#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dki s GLN 2 N 0.00 2.47 0.31 3.17 -0.21 -1.26 -5.12 119.66 119.02 2dki s GLN 2 Ca 0.00 -0.84 -0.13 0.00 0.02 0.00 0.00 55.36 54.41 2dki s GLN 2 Cb 0.00 -2.22 0.02 0.00 1.00 0.00 0.00 33.01 31.81 2dki s GLN 2 CO 0.00 0.49 0.61 -0.59 -2.12 0.00 0.00 175.29 173.67 2dki s PHE 3 N -0.41 0.36 -0.74 0.91 -0.71 -1.26 -4.92 117.98 111.21 2dki s PHE 3 Ca 0.04 -0.79 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 2dki s PHE 3 Cb -0.12 0.40 0.00 0.00 -1.21 0.00 0.00 43.02 42.09 2dki s PHE 3 CO 0.02 -1.23 0.00 0.72 -1.34 0.00 0.00 175.22 173.38 2dki n HIS 4 N -0.48 -0.01 -0.14 3.49 8.25 -1.26 -4.92 115.22 120.14 2dki n HIS 4 Ca -0.03 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.46 2dki n HIS 4 Cb 0.61 -1.53 0.33 0.00 1.12 0.00 0.00 29.99 30.52 2dki n HIS 4 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2dki h LEU 5 N 0.00 0.68 -3.10 2.41 5.85 -1.98 -2.96 115.31 116.20 2dki h LEU 5 Ca -0.15 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2dki h LEU 5 Cb 0.49 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.36 2dki h LEU 5 CO 0.21 0.48 0.00 0.59 -0.34 0.00 0.00 178.44 179.38 2dki n ASN 6 N -4.45 2.98 0.00 1.25 3.02 -1.26 -4.33 115.26 112.46 2dki n ASN 6 Ca 0.07 -3.01 0.00 0.00 -0.03 0.00 0.00 54.58 51.61 2dki n ASN 6 Cb 0.10 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2dki n ASN 6 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dki n GLY 7 N -1.00 4.29 3.77 7.41 0.00 -1.12 -4.93 105.19 113.60 2dki n GLY 7 Ca 0.18 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 2dki n GLY 7 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2dki s PHE 8 N -2.11 2.61 -0.12 1.61 2.19 -1.26 -4.32 117.98 116.58 2dki s PHE 8 Ca 0.00 1.05 -0.01 0.00 0.33 0.00 0.00 56.93 58.29 2dki s PHE 8 Cb 0.00 -4.05 0.04 0.00 -1.31 0.00 0.00 43.02 37.69 2dki s PHE 8 CO 0.00 -3.22 -0.01 0.50 1.83 0.00 0.00 175.22 174.32 2dki s ARG 9 N -1.66 0.85 0.93 10.12 3.52 -1.26 -5.05 118.95 126.40 2dki s ARG 9 Ca 0.56 -0.13 -0.12 0.00 -0.13 0.00 0.00 55.73 55.90 2dki s ARG 9 Cb -0.47 -1.44 0.15 0.00 -1.56 0.00 0.00 34.95 31.63 2dki s ARG 9 CO 0.59 -0.39 1.12 -1.25 -0.81 0.00 0.00 175.30 174.56 2dki s PRO 10 N 1.87 0.98 0.77 5.12 0.04 -1.26 -4.88 135.00 137.64 2dki s PRO 10 Ca 0.03 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.49 2dki s PRO 10 Cb -0.14 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2dki s PRO 10 CO -0.07 -2.33 0.00 0.41 0.04 0.00 0.00 177.00 175.05 2dki n GLY 11 N -1.77 -2.07 3.64 0.56 0.00 -1.26 -4.76 105.19 99.53 2dki n GLY 11 Ca 0.06 -1.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 2dki n GLY 11 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dki s ASN 12 N -3.54 6.48 0.58 1.61 2.47 -1.26 -4.88 114.94 116.40 2dki s ASN 12 Ca 0.00 1.94 0.38 0.00 0.42 0.00 0.00 52.86 55.61 2dki s ASN 12 Cb 0.00 -2.53 2.09 0.00 -1.45 0.00 0.00 41.25 39.36 2dki s ASN 12 CO 0.00 -1.12 2.18 1.55 -3.72 0.00 0.00 177.10 175.98 2dki h PRO 13 N 10.34 0.00 0.00 0.43 0.13 -1.90 -1.84 132.00 139.16 2dki h PRO 13 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2dki h PRO 13 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2dki h PRO 13 CO 0.98 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 180.03 2dki n LEU 14 N -2.87 0.25 -4.56 1.56 4.77 -1.26 -4.44 117.00 110.45 2dki n LEU 14 Ca -0.03 0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 56.08 2dki n LEU 14 Cb 0.08 -0.49 -0.07 0.00 -2.33 0.00 0.00 43.42 40.61 2dki n LEU 14 CO 0.17 -0.25 0.35 -0.63 -1.33 0.00 0.00 177.39 175.70 2dki s ILE 15 N -3.08 4.91 0.44 -0.08 1.01 -0.69 -4.82 121.20 118.88 2dki s ILE 15 Ca 0.09 0.47 -0.18 0.00 0.00 0.00 0.00 60.65 61.03 2dki s ILE 15 Cb 0.12 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.43 2dki s ILE 15 CO 0.40 -0.33 0.91 0.00 0.00 0.00 0.00 174.94 175.93 2dki s ALA 16 N 2.65 3.12 0.30 9.38 0.00 0.06 -4.97 121.76 132.30 2dki s ALA 16 Ca 0.23 0.22 -0.29 0.00 0.00 0.00 0.00 51.96 52.12 2dki s ALA 16 Cb -0.15 -3.04 -0.10 0.00 0.00 0.00 0.00 23.12 19.83 2dki s ALA 16 CO 0.15 0.03 1.24 -2.14 0.00 0.00 0.00 175.76 175.05 2dki s PRO 17 N -3.50 4.45 0.15 0.00 0.02 -1.26 -4.68 135.00 130.18 2dki s PRO 17 Ca 0.59 2.07 -0.31 0.00 0.02 0.00 0.00 61.00 63.37 2dki s PRO 17 Cb -0.10 -3.12 -0.11 0.00 0.02 0.00 0.00 34.50 31.19 2dki s PRO 17 CO 0.21 -0.07 1.80 0.00 -0.33 0.00 0.00 177.00 178.61 2dki s ALA 18 N -1.00 3.83 0.04 -1.55 0.00 -1.26 -4.41 121.76 117.40 2dki s ALA 18 Ca 0.48 1.50 -0.29 0.00 0.00 0.00 0.00 51.96 53.66 2dki s ALA 18 Cb -0.37 -3.74 -0.04 0.00 0.00 0.00 0.00 23.12 18.96 2dki s ALA 18 CO 0.48 -1.13 0.91 0.45 0.00 0.00 0.00 175.76 176.47 2dki s SER 19 N 2.23 7.35 0.49 0.00 0.15 0.27 -4.93 113.70 119.26 2dki s SER 19 Ca 0.79 1.63 0.27 0.00 0.70 0.00 0.00 55.95 59.34 2dki s SER 19 Cb -0.47 -2.55 1.22 0.00 -1.71 0.00 0.00 66.02 62.51 2dki s SER 19 CO 0.35 -0.13 1.95 1.55 1.20 0.00 0.00 173.24 178.16 2dki h PRO 20 N 6.18 0.00 0.00 5.44 0.13 -1.93 -2.38 132.00 139.45 2dki h PRO 20 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2dki h PRO 20 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dki h PRO 20 CO 0.73 0.15 0.00 1.28 -0.23 0.00 0.00 178.00 179.93 2dki n LEU 21 N -3.42 0.56 -4.27 1.56 4.77 -1.26 -4.54 117.00 110.41 2dki n LEU 21 Ca -0.01 0.69 -0.36 0.00 -0.03 0.00 0.00 56.01 56.31 2dki n LEU 21 Cb 0.33 -0.68 -0.14 0.00 -2.33 0.00 0.00 43.42 40.61 2dki n LEU 21 CO 0.31 -0.71 -0.35 0.00 -1.33 0.00 0.00 177.39 175.31 2dki s ALA 22 N -3.39 2.87 0.35 -1.18 0.00 -0.90 -4.71 121.76 114.80 2dki s ALA 22 Ca 0.01 -1.46 -0.28 0.00 0.00 0.00 0.00 51.96 50.23 2dki s ALA 22 Cb 0.08 -1.90 -0.11 0.00 0.00 0.00 0.00 23.12 21.19 2dki s ALA 22 CO 0.28 -0.87 1.37 -1.25 0.00 0.00 0.00 175.76 175.30 2dki s PRO 23 N 1.40 4.27 0.62 0.00 0.04 -1.26 -4.89 135.00 135.18 2dki s PRO 23 Ca 0.01 2.35 -0.18 0.00 0.04 0.00 0.00 61.00 63.22 2dki s PRO 23 Cb -0.17 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.30 2dki s PRO 23 CO -0.01 -0.31 1.01 0.00 0.04 0.00 0.00 177.00 177.73 2dki n ALA 24 N 0.67 0.31 -1.75 8.56 0.00 -1.26 -4.91 120.51 122.13 2dki n ALA 24 Ca 0.00 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 2dki n ALA 24 Cb 0.41 -2.14 -0.01 0.00 0.00 0.00 0.00 19.45 17.71 2dki n ALA 24 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2dki n HIS 25 N -1.85 2.79 -4.36 0.00 -0.00 -1.26 -5.01 115.22 105.53 2dki n HIS 25 Ca 0.14 0.41 -0.29 0.00 0.46 0.00 0.00 57.72 58.44 2dki n HIS 25 Cb 0.48 -2.53 -0.12 0.00 -0.12 0.00 0.00 29.99 27.70 2dki n HIS 25 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 2dki s THR 26 N -0.72 2.54 0.25 3.57 -4.23 -1.26 -5.03 115.64 110.76 2dki s THR 26 Ca 0.58 -1.72 -0.06 0.00 -1.18 0.00 0.00 61.69 59.31 2dki s THR 26 Cb -0.51 -2.17 0.24 0.00 1.34 0.00 0.00 72.50 71.40 2dki s THR 26 CO 0.58 0.04 1.90 -0.08 -0.54 0.00 0.00 174.62 176.52 2dki h GLU 27 N 3.63 1.16 -5.98 3.99 4.22 -2.02 -3.41 114.58 116.17 2dki h GLU 27 Ca -0.49 -0.07 -0.61 0.00 0.08 0.00 0.00 59.36 58.27 2dki h GLU 27 Cb 1.18 -0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.11 2dki h GLU 27 CO 0.44 0.77 -0.20 0.00 -2.18 0.00 0.00 179.01 177.84 2dki s ALA 28 N -6.09 3.67 0.17 2.92 0.00 -1.26 -5.03 121.76 116.14 2dki s ALA 28 Ca -0.13 -0.22 -0.32 0.00 0.00 0.00 0.00 51.96 51.30 2dki s ALA 28 Cb 0.18 -2.41 -0.12 0.00 0.00 0.00 0.00 23.12 20.77 2dki s ALA 28 CO 0.81 0.43 1.77 0.28 0.00 0.00 0.00 175.76 179.04 2dki n VAL 29 N 2.03 0.16 -1.31 0.00 0.31 -1.26 -4.92 118.33 113.33 2dki n VAL 29 Ca -0.13 -0.03 -0.36 0.00 -0.01 0.00 0.00 64.34 63.81 2dki n VAL 29 Cb 0.52 -2.01 0.07 0.00 -0.91 0.00 0.00 33.84 31.51 2dki n VAL 29 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2dki n PRO 30 N 4.66 0.39 -0.08 5.55 -0.04 -1.26 -4.92 135.00 139.30 2dki n PRO 30 Ca 0.17 0.18 -0.15 0.00 -0.04 0.00 0.00 63.50 63.66 2dki n PRO 30 Cb 0.35 -1.97 -0.05 0.00 -0.04 0.00 0.00 33.50 31.80 2dki n PRO 30 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2dki h SER 31 N -0.29 0.93 -3.91 3.54 0.02 -1.91 -3.44 113.55 108.49 2dki h SER 31 Ca -0.46 -0.54 -0.50 0.00 -0.84 0.00 0.00 61.79 59.45 2dki h SER 31 Cb 1.35 -0.27 -0.31 0.00 0.14 0.00 0.00 62.40 63.31 2dki h SER 31 CO 0.44 1.29 -0.82 -1.10 -1.14 0.00 0.00 176.83 175.51 2dki s GLN 32 N -4.11 1.40 0.06 3.45 -0.21 -1.26 -0.24 119.66 118.75 2dki s GLN 32 Ca -0.11 -0.48 -0.02 0.00 0.02 0.00 0.00 55.36 54.76 2dki s GLN 32 Cb 0.09 -1.26 -0.03 0.00 1.00 0.00 0.00 33.01 32.82 2dki s GLN 32 CO 0.88 0.20 0.01 0.14 -2.12 0.00 0.00 175.29 174.40 2dki s VAL 33 N 0.05 0.20 -0.10 1.09 -7.23 0.25 -4.96 120.40 109.70 2dki s VAL 33 Ca -0.02 -1.66 -0.25 0.00 -1.81 0.00 0.00 61.98 58.24 2dki s VAL 33 Cb -0.10 -1.44 -0.21 0.00 0.56 0.00 0.00 36.38 35.20 2dki s VAL 33 CO 0.01 -0.92 0.81 0.44 -0.31 0.00 0.00 175.10 175.13 2dki h ASP 34 N 3.14 -0.03 -3.43 4.85 3.45 -1.19 -2.81 116.42 120.41 2dki h ASP 34 Ca -0.34 -0.71 -0.51 0.00 0.43 0.00 0.00 57.03 55.90 2dki h ASP 34 Cb 1.15 0.01 -0.33 0.00 -0.56 0.00 0.00 39.33 39.60 2dki h ASP 34 CO 0.63 0.76 -0.81 -0.69 -1.57 0.00 0.00 179.24 177.57 2dki s VAL 35 N -2.71 1.09 -0.23 -1.35 1.01 -0.77 -1.50 120.40 115.94 2dki s VAL 35 Ca -0.16 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 2dki s VAL 35 Cb -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.37 2dki s VAL 35 CO 0.59 0.34 -0.05 -0.22 0.00 0.00 0.00 175.10 175.76 2dki s LEU 36 N 0.68 2.95 -0.15 3.92 2.96 -0.54 -0.96 118.68 127.53 2dki s LEU 36 Ca -0.14 -0.52 -0.05 0.00 -0.22 0.00 0.00 54.13 53.20 2dki s LEU 36 Cb -0.16 -1.71 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2dki s LEU 36 CO 0.03 -0.05 0.03 -0.63 -1.32 0.00 0.00 176.35 174.42 2dki s ILE 37 N 1.44 4.54 -0.30 6.68 1.01 0.72 -0.64 121.20 134.65 2dki s ILE 37 Ca 0.05 -0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 2dki s ILE 37 Cb -0.15 -3.00 0.02 0.00 0.01 0.00 0.00 42.46 39.34 2dki s ILE 37 CO -0.04 0.51 0.07 -0.69 0.00 0.00 0.00 174.94 174.79 2dki s VAL 38 N 0.01 3.76 0.00 2.92 1.01 -0.39 -0.92 120.40 126.80 2dki s VAL 38 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2dki s VAL 38 Cb -0.12 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2dki s VAL 38 CO 0.01 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2dki n GLY 39 N 4.82 2.51 2.80 4.51 0.00 0.19 -0.85 105.19 119.18 2dki n GLY 39 Ca -0.14 -1.16 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 2dki n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dki n GLY 41 N -0.38 1.59 0.22 0.00 0.00 -1.26 -4.71 105.19 100.65 2dki n GLY 41 Ca 0.54 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2dki n GLY 41 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2dki h PRO 42 N 0.00 0.16 0.14 1.61 0.11 -1.93 -0.54 132.00 131.55 2dki h PRO 42 Ca -0.01 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 2dki h PRO 42 Cb 0.04 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.12 2dki h PRO 42 CO 0.01 0.11 -0.07 0.00 -0.21 0.00 0.00 178.00 177.84 2dki h ALA 43 N 1.50 -0.19 -0.13 -0.75 0.00 -1.90 -1.41 119.26 116.39 2dki h ALA 43 Ca 0.30 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2dki h ALA 43 Cb 0.47 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2dki h ALA 43 CO -0.45 -0.49 -0.07 0.78 0.00 0.00 0.00 179.25 179.01 2dki h GLY 44 N -0.42 0.04 1.90 0.00 0.00 -1.58 -1.46 103.07 101.55 2dki h GLY 44 Ca -0.02 0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 2dki h GLY 44 CO 0.03 -0.09 -0.24 1.41 0.00 0.00 0.00 176.54 177.65 2dki h LEU 45 N -0.07 0.12 -0.20 3.11 3.38 -1.15 -0.28 115.31 120.22 2dki h LEU 45 Ca 0.08 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2dki h LEU 45 Cb 0.18 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2dki h LEU 45 CO -0.18 0.36 -0.02 0.74 0.09 0.00 0.00 178.44 179.44 2dki h THR 46 N 0.11 1.27 -0.34 0.22 2.02 -0.80 -0.58 112.91 114.82 2dki h THR 46 Ca 0.02 -0.93 -0.04 0.00 0.77 0.00 0.00 66.41 66.22 2dki h THR 46 Cb 0.49 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 2dki h THR 46 CO 0.03 0.28 0.04 0.25 0.37 0.00 0.00 175.52 176.50 2dki h LEU 47 N 0.12 0.55 -0.82 2.58 5.85 -0.98 -2.25 115.31 120.36 2dki h LEU 47 Ca 0.06 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.51 2dki h LEU 47 Cb 0.43 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2dki h LEU 47 CO 0.01 0.68 0.54 0.00 -0.34 0.00 0.00 178.44 179.34 2dki h ALA 48 N 0.88 1.04 -0.16 1.25 0.00 -1.01 -1.07 119.26 120.20 2dki h ALA 48 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2dki h ALA 48 Cb 0.38 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2dki h ALA 48 CO 0.01 0.43 -0.08 0.00 0.00 0.00 0.00 179.25 179.61 2dki h ALA 49 N 1.31 1.58 -0.05 0.00 0.00 -0.91 0.13 119.26 121.32 2dki h ALA 49 Ca 0.30 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2dki h ALA 49 Cb -0.11 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2dki h ALA 49 CO -0.07 0.30 -0.35 0.37 0.00 0.00 0.00 179.25 179.50 2dki h GLN 50 N 0.23 0.33 0.00 0.00 5.75 -0.76 -3.26 115.11 117.40 2dki h GLN 50 Ca 0.05 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 2dki h GLN 50 Cb 0.29 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.91 2dki h GLN 50 CO 0.01 0.94 0.00 -0.07 -2.65 0.00 0.00 178.83 177.06 2dki h LEU 51 N -0.18 0.00 -0.96 -2.39 3.38 -0.95 -3.02 115.31 111.19 2dki h LEU 51 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2dki h LEU 51 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2dki h LEU 51 CO 0.07 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.60 2dki h ALA 52 N 2.07 1.00 -0.00 1.53 0.00 -1.01 -1.93 119.26 120.91 2dki h ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dki h ALA 52 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2dki h ALA 52 CO 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 179.25 179.22 2dki n ALA 53 N -1.81 2.48 -3.86 0.00 0.00 -1.14 -3.53 120.51 112.65 2dki n ALA 53 Ca 0.01 -0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.00 2dki n ALA 53 Cb 0.19 -1.45 -0.12 0.00 0.00 0.00 0.00 19.45 18.08 2dki n ALA 53 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2dki s PHE 54 N -2.81 3.47 -0.62 0.00 0.08 -0.73 -4.90 117.98 112.46 2dki s PHE 54 Ca 0.20 -3.16 0.10 0.00 0.12 0.00 0.00 56.93 54.19 2dki s PHE 54 Cb 0.19 -2.89 0.56 0.00 -0.57 0.00 0.00 43.02 40.31 2dki s PHE 54 CO 0.51 -0.68 1.32 -0.35 -0.10 0.00 0.00 175.22 175.92 2dki n PRO 55 N 2.59 0.07 0.01 0.24 -0.04 -1.26 -1.35 135.00 135.25 2dki n PRO 55 Ca 0.13 0.56 0.14 0.00 -0.04 0.00 0.00 63.50 64.29 2dki n PRO 55 Cb 0.35 -1.72 0.53 0.00 -0.04 0.00 0.00 33.50 32.62 2dki n PRO 55 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2dki n ASP 56 N -1.86 0.14 -4.65 3.54 5.68 -1.26 -3.86 116.55 114.28 2dki n ASP 56 Ca -0.01 0.35 -0.35 0.00 -0.50 0.00 0.00 54.79 54.29 2dki n ASP 56 Cb 0.02 -0.36 -0.10 0.00 -1.14 0.00 0.00 41.12 39.55 2dki n ASP 56 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2dki s ILE 57 N -3.01 4.71 -0.56 2.12 1.01 -0.46 -5.06 121.20 119.95 2dki s ILE 57 Ca 0.13 -0.07 -0.23 0.00 0.00 0.00 0.00 60.65 60.49 2dki s ILE 57 Cb 0.18 -3.10 0.05 0.00 0.01 0.00 0.00 42.46 39.61 2dki s ILE 57 CO 0.57 0.49 0.87 -0.60 0.00 0.00 0.00 174.94 176.27 2dki s ARG 58 N 0.12 3.24 -0.13 2.79 6.06 -1.26 -4.96 118.95 124.82 2dki s ARG 58 Ca 0.04 -0.51 -0.01 0.00 -2.50 0.00 0.00 55.73 52.75 2dki s ARG 58 Cb -0.12 -4.09 -0.02 0.00 0.06 0.00 0.00 34.95 30.77 2dki s ARG 58 CO 0.01 -1.48 -0.09 0.99 -2.50 0.00 0.00 175.30 172.23 2dki s THR 59 N 3.66 3.46 -0.10 4.11 2.01 -1.26 -0.66 115.64 126.85 2dki s THR 59 Ca 0.25 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.75 2dki s THR 59 Cb -0.15 -2.48 0.01 0.00 0.01 0.00 0.00 72.50 69.90 2dki s THR 59 CO 0.16 0.52 -0.15 0.00 -0.69 0.00 0.00 174.62 174.46 2dki s ILE 61 N 0.97 2.42 0.17 0.00 2.07 -1.26 -0.20 121.20 125.37 2dki s ILE 61 Ca -0.07 -0.87 0.08 0.00 -1.41 0.00 0.00 60.65 58.38 2dki s ILE 61 Cb -0.15 -1.99 -0.04 0.00 0.13 0.00 0.00 42.46 40.41 2dki s ILE 61 CO -0.01 0.54 -0.07 0.68 -1.91 0.00 0.00 174.94 174.17 2dki s VAL 62 N 0.63 3.38 -0.10 4.00 -7.23 -0.09 -1.51 120.40 119.48 2dki s VAL 62 Ca -0.10 -1.53 -0.08 0.00 -1.81 0.00 0.00 61.98 58.47 2dki s VAL 62 Cb -0.16 -2.67 0.03 0.00 0.56 0.00 0.00 36.38 34.14 2dki s VAL 62 CO 0.02 -0.08 0.26 -0.70 -0.31 0.00 0.00 175.10 174.30 2dki s GLU 63 N -2.77 0.27 0.27 4.82 2.56 -1.05 0.58 118.70 123.38 2dki s GLU 63 Ca 0.25 0.42 0.12 0.00 0.00 0.00 0.00 54.97 55.76 2dki s GLU 63 Cb -0.09 0.06 0.31 0.00 2.00 0.00 0.00 34.13 36.40 2dki s GLU 63 CO 0.16 -0.08 1.57 -0.56 -0.56 0.00 0.00 175.26 175.79 2dki h GLN 64 N 6.22 0.00 -7.14 4.30 3.07 -1.62 -0.30 115.11 119.63 2dki h GLN 64 Ca -0.31 0.00 -0.54 0.00 0.09 0.00 0.00 58.65 57.89 2dki h GLN 64 Cb 1.18 0.00 0.15 0.00 0.08 0.00 0.00 27.48 28.89 2dki h GLN 64 CO 0.35 0.63 0.45 0.15 0.09 0.00 0.00 178.83 180.50 2dki s LYS 65 N -3.42 2.39 0.00 0.06 1.02 -1.26 -3.40 119.74 115.12 2dki s LYS 65 Ca -0.00 1.88 0.28 0.00 0.02 0.00 0.00 55.97 58.15 2dki s LYS 65 Cb 0.12 -1.85 1.57 0.00 -0.52 0.00 0.00 37.83 37.15 2dki s LYS 65 CO 0.76 -1.67 2.02 0.39 -0.92 0.00 0.00 175.35 175.93 2dki n GLU 66 N -2.28 1.11 -3.07 1.68 1.02 -1.26 -0.97 120.64 116.86 2dki n GLU 66 Ca 0.14 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2dki n GLU 66 Cb 0.49 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 2dki n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dki n GLY 67 N 0.98 -1.22 3.77 0.62 0.00 -1.26 -4.68 105.19 103.39 2dki n GLY 67 Ca 0.21 -1.00 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 2dki n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dki s PRO 68 N -1.68 3.80 0.55 1.61 0.04 -1.26 -5.01 135.00 133.04 2dki s PRO 68 Ca 0.00 1.95 -0.15 0.00 0.04 0.00 0.00 61.00 62.84 2dki s PRO 68 Cb 0.00 -2.54 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 2dki s PRO 68 CO 0.00 -0.56 1.00 0.00 0.04 0.00 0.00 177.00 177.48 2dki s MET 69 N -2.51 3.79 -0.01 4.56 0.23 -1.26 -4.98 119.30 119.13 2dki s MET 69 Ca 0.61 0.95 0.08 0.00 -1.03 0.00 0.00 55.69 56.30 2dki s MET 69 Cb -0.33 -2.11 -0.10 0.00 -1.53 0.00 0.00 34.83 30.76 2dki s MET 69 CO 0.41 -0.40 0.23 0.39 -2.03 0.00 0.00 175.02 173.62 2dki n GLU 70 N -1.86 2.08 -3.37 3.16 1.02 -1.26 -4.77 120.64 115.63 2dki n GLU 70 Ca 0.07 -0.04 -0.11 0.00 -0.02 0.00 0.00 57.16 57.06 2dki n GLU 70 Cb 0.54 -1.04 -0.09 0.00 -0.02 0.00 0.00 31.44 30.83 2dki n GLU 70 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2dki s LEU 71 N -3.03 -0.54 0.45 -4.62 0.20 -1.26 -4.77 118.68 105.11 2dki s LEU 71 Ca -0.00 0.04 0.08 0.00 0.69 0.00 0.00 54.13 54.94 2dki s LEU 71 Cb 0.05 0.97 0.01 0.00 -0.43 0.00 0.00 46.19 46.79 2dki s LEU 71 CO 0.31 -0.31 0.53 -0.83 -0.29 0.00 0.00 176.35 175.76 2dki s GLY 72 N 2.50 2.01 0.07 7.98 0.00 -1.26 -4.93 107.32 113.69 2dki s GLY 72 Ca 0.11 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 43.09 2dki s GLY 72 CO -0.18 -1.62 1.10 0.06 0.00 0.00 0.00 173.10 172.47 2dki h GLN 73 N 0.71 0.09 -6.69 2.90 -0.00 -2.00 -3.43 115.11 106.70 2dki h GLN 73 Ca -0.39 -0.15 -0.50 0.00 -0.00 0.00 0.00 58.65 57.61 2dki h GLN 73 Cb 1.28 0.06 -0.01 0.00 -0.00 0.00 0.00 27.48 28.80 2dki h GLN 73 CO 0.49 0.98 0.04 0.00 -0.00 0.00 0.00 178.83 180.35 2dki s ALA 74 N -2.67 3.41 0.00 0.06 0.00 -1.26 -4.97 121.76 116.32 2dki s ALA 74 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 51.77 2dki s ALA 74 Cb 0.09 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.57 2dki s ALA 74 CO 0.84 0.23 0.00 -0.40 0.00 0.00 0.00 175.76 176.43 2dki n ASP 75 N -0.72 0.00 -4.67 0.00 5.75 -1.26 -2.38 116.55 113.27 2dki n ASP 75 Ca 0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.38 2dki n ASP 75 Cb 0.53 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.59 2dki n ASP 75 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2dki s GLY 76 N 0.00 2.07 -0.33 6.12 0.00 -1.26 -1.07 107.32 112.85 2dki s GLY 76 Ca 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 44.72 44.80 2dki s GLY 76 CO 0.00 1.80 0.07 -0.42 0.00 0.00 0.00 173.10 174.54 2dki s ILE 77 N 2.31 3.22 0.68 0.90 1.01 0.11 -4.61 121.20 124.82 2dki s ILE 77 Ca 0.41 -1.48 -0.14 0.00 0.00 0.00 0.00 60.65 59.44 2dki s ILE 77 Cb -0.17 -2.92 0.01 0.00 0.01 0.00 0.00 42.46 39.39 2dki s ILE 77 CO 0.12 -0.25 1.10 0.00 0.00 0.00 0.00 174.94 175.91 2dki s ALA 78 N 1.26 2.47 0.16 9.38 0.00 -1.26 -1.41 121.76 132.36 2dki s ALA 78 Ca -0.02 0.44 -0.19 0.00 0.00 0.00 0.00 51.96 52.19 2dki s ALA 78 Cb -0.20 -3.29 0.08 0.00 0.00 0.00 0.00 23.12 19.71 2dki s ALA 78 CO -0.01 -1.32 1.65 0.00 0.00 0.00 0.00 175.76 176.08 2dki h ARG 80 N -0.11 0.95 -0.61 0.00 1.12 -1.41 -0.80 114.38 113.52 2dki h ARG 80 Ca 0.18 -0.06 -0.07 0.00 -1.11 0.00 0.00 59.98 58.92 2dki h ARG 80 Cb 0.38 -0.22 -0.03 0.00 -0.01 0.00 0.00 29.97 30.10 2dki h ARG 80 CO -0.42 0.63 0.10 1.15 -3.11 0.00 0.00 179.97 178.32 2dki h THR 81 N 0.98 1.25 -0.50 0.20 2.02 -1.30 -1.86 112.91 113.69 2dki h THR 81 Ca 0.28 -0.98 -0.05 0.00 0.77 0.00 0.00 66.41 66.42 2dki h THR 81 Cb -0.08 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 2dki h THR 81 CO -0.06 0.36 0.09 0.24 0.37 0.00 0.00 175.52 176.52 2dki h MET 82 N 0.94 0.79 -0.86 6.66 2.86 0.27 0.10 114.93 125.69 2dki h MET 82 Ca 0.19 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2dki h MET 82 Cb 0.40 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 2dki h MET 82 CO 0.01 0.73 0.43 0.93 1.06 0.00 0.00 176.91 180.07 2dki h GLU 83 N 0.75 1.23 -0.46 1.72 5.08 -0.44 -0.05 114.58 122.41 2dki h GLU 83 Ca 0.16 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 2dki h GLU 83 Cb 0.33 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2dki h GLU 83 CO 0.00 0.93 -0.20 1.98 -1.00 0.00 0.00 179.01 180.73 2dki h MET 84 N 1.22 0.93 -0.51 2.33 4.05 -0.66 -2.09 114.93 120.21 2dki h MET 84 Ca 0.30 -0.38 -0.02 0.00 -0.28 0.00 0.00 59.70 59.32 2dki h MET 84 Cb 0.10 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 2dki h MET 84 CO -0.04 1.04 0.24 0.74 0.23 0.00 0.00 176.91 179.13 2dki h PHE 85 N 0.81 0.69 -0.82 1.39 0.04 -0.33 0.63 116.94 119.36 2dki h PHE 85 Ca 0.11 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.85 2dki h PHE 85 Cb 0.76 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.65 2dki h PHE 85 CO 0.05 0.51 0.43 1.49 -0.60 0.00 0.00 178.31 180.19 2dki h GLU 86 N 0.71 1.15 0.00 1.51 4.57 -0.49 -0.70 114.58 121.33 2dki h GLU 86 Ca 0.18 -0.14 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 2dki h GLU 86 Cb 0.07 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.44 2dki h GLU 86 CO -0.02 0.85 -0.13 0.00 -1.18 0.00 0.00 179.01 178.53 2dki h ALA 87 N 1.33 1.50 -0.59 2.92 0.00 -0.25 -0.38 119.26 123.79 2dki h ALA 87 Ca 0.29 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2dki h ALA 87 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dki h ALA 87 CO -0.04 0.16 0.00 1.19 0.00 0.00 0.00 179.25 180.55 2dki n PHE 88 N -3.96 0.79 -2.40 0.00 3.01 -0.36 -1.55 117.46 112.99 2dki n PHE 88 Ca -0.02 -0.39 -0.21 0.00 1.01 0.00 0.00 57.45 57.83 2dki n PHE 88 Cb 0.22 -0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.67 2dki n PHE 88 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2dki n GLU 89 N 1.21 -1.68 -0.35 -1.08 1.02 -0.15 -4.88 120.64 114.73 2dki n GLU 89 Ca 0.20 1.02 0.03 0.00 -0.02 0.00 0.00 57.16 58.38 2dki n GLU 89 Cb 0.50 -5.68 0.04 0.00 -0.02 0.00 0.00 31.44 26.27 2dki n GLU 89 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 2dki n PHE 90 N -4.02 0.00 0.08 -0.32 -1.74 -0.81 -4.78 117.46 105.87 2dki n PHE 90 Ca -0.25 -0.27 -0.02 0.00 -0.56 0.00 0.00 57.45 56.35 2dki n PHE 90 Cb 0.69 -0.07 0.22 0.00 1.52 0.00 0.00 39.48 41.84 2dki n PHE 90 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2dki h ALA 91 N 0.00 1.11 0.08 1.98 0.00 -1.85 -2.73 119.26 117.85 2dki h ALA 91 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.54 2dki h ALA 91 Cb 1.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2dki h ALA 91 CO 0.00 0.57 -0.18 0.38 0.00 0.00 0.00 179.25 180.03 2dki h ASP 92 N 0.25 -0.50 -0.81 0.00 -0.00 -1.90 -0.89 116.42 112.57 2dki h ASP 92 Ca 0.03 0.06 0.01 0.00 -0.00 0.00 0.00 57.03 57.13 2dki h ASP 92 Cb 0.77 0.19 -0.04 0.00 -0.00 0.00 0.00 39.33 40.26 2dki h ASP 92 CO 0.06 -0.25 0.53 -1.28 -0.00 0.00 0.00 179.24 178.30 2dki h SER 93 N -0.33 0.94 -0.96 4.15 0.87 -1.88 -2.12 113.55 114.22 2dki h SER 93 Ca 0.03 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2dki h SER 93 Cb 0.36 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.04 2dki h SER 93 CO -0.11 0.69 0.60 0.40 -0.53 0.00 0.00 176.83 177.88 2dki h ILE 94 N 1.10 1.25 -0.28 2.23 1.08 -1.14 -2.55 117.51 119.21 2dki h ILE 94 Ca 0.30 -0.51 -0.05 0.00 -0.39 0.00 0.00 64.86 64.20 2dki h ILE 94 Cb -0.12 -0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 33.49 2dki h ILE 94 CO -0.06 0.26 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.53 2dki h LEU 95 N 1.31 0.41 -0.07 1.44 3.38 -0.52 0.20 115.31 121.47 2dki h LEU 95 Ca 0.35 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 2dki h LEU 95 Cb -0.10 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2dki h LEU 95 CO -0.07 0.52 -0.47 0.50 0.09 0.00 0.00 178.44 179.01 2dki h LYS 96 N 0.42 0.00 0.00 1.13 3.64 -1.10 -3.36 116.57 117.30 2dki h LYS 96 Ca 0.09 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.11 2dki h LYS 96 Cb 0.36 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.12 2dki h LYS 96 CO 0.02 0.47 -2.34 -1.91 -2.27 0.00 0.00 179.45 173.41 2dki n GLU 97 N -3.24 0.76 -1.24 1.90 2.13 -0.99 -5.02 120.64 114.94 2dki n GLU 97 Ca 0.02 0.06 -0.31 0.00 0.66 0.00 0.00 57.16 57.59 2dki n GLU 97 Cb 0.71 -1.49 0.10 0.00 0.27 0.00 0.00 31.44 31.03 2dki n GLU 97 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dki s ALA 98 N -2.47 2.09 -0.35 4.31 0.00 0.70 -4.14 121.76 121.90 2dki s ALA 98 Ca -0.20 0.19 -0.15 0.00 0.00 0.00 0.00 51.96 51.80 2dki s ALA 98 Cb 0.07 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 2dki s ALA 98 CO 0.68 -1.91 0.36 0.00 0.00 0.00 0.00 175.76 174.89 2dki s TRP 100 N 2.00 2.57 -0.39 0.00 0.52 -1.26 -1.01 118.94 121.37 2dki s TRP 100 Ca 0.11 1.54 -0.00 0.00 0.02 0.00 0.00 56.10 57.77 2dki s TRP 100 Cb -0.17 -3.33 0.11 0.00 -1.15 0.00 0.00 33.47 28.93 2dki s TRP 100 CO 0.12 -1.80 0.16 0.42 0.02 0.00 0.00 176.95 175.87 2dki s ILE 101 N -1.80 2.95 -0.19 2.03 -1.09 -0.60 -4.89 121.20 117.62 2dki s ILE 101 Ca 0.73 -2.20 -0.06 0.00 -2.23 0.00 0.00 60.65 56.89 2dki s ILE 101 Cb -0.25 -3.06 -0.21 0.00 -1.58 0.00 0.00 42.46 37.35 2dki s ILE 101 CO 0.31 -0.67 0.10 0.59 -1.23 0.00 0.00 174.94 174.04 2dki n ASN 102 N 4.42 2.04 -4.33 3.58 3.02 -1.26 -4.49 115.26 118.24 2dki n ASN 102 Ca 0.00 0.13 -0.17 0.00 -0.03 0.00 0.00 54.58 54.50 2dki n ASN 102 Cb 0.41 -0.72 -0.10 0.00 -0.61 0.00 0.00 39.78 38.76 2dki n ASN 102 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2dki s ASP 103 N -6.89 2.18 -0.07 6.41 -0.00 -1.26 -0.41 116.67 116.63 2dki s ASP 103 Ca -0.28 -1.11 0.00 0.00 -0.00 0.00 0.00 52.55 51.16 2dki s ASP 103 Cb 0.08 -0.07 0.02 0.00 -0.00 0.00 0.00 42.92 42.96 2dki s ASP 103 CO 0.67 -0.34 -0.05 -0.69 -0.00 0.00 0.00 175.17 174.77 2dki s VAL 104 N -3.21 0.67 0.07 -1.27 1.01 -0.60 -3.47 120.40 113.60 2dki s VAL 104 Ca 0.24 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.13 2dki s VAL 104 Cb 0.03 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 2dki s VAL 104 CO 0.06 0.29 0.03 0.42 0.00 0.00 0.00 175.10 175.90 2dki s THR 105 N 1.42 4.26 -0.08 3.92 -4.23 -0.74 -1.32 115.64 118.88 2dki s THR 105 Ca -0.02 -0.84 0.03 0.00 -1.18 0.00 0.00 61.69 59.68 2dki s THR 105 Cb -0.13 -3.02 -0.02 0.00 1.34 0.00 0.00 72.50 70.67 2dki s THR 105 CO -0.03 0.16 -0.18 -0.36 -0.54 0.00 0.00 174.62 173.67 2dki s PHE 106 N -1.31 2.64 -0.05 3.99 0.08 -0.31 -1.86 117.98 121.17 2dki s PHE 106 Ca 0.26 -0.56 0.05 0.00 0.12 0.00 0.00 56.93 56.79 2dki s PHE 106 Cb -0.12 -1.70 -0.00 0.00 -0.57 0.00 0.00 43.02 40.63 2dki s PHE 106 CO 0.19 -0.12 -0.18 -1.58 -0.10 0.00 0.00 175.22 173.43 2dki s TRP 107 N -0.11 1.81 0.39 0.36 0.52 -0.35 -0.24 118.94 121.31 2dki s TRP 107 Ca -0.03 -0.52 0.05 0.00 0.02 0.00 0.00 56.10 55.62 2dki s TRP 107 Cb -0.14 -1.21 -0.02 0.00 -1.15 0.00 0.00 33.47 30.94 2dki s TRP 107 CO 0.04 -0.17 0.18 0.15 0.02 0.00 0.00 176.95 177.17 2dki s LYS 108 N 0.01 1.89 0.32 4.98 1.02 -0.96 -0.58 119.74 126.41 2dki s LYS 108 Ca -0.04 -2.14 -0.29 0.00 0.02 0.00 0.00 55.97 53.52 2dki s LYS 108 Cb -0.12 -0.29 -0.10 0.00 -0.52 0.00 0.00 37.83 36.80 2dki s LYS 108 CO 0.02 -0.55 1.26 -2.14 -0.92 0.00 0.00 175.35 173.02 2dki s PRO 109 N -3.61 4.42 -0.03 -1.68 0.02 -1.22 -1.24 135.00 131.66 2dki s PRO 109 Ca 0.28 2.12 -0.30 0.00 0.02 0.00 0.00 61.00 63.13 2dki s PRO 109 Cb 0.02 -3.10 -0.05 0.00 0.02 0.00 0.00 34.50 31.40 2dki s PRO 109 CO 0.19 -0.10 1.34 0.34 -0.33 0.00 0.00 177.00 178.45 2dki s ASP 110 N -0.57 6.91 0.26 2.53 -1.08 0.22 -4.73 116.67 120.20 2dki s ASP 110 Ca 0.48 2.01 -0.02 0.00 -0.52 0.00 0.00 52.55 54.50 2dki s ASP 110 Cb -0.38 -2.56 0.43 0.00 -1.46 0.00 0.00 42.92 38.95 2dki s ASP 110 CO 0.50 -0.69 1.85 -0.65 0.52 0.00 0.00 175.17 176.70 2dki h PRO 111 N 7.79 0.99 0.00 4.34 0.11 -1.92 -2.76 132.00 140.55 2dki h PRO 111 Ca -0.36 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.66 2dki h PRO 111 Cb 1.17 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2dki h PRO 111 CO 0.90 0.66 -1.11 0.41 -0.21 0.00 0.00 178.00 178.65 2dki n GLY 112 N -1.34 -1.41 3.64 -0.55 0.00 -1.26 -4.84 105.19 99.43 2dki n GLY 112 Ca 0.15 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 2dki n GLY 112 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dki s GLN 113 N -3.31 4.05 -0.02 1.61 1.11 -1.04 -5.06 119.66 117.00 2dki s GLN 113 Ca -0.01 -0.20 -0.30 0.00 0.01 0.00 0.00 55.36 54.86 2dki s GLN 113 Cb 0.10 -3.58 -0.05 0.00 -1.01 0.00 0.00 33.01 28.47 2dki s GLN 113 CO 0.80 -0.04 1.43 -2.14 0.01 0.00 0.00 175.29 175.35 2dki s PRO 114 N 1.34 4.26 -1.47 2.91 0.02 -1.26 -3.70 135.00 137.10 2dki s PRO 114 Ca 0.09 1.98 -0.11 0.00 0.02 0.00 0.00 61.00 62.98 2dki s PRO 114 Cb -0.14 -3.66 0.07 0.00 0.02 0.00 0.00 34.50 30.79 2dki s PRO 114 CO 0.07 -0.64 0.79 0.41 -0.33 0.00 0.00 177.00 177.30 2dki n GLY 115 N 3.72 -0.50 2.99 0.52 0.00 -1.26 -4.98 105.19 105.69 2dki n GLY 115 Ca 0.14 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.17 2dki n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dki s ARG 116 N -6.31 0.44 0.25 1.61 0.52 -1.24 -4.70 118.95 109.52 2dki s ARG 116 Ca 0.54 -0.40 0.01 0.00 -0.52 0.00 0.00 55.73 55.35 2dki s ARG 116 Cb -0.27 -0.34 -0.04 0.00 0.52 0.00 0.00 34.95 34.83 2dki s ARG 116 CO 0.66 0.08 0.43 0.96 0.02 0.00 0.00 175.30 177.45 2dki s ILE 117 N -0.62 5.19 0.04 1.52 -4.36 -1.19 0.70 121.20 122.47 2dki s ILE 117 Ca -0.03 -0.51 -0.08 0.00 -0.26 0.00 0.00 60.65 59.77 2dki s ILE 117 Cb -0.05 -3.79 -0.00 0.00 1.25 0.00 0.00 42.46 39.86 2dki s ILE 117 CO 0.00 -0.31 0.15 0.00 0.24 0.00 0.00 174.94 175.02 2dki s ALA 118 N -2.01 -0.21 0.03 2.27 0.00 -0.37 -4.69 121.76 116.77 2dki s ALA 118 Ca 0.38 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.61 2dki s ALA 118 Cb -0.10 0.28 -0.06 0.00 0.00 0.00 0.00 23.12 23.23 2dki s ALA 118 CO 0.31 -0.35 1.40 0.50 0.00 0.00 0.00 175.76 177.62 2dki s ARG 119 N -2.66 4.29 -0.03 0.00 3.52 -1.26 -2.27 118.95 120.54 2dki s ARG 119 Ca -0.04 2.00 0.13 0.00 -0.13 0.00 0.00 55.73 57.69 2dki s ARG 119 Cb -0.01 -3.49 -0.20 0.00 -1.56 0.00 0.00 34.95 29.69 2dki s ARG 119 CO -0.05 -0.54 0.26 0.72 -0.81 0.00 0.00 175.30 174.89 2dki n HIS 120 N 4.99 0.00 -3.81 5.12 8.25 0.66 -4.93 115.22 125.50 2dki n HIS 120 Ca 0.13 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.53 2dki n HIS 120 Cb 0.43 -0.35 -0.01 0.00 1.12 0.00 0.00 29.99 31.18 2dki n HIS 120 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2dki s GLY 121 N -3.69 -0.08 -0.24 -1.41 0.00 -0.98 -4.97 107.32 95.95 2dki s GLY 121 Ca -0.05 -0.19 -0.15 0.00 0.00 0.00 0.00 44.72 44.33 2dki s GLY 121 CO 0.56 0.12 0.60 -1.60 0.00 0.00 0.00 173.10 172.78 2dki s ARG 122 N -3.33 0.63 0.06 2.90 3.52 -1.26 -1.16 118.95 120.30 2dki s ARG 122 Ca 0.13 1.04 0.03 0.00 -0.13 0.00 0.00 55.73 56.81 2dki s ARG 122 Cb -0.04 0.13 -0.03 0.00 -1.56 0.00 0.00 34.95 33.46 2dki s ARG 122 CO 0.05 -0.14 -0.10 0.14 -0.81 0.00 0.00 175.30 174.44 2dki s VAL 123 N 1.34 0.80 -0.06 7.11 -7.23 -0.43 -4.98 120.40 116.93 2dki s VAL 123 Ca -0.08 -1.22 -0.30 0.00 -1.81 0.00 0.00 61.98 58.57 2dki s VAL 123 Cb -0.06 -0.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 2dki s VAL 123 CO -0.14 -0.34 1.30 -1.58 -0.31 0.00 0.00 175.10 174.03 2dki s GLN 124 N -1.75 4.30 0.20 4.82 0.74 -1.26 -1.56 119.66 125.14 2dki s GLN 124 Ca -0.06 1.79 -0.11 0.00 0.05 0.00 0.00 55.36 57.04 2dki s GLN 124 Cb -0.09 -3.63 0.18 0.00 1.10 0.00 0.00 33.01 30.57 2dki s GLN 124 CO 0.01 -0.56 1.82 0.22 -0.55 0.00 0.00 175.29 176.23 2dki h ASP 125 N 7.84 0.60 -3.65 6.67 3.58 -1.01 -3.39 116.42 127.06 2dki h ASP 125 Ca -0.34 0.01 -0.68 0.00 0.42 0.00 0.00 57.03 56.44 2dki h ASP 125 Cb 1.16 -0.11 -0.33 0.00 1.72 0.00 0.00 39.33 41.76 2dki h ASP 125 CO 0.91 0.41 -0.74 -0.89 -2.88 0.00 0.00 179.24 176.05 2dki s THR 126 N -6.12 2.82 0.50 2.25 2.01 -1.26 -5.04 115.64 110.79 2dki s THR 126 Ca -0.13 -1.24 -0.22 0.00 0.31 0.00 0.00 61.69 60.41 2dki s THR 126 Cb 0.15 -2.53 -0.08 0.00 0.01 0.00 0.00 72.50 70.05 2dki s THR 126 CO 0.76 0.06 1.07 -1.84 -0.69 0.00 0.00 174.62 173.97 2dki n GLU 127 N 4.62 1.34 -1.60 4.92 0.28 -1.26 -4.84 120.64 124.09 2dki n GLU 127 Ca -0.15 0.49 -0.47 0.00 -0.16 0.00 0.00 57.16 56.87 2dki n GLU 127 Cb 0.45 -2.20 -0.03 0.00 1.43 0.00 0.00 31.44 31.09 2dki n GLU 127 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2dki n ASP 128 N -0.12 1.69 -0.23 -1.84 10.43 -1.26 -2.31 116.55 122.91 2dki n ASP 128 Ca 0.10 1.15 -0.03 0.00 2.57 0.00 0.00 54.79 58.58 2dki n ASP 128 Cb 0.43 -1.29 -0.01 0.00 1.84 0.00 0.00 41.12 42.09 2dki n ASP 128 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2dki n GLY 129 N 1.87 0.51 0.15 0.44 0.00 -1.26 -4.90 105.19 102.00 2dki n GLY 129 Ca 0.13 -0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 2dki n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dki h LEU 130 N 0.00 0.56 -7.00 0.99 6.46 -1.80 -3.48 115.31 111.04 2dki h LEU 130 Ca -0.06 -0.48 -0.02 0.00 -0.12 0.00 0.00 57.88 57.21 2dki h LEU 130 Cb 0.57 -0.17 -0.15 0.00 -0.73 0.00 0.00 40.66 40.18 2dki h LEU 130 CO 0.09 1.29 0.24 -0.55 -0.62 0.00 0.00 178.44 178.90 2dki s SER 131 N -7.13 -0.57 0.00 1.25 0.15 -1.26 -5.03 113.70 101.10 2dki s SER 131 Ca -0.06 0.21 0.28 0.00 0.70 0.00 0.00 55.95 57.08 2dki s SER 131 Cb 0.08 0.55 0.99 0.00 -1.71 0.00 0.00 66.02 65.93 2dki s SER 131 CO 0.88 -0.82 1.75 -1.84 1.20 0.00 0.00 173.24 174.41 2dki n GLU 132 N 0.02 0.05 -4.27 5.44 0.00 -1.26 -4.82 120.64 115.80 2dki n GLU 132 Ca -0.17 -0.01 -0.27 0.00 0.00 0.00 0.00 57.16 56.71 2dki n GLU 132 Cb 0.62 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.47 2dki n GLU 132 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2dki s PHE 133 N -2.96 2.67 0.50 -1.84 0.08 -1.26 -5.14 117.98 110.04 2dki s PHE 133 Ca 0.14 -0.20 0.06 0.00 0.12 0.00 0.00 56.93 57.05 2dki s PHE 133 Cb 0.19 -1.30 0.04 0.00 -0.57 0.00 0.00 43.02 41.37 2dki s PHE 133 CO 0.58 0.51 0.69 -1.25 -0.10 0.00 0.00 175.22 175.66 2dki s PRO 134 N -2.85 2.57 0.02 0.24 0.04 -1.26 -4.80 135.00 128.95 2dki s PRO 134 Ca 0.25 -1.20 -0.29 0.00 0.04 0.00 0.00 61.00 59.80 2dki s PRO 134 Cb -0.09 -2.64 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 2dki s PRO 134 CO 0.16 -0.58 0.95 -1.58 0.04 0.00 0.00 177.00 175.98 2dki s HIS 135 N -2.57 3.68 0.18 0.56 5.65 -1.26 -4.40 115.29 117.14 2dki s HIS 135 Ca 0.58 1.67 0.02 0.00 0.25 0.00 0.00 55.06 57.58 2dki s HIS 135 Cb -0.09 -3.07 -0.05 0.00 -1.18 0.00 0.00 32.58 28.19 2dki s HIS 135 CO 0.36 0.05 -0.01 0.14 -0.65 0.00 0.00 174.74 174.63 2dki s VAL 136 N 0.77 0.79 -0.18 0.89 -7.23 -0.50 -1.55 120.40 113.38 2dki s VAL 136 Ca 0.49 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.67 2dki s VAL 136 Cb -0.21 -2.14 0.02 0.00 0.56 0.00 0.00 36.38 34.60 2dki s VAL 136 CO 0.27 -0.47 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.78 2dki s ILE 137 N -3.58 2.21 -0.15 -0.62 -1.09 -0.18 0.08 121.20 117.86 2dki s ILE 137 Ca 0.24 -0.89 -0.11 0.00 -2.23 0.00 0.00 60.65 57.66 2dki s ILE 137 Cb 0.06 -1.93 0.05 0.00 -1.58 0.00 0.00 42.46 39.05 2dki s ILE 137 CO 0.05 0.53 0.39 -0.22 -1.23 0.00 0.00 174.94 174.45 2dki s LEU 138 N 1.27 0.22 -0.27 2.97 2.96 -0.23 -1.22 118.68 124.38 2dki s LEU 138 Ca 0.04 0.81 -0.42 0.00 -0.22 0.00 0.00 54.13 54.35 2dki s LEU 138 Cb -0.13 1.29 -0.17 0.00 0.50 0.00 0.00 46.19 47.67 2dki s LEU 138 CO -0.11 -0.16 1.59 -3.20 -1.32 0.00 0.00 176.35 173.14 2dki n ASN 139 N 3.63 1.72 -0.32 3.68 5.15 -1.26 -4.46 115.26 123.41 2dki n ASN 139 Ca -0.19 1.12 0.18 0.00 -0.60 0.00 0.00 54.58 55.09 2dki n ASN 139 Cb 0.56 -1.05 0.37 0.00 -0.53 0.00 0.00 39.78 39.13 2dki n ASN 139 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 2dki h GLN 140 N 5.83 0.23 -0.67 1.20 4.15 -1.73 0.11 115.11 124.21 2dki h GLN 140 Ca -0.46 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.09 2dki h GLN 140 Cb 1.35 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.94 2dki h GLN 140 CO 0.92 0.15 0.46 0.00 -1.93 0.00 0.00 178.83 178.43 2dki h ALA 141 N 1.83 2.21 -0.20 3.38 0.00 -1.86 -0.39 119.26 124.22 2dki h ALA 141 Ca 0.64 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.38 2dki h ALA 141 Cb 1.37 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2dki h ALA 141 CO -0.65 -0.39 -0.52 0.00 0.00 0.00 0.00 179.25 177.68 2dki h ARG 142 N 0.30 0.58 -0.63 0.00 2.47 -1.12 0.44 114.38 116.43 2dki h ARG 142 Ca 0.33 -0.35 -0.07 0.00 -1.26 0.00 0.00 59.98 58.62 2dki h ARG 142 Cb 0.86 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.19 2dki h ARG 142 CO -0.08 0.96 0.11 0.28 0.56 0.00 0.00 179.97 181.80 2dki h VAL 143 N 0.45 1.25 -0.48 2.04 2.07 -1.11 -1.90 116.25 118.57 2dki h VAL 143 Ca 0.01 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 2dki h VAL 143 Cb 1.07 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2dki h VAL 143 CO 0.10 0.37 0.30 0.45 0.02 0.00 0.00 177.57 178.81 2dki h HIS 144 N 0.96 0.63 -0.41 1.57 3.86 -0.82 -1.91 115.15 119.03 2dki h HIS 144 Ca 0.19 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.48 2dki h HIS 144 Cb 0.40 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.60 2dki h HIS 144 CO 0.03 0.43 0.04 -0.44 0.86 0.00 0.00 177.93 178.84 2dki h ASP 145 N 0.65 -0.09 -0.32 2.45 3.32 -0.37 0.25 116.42 122.31 2dki h ASP 145 Ca 0.17 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.33 2dki h ASP 145 Cb -0.02 0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 2dki h ASP 145 CO -0.03 -0.01 0.15 0.45 -1.72 0.00 0.00 179.24 178.07 2dki h HIS 146 N 0.15 0.27 -0.68 4.55 3.86 -0.94 0.29 115.15 122.66 2dki h HIS 146 Ca 0.20 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 2dki h HIS 146 Cb 0.27 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.63 2dki h HIS 146 CO -0.24 0.14 0.26 1.88 0.86 0.00 0.00 177.93 180.83 2dki h TYR 147 N 0.31 1.04 -0.04 2.45 0.99 -0.81 -0.12 116.97 120.80 2dki h TYR 147 Ca 0.14 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.73 2dki h TYR 147 Cb 0.06 -0.31 -0.01 0.00 1.00 0.00 0.00 36.73 37.47 2dki h TYR 147 CO -0.11 0.82 -0.21 -0.07 -0.00 0.00 0.00 178.16 178.60 2dki h LEU 148 N 0.97 0.06 0.19 3.88 3.38 0.00 0.37 115.31 124.16 2dki h LEU 148 Ca 0.22 -0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.89 2dki h LEU 148 Cb 0.23 -0.02 0.03 0.00 0.09 0.00 0.00 40.66 40.99 2dki h LEU 148 CO -0.02 0.27 -1.24 -0.08 0.09 0.00 0.00 178.44 177.47 2dki h GLU 149 N 0.06 0.50 -0.50 1.13 4.81 -0.59 -2.19 114.58 117.81 2dki h GLU 149 Ca 0.01 -0.80 0.02 0.00 -0.13 0.00 0.00 59.36 58.46 2dki h GLU 149 Cb 0.40 0.29 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 2dki h GLU 149 CO 0.03 1.37 0.30 -0.09 -0.73 0.00 0.00 179.01 179.89 2dki h ARG 150 N 0.04 0.58 -0.44 1.92 9.65 -0.68 0.23 114.38 125.67 2dki h ARG 150 Ca -0.21 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.63 2dki h ARG 150 Cb 1.96 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 30.39 2dki h ARG 150 CO 0.23 0.38 0.27 0.52 2.80 0.00 0.00 179.97 184.18 2dki h MET 151 N 0.60 0.60 -0.51 0.20 2.86 -0.98 -1.69 114.93 116.00 2dki h MET 151 Ca 0.20 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 2dki h MET 151 Cb 0.01 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 2dki h MET 151 CO -0.08 0.43 -0.03 -0.09 1.06 0.00 0.00 176.91 178.19 2dki h ARG 152 N 0.59 0.93 -0.00 1.72 2.43 -0.88 -1.46 114.38 117.70 2dki h ARG 152 Ca 0.16 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2dki h ARG 152 Cb -0.02 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2dki h ARG 152 CO -0.03 0.97 -0.07 0.09 -1.51 0.00 0.00 179.97 179.42 2dki n ASN 153 N -4.27 0.32 -4.73 -3.80 5.03 0.75 -4.15 115.26 104.41 2dki n ASN 153 Ca 0.01 -0.50 -0.29 0.00 0.87 0.00 0.00 54.58 54.67 2dki n ASN 153 Cb 0.34 -0.12 0.15 0.00 -1.02 0.00 0.00 39.78 39.13 2dki n ASN 153 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2dki s SER 154 N -2.46 3.23 0.60 6.41 1.04 -0.65 -0.76 113.70 121.11 2dki s SER 154 Ca 0.30 1.19 0.35 0.00 0.48 0.00 0.00 55.95 58.27 2dki s SER 154 Cb 0.20 -1.85 1.90 0.00 0.10 0.00 0.00 66.02 66.38 2dki s SER 154 CO 0.46 -2.75 2.23 -0.65 0.98 0.00 0.00 173.24 173.50 2dki h PRO 155 N -1.63 0.00 0.00 4.02 0.11 -1.77 -1.55 132.00 131.18 2dki h PRO 155 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2dki h PRO 155 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2dki h PRO 155 CO 0.58 0.03 0.00 0.77 -0.21 0.00 0.00 178.00 179.18 2dki h SER 156 N 0.00 0.00 -6.51 -2.05 0.02 -1.85 0.79 113.55 103.94 2dki h SER 156 Ca -0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 2dki h SER 156 Cb 0.14 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.58 2dki h SER 156 CO 0.00 0.00 -0.84 0.54 -1.14 0.00 0.00 176.83 175.40 2dki n ARG 157 N -2.82 -3.86 -2.62 3.45 5.12 -0.58 -4.88 116.66 110.47 2dki n ARG 157 Ca 0.04 0.45 -0.42 0.00 -1.93 0.00 0.00 57.85 55.99 2dki n ARG 157 Cb 0.46 -4.99 -0.03 0.00 -1.16 0.00 0.00 32.46 26.74 2dki n ARG 157 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2dki s LEU 158 N -7.12 4.38 0.01 0.55 2.96 -0.56 -4.73 118.68 114.17 2dki s LEU 158 Ca 0.41 1.78 -0.03 0.00 -0.22 0.00 0.00 54.13 56.06 2dki s LEU 158 Cb -0.22 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 42.89 2dki s LEU 158 CO 0.88 -0.31 0.05 -1.83 -1.32 0.00 0.00 176.35 173.82 2dki s GLU 159 N 0.96 0.39 0.67 1.98 -1.05 -1.26 -2.78 118.70 117.61 2dki s GLU 159 Ca 0.54 -0.50 -0.15 0.00 -0.15 0.00 0.00 54.97 54.71 2dki s GLU 159 Cb -0.24 0.15 0.01 0.00 -0.44 0.00 0.00 34.13 33.61 2dki s GLU 159 CO 0.29 -0.08 1.11 -2.14 0.95 0.00 0.00 175.26 175.39 2dki s PRO 160 N -1.40 2.72 -0.45 -4.83 0.02 -1.26 -4.76 135.00 125.04 2dki s PRO 160 Ca -0.15 1.39 -0.10 0.00 0.02 0.00 0.00 61.00 62.15 2dki s PRO 160 Cb -0.09 -1.94 0.09 0.00 0.02 0.00 0.00 34.50 32.58 2dki s PRO 160 CO 0.00 -1.31 0.32 -1.01 -0.33 0.00 0.00 177.00 174.67 2dki s HIS 161 N -2.38 3.35 0.90 6.54 3.76 -0.57 -5.04 115.29 121.85 2dki s HIS 161 Ca 0.67 -1.54 -0.14 0.00 -0.15 0.00 0.00 55.06 53.90 2dki s HIS 161 Cb -0.21 -3.19 0.16 0.00 1.11 0.00 0.00 32.58 30.45 2dki s HIS 161 CO 0.43 -0.89 1.25 0.71 -0.85 0.00 0.00 174.74 175.39 2dki s TYR 162 N 1.44 1.95 -1.39 1.40 2.02 -1.26 -2.53 117.35 118.99 2dki s TYR 162 Ca 0.04 0.37 -0.03 0.00 -0.37 0.00 0.00 57.07 57.08 2dki s TYR 162 Cb -0.25 -3.86 0.02 0.00 -0.40 0.00 0.00 41.96 37.48 2dki s TYR 162 CO 0.02 -2.33 0.67 0.00 -1.57 0.00 0.00 175.55 172.33 2dki n ALA 163 N -3.56 -1.87 -3.72 3.71 0.00 -0.15 -4.83 120.51 110.09 2dki n ALA 163 Ca 0.13 -0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2dki n ALA 163 Cb 0.60 -2.27 -0.17 0.00 0.00 0.00 0.00 19.45 17.61 2dki n ALA 163 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dki s ARG 164 N -6.28 0.98 -0.24 0.00 3.00 -0.56 -0.45 118.95 115.39 2dki s ARG 164 Ca 0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 55.73 55.75 2dki s ARG 164 Cb -0.07 -1.10 0.02 0.00 0.00 0.00 0.00 34.95 33.80 2dki s ARG 164 CO 0.84 -0.19 -0.05 0.50 0.00 0.00 0.00 175.30 176.40 2dki s ARG 165 N 1.44 2.99 -0.15 3.54 3.52 -0.09 -1.60 118.95 128.61 2dki s ARG 165 Ca -0.02 -0.88 -0.29 0.00 -0.13 0.00 0.00 55.73 54.41 2dki s ARG 165 Cb -0.13 -3.01 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 2dki s ARG 165 CO -0.03 -0.35 1.69 0.08 -0.81 0.00 0.00 175.30 175.87 2dki s VAL 166 N 1.38 3.58 -0.04 7.11 1.01 -1.26 -0.93 120.40 131.24 2dki s VAL 166 Ca 0.02 0.67 -0.12 0.00 0.00 0.00 0.00 61.98 62.55 2dki s VAL 166 Cb -0.16 -3.53 -0.31 0.00 0.00 0.00 0.00 36.38 32.37 2dki s VAL 166 CO -0.04 -0.17 0.71 -0.07 0.00 0.00 0.00 175.10 175.52 2dki h LEU 167 N 11.34 0.64 -7.01 3.92 3.38 -0.52 -3.47 115.31 123.60 2dki h LEU 167 Ca -0.37 -0.94 -0.06 0.00 0.09 0.00 0.00 57.88 56.61 2dki h LEU 167 Cb 1.17 -0.21 -0.18 0.00 0.09 0.00 0.00 40.66 41.53 2dki h LEU 167 CO 0.98 1.77 0.18 -0.62 0.09 0.00 0.00 178.44 180.84 2dki s ASP 168 N -7.33 -0.63 -0.07 -0.43 2.15 -1.07 -5.00 116.67 104.29 2dki s ASP 168 Ca -0.15 0.59 0.02 0.00 0.43 0.00 0.00 52.55 53.44 2dki s ASP 168 Cb 0.05 0.54 0.02 0.00 -0.30 0.00 0.00 42.92 43.23 2dki s ASP 168 CO 0.86 -0.66 -0.10 -0.69 -0.17 0.00 0.00 175.17 174.41 2dki s VAL 169 N -1.59 0.99 0.01 1.11 1.01 -1.26 -0.55 120.40 120.11 2dki s VAL 169 Ca -0.09 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.55 2dki s VAL 169 Cb -0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 2dki s VAL 169 CO 0.06 0.33 -0.12 -0.54 0.00 0.00 0.00 175.10 174.83 2dki s LYS 170 N 0.87 0.91 -0.19 2.72 -0.14 -0.59 -4.73 119.74 118.59 2dki s LYS 170 Ca -0.11 -0.52 -0.02 0.00 -1.36 0.00 0.00 55.97 53.95 2dki s LYS 170 Cb -0.15 -0.88 -0.01 0.00 -1.68 0.00 0.00 37.83 35.11 2dki s LYS 170 CO 0.01 0.23 -0.08 0.08 -0.76 0.00 0.00 175.35 174.83 2dki s VAL 171 N -0.48 3.19 -0.78 3.17 1.01 -1.26 -0.69 120.40 124.56 2dki s VAL 171 Ca 0.03 -0.58 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 2dki s VAL 171 Cb -0.06 -2.41 0.18 0.00 0.00 0.00 0.00 36.38 34.10 2dki s VAL 171 CO 0.00 0.47 0.78 -0.62 0.00 0.00 0.00 175.10 175.72 2dki s ASP 172 N 1.06 6.62 0.00 3.32 3.68 0.34 -4.89 116.67 126.80 2dki s ASP 172 Ca 0.00 -2.37 0.00 0.00 2.13 0.00 0.00 52.55 52.31 2dki s ASP 172 Cb -0.15 -2.24 0.00 0.00 -1.45 0.00 0.00 42.92 39.08 2dki s ASP 172 CO -0.01 -0.73 0.23 1.41 0.13 0.00 0.00 175.17 176.20 2dki n HIS 173 N 4.71 0.00 0.07 -5.34 8.25 -1.26 -1.11 115.22 120.53 2dki n HIS 173 Ca 0.09 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.57 2dki n HIS 173 Cb 0.46 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 2dki n HIS 173 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dki n GLY 174 N -0.25 0.22 3.65 -1.41 0.00 -1.26 -5.05 105.19 101.10 2dki n GLY 174 Ca 0.00 -0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2dki n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dki n ALA 175 N -1.38 -0.24 0.03 4.61 0.00 -0.27 -4.94 120.51 118.33 2dki n ALA 175 Ca -0.00 -0.31 0.03 0.00 0.00 0.00 0.00 53.44 53.16 2dki n ALA 175 Cb 0.07 -2.18 -0.08 0.00 0.00 0.00 0.00 19.45 17.26 2dki n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dki n ALA 176 N -3.10 2.12 -3.47 0.00 0.00 -1.26 -4.89 120.51 109.91 2dki n ALA 176 Ca 0.13 -0.52 -0.13 0.00 0.00 0.00 0.00 53.44 52.91 2dki n ALA 176 Cb 0.50 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 2dki n ALA 176 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dki s ASP 177 N -5.54 -0.56 -1.32 0.00 -1.08 -1.26 -4.97 116.67 101.94 2dki s ASP 177 Ca -0.03 0.25 -0.05 0.00 -0.52 0.00 0.00 52.55 52.20 2dki s ASP 177 Cb 0.09 0.53 -0.00 0.00 -1.46 0.00 0.00 42.92 42.08 2dki s ASP 177 CO 0.82 -0.77 0.56 -1.22 0.52 0.00 0.00 175.17 175.08 2dki n TYR 178 N 0.12 -1.76 0.23 -5.34 4.01 -1.26 -4.83 117.16 108.33 2dki n TYR 178 Ca -0.16 0.69 0.13 0.00 -0.16 0.00 0.00 57.90 58.40 2dki n TYR 178 Cb 0.62 -3.81 0.64 0.00 -0.31 0.00 0.00 39.34 36.48 2dki n TYR 178 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2dki h PRO 179 N -1.86 0.00 -5.27 -0.72 0.13 -1.84 -3.38 132.00 119.06 2dki h PRO 179 Ca -0.64 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 63.89 2dki h PRO 179 Cb 1.37 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.37 2dki h PRO 179 CO 0.58 0.00 -0.40 0.08 -0.23 0.00 0.00 178.00 178.03 2dki s VAL 180 N -3.57 5.32 -0.24 1.56 1.01 -0.32 -0.50 120.40 123.66 2dki s VAL 180 Ca -0.01 0.37 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 2dki s VAL 180 Cb 0.08 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.89 2dki s VAL 180 CO 0.27 0.35 -0.04 -0.89 0.00 0.00 0.00 175.10 174.79 2dki s THR 181 N 0.87 3.27 -0.15 3.92 2.01 0.14 0.36 115.64 126.05 2dki s THR 181 Ca 0.12 -0.68 -0.04 0.00 0.31 0.00 0.00 61.69 61.40 2dki s THR 181 Cb -0.13 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.79 2dki s THR 181 CO 0.04 0.32 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.57 2dki s VAL 182 N 1.43 4.02 -0.22 3.82 1.01 0.75 -1.55 120.40 129.66 2dki s VAL 182 Ca 0.04 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 2dki s VAL 182 Cb -0.15 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2dki s VAL 182 CO -0.03 0.51 0.03 -0.89 0.00 0.00 0.00 175.10 174.71 2dki s THR 183 N 0.19 4.15 0.12 3.92 2.01 0.29 -0.64 115.64 125.68 2dki s THR 183 Ca -0.01 -0.24 0.10 0.00 0.31 0.00 0.00 61.69 61.85 2dki s THR 183 Cb -0.14 -2.90 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2dki s THR 183 CO 0.03 0.40 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.35 2dki s LEU 184 N 1.16 2.31 -0.18 4.42 1.02 0.24 0.28 118.68 127.93 2dki s LEU 184 Ca 0.03 -0.73 -0.00 0.00 0.02 0.00 0.00 54.13 53.46 2dki s LEU 184 Cb -0.14 -1.09 0.01 0.00 0.02 0.00 0.00 46.19 44.99 2dki s LEU 184 CO 0.02 0.13 -0.16 -0.70 0.02 0.00 0.00 176.35 175.66 2dki s GLU 185 N -2.01 3.12 0.13 1.70 2.12 -0.11 0.97 118.70 124.62 2dki s GLU 185 Ca 0.11 -0.77 -0.30 0.00 0.36 0.00 0.00 54.97 54.37 2dki s GLU 185 Cb -0.10 -2.67 -0.07 0.00 0.26 0.00 0.00 34.13 31.55 2dki s GLU 185 CO 0.05 -0.16 1.25 1.03 -0.54 0.00 0.00 175.26 176.90 2dki s ARG 186 N 1.23 4.42 0.00 4.30 0.52 0.33 -0.92 118.95 128.83 2dki s ARG 186 Ca 0.03 1.90 0.19 0.00 -0.52 0.00 0.00 55.73 57.32 2dki s ARG 186 Cb -0.14 -3.27 -0.10 0.00 0.52 0.00 0.00 34.95 31.96 2dki s ARG 186 CO -0.08 -0.24 0.87 0.00 0.02 0.00 0.00 175.30 175.87 2dki s ASP 188 N -2.42 7.45 0.47 0.00 3.84 -1.26 -4.72 116.67 120.03 2dki s ASP 188 Ca 0.12 2.12 0.31 0.00 -0.00 0.00 0.00 52.55 55.09 2dki s ASP 188 Cb 0.15 -2.62 1.41 0.00 -1.38 0.00 0.00 42.92 40.47 2dki s ASP 188 CO 0.60 0.00 1.71 0.00 -0.00 0.00 0.00 175.17 177.49 2dki h ALA 189 N 3.99 2.83 0.00 2.11 0.00 -1.96 1.29 119.26 127.52 2dki h ALA 189 Ca -0.46 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2dki h ALA 189 Cb 1.21 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2dki h ALA 189 CO 0.67 -1.31 -0.09 0.00 0.00 0.00 0.00 179.25 178.53 2dki h ALA 190 N 1.48 0.99 0.00 0.00 0.00 -1.99 -3.24 119.26 116.50 2dki h ALA 190 Ca 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.52 2dki h ALA 190 Cb 2.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.09 2dki h ALA 190 CO -0.22 0.11 0.00 0.72 0.00 0.00 0.00 179.25 179.87 2dki n HIS 191 N -3.18 0.00 -0.93 0.00 8.25 1.00 -5.09 115.22 115.27 2dki n HIS 191 Ca 0.01 -0.18 -0.36 0.00 -0.26 0.00 0.00 57.72 56.93 2dki n HIS 191 Cb 0.42 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.46 2dki n HIS 191 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dki n ALA 192 N -0.18 -1.68 0.00 -1.41 0.00 0.40 -0.45 120.51 117.19 2dki n ALA 192 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2dki n ALA 192 Cb 0.26 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.65 2dki n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dki n GLY 193 N 1.47 2.80 3.74 0.00 0.00 -0.94 -5.01 105.19 107.26 2dki n GLY 193 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2dki n GLY 193 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dki s GLN 194 N -0.09 4.24 -0.23 1.61 -0.21 0.40 -4.78 119.66 120.60 2dki s GLN 194 Ca 0.00 2.35 -0.10 0.00 0.02 0.00 0.00 55.36 57.63 2dki s GLN 194 Cb 0.00 -3.11 -0.05 0.00 1.00 0.00 0.00 33.01 30.86 2dki s GLN 194 CO 0.00 -0.48 0.14 0.42 -2.12 0.00 0.00 175.29 173.25 2dki s ILE 195 N 0.20 5.26 0.08 1.08 -1.09 -1.26 -0.51 121.20 124.96 2dki s ILE 195 Ca 0.62 0.14 0.07 0.00 -2.23 0.00 0.00 60.65 59.24 2dki s ILE 195 Cb -0.43 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2dki s ILE 195 CO 0.42 0.37 -0.10 -1.61 -1.23 0.00 0.00 174.94 172.79 2dki s GLU 196 N 0.91 2.19 -0.03 2.79 2.02 0.27 -4.95 118.70 121.90 2dki s GLU 196 Ca 0.07 -0.98 0.04 0.00 0.02 0.00 0.00 54.97 54.12 2dki s GLU 196 Cb -0.13 -2.32 -0.00 0.00 0.10 0.00 0.00 34.13 31.77 2dki s GLU 196 CO 0.03 0.52 -0.14 0.99 0.02 0.00 0.00 175.26 176.68 2dki s THR 197 N -1.16 1.19 -0.02 3.63 2.01 -1.26 0.80 115.64 120.82 2dki s THR 197 Ca 0.20 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.65 2dki s THR 197 Cb -0.11 -1.03 -0.00 0.00 0.01 0.00 0.00 72.50 71.37 2dki s THR 197 CO 0.12 0.35 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.60 2dki s VAL 198 N 0.06 0.92 -0.24 3.82 1.01 0.19 -4.72 120.40 121.44 2dki s VAL 198 Ca -0.03 -0.46 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 2dki s VAL 198 Cb -0.10 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 2dki s VAL 198 CO 0.01 0.27 0.15 -1.10 0.00 0.00 0.00 175.10 174.44 2dki s GLN 199 N 0.01 4.01 0.08 2.72 -1.52 0.67 -0.18 119.66 125.45 2dki s GLN 199 Ca -0.00 -0.30 0.04 0.00 -1.95 0.00 0.00 55.36 53.15 2dki s GLN 199 Cb -0.08 -3.53 -0.03 0.00 -0.22 0.00 0.00 33.01 29.16 2dki s GLN 199 CO 0.00 0.01 -0.12 0.00 -0.25 0.00 0.00 175.29 174.93 2dki s ALA 200 N 1.19 1.09 0.02 6.09 0.00 0.16 -0.58 121.76 129.72 2dki s ALA 200 Ca 0.07 -1.04 -0.08 0.00 0.00 0.00 0.00 51.96 50.91 2dki s ALA 200 Cb -0.14 -0.04 -0.31 0.00 0.00 0.00 0.00 23.12 22.64 2dki s ALA 200 CO 0.05 0.07 0.93 0.00 0.00 0.00 0.00 175.76 176.82 2dki h ARG 201 N 4.05 0.36 -3.53 0.00 3.08 -1.20 -0.84 114.38 116.29 2dki h ARG 201 Ca -0.39 -0.61 -0.22 0.00 0.07 0.00 0.00 59.98 58.83 2dki h ARG 201 Cb 1.19 0.23 -0.28 0.00 0.08 0.00 0.00 29.97 31.19 2dki h ARG 201 CO 0.45 1.26 -0.63 0.71 -1.07 0.00 0.00 179.97 180.68 2dki s TYR 202 N -2.62 -0.08 -0.04 3.04 2.02 -0.56 -4.68 117.35 114.43 2dki s TYR 202 Ca -0.09 0.21 0.06 0.00 -0.37 0.00 0.00 57.07 56.88 2dki s TYR 202 Cb 0.06 0.01 -0.01 0.00 -0.40 0.00 0.00 41.96 41.62 2dki s TYR 202 CO 0.89 -0.05 -0.23 0.08 -1.57 0.00 0.00 175.55 174.67 2dki s VAL 203 N 0.14 1.85 -0.24 0.71 1.01 -0.87 -1.46 120.40 121.53 2dki s VAL 203 Ca -0.01 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.02 2dki s VAL 203 Cb -0.02 -1.55 0.06 0.00 0.00 0.00 0.00 36.38 34.87 2dki s VAL 203 CO -0.00 0.52 -0.08 -0.69 0.00 0.00 0.00 175.10 174.84 2dki s VAL 204 N -0.31 1.84 -0.59 2.92 1.01 0.19 -1.46 120.40 124.01 2dki s VAL 204 Ca 0.02 -1.41 -0.27 0.00 0.00 0.00 0.00 61.98 60.32 2dki s VAL 204 Cb -0.11 -2.02 0.03 0.00 0.00 0.00 0.00 36.38 34.28 2dki s VAL 204 CO 0.01 -0.05 1.16 -0.83 0.00 0.00 0.00 175.10 175.39 2dki s GLY 205 N 1.25 1.16 -0.26 4.51 0.00 1.00 -1.26 107.32 113.72 2dki s GLY 205 Ca -0.07 -0.94 0.09 0.00 0.00 0.00 0.00 44.72 43.80 2dki s GLY 205 CO -0.06 2.44 1.24 0.00 0.00 0.00 0.00 173.10 176.72 2dki n ASP 207 N -0.93 3.40 -0.54 0.00 5.75 -0.65 -4.40 116.55 119.18 2dki n ASP 207 Ca 0.32 -2.73 0.04 0.00 -0.01 0.00 0.00 54.79 52.42 2dki n ASP 207 Cb 0.84 -0.65 -0.01 0.00 -1.03 0.00 0.00 41.12 40.27 2dki n ASP 207 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dki n GLY 208 N -0.16 -1.82 0.29 6.12 0.00 -1.26 -3.74 105.19 104.62 2dki n GLY 208 Ca 0.26 -1.30 0.10 0.00 0.00 0.00 0.00 46.02 45.08 2dki n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dki h ALA 209 N -0.52 1.14 -0.99 4.61 0.00 -1.92 -0.04 119.26 121.53 2dki h ALA 209 Ca 0.01 0.20 -0.56 0.00 0.00 0.00 0.00 54.91 54.56 2dki h ALA 209 Cb 0.28 0.28 -0.30 0.00 0.00 0.00 0.00 17.79 18.04 2dki h ALA 209 CO 0.00 -0.40 0.71 0.54 0.00 0.00 0.00 179.25 180.10 2dki n ARG 210 N -5.19 2.35 -1.57 0.00 1.74 -1.26 -4.81 116.66 107.92 2dki n ARG 210 Ca 0.18 -3.05 -0.56 0.00 -0.77 0.00 0.00 57.85 53.66 2dki n ARG 210 Cb 0.58 -2.20 -0.07 0.00 -1.02 0.00 0.00 32.46 29.76 2dki n ARG 210 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2dki n SER 211 N -1.07 1.05 0.06 0.55 2.88 -0.04 -4.90 113.62 112.14 2dki n SER 211 Ca 0.60 1.13 -0.10 0.00 -1.33 0.00 0.00 58.87 59.18 2dki n SER 211 Cb 1.41 -1.07 -0.13 0.00 -0.75 0.00 0.00 64.21 63.67 2dki n SER 211 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2dki h ASN 212 N 4.14 0.11 -0.76 -3.46 2.35 -1.88 -3.22 115.58 112.85 2dki h ASN 212 Ca -0.49 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.10 2dki h ASN 212 Cb 1.37 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 39.67 2dki h ASN 212 CO 0.75 1.10 0.35 0.58 -1.65 0.00 0.00 177.43 178.56 2dki h VAL 213 N 0.02 1.25 0.34 2.81 2.07 -1.90 0.14 116.25 120.97 2dki h VAL 213 Ca -0.09 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 2dki h VAL 213 Cb 1.86 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2dki h VAL 213 CO 0.14 0.30 -0.16 -0.09 0.02 0.00 0.00 177.57 177.78 2dki h ARG 214 N 1.11 -0.44 0.00 1.57 2.43 -1.89 -2.53 114.38 114.63 2dki h ARG 214 Ca 0.26 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 2dki h ARG 214 Cb 0.15 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2dki h ARG 214 CO -0.03 -0.19 -0.08 0.00 -1.51 0.00 0.00 179.97 178.16 2dki h ARG 215 N -0.61 0.00 -0.43 0.20 3.08 -1.53 -2.00 114.38 113.09 2dki h ARG 215 Ca -0.05 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 2dki h ARG 215 Cb 0.44 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2dki h ARG 215 CO 0.08 0.08 -0.24 0.00 -1.07 0.00 0.00 179.97 178.82 2dki h ALA 216 N 1.92 0.77 -0.61 0.04 0.00 -0.40 -2.87 119.26 118.11 2dki h ALA 216 Ca -0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 2dki h ALA 216 Cb 0.20 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 2dki h ALA 216 CO 0.01 0.66 0.14 0.44 0.00 0.00 0.00 179.25 180.50 2dki n ILE 217 N -4.10 2.63 -0.94 0.00 -5.35 -0.80 -4.91 119.36 105.90 2dki n ILE 217 Ca -0.00 -1.38 0.00 0.00 -0.27 0.00 0.00 62.75 61.10 2dki n ILE 217 Cb 0.45 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 2dki n ILE 217 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dki n GLY 218 N 0.20 0.22 3.82 3.28 0.00 -1.03 -4.92 105.19 106.75 2dki n GLY 218 Ca 0.32 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 2dki n GLY 218 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dki s ARG 219 N -1.13 1.54 -0.26 1.61 1.81 -0.93 -4.99 118.95 116.60 2dki s ARG 219 Ca 0.00 0.32 -0.21 0.00 -1.72 0.00 0.00 55.73 54.12 2dki s ARG 219 Cb 0.00 -1.88 0.07 0.00 -0.45 0.00 0.00 34.95 32.69 2dki s ARG 219 CO 0.00 -1.93 0.67 1.14 -0.68 0.00 0.00 175.30 174.50 2dki s GLN 220 N -5.32 0.75 -0.27 3.54 -2.07 -1.26 -4.39 119.66 110.63 2dki s GLN 220 Ca 0.63 1.03 -0.29 0.00 -1.82 0.00 0.00 55.36 54.91 2dki s GLN 220 Cb -0.14 0.29 -0.02 0.00 -1.09 0.00 0.00 33.01 32.05 2dki s GLN 220 CO 0.53 -0.11 1.71 -0.51 -1.32 0.00 0.00 175.29 175.58 2dki s LEU 221 N 0.80 3.70 -0.20 2.60 1.43 -1.26 -4.18 118.68 121.57 2dki s LEU 221 Ca -0.04 1.46 -0.06 0.00 -1.03 0.00 0.00 54.13 54.47 2dki s LEU 221 Cb -0.05 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 2dki s LEU 221 CO -0.06 -1.48 0.04 -0.69 0.23 0.00 0.00 176.35 174.38 2dki s VAL 222 N 6.03 4.32 0.00 -1.59 1.01 -0.56 -4.69 120.40 124.93 2dki s VAL 222 Ca 0.76 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.55 2dki s VAL 222 Cb -0.24 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.18 2dki s VAL 222 CO 0.32 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.45 2dki n GLY 223 N 4.11 0.88 3.86 4.51 0.00 -1.26 -0.87 105.19 116.43 2dki n GLY 223 Ca -0.17 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 2dki n GLY 223 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dki s ASP 224 N 2.00 5.09 0.97 1.61 1.01 -1.13 -4.97 116.67 121.25 2dki s ASP 224 Ca 0.00 -0.69 -0.12 0.00 0.71 0.00 0.00 52.55 52.45 2dki s ASP 224 Cb 0.00 -0.68 0.17 0.00 1.01 0.00 0.00 42.92 43.42 2dki s ASP 224 CO 0.00 -0.56 1.09 -0.44 0.21 0.00 0.00 175.17 175.47 2dki s SER 225 N -4.08 2.87 -0.49 0.27 0.01 -1.26 -3.91 113.70 107.10 2dki s SER 225 Ca 0.46 1.37 -0.27 0.00 1.31 0.00 0.00 55.95 58.82 2dki s SER 225 Cb -0.04 -2.05 -0.08 0.00 0.21 0.00 0.00 66.02 64.06 2dki s SER 225 CO 0.27 -3.00 2.41 0.00 0.41 0.00 0.00 173.24 173.33 2dki n ALA 226 N -4.11 0.88 -0.00 1.44 0.00 -1.26 -4.39 120.51 113.07 2dki n ALA 226 Ca 0.06 -0.77 -0.11 0.00 0.00 0.00 0.00 53.44 52.61 2dki n ALA 226 Cb 0.56 -3.08 -0.05 0.00 0.00 0.00 0.00 19.45 16.88 2dki n ALA 226 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 2dki h ASN 227 N 18.21 -1.15 -4.41 0.00 7.08 -1.89 -3.45 115.58 129.96 2dki h ASN 227 Ca -0.25 0.16 -0.50 0.00 -3.08 0.00 0.00 56.30 52.63 2dki h ASN 227 Cb 1.27 0.48 -0.13 0.00 -2.08 0.00 0.00 38.32 37.86 2dki h ASN 227 CO 1.15 -0.39 -0.51 -1.10 -2.08 0.00 0.00 177.43 174.49 2dki s GLN 228 N -5.95 1.81 0.01 4.14 1.11 -1.26 -5.09 119.66 114.44 2dki s GLN 228 Ca -0.15 -2.08 0.03 0.00 0.01 0.00 0.00 55.36 53.17 2dki s GLN 228 Cb 0.10 -0.18 -0.01 0.00 -1.01 0.00 0.00 33.01 31.91 2dki s GLN 228 CO 0.65 -0.54 -0.09 0.00 0.01 0.00 0.00 175.29 175.32 2dki s ALA 229 N -3.37 0.72 -0.02 6.09 0.00 -1.25 -4.27 121.76 119.65 2dki s ALA 229 Ca 0.32 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.82 2dki s ALA 229 Cb 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 2dki s ALA 229 CO 0.20 0.14 -0.12 -1.58 0.00 0.00 0.00 175.76 174.39 2dki s TRP 230 N -0.50 1.17 -0.19 0.00 0.52 0.47 -0.12 118.94 120.29 2dki s TRP 230 Ca 0.01 -0.27 -0.17 0.00 0.02 0.00 0.00 56.10 55.69 2dki s TRP 230 Cb -0.05 -0.79 -0.04 0.00 -1.15 0.00 0.00 33.47 31.45 2dki s TRP 230 CO 0.00 -0.07 0.44 0.20 0.02 0.00 0.00 176.95 177.54 2dki s GLY 231 N -0.07 2.11 -0.19 0.98 0.00 0.80 -0.22 107.32 110.73 2dki s GLY 231 Ca 0.01 -0.45 0.01 0.00 0.00 0.00 0.00 44.72 44.28 2dki s GLY 231 CO 0.00 0.90 -0.18 0.14 0.00 0.00 0.00 173.10 173.96 2dki s VAL 232 N 1.35 2.18 -0.07 1.40 1.01 -0.44 -0.32 120.40 125.51 2dki s VAL 232 Ca 0.21 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.30 2dki s VAL 232 Cb -0.15 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.32 2dki s VAL 232 CO 0.09 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.60 2dki s MET 233 N 1.30 1.53 -0.29 2.72 0.23 -0.65 -0.39 119.30 123.76 2dki s MET 233 Ca 0.05 -0.34 -0.15 0.00 -1.03 0.00 0.00 55.69 54.22 2dki s MET 233 Cb -0.13 -1.34 -0.03 0.00 -1.53 0.00 0.00 34.83 31.80 2dki s MET 233 CO -0.12 -0.03 0.40 -0.51 -2.03 0.00 0.00 175.02 172.72 2dki s ASP 234 N 0.86 6.26 0.11 -1.18 -0.00 0.99 -1.15 116.67 122.56 2dki s ASP 234 Ca -0.11 0.21 0.04 0.00 -0.00 0.00 0.00 52.55 52.69 2dki s ASP 234 Cb -0.15 -2.22 -0.04 0.00 -0.00 0.00 0.00 42.92 40.51 2dki s ASP 234 CO 0.01 -0.24 -0.11 0.68 -0.00 0.00 0.00 175.17 175.51 2dki s VAL 235 N 2.12 1.06 -0.54 -1.27 -7.23 0.25 -3.07 120.40 111.71 2dki s VAL 235 Ca 0.15 -1.67 -0.03 0.00 -1.81 0.00 0.00 61.98 58.62 2dki s VAL 235 Cb -0.16 -1.42 0.14 0.00 0.56 0.00 0.00 36.38 35.50 2dki s VAL 235 CO 0.10 -0.52 0.35 -0.76 -0.31 0.00 0.00 175.10 173.96 2dki s LEU 236 N -2.47 5.25 0.17 1.32 1.43 0.30 -1.56 118.68 123.12 2dki s LEU 236 Ca 0.07 -2.53 0.05 0.00 -1.03 0.00 0.00 54.13 50.69 2dki s LEU 236 Cb -0.03 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 2dki s LEU 236 CO 0.01 -0.44 -0.09 0.00 0.23 0.00 0.00 176.35 176.05 2dki s ALA 237 N 0.41 1.59 -0.19 4.21 0.00 -1.26 -1.26 121.76 125.26 2dki s ALA 237 Ca 0.13 -1.55 -0.06 0.00 0.00 0.00 0.00 51.96 50.48 2dki s ALA 237 Cb -0.21 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2dki s ALA 237 CO -0.04 -0.09 0.03 0.08 0.00 0.00 0.00 175.76 175.74 2dki s VAL 238 N -3.29 4.33 0.10 0.00 1.01 -0.13 -4.94 120.40 117.48 2dki s VAL 238 Ca 0.19 -0.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 2dki s VAL 238 Cb 0.02 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 2dki s VAL 238 CO 0.03 0.44 0.17 0.28 0.00 0.00 0.00 175.10 176.02 2dki s THR 239 N 0.69 0.13 -1.28 3.92 -1.32 -1.26 -0.67 115.64 115.86 2dki s THR 239 Ca 0.01 -1.35 0.12 0.00 -1.21 0.00 0.00 61.69 59.26 2dki s THR 239 Cb -0.14 -1.51 0.23 0.00 -1.51 0.00 0.00 72.50 69.56 2dki s THR 239 CO 0.02 -0.61 1.10 -0.90 -2.21 0.00 0.00 174.62 172.02 2dki n ASP 240 N -0.07 2.56 -4.66 8.08 3.85 -1.19 -4.93 116.55 120.19 2dki n ASP 240 Ca -0.13 -1.77 -0.42 0.00 -0.71 0.00 0.00 54.79 51.76 2dki n ASP 240 Cb 0.62 -0.14 -0.03 0.00 -1.35 0.00 0.00 41.12 40.23 2dki n ASP 240 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 2dki s PHE 241 N -1.02 1.56 0.45 2.11 5.36 -1.26 -4.87 117.98 120.32 2dki s PHE 241 Ca 0.20 -0.15 0.35 0.00 -0.96 0.00 0.00 56.93 56.37 2dki s PHE 241 Cb 0.12 -4.10 1.82 0.00 -0.34 0.00 0.00 43.02 40.51 2dki s PHE 241 CO 0.17 -4.80 2.18 -1.00 -1.46 0.00 0.00 175.22 170.30 2dki h PRO 242 N 10.37 0.00 -0.53 10.12 0.13 -2.01 -3.15 132.00 146.93 2dki h PRO 242 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2dki h PRO 242 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dki h PRO 242 CO 0.95 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.51 2dki n ASP 243 N -3.34 5.15 0.10 1.44 10.43 -1.26 -4.63 116.55 124.44 2dki n ASP 243 Ca -0.02 -2.83 0.14 0.00 2.57 0.00 0.00 54.79 54.66 2dki n ASP 243 Cb 0.18 -0.63 0.65 0.00 1.84 0.00 0.00 41.12 43.16 2dki n ASP 243 CO 0.00 0.00 0.00 1.62 -1.07 0.00 0.00 177.20 177.75 2dki h VAL 244 N 3.58 0.86 -0.19 2.53 3.04 -1.95 -1.21 116.25 122.91 2dki h VAL 244 Ca 0.00 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 2dki h VAL 244 Cb 1.75 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 31.85 2dki h VAL 244 CO 0.38 0.01 0.00 0.54 -1.01 0.00 0.00 177.57 177.49 2dki n ARG 245 N -4.45 1.59 -3.76 4.17 5.12 -1.26 -4.51 116.66 113.55 2dki n ARG 245 Ca 0.04 -0.90 -0.22 0.00 -1.93 0.00 0.00 57.85 54.85 2dki n ARG 245 Cb 0.37 -1.30 -0.04 0.00 -1.16 0.00 0.00 32.46 30.32 2dki n ARG 245 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2dki s TYR 246 N -1.75 2.72 -0.13 -1.55 2.02 -0.46 -4.79 117.35 113.42 2dki s TYR 246 Ca 0.26 -0.46 -0.24 0.00 -0.37 0.00 0.00 57.07 56.25 2dki s TYR 246 Cb 0.13 -2.01 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2dki s TYR 246 CO 0.20 0.03 0.75 0.21 -1.57 0.00 0.00 175.55 175.17 2dki s LYS 247 N -4.04 4.35 -0.04 -0.62 2.20 -1.23 -4.09 119.74 116.28 2dki s LYS 247 Ca 0.45 0.92 0.02 0.00 -0.36 0.00 0.00 55.97 57.00 2dki s LYS 247 Cb -0.02 -3.52 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2dki s LYS 247 CO 0.26 -0.15 -0.10 0.08 -0.36 0.00 0.00 175.35 175.08 2dki s VAL 248 N 1.53 0.90 -0.29 4.02 1.01 -0.06 -1.78 120.40 125.72 2dki s VAL 248 Ca 0.37 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.88 2dki s VAL 248 Cb -0.17 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 2dki s VAL 248 CO 0.15 0.29 0.11 0.00 0.00 0.00 0.00 175.10 175.65 2dki s ALA 249 N 0.41 3.18 -0.17 5.51 0.00 -0.78 0.96 121.76 130.88 2dki s ALA 249 Ca -0.08 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 50.53 2dki s ALA 249 Cb -0.12 -2.24 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 2dki s ALA 249 CO 0.01 -0.81 -0.13 0.42 0.00 0.00 0.00 175.76 175.25 2dki s ILE 250 N 1.58 2.79 -0.15 0.00 1.01 0.21 -1.22 121.20 125.43 2dki s ILE 250 Ca 0.04 -0.72 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 2dki s ILE 250 Cb -0.17 -2.20 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 2dki s ILE 250 CO 0.04 0.50 -0.13 -1.10 0.00 0.00 0.00 174.94 174.25 2dki s GLN 251 N 0.95 3.31 0.18 2.79 -0.21 0.25 -0.08 119.66 126.84 2dki s GLN 251 Ca -0.02 -0.71 -0.04 0.00 0.02 0.00 0.00 55.36 54.61 2dki s GLN 251 Cb -0.15 -2.67 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 2dki s GLN 251 CO -0.02 0.08 0.18 -1.54 -2.12 0.00 0.00 175.29 171.88 2dki s SER 252 N 0.68 0.15 0.46 5.90 1.04 -0.23 -3.45 113.70 118.24 2dki s SER 252 Ca -0.07 -1.17 0.12 0.00 0.48 0.00 0.00 55.95 55.32 2dki s SER 252 Cb -0.15 0.39 1.06 0.00 0.10 0.00 0.00 66.02 67.42 2dki s SER 252 CO 0.02 -0.85 2.08 -0.33 0.98 0.00 0.00 173.24 175.14 2dki h GLU 253 N 2.64 0.29 -0.77 4.02 5.08 -1.95 -2.06 114.58 121.83 2dki h GLU 253 Ca -0.34 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 57.77 2dki h GLU 253 Cb 1.23 -0.07 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 2dki h GLU 253 CO 0.52 0.19 0.30 0.00 -1.00 0.00 0.00 179.01 179.02 2dki n GLN 254 N -4.50 3.70 0.00 2.33 0.00 -1.26 -5.04 117.38 112.61 2dki n GLN 254 Ca 0.02 -3.08 0.00 0.00 0.00 0.00 0.00 57.00 53.94 2dki n GLN 254 Cb 0.13 -2.23 0.00 0.00 0.00 0.00 0.00 30.24 28.14 2dki n GLN 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2dki n GLY 255 N -0.18 2.73 3.50 2.61 0.00 -0.77 -4.62 105.19 108.46 2dki n GLY 255 Ca 0.42 -2.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 2dki n GLY 255 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dki s ASN 256 N 0.00 4.19 0.03 1.61 0.01 -1.26 -1.07 114.94 118.45 2dki s ASN 256 Ca 0.00 -0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.02 2dki s ASN 256 Cb 0.00 -0.95 -0.02 0.00 0.41 0.00 0.00 41.25 40.70 2dki s ASN 256 CO 0.00 0.35 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.18 2dki s VAL 257 N -0.73 0.51 -0.12 1.60 1.01 0.88 -1.99 120.40 121.56 2dki s VAL 257 Ca 0.11 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.35 2dki s VAL 257 Cb -0.11 -0.53 0.01 0.00 0.00 0.00 0.00 36.38 35.75 2dki s VAL 257 CO 0.01 -0.19 -0.22 -0.22 0.00 0.00 0.00 175.10 174.48 2dki s LEU 258 N -1.05 2.05 -0.24 3.92 2.96 0.15 0.65 118.68 127.12 2dki s LEU 258 Ca -0.05 -0.56 -0.08 0.00 -0.22 0.00 0.00 54.13 53.21 2dki s LEU 258 Cb -0.07 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 2dki s LEU 258 CO 0.00 0.10 0.09 -0.63 -1.32 0.00 0.00 176.35 174.59 2dki s ILE 259 N 0.67 4.67 -0.28 6.68 1.01 0.27 -0.90 121.20 133.33 2dki s ILE 259 Ca -0.11 -0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.51 2dki s ILE 259 Cb -0.16 -3.17 0.06 0.00 0.01 0.00 0.00 42.46 39.20 2dki s ILE 259 CO 0.02 0.35 -0.08 -0.63 0.00 0.00 0.00 174.94 174.61 2dki s ILE 260 N 1.28 2.31 0.16 2.92 -1.09 -0.47 -0.88 121.20 125.43 2dki s ILE 260 Ca 0.05 -1.68 -0.31 0.00 -2.23 0.00 0.00 60.65 56.49 2dki s ILE 260 Cb -0.15 -2.39 -0.09 0.00 -1.58 0.00 0.00 42.46 38.26 2dki s ILE 260 CO 0.04 -0.10 1.38 -2.16 -1.23 0.00 0.00 174.94 172.87 2dki s PRO 261 N 1.10 4.33 0.30 2.79 0.04 -1.26 -0.70 135.00 141.60 2dki s PRO 261 Ca -0.06 2.11 0.06 0.00 0.04 0.00 0.00 61.00 63.15 2dki s PRO 261 Cb -0.20 -3.21 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 2dki s PRO 261 CO -0.05 -0.39 0.43 1.03 0.04 0.00 0.00 177.00 178.07 2dki s ARG 262 N 0.56 3.24 0.36 4.56 1.81 -0.84 -4.81 118.95 123.83 2dki s ARG 262 Ca 0.62 -0.91 -0.27 0.00 -1.72 0.00 0.00 55.73 53.45 2dki s ARG 262 Cb -0.38 -2.84 -0.12 0.00 -0.45 0.00 0.00 34.95 31.16 2dki s ARG 262 CO 0.34 0.20 1.23 -0.85 -0.68 0.00 0.00 175.30 175.54 2dki n GLU 263 N -1.56 1.95 0.00 3.54 0.00 -1.25 -3.19 120.64 120.12 2dki n GLU 263 Ca -0.03 0.69 0.00 0.00 0.00 0.00 0.00 57.16 57.81 2dki n GLU 263 Cb 0.58 -2.26 0.00 0.00 0.00 0.00 0.00 31.44 29.75 2dki n GLU 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dki n GLY 264 N 0.86 0.71 3.09 -1.84 0.00 -1.26 -4.48 105.19 102.27 2dki n GLY 264 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2dki n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dki n GLY 265 N -1.62 2.45 0.86 -0.02 0.00 -1.19 -4.78 105.19 100.88 2dki n GLY 265 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2dki n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dki n HIS 266 N -2.00 0.00 -1.80 1.61 8.25 -1.26 -5.04 115.22 114.98 2dki n HIS 266 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 2dki n HIS 266 Cb 0.00 -0.11 0.03 0.00 1.12 0.00 0.00 29.99 31.03 2dki n HIS 266 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dki s LEU 267 N -6.11 3.95 -0.00 2.41 2.96 -1.26 -4.68 118.68 115.96 2dki s LEU 267 Ca -0.04 2.82 -0.01 0.00 -0.22 0.00 0.00 54.13 56.68 2dki s LEU 267 Cb 0.02 -4.14 -0.00 0.00 0.50 0.00 0.00 46.19 42.56 2dki s LEU 267 CO 0.05 -1.41 0.01 -0.69 -1.32 0.00 0.00 176.35 173.00 2dki s VAL 268 N -1.27 0.03 -0.08 1.68 1.01 -0.60 -1.99 120.40 119.19 2dki s VAL 268 Ca 0.67 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 2dki s VAL 268 Cb -0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2dki s VAL 268 CO 0.51 -0.14 -0.03 -0.60 0.00 0.00 0.00 175.10 174.83 2dki s ARG 269 N -0.42 2.88 -0.10 2.72 3.52 0.12 -0.59 118.95 127.08 2dki s ARG 269 Ca -0.05 -0.47 0.03 0.00 -0.13 0.00 0.00 55.73 55.11 2dki s ARG 269 Cb -0.03 -2.70 0.01 0.00 -1.56 0.00 0.00 34.95 30.67 2dki s ARG 269 CO -0.00 0.68 -0.19 -0.06 -0.81 0.00 0.00 175.30 174.92 2dki s PHE 270 N -0.84 2.18 -0.34 5.12 0.40 -0.30 -1.37 117.98 122.83 2dki s PHE 270 Ca 0.13 -0.95 -0.08 0.00 -0.60 0.00 0.00 56.93 55.42 2dki s PHE 270 Cb -0.11 -1.51 0.03 0.00 0.51 0.00 0.00 43.02 41.93 2dki s PHE 270 CO 0.02 -0.44 0.14 0.71 0.70 0.00 0.00 175.22 176.35 2dki s TYR 271 N 0.67 3.22 -0.26 0.36 1.51 -0.08 -1.63 117.35 121.14 2dki s TYR 271 Ca -0.13 -1.13 -0.09 0.00 -1.01 0.00 0.00 57.07 54.72 2dki s TYR 271 Cb -0.16 -2.33 -0.04 0.00 -0.11 0.00 0.00 41.96 39.32 2dki s TYR 271 CO 0.03 -0.65 0.13 0.08 -1.11 0.00 0.00 175.55 174.02 2dki s VAL 272 N 1.49 4.77 0.33 0.71 1.01 0.56 -0.67 120.40 128.60 2dki s VAL 272 Ca 0.01 -0.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 2dki s VAL 272 Cb -0.19 -3.26 -0.09 0.00 0.00 0.00 0.00 36.38 32.84 2dki s VAL 272 CO 0.04 0.29 1.19 -0.70 0.00 0.00 0.00 175.10 175.92 2dki s GLU 273 N 1.68 4.37 0.00 2.72 2.12 -0.84 -0.14 118.70 128.61 2dki s GLU 273 Ca 0.07 1.94 0.00 0.00 0.36 0.00 0.00 54.97 57.34 2dki s GLU 273 Cb -0.16 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.25 2dki s GLU 273 CO 0.07 -0.08 0.00 -1.33 -0.54 0.00 0.00 175.26 173.38 2dki n MET 274 N 0.71 0.53 -1.29 4.30 2.81 0.83 -4.78 117.12 120.24 2dki n MET 274 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2dki n MET 274 Cb 0.44 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.95 2dki n MET 274 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2dki n ASP 275 N -0.98 -1.72 0.00 7.83 2.03 -1.26 -3.93 116.55 118.51 2dki n ASP 275 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2dki n ASP 275 Cb 0.00 -0.86 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 2dki n ASP 275 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2dki n ARG 286 N -0.10 -0.08 -2.81 -0.67 3.00 -1.26 -5.03 116.66 109.71 2dki n ARG 286 Ca 0.00 0.02 -0.14 0.00 -0.00 0.00 0.00 57.85 57.73 2dki n ARG 286 Cb 0.00 -2.96 0.03 0.00 0.00 0.00 0.00 32.46 29.52 2dki n ARG 286 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2dki n ASN 287 N -0.04 -4.43 -3.78 6.15 5.15 -1.26 -5.01 115.26 112.04 2dki n ASN 287 Ca 0.00 -0.20 -0.13 0.00 -0.60 0.00 0.00 54.58 53.65 2dki n ASN 287 Cb 0.02 -3.25 -0.12 0.00 -0.53 0.00 0.00 39.78 35.89 2dki n ASN 287 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 2dki s ILE 288 N -2.98 -0.01 0.45 -1.44 -1.16 -1.26 -5.18 121.20 109.63 2dki s ILE 288 Ca 0.22 0.03 0.05 0.00 -0.51 0.00 0.00 60.65 60.44 2dki s ILE 288 Cb -0.10 -0.33 -0.05 0.00 0.61 0.00 0.00 42.46 42.60 2dki s ILE 288 CO 0.27 0.01 0.05 0.42 -2.81 0.00 0.00 174.94 172.89 2dki s THR 289 N 0.38 1.74 0.05 4.00 -4.23 -1.26 -5.04 115.64 111.27 2dki s THR 289 Ca -0.02 -1.93 -0.24 0.00 -1.18 0.00 0.00 61.69 58.32 2dki s THR 289 Cb -0.04 -2.67 -0.17 0.00 1.34 0.00 0.00 72.50 70.97 2dki s THR 289 CO -0.02 0.00 1.56 0.58 -0.54 0.00 0.00 174.62 176.20 2dki h VAL 290 N 1.52 1.10 -0.94 2.29 2.07 -2.00 -2.76 116.25 117.53 2dki h VAL 290 Ca -0.43 -0.41 0.24 0.00 0.82 0.00 0.00 66.70 66.92 2dki h VAL 290 Cb 1.27 1.37 -0.13 0.00 -1.52 0.00 0.00 31.29 32.28 2dki h VAL 290 CO 0.76 0.10 0.47 -0.33 0.02 0.00 0.00 177.57 178.59 2dki h GLU 291 N -0.22 0.43 -0.35 1.57 3.07 -1.98 0.22 114.58 117.31 2dki h GLU 291 Ca -0.00 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.77 2dki h GLU 291 Cb 0.21 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 2dki h GLU 291 CO 0.01 0.28 0.00 1.96 -1.40 0.00 0.00 179.01 179.86 2dki h GLN 292 N 0.44 0.62 -0.20 2.33 4.20 -1.92 0.06 115.11 120.65 2dki h GLN 292 Ca 0.60 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 59.12 2dki h GLN 292 Cb 1.17 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 2dki h GLN 292 CO -0.52 0.73 0.12 -0.07 -0.67 0.00 0.00 178.83 178.42 2dki h LEU 293 N 0.44 0.23 -0.42 1.46 3.38 -0.52 0.83 115.31 120.71 2dki h LEU 293 Ca 0.10 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.07 2dki h LEU 293 Cb 0.45 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2dki h LEU 293 CO 0.02 0.19 0.22 0.40 0.09 0.00 0.00 178.44 179.36 2dki h ILE 294 N 0.25 0.99 -0.93 1.22 2.04 -0.58 0.61 117.51 121.11 2dki h ILE 294 Ca 0.07 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.79 2dki h ILE 294 Cb 0.00 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.55 2dki h ILE 294 CO -0.01 0.08 0.62 0.00 0.00 0.00 0.00 178.15 178.83 2dki h ALA 295 N 1.21 1.19 -0.34 1.87 0.00 -0.55 0.64 119.26 123.28 2dki h ALA 295 Ca 0.17 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2dki h ALA 295 Cb 0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2dki h ALA 295 CO -0.11 0.57 -0.06 1.15 0.00 0.00 0.00 179.25 180.80 2dki h THR 296 N 1.25 1.27 -0.91 0.00 2.02 -0.11 -1.79 112.91 114.64 2dki h THR 296 Ca 0.35 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 2dki h THR 296 Cb -0.13 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 2dki h THR 296 CO -0.08 0.36 0.54 0.00 0.37 0.00 0.00 175.52 176.71 2dki h ALA 297 N 0.83 1.24 -0.24 6.16 0.00 -0.37 -0.80 119.26 126.07 2dki h ALA 297 Ca 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2dki h ALA 297 Cb 0.55 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2dki h ALA 297 CO 0.03 0.64 0.11 1.96 0.00 0.00 0.00 179.25 181.99 2dki h GLN 298 N 1.25 0.36 -0.86 0.00 4.20 -0.68 0.16 115.11 119.55 2dki h GLN 298 Ca 0.33 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 59.02 2dki h GLN 298 Cb -0.04 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 2dki h GLN 298 CO -0.06 0.38 0.55 0.00 -0.67 0.00 0.00 178.83 179.03 2dki h ARG 299 N 0.25 1.01 -0.22 1.46 3.08 -0.84 -1.21 114.38 117.92 2dki h ARG 299 Ca 0.08 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 2dki h ARG 299 Cb 0.15 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2dki h ARG 299 CO -0.01 0.67 0.02 0.28 -1.07 0.00 0.00 179.97 179.86 2dki h VAL 300 N 1.04 1.24 0.00 2.04 2.07 -0.77 -3.07 116.25 118.80 2dki h VAL 300 Ca 0.35 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2dki h VAL 300 Cb 0.05 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2dki h VAL 300 CO -0.13 0.25 0.00 -0.07 0.02 0.00 0.00 177.57 177.64 2dki h LEU 301 N 0.16 0.00 -9.46 2.57 3.38 -0.30 -3.44 115.31 108.22 2dki h LEU 301 Ca 0.06 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.43 2dki h LEU 301 Cb 0.35 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.22 2dki h LEU 301 CO 0.01 0.00 0.05 1.57 0.09 0.00 0.00 178.44 180.16 2dki n HIS 302 N -2.48 1.02 1.53 1.13 -0.00 -0.49 0.14 115.22 116.06 2dki n HIS 302 Ca 0.02 0.69 0.10 0.00 0.46 0.00 0.00 57.72 58.99 2dki n HIS 302 Cb 0.25 -2.21 0.60 0.00 -0.12 0.00 0.00 29.99 28.52 2dki n HIS 302 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2dki n PRO 303 N 0.65 0.76 -2.53 1.57 -0.04 -1.26 -3.19 135.00 130.96 2dki n PRO 303 Ca 0.10 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.16 2dki n PRO 303 Cb 0.33 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 32.33 2dki n PRO 303 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dki s TYR 304 N -2.00 3.67 -0.07 0.54 2.02 0.12 -5.02 117.35 116.61 2dki s TYR 304 Ca 0.30 1.74 -0.11 0.00 -0.37 0.00 0.00 57.07 58.64 2dki s TYR 304 Cb 0.14 -3.22 -0.05 0.00 -0.40 0.00 0.00 41.96 38.43 2dki s TYR 304 CO 0.23 -0.34 0.27 0.15 -1.57 0.00 0.00 175.55 174.29 2dki s LYS 305 N -1.38 3.70 -0.26 -0.62 1.02 -1.26 -4.69 119.74 116.26 2dki s LYS 305 Ca 0.44 0.12 0.02 0.00 0.02 0.00 0.00 55.97 56.56 2dki s LYS 305 Cb -0.31 -3.22 0.07 0.00 -0.52 0.00 0.00 37.83 33.85 2dki s LYS 305 CO 0.39 0.71 -0.04 -1.17 -0.92 0.00 0.00 175.35 174.32 2dki s LEU 306 N -0.95 3.06 -0.49 3.17 2.96 -1.26 -3.14 118.68 122.03 2dki s LEU 306 Ca 0.19 -1.40 -0.09 0.00 -0.22 0.00 0.00 54.13 52.61 2dki s LEU 306 Cb -0.14 -1.31 0.13 0.00 0.50 0.00 0.00 46.19 45.37 2dki s LEU 306 CO 0.08 -0.26 0.36 -0.70 -1.32 0.00 0.00 176.35 174.52 2dki s GLU 307 N 1.27 2.51 -0.12 1.98 2.12 0.16 -4.96 118.70 121.66 2dki s GLU 307 Ca -0.03 -1.84 -0.29 0.00 0.36 0.00 0.00 54.97 53.16 2dki s GLU 307 Cb -0.19 -3.92 -0.02 0.00 0.26 0.00 0.00 34.13 30.26 2dki s GLU 307 CO -0.07 -1.19 1.21 0.08 -0.54 0.00 0.00 175.26 174.74 2dki s VAL 308 N 1.22 4.32 -0.22 3.70 1.01 -1.26 -0.96 120.40 128.21 2dki s VAL 308 Ca 0.07 1.61 0.05 0.00 0.00 0.00 0.00 61.98 63.71 2dki s VAL 308 Cb -0.25 -4.04 -0.20 0.00 0.00 0.00 0.00 36.38 31.89 2dki s VAL 308 CO -0.01 -0.08 -0.04 0.29 0.00 0.00 0.00 175.10 175.26 2dki n LYS 309 N 5.96 0.67 -3.71 2.72 4.76 -0.39 -4.98 118.16 123.20 2dki n LYS 309 Ca 0.12 0.14 -0.14 0.00 -2.87 0.00 0.00 58.31 55.56 2dki n LYS 309 Cb 0.46 -1.56 -0.08 0.00 -1.84 0.00 0.00 35.03 32.00 2dki n LYS 309 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2dki s ASN 310 N -6.33 -0.34 -0.46 4.39 3.84 -0.89 -5.00 114.94 110.15 2dki s ASN 310 Ca -0.26 0.39 0.02 0.00 0.21 0.00 0.00 52.86 53.22 2dki s ASN 310 Cb 0.08 0.49 0.14 0.00 -0.55 0.00 0.00 41.25 41.41 2dki s ASN 310 CO 0.69 -0.40 0.25 -0.69 -2.79 0.00 0.00 177.10 174.15 2dki s VAL 311 N -0.93 1.60 0.55 -5.21 1.01 -1.26 -0.54 120.40 115.63 2dki s VAL 311 Ca -0.10 -2.71 0.22 0.00 0.00 0.00 0.00 61.98 59.40 2dki s VAL 311 Cb -0.04 -2.12 0.32 0.00 0.00 0.00 0.00 36.38 34.55 2dki s VAL 311 CO 0.04 -0.89 2.14 -0.65 0.00 0.00 0.00 175.10 175.75 2dki h PRO 312 N 6.65 0.00 -1.78 2.72 0.11 -1.93 -3.45 132.00 134.32 2dki h PRO 312 Ca -0.01 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.13 2dki h PRO 312 Cb 0.92 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 31.82 2dki h PRO 312 CO 0.52 0.00 0.42 -0.46 -0.21 0.00 0.00 178.00 178.27 2dki s TRP 313 N -4.90 -0.47 -0.08 0.65 -0.00 -1.23 -5.04 118.94 107.88 2dki s TRP 313 Ca -0.05 0.76 -0.30 0.00 -0.00 0.00 0.00 56.10 56.52 2dki s TRP 313 Cb 0.17 0.44 0.11 0.00 -0.00 0.00 0.00 33.47 34.19 2dki s TRP 313 CO 0.63 -0.45 0.88 1.67 -0.00 0.00 0.00 176.95 179.68 2dki s TRP 314 N -1.32 -0.44 0.00 5.86 1.48 -1.26 -0.00 118.94 123.26 2dki s TRP 314 Ca -0.04 0.62 0.00 0.00 -1.06 0.00 0.00 56.10 55.62 2dki s TRP 314 Cb -0.00 0.47 0.00 0.00 -1.16 0.00 0.00 33.47 32.78 2dki s TRP 314 CO 0.03 -0.48 0.00 0.45 -4.06 0.00 0.00 176.95 172.89 2dki n SER 315 N 0.46 0.00 -3.69 -2.66 2.88 0.48 -4.99 113.62 106.10 2dki n SER 315 Ca -0.12 -0.19 -0.28 0.00 -1.33 0.00 0.00 58.87 56.95 2dki n SER 315 Cb 0.59 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.89 2dki n SER 315 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2dki s VAL 316 N -2.85 0.42 -0.51 2.46 1.01 -1.26 -1.33 120.40 118.34 2dki s VAL 316 Ca 0.00 -0.67 -0.24 0.00 0.00 0.00 0.00 61.98 61.07 2dki s VAL 316 Cb 0.00 -1.07 0.04 0.00 0.00 0.00 0.00 36.38 35.34 2dki s VAL 316 CO 0.00 -0.37 0.88 -0.47 0.00 0.00 0.00 175.10 175.15 2dki s TYR 317 N 1.89 2.88 -0.21 5.22 6.04 0.69 -4.88 117.35 128.97 2dki s TYR 317 Ca 0.02 0.07 -0.04 0.00 0.04 0.00 0.00 57.07 57.16 2dki s TYR 317 Cb -0.17 -3.92 0.09 0.00 -1.04 0.00 0.00 41.96 36.92 2dki s TYR 317 CO -0.15 -1.20 0.20 -2.00 -1.54 0.00 0.00 175.55 170.86 2dki s GLU 318 N 3.67 0.18 -0.11 4.97 2.12 -1.26 -0.40 118.70 127.88 2dki s GLU 318 Ca 0.30 0.04 -0.18 0.00 0.36 0.00 0.00 54.97 55.50 2dki s GLU 318 Cb -0.12 -1.26 0.04 0.00 0.26 0.00 0.00 34.13 33.04 2dki s GLU 318 CO 0.21 -0.73 0.44 0.96 -0.54 0.00 0.00 175.26 175.60 2dki s ILE 319 N 2.27 0.02 0.58 -3.70 -0.00 -1.26 -4.99 121.20 114.12 2dki s ILE 319 Ca 0.06 -0.15 -0.02 0.00 -0.00 0.00 0.00 60.65 60.54 2dki s ILE 319 Cb -0.16 -0.68 0.03 0.00 -0.00 0.00 0.00 42.46 41.66 2dki s ILE 319 CO -0.16 -0.08 0.84 -0.83 -0.00 0.00 0.00 174.94 174.71 2dki s GLY 320 N -0.45 1.71 -0.45 6.27 0.00 -1.26 -4.36 107.32 108.78 2dki s GLY 320 Ca -0.06 -1.07 -0.21 0.00 0.00 0.00 0.00 44.72 43.38 2dki s GLY 320 CO 0.03 -0.77 0.65 1.20 0.00 0.00 0.00 173.10 174.21 2dki s GLN 321 N -4.90 3.26 0.29 2.90 -0.21 -1.25 -4.56 119.66 115.19 2dki s GLN 321 Ca 0.56 -0.42 0.06 0.00 0.02 0.00 0.00 55.36 55.58 2dki s GLN 321 Cb -0.10 -3.97 -0.06 0.00 1.00 0.00 0.00 33.01 29.88 2dki s GLN 321 CO 0.41 -1.05 -0.03 1.03 -2.12 0.00 0.00 175.29 173.52 2dki s ARG 322 N 2.85 1.56 -0.21 2.91 0.52 -1.03 -2.83 118.95 122.72 2dki s ARG 322 Ca 0.22 -1.80 -0.27 0.00 -0.52 0.00 0.00 55.73 53.36 2dki s ARG 322 Cb -0.15 -1.08 0.10 0.00 0.52 0.00 0.00 34.95 34.35 2dki s ARG 322 CO 0.18 -0.01 0.90 -1.50 0.02 0.00 0.00 175.30 174.90 2dki s ILE 323 N -3.08 0.00 0.62 1.52 2.07 -0.05 -1.68 121.20 120.60 2dki s ILE 323 Ca 0.30 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 59.41 2dki s ILE 323 Cb 0.05 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.61 2dki s ILE 323 CO 0.12 0.00 1.04 0.00 -1.91 0.00 0.00 174.94 174.19 2dki h ALA 325 N 0.02 0.74 -2.57 0.00 0.00 -1.91 -3.46 119.26 112.08 2dki h ALA 325 Ca -0.45 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 53.86 2dki h ALA 325 Cb 1.20 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.74 2dki h ALA 325 CO 0.59 0.65 -0.56 0.21 0.00 0.00 0.00 179.25 180.14 2dki s LYS 326 N -3.14 0.58 0.00 0.00 2.47 -1.26 -5.03 119.74 113.36 2dki s LYS 326 Ca 0.02 -0.83 0.15 0.00 -1.56 0.00 0.00 55.97 53.75 2dki s LYS 326 Cb 0.09 0.22 0.38 0.00 -1.46 0.00 0.00 37.83 37.06 2dki s LYS 326 CO 0.73 -0.14 1.31 0.66 0.16 0.00 0.00 175.35 178.07 2dki n TYR 327 N 0.70 0.56 -4.20 4.03 0.53 -1.26 -4.96 117.16 112.56 2dki n TYR 327 Ca -0.18 -0.45 -0.12 0.00 -1.02 0.00 0.00 57.90 56.13 2dki n TYR 327 Cb 0.59 -0.02 -0.05 0.00 -1.03 0.00 0.00 39.34 38.83 2dki n TYR 327 CO 0.00 0.00 0.00 -0.40 -1.02 0.00 0.00 176.86 175.44 2dki n ASP 328 N 0.88 -0.12 -1.09 7.72 3.85 -1.26 0.03 116.55 126.56 2dki n ASP 328 Ca 0.15 -2.32 0.04 0.00 -0.71 0.00 0.00 54.79 51.95 2dki n ASP 328 Cb 0.48 0.93 0.19 0.00 -1.35 0.00 0.00 41.12 41.37 2dki n ASP 328 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2dki n ASP 329 N -2.12 3.06 -4.65 -1.12 3.85 -0.53 -4.86 116.55 110.19 2dki n ASP 329 Ca 0.03 -2.38 -0.39 0.00 -0.71 0.00 0.00 54.79 51.35 2dki n ASP 329 Cb 0.36 -0.53 -0.08 0.00 -1.35 0.00 0.00 41.12 39.52 2dki n ASP 329 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 2dki s VAL 330 N -1.79 5.18 0.20 2.12 1.01 -1.26 -4.93 120.40 120.93 2dki s VAL 330 Ca 0.26 0.67 -0.10 0.00 0.00 0.00 0.00 61.98 62.80 2dki s VAL 330 Cb 0.19 -3.72 0.14 0.00 0.00 0.00 0.00 36.38 32.98 2dki s VAL 330 CO 0.09 0.21 1.82 0.58 0.00 0.00 0.00 175.10 177.80 2dki h VAL 331 N 5.17 1.22 -2.20 2.92 2.07 -1.93 -3.44 116.25 120.06 2dki h VAL 331 Ca -0.34 -0.55 -0.59 0.00 0.82 0.00 0.00 66.70 66.04 2dki h VAL 331 Cb 1.16 0.26 0.05 0.00 -1.52 0.00 0.00 31.29 31.24 2dki h VAL 331 CO 0.69 0.24 0.84 0.47 0.02 0.00 0.00 177.57 179.83 2dki n ASP 332 N -4.48 3.09 -0.19 0.57 8.00 -1.26 -4.87 116.55 117.41 2dki n ASP 332 Ca 0.06 1.06 -0.04 0.00 0.71 0.00 0.00 54.79 56.59 2dki n ASP 332 Cb 0.09 -1.41 0.06 0.00 -0.02 0.00 0.00 41.12 39.84 2dki n ASP 332 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dki h ALA 333 N 6.47 0.74 -3.56 2.24 0.00 -1.97 -3.37 119.26 119.81 2dki h ALA 333 Ca -0.46 0.01 -0.59 0.00 0.00 0.00 0.00 54.91 53.87 2dki h ALA 333 Cb 1.26 -0.12 -0.39 0.00 0.00 0.00 0.00 17.79 18.55 2dki h ALA 333 CO 0.89 0.00 -0.78 0.08 0.00 0.00 0.00 179.25 179.45 2dki s VAL 334 N -6.12 1.34 0.70 0.00 1.01 -1.26 -5.00 120.40 111.06 2dki s VAL 334 Ca -0.13 -1.12 -0.15 0.00 0.00 0.00 0.00 61.98 60.58 2dki s VAL 334 Cb 0.14 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.88 2dki s VAL 334 CO 0.75 -0.14 1.19 0.00 0.00 0.00 0.00 175.10 176.89 2dki s ALA 335 N 1.48 2.24 0.19 5.51 0.00 -1.26 -5.06 121.76 124.86 2dki s ALA 335 Ca -0.04 0.83 -0.02 0.00 0.00 0.00 0.00 51.96 52.73 2dki s ALA 335 Cb -0.19 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 2dki s ALA 335 CO -0.07 -1.67 0.13 0.95 0.00 0.00 0.00 175.76 175.11 2dki s THR 336 N -2.00 0.02 0.17 0.00 -4.23 -1.26 -5.02 115.64 103.31 2dki s THR 336 Ca 0.73 -1.95 0.12 0.00 -1.18 0.00 0.00 61.69 59.41 2dki s THR 336 Cb -0.28 -2.40 0.12 0.00 1.34 0.00 0.00 72.50 71.29 2dki s THR 336 CO 0.43 -0.09 1.27 -0.65 -0.54 0.00 0.00 174.62 175.04 2dki h PRO 337 N 2.65 0.00 -0.36 3.99 0.11 -2.01 -0.56 132.00 135.82 2dki h PRO 337 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2dki h PRO 337 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2dki h PRO 337 CO 0.53 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 2dki n ASP 338 N -2.12 2.98 -4.82 -2.05 5.75 -1.26 -5.01 116.55 110.02 2dki n ASP 338 Ca -0.01 -1.92 -0.32 0.00 -0.01 0.00 0.00 54.79 52.53 2dki n ASP 338 Cb 0.42 -0.23 -0.01 0.00 -1.03 0.00 0.00 41.12 40.27 2dki n ASP 338 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2dki s SER 339 N -1.04 6.13 0.64 -1.12 0.01 -0.22 -5.01 113.70 113.10 2dki s SER 339 Ca 0.27 1.71 -0.17 0.00 1.31 0.00 0.00 55.95 59.07 2dki s SER 339 Cb 0.15 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 2dki s SER 339 CO 0.20 -0.93 1.20 -2.84 0.41 0.00 0.00 173.24 171.28 2dki s PRO 340 N -4.08 2.69 0.34 12.44 0.02 -1.26 -4.95 135.00 140.19 2dki s PRO 340 Ca 0.62 1.78 -0.23 0.00 0.02 0.00 0.00 61.00 63.19 2dki s PRO 340 Cb -0.13 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.39 2dki s PRO 340 CO 0.35 -1.42 0.89 -0.51 -0.33 0.00 0.00 177.00 175.98 2dki s LEU 341 N -4.47 4.20 0.50 -5.54 1.43 -1.26 -4.91 118.68 108.63 2dki s LEU 341 Ca 0.76 1.67 -0.20 0.00 -1.03 0.00 0.00 54.13 55.33 2dki s LEU 341 Cb -0.30 -4.10 -0.07 0.00 0.03 0.00 0.00 46.19 41.75 2dki s LEU 341 CO 0.38 -0.15 1.08 -2.16 0.23 0.00 0.00 176.35 175.73 2dki s PRO 342 N -2.45 3.64 0.00 1.29 0.04 -1.26 -4.88 135.00 131.38 2dki s PRO 342 Ca 0.53 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.04 2dki s PRO 342 Cb -0.15 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2dki s PRO 342 CO 0.20 -0.59 0.00 0.54 0.04 0.00 0.00 177.00 177.19 2dki n ARG 343 N -1.06 2.33 -4.73 4.56 5.12 -1.26 -5.03 116.66 116.60 2dki n ARG 343 Ca 0.10 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.76 2dki n ARG 343 Cb 0.52 -0.75 -0.17 0.00 -1.16 0.00 0.00 32.46 30.90 2dki n ARG 343 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2dki s VAL 344 N -1.34 1.35 0.19 1.55 1.01 -1.26 -2.05 120.40 119.84 2dki s VAL 344 Ca 0.00 -0.60 0.10 0.00 0.00 0.00 0.00 61.98 61.48 2dki s VAL 344 Cb 0.00 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 2dki s VAL 344 CO 0.00 0.40 -0.22 -0.36 0.00 0.00 0.00 175.10 174.92 2dki s PHE 345 N 0.59 2.13 -0.05 5.22 0.40 -0.54 -1.45 117.98 124.29 2dki s PHE 345 Ca -0.16 -0.39 0.07 0.00 -0.60 0.00 0.00 56.93 55.85 2dki s PHE 345 Cb -0.16 -1.05 -0.01 0.00 0.51 0.00 0.00 43.02 42.30 2dki s PHE 345 CO 0.05 0.45 -0.25 0.42 0.70 0.00 0.00 175.22 176.59 2dki s ILE 346 N -1.82 2.03 0.05 0.64 -1.09 0.10 -0.00 121.20 121.11 2dki s ILE 346 Ca 0.19 -1.07 0.01 0.00 -2.23 0.00 0.00 60.65 57.55 2dki s ILE 346 Cb -0.07 -1.71 -0.03 0.00 -1.58 0.00 0.00 42.46 39.07 2dki s ILE 346 CO 0.09 0.57 -0.05 0.00 -1.23 0.00 0.00 174.94 174.32 2dki s ALA 347 N -0.28 0.49 0.00 9.38 0.00 -0.21 -4.84 121.76 126.30 2dki s ALA 347 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.03 2dki s ALA 347 Cb -0.13 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2dki s ALA 347 CO 0.02 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2dki n GLY 348 N 0.88 -0.46 0.32 0.00 0.00 -1.26 -3.76 105.19 100.92 2dki n GLY 348 Ca -0.19 -1.10 0.18 0.00 0.00 0.00 0.00 46.02 44.91 2dki n GLY 348 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dki h ASP 349 N 6.41 0.00 0.00 1.61 3.32 -1.88 -2.32 116.42 123.57 2dki h ASP 349 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dki h ASP 349 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2dki h ASP 349 CO 0.00 0.00 0.05 0.00 -1.72 0.00 0.00 179.24 177.57 2dki h ALA 350 N 1.99 1.04 0.00 3.45 0.00 -1.62 -2.93 119.26 121.19 2dki h ALA 350 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dki h ALA 350 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2dki h ALA 350 CO -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.21 2dki s HIS 352 N -0.07 -0.56 -0.04 0.00 0.00 -1.04 -0.96 115.29 112.62 2dki s HIS 352 Ca 0.00 0.99 0.06 0.00 -3.00 0.00 0.00 55.06 53.11 2dki s HIS 352 Cb 0.00 0.33 -0.02 0.00 -4.00 0.00 0.00 32.58 28.89 2dki s HIS 352 CO 0.00 -0.28 -0.22 0.95 -1.00 0.00 0.00 174.74 174.19 2dki s THR 353 N 2.13 2.36 0.01 -5.38 -4.23 -0.67 -3.75 115.64 106.11 2dki s THR 353 Ca -0.04 -0.98 0.06 0.00 -1.18 0.00 0.00 61.69 59.55 2dki s THR 353 Cb -0.05 -1.86 -0.03 0.00 1.34 0.00 0.00 72.50 71.90 2dki s THR 353 CO -0.16 0.58 -0.16 -1.00 -0.54 0.00 0.00 174.62 173.33 2dki s HIS 354 N -0.56 2.61 0.69 3.99 3.76 -1.26 -2.45 115.29 122.06 2dki s HIS 354 Ca 0.08 -0.22 -0.17 0.00 -0.15 0.00 0.00 55.06 54.60 2dki s HIS 354 Cb -0.11 -1.52 0.01 0.00 1.11 0.00 0.00 32.58 32.07 2dki s HIS 354 CO 0.00 0.23 1.22 -1.13 -0.85 0.00 0.00 174.74 174.22 2dki n SER 355 N 1.76 1.62 -0.34 1.40 3.41 -1.26 -4.88 113.62 115.33 2dki n SER 355 Ca -0.16 0.76 0.07 0.00 -0.26 0.00 0.00 58.87 59.28 2dki n SER 355 Cb 0.52 -1.52 0.23 0.00 -0.26 0.00 0.00 64.21 63.18 2dki n SER 355 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2dki h PRO 356 N 0.16 0.85 0.00 4.33 0.11 -1.96 -0.38 132.00 135.11 2dki h PRO 356 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2dki h PRO 356 Cb 1.33 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2dki h PRO 356 CO 0.51 0.56 0.00 0.87 -0.21 0.00 0.00 178.00 179.73 2dki h LYS 357 N 0.87 0.00 -0.48 1.05 1.57 -1.98 -1.88 116.57 115.72 2dki h LYS 357 Ca 0.48 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.22 2dki h LYS 357 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2dki h LYS 357 CO -0.29 0.00 0.15 0.00 -0.57 0.00 0.00 179.45 178.75 2dki h ALA 358 N 2.01 1.38 -0.04 3.86 0.00 -1.40 -3.47 119.26 121.61 2dki h ALA 358 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2dki h ALA 358 Cb 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2dki h ALA 358 CO 0.00 0.46 -0.01 0.41 0.00 0.00 0.00 179.25 180.10 2dki n GLY 359 N -1.04 0.45 0.08 0.00 0.00 -0.71 -4.77 105.19 99.20 2dki n GLY 359 Ca 0.03 -0.94 -0.05 0.00 0.00 0.00 0.00 46.02 45.06 2dki n GLY 359 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2dki h GLN 360 N 0.10 0.00 0.00 1.61 1.08 -1.83 -3.46 115.11 112.61 2dki h GLN 360 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 2dki h GLN 360 Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2dki h GLN 360 CO 0.02 0.84 0.00 0.41 -0.95 0.00 0.00 178.83 179.15 2dki n GLY 361 N 1.35 2.91 0.33 3.46 0.00 -1.26 -1.31 105.19 110.66 2dki n GLY 361 Ca -0.01 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.94 2dki n GLY 361 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2dki n MET 362 N 14.00 0.95 0.29 1.61 0.00 -1.26 -4.56 117.12 128.14 2dki n MET 362 Ca 0.00 -0.67 -0.17 0.00 0.00 0.00 0.00 57.70 56.86 2dki n MET 362 Cb 0.00 -1.49 -0.08 0.00 0.00 0.00 0.00 33.22 31.65 2dki n MET 362 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 2dki h ASN 363 N 1.64 -0.96 -0.66 3.17 2.35 -1.46 -2.58 115.58 117.09 2dki h ASN 363 Ca 0.00 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2dki h ASN 363 Cb 0.60 0.30 -0.03 0.00 0.05 0.00 0.00 38.32 39.25 2dki h ASN 363 CO 0.00 -0.55 0.42 0.15 -1.65 0.00 0.00 177.43 175.80 2dki h PHE 364 N -0.84 0.85 -0.56 1.19 3.57 -1.80 -2.46 116.94 116.89 2dki h PHE 364 Ca -0.05 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.53 2dki h PHE 364 Cb 0.71 -0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 2dki h PHE 364 CO -0.15 0.55 0.24 1.03 -2.23 0.00 0.00 178.31 177.75 2dki h SER 365 N 0.91 0.30 0.71 0.41 0.87 -1.78 -1.58 113.55 113.38 2dki h SER 365 Ca 0.24 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.82 2dki h SER 365 Cb -0.07 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2dki h SER 365 CO -0.05 0.20 -0.14 0.24 -0.53 0.00 0.00 176.83 176.54 2dki h MET 366 N 0.46 0.00 0.00 2.24 2.86 -1.05 -2.61 114.93 116.83 2dki h MET 366 Ca 0.27 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.86 2dki h MET 366 Cb 0.26 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2dki h MET 366 CO -0.23 0.14 -0.22 1.96 1.06 0.00 0.00 176.91 179.62 2dki h GLN 367 N 0.00 0.00 0.20 1.72 1.08 -1.14 -2.04 115.11 114.93 2dki h GLN 367 Ca -0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 2dki h GLN 367 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 2dki h GLN 367 CO 0.02 0.22 -0.10 -0.44 -0.95 0.00 0.00 178.83 177.58 2dki h ASP 368 N 0.00 -0.23 -0.58 1.46 3.32 -1.38 -2.14 116.42 116.87 2dki h ASP 368 Ca -0.00 -0.17 0.02 0.00 0.02 0.00 0.00 57.03 56.90 2dki h ASP 368 Cb 0.72 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 2dki h ASP 368 CO 0.03 0.05 0.38 0.28 -1.72 0.00 0.00 179.24 178.26 2dki h SER 369 N -0.51 0.62 0.95 6.45 0.02 -1.59 -0.62 113.55 118.87 2dki h SER 369 Ca -0.03 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2dki h SER 369 Cb 0.38 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2dki h SER 369 CO 0.05 0.44 -0.19 0.15 -1.14 0.00 0.00 176.83 176.13 2dki h PHE 370 N 0.73 0.00 0.07 3.45 3.57 -1.26 0.15 116.94 123.65 2dki h PHE 370 Ca 0.22 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.57 2dki h PHE 370 Cb 0.01 0.00 0.02 0.00 2.79 0.00 0.00 35.95 38.76 2dki h PHE 370 CO -0.00 0.19 -0.63 -0.97 -2.23 0.00 0.00 178.31 174.67 2dki h ASN 371 N 0.00 0.44 0.11 0.41 -0.73 -0.48 -3.37 115.58 111.97 2dki h ASN 371 Ca -0.00 -0.86 -0.26 0.00 1.87 0.00 0.00 56.30 57.04 2dki h ASN 371 Cb 0.72 -0.14 0.02 0.00 0.27 0.00 0.00 38.32 39.19 2dki h ASN 371 CO 0.03 1.26 -1.05 0.25 -0.37 0.00 0.00 177.43 177.55 2dki h LEU 372 N -0.32 0.81 0.00 0.34 5.85 -1.06 -3.37 115.31 117.56 2dki h LEU 372 Ca -0.10 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 57.96 2dki h LEU 372 Cb 1.42 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2dki h LEU 372 CO 0.12 1.46 0.00 0.61 -0.34 0.00 0.00 178.44 180.29 2dki n GLY 373 N 1.09 -2.70 0.26 3.75 0.00 0.51 -1.44 105.19 106.67 2dki n GLY 373 Ca -0.10 0.52 0.06 0.00 0.00 0.00 0.00 46.02 46.51 2dki n GLY 373 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2dki h TRP 374 N 0.00 0.11 -0.06 1.61 5.08 -1.77 -2.60 115.95 118.32 2dki h TRP 374 Ca 0.00 -0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 2dki h TRP 374 Cb 0.00 -0.04 -0.00 0.00 -3.00 0.00 0.00 29.16 26.12 2dki h TRP 374 CO -0.63 0.11 0.01 0.87 -1.28 0.00 0.00 178.44 177.53 2dki h LYS 375 N 0.12 0.09 -0.33 0.12 1.57 -1.46 -1.23 116.57 115.44 2dki h LYS 375 Ca 0.03 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 2dki h LYS 375 Cb 0.06 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.31 2dki h LYS 375 CO -0.00 0.28 0.04 -0.07 -0.57 0.00 0.00 179.45 179.13 2dki h LEU 376 N -0.12 -0.04 -0.59 2.94 3.38 -0.88 -1.32 115.31 118.68 2dki h LEU 376 Ca 0.02 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.07 2dki h LEU 376 Cb 0.23 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2dki h LEU 376 CO 0.00 0.01 0.37 0.00 0.09 0.00 0.00 178.44 178.91 2dki h ALA 377 N 1.26 0.76 -0.44 1.53 0.00 -1.34 0.39 119.26 121.41 2dki h ALA 377 Ca 0.16 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2dki h ALA 377 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2dki h ALA 377 CO -0.23 0.11 0.16 0.00 0.00 0.00 0.00 179.25 179.29 2dki h ALA 378 N 1.25 0.58 -0.38 0.00 0.00 -0.77 -0.60 119.26 119.33 2dki h ALA 378 Ca 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2dki h ALA 378 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2dki h ALA 378 CO -0.09 0.20 0.10 0.28 0.00 0.00 0.00 179.25 179.75 2dki h VAL 379 N 0.57 1.22 -0.54 0.00 2.07 -0.98 0.16 116.25 118.76 2dki h VAL 379 Ca 0.15 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 2dki h VAL 379 Cb 0.23 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2dki h VAL 379 CO -0.01 0.26 0.26 -0.07 0.02 0.00 0.00 177.57 178.03 2dki h LEU 380 N 0.47 0.69 -0.47 2.57 3.38 -0.79 -0.32 115.31 120.83 2dki h LEU 380 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dki h LEU 380 Cb 0.29 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2dki h LEU 380 CO -0.00 0.59 0.00 0.54 0.09 0.00 0.00 178.44 179.66 2dki n ARG 381 N -4.37 1.30 -3.07 1.13 1.74 -0.25 -4.89 116.66 108.26 2dki n ARG 381 Ca 0.05 -0.46 -0.22 0.00 -0.77 0.00 0.00 57.85 56.45 2dki n ARG 381 Cb 0.13 -1.28 0.01 0.00 -1.02 0.00 0.00 32.46 30.30 2dki n ARG 381 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2dki n LYS 382 N -0.28 -3.82 0.02 5.56 5.02 -0.13 -4.83 118.16 119.70 2dki n LYS 382 Ca 0.12 0.70 0.11 0.00 -2.02 0.00 0.00 58.31 57.22 2dki n LYS 382 Cb 0.16 -5.46 -0.09 0.00 -0.02 0.00 0.00 35.03 29.63 2dki n LYS 382 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2dki n GLN 383 N -3.72 0.48 -4.05 1.97 6.02 0.48 -4.61 117.38 113.95 2dki n GLN 383 Ca -0.08 -0.07 -0.12 0.00 -0.01 0.00 0.00 57.00 56.71 2dki n GLN 383 Cb 0.59 -1.59 -0.12 0.00 1.02 0.00 0.00 30.24 30.15 2dki n GLN 383 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dki s ALA 385 N -1.23 3.23 0.64 0.00 0.00 0.45 -4.28 121.76 120.56 2dki s ALA 385 Ca -0.10 1.31 0.36 0.00 0.00 0.00 0.00 51.96 53.52 2dki s ALA 385 Cb -0.09 -3.52 1.98 0.00 0.00 0.00 0.00 23.12 21.49 2dki s ALA 385 CO 0.00 -0.97 2.18 -1.00 0.00 0.00 0.00 175.76 175.97 2dki h PRO 386 N 2.49 0.00 -0.17 0.00 0.13 -1.91 -0.95 132.00 131.60 2dki h PRO 386 Ca -0.50 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.68 2dki h PRO 386 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2dki h PRO 386 CO 0.62 0.00 0.19 0.93 -0.23 0.00 0.00 178.00 179.51 2dki h GLU 387 N 0.00 0.00 -0.98 0.86 3.07 -1.95 -1.05 114.58 114.53 2dki h GLU 387 Ca 0.02 0.00 0.14 0.00 -0.50 0.00 0.00 59.36 59.02 2dki h GLU 387 Cb 0.30 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.13 2dki h GLU 387 CO -0.00 0.00 0.62 1.25 -1.40 0.00 0.00 179.01 179.48 2dki h LEU 388 N 0.00 0.86 -2.06 1.33 5.85 -1.53 -1.14 115.31 118.62 2dki h LEU 388 Ca 0.08 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.93 2dki h LEU 388 Cb 0.46 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2dki h LEU 388 CO -0.00 0.43 0.36 -0.07 -0.34 0.00 0.00 178.44 178.82 2dki h LEU 389 N 0.90 0.00 -1.18 2.25 3.38 -1.40 -0.63 115.31 118.63 2dki h LEU 389 Ca 0.50 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.42 2dki h LEU 389 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2dki h LEU 389 CO -0.27 0.00 0.01 0.45 0.09 0.00 0.00 178.44 178.72 2dki h HIS 390 N 0.00 0.60 0.00 1.13 3.86 -1.38 -2.66 115.15 116.70 2dki h HIS 390 Ca 0.13 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2dki h HIS 390 Cb 0.84 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 29.14 2dki h HIS 390 CO 0.00 0.58 -0.00 1.79 0.86 0.00 0.00 177.93 181.16 2dki h THR 391 N 0.56 0.00 0.67 2.45 1.35 -1.26 -2.78 112.91 113.89 2dki h THR 391 Ca 0.12 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.82 2dki h THR 391 Cb 0.34 1.13 0.01 0.00 -1.73 0.00 0.00 68.15 67.89 2dki h THR 391 CO 0.01 0.00 -0.32 0.22 -0.25 0.00 0.00 175.52 175.18 2dki h TYR 392 N 0.00 -0.83 -0.16 4.73 3.20 -1.62 -0.08 116.97 122.21 2dki h TYR 392 Ca -0.00 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2dki h TYR 392 Cb 0.13 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2dki h TYR 392 CO 0.00 -0.50 0.04 1.03 -1.64 0.00 0.00 178.16 177.09 2dki h SER 393 N -0.94 0.24 -0.10 -2.11 0.87 -1.67 -0.14 113.55 109.69 2dki h SER 393 Ca -0.09 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.23 2dki h SER 393 Cb 0.70 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2dki h SER 393 CO 0.15 0.40 0.02 0.77 -0.53 0.00 0.00 176.83 177.64 2dki h SER 394 N 0.07 0.21 0.00 6.23 4.64 -1.55 0.17 113.55 123.32 2dki h SER 394 Ca 0.05 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2dki h SER 394 Cb 0.25 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2dki h SER 394 CO -0.00 0.24 -0.01 -0.33 -0.87 0.00 0.00 176.83 175.85 2dki h GLU 395 N 0.24 0.00 0.00 4.77 5.08 -0.82 -3.30 114.58 120.55 2dki h GLU 395 Ca 0.06 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 2dki h GLU 395 Cb 0.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 2dki h GLU 395 CO -0.00 0.42 -0.59 0.00 -1.00 0.00 0.00 179.01 177.84 2dki h ARG 396 N -1.00 0.00 -0.15 2.33 2.47 -1.01 -2.97 114.38 114.06 2dki h ARG 396 Ca -0.00 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 2dki h ARG 396 Cb 0.43 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.75 2dki h ARG 396 CO -0.00 0.59 -0.28 0.37 0.56 0.00 0.00 179.97 181.21 2dki h GLN 397 N 0.00 0.45 -0.01 0.04 -0.00 -1.14 -2.82 115.11 111.62 2dki h GLN 397 Ca -0.01 -0.29 -0.00 0.00 -0.00 0.00 0.00 58.65 58.36 2dki h GLN 397 Cb 1.05 0.03 -0.00 0.00 0.00 0.00 0.00 27.48 28.56 2dki h GLN 397 CO 0.08 0.89 0.00 0.28 0.00 0.00 0.00 178.83 180.08 2dki h VAL 398 N 0.06 1.08 0.00 2.39 2.07 -1.63 -1.06 116.25 119.15 2dki h VAL 398 Ca 0.01 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.24 2dki h VAL 398 Cb 0.87 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2dki h VAL 398 CO 0.06 0.06 -0.29 -0.37 0.02 0.00 0.00 177.57 177.06 2dki h VAL 399 N -0.08 1.07 -0.03 2.57 -1.51 -1.63 0.10 116.25 116.74 2dki h VAL 399 Ca 0.00 -1.03 -0.02 0.00 -1.23 0.00 0.00 66.70 64.43 2dki h VAL 399 Cb 0.09 1.57 -0.00 0.00 -2.13 0.00 0.00 31.29 30.83 2dki h VAL 399 CO -0.00 0.28 -0.05 0.00 -1.23 0.00 0.00 177.57 176.57 2dki h ALA 400 N 1.71 0.05 -0.70 5.19 0.00 -1.29 -1.63 119.26 122.59 2dki h ALA 400 Ca -0.00 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.63 2dki h ALA 400 Cb 0.55 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2dki h ALA 400 CO 0.04 -0.14 0.46 0.37 0.00 0.00 0.00 179.25 179.98 2dki h GLN 401 N -0.40 0.91 -0.25 0.00 5.75 -0.91 -0.77 115.11 119.43 2dki h GLN 401 Ca 0.00 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.41 2dki h GLN 401 Cb 0.58 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 2dki h GLN 401 CO 0.01 0.60 -0.02 1.96 -2.65 0.00 0.00 178.83 178.73 2dki h GLN 402 N 0.94 0.38 -0.42 1.69 4.20 -0.97 0.11 115.11 121.04 2dki h GLN 402 Ca 0.26 -0.07 -0.12 0.00 0.06 0.00 0.00 58.65 58.78 2dki h GLN 402 Cb -0.09 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 2dki h GLN 402 CO -0.06 0.43 -0.19 1.25 -0.67 0.00 0.00 178.83 179.58 2dki h LEU 403 N 0.37 0.90 -0.43 1.46 5.85 -0.40 -2.15 115.31 120.91 2dki h LEU 403 Ca 0.08 -0.40 -0.08 0.00 0.84 0.00 0.00 57.88 58.33 2dki h LEU 403 Cb 0.28 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2dki h LEU 403 CO 0.01 1.10 -0.02 0.40 -0.34 0.00 0.00 178.44 179.59 2dki h ILE 404 N 0.69 1.26 -0.93 4.05 2.04 -0.49 -1.54 117.51 122.60 2dki h ILE 404 Ca 0.09 -1.07 0.05 0.00 1.00 0.00 0.00 64.86 64.93 2dki h ILE 404 Cb 0.76 1.09 -0.06 0.00 -0.74 0.00 0.00 36.82 37.87 2dki h ILE 404 CO 0.06 0.37 0.61 0.44 0.00 0.00 0.00 178.15 179.63 2dki h ASP 405 N 0.62 0.97 0.09 1.72 3.32 -0.70 0.12 116.42 122.56 2dki h ASP 405 Ca 0.12 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2dki h ASP 405 Cb 0.52 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2dki h ASP 405 CO 0.03 0.64 -0.04 0.15 -1.72 0.00 0.00 179.24 178.30 2dki h PHE 406 N 1.12 -0.11 0.00 4.55 3.04 -1.14 -2.93 116.94 121.47 2dki h PHE 406 Ca 0.39 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.34 2dki h PHE 406 Cb 0.11 0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.66 2dki h PHE 406 CO -0.00 0.33 0.00 -0.25 -2.02 0.00 0.00 178.31 176.37 2dki n ASP 407 N -4.92 0.00 0.07 0.41 8.00 -0.60 -1.48 116.55 118.02 2dki n ASP 407 Ca -0.09 -0.10 -0.05 0.00 0.71 0.00 0.00 54.79 55.27 2dki n ASP 407 Cb 0.25 -0.19 -0.09 0.00 -0.02 0.00 0.00 41.12 41.06 2dki n ASP 407 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2dki h ARG 408 N 0.00 0.00 0.00 -1.24 9.65 -0.78 -3.31 114.38 118.70 2dki h ARG 408 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2dki h ARG 408 Cb 0.09 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 2dki h ARG 408 CO 0.00 0.84 -1.89 0.39 2.80 0.00 0.00 179.97 182.10 2dki n GLU 409 N -3.28 0.61 0.15 0.20 -0.58 -0.55 -4.08 120.64 113.11 2dki n GLU 409 Ca -0.02 -0.18 0.09 0.00 -0.42 0.00 0.00 57.16 56.64 2dki n GLU 409 Cb 0.91 -1.49 0.49 0.00 -0.57 0.00 0.00 31.44 30.78 2dki n GLU 409 CO 0.00 0.00 0.00 1.87 -0.48 0.00 0.00 177.13 178.52 2dki n TRP 410 N -2.18 0.61 -1.51 -0.32 -0.00 -0.58 -3.40 117.44 110.06 2dki n TRP 410 Ca -0.03 0.32 -0.42 0.00 -0.00 0.00 0.00 57.50 57.37 2dki n TRP 410 Cb 0.53 -0.96 -0.03 0.00 -0.00 0.00 0.00 31.31 30.85 2dki n TRP 410 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2dki n ALA 411 N -1.70 3.97 -0.22 5.87 0.00 -1.26 -5.09 120.51 122.09 2dki n ALA 411 Ca -0.01 -3.52 -0.08 0.00 0.00 0.00 0.00 53.44 49.83 2dki n ALA 411 Cb 0.10 -3.59 0.01 0.00 0.00 0.00 0.00 19.45 15.97 2dki n ALA 411 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dki n LYS 412 N 6.88 0.00 0.00 0.00 5.02 -1.22 -5.11 118.16 123.73 2dki n LYS 412 Ca 0.50 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 2dki n LYS 412 Cb 0.41 -0.22 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 2dki n LYS 412 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2dki n ASP 427 N 0.76 0.00 -0.20 4.39 2.03 -1.26 -5.13 116.55 117.13 2dki n ASP 427 Ca -0.00 0.00 0.24 0.00 0.52 0.00 0.00 54.79 55.55 2dki n ASP 427 Cb 0.12 0.00 0.63 0.00 -0.72 0.00 0.00 41.12 41.15 2dki n ASP 427 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dki h PRO 428 N 0.00 0.17 0.00 -0.67 0.13 -2.06 0.57 132.00 130.14 2dki h PRO 428 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2dki h PRO 428 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 2dki h PRO 428 CO 0.00 0.12 -0.93 1.17 -0.23 0.00 0.00 178.00 178.13 2dki n LYS 429 N -4.39 0.50 0.22 0.86 4.81 -1.26 -3.20 118.16 115.69 2dki n LYS 429 Ca 0.19 0.10 0.10 0.00 -0.87 0.00 0.00 58.31 57.83 2dki n LYS 429 Cb 0.83 -1.77 0.33 0.00 0.02 0.00 0.00 35.03 34.45 2dki n LYS 429 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2dki h GLU 430 N 0.00 0.00 0.21 1.64 4.57 -0.44 -2.40 114.58 118.15 2dki h GLU 430 Ca 0.00 0.00 -0.32 0.00 -1.18 0.00 0.00 59.36 57.86 2dki h GLU 430 Cb 0.91 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.53 2dki h GLU 430 CO 0.00 0.17 -1.44 0.35 -1.18 0.00 0.00 179.01 176.92 2dki h PHE 431 N 0.00 0.79 0.00 0.92 3.04 -0.84 -2.31 116.94 118.53 2dki h PHE 431 Ca -0.00 -0.58 -0.02 0.00 3.98 0.00 0.00 57.97 61.35 2dki h PHE 431 Cb 0.90 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.38 2dki h PHE 431 CO 0.00 1.48 -0.10 0.37 -2.02 0.00 0.00 178.31 178.03 2dki h GLN 432 N 0.12 0.00 0.02 1.11 5.75 -1.48 0.35 115.11 120.98 2dki h GLN 432 Ca -0.23 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.17 2dki h GLN 432 Cb 2.10 0.00 0.01 0.00 1.07 0.00 0.00 27.48 30.66 2dki h GLN 432 CO 0.24 0.10 -0.43 -0.22 -2.65 0.00 0.00 178.83 175.88 2dki h LYS 433 N 0.00 0.25 -0.83 1.69 3.64 -1.37 -1.79 116.57 118.15 2dki h LYS 433 Ca -0.00 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.06 2dki h LYS 433 Cb 0.41 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 2dki h LYS 433 CO 0.01 1.04 0.46 1.88 -2.27 0.00 0.00 179.45 180.57 2dki h TYR 434 N -0.40 1.13 -0.37 1.91 0.05 -0.80 -0.73 116.97 117.76 2dki h TYR 434 Ca -0.06 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.67 2dki h TYR 434 Cb 1.21 -0.36 -0.02 0.00 1.01 0.00 0.00 36.73 38.57 2dki h TYR 434 CO 0.18 0.78 0.15 0.35 -1.05 0.00 0.00 178.16 178.58 2dki h PHE 435 N 1.15 0.56 -0.18 4.88 3.57 -0.35 -1.37 116.94 125.21 2dki h PHE 435 Ca 0.29 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 2dki h PHE 435 Cb 0.02 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 2dki h PHE 435 CO 0.00 0.51 0.01 1.49 -2.23 0.00 0.00 178.31 178.09 2dki h GLU 436 N 0.45 0.31 -0.78 1.11 4.81 -1.00 -2.75 114.58 116.73 2dki h GLU 436 Ca 0.12 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2dki h GLU 436 Cb 0.18 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 2dki h GLU 436 CO -0.01 0.51 0.39 0.37 -0.73 0.00 0.00 179.01 179.53 2dki h GLN 437 N 0.07 1.12 -0.61 1.92 5.75 -1.11 -1.98 115.11 120.28 2dki h GLN 437 Ca 0.05 -0.15 0.04 0.00 -0.15 0.00 0.00 58.65 58.44 2dki h GLN 437 Cb 0.36 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 2dki h GLN 437 CO 0.01 0.85 0.40 1.25 -2.65 0.00 0.00 178.83 178.69 2dki h HIS 438 N 1.11 0.68 -0.35 3.99 2.76 -1.15 -1.60 115.15 120.59 2dki h HIS 438 Ca 0.27 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.39 2dki h HIS 438 Cb 0.09 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 2dki h HIS 438 CO 0.01 0.39 -0.06 0.78 -1.30 0.00 0.00 177.93 177.75 2dki h GLY 439 N 0.70 0.71 1.14 5.26 0.00 -1.06 -0.16 103.07 109.66 2dki h GLY 439 Ca 0.24 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2dki h GLY 439 CO -0.07 0.52 0.32 3.21 0.00 0.00 0.00 176.54 180.52 2dki h ARG 440 N 0.45 1.10 -0.22 4.80 3.08 -1.24 -1.17 114.38 121.18 2dki h ARG 440 Ca 0.09 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 59.91 2dki h ARG 440 Cb 0.56 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2dki h ARG 440 CO 0.03 0.88 -0.06 0.74 -1.07 0.00 0.00 179.97 180.48 2dki h PHE 441 N 1.08 0.49 0.00 3.04 0.05 -1.11 -2.21 116.94 118.28 2dki h PHE 441 Ca 0.25 -0.11 -0.04 0.00 3.82 0.00 0.00 57.97 61.89 2dki h PHE 441 Cb 0.18 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 38.00 2dki h PHE 441 CO 0.02 0.68 -0.21 1.79 -0.18 0.00 0.00 178.31 180.41 2dki h THR 442 N 0.16 0.68 0.00 -1.55 1.35 -0.88 -1.12 112.91 111.54 2dki h THR 442 Ca 0.05 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2dki h THR 442 Cb 0.53 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2dki h THR 442 CO 0.02 0.20 0.00 0.00 -0.25 0.00 0.00 175.52 175.50 2dki n ALA 443 N -2.29 2.19 -1.07 6.62 0.00 -0.45 -4.72 120.51 120.78 2dki n ALA 443 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 2dki n ALA 443 Cb 0.34 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 2dki n ALA 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dki n GLY 444 N 1.15 0.59 0.79 0.00 0.00 -0.43 -1.13 105.19 106.17 2dki n GLY 444 Ca 0.06 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.40 2dki n GLY 444 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dki n VAL 445 N -2.89 1.09 1.06 1.61 0.24 -0.87 -4.45 118.33 114.11 2dki n VAL 445 Ca -0.03 -1.05 0.12 0.00 -2.04 0.00 0.00 64.34 61.34 2dki n VAL 445 Cb 0.10 0.45 0.19 0.00 -1.47 0.00 0.00 33.84 33.12 2dki n VAL 445 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dki n GLY 446 N 0.66 -0.93 3.70 7.63 0.00 -1.20 -4.81 105.19 110.25 2dki n GLY 446 Ca 0.15 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 2dki n GLY 446 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dki s THR 447 N -2.82 2.45 -0.28 2.61 2.01 -1.26 -4.96 115.64 113.38 2dki s THR 447 Ca 0.15 0.07 -0.04 0.00 0.31 0.00 0.00 61.69 62.18 2dki s THR 447 Cb 0.18 -3.05 0.10 0.00 0.01 0.00 0.00 72.50 69.74 2dki s THR 447 CO 0.67 0.00 0.13 -2.28 -0.69 0.00 0.00 174.62 172.46 2dki s HIS 448 N 2.35 0.28 0.34 4.92 5.04 -1.26 -4.25 115.29 122.71 2dki s HIS 448 Ca 0.79 -0.81 -0.27 0.00 -1.54 0.00 0.00 55.06 53.23 2dki s HIS 448 Cb -0.46 -0.87 -0.09 0.00 0.04 0.00 0.00 32.58 31.20 2dki s HIS 448 CO 0.35 -0.81 1.18 0.71 -2.34 0.00 0.00 174.74 173.83 2dki s TYR 449 N 2.11 3.24 0.57 3.88 2.02 0.03 -4.97 117.35 124.23 2dki s TYR 449 Ca 0.09 1.57 -0.09 0.00 -0.37 0.00 0.00 57.07 58.26 2dki s TYR 449 Cb -0.16 -3.43 -0.04 0.00 -0.40 0.00 0.00 41.96 37.93 2dki s TYR 449 CO -0.35 -1.19 0.94 0.00 -1.57 0.00 0.00 175.55 173.38 2dki s ALA 450 N -1.27 3.21 0.33 3.71 0.00 -1.26 -4.58 121.76 121.91 2dki s ALA 450 Ca 0.51 -0.24 -0.25 0.00 0.00 0.00 0.00 51.96 51.97 2dki s ALA 450 Cb -0.33 -2.90 -0.14 0.00 0.00 0.00 0.00 23.12 19.75 2dki s ALA 450 CO 0.43 -0.56 0.68 -2.30 0.00 0.00 0.00 175.76 174.01 2dki n PRO 451 N -2.56 0.69 0.00 0.00 -0.02 -1.26 -4.68 135.00 127.17 2dki n PRO 451 Ca 0.04 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2dki n PRO 451 Cb 0.54 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 2dki n PRO 451 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2dki n SER 452 N 1.43 0.00 -0.30 2.55 3.41 0.50 -4.88 113.62 116.33 2dki n SER 452 Ca 0.12 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.68 2dki n SER 452 Cb 0.34 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.36 2dki n SER 452 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2dki h LEU 453 N 0.00 1.05 0.00 1.04 5.85 -2.01 -3.23 115.31 118.01 2dki h LEU 453 Ca 0.00 -0.13 -0.27 0.00 0.84 0.00 0.00 57.88 58.32 2dki h LEU 453 Cb 0.00 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 2dki h LEU 453 CO 0.00 0.88 -2.01 0.18 -0.34 0.00 0.00 178.44 177.15 2dki n LEU 454 N -4.35 0.36 -4.64 2.25 4.77 -1.26 -4.95 117.00 109.18 2dki n LEU 454 Ca 0.08 0.16 -0.36 0.00 -0.03 0.00 0.00 56.01 55.87 2dki n LEU 454 Cb 0.13 0.29 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 2dki n LEU 454 CO 0.39 0.35 -0.21 -0.89 -1.33 0.00 0.00 177.39 175.70 2dki s THR 455 N -2.71 5.06 1.08 -5.08 2.01 -1.22 -4.68 115.64 110.10 2dki s THR 455 Ca -0.07 0.07 -0.15 0.00 0.31 0.00 0.00 61.69 61.84 2dki s THR 455 Cb 0.08 -3.32 0.23 0.00 0.01 0.00 0.00 72.50 69.50 2dki s THR 455 CO 0.83 0.40 1.11 -0.83 -0.69 0.00 0.00 174.62 175.44 2dki s GLY 456 N 0.77 1.58 0.00 4.40 0.00 -0.41 -0.37 107.32 113.29 2dki s GLY 456 Ca 0.06 -0.67 0.26 0.00 0.00 0.00 0.00 44.72 44.37 2dki s GLY 456 CO 0.02 0.07 1.50 -0.18 0.00 0.00 0.00 173.10 174.51 2dki n GLN 457 N -4.40 0.92 -2.48 2.90 7.27 -1.26 -4.33 117.38 116.00 2dki n GLN 457 Ca 0.09 -0.59 -0.10 0.00 0.07 0.00 0.00 57.00 56.47 2dki n GLN 457 Cb 0.59 -1.49 0.01 0.00 2.41 0.00 0.00 30.24 31.76 2dki n GLN 457 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2dki n ALA 458 N -0.52 -0.41 0.36 1.69 0.00 -1.26 -4.93 120.51 115.43 2dki n ALA 458 Ca 0.12 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.82 2dki n ALA 458 Cb 0.37 -1.86 0.45 0.00 0.00 0.00 0.00 19.45 18.40 2dki n ALA 458 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dki h LYS 459 N -0.45 0.00 -0.21 0.00 1.57 -1.93 -3.03 116.57 112.51 2dki h LYS 459 Ca -0.25 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.42 2dki h LYS 459 Cb 1.17 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.42 2dki h LYS 459 CO 0.27 0.00 -0.27 0.72 -0.57 0.00 0.00 179.45 179.61 2dki n HIS 460 N -2.74 0.65 0.16 -1.35 8.25 -1.26 -4.76 115.22 114.17 2dki n HIS 460 Ca 0.03 -1.58 0.09 0.00 -0.26 0.00 0.00 57.72 56.00 2dki n HIS 460 Cb 0.38 -0.39 0.60 0.00 1.12 0.00 0.00 29.99 31.69 2dki n HIS 460 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2dki h GLN 461 N 1.01 0.12 0.00 -0.41 5.75 -1.79 -2.09 115.11 117.71 2dki h GLN 461 Ca 0.13 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2dki h GLN 461 Cb 1.38 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.91 2dki h GLN 461 CO 0.23 0.08 0.00 0.00 -2.65 0.00 0.00 178.83 176.49 2dki n ALA 462 N -2.54 1.44 0.17 3.38 0.00 -1.26 -1.95 120.51 119.76 2dki n ALA 462 Ca 0.00 0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.56 2dki n ALA 462 Cb 0.16 -1.33 0.33 0.00 0.00 0.00 0.00 19.45 18.60 2dki n ALA 462 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2dki h LEU 463 N 0.00 0.02 -5.56 0.00 3.38 -1.66 -3.36 115.31 108.13 2dki h LEU 463 Ca 0.00 -0.01 -0.37 0.00 0.09 0.00 0.00 57.88 57.59 2dki h LEU 463 Cb 0.23 -0.01 -0.26 0.00 0.09 0.00 0.00 40.66 40.71 2dki h LEU 463 CO 0.00 0.42 -0.76 0.00 0.09 0.00 0.00 178.44 178.20 2dki n ALA 464 N -2.46 0.39 -0.08 1.53 0.00 -0.82 -0.30 120.51 118.77 2dki n ALA 464 Ca -0.02 -2.18 0.16 0.00 0.00 0.00 0.00 53.44 51.40 2dki n ALA 464 Cb 0.43 -1.11 0.56 0.00 0.00 0.00 0.00 19.45 19.33 2dki n ALA 464 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dki h SER 465 N 4.65 0.26 0.15 0.00 4.64 -0.86 -1.62 113.55 120.76 2dki h SER 465 Ca 0.06 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2dki h SER 465 Cb 0.99 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2dki h SER 465 CO 0.29 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 2dki n GLY 466 N -1.56 -0.97 2.49 -0.77 0.00 0.34 -4.10 105.19 100.63 2dki n GLY 466 Ca 0.11 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 2dki n GLY 466 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dki n PHE 467 N -1.08 3.63 -1.69 1.61 3.72 -0.61 -4.71 117.46 118.33 2dki n PHE 467 Ca 0.19 -4.12 -0.54 0.00 -0.05 0.00 0.00 57.45 52.92 2dki n PHE 467 Cb 0.13 -0.54 -0.06 0.00 -0.94 0.00 0.00 39.48 38.06 2dki n PHE 467 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2dki n THR 468 N 0.68 0.33 -1.71 4.37 -1.04 -1.26 -4.86 114.28 110.79 2dki n THR 468 Ca 0.30 -0.06 -0.43 0.00 -2.04 0.00 0.00 64.05 61.82 2dki n THR 468 Cb 0.41 -1.35 -0.03 0.00 -1.82 0.00 0.00 70.33 67.54 2dki n THR 468 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2dki n VAL 469 N 4.45 0.01 -0.10 12.58 0.31 -1.26 -1.95 118.33 132.37 2dki n VAL 469 Ca 0.24 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 2dki n VAL 469 Cb 0.18 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.24 2dki n VAL 469 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dki n GLY 470 N 3.81 0.76 3.75 2.92 0.00 -0.25 -4.80 105.19 111.39 2dki n GLY 470 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 2dki n GLY 470 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dki s MET 471 N -0.72 2.33 0.55 1.61 1.00 -0.82 -0.79 119.30 122.46 2dki s MET 471 Ca 0.00 -1.66 -0.21 0.00 0.00 0.00 0.00 55.69 53.82 2dki s MET 471 Cb 0.00 -2.12 -0.05 0.00 0.00 0.00 0.00 34.83 32.66 2dki s MET 471 CO 0.00 -0.01 1.28 -0.98 0.00 0.00 0.00 175.02 175.31 2dki s ARG 472 N -3.90 3.14 -0.50 2.03 1.04 -1.26 -1.24 118.95 118.26 2dki s ARG 472 Ca 0.40 2.03 -0.27 0.00 -1.04 0.00 0.00 55.73 56.85 2dki s ARG 472 Cb -0.00 -2.15 -0.02 0.00 -2.04 0.00 0.00 34.95 30.73 2dki s ARG 472 CO 0.23 -1.13 1.83 0.12 -0.04 0.00 0.00 175.30 176.31 2dki s PHE 473 N -1.42 1.74 -0.70 5.89 5.36 -0.04 -4.77 117.98 124.03 2dki s PHE 473 Ca 0.73 0.75 -0.26 0.00 -0.96 0.00 0.00 56.93 57.19 2dki s PHE 473 Cb -0.36 -4.10 -0.01 0.00 -0.34 0.00 0.00 43.02 38.22 2dki s PHE 473 CO 0.41 -2.52 1.69 -1.58 -1.46 0.00 0.00 175.22 171.75 2dki s HIS 474 N 8.17 1.90 0.87 10.12 5.65 -1.26 -4.91 115.29 135.82 2dki s HIS 474 Ca 0.72 0.44 -0.12 0.00 0.25 0.00 0.00 55.06 56.36 2dki s HIS 474 Cb -0.16 -4.27 0.12 0.00 -1.18 0.00 0.00 32.58 27.08 2dki s HIS 474 CO 0.26 -2.16 1.15 0.45 -0.65 0.00 0.00 174.74 173.79 2dki n SER 475 N 11.74 0.58 -3.64 9.88 2.88 -1.26 -4.94 113.62 128.86 2dki n SER 475 Ca 0.18 0.49 -0.13 0.00 -1.33 0.00 0.00 58.87 58.09 2dki n SER 475 Cb 0.51 -1.48 -0.06 0.00 -0.75 0.00 0.00 64.21 62.42 2dki n SER 475 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dki s ALA 476 N -2.39 -1.08 0.52 -1.46 0.00 -1.26 -4.92 121.76 111.16 2dki s ALA 476 Ca 0.70 0.34 -0.21 0.00 0.00 0.00 0.00 51.96 52.79 2dki s ALA 476 Cb -0.26 0.40 -0.06 0.00 0.00 0.00 0.00 23.12 23.20 2dki s ALA 476 CO 0.55 -0.49 1.20 -1.25 0.00 0.00 0.00 175.76 175.77 2dki s PRO 477 N -2.63 3.41 0.30 0.00 0.04 -1.26 -1.16 135.00 133.69 2dki s PRO 477 Ca -0.04 1.84 -0.04 0.00 0.04 0.00 0.00 61.00 62.80 2dki s PRO 477 Cb -0.00 -2.21 -0.01 0.00 0.04 0.00 0.00 34.50 32.32 2dki s PRO 477 CO -0.03 -0.86 0.40 0.14 0.04 0.00 0.00 177.00 176.69 2dki s VAL 478 N -1.55 0.00 -0.14 -0.36 -7.23 0.11 -4.38 120.40 106.86 2dki s VAL 478 Ca 0.70 -1.65 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 2dki s VAL 478 Cb -0.30 -2.50 0.02 0.00 0.56 0.00 0.00 36.38 34.15 2dki s VAL 478 CO 0.35 0.00 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.29 2dki s VAL 479 N -3.49 1.69 0.04 1.32 1.01 0.72 -1.84 120.40 119.84 2dki s VAL 479 Ca 0.31 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 2dki s VAL 479 Cb 0.01 -1.54 -0.07 0.00 0.00 0.00 0.00 36.38 34.78 2dki s VAL 479 CO 0.17 0.48 1.45 -0.60 0.00 0.00 0.00 175.10 176.60 2dki s ARG 480 N 1.21 4.27 0.26 2.72 3.52 -0.59 -0.73 118.95 129.61 2dki s ARG 480 Ca -0.00 2.06 0.01 0.00 -0.13 0.00 0.00 55.73 57.67 2dki s ARG 480 Cb -0.14 -3.51 0.35 0.00 -1.56 0.00 0.00 34.95 30.08 2dki s ARG 480 CO -0.07 -0.58 1.68 0.28 -0.81 0.00 0.00 175.30 175.80 2dki h VAL 481 N 4.77 1.28 -0.09 7.11 2.07 -1.69 0.31 116.25 130.00 2dki h VAL 481 Ca -0.40 -1.37 -0.04 0.00 0.82 0.00 0.00 66.70 65.71 2dki h VAL 481 Cb 1.19 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 2dki h VAL 481 CO 0.90 0.43 -0.13 0.00 0.02 0.00 0.00 177.57 178.80 2dki n ASP 483 N -4.32 0.00 -2.54 0.00 3.85 -1.22 -5.03 116.55 107.29 2dki n ASP 483 Ca -0.01 -1.16 -0.20 0.00 -0.71 0.00 0.00 54.79 52.70 2dki n ASP 483 Cb 0.24 -0.03 -0.00 0.00 -1.35 0.00 0.00 41.12 39.98 2dki n ASP 483 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2dki n ALA 484 N 0.00 -0.71 -2.49 2.12 0.00 0.11 -4.97 120.51 114.56 2dki n ALA 484 Ca 0.00 0.18 -0.39 0.00 0.00 0.00 0.00 53.44 53.23 2dki n ALA 484 Cb 0.53 -2.45 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 2dki n ALA 484 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dki s LYS 485 N -5.19 4.40 0.04 0.00 2.20 -1.21 -4.76 119.74 115.22 2dki s LYS 485 Ca 0.06 0.86 -0.30 0.00 -0.36 0.00 0.00 55.97 56.23 2dki s LYS 485 Cb -0.03 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.88 2dki s LYS 485 CO 0.08 0.29 1.16 -2.14 -0.36 0.00 0.00 175.35 174.38 2dki s PRO 486 N 0.01 4.45 0.11 4.03 0.02 -1.26 -1.54 135.00 140.82 2dki s PRO 486 Ca 0.34 1.70 -0.06 0.00 0.02 0.00 0.00 61.00 63.00 2dki s PRO 486 Cb -0.19 -3.38 -0.02 0.00 0.02 0.00 0.00 34.50 30.93 2dki s PRO 486 CO 0.19 -0.23 0.17 0.14 -0.33 0.00 0.00 177.00 176.94 2dki s VAL 487 N 1.13 0.12 -0.32 3.83 -7.23 -0.77 -4.97 120.40 112.19 2dki s VAL 487 Ca 0.57 -1.45 -0.21 0.00 -1.81 0.00 0.00 61.98 59.08 2dki s VAL 487 Cb -0.27 -1.63 -0.00 0.00 0.56 0.00 0.00 36.38 35.03 2dki s VAL 487 CO 0.28 -0.57 0.66 -1.10 -0.31 0.00 0.00 175.10 174.07 2dki s GLN 488 N -3.93 3.85 0.28 4.82 -1.52 -1.26 -0.71 119.66 121.19 2dki s GLN 488 Ca 0.12 0.28 0.02 0.00 -1.95 0.00 0.00 55.36 53.84 2dki s GLN 488 Cb 0.05 -3.75 0.64 0.00 -0.22 0.00 0.00 33.01 29.73 2dki s GLN 488 CO -0.06 -0.64 1.76 1.25 -0.25 0.00 0.00 175.29 177.35 2dki h LEU 489 N 9.29 0.60 -0.35 2.90 5.85 -1.46 -0.47 115.31 131.67 2dki h LEU 489 Ca -0.26 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2dki h LEU 489 Cb 1.11 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2dki h LEU 489 CO 0.83 0.21 0.00 0.61 -0.34 0.00 0.00 178.44 179.74 2dki n GLY 490 N -1.33 -0.95 0.00 3.75 0.00 -1.26 -2.29 105.19 103.11 2dki n GLY 490 Ca 0.20 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.36 2dki n GLY 490 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dki n HIS 491 N -1.78 0.00 0.22 1.61 8.25 -0.18 -2.20 115.22 121.13 2dki n HIS 491 Ca 0.02 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.59 2dki n HIS 491 Cb 0.13 0.00 0.28 0.00 1.12 0.00 0.00 29.99 31.53 2dki n HIS 491 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dki s GLY 493 N -4.26 1.42 0.35 0.00 0.00 -0.94 -5.00 107.32 98.88 2dki s GLY 493 Ca 0.04 -2.13 0.05 0.00 0.00 0.00 0.00 44.72 42.68 2dki s GLY 493 CO 0.66 2.30 0.51 0.54 0.00 0.00 0.00 173.10 177.11 2dki s LYS 494 N 4.18 3.16 -1.37 2.90 -0.14 -1.26 -4.60 119.74 122.61 2dki s LYS 494 Ca 0.33 -0.82 -0.09 0.00 -1.36 0.00 0.00 55.97 54.03 2dki s LYS 494 Cb -0.08 -2.76 -0.09 0.00 -1.68 0.00 0.00 37.83 33.23 2dki s LYS 494 CO 0.00 0.03 2.76 0.00 -0.76 0.00 0.00 175.35 177.39 2dki n ALA 495 N -1.73 6.76 -0.35 5.17 0.00 -0.59 -4.28 120.51 125.49 2dki n ALA 495 Ca -0.01 -3.04 0.05 0.00 0.00 0.00 0.00 53.44 50.44 2dki n ALA 495 Cb 0.58 -3.23 0.12 0.00 0.00 0.00 0.00 19.45 16.92 2dki n ALA 495 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2dki n ASP 496 N 3.69 2.71 0.00 0.00 3.85 -1.26 -4.92 116.55 120.62 2dki n ASP 496 Ca 0.68 -2.29 0.00 0.00 -0.71 0.00 0.00 54.79 52.47 2dki n ASP 496 Cb 0.23 -0.23 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 2dki n ASP 496 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2dki n GLY 497 N -0.20 0.41 3.87 6.12 0.00 -1.26 -5.03 105.19 109.11 2dki n GLY 497 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 2dki n GLY 497 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dki s ARG 498 N -0.38 3.70 0.43 1.61 0.52 -1.26 -4.81 118.95 118.76 2dki s ARG 498 Ca 0.00 0.10 -0.17 0.00 -0.52 0.00 0.00 55.73 55.13 2dki s ARG 498 Cb 0.00 -3.04 -0.09 0.00 0.52 0.00 0.00 34.95 32.34 2dki s ARG 498 CO 0.00 0.60 0.90 -1.58 0.02 0.00 0.00 175.30 175.24 2dki s TRP 499 N -1.35 3.38 0.06 -0.53 0.52 -0.82 -3.69 118.94 116.51 2dki s TRP 499 Ca 0.31 1.43 0.09 0.00 0.02 0.00 0.00 56.10 57.95 2dki s TRP 499 Cb -0.14 -2.73 -0.03 0.00 -1.15 0.00 0.00 33.47 29.42 2dki s TRP 499 CO 0.17 -0.15 -0.25 1.03 0.02 0.00 0.00 176.95 177.77 2dki s ARG 500 N -3.48 1.66 -0.27 4.98 3.00 0.38 -0.21 118.95 125.01 2dki s ARG 500 Ca 0.58 -1.12 0.00 0.00 0.00 0.00 0.00 55.73 55.20 2dki s ARG 500 Cb -0.10 -1.88 0.08 0.00 0.00 0.00 0.00 34.95 33.05 2dki s ARG 500 CO 0.21 0.48 0.02 -0.51 0.00 0.00 0.00 175.30 175.50 2dki s LEU 501 N -1.36 2.64 -0.48 2.53 1.43 0.09 -0.32 118.68 123.21 2dki s LEU 501 Ca 0.11 -1.42 -0.18 0.00 -1.03 0.00 0.00 54.13 51.62 2dki s LEU 501 Cb -0.10 -1.09 0.05 0.00 0.03 0.00 0.00 46.19 45.09 2dki s LEU 501 CO 0.03 -0.32 0.54 -0.31 0.23 0.00 0.00 176.35 176.52 2dki s TYR 502 N 1.44 3.12 -0.51 0.29 2.02 -0.42 -0.78 117.35 122.51 2dki s TYR 502 Ca 0.02 -0.57 -0.17 0.00 -0.37 0.00 0.00 57.07 55.98 2dki s TYR 502 Cb -0.18 -3.32 0.08 0.00 -0.40 0.00 0.00 41.96 38.14 2dki s TYR 502 CO -0.12 -0.91 0.52 0.00 -1.57 0.00 0.00 175.55 173.47 2dki s ALA 503 N 2.32 3.51 -0.32 3.71 0.00 -0.25 -0.88 121.76 129.86 2dki s ALA 503 Ca 0.12 -2.11 -0.23 0.00 0.00 0.00 0.00 51.96 49.75 2dki s ALA 503 Cb -0.20 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2dki s ALA 503 CO 0.11 -1.94 0.77 -0.06 0.00 0.00 0.00 175.76 174.64 2dki s PHE 504 N 2.03 3.19 0.46 0.00 0.40 0.31 -0.82 117.98 123.55 2dki s PHE 504 Ca 0.08 0.73 -0.23 0.00 -0.60 0.00 0.00 56.93 56.91 2dki s PHE 504 Cb -0.24 -3.23 -0.08 0.00 0.51 0.00 0.00 43.02 39.99 2dki s PHE 504 CO 0.07 -0.59 1.13 0.00 0.70 0.00 0.00 175.22 176.54 2dki s ALA 505 N 2.94 2.96 0.74 5.36 0.00 0.34 -0.57 121.76 133.53 2dki s ALA 505 Ca 0.31 0.86 -0.11 0.00 0.00 0.00 0.00 51.96 53.03 2dki s ALA 505 Cb -0.14 -3.35 0.03 0.00 0.00 0.00 0.00 23.12 19.66 2dki s ALA 505 CO 0.13 -0.57 1.08 0.00 0.00 0.00 0.00 175.76 176.40 2dki s ALA 506 N -1.62 2.45 0.24 0.00 0.00 -1.26 -4.54 121.76 117.03 2dki s ALA 506 Ca 0.64 0.12 -0.08 0.00 0.00 0.00 0.00 51.96 52.64 2dki s ALA 506 Cb -0.26 -3.20 0.41 0.00 0.00 0.00 0.00 23.12 20.06 2dki s ALA 506 CO 0.32 -1.50 1.65 0.37 0.00 0.00 0.00 175.76 176.59 2dki h GLN 507 N -0.93 0.13 -0.51 0.00 5.75 -0.92 -2.40 115.11 116.23 2dki h GLN 507 Ca -0.44 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.05 2dki h GLN 507 Cb 1.23 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.75 2dki h GLN 507 CO 0.55 0.08 0.00 0.09 -2.65 0.00 0.00 178.83 176.90 2dki n ASN 508 N -5.30 3.18 -0.20 -0.69 3.02 -1.26 -4.57 115.26 109.44 2dki n ASN 508 Ca 0.12 -1.97 -0.01 0.00 -0.03 0.00 0.00 54.58 52.69 2dki n ASN 508 Cb 0.44 -0.33 0.09 0.00 -0.61 0.00 0.00 39.78 39.37 2dki n ASN 508 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2dki h ASP 509 N 3.71 0.32 -0.32 6.41 3.45 -1.69 0.16 116.42 128.47 2dki h ASP 509 Ca 0.00 0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.49 2dki h ASP 509 Cb 0.84 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 39.59 2dki h ASP 509 CO 0.00 0.20 0.14 0.25 -1.57 0.00 0.00 179.24 178.26 2dki h LEU 510 N 0.48 0.48 0.00 1.55 5.85 -1.80 -2.74 115.31 119.12 2dki h LEU 510 Ca 0.28 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2dki h LEU 510 Cb 0.28 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2dki h LEU 510 CO -0.24 0.45 -0.96 0.00 -0.34 0.00 0.00 178.44 177.35 2dki h ALA 511 N 1.63 0.64 -3.01 1.25 0.00 -1.70 -3.42 119.26 114.63 2dki h ALA 511 Ca 0.13 -0.36 -0.61 0.00 0.00 0.00 0.00 54.91 54.07 2dki h ALA 511 Cb 0.13 0.09 -0.40 0.00 0.00 0.00 0.00 17.79 17.60 2dki h ALA 511 CO -0.01 0.40 -0.73 -0.65 0.00 0.00 0.00 179.25 178.26 2dki s GLN 512 N -3.14 1.33 0.07 0.00 -0.21 0.50 -4.98 119.66 113.23 2dki s GLN 512 Ca 0.00 -2.04 0.16 0.00 0.02 0.00 0.00 55.36 53.50 2dki s GLN 512 Cb 0.08 -2.40 0.69 0.00 1.00 0.00 0.00 33.01 32.39 2dki s GLN 512 CO 0.78 -1.16 1.51 -2.30 -2.12 0.00 0.00 175.29 172.00 2dki n PRO 513 N 3.52 0.05 0.13 2.91 -0.02 -1.24 -3.44 135.00 136.90 2dki n PRO 513 Ca 0.08 0.30 0.18 0.00 -2.02 0.00 0.00 63.50 62.05 2dki n PRO 513 Cb 0.34 -1.59 0.76 0.00 -0.02 0.00 0.00 33.50 32.99 2dki n PRO 513 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2dki h GLU 514 N 0.00 0.00 0.00 -0.52 3.07 -1.93 -3.30 114.58 111.90 2dki h GLU 514 Ca 0.00 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 2dki h GLU 514 Cb 0.27 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 2dki h GLU 514 CO 0.00 0.00 -0.04 -1.13 -1.40 0.00 0.00 179.01 176.44 2dki n SER 515 N -4.00 -0.36 0.00 1.42 3.41 -1.22 -4.82 113.62 108.04 2dki n SER 515 Ca 0.04 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.14 2dki n SER 515 Cb 0.44 0.68 0.00 0.00 -0.26 0.00 0.00 64.21 65.06 2dki n SER 515 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dki n GLY 516 N -0.16 -0.38 0.19 5.00 0.00 -1.26 -3.80 105.19 104.77 2dki n GLY 516 Ca 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 46.02 44.85 2dki n GLY 516 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dki h LEU 517 N 0.00 0.47 -1.08 0.99 6.46 -1.92 -1.81 115.31 118.42 2dki h LEU 517 Ca 0.00 -0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.69 2dki h LEU 517 Cb 0.00 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 39.80 2dki h LEU 517 CO 0.00 0.34 -0.02 -0.07 -0.62 0.00 0.00 178.44 178.07 2dki h LEU 518 N 0.56 0.59 -0.52 2.25 3.38 -1.85 -1.75 115.31 117.97 2dki h LEU 518 Ca 0.16 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2dki h LEU 518 Cb -0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2dki h LEU 518 CO -0.05 0.68 -0.11 0.00 0.09 0.00 0.00 178.44 179.04 2dki h ALA 519 N 1.39 0.72 -0.52 1.53 0.00 -1.57 -1.17 119.26 119.64 2dki h ALA 519 Ca 0.12 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.72 2dki h ALA 519 Cb 0.41 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2dki h ALA 519 CO 0.02 0.64 0.26 1.25 0.00 0.00 0.00 179.25 181.42 2dki h LEU 520 N 0.87 0.37 -0.52 0.00 5.85 -0.79 -0.37 115.31 120.72 2dki h LEU 520 Ca 0.13 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.92 2dki h LEU 520 Cb 0.68 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 2dki h LEU 520 CO 0.05 0.25 0.30 0.00 -0.34 0.00 0.00 178.44 178.71 2dki h ARG 522 N 0.60 0.97 -0.01 0.00 2.43 -0.44 -1.61 114.38 116.32 2dki h ARG 522 Ca 0.22 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2dki h ARG 522 Cb 0.05 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2dki h ARG 522 CO -0.11 0.64 -0.00 0.35 -1.51 0.00 0.00 179.97 179.34 2dki h PHE 523 N 1.00 0.02 -0.41 2.20 3.04 -0.31 -1.22 116.94 121.26 2dki h PHE 523 Ca 0.33 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.35 2dki h PHE 523 Cb 0.05 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 2dki h PHE 523 CO -0.03 0.41 0.28 -0.07 -2.02 0.00 0.00 178.31 176.88 2dki h LEU 524 N -0.38 0.22 0.06 0.59 3.38 -0.08 -1.69 115.31 117.41 2dki h LEU 524 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 2dki h LEU 524 Cb 0.41 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2dki h LEU 524 CO 0.00 0.14 -2.13 -1.84 0.09 0.00 0.00 178.44 174.70 2dki n GLU 525 N -4.47 0.70 -0.01 1.13 0.28 -0.64 -4.14 120.64 113.48 2dki n GLU 525 Ca 0.06 0.21 0.06 0.00 -0.16 0.00 0.00 57.16 57.32 2dki n GLU 525 Cb 0.31 -1.65 -0.14 0.00 1.43 0.00 0.00 31.44 31.38 2dki n GLU 525 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dki n GLY 526 N 1.98 -1.07 3.64 -1.84 0.00 -0.46 -4.89 105.19 102.55 2dki n GLY 526 Ca -0.34 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 2dki n GLY 526 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dki s ASP 527 N -4.92 6.87 0.63 1.61 -1.08 -0.64 -4.90 116.67 114.24 2dki s ASP 527 Ca -0.07 1.06 0.37 0.00 -0.52 0.00 0.00 52.55 53.38 2dki s ASP 527 Cb 0.11 -2.46 2.07 0.00 -1.46 0.00 0.00 42.92 41.18 2dki s ASP 527 CO 0.87 -0.58 2.26 0.00 0.52 0.00 0.00 175.17 178.24 2dki h ALA 528 N 7.72 1.31 -0.01 3.66 0.00 -1.90 0.33 119.26 130.37 2dki h ALA 528 Ca -0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2dki h ALA 528 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2dki h ALA 528 CO 0.91 -0.08 -0.05 0.00 0.00 0.00 0.00 179.25 180.02 2dki n ALA 529 N -2.17 2.69 -1.77 0.00 0.00 -1.26 -4.16 120.51 113.84 2dki n ALA 529 Ca -0.02 -0.36 -0.38 0.00 0.00 0.00 0.00 53.44 52.68 2dki n ALA 529 Cb 0.14 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 2dki n ALA 529 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2dki s SER 530 N -2.14 6.31 0.42 0.00 1.04 0.11 -4.85 113.70 114.59 2dki s SER 530 Ca 0.37 2.37 0.10 0.00 0.48 0.00 0.00 55.95 59.26 2dki s SER 530 Cb 0.21 -2.61 0.93 0.00 0.10 0.00 0.00 66.02 64.64 2dki s SER 530 CO 0.39 -0.82 2.03 1.55 0.98 0.00 0.00 173.24 177.37 2dki h PRO 531 N 2.35 0.48 -0.73 4.02 0.13 -1.89 -0.15 132.00 136.20 2dki h PRO 531 Ca -0.49 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 2dki h PRO 531 Cb 1.24 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 2dki h PRO 531 CO 0.61 0.32 0.35 1.25 -0.23 0.00 0.00 178.00 180.30 2dki h LEU 532 N 0.49 0.96 0.17 1.56 5.85 -1.91 -0.15 115.31 122.28 2dki h LEU 532 Ca 0.19 -0.14 -0.28 0.00 0.84 0.00 0.00 57.88 58.50 2dki h LEU 532 Cb 0.15 -0.25 0.03 0.00 0.37 0.00 0.00 40.66 40.96 2dki h LEU 532 CO -0.05 0.83 -1.19 0.03 -0.34 0.00 0.00 178.44 177.72 2dki h ARG 533 N 1.03 0.50 -0.66 1.25 2.47 -1.58 -2.96 114.38 114.44 2dki h ARG 533 Ca 0.25 -0.77 -0.04 0.00 -1.26 0.00 0.00 59.98 58.16 2dki h ARG 533 Cb 0.13 0.27 -0.03 0.00 -1.65 0.00 0.00 29.97 28.69 2dki h ARG 533 CO -0.03 1.36 0.25 0.00 0.56 0.00 0.00 179.97 182.10 2dki h ARG 534 N 0.04 0.99 -0.02 0.04 2.47 -0.96 -3.34 114.38 113.60 2dki h ARG 534 Ca -0.20 -0.19 0.00 0.00 -1.26 0.00 0.00 59.98 58.33 2dki h ARG 534 Cb 1.91 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 30.08 2dki h ARG 534 CO 0.23 0.84 -0.14 1.19 0.56 0.00 0.00 179.97 182.64 2dki n PHE 535 N -4.40 0.00 -2.94 3.04 3.01 -0.08 -4.51 117.46 111.59 2dki n PHE 535 Ca 0.05 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.09 2dki n PHE 535 Cb 0.18 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.60 2dki n PHE 535 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2dki s THR 536 N -1.54 4.86 0.20 4.37 2.01 -1.12 -4.99 115.64 119.42 2dki s THR 536 Ca 0.16 1.41 -0.32 0.00 0.31 0.00 0.00 61.69 63.25 2dki s THR 536 Cb 0.13 -4.09 -0.14 0.00 0.01 0.00 0.00 72.50 68.41 2dki s THR 536 CO 0.28 -0.09 1.33 -2.65 -0.69 0.00 0.00 174.62 172.81 2dki n PRO 537 N 5.99 1.69 -1.62 4.92 -0.02 -1.26 -4.86 135.00 139.84 2dki n PRO 537 Ca 0.04 0.60 -0.45 0.00 -2.02 0.00 0.00 63.50 61.67 2dki n PRO 537 Cb 0.48 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.73 2dki n PRO 537 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dki n ALA 538 N 1.95 0.18 -0.60 3.55 0.00 -1.26 -1.71 120.51 122.62 2dki n ALA 538 Ca 0.14 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2dki n ALA 538 Cb 0.28 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.63 2dki n ALA 538 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dki n GLY 539 N 1.39 1.51 3.97 0.00 0.00 -1.26 -5.04 105.19 105.77 2dki n GLY 539 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 2dki n GLY 539 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dki s GLN 540 N -0.10 3.14 0.40 1.61 -0.21 -0.69 -5.05 119.66 118.76 2dki s GLN 540 Ca 0.00 -0.72 -0.27 0.00 0.02 0.00 0.00 55.36 54.39 2dki s GLN 540 Cb 0.00 -2.70 -0.10 0.00 1.00 0.00 0.00 33.01 31.21 2dki s GLN 540 CO 0.00 -0.05 1.44 -0.25 -2.12 0.00 0.00 175.29 174.31 2dki n ASP 541 N -1.82 3.46 0.26 5.90 8.00 -1.26 -4.84 116.55 126.25 2dki n ASP 541 Ca -0.00 1.18 0.14 0.00 0.71 0.00 0.00 54.79 56.81 2dki n ASP 541 Cb 0.58 -1.60 0.72 0.00 -0.02 0.00 0.00 41.12 40.80 2dki n ASP 541 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2dki h ILE 542 N 2.62 0.00 -0.18 0.53 2.10 -1.97 0.42 117.51 121.03 2dki h ILE 542 Ca -0.50 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 65.41 2dki h ILE 542 Cb 1.26 0.59 -0.02 0.00 -1.09 0.00 0.00 36.82 37.56 2dki h ILE 542 CO 0.62 0.00 -0.04 -0.90 -1.08 0.00 0.00 178.15 176.75 2dki n ASP 543 N -2.58 3.05 0.09 2.19 5.75 -1.26 -4.68 116.55 119.11 2dki n ASP 543 Ca -0.02 -3.21 0.13 0.00 -0.01 0.00 0.00 54.79 51.68 2dki n ASP 543 Cb 0.25 -0.52 0.45 0.00 -1.03 0.00 0.00 41.12 40.26 2dki n ASP 543 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2dki n SER 544 N -0.94 0.65 0.00 -1.12 3.41 0.14 -4.10 113.62 111.65 2dki n SER 544 Ca 0.21 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 2dki n SER 544 Cb 0.82 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2dki n SER 544 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2dki n ILE 545 N -2.13 0.00 -3.99 -1.33 2.08 -1.26 -4.85 119.36 107.87 2dki n ILE 545 Ca 0.05 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 63.02 2dki n ILE 545 Cb 0.36 -0.59 -0.15 0.00 -0.75 0.00 0.00 39.64 38.51 2dki n ILE 545 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2dki s PHE 546 N -1.93 3.08 -0.58 1.39 0.08 -1.26 -1.94 117.98 116.82 2dki s PHE 546 Ca 0.00 -1.72 -0.18 0.00 0.12 0.00 0.00 56.93 55.15 2dki s PHE 546 Cb 0.00 -2.02 0.11 0.00 -0.57 0.00 0.00 43.02 40.54 2dki s PHE 546 CO 0.00 -0.77 0.65 0.34 -0.10 0.00 0.00 175.22 175.34 2dki s ASP 547 N 1.28 6.19 -0.08 1.36 3.68 0.70 -4.41 116.67 125.39 2dki s ASP 547 Ca -0.01 -1.56 -0.20 0.00 2.13 0.00 0.00 52.55 52.91 2dki s ASP 547 Cb -0.17 -2.27 -0.04 0.00 -1.45 0.00 0.00 42.92 38.98 2dki s ASP 547 CO -0.05 -1.04 0.55 -0.22 0.13 0.00 0.00 175.17 174.55 2dki s LEU 548 N 2.34 4.32 -0.07 -1.34 2.96 -1.26 -0.74 118.68 124.89 2dki s LEU 548 Ca 0.09 0.98 0.01 0.00 -0.22 0.00 0.00 54.13 54.99 2dki s LEU 548 Cb -0.26 -2.83 0.02 0.00 0.50 0.00 0.00 46.19 43.62 2dki s LEU 548 CO 0.05 0.00 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.87 2dki s ARG 549 N 0.45 1.39 -0.12 1.98 1.81 0.04 -4.82 118.95 119.67 2dki s ARG 549 Ca 0.30 -0.27 -0.05 0.00 -1.72 0.00 0.00 55.73 53.99 2dki s ARG 549 Cb -0.16 -1.30 -0.04 0.00 -0.45 0.00 0.00 34.95 33.00 2dki s ARG 549 CO 0.14 -0.10 0.08 0.00 -0.68 0.00 0.00 175.30 174.73 2dki s ALA 550 N 1.09 3.58 -0.17 2.13 0.00 0.97 -1.09 121.76 128.27 2dki s ALA 550 Ca -0.07 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.17 2dki s ALA 550 Cb -0.14 -1.79 0.03 0.00 0.00 0.00 0.00 23.12 21.22 2dki s ALA 550 CO -0.01 0.51 -0.10 0.08 0.00 0.00 0.00 175.76 176.24 2dki s VAL 551 N -0.68 1.44 -0.01 0.00 1.01 0.00 -0.09 120.40 122.08 2dki s VAL 551 Ca 0.12 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 2dki s VAL 551 Cb -0.12 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2dki s VAL 551 CO 0.02 0.27 0.15 -0.36 0.00 0.00 0.00 175.10 175.18 2dki s PHE 552 N 1.51 3.47 -0.33 5.22 0.08 0.17 -0.51 117.98 127.58 2dki s PHE 552 Ca 0.02 0.31 0.27 0.00 0.12 0.00 0.00 56.93 57.65 2dki s PHE 552 Cb -0.15 -1.80 0.92 0.00 -0.57 0.00 0.00 43.02 41.43 2dki s PHE 552 CO -0.09 0.62 1.79 -1.00 -0.10 0.00 0.00 175.22 176.44 2dki h PRO 553 N 3.88 0.00 -7.08 0.24 0.13 -1.88 -3.29 132.00 124.00 2dki h PRO 553 Ca -0.49 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.13 2dki h PRO 553 Cb 1.19 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.40 2dki h PRO 553 CO 0.67 0.00 0.45 -0.65 -0.23 0.00 0.00 178.00 178.24 2dki s GLN 554 N -3.36 3.25 0.43 0.86 1.11 -1.26 -4.58 119.66 116.10 2dki s GLN 554 Ca 0.05 1.71 -0.25 0.00 0.01 0.00 0.00 55.36 56.88 2dki s GLN 554 Cb 0.09 -2.01 -0.09 0.00 -1.01 0.00 0.00 33.01 29.98 2dki s GLN 554 CO 0.55 -0.95 1.31 0.00 0.01 0.00 0.00 175.29 176.20 2dki n ALA 555 N -1.33 1.48 -0.31 6.09 0.00 -1.26 -4.29 120.51 120.89 2dki n ALA 555 Ca 0.12 0.26 0.19 0.00 0.00 0.00 0.00 53.44 54.01 2dki n ALA 555 Cb 0.50 -2.30 0.46 0.00 0.00 0.00 0.00 19.45 18.12 2dki n ALA 555 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2dki h TYR 556 N 2.15 0.72 0.00 0.00 -0.00 -1.91 0.89 116.97 118.83 2dki h TYR 556 Ca -0.49 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.27 2dki h TYR 556 Cb 1.29 -0.22 0.00 0.00 -0.00 0.00 0.00 36.73 37.80 2dki h TYR 556 CO 0.48 0.13 0.00 0.25 -0.00 0.00 0.00 178.16 179.02 2dki n THR 557 N -4.62 1.36 0.75 -0.90 -2.24 -1.26 -1.62 114.28 105.75 2dki n THR 557 Ca 0.23 0.34 0.11 0.00 -2.27 0.00 0.00 64.05 62.46 2dki n THR 557 Cb 0.75 -1.22 0.12 0.00 -2.10 0.00 0.00 70.33 67.87 2dki n THR 557 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dki n GLU 558 N -1.45 2.12 -3.55 -0.78 1.02 0.31 -4.85 120.64 113.47 2dki n GLU 558 Ca 0.02 -1.90 -0.41 0.00 -0.02 0.00 0.00 57.16 54.85 2dki n GLU 558 Cb 0.07 -1.43 -0.10 0.00 -0.02 0.00 0.00 31.44 29.96 2dki n GLU 558 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2dki s VAL 559 N -1.71 4.68 -0.66 2.62 1.01 -0.64 -4.97 120.40 120.73 2dki s VAL 559 Ca 0.28 -1.01 -0.25 0.00 0.00 0.00 0.00 61.98 61.01 2dki s VAL 559 Cb 0.19 -3.71 0.05 0.00 0.00 0.00 0.00 36.38 32.91 2dki s VAL 559 CO 0.28 -0.37 1.07 0.00 0.00 0.00 0.00 175.10 176.08 2dki s ALA 560 N 1.55 3.00 0.22 5.51 0.00 -1.26 -4.92 121.76 125.86 2dki s ALA 560 Ca 0.03 -1.54 -0.08 0.00 0.00 0.00 0.00 51.96 50.37 2dki s ALA 560 Cb -0.21 -3.97 0.33 0.00 0.00 0.00 0.00 23.12 19.26 2dki s ALA 560 CO 0.06 -2.87 1.73 -0.07 0.00 0.00 0.00 175.76 174.61 2dki h LEU 561 N 11.85 0.17 -2.30 0.00 3.38 -1.96 -1.51 115.31 124.94 2dki h LEU 561 Ca -0.28 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2dki h LEU 561 Cb 1.06 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dki h LEU 561 CO 1.20 0.09 0.15 1.05 0.09 0.00 0.00 178.44 181.02 2dki h GLU 562 N 0.37 0.00 -0.59 1.13 9.09 -2.01 -0.42 114.58 122.15 2dki h GLU 562 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.75 2dki h GLU 562 Cb 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 2dki h GLU 562 CO -0.36 0.00 0.00 0.25 0.05 0.00 0.00 179.01 178.95 2dki n THR 563 N -2.85 2.24 -4.05 -1.06 -2.24 -0.57 -4.98 114.28 100.77 2dki n THR 563 Ca -0.02 -1.33 -0.26 0.00 -2.27 0.00 0.00 64.05 60.17 2dki n THR 563 Cb 0.21 -0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.34 2dki n THR 563 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dki s LEU 564 N -2.27 3.96 0.64 3.22 1.43 -0.17 -5.05 118.68 120.43 2dki s LEU 564 Ca 0.52 -0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.39 2dki s LEU 564 Cb 0.36 -2.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 2dki s LEU 564 CO 0.20 0.06 1.16 -2.65 0.23 0.00 0.00 176.35 175.35 2dki n PRO 565 N -0.46 1.00 0.29 1.29 -0.02 -1.26 -4.86 135.00 130.98 2dki n PRO 565 Ca -0.08 0.39 0.14 0.00 -2.02 0.00 0.00 63.50 61.93 2dki n PRO 565 Cb 0.55 -2.39 0.86 0.00 -0.02 0.00 0.00 33.50 32.50 2dki n PRO 565 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dki h ALA 566 N 0.46 1.54 0.00 3.55 0.00 -1.97 -0.59 119.26 122.25 2dki h ALA 566 Ca -0.50 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2dki h ALA 566 Cb 1.35 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2dki h ALA 566 CO 0.52 0.03 -0.01 1.25 0.00 0.00 0.00 179.25 181.04 2dki h LEU 567 N 0.00 0.00 -0.03 0.00 5.85 -1.93 0.11 115.31 119.31 2dki h LEU 567 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2dki h LEU 567 Cb 0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2dki h LEU 567 CO 0.00 0.01 -0.42 0.18 -0.34 0.00 0.00 178.44 177.87 2dki n LEU 568 N -4.30 0.48 -2.88 2.25 4.77 -0.23 -4.00 117.00 113.08 2dki n LEU 568 Ca -0.03 0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2dki n LEU 568 Cb 0.09 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2dki n LEU 568 CO 0.32 0.11 -0.14 0.18 -1.33 0.00 0.00 177.39 176.54 2dki n LEU 569 N -1.44 1.49 -4.71 2.23 4.32 -0.36 -4.39 117.00 114.14 2dki n LEU 569 Ca 0.06 -4.42 -0.42 0.00 -0.02 0.00 0.00 56.01 51.21 2dki n LEU 569 Cb 0.34 0.46 -0.03 0.00 -1.62 0.00 0.00 43.42 42.57 2dki n LEU 569 CO 0.33 1.94 1.38 -2.16 -1.22 0.00 0.00 177.39 177.66 2dki s PRO 570 N -2.87 4.15 0.64 3.23 0.04 -0.12 -4.61 135.00 135.46 2dki s PRO 570 Ca 0.34 2.54 -0.12 0.00 0.04 0.00 0.00 61.00 63.81 2dki s PRO 570 Cb 0.40 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 2dki s PRO 570 CO -0.03 -0.76 1.04 -1.25 0.04 0.00 0.00 177.00 176.04 2dki s PRO 571 N 1.77 3.36 0.20 0.56 0.04 -1.26 -1.41 135.00 138.26 2dki s PRO 571 Ca 0.76 0.87 -0.23 0.00 0.04 0.00 0.00 61.00 62.43 2dki s PRO 571 Cb -0.47 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.07 2dki s PRO 571 CO 0.33 -0.76 0.81 -1.59 0.04 0.00 0.00 177.00 175.83 2dki s LYS 572 N -4.99 1.46 0.24 4.56 -2.85 0.19 -4.67 119.74 113.68 2dki s LYS 572 Ca 0.57 -0.77 0.00 0.00 -1.00 0.00 0.00 55.97 54.76 2dki s LYS 572 Cb -0.12 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.17 2dki s LYS 572 CO 0.52 -0.66 0.00 0.41 0.10 0.00 0.00 175.35 175.71 2dki n GLY 573 N -0.44 -1.90 0.34 0.59 0.00 -1.26 -2.19 105.19 100.32 2dki n GLY 573 Ca -0.06 -1.28 0.17 0.00 0.00 0.00 0.00 46.02 44.85 2dki n GLY 573 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2dki h GLN 574 N -0.86 0.00 -0.13 1.61 4.20 -1.95 -2.42 115.11 115.56 2dki h GLN 574 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2dki h GLN 574 Cb 0.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.63 2dki h GLN 574 CO 0.01 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.45 2dki n LEU 575 N -3.98 2.90 -1.29 1.46 4.77 -1.26 -4.96 117.00 114.63 2dki n LEU 575 Ca 0.03 -1.17 -0.15 0.00 -0.03 0.00 0.00 56.01 54.69 2dki n LEU 575 Cb 0.39 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 2dki n LEU 575 CO 0.30 0.55 -0.16 0.61 -1.33 0.00 0.00 177.39 177.36 2dki n GLY 576 N 1.21 1.11 3.72 -0.72 0.00 -0.91 -4.95 105.19 104.65 2dki n GLY 576 Ca 0.14 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2dki n GLY 576 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dki n MET 577 N -2.54 1.54 -3.15 1.61 2.81 -0.93 -4.11 117.12 112.35 2dki n MET 577 Ca -0.16 0.57 -0.39 0.00 -1.81 0.00 0.00 57.70 55.91 2dki n MET 577 Cb 0.53 -2.49 -0.05 0.00 -0.71 0.00 0.00 33.22 30.50 2dki n MET 577 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2dki s ILE 578 N -1.32 4.95 -0.32 2.02 -1.09 -1.26 -0.64 121.20 123.54 2dki s ILE 578 Ca 0.72 1.32 -0.22 0.00 -2.23 0.00 0.00 60.65 60.24 2dki s ILE 578 Cb -0.42 -3.97 -0.00 0.00 -1.58 0.00 0.00 42.46 36.48 2dki s ILE 578 CO 0.49 0.36 0.71 -0.62 -1.23 0.00 0.00 174.94 174.64 2dki s ASP 579 N 0.18 6.55 -0.13 3.58 -1.08 -0.50 -4.93 116.67 120.35 2dki s ASP 579 Ca 0.33 0.46 0.18 0.00 -0.52 0.00 0.00 52.55 53.00 2dki s ASP 579 Cb -0.18 -2.37 0.72 0.00 -1.46 0.00 0.00 42.92 39.63 2dki s ASP 579 CO 0.17 -0.58 1.63 -1.22 0.52 0.00 0.00 175.17 175.70 2dki n TYR 580 N 6.10 1.52 -1.61 -5.34 4.01 -1.26 -4.04 117.16 116.54 2dki n TYR 580 Ca 0.01 -0.63 -0.20 0.00 -0.16 0.00 0.00 57.90 56.92 2dki n TYR 580 Cb 0.48 -0.27 0.11 0.00 -0.31 0.00 0.00 39.34 39.35 2dki n TYR 580 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2dki n GLU 581 N 1.00 2.69 0.00 -0.72 1.02 -1.26 -4.39 120.64 118.97 2dki n GLU 581 Ca 0.26 -3.55 0.07 0.00 -0.02 0.00 0.00 57.16 53.91 2dki n GLU 581 Cb 0.92 -2.11 -0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2dki n GLU 581 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2dki n LYS 582 N -0.93 1.83 -4.94 3.49 4.76 -1.26 -4.97 118.16 116.14 2dki n LYS 582 Ca 0.46 -0.73 -0.31 0.00 -2.87 0.00 0.00 58.31 54.86 2dki n LYS 582 Cb 0.95 -1.19 -0.17 0.00 -1.84 0.00 0.00 35.03 32.78 2dki n LYS 582 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2dki s VAL 583 N -1.65 1.86 0.18 -0.18 1.01 -1.26 -0.02 120.40 120.33 2dki s VAL 583 Ca 0.11 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2dki s VAL 583 Cb 0.11 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2dki s VAL 583 CO 0.34 0.52 -0.02 -0.36 0.00 0.00 0.00 175.10 175.57 2dki s PHE 584 N 0.55 1.28 0.37 5.22 0.40 0.88 -1.78 117.98 124.90 2dki s PHE 584 Ca -0.15 -0.94 0.04 0.00 -0.60 0.00 0.00 56.93 55.28 2dki s PHE 584 Cb -0.17 -0.72 -0.03 0.00 0.51 0.00 0.00 43.02 42.61 2dki s PHE 584 CO 0.05 -0.11 0.13 -1.12 0.70 0.00 0.00 175.22 174.87 2dki s SER 585 N -3.19 2.41 0.67 1.36 0.01 0.09 -0.66 113.70 114.39 2dki s SER 585 Ca 0.23 -1.61 -0.05 0.00 1.31 0.00 0.00 55.95 55.83 2dki s SER 585 Cb 0.05 0.39 0.05 0.00 0.21 0.00 0.00 66.02 66.73 2dki s SER 585 CO 0.04 -0.88 0.96 -2.84 0.41 0.00 0.00 173.24 170.93 2dki s PRO 586 N -3.75 2.29 -0.58 12.44 0.02 -1.24 -0.20 135.00 143.97 2dki s PRO 586 Ca 0.29 -0.38 -0.25 0.00 0.02 0.00 0.00 61.00 60.69 2dki s PRO 586 Cb 0.04 -2.25 0.04 0.00 0.02 0.00 0.00 34.50 32.36 2dki s PRO 586 CO 0.16 -1.11 0.99 0.34 -0.33 0.00 0.00 177.00 177.05 2dki s ASP 587 N -4.49 6.32 0.00 2.53 -1.08 -1.25 -4.31 116.67 114.38 2dki s ASP 587 Ca 0.59 -0.39 0.18 0.00 -0.52 0.00 0.00 52.55 52.41 2dki s ASP 587 Cb -0.11 -2.45 0.23 0.00 -1.46 0.00 0.00 42.92 39.13 2dki s ASP 587 CO 0.43 -1.32 1.15 0.18 0.52 0.00 0.00 175.17 176.14 2dki n LEU 588 N 7.71 2.73 -0.07 -1.34 4.77 -1.26 -3.42 117.00 126.13 2dki n LEU 588 Ca 0.02 -1.24 -0.16 0.00 -0.03 0.00 0.00 56.01 54.60 2dki n LEU 588 Cb 0.47 -0.09 -0.13 0.00 -2.33 0.00 0.00 43.42 41.35 2dki n LEU 588 CO 0.65 0.54 0.15 0.50 -1.33 0.00 0.00 177.39 177.90 2dki h LYS 589 N 3.47 0.02 -5.61 3.23 3.64 -1.98 -3.45 116.57 115.89 2dki h LYS 589 Ca 0.00 -0.04 -0.59 0.00 -1.27 0.00 0.00 60.65 58.75 2dki h LYS 589 Cb 0.78 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.52 2dki h LYS 589 CO 0.00 1.02 -0.09 -0.80 -2.27 0.00 0.00 179.45 177.31 2dki s ASN 590 N -6.42 6.60 0.25 4.20 0.01 -1.26 -5.03 114.94 113.29 2dki s ASN 590 Ca -0.21 0.72 -0.30 0.00 -0.71 0.00 0.00 52.86 52.36 2dki s ASN 590 Cb -0.01 -2.28 -0.14 0.00 0.41 0.00 0.00 41.25 39.23 2dki s ASN 590 CO 0.68 -0.10 1.17 0.00 -1.51 0.00 0.00 177.10 177.35 2dki n ALA 591 N 4.30 0.09 -2.35 0.60 0.00 -1.26 -2.47 120.51 119.42 2dki n ALA 591 Ca -0.06 0.41 -0.18 0.00 0.00 0.00 0.00 53.44 53.61 2dki n ALA 591 Cb 0.51 -2.11 -0.01 0.00 0.00 0.00 0.00 19.45 17.84 2dki n ALA 591 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dki n GLY 592 N 1.61 -0.38 0.14 0.00 0.00 -1.26 -4.89 105.19 100.40 2dki n GLY 592 Ca 0.11 -0.12 0.03 0.00 0.00 0.00 0.00 46.02 46.04 2dki n GLY 592 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dki n GLN 593 N -2.75 2.73 -2.47 1.61 1.13 -1.03 -4.92 117.38 111.67 2dki n GLN 593 Ca -0.22 -1.78 -0.43 0.00 -1.94 0.00 0.00 57.00 52.63 2dki n GLN 593 Cb 0.66 -1.14 -0.02 0.00 0.11 0.00 0.00 30.24 29.85 2dki n GLN 593 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2dki s ASP 594 N -1.30 6.68 0.48 1.08 3.68 -1.22 -3.92 116.67 122.15 2dki s ASP 594 Ca 0.10 1.07 0.21 0.00 2.13 0.00 0.00 52.55 56.05 2dki s ASP 594 Cb 0.07 -2.54 1.23 0.00 -1.45 0.00 0.00 42.92 40.23 2dki s ASP 594 CO 0.03 -1.10 1.97 -0.29 0.13 0.00 0.00 175.17 175.91 2dki h ILE 595 N 5.99 0.77 -0.16 4.11 2.10 -1.88 0.11 117.51 128.56 2dki h ILE 595 Ca -0.25 -0.07 -0.04 0.00 1.08 0.00 0.00 64.86 65.59 2dki h ILE 595 Cb 1.09 0.57 -0.01 0.00 -1.09 0.00 0.00 36.82 37.37 2dki h ILE 595 CO 1.05 0.04 -0.07 -0.26 -1.08 0.00 0.00 178.15 177.83 2dki h PHE 596 N 0.19 0.25 0.05 2.19 -1.00 -1.94 -0.40 116.94 116.28 2dki h PHE 596 Ca 0.30 -0.02 -0.15 0.00 2.81 0.00 0.00 57.97 60.90 2dki h PHE 596 Cb 0.90 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.38 2dki h PHE 596 CO -0.00 0.32 -0.78 1.49 -1.61 0.00 0.00 178.31 177.72 2dki h GLU 597 N 0.24 0.11 -0.32 1.51 4.57 -1.22 -1.72 114.58 117.75 2dki h GLU 597 Ca 0.05 -0.19 0.04 0.00 -1.18 0.00 0.00 59.36 58.08 2dki h GLU 597 Cb 0.27 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2dki h GLU 597 CO 0.01 1.09 0.22 -0.07 -1.18 0.00 0.00 179.01 179.08 2dki h LEU 598 N -0.72 0.24 -3.02 1.64 3.38 -0.85 -2.92 115.31 113.07 2dki h LEU 598 Ca -0.18 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2dki h LEU 598 Cb 1.37 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2dki h LEU 598 CO -0.01 0.16 0.00 0.54 0.09 0.00 0.00 178.44 179.23 2dki n ARG 599 N -4.49 2.82 -3.67 1.13 5.12 -0.17 -4.84 116.66 112.56 2dki n ARG 599 Ca 0.03 -2.25 -0.23 0.00 -1.93 0.00 0.00 57.85 53.47 2dki n ARG 599 Cb 0.19 -1.42 0.05 0.00 -1.16 0.00 0.00 32.46 30.11 2dki n ARG 599 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dki n GLY 600 N -0.02 -0.39 3.75 -0.13 0.00 -1.10 0.13 105.19 107.43 2dki n GLY 600 Ca 0.13 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 2dki n GLY 600 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dki s ILE 601 N -3.47 3.80 -0.42 -0.61 -1.09 -0.66 -1.87 121.20 116.89 2dki s ILE 601 Ca 0.23 1.82 -0.29 0.00 -2.23 0.00 0.00 60.65 60.18 2dki s ILE 601 Cb -0.11 -4.16 0.01 0.00 -1.58 0.00 0.00 42.46 36.62 2dki s ILE 601 CO 0.79 0.43 1.40 -0.62 -1.23 0.00 0.00 174.94 175.71 2dki s ASP 602 N -1.04 6.34 0.26 3.58 -1.08 0.59 -4.88 116.67 120.45 2dki s ASP 602 Ca 0.43 0.81 -0.05 0.00 -0.52 0.00 0.00 52.55 53.22 2dki s ASP 602 Cb -0.29 -2.54 0.30 0.00 -1.46 0.00 0.00 42.92 38.93 2dki s ASP 602 CO 0.36 -1.43 1.94 0.03 0.52 0.00 0.00 175.17 176.59 2dki h ARG 603 N 10.66 1.28 -0.11 4.34 3.08 -1.92 0.16 114.38 131.87 2dki h ARG 603 Ca -0.27 -0.08 -0.16 0.00 0.07 0.00 0.00 59.98 59.53 2dki h ARG 603 Cb 1.10 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 2dki h ARG 603 CO 1.09 0.85 -0.63 0.37 -1.07 0.00 0.00 179.97 180.57 2dki h GLN 604 N 1.32 0.40 0.00 0.04 4.15 -1.93 0.14 115.11 119.23 2dki h GLN 604 Ca 0.36 -0.29 -0.36 0.00 0.77 0.00 0.00 58.65 59.13 2dki h GLN 604 Cb -0.15 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.52 2dki h GLN 604 CO -0.08 0.90 -2.26 1.04 -1.93 0.00 0.00 178.83 176.51 2dki n GLN 605 N -3.89 0.68 -0.04 1.69 1.13 -1.16 -4.42 117.38 111.38 2dki n GLN 605 Ca -0.03 0.06 0.01 0.00 -1.94 0.00 0.00 57.00 55.09 2dki n GLN 605 Cb 0.65 -1.58 -0.00 0.00 0.11 0.00 0.00 30.24 29.42 2dki n GLN 605 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2dki n GLY 606 N 1.74 -2.18 3.61 1.08 0.00 0.55 -4.46 105.19 105.53 2dki n GLY 606 Ca -0.30 -1.48 -0.11 0.00 0.00 0.00 0.00 46.02 44.13 2dki n GLY 606 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dki s ALA 607 N -1.05 -1.92 -0.32 4.61 0.00 0.27 -4.60 121.76 118.75 2dki s ALA 607 Ca 0.00 1.79 -0.08 0.00 0.00 0.00 0.00 51.96 53.66 2dki s ALA 607 Cb 0.00 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 22.00 2dki s ALA 607 CO 0.00 -0.28 0.13 -1.17 0.00 0.00 0.00 175.76 174.44 2dki s LEU 608 N -0.16 4.15 -0.41 0.00 2.96 0.32 -0.53 118.68 125.01 2dki s LEU 608 Ca 0.01 -0.75 -0.09 0.00 -0.22 0.00 0.00 54.13 53.08 2dki s LEU 608 Cb -0.04 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.78 2dki s LEU 608 CO -0.02 -0.24 0.24 -0.69 -1.32 0.00 0.00 176.35 174.31 2dki s VAL 609 N 1.54 4.14 -0.21 1.68 1.01 -0.06 -0.14 120.40 128.36 2dki s VAL 609 Ca 0.03 -1.38 -0.23 0.00 0.00 0.00 0.00 61.98 60.39 2dki s VAL 609 Cb -0.18 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 2dki s VAL 609 CO 0.05 -0.47 0.76 -0.69 0.00 0.00 0.00 175.10 174.75 2dki s VAL 610 N 1.41 4.91 -0.06 2.92 1.01 -0.01 -1.30 120.40 129.29 2dki s VAL 610 Ca 0.03 1.45 0.06 0.00 0.00 0.00 0.00 61.98 63.51 2dki s VAL 610 Cb -0.22 -4.06 -0.01 0.00 0.00 0.00 0.00 36.38 32.08 2dki s VAL 610 CO 0.02 0.02 -0.23 -0.69 0.00 0.00 0.00 175.10 174.22 2dki s VAL 611 N 2.32 2.21 0.87 2.92 1.01 0.56 -0.49 120.40 129.80 2dki s VAL 611 Ca 0.34 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 2dki s VAL 611 Cb -0.16 -1.81 0.11 0.00 0.00 0.00 0.00 36.38 34.52 2dki s VAL 611 CO 0.10 0.57 1.09 -0.13 0.00 0.00 0.00 175.10 176.73 2dki s ARG 612 N -0.19 1.48 0.56 2.72 0.52 0.92 -0.47 118.95 124.49 2dki s ARG 612 Ca -0.03 0.85 0.37 0.00 -0.52 0.00 0.00 55.73 56.41 2dki s ARG 612 Cb -0.14 -1.83 1.94 0.00 0.52 0.00 0.00 34.95 35.44 2dki s ARG 612 CO 0.03 -2.10 2.14 -1.35 0.02 0.00 0.00 175.30 174.05 2dki h PRO 613 N -1.44 0.00 -0.66 3.54 0.11 -1.88 -1.10 132.00 130.56 2dki h PRO 613 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2dki h PRO 613 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2dki h PRO 613 CO 0.55 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 2dki n ASP 614 N -2.88 4.35 -0.29 -2.05 5.68 -1.26 -4.73 116.55 115.37 2dki n ASP 614 Ca -0.02 -2.59 -0.04 0.00 -0.50 0.00 0.00 54.79 51.64 2dki n ASP 614 Cb 0.11 -0.60 -0.02 0.00 -1.14 0.00 0.00 41.12 39.48 2dki n ASP 614 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dki n GLN 615 N 0.58 -0.69 -3.78 0.11 6.02 -0.42 -5.00 117.38 114.21 2dki n GLN 615 Ca 0.21 0.46 -0.37 0.00 -0.01 0.00 0.00 57.00 57.30 2dki n GLN 615 Cb 0.89 -4.17 -0.06 0.00 1.02 0.00 0.00 30.24 27.92 2dki n GLN 615 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2dki s TYR 616 N -1.92 3.57 0.07 1.08 2.02 -1.26 -0.86 117.35 120.04 2dki s TYR 616 Ca 0.00 0.55 -0.31 0.00 -0.37 0.00 0.00 57.07 56.94 2dki s TYR 616 Cb 0.00 -2.06 -0.07 0.00 -0.40 0.00 0.00 41.96 39.44 2dki s TYR 616 CO 0.00 0.60 1.41 0.08 -1.57 0.00 0.00 175.55 176.07 2dki s VAL 617 N -0.65 3.46 -0.25 0.71 1.01 -0.37 -0.06 120.40 124.26 2dki s VAL 617 Ca 0.15 0.98 -0.01 0.00 0.00 0.00 0.00 61.98 63.09 2dki s VAL 617 Cb -0.12 -3.63 -0.15 0.00 0.00 0.00 0.00 36.38 32.48 2dki s VAL 617 CO 0.04 0.04 -0.24 0.00 0.00 0.00 0.00 175.10 174.94 2dki n ALA 618 N 4.63 1.44 -2.62 5.51 0.00 0.35 -1.09 120.51 128.74 2dki n ALA 618 Ca 0.12 -1.04 -0.09 0.00 0.00 0.00 0.00 53.44 52.43 2dki n ALA 618 Cb 0.43 -0.02 -0.08 0.00 0.00 0.00 0.00 19.45 19.78 2dki n ALA 618 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2dki s GLN 619 N -2.48 0.71 -0.34 0.00 -1.52 -1.07 -1.29 119.66 113.67 2dki s GLN 619 Ca -0.33 -0.85 -0.00 0.00 -1.95 0.00 0.00 55.36 52.22 2dki s GLN 619 Cb 0.10 0.28 0.11 0.00 -0.22 0.00 0.00 33.01 33.28 2dki s GLN 619 CO 0.54 -0.20 0.14 0.08 -0.25 0.00 0.00 175.29 175.60 2dki s VAL 620 N -3.22 0.81 0.24 1.09 1.01 -1.25 -0.83 120.40 118.24 2dki s VAL 620 Ca 0.00 -1.59 0.09 0.00 0.00 0.00 0.00 61.98 60.48 2dki s VAL 620 Cb 0.02 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2dki s VAL 620 CO -0.07 -0.76 -0.04 -0.76 0.00 0.00 0.00 175.10 173.47 2dki s LEU 621 N 1.36 3.10 0.34 3.92 1.43 0.80 -4.49 118.68 125.15 2dki s LEU 621 Ca 0.12 -0.63 -0.28 0.00 -1.03 0.00 0.00 54.13 52.31 2dki s LEU 621 Cb -0.19 -1.68 -0.10 0.00 0.03 0.00 0.00 46.19 44.25 2dki s LEU 621 CO -0.19 0.04 1.25 -2.84 0.23 0.00 0.00 176.35 174.84 2dki s PRO 622 N -3.38 4.34 0.46 1.29 0.02 -1.26 -0.52 135.00 135.95 2dki s PRO 622 Ca 0.29 2.08 0.17 0.00 0.02 0.00 0.00 61.00 63.56 2dki s PRO 622 Cb -0.07 -3.02 1.13 0.00 0.02 0.00 0.00 34.50 32.56 2dki s PRO 622 CO 0.18 -0.15 1.98 -0.07 -0.33 0.00 0.00 177.00 178.61 2dki h LEU 623 N 3.31 0.27 0.00 -5.54 3.38 -1.86 -1.77 115.31 113.11 2dki h LEU 623 Ca -0.48 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2dki h LEU 623 Cb 1.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2dki h LEU 623 CO 0.65 0.16 -0.24 0.61 0.09 0.00 0.00 178.44 179.71 2dki n GLY 624 N -1.55 -1.51 2.60 0.83 0.00 -1.26 -4.46 105.19 99.85 2dki n GLY 624 Ca 0.10 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 2dki n GLY 624 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dki n ASP 625 N -1.90 5.54 -0.19 1.61 4.64 -0.67 -4.65 116.55 120.94 2dki n ASP 625 Ca 0.05 -2.77 -0.01 0.00 -1.38 0.00 0.00 54.79 50.68 2dki n ASP 625 Cb 0.39 -1.62 0.20 0.00 -1.04 0.00 0.00 41.12 39.06 2dki n ASP 625 CO 0.00 0.00 0.00 0.45 -0.82 0.00 0.00 177.20 176.83 2dki h HIS 626 N 5.65 0.94 -0.72 -0.67 3.86 -1.83 -2.59 115.15 119.79 2dki h HIS 626 Ca 0.66 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.82 2dki h HIS 626 Cb 0.52 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 2dki h HIS 626 CO 1.59 0.68 0.35 0.00 0.86 0.00 0.00 177.93 181.40 2dki h ALA 627 N 1.42 0.92 -0.77 2.45 0.00 -1.98 -1.09 119.26 120.21 2dki h ALA 627 Ca 0.24 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2dki h ALA 627 Cb 0.08 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2dki h ALA 627 CO -0.03 0.49 0.32 0.00 0.00 0.00 0.00 179.25 180.02 2dki h ALA 628 N 1.17 1.11 0.04 0.00 0.00 -1.86 0.44 119.26 120.16 2dki h ALA 628 Ca 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2dki h ALA 628 Cb 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2dki h ALA 628 CO -0.03 0.64 -0.02 1.25 0.00 0.00 0.00 179.25 181.09 2dki h LEU 629 N 1.12 -0.05 0.46 0.00 5.85 -1.10 -1.12 115.31 120.47 2dki h LEU 629 Ca 0.26 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2dki h LEU 629 Cb 0.19 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2dki h LEU 629 CO -0.02 0.16 -0.31 0.28 -0.34 0.00 0.00 178.44 178.21 2dki h SER 630 N -0.26 -0.79 -0.84 1.25 0.02 -1.01 -2.78 113.55 109.14 2dki h SER 630 Ca -0.01 0.05 0.18 0.00 -0.84 0.00 0.00 61.79 61.17 2dki h SER 630 Cb 0.24 0.24 -0.11 0.00 0.14 0.00 0.00 62.40 62.91 2dki h SER 630 CO 0.01 -0.48 0.38 0.00 -1.14 0.00 0.00 176.83 175.60 2dki h ALA 631 N -0.28 1.28 0.23 3.77 0.00 -0.89 0.39 119.26 123.76 2dki h ALA 631 Ca -0.05 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2dki h ALA 631 Cb 0.62 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2dki h ALA 631 CO 0.03 -0.23 -0.37 -0.92 0.00 0.00 0.00 179.25 177.77 2dki h TYR 632 N 0.48 -1.01 0.00 0.00 -0.00 -0.93 -2.04 116.97 113.47 2dki h TYR 632 Ca 0.49 0.02 -0.09 0.00 -0.00 0.00 0.00 58.73 59.15 2dki h TYR 632 Cb 0.82 0.41 -0.01 0.00 -0.00 0.00 0.00 36.73 37.95 2dki h TYR 632 CO -0.13 -0.49 -0.43 0.74 -0.00 0.00 0.00 178.16 177.84 2dki h PHE 633 N -0.67 0.00 0.00 -3.82 -1.00 -1.19 -2.64 116.94 107.62 2dki h PHE 633 Ca 0.00 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 2dki h PHE 633 Cb 0.65 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.21 2dki h PHE 633 CO -0.28 0.43 -0.19 0.93 -1.61 0.00 0.00 178.31 177.60 2dki h GLU 634 N 0.00 0.00 0.00 1.51 4.39 -0.62 0.11 114.58 119.97 2dki h GLU 634 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2dki h GLU 634 Cb 0.85 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.50 2dki h GLU 634 CO 0.06 0.19 0.00 0.66 -1.16 0.00 0.00 179.01 178.76 2dki h SER 635 N 0.00 0.00 0.00 1.42 4.64 -0.99 -3.36 113.55 115.27 2dki h SER 635 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dki h SER 635 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2dki h SER 635 CO 0.02 0.00 0.00 2.22 -0.87 0.00 0.00 176.83 178.20 2dki n PHE 636 N -2.31 0.00 -3.31 4.77 1.16 -1.00 -5.01 117.46 111.75 2dki n PHE 636 Ca 0.01 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.30 2dki n PHE 636 Cb 0.17 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.01 2dki n PHE 636 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2dki s MET 637 N 0.00 3.65 -0.15 3.97 -1.94 0.35 -0.41 119.30 124.77 2dki s MET 637 Ca 0.00 0.06 -0.02 0.00 -1.71 0.00 0.00 55.69 54.01 2dki s MET 637 Cb 0.00 -2.63 -0.02 0.00 2.01 0.00 0.00 34.83 34.19 2dki s MET 637 CO 0.00 0.20 -0.07 1.03 -0.01 0.00 0.00 175.02 176.17 2dki s ARG 638 N -3.51 3.53 0.00 2.03 0.52 0.46 -4.77 118.95 117.20 2dki s ARG 638 Ca 0.45 -0.60 0.32 0.00 -0.52 0.00 0.00 55.73 55.38 2dki s ARG 638 Cb -0.11 -2.81 1.86 0.00 0.52 0.00 0.00 34.95 34.41 2dki s ARG 638 CO 0.29 0.19 2.20 0.00 0.02 0.00 0.00 175.30 178.01