.38 0.00 1.96 0.11 -1.93 -3.45 132.00 128.31 1d6m h PRO 360 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1d6m h PRO 360 Cb 0.89 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1d6m h PRO 360 CO 0.00 -0.25 0.00 0.94 -0.21 0.00 0.00 178.00 178.48 1d6m n GLN 361 N -5.00 0.00 0.21 1.05 -0.06 -1.26 -4.90 117.38 107.41 1d6m n GLN 361 Ca -0.04 0.00 0.15 0.00 -2.00 0.00 0.00 57.00 55.11 1d6m n GLN 361 Cb 0.30 0.00 0.63 0.00 -4.06 0.00 0.00 30.24 27.11 1d6m n GLN 361 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 1d6m h PRO 362 N 1.49 0.00 0.00 3.69 0.13 -1.96 -3.08 132.00 132.27 1d6m h PRO 362 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 1d6m h PRO 362 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1d6m h PRO 362 CO 0.00 0.00 -0.66 0.28 -0.23 0.00 0.00 178.00 177.39 1d6m h VAL 363 N 0.00 1.31 -2.63 1.56 2.07 -1.96 -3.43 116.25 113.16 1d6m h VAL 363 Ca 0.00 -2.39 -0.53 0.00 0.82 0.00 0.00 66.70 64.60 1d6m h VAL 363 Cb 0.39 2.35 0.03 0.00 -1.52 0.00 0.00 31.29 32.54 1d6m h VAL 363 CO 0.00 0.65 1.04 -0.69 0.02 0.00 0.00 177.57 178.58 1d6m s VAL 364 N -3.24 2.74 -0.24 2.57 1.01 -1.17 -4.60 120.40 117.48 1d6m s VAL 364 Ca 0.01 0.28 0.02 0.00 0.00 0.00 0.00 61.98 62.28 1d6m s VAL 364 Cb 0.11 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.36 1d6m s VAL 364 CO 0.76 0.00 -0.12 -0.62 0.00 0.00 0.00 175.10 175.12 1d6m s ASP 365 N 2.37 4.05 0.43 3.32 -1.08 0.16 -5.00 116.67 120.92 1d6m s ASP 365 Ca 0.77 -1.20 0.14 0.00 -0.52 0.00 0.00 52.55 51.74 1d6m s ASP 365 Cb -0.43 -1.46 1.02 0.00 -1.46 0.00 0.00 42.92 40.58 1d6m s ASP 365 CO 0.34 -0.16 1.95 -0.65 0.52 0.00 0.00 175.17 177.17 1d6m h PRO 366 N 7.84 0.42 -0.00 4.34 0.11 -1.94 -2.05 132.00 140.72 1d6m h PRO 366 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1d6m h PRO 366 Cb 1.07 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1d6m h PRO 366 CO 0.49 0.28 -0.08 -0.25 -0.21 0.00 0.00 178.00 178.22 1d6m n ASP 367 N -4.47 0.38 -4.71 -2.05 8.00 -1.26 -4.80 116.55 107.64 1d6m n ASP 367 Ca 0.12 -0.54 -0.42 0.00 0.71 0.00 0.00 54.79 54.66 1d6m n ASP 367 Cb 0.42 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 1d6m n ASP 367 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1d6m s ILE 368 N -2.46 3.74 -0.69 0.53 1.01 -0.77 -4.96 121.20 117.60 1d6m s ILE 368 Ca 0.30 1.22 0.05 0.00 0.00 0.00 0.00 60.65 62.22 1d6m s ILE 368 Cb 0.20 -3.78 0.19 0.00 0.01 0.00 0.00 42.46 39.07 1d6m s ILE 368 CO 0.47 0.07 0.55 -1.14 0.00 0.00 0.00 174.94 174.89 1d6m n ARG 369 N 4.26 1.98 0.00 2.79 0.63 -1.26 -4.77 116.66 120.28 1d6m n ARG 369 Ca 0.11 -4.52 0.00 0.00 -0.92 0.00 0.00 57.85 52.52 1d6m n ARG 369 Cb 0.44 -2.27 0.00 0.00 0.45 0.00 0.00 32.46 31.08 1d6m n ARG 369 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1d6m n ASN 370 N 1.71 -0.75 0.21 6.15 2.04 -1.26 -4.94 115.26 118.42 1d6m n ASN 370 Ca 0.22 -0.01 0.08 0.00 -0.44 0.00 0.00 54.58 54.43 1d6m n ASN 370 Cb 0.36 0.00 0.42 0.00 -2.53 0.00 0.00 39.78 38.03 1d6m n ASN 370 CO 0.00 0.00 0.00 0.08 -0.44 0.00 0.00 177.26 176.90 1d6m h ARG 371 N 0.00 0.00 -0.29 -3.83 0.11 -1.98 -3.34 114.38 105.05 1d6m h ARG 371 Ca 0.00 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.95 1d6m h ARG 371 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.07 1d6m h ARG 371 CO 0.00 0.28 -0.34 0.00 0.10 0.00 0.00 179.97 180.02 1d6m s TRP 373 N -4.38 1.31 -0.31 0.00 0.52 -1.26 -1.88 118.94 112.94 1d6m s TRP 373 Ca -0.08 0.69 0.01 0.00 0.02 0.00 0.00 56.10 56.73 1d6m s TRP 373 Cb 0.13 -3.94 0.19 0.00 -1.15 0.00 0.00 33.47 28.70 1d6m s TRP 373 CO 0.83 -3.60 0.75 0.34 0.02 0.00 0.00 176.95 175.28 1d6m s ASP 374 N 8.26 -1.22 0.46 2.95 -1.08 0.17 -4.85 116.67 121.37 1d6m s ASP 374 Ca 0.95 -0.03 0.19 0.00 -0.52 0.00 0.00 52.55 53.14 1d6m s ASP 374 Cb -0.28 1.71 1.18 0.00 -1.46 0.00 0.00 42.92 44.06 1d6m s ASP 374 CO 0.33 -0.20 1.95 0.44 0.52 0.00 0.00 175.17 178.21 1d6m h ASP 375 N 7.45 0.25 1.02 -0.34 3.32 -1.90 0.66 116.42 126.87 1d6m h ASP 375 Ca -0.02 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1d6m h ASP 375 Cb 1.19 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1d6m h ASP 375 CO 0.06 0.13 -0.01 0.11 -1.72 0.00 0.00 179.24 177.82 1d6m h LYS 376 N 0.27 0.00 -0.55 3.56 1.57 -1.95 -3.14 116.57 116.33 1d6m h LYS 376 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1d6m h LYS 376 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1d6m h LYS 376 CO -0.08 0.01 0.00 1.63 -0.57 0.00 0.00 179.45 180.44 1d6m n LYS 377 N -3.10 2.99 -4.20 3.15 5.02 0.22 -4.96 118.16 117.28 1d6m n LYS 377 Ca 0.01 -2.50 -0.16 0.00 -2.02 0.00 0.00 58.31 53.64 1d6m n LYS 377 Cb 0.31 -1.54 -0.13 0.00 -0.02 0.00 0.00 35.03 33.65 1d6m n LYS 377 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1d6m s VAL 378 N -1.27 0.66 0.00 -0.18 -7.23 -1.19 -4.70 120.40 106.49 1d6m s VAL 378 Ca 0.40 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.84 1d6m s VAL 378 Cb 0.23 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.54 1d6m s VAL 378 CO 0.24 -0.07 0.00 -0.67 -0.31 0.00 0.00 175.10 174.28 1d6m n ASP 379 N 2.17 0.00 0.01 4.85 2.03 -1.26 -4.90 116.55 119.46 1d6m n ASP 379 Ca -0.18 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.09 1d6m n ASP 379 Cb 0.56 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.85 1d6m n ASP 379 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1d6m h ALA 380 N 0.35 0.69 -2.67 -1.67 0.00 -1.99 -3.48 119.26 110.48 1d6m h ALA 380 Ca 0.00 -1.13 -0.07 0.00 0.00 0.00 0.00 54.91 53.71 1d6m h ALA 380 Cb 0.00 0.33 -0.13 0.00 0.00 0.00 0.00 17.79 18.00 1d6m h ALA 380 CO 0.00 1.24 -0.21 -3.38 0.00 0.00 0.00 179.25 176.91 1d6m s HIS 381 N -2.76 0.07 0.00 0.00 -3.43 -1.25 -4.84 115.29 103.09 1d6m s HIS 381 Ca -0.03 -0.44 0.00 0.00 -0.80 0.00 0.00 55.06 53.79 1d6m s HIS 381 Cb 0.08 0.11 0.00 0.00 -1.43 0.00 0.00 32.58 31.34 1d6m s HIS 381 CO 0.82 -0.70 0.00 -2.39 -2.00 0.00 0.00 174.74 170.47 1d6m n HIS 382 N -0.20 0.00 -1.52 0.38 1.44 -1.26 -4.77 115.22 109.30 1d6m n HIS 382 Ca -0.12 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.26 1d6m n HIS 382 Cb 0.63 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.81 1d6m n HIS 382 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1d6m s ALA 383 N -2.00 2.26 -0.47 1.59 0.00 -0.86 -4.65 121.76 117.63 1d6m s ALA 383 Ca 0.00 0.62 -0.28 0.00 0.00 0.00 0.00 51.96 52.30 1d6m s ALA 383 Cb 0.00 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.75 1d6m s ALA 383 CO 0.00 -1.63 1.58 0.42 0.00 0.00 0.00 175.76 176.13 1d6m s ILE 384 N -2.32 3.67 0.20 0.00 1.01 0.65 -4.87 121.20 119.54 1d6m s ILE 384 Ca 0.68 0.62 0.06 0.00 0.00 0.00 0.00 60.65 62.01 1d6m s ILE 384 Cb -0.23 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 1d6m s ILE 384 CO 0.46 -0.81 -0.09 0.27 0.00 0.00 0.00 174.94 174.77 1d6m s ILE 385 N 6.56 1.38 1.13 2.92 -4.36 -1.26 -4.35 121.20 123.23 1d6m s ILE 385 Ca 0.64 -2.11 -0.15 0.00 -0.26 0.00 0.00 60.65 58.77 1d6m s ILE 385 Cb -0.15 -2.11 0.26 0.00 1.25 0.00 0.00 42.46 41.70 1d6m s ILE 385 CO 0.29 -0.54 1.07 -2.84 0.24 0.00 0.00 174.94 173.16 1d6m s PRO 386 N -3.74 -0.67 0.28 0.37 0.02 -1.26 -0.70 135.00 129.31 1d6m s PRO 386 Ca 0.23 0.37 0.02 0.00 0.02 0.00 0.00 61.00 61.64 1d6m s PRO 386 Cb 0.02 -1.62 0.02 0.00 0.02 0.00 0.00 34.50 32.94 1d6m s PRO 386 CO 0.06 -3.44 0.14 2.41 -0.33 0.00 0.00 177.00 175.84 1d6m n THR 387 N -4.64 0.00 1.02 0.99 -1.04 -1.26 -4.64 114.28 104.70 1d6m n THR 387 Ca 0.07 -1.20 0.12 0.00 -2.04 0.00 0.00 64.05 61.00 1d6m n THR 387 Cb 0.58 -0.07 0.31 0.00 -1.82 0.00 0.00 70.33 69.33 1d6m n THR 387 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1d6m n ALA 388 N -2.30 2.50 -1.70 2.41 0.00 -1.26 -4.53 120.51 115.62 1d6m n ALA 388 Ca -0.10 -0.66 -0.42 0.00 0.00 0.00 0.00 53.44 52.26 1d6m n ALA 388 Cb 0.34 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 1d6m n ALA 388 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1d6m s ARG 389 N -1.82 4.14 -0.00 0.00 6.06 -1.26 -4.69 118.95 121.38 1d6m s ARG 389 Ca 0.34 2.59 0.09 0.00 -2.50 0.00 0.00 55.73 56.26 1d6m s ARG 389 Cb 0.20 -3.93 -0.11 0.00 0.06 0.00 0.00 34.95 31.17 1d6m s ARG 389 CO 0.30 -0.91 0.32 -1.13 -2.50 0.00 0.00 175.30 171.39 1d6m n SER 390 N 6.79 1.24 -4.69 -2.12 3.41 -1.26 -4.69 113.62 112.30 1d6m n SER 390 Ca 0.19 -0.48 -0.53 0.00 -0.26 0.00 0.00 58.87 57.79 1d6m n SER 390 Cb 0.40 1.14 -0.06 0.00 -0.26 0.00 0.00 64.21 65.43 1d6m n SER 390 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1d6m n SER 391 N -1.42 2.86 -4.68 4.04 7.64 -1.26 -4.84 113.62 115.96 1d6m n SER 391 Ca 0.01 1.00 -0.61 0.00 1.01 0.00 0.00 58.87 60.27 1d6m n SER 391 Cb 0.17 -1.25 -0.08 0.00 -1.01 0.00 0.00 64.21 62.04 1d6m n SER 391 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d6m n ALA 392 N 6.19 -1.22 -2.63 -0.43 0.00 -1.26 -4.95 120.51 116.21 1d6m n ALA 392 Ca 0.26 0.48 -0.20 0.00 0.00 0.00 0.00 53.44 53.97 1d6m n ALA 392 Cb 0.21 -2.03 -0.14 0.00 0.00 0.00 0.00 19.45 17.49 1d6m n ALA 392 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1d6m s ILE 393 N 2.46 1.09 -0.24 0.00 1.01 -1.26 -5.14 121.20 119.12 1d6m s ILE 393 Ca 0.98 -0.88 -0.16 0.00 0.00 0.00 0.00 60.65 60.59 1d6m s ILE 393 Cb -1.25 -0.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1d6m s ILE 393 CO 0.68 0.09 0.41 0.20 0.00 0.00 0.00 174.94 176.32 1d6m s ASN 394 N -0.91 6.35 -0.03 3.58 0.01 -1.26 -5.05 114.94 117.63 1d6m s ASN 394 Ca 0.03 0.42 0.07 0.00 -0.71 0.00 0.00 52.86 52.66 1d6m s ASN 394 Cb -0.07 -2.23 -0.02 0.00 0.41 0.00 0.00 41.25 39.34 1d6m s ASN 394 CO 0.01 -0.17 -0.25 -0.76 -1.51 0.00 0.00 177.10 174.42 1d6m s LEU 395 N 1.85 2.05 0.82 0.60 1.43 -1.26 -5.11 118.68 119.07 1d6m s LEU 395 Ca 0.18 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.69 1d6m s LEU 395 Cb -0.15 -1.33 0.09 0.00 0.03 0.00 0.00 46.19 44.83 1d6m s LEU 395 CO 0.09 0.29 1.12 0.42 0.23 0.00 0.00 176.35 178.50 1d6m s THR 396 N -0.45 2.74 0.29 5.49 -4.23 -1.26 -4.67 115.64 113.55 1d6m s THR 396 Ca 0.05 0.25 0.04 0.00 -1.18 0.00 0.00 61.69 60.85 1d6m s THR 396 Cb -0.11 -2.55 0.28 0.00 1.34 0.00 0.00 72.50 71.46 1d6m s THR 396 CO 0.01 -0.30 1.72 -0.08 -0.54 0.00 0.00 174.62 175.42 1d6m h GLU 397 N -1.34 0.47 -0.46 3.99 4.81 -1.99 0.15 114.58 120.21 1d6m h GLU 397 Ca -0.44 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 58.66 1d6m h GLU 397 Cb 1.25 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 1d6m h GLU 397 CO 0.47 0.31 -0.15 -0.91 -0.73 0.00 0.00 179.01 178.00 1d6m h ASN 398 N 0.49 0.87 -0.27 1.04 4.21 -1.99 -1.21 115.58 118.72 1d6m h ASN 398 Ca 0.56 -0.29 -0.00 0.00 1.21 0.00 0.00 56.30 57.78 1d6m h ASN 398 Cb 1.01 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.96 1d6m h ASN 398 CO -0.48 1.02 0.17 -0.33 -1.29 0.00 0.00 177.43 176.51 1d6m h GLU 399 N 0.77 0.36 0.35 0.81 5.08 -1.33 0.08 114.58 120.69 1d6m h GLU 399 Ca 0.12 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1d6m h GLU 399 Cb 0.68 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1d6m h GLU 399 CO 0.05 0.27 -0.50 0.00 -1.00 0.00 0.00 179.01 177.84 1d6m h ALA 400 N 1.07 -1.08 -0.78 3.43 0.00 -1.32 0.22 119.26 120.79 1d6m h ALA 400 Ca 0.10 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1d6m h ALA 400 Cb 0.00 0.78 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1d6m h ALA 400 CO -0.02 -1.15 -0.46 0.87 0.00 0.00 0.00 179.25 178.49 1d6m h LYS 401 N -0.88 -0.00 -0.53 0.00 1.79 -0.66 0.36 116.57 116.64 1d6m h LYS 401 Ca -0.04 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.47 1d6m h LYS 401 Cb 0.80 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.41 1d6m h LYS 401 CO -0.14 -0.00 0.28 0.28 -1.08 0.00 0.00 179.45 178.79 1d6m h VAL 402 N -0.00 0.98 -0.22 0.50 2.07 -0.82 -2.57 116.25 116.19 1d6m h VAL 402 Ca 0.12 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1d6m h VAL 402 Cb 0.32 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1d6m h VAL 402 CO -0.73 0.10 0.07 0.22 0.02 0.00 0.00 177.57 177.25 1d6m h TYR 403 N 0.55 0.12 -0.50 1.57 3.20 0.19 -1.85 116.97 120.26 1d6m h TYR 403 Ca 0.23 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.17 1d6m h TYR 403 Cb 0.11 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 38.27 1d6m h TYR 403 CO -0.09 0.06 -0.57 -0.97 -1.64 0.00 0.00 178.16 174.95 1d6m h ASN 404 N 0.17 -1.92 -0.52 -2.11 -1.24 -0.03 0.20 115.58 110.12 1d6m h ASN 404 Ca 0.10 0.26 0.09 0.00 0.71 0.00 0.00 56.30 57.46 1d6m h ASN 404 Cb 0.07 0.80 -0.10 0.00 0.73 0.00 0.00 38.32 39.81 1d6m h ASN 404 CO -0.10 -0.38 -0.36 -0.07 -1.29 0.00 0.00 177.43 175.23 1d6m h LEU 405 N -0.34 -1.21 0.02 0.34 4.07 -1.19 0.66 115.31 117.66 1d6m h LEU 405 Ca 0.09 0.22 0.02 0.00 0.08 0.00 0.00 57.88 58.28 1d6m h LEU 405 Cb 0.57 0.58 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 1d6m h LEU 405 CO -0.65 -0.32 -0.12 0.40 -1.08 0.00 0.00 178.44 176.67 1d6m h ILE 406 N -0.21 0.71 -0.13 1.22 2.04 -0.34 -2.30 117.51 118.49 1d6m h ILE 406 Ca 0.20 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.10 1d6m h ILE 406 Cb 0.55 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 1d6m h ILE 406 CO -0.63 0.00 -0.20 0.00 0.00 0.00 0.00 178.15 177.32 1d6m h ALA 407 N 0.73 -0.15 -0.28 1.87 0.00 0.61 -2.50 119.26 119.55 1d6m h ALA 407 Ca 0.04 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1d6m h ALA 407 Cb 0.25 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1d6m h ALA 407 CO -0.10 -0.66 0.04 -0.09 0.00 0.00 0.00 179.25 178.44 1d6m h ARG 408 N -0.26 0.13 -0.60 0.00 2.43 0.42 -0.02 114.38 116.49 1d6m h ARG 408 Ca 0.10 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1d6m h ARG 408 Cb 0.40 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.86 1d6m h ARG 408 CO -0.28 0.09 0.29 0.37 -1.51 0.00 0.00 179.97 178.92 1d6m h GLN 409 N 0.14 0.51 -0.08 0.20 5.75 -1.37 0.20 115.11 120.45 1d6m h GLN 409 Ca 0.13 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.60 1d6m h GLN 409 Cb 0.14 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.58 1d6m h GLN 409 CO -0.18 0.34 0.04 -0.92 -2.65 0.00 0.00 178.83 175.45 1d6m h TYR 410 N 0.53 0.11 -0.72 3.99 3.20 -0.95 -2.70 116.97 120.43 1d6m h TYR 410 Ca 0.28 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.23 1d6m h TYR 410 Cb 0.25 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.42 1d6m h TYR 410 CO -0.12 0.18 0.38 -0.07 -1.64 0.00 0.00 178.16 176.89 1d6m h LEU 411 N 0.01 0.52 -0.89 2.82 3.38 -0.25 -1.55 115.31 119.35 1d6m h LEU 411 Ca 0.03 0.05 0.24 0.00 0.09 0.00 0.00 57.88 58.29 1d6m h LEU 411 Cb 0.11 -0.04 -0.15 0.00 0.09 0.00 0.00 40.66 40.66 1d6m h LEU 411 CO -0.00 0.31 0.12 0.24 0.09 0.00 0.00 178.44 179.20 1d6m h MET 412 N 0.66 0.11 0.00 1.13 2.86 -0.29 -0.83 114.93 118.57 1d6m h MET 412 Ca 0.35 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 1d6m h MET 412 Cb 0.33 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1d6m h MET 412 CO -0.24 0.07 0.40 1.96 1.06 0.00 0.00 176.91 180.15 1d6m h GLN 413 N 0.11 0.00 -0.27 1.72 7.50 -1.29 0.27 115.11 123.15 1d6m h GLN 413 Ca 0.55 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.70 1d6m h GLN 413 Cb 1.10 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.63 1d6m h GLN 413 CO -0.75 0.00 0.00 1.19 -1.50 0.00 0.00 178.83 177.77 1d6m n PHE 414 N -2.14 0.71 -4.78 2.96 3.72 -0.31 -4.33 117.46 113.28 1d6m n PHE 414 Ca -0.01 -0.74 -0.31 0.00 -0.05 0.00 0.00 57.45 56.34 1d6m n PHE 414 Cb 0.42 -0.20 -0.13 0.00 -0.94 0.00 0.00 39.48 38.63 1d6m n PHE 414 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1d6m s PRO 416 N -1.21 1.24 0.56 0.00 0.04 -1.26 -4.51 135.00 129.85 1d6m s PRO 416 Ca 0.13 1.65 -0.21 0.00 0.04 0.00 0.00 61.00 62.61 1d6m s PRO 416 Cb -0.10 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.65 1d6m s PRO 416 CO 0.04 -2.49 1.35 -0.25 0.04 0.00 0.00 177.00 175.68 1d6m n ASP 417 N -3.86 2.62 -4.80 6.66 8.00 -1.26 -1.03 116.55 122.87 1d6m n ASP 417 Ca 0.13 0.96 -0.35 0.00 0.71 0.00 0.00 54.79 56.24 1d6m n ASP 417 Cb 0.51 -1.57 -0.06 0.00 -0.02 0.00 0.00 41.12 39.98 1d6m n ASP 417 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d6m s ALA 418 N -1.30 3.09 -0.11 2.24 0.00 0.14 -4.44 121.76 121.38 1d6m s ALA 418 Ca 0.73 0.48 0.02 0.00 0.00 0.00 0.00 51.96 53.18 1d6m s ALA 418 Cb -0.41 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 19.54 1d6m s ALA 418 CO 0.48 0.09 -0.18 0.08 0.00 0.00 0.00 175.76 176.24 1d6m s VAL 419 N -1.95 1.67 -0.18 0.00 1.01 0.11 -0.28 120.40 120.79 1d6m s VAL 419 Ca 0.58 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 1d6m s VAL 419 Cb -0.14 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1d6m s VAL 419 CO 0.18 0.47 0.04 -0.36 0.00 0.00 0.00 175.10 175.43 1d6m s PHE 420 N 0.86 3.18 -0.36 5.22 0.08 0.27 -0.17 117.98 127.05 1d6m s PHE 420 Ca -0.08 -0.06 -0.19 0.00 0.12 0.00 0.00 56.93 56.71 1d6m s PHE 420 Cb -0.15 -2.06 0.00 0.00 -0.57 0.00 0.00 43.02 40.24 1d6m s PHE 420 CO -0.00 0.07 0.57 0.50 -0.10 0.00 0.00 175.22 176.25 1d6m s ARG 421 N 0.46 3.61 -0.16 0.44 6.06 -0.66 0.52 118.95 129.21 1d6m s ARG 421 Ca 0.01 -0.10 0.02 0.00 -2.50 0.00 0.00 55.73 53.16 1d6m s ARG 421 Cb -0.13 -3.82 0.01 0.00 0.06 0.00 0.00 34.95 31.07 1d6m s ARG 421 CO 0.01 -0.71 -0.20 0.21 -2.50 0.00 0.00 175.30 172.11 1d6m s LYS 422 N 2.54 3.02 -0.08 5.12 2.20 -0.09 -1.63 119.74 130.82 1d6m s LYS 422 Ca 0.21 -0.83 0.01 0.00 -0.36 0.00 0.00 55.97 55.00 1d6m s LYS 422 Cb -0.15 -2.52 0.02 0.00 -1.51 0.00 0.00 37.83 33.67 1d6m s LYS 422 CO 0.14 -0.12 -0.09 0.00 -0.36 0.00 0.00 175.35 174.92 1d6m s VAL 424 N 1.09 2.48 -0.24 0.00 1.01 -0.25 -2.52 120.40 121.95 1d6m s VAL 424 Ca -0.07 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 1d6m s VAL 424 Cb -0.14 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 1d6m s VAL 424 CO -0.01 0.51 0.00 -0.63 0.00 0.00 0.00 175.10 174.97 1d6m s ILE 425 N 1.16 3.63 -0.26 2.22 1.01 0.46 -1.27 121.20 128.15 1d6m s ILE 425 Ca 0.01 -0.51 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 1d6m s ILE 425 Cb -0.14 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 1d6m s ILE 425 CO -0.07 0.32 0.12 -1.61 0.00 0.00 0.00 174.94 173.71 1d6m s GLU 426 N 1.50 3.78 0.20 2.79 2.02 -0.81 -1.09 118.70 127.09 1d6m s GLU 426 Ca 0.05 -0.41 0.07 0.00 0.02 0.00 0.00 54.97 54.70 1d6m s GLU 426 Cb -0.15 -3.46 -0.04 0.00 0.10 0.00 0.00 34.13 30.58 1d6m s GLU 426 CO -0.01 -0.18 0.07 -0.51 0.02 0.00 0.00 175.26 174.65 1d6m s LEU 427 N 1.65 3.51 -0.28 1.80 1.43 0.20 -0.95 118.68 126.03 1d6m s LEU 427 Ca 0.07 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1d6m s LEU 427 Cb -0.15 -2.11 0.03 0.00 0.03 0.00 0.00 46.19 43.99 1d6m s LEU 427 CO 0.06 0.05 0.00 -1.81 0.23 0.00 0.00 176.35 174.88 1d6m s ASP 428 N -3.27 4.77 -0.14 2.29 1.11 -0.57 -0.55 116.67 120.31 1d6m s ASP 428 Ca 0.30 -1.01 0.01 0.00 0.18 0.00 0.00 52.55 52.02 1d6m s ASP 428 Cb -0.09 -1.74 0.02 0.00 1.07 0.00 0.00 42.92 42.18 1d6m s ASP 428 CO 0.21 -0.21 -0.15 -0.63 1.18 0.00 0.00 175.17 175.58 1d6m s ILE 429 N 1.34 1.56 -1.62 0.77 1.01 -0.88 -1.45 121.20 121.94 1d6m s ILE 429 Ca -0.02 -0.64 -0.14 0.00 0.00 0.00 0.00 60.65 59.86 1d6m s ILE 429 Cb -0.18 -1.46 0.11 0.00 0.01 0.00 0.00 42.46 40.95 1d6m s ILE 429 CO -0.01 0.46 0.71 0.00 0.00 0.00 0.00 174.94 176.09 1d6m n ALA 430 N 4.61 -1.44 -0.39 9.38 0.00 -1.26 -0.86 120.51 130.54 1d6m n ALA 430 Ca -0.18 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1d6m n ALA 430 Cb 0.50 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.88 1d6m n ALA 430 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1d6m n LYS 431 N -4.42 0.00 -4.69 0.00 5.02 -1.26 -5.01 118.16 107.81 1d6m n LYS 431 Ca -0.02 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.93 1d6m n LYS 431 Cb 0.54 -1.80 -0.13 0.00 -0.02 0.00 0.00 35.03 33.63 1d6m n LYS 431 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1d6m s GLY 432 N -1.97 1.62 -0.09 0.72 0.00 -0.04 -5.09 107.32 102.47 1d6m s GLY 432 Ca 0.00 -0.90 -0.30 0.00 0.00 0.00 0.00 44.72 43.53 1d6m s GLY 432 CO 0.00 -0.45 1.06 0.54 0.00 0.00 0.00 173.10 174.25 1d6m s LYS 433 N -0.27 4.41 0.13 2.90 -0.14 -1.26 -2.06 119.74 123.45 1d6m s LYS 433 Ca 0.03 1.47 0.06 0.00 -1.36 0.00 0.00 55.97 56.17 1d6m s LYS 433 Cb -0.13 -3.54 -0.04 0.00 -1.68 0.00 0.00 37.83 32.44 1d6m s LYS 433 CO 0.03 -0.34 -0.02 -0.06 -0.76 0.00 0.00 175.35 174.20 1d6m s PHE 434 N 2.01 2.88 0.07 3.18 0.40 0.29 -1.64 117.98 125.16 1d6m s PHE 434 Ca 0.51 -0.10 0.06 0.00 -0.60 0.00 0.00 56.93 56.80 1d6m s PHE 434 Cb -0.20 -1.45 -0.03 0.00 0.51 0.00 0.00 43.02 41.85 1d6m s PHE 434 CO 0.19 0.48 -0.17 0.08 0.70 0.00 0.00 175.22 176.51 1d6m s VAL 435 N -1.47 1.35 -0.07 -0.44 1.01 -0.54 -0.63 120.40 119.61 1d6m s VAL 435 Ca 0.26 -1.28 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1d6m s VAL 435 Cb -0.11 -1.24 0.04 0.00 0.00 0.00 0.00 36.38 35.07 1d6m s VAL 435 CO 0.18 -0.07 0.16 0.00 0.00 0.00 0.00 175.10 175.36 1d6m s ALA 436 N -1.08 -0.27 0.13 5.51 0.00 -0.25 0.35 121.76 126.16 1d6m s ALA 436 Ca 0.02 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.66 1d6m s ALA 436 Cb -0.09 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1d6m s ALA 436 CO 0.03 -0.22 0.05 -1.59 0.00 0.00 0.00 175.76 174.02 1d6m s LYS 437 N 1.35 0.92 -0.21 0.00 -2.85 -1.26 -0.40 119.74 117.28 1d6m s LYS 437 Ca -0.07 -1.43 -0.16 0.00 -1.00 0.00 0.00 55.97 53.31 1d6m s LYS 437 Cb -0.12 0.22 0.06 0.00 -2.06 0.00 0.00 37.83 35.94 1d6m s LYS 437 CO -0.06 -0.25 0.55 0.00 0.10 0.00 0.00 175.35 175.69 1d6m s ALA 438 N -4.03 -1.40 -0.07 0.59 0.00 -1.05 -4.59 121.76 111.21 1d6m s ALA 438 Ca 0.23 1.76 0.03 0.00 0.00 0.00 0.00 51.96 53.98 1d6m s ALA 438 Cb 0.07 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1d6m s ALA 438 CO 0.01 -0.29 -0.17 0.50 0.00 0.00 0.00 175.76 175.81 1d6m s ARG 439 N 0.91 2.17 -0.23 0.00 3.52 -0.49 -1.66 118.95 123.17 1d6m s ARG 439 Ca -0.05 -0.61 -0.20 0.00 -0.13 0.00 0.00 55.73 54.73 1d6m s ARG 439 Cb -0.05 -1.74 0.06 0.00 -1.56 0.00 0.00 34.95 31.66 1d6m s ARG 439 CO -0.08 0.13 0.60 -0.59 -0.81 0.00 0.00 175.30 174.55 1d6m s PHE 440 N 0.41 -0.68 0.09 5.12 -0.12 -0.65 -0.65 117.98 121.51 1d6m s PHE 440 Ca -0.13 1.62 -0.31 0.00 -0.05 0.00 0.00 56.93 58.06 1d6m s PHE 440 Cb -0.16 0.25 -0.10 0.00 -0.63 0.00 0.00 43.02 42.38 1d6m s PHE 440 CO 0.05 -0.33 1.90 1.28 -0.05 0.00 0.00 175.22 178.08 1d6m n LEU 441 N 2.87 4.13 -0.08 -1.99 4.77 -1.26 -1.65 117.00 123.79 1d6m n LEU 441 Ca -0.14 0.95 -0.10 0.00 -0.03 0.00 0.00 56.01 56.69 1d6m n LEU 441 Cb 0.56 -1.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.00 1d6m n LEU 441 CO 0.06 0.20 -1.03 0.00 -1.33 0.00 0.00 177.39 175.29 1d6m n ALA 442 N 6.46 1.62 -3.71 -1.18 0.00 0.76 -4.85 120.51 119.60 1d6m n ALA 442 Ca 0.19 -0.91 -0.29 0.00 0.00 0.00 0.00 53.44 52.43 1d6m n ALA 442 Cb 0.39 -0.01 -0.15 0.00 0.00 0.00 0.00 19.45 19.67 1d6m n ALA 442 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1d6m s GLU 443 N -2.36 0.65 0.29 0.00 2.02 -1.01 -4.97 118.70 113.32 1d6m s GLU 443 Ca -0.14 -0.83 -0.01 0.00 0.02 0.00 0.00 54.97 54.01 1d6m s GLU 443 Cb 0.05 -1.92 0.43 0.00 0.10 0.00 0.00 34.13 32.79 1d6m s GLU 443 CO 0.54 -0.89 1.90 0.00 0.02 0.00 0.00 175.26 176.83 1d6m h ALA 444 N 8.17 1.32 -0.25 5.21 0.00 -1.89 0.31 119.26 132.14 1d6m h ALA 444 Ca -0.15 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1d6m h ALA 444 Cb 1.04 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1d6m h ALA 444 CO 0.43 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.63 1d6m n GLY 445 N -1.14 2.74 0.33 0.00 0.00 -1.26 -1.12 105.19 104.74 1d6m n GLY 445 Ca 0.06 -0.03 0.16 0.00 0.00 0.00 0.00 46.02 46.21 1d6m n GLY 445 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1d6m h TRP 446 N 0.00 0.87 0.00 1.61 5.08 -1.31 0.41 115.95 122.62 1d6m h TRP 446 Ca 0.00 0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.01 1d6m h TRP 446 Cb 0.00 -0.24 0.00 0.00 -3.00 0.00 0.00 29.16 25.92 1d6m h TRP 446 CO 0.00 0.03 0.00 0.54 -1.28 0.00 0.00 178.44 177.73 1d6m n ARG 447 N -4.95 0.09 -0.04 0.12 1.74 -0.28 -2.00 116.66 111.34 1d6m n ARG 447 Ca 0.25 0.10 -0.05 0.00 -0.77 0.00 0.00 57.85 57.37 1d6m n ARG 447 Cb 0.70 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.79 1d6m n ARG 447 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1d6m h THR 448 N 0.00 1.27 -0.41 0.55 1.35 -0.23 -2.70 112.91 112.74 1d6m h THR 448 Ca 0.00 -1.28 0.08 0.00 -0.55 0.00 0.00 66.41 64.66 1d6m h THR 448 Cb 0.01 1.24 -0.02 0.00 -1.73 0.00 0.00 68.15 67.65 1d6m h THR 448 CO 0.00 0.42 0.28 -0.07 -0.25 0.00 0.00 175.52 175.90 1d6m h LEU 449 N 0.57 0.19-10.38 3.87 3.38 -1.60 -3.43 115.31 107.91 1d6m h LEU 449 Ca 0.08 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.58 1d6m h LEU 449 Cb 0.68 -0.04 0.14 0.00 0.09 0.00 0.00 40.66 41.53 1d6m h LEU 449 CO 0.05 0.12 0.27 -0.76 0.09 0.00 0.00 178.44 178.21 1d6m s LEU 450 N -9.13 2.21 0.63 1.67 1.43 -1.02 -5.02 118.68 109.45 1d6m s LEU 450 Ca -0.06 1.30 -0.11 0.00 -1.03 0.00 0.00 54.13 54.23 1d6m s LEU 450 Cb 0.19 -3.73 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 1d6m s LEU 450 CO 0.72 -2.52 1.04 -0.83 0.23 0.00 0.00 176.35 174.99 1d6m s GLY 451 N -3.66 1.66 0.08 -3.19 0.00 -1.26 -4.65 107.32 96.29 1d6m s GLY 451 Ca 0.63 -0.10 -0.16 0.00 0.00 0.00 0.00 44.72 45.09 1d6m s GLY 451 CO 0.56 0.18 1.19 -1.26 0.00 0.00 0.00 173.10 173.77 1d6m n SER 452 N -2.80 -0.54 -0.07 1.64 2.88 -1.26 0.02 113.62 113.50 1d6m n SER 452 Ca 0.06 1.31 -0.08 0.00 -1.33 0.00 0.00 58.87 58.84 1d6m n SER 452 Cb 0.54 -0.32 -0.01 0.00 -0.75 0.00 0.00 64.21 63.67 1d6m n SER 452 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1d6m h LYS 453 N 0.00 -0.21 -0.48 -1.46 3.11 -1.97 -1.82 116.57 113.75 1d6m h LYS 453 Ca 0.08 0.01 0.01 0.00 -2.81 0.00 0.00 60.65 57.95 1d6m h LYS 453 Cb 0.21 0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 31.46 1d6m h LYS 453 CO -0.48 -0.14 0.30 0.93 -2.81 0.00 0.00 179.45 177.25 1d6m h GLU 454 N -0.22 0.59 -0.61 1.90 5.08 -1.62 -1.95 114.58 117.75 1d6m h GLU 454 Ca 0.15 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1d6m h GLU 454 Cb 0.45 -0.13 -0.10 0.00 0.50 0.00 0.00 28.75 29.47 1d6m h GLU 454 CO -0.41 0.39 -0.51 -0.09 -1.00 0.00 0.00 179.01 177.39 1d6m h ARG 455 N 0.61 -0.23 -0.59 2.33 2.43 0.37 -2.32 114.38 116.97 1d6m h ARG 455 Ca 0.18 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1d6m h ARG 455 Cb -0.03 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1d6m h ARG 455 CO -0.06 -0.15 0.00 -0.25 -1.51 0.00 0.00 179.97 178.00 1d6m n ASP 456 N -5.37 2.43 0.11 -3.80 8.00 -0.76 -4.49 116.55 112.66 1d6m n ASP 456 Ca 0.00 -2.22 0.03 0.00 0.71 0.00 0.00 54.79 53.31 1d6m n ASP 456 Cb 0.33 -0.41 0.40 0.00 -0.02 0.00 0.00 41.12 41.42 1d6m n ASP 456 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1d6m h GLU 457 N 1.77 0.27 -0.00 -1.24 4.11 -0.77 -2.67 114.58 116.06 1d6m h GLU 457 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.38 1d6m h GLU 457 Cb 0.81 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1d6m h GLU 457 CO 0.12 0.36 -0.19 0.39 0.07 0.00 0.00 179.01 179.76 1d6m n GLU 458 N -4.31 0.30 -1.73 1.06 1.02 -1.26 -4.84 120.64 110.87 1d6m n GLU 458 Ca -0.00 -0.11 -0.42 0.00 -0.02 0.00 0.00 57.16 56.61 1d6m n GLU 458 Cb 0.23 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.13 1d6m n GLU 458 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1d6m n ASN 459 N -1.25 3.93 -3.50 1.62 5.03 -1.01 -4.78 115.26 115.30 1d6m n ASN 459 Ca 0.10 1.11 -0.20 0.00 0.87 0.00 0.00 54.58 56.46 1d6m n ASN 459 Cb 0.31 -1.59 -0.13 0.00 -1.02 0.00 0.00 39.78 37.35 1d6m n ASN 459 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1d6m s ASP 460 N 0.81 1.65 0.00 6.41 2.15 0.18 -4.98 116.67 122.89 1d6m s ASP 460 Ca 0.69 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 53.29 1d6m s ASP 460 Cb -0.50 0.27 0.00 0.00 -0.30 0.00 0.00 42.92 42.39 1d6m s ASP 460 CO 0.41 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.68 1d6m n GLY 461 N 5.31 2.28 3.82 2.66 0.00 -1.26 -1.39 105.19 116.61 1d6m n GLY 461 Ca -0.05 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 1d6m n GLY 461 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1d6m s THR 462 N -2.90 4.58 0.59 2.61 -4.23 -1.26 -4.67 115.64 110.36 1d6m s THR 462 Ca 0.00 1.22 -0.20 0.00 -1.18 0.00 0.00 61.69 61.54 1d6m s THR 462 Cb 0.00 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 70.00 1d6m s THR 462 CO 0.00 0.12 1.33 -2.84 -0.54 0.00 0.00 174.62 172.69 1d6m s PRO 463 N -2.21 2.86 0.17 3.99 0.02 -1.26 -4.63 135.00 133.94 1d6m s PRO 463 Ca 0.46 2.16 0.05 0.00 0.02 0.00 0.00 61.00 63.69 1d6m s PRO 463 Cb -0.15 -2.06 -0.04 0.00 0.02 0.00 0.00 34.50 32.27 1d6m s PRO 463 CO 0.20 -1.39 0.14 -0.51 -0.33 0.00 0.00 177.00 175.12 1d6m s LEU 464 N -3.93 3.81 0.68 -5.54 1.43 -1.26 -5.00 118.68 108.88 1d6m s LEU 464 Ca 0.77 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.63 1d6m s LEU 464 Cb -0.39 -2.42 -0.00 0.00 0.03 0.00 0.00 46.19 43.41 1d6m s LEU 464 CO 0.44 0.06 1.06 -2.16 0.23 0.00 0.00 176.35 175.98 1d6m s PRO 465 N -3.14 3.05 -0.21 1.29 0.04 -1.26 -4.99 135.00 129.79 1d6m s PRO 465 Ca 0.31 0.87 -0.24 0.00 0.04 0.00 0.00 61.00 61.97 1d6m s PRO 465 Cb -0.10 -2.01 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1d6m s PRO 465 CO 0.24 -1.00 0.81 0.08 0.04 0.00 0.00 177.00 177.17 1d6m s VAL 466 N -3.10 4.87 0.10 -0.36 1.01 -1.26 -5.01 120.40 116.66 1d6m s VAL 466 Ca 0.57 1.56 0.03 0.00 0.00 0.00 0.00 61.98 64.14 1d6m s VAL 466 Cb -0.13 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 1d6m s VAL 466 CO 0.55 -0.01 -0.08 -0.69 0.00 0.00 0.00 175.10 174.86 1d6m s VAL 467 N 2.45 0.82 0.09 2.92 1.01 -1.26 -5.15 120.40 121.28 1d6m s VAL 467 Ca 0.36 -1.72 0.04 0.00 0.00 0.00 0.00 61.98 60.65 1d6m s VAL 467 Cb -0.16 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1d6m s VAL 467 CO 0.10 -0.67 -0.10 0.00 0.00 0.00 0.00 175.10 174.43 1d6m s ALA 468 N -2.83 1.04 -0.06 5.51 0.00 -1.26 -4.89 121.76 119.27 1d6m s ALA 468 Ca 0.07 -1.12 -0.37 0.00 0.00 0.00 0.00 51.96 50.53 1d6m s ALA 468 Cb -0.00 0.02 -0.15 0.00 0.00 0.00 0.00 23.12 22.99 1d6m s ALA 468 CO -0.02 -0.02 1.60 1.17 0.00 0.00 0.00 175.76 178.49 1d6m n LYS 469 N 0.72 1.43 0.00 0.00 4.81 -1.26 -1.73 118.16 122.13 1d6m n LYS 469 Ca -0.17 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1d6m n LYS 469 Cb 0.57 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.40 1d6m n LYS 469 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1d6m n GLY 470 N 3.52 2.69 3.75 3.14 0.00 0.43 -4.97 105.19 113.75 1d6m n GLY 470 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1d6m n GLY 470 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d6m n ASP 471 N 0.00 3.26 -4.39 1.61 9.92 -0.70 -4.58 116.55 121.66 1d6m n ASP 471 Ca 0.00 1.14 -0.44 0.00 -0.53 0.00 0.00 54.79 54.96 1d6m n ASP 471 Cb 0.00 -1.58 -0.06 0.00 -0.64 0.00 0.00 41.12 38.84 1d6m n ASP 471 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1d6m s GLU 472 N -2.31 3.05 0.57 -1.24 2.12 -1.26 -1.27 118.70 118.36 1d6m s GLU 472 Ca 0.59 -1.23 0.07 0.00 0.36 0.00 0.00 54.97 54.76 1d6m s GLU 472 Cb -0.47 -4.19 0.07 0.00 0.26 0.00 0.00 34.13 29.80 1d6m s GLU 472 CO 0.59 -1.31 0.78 -0.51 -0.54 0.00 0.00 175.26 174.27 1d6m s LEU 473 N 2.34 3.21 -0.16 2.70 1.43 0.29 -4.77 118.68 123.72 1d6m s LEU 473 Ca 0.10 -0.61 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 1d6m s LEU 473 Cb -0.23 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.00 1d6m s LEU 473 CO 0.08 -1.30 -0.20 -0.22 0.23 0.00 0.00 176.35 174.93 1d6m s LEU 474 N -4.69 2.08 -0.50 1.79 2.96 -0.26 0.75 118.68 120.80 1d6m s LEU 474 Ca 0.61 -0.61 -0.28 0.00 -0.22 0.00 0.00 54.13 53.63 1d6m s LEU 474 Cb -0.07 -1.43 0.01 0.00 0.50 0.00 0.00 46.19 45.20 1d6m s LEU 474 CO 0.39 0.04 1.43 0.00 -1.32 0.00 0.00 176.35 176.89 1d6m h GLU 476 N 11.09 0.00 0.00 0.00 4.81 -0.41 -1.92 114.58 128.15 1d6m h GLU 476 Ca -0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1d6m h GLU 476 Cb 1.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1d6m h GLU 476 CO 1.14 0.51 0.00 0.36 -0.73 0.00 0.00 179.01 180.29 1d6m n LYS 477 N -3.94 0.00 -3.89 1.92 0.00 -1.23 -4.04 118.16 106.99 1d6m n LYS 477 Ca -0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.08 1d6m n LYS 477 Cb 0.52 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.51 1d6m n LYS 477 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1d6m s GLY 478 N 0.00 1.85 -0.03 2.58 0.00 -1.26 -1.11 107.32 109.35 1d6m s GLY 478 Ca 0.00 -1.72 -0.07 0.00 0.00 0.00 0.00 44.72 42.93 1d6m s GLY 478 CO 0.00 -1.64 0.17 -1.83 0.00 0.00 0.00 173.10 169.80 1d6m s GLU 479 N -3.96 0.40 -0.20 2.90 -1.05 -0.35 -4.96 118.70 111.48 1d6m s GLU 479 Ca 0.40 -0.14 -0.17 0.00 -0.15 0.00 0.00 54.97 54.92 1d6m s GLU 479 Cb -0.05 0.17 -0.04 0.00 -0.44 0.00 0.00 34.13 33.78 1d6m s GLU 479 CO 0.25 -0.09 0.46 0.08 0.95 0.00 0.00 175.26 176.92 1d6m s VAL 480 N -0.82 5.15 -0.27 1.83 1.01 -1.26 -1.50 120.40 124.55 1d6m s VAL 480 Ca -0.09 0.85 -0.09 0.00 0.00 0.00 0.00 61.98 62.64 1d6m s VAL 480 Cb -0.05 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1d6m s VAL 480 CO 0.01 0.22 0.14 -0.69 0.00 0.00 0.00 175.10 174.78 1d6m s VAL 481 N 1.43 4.86 -0.15 2.92 1.01 0.65 -4.96 120.40 126.17 1d6m s VAL 481 Ca 0.22 0.02 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 1d6m s VAL 481 Cb -0.15 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1d6m s VAL 481 CO 0.09 0.29 0.64 -1.61 0.00 0.00 0.00 175.10 174.52 1d6m s GLU 482 N 1.68 4.30 0.04 2.72 2.02 -1.26 -1.46 118.70 126.74 1d6m s GLU 482 Ca 0.07 0.70 0.05 0.00 0.02 0.00 0.00 54.97 55.81 1d6m s GLU 482 Cb -0.16 -3.52 -0.02 0.00 0.10 0.00 0.00 34.13 30.53 1d6m s GLU 482 CO 0.08 -0.10 -0.14 1.03 0.02 0.00 0.00 175.26 176.14 1d6m s ARG 483 N 1.43 0.93 -0.11 1.61 0.52 -0.23 -5.01 118.95 118.08 1d6m s ARG 483 Ca 0.32 -0.78 0.01 0.00 -0.52 0.00 0.00 55.73 54.75 1d6m s ARG 483 Cb -0.16 -0.94 -0.02 0.00 0.52 0.00 0.00 34.95 34.35 1d6m s ARG 483 CO 0.13 0.23 -0.14 -1.14 0.02 0.00 0.00 175.30 174.40 1d6m s GLN 484 N -1.20 3.22 0.76 3.54 0.74 -1.26 -0.26 119.66 125.20 1d6m s GLN 484 Ca 0.01 -0.69 -0.12 0.00 0.05 0.00 0.00 55.36 54.61 1d6m s GLN 484 Cb -0.08 -2.58 0.06 0.00 1.10 0.00 0.00 33.01 31.51 1d6m s GLN 484 CO 0.01 0.28 1.11 0.95 -0.55 0.00 0.00 175.29 177.10 1d6m s THR 485 N 0.16 3.04 0.02 -0.34 -4.23 0.01 -4.97 115.64 109.33 1d6m s THR 485 Ca -0.07 0.38 0.07 0.00 -1.18 0.00 0.00 61.69 60.89 1d6m s THR 485 Cb -0.15 -2.81 -0.03 0.00 1.34 0.00 0.00 72.50 70.85 1d6m s THR 485 CO 0.05 -0.40 -0.20 -1.10 -0.54 0.00 0.00 174.62 172.44 1d6m s GLN 486 N -4.60 2.10 0.63 3.99 -1.52 -1.26 -4.65 119.66 114.34 1d6m s GLN 486 Ca 0.64 -0.95 -0.15 0.00 -1.95 0.00 0.00 55.36 52.95 1d6m s GLN 486 Cb -0.20 -2.17 -0.02 0.00 -0.22 0.00 0.00 33.01 30.41 1d6m s GLN 486 CO 0.52 0.55 1.07 -1.25 -0.25 0.00 0.00 175.29 175.93 1d6m s PRO 487 N -1.23 3.11 0.96 2.91 0.04 -1.26 -5.01 135.00 134.52 1d6m s PRO 487 Ca 0.13 1.20 -0.12 0.00 0.04 0.00 0.00 61.00 62.26 1d6m s PRO 487 Cb -0.10 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1d6m s PRO 487 CO 0.03 -0.98 0.68 -2.30 0.04 0.00 0.00 177.00 174.47 1d6m n PRO 488 N -2.34 -0.56 -3.60 0.56 -0.02 -1.26 -4.97 135.00 122.81 1d6m n PRO 488 Ca 0.09 -0.12 -0.35 0.00 -2.02 0.00 0.00 63.50 61.11 1d6m n PRO 488 Cb 0.53 -2.05 -0.05 0.00 -0.02 0.00 0.00 33.50 31.91 1d6m n PRO 488 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1d6m s ARG 489 N -4.02 3.74 0.34 -0.52 1.81 -1.26 -4.88 118.95 114.16 1d6m s ARG 489 Ca 0.61 0.14 -0.29 0.00 -1.72 0.00 0.00 55.73 54.47 1d6m s ARG 489 Cb -0.21 -3.00 -0.11 0.00 -0.45 0.00 0.00 34.95 31.18 1d6m s ARG 489 CO 0.64 0.56 1.43 -1.01 -0.68 0.00 0.00 175.30 176.25 1d6m s HIS 490 N -1.40 2.79 0.63 -0.53 3.76 -1.26 -4.91 115.29 114.37 1d6m s HIS 490 Ca 0.33 1.21 -0.17 0.00 -0.15 0.00 0.00 55.06 56.27 1d6m s HIS 490 Cb -0.14 -3.90 -0.05 0.00 1.11 0.00 0.00 32.58 29.61 1d6m s HIS 490 CO 0.18 -2.64 0.79 1.19 -0.85 0.00 0.00 174.74 173.42 1d6m n PHE 491 N 0.88 0.18 -4.24 1.40 3.72 -1.26 -4.75 117.46 113.40 1d6m n PHE 491 Ca 0.02 0.42 -0.25 0.00 -0.05 0.00 0.00 57.45 57.58 1d6m n PHE 491 Cb 0.40 -2.05 -0.08 0.00 -0.94 0.00 0.00 39.48 36.81 1d6m n PHE 491 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1d6m s THR 492 N -1.67 2.26 0.17 4.37 -4.23 -1.26 -0.08 115.64 115.20 1d6m s THR 492 Ca 0.73 -1.77 -0.22 0.00 -1.18 0.00 0.00 61.69 59.25 1d6m s THR 492 Cb -0.40 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.53 1d6m s THR 492 CO 0.50 -0.01 1.60 0.44 -0.54 0.00 0.00 174.62 176.61 1d6m h ASP 493 N 1.52 -1.04 -0.08 3.99 3.32 -1.94 -0.39 116.42 121.80 1d6m h ASP 493 Ca -0.43 0.20 0.02 0.00 0.02 0.00 0.00 57.03 56.83 1d6m h ASP 493 Cb 1.25 0.50 -0.04 0.00 0.22 0.00 0.00 39.33 41.26 1d6m h ASP 493 CO 0.72 -0.31 -0.35 0.00 -1.72 0.00 0.00 179.24 177.58 1d6m h ALA 494 N 0.88 -0.74 -0.73 3.45 0.00 -1.85 -2.61 119.26 117.66 1d6m h ALA 494 Ca 0.19 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1d6m h ALA 494 Cb 0.53 0.85 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1d6m h ALA 494 CO -0.57 -0.86 0.27 1.79 0.00 0.00 0.00 179.25 179.88 1d6m h THR 495 N -0.38 1.25 -0.35 0.00 1.35 -1.79 -0.51 112.91 112.47 1d6m h THR 495 Ca 0.02 -0.81 -0.00 0.00 -0.55 0.00 0.00 66.41 65.06 1d6m h THR 495 Cb 0.44 0.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.25 1d6m h THR 495 CO -0.28 0.33 0.20 0.25 -0.25 0.00 0.00 175.52 175.77 1d6m h LEU 496 N 1.06 0.43 -0.56 3.87 5.85 -1.14 0.38 115.31 125.20 1d6m h LEU 496 Ca 0.24 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1d6m h LEU 496 Cb 0.23 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1d6m h LEU 496 CO -0.02 0.38 0.06 0.25 -0.34 0.00 0.00 178.44 178.77 1d6m h LEU 497 N 0.45 0.92 -0.39 2.25 5.85 -1.13 -1.03 115.31 122.23 1d6m h LEU 497 Ca 0.13 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1d6m h LEU 497 Cb 0.04 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1d6m h LEU 497 CO -0.02 0.97 0.17 0.28 -0.34 0.00 0.00 178.44 179.49 1d6m h SER 498 N 0.84 0.22 -0.94 1.25 0.02 -0.95 0.38 113.55 114.37 1d6m h SER 498 Ca 0.17 0.03 0.17 0.00 -0.84 0.00 0.00 61.79 61.32 1d6m h SER 498 Cb 0.46 -0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.89 1d6m h SER 498 CO 0.02 0.16 0.53 0.00 -1.14 0.00 0.00 176.83 176.40 1d6m h ALA 499 N 1.23 1.49 -0.05 3.77 0.00 -0.48 0.47 119.26 125.68 1d6m h ALA 499 Ca 0.17 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1d6m h ALA 499 Cb 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1d6m h ALA 499 CO -0.15 -0.06 -0.65 0.52 0.00 0.00 0.00 179.25 178.91 1d6m h MET 500 N 0.71 0.21 0.00 0.00 2.07 -0.17 -3.25 114.93 114.50 1d6m h MET 500 Ca 0.53 -0.16 -0.20 0.00 -2.07 0.00 0.00 59.70 57.80 1d6m h MET 500 Cb 0.77 0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 30.52 1d6m h MET 500 CO -0.37 0.79 -0.89 1.79 1.07 0.00 0.00 176.91 179.30 1d6m h THR 501 N 0.15 1.47 -3.12 2.22 1.35 0.73 0.49 112.91 116.19 1d6m h THR 501 Ca -0.01 -2.58 -0.62 0.00 -0.55 0.00 0.00 66.41 62.65 1d6m h THR 501 Cb 1.18 2.45 -0.41 0.00 -1.73 0.00 0.00 68.15 69.64 1d6m h THR 501 CO 0.10 0.75 -0.67 -0.83 -0.25 0.00 0.00 175.52 174.63 1d6m s GLY 502 N -4.49 2.29 0.13 5.82 0.00 -0.01 -3.41 107.32 107.65 1d6m s GLY 502 Ca -0.03 -3.19 -0.07 0.00 0.00 0.00 0.00 44.72 41.43 1d6m s GLY 502 CO 0.84 1.25 1.32 1.19 0.00 0.00 0.00 173.10 177.70 1d6m h ILE 503 N 5.06 1.35 -0.59 0.90 6.09 -1.32 -3.38 117.51 125.62 1d6m h ILE 503 Ca 0.03 -2.26 0.18 0.00 -1.37 0.00 0.00 64.86 61.44 1d6m h ILE 503 Cb 0.86 2.26 -0.11 0.00 0.47 0.00 0.00 36.82 40.30 1d6m h ILE 503 CO 0.62 0.69 0.06 0.00 -3.07 0.00 0.00 178.15 176.44 1d6m n ALA 504 N -2.56 0.35 0.17 0.18 0.00 -1.26 0.38 120.51 117.77 1d6m n ALA 504 Ca -0.07 0.63 0.16 0.00 0.00 0.00 0.00 53.44 54.16 1d6m n ALA 504 Cb 0.80 -0.49 0.77 0.00 0.00 0.00 0.00 19.45 20.53 1d6m n ALA 504 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d6m h ARG 505 N 0.00 0.00 -0.00 0.00 3.08 -1.95 -1.86 114.38 113.65 1d6m h ARG 505 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1d6m h ARG 505 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1d6m h ARG 505 CO -0.54 0.00 -0.90 1.19 -1.07 0.00 0.00 179.97 178.65 1d6m n PHE 506 N -4.07 0.00 -2.04 3.04 3.72 0.16 -4.98 117.46 113.29 1d6m n PHE 506 Ca 0.02 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.01 1d6m n PHE 506 Cb 0.34 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.86 1d6m n PHE 506 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1d6m s VAL 507 N -2.87 2.64 0.02 -4.37 1.01 -0.70 -4.80 120.40 111.33 1d6m s VAL 507 Ca 0.09 0.59 -0.17 0.00 0.00 0.00 0.00 61.98 62.49 1d6m s VAL 507 Cb 0.16 -3.38 -0.31 0.00 0.00 0.00 0.00 36.38 32.85 1d6m s VAL 507 CO 0.80 0.12 1.03 -0.61 0.00 0.00 0.00 175.10 176.45 1d6m h GLN 508 N 4.03 0.52 -6.57 2.72 5.75 -1.93 -3.46 115.11 116.17 1d6m h GLN 508 Ca -0.48 -0.75 -0.52 0.00 -0.15 0.00 0.00 58.65 56.75 1d6m h GLN 508 Cb 1.22 0.26 -0.02 0.00 1.07 0.00 0.00 27.48 30.02 1d6m h GLN 508 CO 0.70 1.34 0.37 0.34 -2.65 0.00 0.00 178.83 178.94 1d6m s ASP 509 N -7.30 7.48 0.27 -0.69 2.15 -1.26 -4.96 116.67 112.34 1d6m s ASP 509 Ca -0.11 1.81 0.04 0.00 0.43 0.00 0.00 52.55 54.73 1d6m s ASP 509 Cb 0.04 -2.59 0.36 0.00 -0.30 0.00 0.00 42.92 40.43 1d6m s ASP 509 CO 0.90 -0.09 1.65 0.11 -0.17 0.00 0.00 175.17 177.58 1d6m h LYS 510 N 5.61 0.32 0.12 4.34 1.57 -1.98 -1.11 116.57 125.43 1d6m h LYS 510 Ca -0.43 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.18 1d6m h LYS 510 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1d6m h LYS 510 CO 0.72 0.71 -0.06 -0.44 -0.57 0.00 0.00 179.45 179.81 1d6m h ASP 511 N 0.26 -0.14 -0.75 0.86 3.32 -2.00 -2.30 116.42 115.67 1d6m h ASP 511 Ca 0.02 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1d6m h ASP 511 Cb 0.89 0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 1d6m h ASP 511 CO 0.07 0.06 0.41 0.25 -1.72 0.00 0.00 179.24 178.31 1d6m h LEU 512 N -0.33 0.93 -1.97 1.55 5.85 -1.94 -2.11 115.31 117.28 1d6m h LEU 512 Ca -0.02 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1d6m h LEU 512 Cb 0.27 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1d6m h LEU 512 CO 0.03 0.76 0.02 0.50 -0.34 0.00 0.00 178.44 179.41 1d6m h LYS 513 N 1.03 0.03 -0.00 1.25 3.64 -1.16 -0.86 116.57 120.50 1d6m h LYS 513 Ca 0.26 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.61 1d6m h LYS 513 Cb 0.03 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1d6m h LYS 513 CO -0.04 0.02 -0.11 -0.22 -2.27 0.00 0.00 179.45 176.83 1d6m h LYS 514 N 0.04 0.08 0.00 1.90 1.63 -0.80 -3.36 116.57 116.05 1d6m h LYS 514 Ca 0.01 -0.08 -0.09 0.00 -0.85 0.00 0.00 60.65 59.64 1d6m h LYS 514 Cb -0.00 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1d6m h LYS 514 CO -0.00 0.84 -0.44 0.82 -3.45 0.00 0.00 179.45 177.21 1d6m h ILE 515 N -0.65 0.84 -2.98 2.00 2.04 -1.32 -3.44 117.51 114.00 1d6m h ILE 515 Ca -0.01 -1.93 -0.53 0.00 1.00 0.00 0.00 64.86 63.39 1d6m h ILE 515 Cb 0.88 2.23 0.02 0.00 -0.74 0.00 0.00 36.82 39.20 1d6m h ILE 515 CO 0.02 0.43 0.75 -0.76 0.00 0.00 0.00 178.15 178.60 1d6m s LEU 516 N -6.65 4.36 1.04 1.44 1.43 -0.34 -5.01 118.68 114.94 1d6m s LEU 516 Ca 0.03 2.29 -0.16 0.00 -1.03 0.00 0.00 54.13 55.25 1d6m s LEU 516 Cb 0.09 -3.58 0.21 0.00 0.03 0.00 0.00 46.19 42.94 1d6m s LEU 516 CO 0.72 -0.67 1.16 -0.60 0.23 0.00 0.00 176.35 177.19 1d6m s ARG 517 N 1.41 0.08 0.39 1.70 3.52 -1.26 -4.94 118.95 119.85 1d6m s ARG 517 Ca 0.65 0.02 0.21 0.00 -0.13 0.00 0.00 55.73 56.47 1d6m s ARG 517 Cb -0.36 -1.74 0.60 0.00 -1.56 0.00 0.00 34.95 31.89 1d6m s ARG 517 CO 0.30 -2.86 1.69 0.00 -0.81 0.00 0.00 175.30 173.61 1d6m h ALA 518 N -1.97 0.91 -0.48 6.12 0.00 -1.97 -3.11 119.26 118.75 1d6m h ALA 518 Ca -0.48 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.15 1d6m h ALA 518 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1d6m h ALA 518 CO 0.46 0.39 0.00 0.25 0.00 0.00 0.00 179.25 180.35 1d6m n THR 519 N -3.34 0.72 -2.23 0.00 -2.24 -1.26 -4.63 114.28 101.30 1d6m n THR 519 Ca 0.01 -0.86 -0.42 0.00 -2.27 0.00 0.00 64.05 60.51 1d6m n THR 519 Cb 0.54 0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 69.50 1d6m n THR 519 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1d6m s ASP 520 N -1.21 6.88 0.00 3.42 1.01 -1.18 -4.82 116.67 120.78 1d6m s ASP 520 Ca 0.39 2.24 0.00 0.00 0.71 0.00 0.00 52.55 55.89 1d6m s ASP 520 Cb 0.21 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.56 1d6m s ASP 520 CO 0.29 -0.61 0.00 0.61 0.21 0.00 0.00 175.17 175.67 1d6m n GLY 521 N 3.44 3.42 0.09 0.21 0.00 -1.22 -1.58 105.19 109.54 1d6m n GLY 521 Ca 0.11 -1.42 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 1d6m n GLY 521 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1d6m h LEU 522 N 0.00 0.00 0.00 0.99 3.38 -0.30 -3.44 115.31 115.94 1d6m h LEU 522 Ca 0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1d6m h LEU 522 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1d6m h LEU 522 CO 0.00 1.13 0.00 0.61 0.09 0.00 0.00 178.44 180.27 1d6m n GLY 523 N 1.54 -0.34 3.45 0.83 0.00 -1.26 -4.97 105.19 104.45 1d6m n GLY 523 Ca -0.19 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 1d6m n GLY 523 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d6m s THR 524 N 0.00 0.01 0.00 2.61 2.01 -1.26 -4.95 115.64 114.06 1d6m s THR 524 Ca 0.00 -0.11 0.00 0.00 0.31 0.00 0.00 61.69 61.89 1d6m s THR 524 Cb 0.00 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.60 1d6m s THR 524 CO 0.00 -0.06 0.34 -1.84 -0.69 0.00 0.00 174.62 172.37 1d6m n GLU 525 N 0.99 0.00 -0.10 4.92 0.00 -1.26 -1.04 120.64 124.15 1d6m n GLU 525 Ca -0.20 0.34 0.00 0.00 0.00 0.00 0.00 57.16 57.31 1d6m n GLU 525 Cb 0.57 -0.53 0.28 0.00 0.00 0.00 0.00 31.44 31.76 1d6m n GLU 525 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1d6m h ALA 526 N -0.42 1.42 0.00 -1.84 0.00 -1.98 -3.37 119.26 113.08 1d6m h ALA 526 Ca 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1d6m h ALA 526 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1d6m h ALA 526 CO 0.00 0.45 -1.53 0.25 0.00 0.00 0.00 179.25 178.42 1d6m n THR 527 N -4.36 0.73 -0.12 0.00 -2.24 -0.21 -4.51 114.28 103.57 1d6m n THR 527 Ca 0.04 -0.61 -0.06 0.00 -2.27 0.00 0.00 64.05 61.15 1d6m n THR 527 Cb 0.14 -0.40 0.01 0.00 -2.10 0.00 0.00 70.33 67.98 1d6m n THR 527 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1d6m h ARG 528 N 0.00 -0.14 -0.18 -0.78 3.08 -1.64 0.66 114.38 115.37 1d6m h ARG 528 Ca -0.11 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.00 1d6m h ARG 528 Cb 1.31 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.33 1d6m h ARG 528 CO 0.02 -0.10 -0.36 0.00 -1.07 0.00 0.00 179.97 178.46 1d6m h ALA 529 N 1.08 -0.43 -0.30 0.04 0.00 -1.86 -1.37 119.26 116.43 1d6m h ALA 529 Ca 0.20 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1d6m h ALA 529 Cb 0.46 0.70 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 1d6m h ALA 529 CO -0.50 -0.84 -0.53 0.78 0.00 0.00 0.00 179.25 178.17 1d6m h GLY 530 N -0.41 -1.08 0.01 0.00 0.00 -1.48 -1.18 103.07 98.93 1d6m h GLY 530 Ca 0.10 0.71 0.17 0.00 0.00 0.00 0.00 47.33 48.31 1d6m h GLY 530 CO -0.40 -0.17 0.33 -2.22 0.00 0.00 0.00 176.54 174.07 1d6m h ILE 531 N -0.43 0.59 -0.26 2.60 2.04 -0.20 -0.03 117.51 121.81 1d6m h ILE 531 Ca 0.06 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1d6m h ILE 531 Cb 0.59 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1d6m h ILE 531 CO -0.52 0.08 0.16 0.40 0.00 0.00 0.00 178.15 178.27 1d6m h ILE 532 N 0.43 1.09 -0.34 -0.67 2.04 -0.45 -2.93 117.51 116.68 1d6m h ILE 532 Ca 0.47 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 66.15 1d6m h ILE 532 Cb 0.78 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1d6m h ILE 532 CO -0.46 0.09 0.16 -0.33 0.00 0.00 0.00 178.15 177.62 1d6m h GLU 533 N 0.33 0.33 -0.07 2.37 4.39 0.11 -2.90 114.58 119.15 1d6m h GLU 533 Ca 0.09 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.81 1d6m h GLU 533 Cb 0.00 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 1d6m h GLU 533 CO -0.02 0.22 -0.18 1.25 -1.16 0.00 0.00 179.01 179.12 1d6m h LEU 534 N 0.34 -0.56 -1.25 1.33 5.85 -1.15 0.46 115.31 120.33 1d6m h LEU 534 Ca 0.14 0.09 0.13 0.00 0.84 0.00 0.00 57.88 59.08 1d6m h LEU 534 Cb 0.06 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 1d6m h LEU 534 CO -0.10 -0.24 0.57 -0.07 -0.34 0.00 0.00 178.44 178.26 1d6m h LEU 535 N -0.26 0.71 -0.46 2.25 3.38 -1.40 0.17 115.31 119.70 1d6m h LEU 535 Ca 0.08 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 1d6m h LEU 535 Cb 0.37 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1d6m h LEU 535 CO -0.23 0.38 -0.29 -0.26 0.09 0.00 0.00 178.44 178.14 1d6m h PHE 536 N 0.76 1.13 -0.60 1.13 -1.00 -1.23 -1.37 116.94 115.76 1d6m h PHE 536 Ca 0.44 -0.30 -0.07 0.00 2.81 0.00 0.00 57.97 60.85 1d6m h PHE 536 Cb 0.60 -0.25 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 1d6m h PHE 536 CO -0.00 1.13 0.11 -0.22 -1.61 0.00 0.00 178.31 177.71 1d6m h LYS 537 N 0.82 0.99 0.00 1.51 3.11 0.11 -2.86 116.57 120.25 1d6m h LYS 537 Ca 0.09 -0.26 0.00 0.00 -2.81 0.00 0.00 60.65 57.67 1d6m h LYS 537 Cb 0.87 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.98 1d6m h LYS 537 CO 0.08 0.93 0.00 0.54 -2.81 0.00 0.00 179.45 178.19 1d6m n ARG 538 N -4.31 0.89 -0.61 1.90 5.12 0.40 -4.89 116.66 115.16 1d6m n ARG 538 Ca 0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 1d6m n ARG 538 Cb 0.27 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 1d6m n ARG 538 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1d6m n GLY 539 N 0.78 0.76 0.08 -0.13 0.00 -1.08 -4.96 105.19 100.64 1d6m n GLY 539 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1d6m n GLY 539 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1d6m n PHE 540 N -2.22 0.73 -4.28 1.61 3.72 -0.53 -4.46 117.46 112.03 1d6m n PHE 540 Ca 0.00 0.21 -0.16 0.00 -0.05 0.00 0.00 57.45 57.45 1d6m n PHE 540 Cb 0.00 -0.79 -0.10 0.00 -0.94 0.00 0.00 39.48 37.65 1d6m n PHE 540 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1d6m s LEU 541 N -4.37 2.52 -0.02 4.37 1.43 -1.17 -2.14 118.68 119.31 1d6m s LEU 541 Ca 0.08 -0.99 -0.15 0.00 -1.03 0.00 0.00 54.13 52.04 1d6m s LEU 541 Cb 0.13 -0.48 0.03 0.00 0.03 0.00 0.00 46.19 45.89 1d6m s LEU 541 CO 0.66 -0.25 0.33 0.28 0.23 0.00 0.00 176.35 177.60 1d6m s THR 542 N -3.05 0.05 -0.25 5.49 -1.32 0.25 -4.65 115.64 112.17 1d6m s THR 542 Ca 0.17 -0.42 -0.10 0.00 -1.21 0.00 0.00 61.69 60.13 1d6m s THR 542 Cb 0.00 -0.63 -0.05 0.00 -1.51 0.00 0.00 72.50 70.32 1d6m s THR 542 CO 0.03 -0.23 0.15 -0.54 -2.21 0.00 0.00 174.62 171.82 1d6m s LYS 543 N -1.23 3.99 -0.30 7.08 -0.14 -1.26 0.73 119.74 128.62 1d6m s LYS 543 Ca -0.13 -0.31 0.03 0.00 -1.36 0.00 0.00 55.97 54.20 1d6m s LYS 543 Cb -0.05 -3.52 0.08 0.00 -1.68 0.00 0.00 37.83 32.67 1d6m s LYS 543 CO 0.04 -0.01 -0.00 0.15 -0.76 0.00 0.00 175.35 174.78 1d6m s LYS 544 N 1.23 1.60 7.99 1.68 1.02 0.12 -4.97 119.74 128.42 1d6m s LYS 544 Ca 0.07 -1.52 0.00 0.00 0.02 0.00 0.00 55.97 54.54 1d6m s LYS 544 Cb -0.14 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 1d6m s LYS 544 CO 0.06 -0.80 0.00 0.41 -0.92 0.00 0.00 175.35 174.10 1d6m n GLY 545 N 4.43 4.14 1.10 -3.33 0.00 -1.26 -0.13 105.19 110.14 1d6m n GLY 545 Ca -0.04 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.17 1d6m n GLY 545 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d6m n ARG 546 N 13.78 2.41 -4.35 1.61 0.63 -1.26 -4.95 116.66 124.54 1d6m n ARG 546 Ca 0.00 -2.16 -0.34 0.00 -0.92 0.00 0.00 57.85 54.42 1d6m n ARG 546 Cb 0.00 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.30 1d6m n ARG 546 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1d6m s TYR 547 N -1.38 3.09 -0.11 -0.14 2.02 0.82 -4.11 117.35 117.54 1d6m s TYR 547 Ca 0.40 -0.09 -0.23 0.00 -0.37 0.00 0.00 57.07 56.78 1d6m s TYR 547 Cb 0.22 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.83 1d6m s TYR 547 CO 0.30 0.15 0.72 0.42 -1.57 0.00 0.00 175.55 175.57 1d6m s ILE 548 N -0.04 5.01 -0.04 2.71 1.01 0.89 -0.70 121.20 130.04 1d6m s ILE 548 Ca 0.03 1.44 0.04 0.00 0.00 0.00 0.00 60.65 62.16 1d6m s ILE 548 Cb -0.13 -4.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.29 1d6m s ILE 548 CO 0.02 0.18 -0.16 -1.00 0.00 0.00 0.00 174.94 173.97 1d6m s HIS 549 N 1.29 1.62 0.34 3.97 3.76 0.23 -3.99 115.29 122.51 1d6m s HIS 549 Ca 0.36 -0.44 -0.27 0.00 -0.15 0.00 0.00 55.06 54.56 1d6m s HIS 549 Cb -0.17 -1.09 -0.09 0.00 1.11 0.00 0.00 32.58 32.33 1d6m s HIS 549 CO 0.15 -0.14 1.07 -1.54 -0.85 0.00 0.00 174.74 173.43 1d6m s SER 550 N -0.00 7.02 0.50 1.40 1.04 -1.26 0.85 113.70 123.24 1d6m s SER 550 Ca -0.02 2.14 0.05 0.00 0.48 0.00 0.00 55.95 58.59 1d6m s SER 550 Cb -0.11 -2.60 0.03 0.00 0.10 0.00 0.00 66.02 63.44 1d6m s SER 550 CO 0.02 -0.31 0.70 0.42 0.98 0.00 0.00 173.24 175.04 1d6m s THR 551 N -1.42 2.73 0.17 2.02 -4.23 -0.91 -4.84 115.64 109.17 1d6m s THR 551 Ca 0.51 -0.85 -0.15 0.00 -1.18 0.00 0.00 61.69 60.02 1d6m s THR 551 Cb -0.27 -2.88 0.07 0.00 1.34 0.00 0.00 72.50 70.76 1d6m s THR 551 CO 0.34 0.00 1.71 0.44 -0.54 0.00 0.00 174.62 176.56 1d6m h ASP 552 N 0.30 -0.11 -0.51 3.99 3.32 -1.90 0.57 116.42 122.09 1d6m h ASP 552 Ca -0.39 0.09 0.04 0.00 0.02 0.00 0.00 57.03 56.78 1d6m h ASP 552 Cb 1.29 0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.94 1d6m h ASP 552 CO 0.47 -0.02 0.26 0.00 -1.72 0.00 0.00 179.24 178.23 1d6m h ALA 553 N 1.34 0.65 -0.16 3.45 0.00 -1.93 0.53 119.26 123.15 1d6m h ALA 553 Ca 0.20 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1d6m h ALA 553 Cb 0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1d6m h ALA 553 CO -0.31 -0.08 0.08 0.78 0.00 0.00 0.00 179.25 179.72 1d6m h GLY 554 N 0.51 0.24 0.72 0.00 0.00 -1.40 0.17 103.07 103.32 1d6m h GLY 554 Ca 0.22 -0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.47 1d6m h GLY 554 CO -0.15 0.11 -0.01 0.50 0.00 0.00 0.00 176.54 176.99 1d6m h LYS 555 N 0.14 0.05 -0.04 4.80 1.57 0.38 -1.30 116.57 122.16 1d6m h LYS 555 Ca 0.05 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 1d6m h LYS 555 Cb 0.10 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 1d6m h LYS 555 CO -0.01 0.03 -0.26 0.00 -0.57 0.00 0.00 179.45 178.64 1d6m h ALA 556 N 1.15 -0.33 -0.35 3.86 0.00 0.28 -1.78 119.26 122.09 1d6m h ALA 556 Ca 0.08 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1d6m h ALA 556 Cb 0.11 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1d6m h ALA 556 CO -0.15 -0.75 0.08 1.25 0.00 0.00 0.00 179.25 179.68 1d6m h LEU 557 N -0.38 0.04 -0.57 0.00 5.85 -0.42 -1.51 115.31 118.32 1d6m h LEU 557 Ca 0.08 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.90 1d6m h LEU 557 Cb 0.49 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 1d6m h LEU 557 CO -0.26 0.06 -0.48 0.15 -0.34 0.00 0.00 178.44 177.57 1d6m h PHE 558 N 0.21 -1.49 0.00 1.25 3.57 -1.03 -1.58 116.94 117.86 1d6m h PHE 558 Ca 0.16 0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1d6m h PHE 558 Cb 0.18 0.73 0.00 0.00 2.79 0.00 0.00 35.95 39.64 1d6m h PHE 558 CO -0.18 -0.36 0.00 0.45 -2.23 0.00 0.00 178.31 175.99 1d6m h HIS 559 N -0.18 0.00 0.00 0.41 3.86 -0.82 -0.20 115.15 118.23 1d6m h HIS 559 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1d6m h HIS 559 Cb 0.42 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.89 1d6m h HIS 559 CO -0.85 0.00 0.00 0.77 0.86 0.00 0.00 177.93 178.71 1d6m h SER 560 N 0.00 0.00 -2.73 2.45 0.02 -0.28 -3.45 113.55 109.56 1d6m h SER 560 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1d6m h SER 560 Cb 0.20 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 1d6m h SER 560 CO 0.00 0.00 -0.56 -0.76 -1.14 0.00 0.00 176.83 174.37 1d6m s LEU 561 N -6.05 3.86 0.70 5.07 1.43 -0.09 -5.05 118.68 118.56 1d6m s LEU 561 Ca 0.04 -0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.93 1d6m s LEU 561 Cb 0.07 -2.47 0.02 0.00 0.03 0.00 0.00 46.19 43.84 1d6m s LEU 561 CO 0.60 0.08 1.09 -2.16 0.23 0.00 0.00 176.35 176.18 1d6m s PRO 562 N -3.05 2.67 0.18 1.29 0.04 -1.26 -4.89 135.00 129.98 1d6m s PRO 562 Ca 0.31 1.19 -0.20 0.00 0.04 0.00 0.00 61.00 62.34 1d6m s PRO 562 Cb -0.10 -1.95 0.10 0.00 0.04 0.00 0.00 34.50 32.59 1d6m s PRO 562 CO 0.24 -1.32 1.61 0.93 0.04 0.00 0.00 177.00 178.50 1d6m h GLU 563 N -0.54 -0.16 -1.42 4.56 4.39 -1.97 -1.45 114.58 117.99 1d6m h GLU 563 Ca -0.45 0.01 0.42 0.00 0.34 0.00 0.00 59.36 59.69 1d6m h GLU 563 Cb 1.23 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 29.83 1d6m h GLU 563 CO 0.54 -0.11 0.98 1.98 -1.16 0.00 0.00 179.01 181.24 1d6m h MET 564 N -0.16 0.08 0.00 2.33 4.05 -1.93 -0.72 114.93 118.57 1d6m h MET 564 Ca 0.20 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.62 1d6m h MET 564 Cb 0.49 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 1d6m h MET 564 CO -0.54 0.05 -1.55 0.00 0.23 0.00 0.00 176.91 175.10 1d6m n ALA 565 N -2.69 2.85 0.85 0.39 0.00 -0.56 -4.41 120.51 116.93 1d6m n ALA 565 Ca 0.34 -0.42 0.10 0.00 0.00 0.00 0.00 53.44 53.46 1d6m n ALA 565 Cb 1.46 -0.89 0.07 0.00 0.00 0.00 0.00 19.45 20.10 1d6m n ALA 565 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1d6m n THR 566 N -2.33 0.00 -3.99 0.00 -2.24 -0.34 -4.08 114.28 101.29 1d6m n THR 566 Ca -0.02 -0.47 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 1d6m n THR 566 Cb 0.54 1.40 -0.05 0.00 -2.10 0.00 0.00 70.33 70.12 1d6m n THR 566 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1d6m s ARG 567 N -1.77 3.15 0.53 -0.78 0.52 -0.79 -4.38 118.95 115.43 1d6m s ARG 567 Ca 0.23 -0.56 0.31 0.00 -0.52 0.00 0.00 55.73 55.19 1d6m s ARG 567 Cb 0.17 -2.88 1.39 0.00 0.52 0.00 0.00 34.95 34.15 1d6m s ARG 567 CO 0.29 0.59 2.01 -1.00 0.02 0.00 0.00 175.30 177.21 1d6m h PRO 568 N 3.26 0.00 -0.70 3.54 0.13 -1.87 -3.36 132.00 133.00 1d6m h PRO 568 Ca -0.46 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 1d6m h PRO 568 Cb 1.16 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.17 1d6m h PRO 568 CO 0.70 0.09 -0.40 -0.44 -0.23 0.00 0.00 178.00 177.73 1d6m h ASP 569 N 0.00 -1.39 0.39 1.44 5.19 -1.94 0.45 116.42 120.57 1d6m h ASP 569 Ca -0.00 0.26 -0.00 0.00 -0.62 0.00 0.00 57.03 56.66 1d6m h ASP 569 Cb 0.47 0.67 -0.02 0.00 0.18 0.00 0.00 39.33 40.63 1d6m h ASP 569 CO 0.01 -0.31 -0.41 -0.03 -3.12 0.00 0.00 179.24 175.39 1d6m h MET 570 N -0.14 -0.79 -0.17 3.56 4.05 -1.85 -2.21 114.93 117.37 1d6m h MET 570 Ca 0.24 0.05 -0.12 0.00 -0.28 0.00 0.00 59.70 59.59 1d6m h MET 570 Cb 0.56 0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.53 1d6m h MET 570 CO -0.77 -0.53 -0.42 1.15 0.23 0.00 0.00 176.91 176.57 1d6m h THR 571 N -0.82 1.31 -0.32 -0.77 2.02 -1.76 -2.37 112.91 110.19 1d6m h THR 571 Ca -0.03 -1.58 0.05 0.00 0.77 0.00 0.00 66.41 65.62 1d6m h THR 571 Cb 0.74 1.65 -0.05 0.00 -1.74 0.00 0.00 68.15 68.75 1d6m h THR 571 CO -0.07 0.48 0.03 0.00 0.37 0.00 0.00 175.52 176.33 1d6m h ALA 572 N 1.23 0.31 0.53 6.16 0.00 0.01 -0.42 119.26 127.07 1d6m h ALA 572 Ca 0.03 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1d6m h ALA 572 Cb 0.88 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1d6m h ALA 572 CO 0.07 -0.38 -0.51 1.25 0.00 0.00 0.00 179.25 179.68 1d6m h HIS 573 N 0.13 -1.41 -0.32 0.00 6.17 -1.32 -3.01 115.15 115.38 1d6m h HIS 573 Ca 0.15 0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.31 1d6m h HIS 573 Cb 0.19 0.55 -0.08 0.00 2.52 0.00 0.00 27.41 30.59 1d6m h HIS 573 CO -0.21 -0.68 -0.39 -1.49 0.71 0.00 0.00 177.93 175.86 1d6m h TRP 574 N -1.03 -1.12 -0.93 5.26 6.55 -0.84 -2.29 115.95 121.54 1d6m h TRP 574 Ca -0.07 0.06 0.19 0.00 0.95 0.00 0.00 58.89 60.02 1d6m h TRP 574 Cb 0.89 0.54 -0.11 0.00 -0.86 0.00 0.00 29.16 29.62 1d6m h TRP 574 CO -0.25 -0.43 0.50 0.93 -1.05 0.00 0.00 178.44 178.14 1d6m h GLU 575 N -0.35 0.61 0.22 0.49 4.39 -1.14 -0.27 114.58 118.53 1d6m h GLU 575 Ca 0.13 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.80 1d6m h GLU 575 Cb 0.58 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 1d6m h GLU 575 CO -0.51 0.40 -0.42 1.03 -1.16 0.00 0.00 179.01 178.35 1d6m h SER 576 N 0.62 -1.22 -0.93 1.42 0.87 -1.27 0.08 113.55 113.12 1d6m h SER 576 Ca 0.54 0.12 0.11 0.00 -1.23 0.00 0.00 61.79 61.34 1d6m h SER 576 Cb 0.88 0.44 -0.08 0.00 -0.44 0.00 0.00 62.40 63.20 1d6m h SER 576 CO -0.41 -0.52 0.56 0.58 -0.53 0.00 0.00 176.83 176.51 1d6m h VAL 577 N -0.73 0.90 -0.43 2.23 2.07 -1.03 -0.23 116.25 119.03 1d6m h VAL 577 Ca -0.00 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1d6m h VAL 577 Cb 0.71 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1d6m h VAL 577 CO -0.18 0.16 0.20 -0.07 0.02 0.00 0.00 177.57 177.71 1d6m h LEU 578 N 0.90 0.54 -0.52 2.57 3.38 -0.37 -0.97 115.31 120.83 1d6m h LEU 578 Ca 0.46 -0.04 -0.16 0.00 0.09 0.00 0.00 57.88 58.22 1d6m h LEU 578 Cb 0.46 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1d6m h LEU 578 CO -0.27 0.47 -0.65 0.74 0.09 0.00 0.00 178.44 178.82 1d6m h THR 579 N 0.61 1.38 0.00 0.22 2.02 0.67 -3.14 112.91 114.66 1d6m h THR 579 Ca 0.15 -2.03 -0.03 0.00 0.77 0.00 0.00 66.41 65.27 1d6m h THR 579 Cb 0.07 2.02 -0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1d6m h THR 579 CO -0.02 0.61 -0.15 1.56 0.37 0.00 0.00 175.52 177.89 1d6m h GLN 580 N 0.25 0.00 -0.23 6.66 4.20 0.09 -2.80 115.11 123.29 1d6m h GLN 580 Ca -0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1d6m h GLN 580 Cb 1.19 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 1d6m h GLN 580 CO 0.11 0.15 0.04 0.82 -0.67 0.00 0.00 178.83 179.28 1d6m h ILE 581 N 0.00 1.22 0.00 2.54 1.08 -1.28 -0.69 117.51 120.38 1d6m h ILE 581 Ca -0.00 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.74 1d6m h ILE 581 Cb 0.44 1.27 0.00 0.00 -3.07 0.00 0.00 36.82 35.46 1d6m h ILE 581 CO 0.02 0.23 0.00 -1.54 -0.69 0.00 0.00 178.15 176.17 1d6m n SER 582 N -4.72 0.00 -0.83 1.72 3.41 -1.07 -2.46 113.62 109.67 1d6m n SER 582 Ca -0.04 0.37 0.10 0.00 -0.26 0.00 0.00 58.87 59.04 1d6m n SER 582 Cb 0.19 -0.45 0.11 0.00 -0.26 0.00 0.00 64.21 63.80 1d6m n SER 582 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1d6m n GLU 583 N -1.45 1.86 -1.55 4.33 1.02 -1.13 -4.59 120.64 119.13 1d6m n GLU 583 Ca 0.07 -1.78 -0.05 0.00 -0.02 0.00 0.00 57.16 55.38 1d6m n GLU 583 Cb 0.25 -1.39 -0.01 0.00 -0.02 0.00 0.00 31.44 30.27 1d6m n GLU 583 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1d6m n LYS 584 N 1.11 -0.35 -1.07 3.49 4.81 -1.03 -4.95 118.16 120.18 1d6m n LYS 584 Ca 0.13 0.48 -0.13 0.00 -0.87 0.00 0.00 58.31 57.92 1d6m n LYS 584 Cb 0.49 -4.21 0.17 0.00 0.02 0.00 0.00 35.03 31.50 1d6m n LYS 584 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1d6m n GLN 585 N -2.26 2.17 0.00 1.64 6.02 -0.28 -4.94 117.38 119.73 1d6m n GLN 585 Ca -0.05 -3.29 0.00 0.00 -0.01 0.00 0.00 57.00 53.65 1d6m n GLN 585 Cb 0.32 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.61 1d6m n GLN 585 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1d6m s ARG 587 N -1.05 2.83 0.15 0.00 1.70 -1.26 -4.32 118.95 117.00 1d6m s ARG 587 Ca 0.00 -1.11 -0.32 0.00 -0.47 0.00 0.00 55.73 53.83 1d6m s ARG 587 Cb 0.00 -2.50 -0.08 0.00 -0.57 0.00 0.00 34.95 31.80 1d6m s ARG 587 CO 0.00 0.39 1.54 -0.92 -1.08 0.00 0.00 175.30 175.23 1d6m h TYR 588 N 1.55 -1.85 -0.25 5.89 3.20 -1.96 -1.57 116.97 121.98 1d6m h TYR 588 Ca -0.48 0.12 0.07 0.00 3.14 0.00 0.00 58.73 61.58 1d6m h TYR 588 Cb 1.24 0.92 -0.01 0.00 1.54 0.00 0.00 36.73 40.42 1d6m h TYR 588 CO 0.57 -0.40 0.18 1.96 -1.64 0.00 0.00 178.16 178.83 1d6m h GLN 589 N -0.11 0.00 0.00 1.82 1.08 -1.97 0.25 115.11 116.18 1d6m h GLN 589 Ca 0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1d6m h GLN 589 Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1d6m h GLN 589 CO -0.85 0.00 0.00 -0.25 -0.95 0.00 0.00 178.83 176.78 1d6m n ASP 590 N -4.41 0.00 -0.07 1.46 8.00 -0.60 -1.87 116.55 119.06 1d6m n ASP 590 Ca 0.03 0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.62 1d6m n ASP 590 Cb 0.33 -0.39 -0.05 0.00 -0.02 0.00 0.00 41.12 40.99 1d6m n ASP 590 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1d6m n PHE 591 N -1.39 0.00 -0.05 1.24 7.35 -0.41 -4.70 117.46 119.49 1d6m n PHE 591 Ca 0.09 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.69 1d6m n PHE 591 Cb 0.24 -0.51 0.08 0.00 0.35 0.00 0.00 39.48 39.63 1d6m n PHE 591 CO 0.00 0.00 0.00 1.98 -0.76 0.00 0.00 176.76 177.98 1d6m h MET 592 N -0.35 0.69 0.55 -4.13 4.05 -1.04 -2.51 114.93 112.20 1d6m h MET 592 Ca -0.34 -0.33 -0.02 0.00 -0.28 0.00 0.00 59.70 58.72 1d6m h MET 592 Cb 1.37 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.16 1d6m h MET 592 CO -0.16 0.94 -0.35 1.96 0.23 0.00 0.00 176.91 179.53 1d6m h GLN 593 N 0.58 -0.83 -0.37 0.39 4.20 -1.62 -2.59 115.11 114.88 1d6m h GLN 593 Ca 0.06 0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 1d6m h GLN 593 Cb 0.88 0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.83 1d6m h GLN 593 CO 0.08 -0.55 0.21 -1.00 -0.67 0.00 0.00 178.83 176.90 1d6m h PRO 594 N -0.86 0.49 0.28 1.46 0.13 -1.80 -0.98 132.00 130.72 1d6m h PRO 594 Ca -0.07 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 1d6m h PRO 594 Cb 0.70 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1d6m h PRO 594 CO 0.06 0.35 -0.14 1.25 -0.23 0.00 0.00 178.00 179.29 1d6m h LEU 595 N 0.50 -0.33 0.01 1.56 7.12 -1.25 -1.02 115.31 121.90 1d6m h LEU 595 Ca 0.13 0.01 0.03 0.00 0.13 0.00 0.00 57.88 58.18 1d6m h LEU 595 Cb -0.01 0.09 -0.05 0.00 -0.53 0.00 0.00 40.66 40.15 1d6m h LEU 595 CO -0.02 -0.23 -0.41 0.58 -0.13 0.00 0.00 178.44 178.23 1d6m h VAL 596 N -0.38 0.17 -0.94 1.05 2.07 -1.21 -2.12 116.25 114.89 1d6m h VAL 596 Ca -0.04 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.73 1d6m h VAL 596 Cb 0.29 0.17 -0.17 0.00 -1.52 0.00 0.00 31.29 30.06 1d6m h VAL 596 CO 0.06 0.00 0.04 1.23 0.02 0.00 0.00 177.57 178.92 1d6m h GLY 597 N -0.57 1.19 1.02 2.17 0.00 -0.83 0.55 103.07 106.60 1d6m h GLY 597 Ca 0.05 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 1d6m h GLY 597 CO -0.30 -0.47 0.57 -0.84 0.00 0.00 0.00 176.54 175.50 1d6m h THR 598 N 0.04 1.26 -0.45 4.70 2.02 -0.59 -2.64 112.91 117.25 1d6m h THR 598 Ca 0.57 -0.56 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1d6m h THR 598 Cb 1.14 -0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1d6m h THR 598 CO -0.86 0.27 0.23 -0.07 0.37 0.00 0.00 175.52 175.46 1d6m h LEU 599 N 1.31 0.33 0.28 2.58 3.38 0.73 0.92 115.31 124.84 1d6m h LEU 599 Ca 0.34 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1d6m h LEU 599 Cb -0.06 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1d6m h LEU 599 CO -0.06 0.24 -0.45 1.88 0.09 0.00 0.00 178.44 180.13 1d6m h TYR 600 N 0.45 -1.27 -0.46 1.13 0.05 -1.26 0.30 116.97 115.92 1d6m h TYR 600 Ca 0.20 0.02 0.06 0.00 0.05 0.00 0.00 58.73 59.06 1d6m h TYR 600 Cb 0.10 0.52 -0.09 0.00 1.01 0.00 0.00 36.73 38.27 1d6m h TYR 600 CO -0.10 -0.58 -0.52 1.96 -1.05 0.00 0.00 178.16 177.87 1d6m h GLN 601 N -0.80 -0.34 -0.69 4.88 1.08 -0.99 -0.47 115.11 117.79 1d6m h GLN 601 Ca -0.02 0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.35 1d6m h GLN 601 Cb 0.75 0.08 -0.10 0.00 -0.05 0.00 0.00 27.48 28.16 1d6m h GLN 601 CO -0.16 -0.22 0.14 1.25 -0.95 0.00 0.00 178.83 178.88 1d6m h LEU 602 N -0.35 -0.03 -0.32 1.46 5.85 0.12 -1.20 115.31 120.84 1d6m h LEU 602 Ca 0.10 0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.90 1d6m h LEU 602 Cb 0.58 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1d6m h LEU 602 CO -0.62 -0.03 -0.05 0.40 -0.34 0.00 0.00 178.44 177.80 1d6m h ILE 603 N 0.25 1.27 -0.14 4.05 2.04 0.49 -2.62 117.51 122.86 1d6m h ILE 603 Ca 0.38 -1.06 0.05 0.00 1.00 0.00 0.00 64.86 65.22 1d6m h ILE 603 Cb 0.62 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 1d6m h ILE 603 CO -0.49 0.34 -0.20 -0.78 0.00 0.00 0.00 178.15 177.03 1d6m h ASP 604 N 0.39 -0.62 -0.12 1.72 3.58 -0.53 0.20 116.42 121.03 1d6m h ASP 604 Ca 0.09 0.11 0.05 0.00 0.42 0.00 0.00 57.03 57.69 1d6m h ASP 604 Cb 0.52 0.29 -0.06 0.00 1.72 0.00 0.00 39.33 41.80 1d6m h ASP 604 CO 0.03 -0.25 -0.29 1.56 -2.88 0.00 0.00 179.24 177.40 1d6m h GLN 605 N -0.25 -0.35 -0.27 0.28 4.20 -1.21 0.41 115.11 117.92 1d6m h GLN 605 Ca 0.10 0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.90 1d6m h GLN 605 Cb 0.40 0.08 -0.08 0.00 0.30 0.00 0.00 27.48 28.18 1d6m h GLN 605 CO -0.28 -0.24 -0.37 0.00 -0.67 0.00 0.00 178.83 177.27 1d6m h ALA 606 N 0.49 -0.39 -0.34 3.87 0.00 -1.05 0.21 119.26 122.05 1d6m h ALA 606 Ca 0.10 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1d6m h ALA 606 Cb 0.51 0.75 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 1d6m h ALA 606 CO -0.33 -0.83 -0.31 0.87 0.00 0.00 0.00 179.25 178.65 1d6m h LYS 607 N -0.37 -0.26 -0.36 0.00 1.57 0.11 -2.83 116.57 114.43 1d6m h LYS 607 Ca 0.12 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1d6m h LYS 607 Cb 0.57 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1d6m h LYS 607 CO -0.47 -0.17 -0.02 0.00 -0.57 0.00 0.00 179.45 178.23 1d6m h ARG 608 N -0.27 0.65 0.00 3.15 3.08 -0.39 -3.51 114.38 117.10 1d6m h ARG 608 Ca 0.16 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1d6m h ARG 608 Cb 0.53 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1d6m h ARG 608 CO -0.49 0.77 0.00 2.41 -1.07 0.00 0.00 179.97 181.59