#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dfk s ARG 9 N 0.00 1.32 -0.26 -2.82 0.52 -1.26 -0.62 118.95 115.83 3dfk s ARG 9 Ca 0.00 -1.12 -0.08 0.00 -0.52 0.00 0.00 55.73 54.01 3dfk s ARG 9 Cb 0.00 -2.53 -0.03 0.00 0.52 0.00 0.00 34.95 32.91 3dfk s ARG 9 CO 0.00 -0.75 0.10 -1.17 0.02 0.00 0.00 175.30 173.51 3dfk s LEU 10 N 1.39 3.62 -0.27 2.53 2.96 0.39 -0.14 118.68 129.16 3dfk s LEU 10 Ca 0.01 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.68 3dfk s LEU 10 Cb -0.18 -1.97 0.00 0.00 0.50 0.00 0.00 46.19 44.54 3dfk s LEU 10 CO -0.11 -0.05 0.04 -0.22 -1.32 0.00 0.00 176.35 174.69 3dfk s LEU 11 N 1.65 3.54 -0.14 -0.68 2.96 -0.46 -1.31 118.68 124.23 3dfk s LEU 11 Ca 0.06 -0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 53.31 3dfk s LEU 11 Cb -0.15 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 3dfk s LEU 11 CO 0.05 -0.13 0.08 0.00 -1.32 0.00 0.00 176.35 175.03 3dfk s ALA 12 N 1.49 3.55 -0.32 5.97 0.00 -0.18 -1.18 121.76 131.09 3dfk s ALA 12 Ca 0.03 -0.72 -0.01 0.00 0.00 0.00 0.00 51.96 51.27 3dfk s ALA 12 Cb -0.16 -1.85 0.07 0.00 0.00 0.00 0.00 23.12 21.17 3dfk s ALA 12 CO 0.01 0.42 0.03 0.42 0.00 0.00 0.00 175.76 176.63 3dfk s ILE 13 N -0.38 2.84 -0.14 0.00 1.01 0.14 -0.34 121.20 124.32 3dfk s ILE 13 Ca 0.10 -1.66 -0.11 0.00 0.00 0.00 0.00 60.65 58.97 3dfk s ILE 13 Cb -0.12 -2.75 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 3dfk s ILE 13 CO 0.02 -0.26 0.23 -0.55 0.00 0.00 0.00 174.94 174.37 3dfk s SER 14 N 1.30 6.41 0.05 3.58 0.15 0.83 -4.12 113.70 121.90 3dfk s SER 14 Ca -0.01 0.48 -0.25 0.00 0.70 0.00 0.00 55.95 56.86 3dfk s SER 14 Cb -0.20 -2.14 -0.17 0.00 -1.71 0.00 0.00 66.02 61.80 3dfk s SER 14 CO -0.03 0.22 1.56 -0.65 1.20 0.00 0.00 173.24 175.54 3dfk h PRO 15 N 6.04 -0.21 -5.72 5.44 0.11 -1.88 0.26 132.00 136.04 3dfk h PRO 15 Ca -0.46 0.01 -0.60 0.00 0.11 0.00 0.00 66.00 65.06 3dfk h PRO 15 Cb 1.18 0.05 -0.13 0.00 0.11 0.00 0.00 31.00 32.21 3dfk h PRO 15 CO 0.70 -0.02 -0.64 -1.01 -0.21 0.00 0.00 178.00 176.82 3dfk s HIS 16 N -5.59 2.39 -1.19 0.65 3.76 -1.26 -0.91 115.29 113.13 3dfk s HIS 16 Ca -0.14 -0.63 -0.21 0.00 -0.15 0.00 0.00 55.06 53.93 3dfk s HIS 16 Cb 0.04 -1.54 -0.01 0.00 1.11 0.00 0.00 32.58 32.19 3dfk s HIS 16 CO 0.64 0.46 1.81 -0.51 -0.85 0.00 0.00 174.74 176.29 3dfk s LEU 17 N -3.63 3.42 0.00 0.89 1.43 -1.26 -2.66 118.68 116.87 3dfk s LEU 17 Ca 0.34 -1.87 0.00 0.00 -1.03 0.00 0.00 54.13 51.56 3dfk s LEU 17 Cb 0.06 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.70 3dfk s LEU 17 CO 0.17 -2.15 0.00 -0.90 0.23 0.00 0.00 176.35 173.70 3dfk n ASP 18 N 11.45 0.00 -0.13 2.29 5.75 -1.26 -4.90 116.55 129.75 3dfk n ASP 18 Ca 0.45 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 55.12 3dfk n ASP 18 Cb 0.47 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.54 3dfk n ASP 18 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3dfk h ASP 19 N 0.12 0.77 -0.71 -1.12 3.32 -1.88 -1.10 116.42 115.82 3dfk h ASP 19 Ca 0.00 -0.38 -0.06 0.00 0.02 0.00 0.00 57.03 56.61 3dfk h ASP 19 Cb 0.00 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 3dfk h ASP 19 CO 0.00 0.97 0.19 0.00 -1.72 0.00 0.00 179.24 178.69 3dfk h ALA 20 N 0.82 0.93 -0.17 3.45 0.00 -1.93 -0.57 119.26 121.79 3dfk h ALA 20 Ca 0.09 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 3dfk h ALA 20 Cb 0.65 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3dfk h ALA 20 CO 0.04 0.64 -0.16 0.28 0.00 0.00 0.00 179.25 180.06 3dfk h VAL 21 N 1.06 1.34 -0.85 0.00 2.07 -1.85 0.26 116.25 118.28 3dfk h VAL 21 Ca 0.23 -1.31 0.03 0.00 0.82 0.00 0.00 66.70 66.46 3dfk h VAL 21 Cb 0.35 1.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 3dfk h VAL 21 CO -0.00 0.39 0.55 -0.07 0.02 0.00 0.00 177.57 178.46 3dfk h LEU 22 N 0.06 0.93 0.00 2.57 3.38 -1.06 -1.34 115.31 119.84 3dfk h LEU 22 Ca 0.03 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.77 3dfk h LEU 22 Cb 0.69 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 3dfk h LEU 22 CO 0.04 0.65 -1.81 -1.20 0.09 0.00 0.00 178.44 176.21 3dfk n SER 23 N -4.54 0.51 -0.16 -0.43 7.64 -0.24 -4.64 113.62 111.77 3dfk n SER 23 Ca 0.10 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.21 3dfk n SER 23 Cb 0.07 0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 3dfk n SER 23 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3dfk n PHE 24 N -2.79 0.00 -0.29 1.43 7.35 0.86 -4.77 117.46 119.25 3dfk n PHE 24 Ca -0.17 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.54 3dfk n PHE 24 Cb 0.93 0.02 0.22 0.00 0.35 0.00 0.00 39.48 41.00 3dfk n PHE 24 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3dfk h GLY 25 N 0.00 1.26 0.98 7.13 0.00 -0.55 0.04 103.07 111.93 3dfk h GLY 25 Ca 0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 3dfk h GLY 25 CO 0.00 0.37 -0.02 0.00 0.00 0.00 0.00 176.54 176.89 3dfk h ALA 26 N 1.49 0.59 -0.74 3.60 0.00 -1.90 -1.03 119.26 121.26 3dfk h ALA 26 Ca 0.35 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3dfk h ALA 26 Cb 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 3dfk h ALA 26 CO -0.11 0.40 0.47 0.78 0.00 0.00 0.00 179.25 180.79 3dfk h GLY 27 N 0.62 1.07 0.87 0.00 0.00 -1.76 -1.30 103.07 102.57 3dfk h GLY 27 Ca 0.12 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 3dfk h GLY 27 CO 0.03 0.31 0.03 1.41 0.00 0.00 0.00 176.54 178.32 3dfk h LEU 28 N 0.93 0.42 -0.46 3.11 3.38 -0.83 -1.15 115.31 120.71 3dfk h LEU 28 Ca 0.29 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3dfk h LEU 28 Cb -0.00 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3dfk h LEU 28 CO -0.10 0.58 0.25 0.00 0.09 0.00 0.00 178.44 179.26 3dfk h ALA 29 N 0.85 0.59 -0.52 1.53 0.00 -1.08 -1.58 119.26 119.05 3dfk h ALA 29 Ca 0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 3dfk h ALA 29 Cb 0.35 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3dfk h ALA 29 CO 0.01 0.12 0.13 0.37 0.00 0.00 0.00 179.25 179.88 3dfk h GLN 30 N 0.61 0.83 -0.44 0.00 5.75 -1.18 -1.51 115.11 119.17 3dfk h GLN 30 Ca 0.16 -0.20 0.06 0.00 -0.15 0.00 0.00 58.65 58.52 3dfk h GLN 30 Cb 0.07 -0.11 -0.05 0.00 1.07 0.00 0.00 27.48 28.45 3dfk h GLN 30 CO -0.02 0.79 0.14 0.00 -2.65 0.00 0.00 178.83 177.08 3dfk h ALA 31 N 1.01 0.51 -0.20 3.38 0.00 -0.98 0.25 119.26 123.23 3dfk h ALA 31 Ca 0.16 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3dfk h ALA 31 Cb 0.33 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3dfk h ALA 31 CO 0.00 -0.26 0.12 0.00 0.00 0.00 0.00 179.25 179.11 3dfk h ALA 32 N 1.30 0.26 -0.65 0.00 0.00 -0.97 -1.41 119.26 117.79 3dfk h ALA 32 Ca 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3dfk h ALA 32 Cb 0.22 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3dfk h ALA 32 CO -0.23 -0.22 0.39 0.37 0.00 0.00 0.00 179.25 179.56 3dfk h GLN 33 N 0.23 0.88 0.00 0.00 4.15 -0.93 -1.16 115.11 118.28 3dfk h GLN 33 Ca 0.07 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3dfk h GLN 33 Cb 0.05 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.55 3dfk h GLN 33 CO -0.01 0.62 0.00 -0.25 -1.93 0.00 0.00 178.83 177.26 3dfk n ASP 34 N -4.40 0.10 0.00 -0.69 8.00 0.05 -4.87 116.55 114.74 3dfk n ASP 34 Ca 0.06 0.53 0.00 0.00 0.71 0.00 0.00 54.79 56.09 3dfk n ASP 34 Cb 0.08 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 3dfk n ASP 34 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dfk n GLY 35 N -0.11 0.83 3.77 0.44 0.00 -0.44 -5.08 105.19 104.62 3dfk n GLY 35 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 3dfk n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfk s ALA 36 N -2.00 2.67 -0.33 4.61 0.00 -0.57 -4.82 121.76 121.33 3dfk s ALA 36 Ca 0.00 0.82 -0.24 0.00 0.00 0.00 0.00 51.96 52.55 3dfk s ALA 36 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.76 3dfk s ALA 36 CO 0.00 -0.82 0.81 1.21 0.00 0.00 0.00 175.76 176.96 3dfk s ASN 37 N -1.80 6.65 -0.10 0.00 3.84 0.20 -4.50 114.94 119.23 3dfk s ASN 37 Ca 0.73 0.60 0.03 0.00 0.21 0.00 0.00 52.86 54.43 3dfk s ASN 37 Cb -0.24 -2.42 -0.01 0.00 -0.55 0.00 0.00 41.25 38.04 3dfk s ASN 37 CO 0.28 -0.68 -0.20 -0.69 -2.79 0.00 0.00 177.10 173.03 3dfk s VAL 38 N 3.07 2.45 -0.06 -5.21 1.01 -1.26 -0.47 120.40 119.92 3dfk s VAL 38 Ca 0.33 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.43 3dfk s VAL 38 Cb -0.14 -1.97 0.02 0.00 0.00 0.00 0.00 36.38 34.30 3dfk s VAL 38 CO 0.14 0.55 -0.07 -0.22 0.00 0.00 0.00 175.10 175.50 3dfk s LEU 39 N 0.22 1.34 -0.32 3.92 2.96 -0.43 -2.44 118.68 123.94 3dfk s LEU 39 Ca -0.13 -0.21 -0.06 0.00 -0.22 0.00 0.00 54.13 53.51 3dfk s LEU 39 Cb -0.16 -0.63 0.03 0.00 0.50 0.00 0.00 46.19 45.92 3dfk s LEU 39 CO 0.07 -0.05 0.09 -0.69 -1.32 0.00 0.00 176.35 174.45 3dfk s VAL 40 N 1.05 3.82 -0.23 1.68 1.01 -0.11 -1.01 120.40 126.62 3dfk s VAL 40 Ca -0.08 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.87 3dfk s VAL 40 Cb -0.14 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3dfk s VAL 40 CO -0.00 -0.05 0.12 -0.47 0.00 0.00 0.00 175.10 174.70 3dfk s TYR 41 N 1.44 3.26 -0.24 5.22 5.04 0.53 -1.23 117.35 131.38 3dfk s TYR 41 Ca 0.00 0.09 -0.08 0.00 -2.44 0.00 0.00 57.07 54.64 3dfk s TYR 41 Cb -0.18 -2.22 -0.04 0.00 0.35 0.00 0.00 41.96 39.88 3dfk s TYR 41 CO 0.02 0.02 0.09 0.99 -1.34 0.00 0.00 175.55 175.33 3dfk s THR 42 N 0.97 4.60 -0.00 4.34 2.01 -0.20 -0.12 115.64 127.24 3dfk s THR 42 Ca 0.06 -0.08 -0.24 0.00 0.31 0.00 0.00 61.69 61.74 3dfk s THR 42 Cb -0.13 -3.14 -0.16 0.00 0.01 0.00 0.00 72.50 69.07 3dfk s THR 42 CO 0.03 0.35 1.18 0.58 -0.69 0.00 0.00 174.62 176.07 3dfk h VAL 43 N 5.34 0.73 -1.58 3.82 2.07 -0.99 0.37 116.25 126.01 3dfk h VAL 43 Ca -0.37 -0.69 -0.67 0.00 0.82 0.00 0.00 66.70 65.79 3dfk h VAL 43 Cb 1.18 1.08 -0.21 0.00 -1.52 0.00 0.00 31.29 31.81 3dfk h VAL 43 CO 0.60 0.13 1.02 0.49 0.02 0.00 0.00 177.57 179.83 3dfk n PHE 44 N -5.09 2.39 -0.82 1.57 3.72 -0.09 -2.57 117.46 116.57 3dfk n PHE 44 Ca -0.09 -2.29 0.08 0.00 -0.05 0.00 0.00 57.45 55.10 3dfk n PHE 44 Cb 0.26 -1.36 0.26 0.00 -0.94 0.00 0.00 39.48 37.71 3dfk n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dfk n ALA 45 N 0.38 2.94 -1.77 4.37 0.00 -1.10 -4.17 120.51 121.16 3dfk n ALA 45 Ca 0.52 -2.03 -0.39 0.00 0.00 0.00 0.00 53.44 51.54 3dfk n ALA 45 Cb 0.35 -0.72 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 3dfk n ALA 45 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3dfk s GLY 46 N -1.61 2.92 0.28 0.00 0.00 0.28 -4.70 107.32 104.50 3dfk s GLY 46 Ca 0.41 1.08 -0.30 0.00 0.00 0.00 0.00 44.72 45.91 3dfk s GLY 46 CO 0.12 1.64 1.53 0.00 0.00 0.00 0.00 173.10 176.39 3dfk s ALA 47 N -1.31 3.69 0.04 3.20 0.00 -1.26 -4.69 121.76 121.43 3dfk s ALA 47 Ca 0.55 1.49 0.06 0.00 0.00 0.00 0.00 51.96 54.06 3dfk s ALA 47 Cb -0.34 -3.61 -0.02 0.00 0.00 0.00 0.00 23.12 19.14 3dfk s ALA 47 CO 0.44 -0.90 -0.18 0.00 0.00 0.00 0.00 175.76 175.12 3dfk s ALA 48 N -0.09 1.50 0.09 0.00 0.00 -1.26 -4.95 121.76 117.04 3dfk s ALA 48 Ca 0.61 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.68 3dfk s ALA 48 Cb -0.46 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 3dfk s ALA 48 CO 0.47 0.32 -0.13 1.14 0.00 0.00 0.00 175.76 177.57 3dfk s GLN 49 N -1.09 0.87 0.90 0.00 -2.07 -1.26 -4.82 119.66 112.19 3dfk s GLN 49 Ca 0.05 -1.08 -0.11 0.00 -1.82 0.00 0.00 55.36 52.40 3dfk s GLN 49 Cb -0.08 -0.73 0.11 0.00 -1.09 0.00 0.00 33.01 31.22 3dfk s GLN 49 CO 0.01 0.14 1.01 -2.30 -1.32 0.00 0.00 175.29 172.84 3dfk n PRO 50 N 0.87 -0.30 -2.60 9.60 -0.02 -1.26 -4.53 135.00 136.75 3dfk n PRO 50 Ca -0.18 -0.02 -0.38 0.00 -2.02 0.00 0.00 63.50 60.89 3dfk n PRO 50 Cb 0.56 -2.28 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 3dfk n PRO 50 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3dfk s PRO 51 N -4.32 4.48 0.13 0.52 0.02 -1.26 -5.18 135.00 129.38 3dfk s PRO 51 Ca 0.66 1.55 0.01 0.00 0.02 0.00 0.00 61.00 63.24 3dfk s PRO 51 Cb -0.24 -2.87 -0.04 0.00 0.02 0.00 0.00 34.50 31.37 3dfk s PRO 51 CO 0.58 0.14 0.28 0.71 -0.33 0.00 0.00 177.00 178.38 3dfk s TYR 52 N -1.45 3.50 0.78 6.54 2.02 -1.26 -5.10 117.35 122.37 3dfk s TYR 52 Ca 0.50 0.19 -0.11 0.00 -0.37 0.00 0.00 57.07 57.28 3dfk s TYR 52 Cb -0.24 -1.72 0.06 0.00 -0.40 0.00 0.00 41.96 39.66 3dfk s TYR 52 CO 0.31 0.52 1.11 -1.54 -1.57 0.00 0.00 175.55 174.38 3dfk s SER 53 N -2.99 4.29 0.29 2.29 1.04 -1.26 -4.80 113.70 112.56 3dfk s SER 53 Ca 0.35 1.95 0.05 0.00 0.48 0.00 0.00 55.95 58.78 3dfk s SER 53 Cb -0.12 -2.54 0.71 0.00 0.10 0.00 0.00 66.02 64.17 3dfk s SER 53 CO 0.28 -2.18 1.76 -0.65 0.98 0.00 0.00 173.24 173.43 3dfk h PRO 54 N -1.04 0.67 -0.41 4.02 0.11 -1.97 -0.44 132.00 132.94 3dfk h PRO 54 Ca -0.44 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3dfk h PRO 54 Cb 1.24 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 3dfk h PRO 54 CO 0.50 0.44 0.20 0.00 -0.21 0.00 0.00 178.00 178.93 3dfk h ALA 55 N 1.64 0.53 -0.39 -0.75 0.00 -1.91 0.77 119.26 119.15 3dfk h ALA 55 Ca 0.56 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 3dfk h ALA 55 Cb 0.89 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3dfk h ALA 55 CO -0.40 0.09 0.19 0.00 0.00 0.00 0.00 179.25 179.14 3dfk h ALA 56 N 1.04 0.50 -1.00 0.00 0.00 -1.67 -2.56 119.26 115.57 3dfk h ALA 56 Ca 0.14 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3dfk h ALA 56 Cb 0.12 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 3dfk h ALA 56 CO -0.02 0.05 0.65 1.96 0.00 0.00 0.00 179.25 181.89 3dfk h GLN 57 N 0.49 1.20 -0.48 0.00 4.20 -0.88 0.92 115.11 120.55 3dfk h GLN 57 Ca 0.13 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3dfk h GLN 57 Cb 0.10 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.61 3dfk h GLN 57 CO -0.02 0.80 0.00 -2.13 -0.67 0.00 0.00 178.83 176.81 3dfk n ARG 58 N -4.46 0.00 0.00 1.46 0.63 0.24 -1.97 116.66 112.57 3dfk n ARG 58 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 3dfk n ARG 58 Cb 0.12 -1.11 0.00 0.00 0.45 0.00 0.00 32.46 31.93 3dfk n ARG 58 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3dfk n HIS 60 N 0.61 0.00 -0.18 -0.14 8.25 0.32 -1.82 115.22 122.26 3dfk n HIS 60 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 3dfk n HIS 60 Cb 0.00 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.15 3dfk n HIS 60 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3dfk h THR 61 N 0.00 1.06 -0.51 1.59 2.02 -1.43 0.10 112.91 115.74 3dfk h THR 61 Ca 0.00 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 3dfk h THR 61 Cb 0.00 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.76 3dfk h THR 61 CO 0.00 0.12 0.26 0.40 0.37 0.00 0.00 175.52 176.67 3dfk h ILE 62 N 0.63 1.17 0.00 3.11 2.04 -1.65 -1.16 117.51 121.65 3dfk h ILE 62 Ca 0.21 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.62 3dfk h ILE 62 Cb 0.02 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3dfk h ILE 62 CO -0.09 0.19 0.00 0.79 0.00 0.00 0.00 178.15 179.04 3dfk n TRP 63 N -4.39 0.00 -1.58 1.37 8.01 -1.00 -4.78 117.44 115.07 3dfk n TRP 63 Ca 0.04 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 56.21 3dfk n TRP 63 Cb 0.11 0.00 -0.01 0.00 -2.01 0.00 0.00 31.31 29.41 3dfk n TRP 63 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3dfk n GLY 64 N 0.65 0.42 3.71 6.99 0.00 -0.44 -4.43 105.19 112.09 3dfk n GLY 64 Ca 0.17 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 45.10 3dfk n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dfk s LEU 65 N -0.71 3.22 0.54 0.99 1.43 0.32 -5.01 118.68 119.46 3dfk s LEU 65 Ca 0.00 -0.79 -0.19 0.00 -1.03 0.00 0.00 54.13 52.13 3dfk s LEU 65 Cb 0.00 -1.69 -0.06 0.00 0.03 0.00 0.00 46.19 44.47 3dfk s LEU 65 CO 0.00 -0.26 1.08 0.00 0.23 0.00 0.00 176.35 177.40 3dfk s ALA 66 N -2.43 2.76 0.30 4.21 0.00 -1.26 -3.49 121.76 121.85 3dfk s ALA 66 Ca 0.37 0.64 0.05 0.00 0.00 0.00 0.00 51.96 53.02 3dfk s ALA 66 Cb -0.03 -3.29 0.74 0.00 0.00 0.00 0.00 23.12 20.55 3dfk s ALA 66 CO 0.22 -0.63 1.75 -1.35 0.00 0.00 0.00 175.76 175.75 3dfk h PRO 67 N 1.11 0.63 -0.67 0.00 0.11 -1.89 -2.11 132.00 129.18 3dfk h PRO 67 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3dfk h PRO 67 Cb 1.24 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3dfk h PRO 67 CO 0.58 0.42 0.00 -0.25 -0.21 0.00 0.00 178.00 178.53 3dfk n ASP 68 N -4.85 4.42 -4.74 -2.05 8.00 -1.26 -4.59 116.55 111.49 3dfk n ASP 68 Ca 0.23 -2.32 -0.32 0.00 0.71 0.00 0.00 54.79 53.10 3dfk n ASP 68 Cb 0.61 -0.55 0.10 0.00 -0.02 0.00 0.00 41.12 41.26 3dfk n ASP 68 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3dfk s ASP 69 N -0.91 4.16 -1.27 -2.24 1.01 -0.79 -4.84 116.67 111.79 3dfk s ASP 69 Ca 0.49 2.03 -0.19 0.00 0.71 0.00 0.00 52.55 55.59 3dfk s ASP 69 Cb 0.30 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.75 3dfk s ASP 69 CO 0.26 -2.27 1.72 -0.62 0.21 0.00 0.00 175.17 174.47 3dfk s ASP 70 N -2.86 6.77 0.27 0.27 -1.08 -1.26 -4.78 116.67 113.99 3dfk s ASP 70 Ca 0.66 -2.35 0.00 0.00 -0.52 0.00 0.00 52.55 50.34 3dfk s ASP 70 Cb -0.21 -2.58 0.38 0.00 -1.46 0.00 0.00 42.92 39.06 3dfk s ASP 70 CO 0.52 -1.25 1.75 0.00 0.52 0.00 0.00 175.17 176.72 3dfk h ALA 71 N 7.81 1.12 -0.60 3.66 0.00 -1.90 -2.46 119.26 126.89 3dfk h ALA 71 Ca 0.42 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3dfk h ALA 71 Cb 0.88 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3dfk h ALA 71 CO 1.45 0.55 0.34 0.28 0.00 0.00 0.00 179.25 181.88 3dfk h VAL 72 N 0.60 1.19 -0.32 0.00 2.07 -1.88 0.45 116.25 118.37 3dfk h VAL 72 Ca 0.11 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.20 3dfk h VAL 72 Cb 0.53 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3dfk h VAL 72 CO 0.03 0.20 0.17 0.25 0.02 0.00 0.00 177.57 178.24 3dfk h LEU 73 N 0.81 0.26 -0.27 2.57 5.85 -1.84 0.14 115.31 122.84 3dfk h LEU 73 Ca 0.21 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.97 3dfk h LEU 73 Cb 0.01 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3dfk h LEU 73 CO -0.04 0.19 0.08 1.88 -0.34 0.00 0.00 178.44 180.22 3dfk h TYR 74 N 0.35 0.14 -0.15 1.25 -1.99 -1.04 -1.36 116.97 114.17 3dfk h TYR 74 Ca 0.13 0.01 -0.11 0.00 2.00 0.00 0.00 58.73 60.76 3dfk h TYR 74 Cb 0.03 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 3dfk h TYR 74 CO -0.09 0.06 -0.40 0.00 -0.00 0.00 0.00 178.16 177.73 3dfk h ARG 75 N 0.19 0.33 -0.68 4.88 3.08 -0.62 -2.10 114.38 119.47 3dfk h ARG 75 Ca 0.12 -0.16 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 3dfk h ARG 75 Cb 0.10 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3dfk h ARG 75 CO -0.14 0.68 0.13 0.00 -1.07 0.00 0.00 179.97 179.57 3dfk h ARG 76 N 0.28 1.11 -0.64 0.04 3.08 -0.41 -0.38 114.38 117.45 3dfk h ARG 76 Ca 0.03 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 59.71 3dfk h ARG 76 Cb 0.82 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.71 3dfk h ARG 76 CO 0.07 1.00 0.07 0.87 -1.07 0.00 0.00 179.97 180.91 3dfk h LYS 77 N 1.03 1.07 -0.41 0.04 1.57 -0.95 -1.21 116.57 117.72 3dfk h LYS 77 Ca 0.21 -0.30 0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3dfk h LYS 77 Cb 0.42 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 3dfk h LYS 77 CO 0.01 1.00 0.24 0.93 -0.57 0.00 0.00 179.45 181.06 3dfk h GLU 78 N 1.00 0.46 -0.54 3.15 5.08 -1.16 -1.52 114.58 121.05 3dfk h GLU 78 Ca 0.19 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.53 3dfk h GLU 78 Cb 0.48 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3dfk h GLU 78 CO 0.02 0.31 0.35 0.22 -1.00 0.00 0.00 179.01 178.90 3dfk h ASP 79 N 0.48 0.60 -0.60 1.42 3.58 -0.70 0.50 116.42 121.69 3dfk h ASP 79 Ca 0.17 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 3dfk h ASP 79 Cb 0.03 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 3dfk h ASP 79 CO -0.09 0.43 0.27 0.40 -2.88 0.00 0.00 179.24 177.37 3dfk h ILE 80 N 0.71 1.22 -0.14 2.25 2.04 -1.06 0.00 117.51 122.53 3dfk h ILE 80 Ca 0.20 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 3dfk h ILE 80 Cb -0.06 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 3dfk h ILE 80 CO -0.06 0.26 0.08 0.00 0.00 0.00 0.00 178.15 178.44 3dfk h ALA 81 N 1.11 0.18 -0.31 1.87 0.00 -0.86 0.15 119.26 121.40 3dfk h ALA 81 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3dfk h ALA 81 Cb 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3dfk h ALA 81 CO -0.02 -0.30 0.21 0.00 0.00 0.00 0.00 179.25 179.13 3dfk h ALA 82 N 1.00 0.40 -0.28 0.00 0.00 -0.67 -0.41 119.26 119.29 3dfk h ALA 82 Ca 0.05 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 3dfk h ALA 82 Cb 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dfk h ALA 82 CO -0.01 -0.13 -0.48 -0.07 0.00 0.00 0.00 179.25 178.55 3dfk h LEU 83 N 0.42 0.84 -0.80 0.00 3.38 -0.93 -2.04 115.31 116.18 3dfk h LEU 83 Ca 0.11 -0.42 0.11 0.00 0.09 0.00 0.00 57.88 57.78 3dfk h LEU 83 Cb -0.05 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.39 3dfk h LEU 83 CO -0.02 1.18 0.43 0.44 0.09 0.00 0.00 178.44 180.55 3dfk h ASP 84 N 0.60 0.56 -0.91 -0.43 3.32 -0.58 -0.58 116.42 118.40 3dfk h ASP 84 Ca 0.03 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3dfk h ASP 84 Cb 1.06 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.53 3dfk h ASP 84 CO 0.10 0.29 0.51 -0.74 -1.72 0.00 0.00 179.24 177.69 3dfk h HIS 85 N 0.68 1.24 0.00 4.55 2.76 -0.40 -1.37 115.15 122.61 3dfk h HIS 85 Ca 0.41 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 3dfk h HIS 85 Cb 0.47 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 29.03 3dfk h HIS 85 CO -0.09 0.85 0.00 1.28 -1.30 0.00 0.00 177.93 178.67 3dfk n LEU 86 N -4.34 0.00 -2.60 0.26 4.77 -0.81 -4.92 117.00 109.36 3dfk n LEU 86 Ca 0.10 0.43 -0.16 0.00 -0.03 0.00 0.00 56.01 56.35 3dfk n LEU 86 Cb 0.09 -0.43 0.05 0.00 -2.33 0.00 0.00 43.42 40.80 3dfk n LEU 86 CO 0.39 -0.10 0.16 0.54 -1.33 0.00 0.00 177.39 177.04 3dfk n ARG 87 N -1.43 -5.35 -4.32 3.23 1.74 -0.33 -4.51 116.66 105.68 3dfk n ARG 87 Ca 0.07 0.56 -0.18 0.00 -0.77 0.00 0.00 57.85 57.53 3dfk n ARG 87 Cb 0.24 -4.79 -0.10 0.00 -1.02 0.00 0.00 32.46 26.78 3dfk n ARG 87 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dfk s VAL 88 N -3.22 1.63 0.49 1.55 -7.23 -0.57 -4.94 120.40 108.11 3dfk s VAL 88 Ca 0.37 -2.10 -0.10 0.00 -1.81 0.00 0.00 61.98 58.34 3dfk s VAL 88 Cb -0.16 -1.93 -0.05 0.00 0.56 0.00 0.00 36.38 34.79 3dfk s VAL 88 CO 0.49 -0.56 0.87 0.00 -0.31 0.00 0.00 175.10 175.59 3dfk s ALA 89 N -2.80 3.26 0.23 1.32 0.00 -1.02 -4.09 121.76 118.65 3dfk s ALA 89 Ca 0.19 -0.19 0.09 0.00 0.00 0.00 0.00 51.96 52.05 3dfk s ALA 89 Cb -0.01 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 20.23 3dfk s ALA 89 CO 0.06 -0.28 -0.17 -3.38 0.00 0.00 0.00 175.76 171.98 3dfk s HIS 90 N -2.69 1.92 -0.16 0.00 -3.43 -1.26 -0.93 115.29 108.74 3dfk s HIS 90 Ca 0.52 -0.48 -0.07 0.00 -0.80 0.00 0.00 55.06 54.23 3dfk s HIS 90 Cb -0.10 -0.87 0.07 0.00 -1.43 0.00 0.00 32.58 30.25 3dfk s HIS 90 CO 0.40 0.48 0.36 0.50 -2.00 0.00 0.00 174.74 174.48 3dfk s ARG 91 N -3.55 0.29 -0.31 -0.38 3.52 -0.36 -4.85 118.95 113.31 3dfk s ARG 91 Ca 0.25 0.83 -0.10 0.00 -0.13 0.00 0.00 55.73 56.58 3dfk s ARG 91 Cb -0.02 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.43 3dfk s ARG 91 CO 0.10 -0.22 0.17 -1.01 -0.81 0.00 0.00 175.30 173.52 3dfk s HIS 92 N 2.03 3.19 1.11 5.12 3.76 -1.26 -1.04 115.29 128.20 3dfk s HIS 92 Ca -0.04 -0.43 -0.18 0.00 -0.15 0.00 0.00 55.06 54.26 3dfk s HIS 92 Cb -0.11 -2.37 0.25 0.00 1.11 0.00 0.00 32.58 31.46 3dfk s HIS 92 CO -0.11 -0.40 1.17 0.20 -0.85 0.00 0.00 174.74 174.74 3dfk s GLY 93 N 1.65 1.63 0.00 -2.22 0.00 0.13 -4.94 107.32 103.57 3dfk s GLY 93 Ca 0.05 -0.96 0.22 0.00 0.00 0.00 0.00 44.72 44.03 3dfk s GLY 93 CO 0.07 -0.14 1.09 -0.96 0.00 0.00 0.00 173.10 173.17 3dfk n ARG 94 N -4.42 1.42 -2.99 2.90 1.85 -1.24 -2.35 116.66 111.83 3dfk n ARG 94 Ca 0.13 -1.14 -0.39 0.00 -1.00 0.00 0.00 57.85 55.45 3dfk n ARG 94 Cb 0.59 -1.46 -0.06 0.00 -1.05 0.00 0.00 32.46 30.49 3dfk n ARG 94 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3dfk s PHE 95 N -2.34 3.86 0.04 2.89 0.08 -1.06 -4.20 117.98 117.24 3dfk s PHE 95 Ca 0.19 1.60 -0.30 0.00 0.12 0.00 0.00 56.93 58.55 3dfk s PHE 95 Cb 0.18 -2.75 -0.04 0.00 -0.57 0.00 0.00 43.02 39.84 3dfk s PHE 95 CO 0.51 0.48 0.96 -0.51 -0.10 0.00 0.00 175.22 176.56 3dfk s LEU 96 N -1.32 4.42 0.63 -0.37 1.43 -1.26 -0.56 118.68 121.65 3dfk s LEU 96 Ca 0.37 1.70 -0.17 0.00 -1.03 0.00 0.00 54.13 55.00 3dfk s LEU 96 Cb -0.22 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.38 3dfk s LEU 96 CO 0.25 -0.18 0.64 -0.67 0.23 0.00 0.00 176.35 176.62 3dfk n ASP 97 N 3.48 -0.61 0.01 2.29 -0.08 -1.26 -4.67 116.55 115.70 3dfk n ASP 97 Ca 0.04 0.71 0.22 0.00 -1.51 0.00 0.00 54.79 54.25 3dfk n ASP 97 Cb 0.50 -1.24 0.72 0.00 2.34 0.00 0.00 41.12 43.44 3dfk n ASP 97 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3dfk h SER 98 N 0.09 0.00 0.58 1.67 4.64 -1.95 -0.35 113.55 118.23 3dfk h SER 98 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3dfk h SER 98 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 3dfk h SER 98 CO 0.47 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.73 3dfk n ILE 99 N -4.10 0.60 0.35 0.95 -5.35 -1.26 -3.13 119.36 107.41 3dfk n ILE 99 Ca 0.10 0.15 0.04 0.00 -0.27 0.00 0.00 62.75 62.77 3dfk n ILE 99 Cb 0.66 -0.82 -0.04 0.00 -1.74 0.00 0.00 39.64 37.70 3dfk n ILE 99 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3dfk n TYR 100 N -1.44 0.00 -2.87 4.28 4.01 -0.15 -4.44 117.16 116.55 3dfk n TYR 100 Ca 0.06 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.48 3dfk n TYR 100 Cb 0.21 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 3dfk n TYR 100 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3dfk s ARG 101 N -1.62 4.06 0.24 -0.72 0.52 -1.15 -4.98 118.95 115.30 3dfk s ARG 101 Ca 0.03 0.88 0.09 0.00 -0.52 0.00 0.00 55.73 56.21 3dfk s ARG 101 Cb 0.06 -2.28 -0.04 0.00 0.52 0.00 0.00 34.95 33.21 3dfk s ARG 101 CO 0.29 -0.00 0.01 0.15 0.02 0.00 0.00 175.30 175.77 3dfk s LYS 102 N -3.31 2.36 0.57 3.54 1.02 -1.26 -1.00 119.74 121.67 3dfk s LYS 102 Ca 0.58 -1.30 -0.07 0.00 0.02 0.00 0.00 55.97 55.20 3dfk s LYS 102 Cb -0.10 -2.25 -0.01 0.00 -0.52 0.00 0.00 37.83 34.95 3dfk s LYS 102 CO 0.19 0.39 0.91 -0.51 -0.92 0.00 0.00 175.35 175.42 3dfk s LEU 103 N -3.45 3.32 0.54 3.17 1.43 0.10 -4.72 118.68 119.07 3dfk s LEU 103 Ca 0.30 0.97 0.29 0.00 -1.03 0.00 0.00 54.13 54.66 3dfk s LEU 103 Cb -0.07 -3.87 1.45 0.00 0.03 0.00 0.00 46.19 43.72 3dfk s LEU 103 CO 0.20 -0.90 1.93 -0.65 0.23 0.00 0.00 176.35 177.16 3dfk h PRO 104 N -0.13 0.00 -0.00 1.29 0.11 -1.99 0.03 132.00 131.31 3dfk h PRO 104 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dfk h PRO 104 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3dfk h PRO 104 CO 0.62 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 178.00 3dfk n ASP 105 N -4.30 0.32 0.00 -2.05 5.68 -1.26 -4.92 116.55 110.02 3dfk n ASP 105 Ca 0.15 -1.04 0.00 0.00 -0.50 0.00 0.00 54.79 53.39 3dfk n ASP 105 Cb 0.81 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.78 3dfk n ASP 105 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dfk n GLY 106 N 1.06 2.07 3.76 6.12 0.00 -0.00 -5.07 105.19 113.13 3dfk n GLY 106 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 3dfk n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dfk s ARG 107 N -0.86 2.33 0.48 1.61 0.52 -1.26 -4.70 118.95 117.07 3dfk s ARG 107 Ca 0.00 1.27 -0.22 0.00 -0.52 0.00 0.00 55.73 56.26 3dfk s ARG 107 Cb 0.00 -1.90 -0.07 0.00 0.52 0.00 0.00 34.95 33.50 3dfk s ARG 107 CO 0.00 -1.60 1.16 -1.58 0.02 0.00 0.00 175.30 173.30 3dfk s TRP 108 N -2.71 2.83 0.14 -0.53 0.52 -1.26 0.00 118.94 117.94 3dfk s TRP 108 Ca 0.63 1.54 -0.13 0.00 0.02 0.00 0.00 56.10 58.16 3dfk s TRP 108 Cb -0.19 -3.36 0.01 0.00 -1.15 0.00 0.00 33.47 28.78 3dfk s TRP 108 CO 0.52 -1.52 1.62 1.25 0.02 0.00 0.00 176.95 178.84 3dfk h LEU 109 N 1.87 0.75 -8.99 2.99 5.85 -1.33 -3.43 115.31 113.03 3dfk h LEU 109 Ca -0.49 -0.27 -0.67 0.00 0.84 0.00 0.00 57.88 57.29 3dfk h LEU 109 Cb 1.25 -0.20 -0.20 0.00 0.37 0.00 0.00 40.66 41.88 3dfk h LEU 109 CO 0.59 0.83 -0.69 0.42 -0.34 0.00 0.00 178.44 179.26 3dfk s THR 110 N -5.16 3.72 0.09 1.05 -4.23 -1.26 -0.19 115.64 109.65 3dfk s THR 110 Ca -0.13 -0.45 0.07 0.00 -1.18 0.00 0.00 61.69 60.00 3dfk s THR 110 Cb 0.11 -2.56 -0.03 0.00 1.34 0.00 0.00 72.50 71.36 3dfk s THR 110 CO 0.80 0.56 -0.18 0.00 -0.54 0.00 0.00 174.62 175.26 3dfk s ALA 111 N -0.37 1.51 -0.11 3.99 0.00 0.09 -4.77 121.76 122.10 3dfk s ALA 111 Ca 0.05 -1.12 -0.19 0.00 0.00 0.00 0.00 51.96 50.71 3dfk s ALA 111 Cb -0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 3dfk s ALA 111 CO 0.02 0.27 0.50 -1.58 0.00 0.00 0.00 175.76 174.97 3dfk s HIS 112 N -1.19 3.52 -0.21 0.00 2.46 -1.26 -0.96 115.29 117.65 3dfk s HIS 112 Ca 0.03 0.92 -0.07 0.00 0.47 0.00 0.00 55.06 56.41 3dfk s HIS 112 Cb -0.10 -2.57 -0.03 0.00 -0.13 0.00 0.00 32.58 29.75 3dfk s HIS 112 CO 0.03 0.17 0.05 0.08 -2.47 0.00 0.00 174.74 172.60 3dfk s VAL 113 N 0.60 4.42 0.03 0.89 1.01 -1.26 -5.00 120.40 121.09 3dfk s VAL 113 Ca 0.27 -0.15 -0.35 0.00 0.00 0.00 0.00 61.98 61.75 3dfk s VAL 113 Cb -0.15 -3.02 -0.14 0.00 0.00 0.00 0.00 36.38 33.07 3dfk s VAL 113 CO 0.11 0.41 1.67 1.21 0.00 0.00 0.00 175.10 178.50 3dfk n GLU 114 N 4.17 1.96 -0.92 2.72 4.07 -1.26 -0.81 120.64 130.58 3dfk n GLU 114 Ca -0.16 0.71 0.00 0.00 -0.06 0.00 0.00 57.16 57.65 3dfk n GLU 114 Cb 0.52 -2.49 0.00 0.00 -0.06 0.00 0.00 31.44 29.41 3dfk n GLU 114 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3dfk n GLY 115 N 3.73 0.87 3.40 8.31 0.00 -1.26 -5.02 105.19 115.22 3dfk n GLY 115 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 3dfk n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dfk s ARG 116 N -0.08 3.49 0.10 1.61 1.81 0.01 -5.02 118.95 120.87 3dfk s ARG 116 Ca 0.00 -0.61 -0.16 0.00 -1.72 0.00 0.00 55.73 53.25 3dfk s ARG 116 Cb 0.00 -2.85 -0.08 0.00 -0.45 0.00 0.00 34.95 31.57 3dfk s ARG 116 CO 0.00 0.10 1.44 -0.56 -0.68 0.00 0.00 175.30 175.60 3dfk h GLN 117 N 7.14 0.65 -6.54 3.54 -0.00 -1.96 -3.41 115.11 114.54 3dfk h GLN 117 Ca -0.32 -0.31 -0.53 0.00 -0.00 0.00 0.00 58.65 57.49 3dfk h GLN 117 Cb 1.19 -0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.66 3dfk h GLN 117 CO 0.60 0.91 0.48 0.21 -0.00 0.00 0.00 178.83 181.03 3dfk s LYS 118 N -4.48 4.53 0.38 0.06 2.47 -1.26 -5.01 119.74 116.43 3dfk s LYS 118 Ca -0.13 1.67 -0.26 0.00 -1.56 0.00 0.00 55.97 55.69 3dfk s LYS 118 Cb 0.08 -3.34 -0.09 0.00 -1.46 0.00 0.00 37.83 33.02 3dfk s LYS 118 CO 0.81 -0.07 1.13 -0.51 0.16 0.00 0.00 175.35 176.87 3dfk s LEU 119 N 0.46 4.24 0.08 5.43 1.43 -1.26 -4.68 118.68 124.39 3dfk s LEU 119 Ca 0.53 2.26 -0.01 0.00 -1.03 0.00 0.00 54.13 55.88 3dfk s LEU 119 Cb -0.27 -4.00 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 3dfk s LEU 119 CO 0.31 -0.54 0.25 0.00 0.23 0.00 0.00 176.35 176.60 3dfk s ALA 120 N -1.44 3.96 -0.18 4.21 0.00 -0.13 -4.93 121.76 123.25 3dfk s ALA 120 Ca 0.55 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 51.65 3dfk s ALA 120 Cb -0.29 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 3dfk s ALA 120 CO 0.36 0.77 0.02 0.08 0.00 0.00 0.00 175.76 176.99 3dfk s VAL 121 N -1.56 4.34 0.32 0.00 1.01 -1.26 -0.73 120.40 122.51 3dfk s VAL 121 Ca 0.36 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 3dfk s VAL 121 Cb -0.13 -2.94 -0.10 0.00 0.00 0.00 0.00 36.38 33.22 3dfk s VAL 121 CO 0.27 0.47 1.21 0.20 0.00 0.00 0.00 175.10 177.25 3dfk s ASN 122 N 0.46 6.95 0.49 3.32 0.02 0.74 -4.98 114.94 121.94 3dfk s ASN 122 Ca 0.00 2.48 -0.22 0.00 -1.02 0.00 0.00 52.86 54.10 3dfk s ASN 122 Cb -0.13 -2.64 -0.06 0.00 0.02 0.00 0.00 41.25 38.44 3dfk s ASN 122 CO 0.02 -0.39 1.23 -1.81 0.02 0.00 0.00 177.10 176.17 3dfk s ASP 123 N -0.72 5.86 0.23 -1.22 1.01 -1.26 -4.98 116.67 115.59 3dfk s ASP 123 Ca 0.48 2.45 -0.17 0.00 0.71 0.00 0.00 52.55 56.03 3dfk s ASP 123 Cb -0.36 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 40.98 3dfk s ASP 123 CO 0.47 -1.14 0.55 -1.38 0.21 0.00 0.00 175.17 173.88 3dfk s HIS 124 N -1.47 0.01 0.57 4.23 -3.43 -1.26 -5.09 115.29 108.85 3dfk s HIS 124 Ca 0.66 -0.39 -0.20 0.00 -0.80 0.00 0.00 55.06 54.34 3dfk s HIS 124 Cb -0.32 0.40 -0.04 0.00 -1.43 0.00 0.00 32.58 31.18 3dfk s HIS 124 CO 0.39 -1.01 1.22 -1.54 -2.00 0.00 0.00 174.74 171.80 3dfk s SER 125 N -2.93 5.32 0.28 7.38 1.04 -1.26 -4.92 113.70 118.62 3dfk s SER 125 Ca 0.14 2.43 0.02 0.00 0.48 0.00 0.00 55.95 59.02 3dfk s SER 125 Cb -0.02 -2.60 0.61 0.00 0.10 0.00 0.00 66.02 64.10 3dfk s SER 125 CO 0.03 -1.51 1.80 -0.65 0.98 0.00 0.00 173.24 173.89 3dfk h PRO 126 N 1.12 0.83 -0.92 4.02 0.11 -2.01 -2.63 132.00 132.51 3dfk h PRO 126 Ca -0.50 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.60 3dfk h PRO 126 Cb 1.29 -0.19 -0.06 0.00 0.11 0.00 0.00 31.00 32.16 3dfk h PRO 126 CO 0.56 0.55 0.59 -0.44 -0.21 0.00 0.00 178.00 179.05 3dfk h ASP 127 N 0.85 0.97 -0.36 -2.05 3.32 -1.99 -1.09 116.42 116.08 3dfk h ASP 127 Ca 0.52 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.46 3dfk h ASP 127 Cb 0.65 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3dfk h ASP 127 CO -0.32 0.66 -0.17 0.77 -1.72 0.00 0.00 179.24 178.46 3dfk h SER 128 N 1.13 0.83 -0.03 6.45 4.64 -1.84 0.82 113.55 125.56 3dfk h SER 128 Ca 0.37 -0.28 -0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3dfk h SER 128 Cb 0.04 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 61.91 3dfk h SER 128 CO -0.13 1.00 0.01 0.44 -0.87 0.00 0.00 176.83 177.28 3dfk h ASP 129 N 0.73 0.04 -0.72 4.97 3.32 -1.37 -2.36 116.42 121.04 3dfk h ASP 129 Ca 0.11 -0.16 0.06 0.00 0.02 0.00 0.00 57.03 57.06 3dfk h ASP 129 Cb 0.69 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.17 3dfk h ASP 129 CO 0.05 0.19 0.41 -0.74 -1.72 0.00 0.00 179.24 177.43 3dfk h HIS 130 N -0.11 0.76 -0.51 4.55 2.76 -0.93 -1.84 115.15 119.83 3dfk h HIS 130 Ca 0.01 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.16 3dfk h HIS 130 Cb 0.16 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 3dfk h HIS 130 CO -0.02 0.37 0.14 -0.44 -1.30 0.00 0.00 177.93 176.67 3dfk h ASP 131 N 0.75 0.76 0.01 3.26 3.32 -0.79 -0.17 116.42 123.56 3dfk h ASP 131 Ca 0.32 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3dfk h ASP 131 Cb 0.19 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3dfk h ASP 131 CO -0.18 0.78 -0.00 0.25 -1.72 0.00 0.00 179.24 178.36 3dfk h LEU 132 N 0.70 -0.01 -0.71 1.55 5.85 -1.12 -0.68 115.31 120.88 3dfk h LEU 132 Ca 0.16 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3dfk h LEU 132 Cb 0.31 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3dfk h LEU 132 CO -0.00 0.08 0.43 0.58 -0.34 0.00 0.00 178.44 179.18 3dfk h VAL 133 N -0.10 1.04 -0.60 1.05 2.07 -1.18 -0.62 116.25 117.91 3dfk h VAL 133 Ca -0.00 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.29 3dfk h VAL 133 Cb 0.09 0.16 -0.05 0.00 -1.52 0.00 0.00 31.29 29.97 3dfk h VAL 133 CO 0.00 0.15 0.33 1.23 0.02 0.00 0.00 177.57 179.30 3dfk h GLY 134 N 0.81 0.86 0.97 2.17 0.00 -0.80 0.54 103.07 107.62 3dfk h GLY 134 Ca 0.30 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 3dfk h GLY 134 CO -0.15 0.16 0.13 0.83 0.00 0.00 0.00 176.54 177.51 3dfk h GLU 135 N 0.64 0.76 -0.55 4.80 4.39 -0.45 -0.57 114.58 123.60 3dfk h GLU 135 Ca 0.26 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 3dfk h GLU 135 Cb 0.12 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3dfk h GLU 135 CO -0.15 0.74 0.23 0.28 -1.16 0.00 0.00 179.01 178.95 3dfk h VAL 136 N 0.65 1.21 -0.93 3.13 2.07 -0.84 -1.92 116.25 119.63 3dfk h VAL 136 Ca 0.15 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 67.04 3dfk h VAL 136 Cb 0.31 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 3dfk h VAL 136 CO -0.00 0.25 0.62 0.00 0.02 0.00 0.00 177.57 178.46 3dfk h ALA 137 N 1.08 1.36 -0.16 1.67 0.00 -0.71 0.28 119.26 122.78 3dfk h ALA 137 Ca 0.18 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3dfk h ALA 137 Cb 0.18 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3dfk h ALA 137 CO -0.02 0.57 0.05 -0.44 0.00 0.00 0.00 179.25 179.41 3dfk h ASP 138 N 1.23 0.05 -0.60 0.00 3.32 -0.69 0.20 116.42 119.91 3dfk h ASP 138 Ca 0.35 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.36 3dfk h ASP 138 Cb -0.08 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3dfk h ASP 138 CO -0.09 0.05 0.14 0.44 -1.72 0.00 0.00 179.24 178.06 3dfk h ASP 139 N 0.12 0.93 -0.60 6.45 5.19 -0.72 -1.93 116.42 125.85 3dfk h ASP 139 Ca 0.07 -0.24 -0.05 0.00 -0.62 0.00 0.00 57.03 56.19 3dfk h ASP 139 Cb 0.04 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.28 3dfk h ASP 139 CO -0.07 0.92 0.18 0.40 -3.12 0.00 0.00 179.24 177.55 3dfk h ILE 140 N 0.88 1.25 -0.91 0.35 2.04 -0.77 -1.23 117.51 119.12 3dfk h ILE 140 Ca 0.19 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.25 3dfk h ILE 140 Cb 0.37 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 3dfk h ILE 140 CO 0.00 0.32 0.58 0.03 0.00 0.00 0.00 178.15 179.09 3dfk h ARG 141 N 0.87 1.06 -0.56 2.37 3.08 -0.71 0.79 114.38 121.27 3dfk h ARG 141 Ca 0.19 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3dfk h ARG 141 Cb 0.31 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 3dfk h ARG 141 CO -0.00 0.70 0.28 0.77 -1.07 0.00 0.00 179.97 180.65 3dfk h SER 142 N 1.09 0.72 -0.34 7.04 0.02 -0.97 -1.25 113.55 119.86 3dfk h SER 142 Ca 0.38 -0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 61.10 3dfk h SER 142 Cb 0.09 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 3dfk h SER 142 CO -0.15 0.64 -0.17 0.40 -1.14 0.00 0.00 176.83 176.41 3dfk h ILE 143 N 0.76 1.27 -0.46 3.27 2.04 -0.68 -0.93 117.51 122.77 3dfk h ILE 143 Ca 0.19 -1.27 0.01 0.00 1.00 0.00 0.00 64.86 64.79 3dfk h ILE 143 Cb 0.09 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 3dfk h ILE 143 CO -0.03 0.43 0.30 0.40 0.00 0.00 0.00 178.15 179.25 3dfk h ILE 144 N 0.72 1.10 -0.80 -0.67 2.04 -0.61 0.43 117.51 119.73 3dfk h ILE 144 Ca 0.11 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 3dfk h ILE 144 Cb 0.68 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 3dfk h ILE 144 CO 0.05 0.11 0.47 0.44 0.00 0.00 0.00 178.15 179.22 3dfk h ASP 145 N 0.61 0.97 -0.01 1.72 3.32 -0.91 0.22 116.42 122.33 3dfk h ASP 145 Ca 0.17 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 3dfk h ASP 145 Cb -0.06 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.26 3dfk h ASP 145 CO -0.05 0.76 -0.29 -0.08 -1.72 0.00 0.00 179.24 177.86 3dfk h GLU 146 N 1.10 0.22 0.00 3.56 4.81 -0.61 -3.36 114.58 120.30 3dfk h GLU 146 Ca 0.28 -0.22 -0.24 0.00 -0.13 0.00 0.00 59.36 59.06 3dfk h GLU 146 Cb -0.02 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 3dfk h GLU 146 CO -0.05 0.93 -1.44 0.35 -0.73 0.00 0.00 179.01 178.06 3dfk h PHE 147 N -0.40 0.00 -5.74 0.92 3.57 -0.17 -3.49 116.94 111.62 3dfk h PHE 147 Ca -0.03 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.15 3dfk h PHE 147 Cb 1.02 0.00 0.16 0.00 2.79 0.00 0.00 35.95 39.92 3dfk h PHE 147 CO 0.17 0.88 -0.89 -3.47 -2.23 0.00 0.00 178.31 172.77 3dfk n ASP 148 N -3.08 -5.98 -4.77 0.41 2.03 0.77 -4.95 116.55 100.99 3dfk n ASP 148 Ca -0.11 -0.82 -0.35 0.00 0.52 0.00 0.00 54.79 54.03 3dfk n ASP 148 Cb 0.97 -4.54 0.02 0.00 -0.72 0.00 0.00 41.12 36.84 3dfk n ASP 148 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3dfk s PRO 149 N -5.01 3.19 0.11 -0.67 0.04 -1.26 -4.83 135.00 126.57 3dfk s PRO 149 Ca 0.45 1.57 0.23 0.00 0.04 0.00 0.00 61.00 63.28 3dfk s PRO 149 Cb -0.10 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.54 3dfk s PRO 149 CO 0.78 -0.97 1.07 0.25 0.04 0.00 0.00 177.00 178.17 3dfk n THR 150 N -1.61 0.36 -3.70 1.26 -2.24 0.81 -4.91 114.28 104.24 3dfk n THR 150 Ca 0.11 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.40 3dfk n THR 150 Cb 0.51 -0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.57 3dfk n THR 150 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3dfk s LEU 151 N -4.52 0.06 -0.09 3.22 2.96 -1.08 -4.39 118.68 114.85 3dfk s LEU 151 Ca 0.02 0.96 0.03 0.00 -0.22 0.00 0.00 54.13 54.91 3dfk s LEU 151 Cb 0.12 1.57 -0.02 0.00 0.50 0.00 0.00 46.19 48.37 3dfk s LEU 151 CO 0.78 -0.18 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.79 3dfk s VAL 152 N 0.67 2.85 -0.05 1.68 1.01 -0.55 -1.36 120.40 124.65 3dfk s VAL 152 Ca -0.03 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.22 3dfk s VAL 152 Cb -0.05 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 3dfk s VAL 152 CO -0.05 0.56 -0.19 -0.69 0.00 0.00 0.00 175.10 174.74 3dfk s VAL 153 N -0.15 1.56 0.00 2.92 1.01 -0.33 -1.11 120.40 124.31 3dfk s VAL 153 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.17 3dfk s VAL 153 Cb -0.14 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 34.91 3dfk s VAL 153 CO 0.03 0.44 0.00 1.07 0.00 0.00 0.00 175.10 176.65 3dfk n THR 154 N 3.09 0.00 -3.20 3.92 5.66 -0.50 -0.68 114.28 122.56 3dfk n THR 154 Ca -0.18 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.48 3dfk n THR 154 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 3dfk n THR 154 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3dfk h ALA 156 N 2.78 1.00 -3.81 0.00 0.00 -1.54 -3.42 119.26 114.27 3dfk h ALA 156 Ca -0.48 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.09 3dfk h ALA 156 Cb 1.18 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.02 3dfk h ALA 156 CO 0.66 0.00 -0.51 0.00 0.00 0.00 0.00 179.25 179.40 3dfk n ALA 157 N -1.99 -0.81 -1.78 0.00 0.00 -1.26 -4.93 120.51 109.74 3dfk n ALA 157 Ca 0.02 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 3dfk n ALA 157 Cb 0.34 -3.37 -0.02 0.00 0.00 0.00 0.00 19.45 16.40 3dfk n ALA 157 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dfk s ILE 158 N -3.08 2.17 0.00 0.00 1.01 -1.26 -1.57 121.20 118.48 3dfk s ILE 158 Ca 0.26 0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.04 3dfk s ILE 158 Cb -0.11 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.27 3dfk s ILE 158 CO 0.32 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.88 3dfk n GLY 159 N 3.17 2.00 2.48 6.18 0.00 -1.26 -4.70 105.19 113.06 3dfk n GLY 159 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 3dfk n GLY 159 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dfk n GLU 160 N -1.78 -1.55 -1.80 1.61 1.02 -0.61 -4.95 120.64 112.58 3dfk n GLU 160 Ca 0.00 1.10 -0.42 0.00 -0.02 0.00 0.00 57.16 57.82 3dfk n GLU 160 Cb 0.00 -5.62 -0.02 0.00 -0.02 0.00 0.00 31.44 25.77 3dfk n GLU 160 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3dfk s HIS 161 N -2.91 2.86 0.38 -0.32 2.46 -1.26 -4.84 115.29 111.66 3dfk s HIS 161 Ca 0.00 0.65 0.08 0.00 0.47 0.00 0.00 55.06 56.26 3dfk s HIS 161 Cb 0.00 -4.05 0.83 0.00 -0.13 0.00 0.00 32.58 29.23 3dfk s HIS 161 CO 0.00 -3.71 1.97 -1.35 -2.47 0.00 0.00 174.74 169.18 3dfk h PRO 162 N 5.70 0.62 -0.13 2.88 0.11 -1.99 -0.24 132.00 138.96 3dfk h PRO 162 Ca -0.45 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 3dfk h PRO 162 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3dfk h PRO 162 CO 0.86 0.41 -0.46 -0.44 -0.21 0.00 0.00 178.00 178.16 3dfk h ASP 163 N 0.64 0.35 -0.25 -2.05 3.32 -1.99 -1.03 116.42 115.41 3dfk h ASP 163 Ca 0.30 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 57.07 3dfk h ASP 163 Cb 0.33 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 3dfk h ASP 163 CO -0.10 0.77 -0.27 0.45 -1.72 0.00 0.00 179.24 178.37 3dfk h HIS 164 N 0.27 0.76 -0.67 4.55 3.86 -1.58 -1.87 115.15 120.48 3dfk h HIS 164 Ca 0.02 -0.23 -0.07 0.00 -1.16 0.00 0.00 60.37 58.92 3dfk h HIS 164 Cb 0.92 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 29.21 3dfk h HIS 164 CO 0.02 0.96 0.15 0.93 0.86 0.00 0.00 177.93 180.85 3dfk h GLU 165 N 0.35 1.08 -0.63 2.45 5.08 -0.94 -1.19 114.58 120.78 3dfk h GLU 165 Ca 0.04 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 3dfk h GLU 165 Cb 0.84 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 3dfk h GLU 165 CO 0.07 0.97 0.20 0.00 -1.00 0.00 0.00 179.01 179.25 3dfk h ALA 166 N 1.06 0.83 0.08 3.43 0.00 -1.18 -0.66 119.26 122.82 3dfk h ALA 166 Ca 0.21 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dfk h ALA 166 Cb 0.39 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dfk h ALA 166 CO 0.01 0.50 -0.04 1.15 0.00 0.00 0.00 179.25 180.86 3dfk h THR 167 N 0.91 1.01 0.30 0.00 2.02 -1.14 -1.34 112.91 114.67 3dfk h THR 167 Ca 0.20 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 3dfk h THR 167 Cb 0.29 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3dfk h THR 167 CO -0.01 0.08 -0.15 -0.09 0.37 0.00 0.00 175.52 175.72 3dfk h ARG 168 N -0.25 -0.39 -0.42 6.66 2.43 -1.10 -0.61 114.38 120.70 3dfk h ARG 168 Ca -0.01 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3dfk h ARG 168 Cb 0.21 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 3dfk h ARG 168 CO 0.02 -0.25 0.27 -0.44 -1.51 0.00 0.00 179.97 178.06 3dfk h ASP 169 N -0.42 0.45 -0.66 -3.80 3.32 -1.12 -0.35 116.42 113.84 3dfk h ASP 169 Ca -0.04 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3dfk h ASP 169 Cb 0.32 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 3dfk h ASP 169 CO 0.07 0.33 0.41 0.00 -1.72 0.00 0.00 179.24 178.32 3dfk h ALA 170 N 1.17 0.84 -0.98 3.45 0.00 -1.09 -0.84 119.26 121.80 3dfk h ALA 170 Ca 0.16 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3dfk h ALA 170 Cb -0.04 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 3dfk h ALA 170 CO -0.05 0.30 0.65 0.00 0.00 0.00 0.00 179.25 180.15 3dfk h ALA 171 N 1.22 1.24 -0.27 0.00 0.00 -0.82 -0.32 119.26 120.30 3dfk h ALA 171 Ca 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dfk h ALA 171 Cb -0.05 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 3dfk h ALA 171 CO -0.05 0.63 0.13 -0.07 0.00 0.00 0.00 179.25 179.89 3dfk h LEU 172 N 1.33 0.35 -0.25 0.00 3.38 -0.32 -0.27 115.31 119.52 3dfk h LEU 172 Ca 0.36 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 3dfk h LEU 172 Cb -0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3dfk h LEU 172 CO -0.08 0.38 0.12 -0.26 0.09 0.00 0.00 178.44 178.70 3dfk h PHE 173 N 0.30 0.37 -0.20 1.13 0.04 -0.93 -0.95 116.94 116.70 3dfk h PHE 173 Ca 0.09 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 3dfk h PHE 173 Cb 0.12 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 3dfk h PHE 173 CO -0.02 0.35 0.03 0.00 -0.60 0.00 0.00 178.31 178.07 3dfk h ALA 174 N 0.98 0.26 -0.29 2.45 0.00 -1.00 -1.56 119.26 120.11 3dfk h ALA 174 Ca 0.09 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 3dfk h ALA 174 Cb 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3dfk h ALA 174 CO -0.01 -0.07 -0.20 1.79 0.00 0.00 0.00 179.25 180.76 3dfk h THR 175 N 0.12 1.25 -0.24 0.00 1.35 -1.03 -1.01 112.91 113.37 3dfk h THR 175 Ca 0.06 -1.19 -0.01 0.00 -0.55 0.00 0.00 66.41 64.72 3dfk h THR 175 Cb 0.31 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.97 3dfk h THR 175 CO 0.00 0.38 0.11 -0.74 -0.25 0.00 0.00 175.52 175.03 3dfk h HIS 176 N 0.48 0.34 -0.64 4.73 6.17 -1.03 0.15 115.15 125.35 3dfk h HIS 176 Ca 0.08 -0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.10 3dfk h HIS 176 Cb 0.61 -0.11 -0.03 0.00 2.52 0.00 0.00 27.41 30.41 3dfk h HIS 176 CO 0.02 0.34 0.24 0.93 0.71 0.00 0.00 177.93 180.17 3dfk h GLU 177 N 0.25 0.96 -0.01 5.26 5.08 -1.09 -2.90 114.58 122.13 3dfk h GLU 177 Ca 0.08 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3dfk h GLU 177 Cb 0.13 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3dfk h GLU 177 CO -0.01 0.82 -0.11 1.63 -1.00 0.00 0.00 179.01 180.33 3dfk n LYS 178 N -4.41 0.84 -3.64 2.33 4.76 -0.40 -4.97 118.16 112.67 3dfk n LYS 178 Ca 0.04 -0.34 -0.22 0.00 -2.87 0.00 0.00 58.31 54.92 3dfk n LYS 178 Cb 0.18 -1.49 0.04 0.00 -1.84 0.00 0.00 35.03 31.92 3dfk n LYS 178 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3dfk n ASN 179 N -0.78 -2.61 -4.42 4.39 5.15 0.42 -5.03 115.26 112.38 3dfk n ASN 179 Ca 0.15 -0.84 -0.32 0.00 -0.60 0.00 0.00 54.58 52.97 3dfk n ASN 179 Cb 0.29 -4.09 -0.14 0.00 -0.53 0.00 0.00 39.78 35.31 3dfk n ASN 179 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3dfk s VAL 180 N -3.60 2.83 0.44 3.44 -7.23 -0.58 -5.05 120.40 110.66 3dfk s VAL 180 Ca 0.15 -0.80 -0.26 0.00 -1.81 0.00 0.00 61.98 59.26 3dfk s VAL 180 Cb -0.04 -2.10 -0.09 0.00 0.56 0.00 0.00 36.38 34.72 3dfk s VAL 180 CO 0.81 0.58 1.42 -2.84 -0.31 0.00 0.00 175.10 174.76 3dfk s PRO 181 N -0.52 3.75 0.03 4.82 0.02 -1.26 -4.61 135.00 137.22 3dfk s PRO 181 Ca 0.07 2.41 0.04 0.00 0.02 0.00 0.00 61.00 63.54 3dfk s PRO 181 Cb -0.11 -2.70 -0.02 0.00 0.02 0.00 0.00 34.50 31.69 3dfk s PRO 181 CO 0.01 -0.76 -0.11 0.54 -0.33 0.00 0.00 177.00 176.35 3dfk s VAL 182 N -1.20 0.84 0.08 3.83 0.11 -1.26 -1.49 120.40 121.32 3dfk s VAL 182 Ca 0.60 -0.84 0.04 0.00 -2.93 0.00 0.00 61.98 58.85 3dfk s VAL 182 Cb -0.44 -0.78 -0.03 0.00 -1.53 0.00 0.00 36.38 33.60 3dfk s VAL 182 CO 0.56 -0.05 -0.11 -0.13 -3.33 0.00 0.00 175.10 172.05 3dfk s ARG 183 N -0.99 0.80 -0.08 1.54 0.52 -0.26 -1.69 118.95 118.78 3dfk s ARG 183 Ca -0.01 -1.06 0.01 0.00 -0.52 0.00 0.00 55.73 54.15 3dfk s ARG 183 Cb -0.07 -0.57 -0.03 0.00 0.52 0.00 0.00 34.95 34.80 3dfk s ARG 183 CO 0.01 0.10 -0.09 -0.51 0.02 0.00 0.00 175.30 174.83 3dfk s LEU 184 N -2.18 3.01 0.40 2.53 1.43 0.51 -1.41 118.68 122.97 3dfk s LEU 184 Ca 0.02 -0.12 -0.05 0.00 -1.03 0.00 0.00 54.13 52.95 3dfk s LEU 184 Cb -0.05 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 3dfk s LEU 184 CO 0.01 0.30 0.69 -1.66 0.23 0.00 0.00 176.35 175.92 3dfk s TRP 185 N -0.47 3.52 -0.23 0.29 -2.14 0.73 -1.28 118.94 119.36 3dfk s TRP 185 Ca 0.07 0.72 -0.29 0.00 2.66 0.00 0.00 56.10 59.26 3dfk s TRP 185 Cb -0.12 -2.20 -0.01 0.00 -3.10 0.00 0.00 33.47 28.04 3dfk s TRP 185 CO 0.02 -0.08 1.30 -2.00 -2.66 0.00 0.00 176.95 173.54 3dfk s GLU 186 N -4.26 4.06 0.06 3.25 2.12 -0.32 -1.43 118.70 122.19 3dfk s GLU 186 Ca 0.46 1.46 -0.31 0.00 0.36 0.00 0.00 54.97 56.95 3dfk s GLU 186 Cb -0.10 -3.83 -0.08 0.00 0.26 0.00 0.00 34.13 30.37 3dfk s GLU 186 CO 0.38 -0.94 1.68 -0.51 -0.54 0.00 0.00 175.26 175.33 3dfk s ASP 187 N 2.49 6.58 0.06 -1.70 1.01 -1.26 -4.77 116.67 119.08 3dfk s ASP 187 Ca 0.56 2.50 0.07 0.00 0.71 0.00 0.00 52.55 56.40 3dfk s ASP 187 Cb -0.19 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.14 3dfk s ASP 187 CO 0.19 -0.91 -0.17 -0.76 0.21 0.00 0.00 175.17 173.73 3dfk s LEU 188 N 2.82 2.66 0.00 1.23 1.43 -1.26 -0.85 118.68 124.71 3dfk s LEU 188 Ca 0.75 -0.45 0.32 0.00 -1.03 0.00 0.00 54.13 53.72 3dfk s LEU 188 Cb -0.40 -1.54 1.82 0.00 0.03 0.00 0.00 46.19 46.10 3dfk s LEU 188 CO 0.33 0.24 2.19 -0.81 0.23 0.00 0.00 176.35 178.52 3dfk n PRO 189 N 1.35 0.98 -0.32 1.29 -0.04 -1.26 -4.47 135.00 132.52 3dfk n PRO 189 Ca -0.16 -0.05 0.10 0.00 -0.04 0.00 0.00 63.50 63.35 3dfk n PRO 189 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 3dfk n PRO 189 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3dfk h TYR 190 N 0.12 -0.14 0.00 0.54 0.05 -1.88 0.78 116.97 116.44 3dfk h TYR 190 Ca 0.00 0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.85 3dfk h TYR 190 Cb 0.06 0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.00 3dfk h TYR 190 CO 0.00 -0.37 0.00 0.00 -1.05 0.00 0.00 178.16 176.74 3dfk n ALA 191 N -3.16 1.21 0.20 3.88 0.00 -0.03 -1.33 120.51 121.29 3dfk n ALA 191 Ca 0.19 0.18 0.08 0.00 0.00 0.00 0.00 53.44 53.88 3dfk n ALA 191 Cb 0.62 -1.35 0.36 0.00 0.00 0.00 0.00 19.45 19.08 3dfk n ALA 191 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3dfk h VAL 192 N 0.00 0.69 0.00 0.00 2.07 -1.11 -3.31 116.25 114.60 3dfk h VAL 192 Ca 0.00 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 66.14 3dfk h VAL 192 Cb 0.10 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3dfk h VAL 192 CO 0.00 0.30 -0.06 2.22 0.02 0.00 0.00 177.57 180.05 3dfk n PHE 193 N -3.42 0.00 -4.32 1.57 -1.74 -0.44 -5.05 117.46 104.06 3dfk n PHE 193 Ca 0.00 -0.57 -0.17 0.00 -0.56 0.00 0.00 57.45 56.15 3dfk n PHE 193 Cb 0.49 -0.08 -0.10 0.00 1.52 0.00 0.00 39.48 41.31 3dfk n PHE 193 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 3dfk s LYS 194 N -1.46 1.26 0.31 3.97 -0.14 -0.85 -5.07 119.74 117.76 3dfk s LYS 194 Ca 0.12 -1.55 0.02 0.00 -1.36 0.00 0.00 55.97 53.20 3dfk s LYS 194 Cb 0.11 -1.00 0.51 0.00 -1.68 0.00 0.00 37.83 35.76 3dfk s LYS 194 CO 0.01 0.16 1.85 0.66 -0.76 0.00 0.00 175.35 177.27 3dfk h SER 195 N 2.64 0.60 0.00 2.83 4.64 -1.91 -3.45 113.55 118.90 3dfk h SER 195 Ca -0.38 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3dfk h SER 195 Cb 1.21 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3dfk h SER 195 CO 0.62 0.65 0.00 0.61 -0.87 0.00 0.00 176.83 177.84 3dfk n GLY 196 N -0.84 2.36 3.75 -0.77 0.00 -1.26 -5.08 105.19 103.34 3dfk n GLY 196 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3dfk n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfk s ALA 197 N -2.42 3.37 0.09 4.61 0.00 -1.26 -4.94 121.76 121.21 3dfk s ALA 197 Ca 0.00 0.77 0.04 0.00 0.00 0.00 0.00 51.96 52.77 3dfk s ALA 197 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 3dfk s ALA 197 CO 0.00 -0.04 -0.10 0.14 0.00 0.00 0.00 175.76 175.76 3dfk s VAL 198 N -0.95 0.94 -0.31 0.00 -7.23 -1.26 -4.93 120.40 106.65 3dfk s VAL 198 Ca 0.44 -1.58 -0.09 0.00 -1.81 0.00 0.00 61.98 58.94 3dfk s VAL 198 Cb -0.29 -1.30 0.00 0.00 0.56 0.00 0.00 36.38 35.35 3dfk s VAL 198 CO 0.36 -0.52 0.14 -0.70 -0.31 0.00 0.00 175.10 174.08 3dfk s GLU 199 N -2.64 3.22 0.45 4.82 2.56 -1.26 -5.09 118.70 120.76 3dfk s GLU 199 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 54.97 54.20 3dfk s GLU 199 Cb -0.04 -3.54 -0.02 0.00 2.00 0.00 0.00 34.13 32.53 3dfk s GLU 199 CO 0.00 -0.46 0.69 -0.51 -0.56 0.00 0.00 175.26 174.43 3dfk s LEU 200 N 1.58 3.68 0.71 2.70 1.43 -1.26 -5.07 118.68 122.45 3dfk s LEU 200 Ca 0.04 0.50 -0.16 0.00 -1.03 0.00 0.00 54.13 53.48 3dfk s LEU 200 Cb -0.17 -3.38 0.03 0.00 0.03 0.00 0.00 46.19 42.69 3dfk s LEU 200 CO 0.05 -0.63 1.22 -2.84 0.23 0.00 0.00 176.35 174.39 3dfk s PRO 201 N -4.59 2.25 0.27 1.29 0.02 -1.26 -4.87 135.00 128.11 3dfk s PRO 201 Ca 0.47 1.82 -0.30 0.00 0.02 0.00 0.00 61.00 63.00 3dfk s PRO 201 Cb -0.10 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.45 3dfk s PRO 201 CO 0.40 -1.76 1.38 0.94 -0.33 0.00 0.00 177.00 177.63 3dfk n GLN 202 N -2.52 2.09 0.00 5.54 -0.06 -1.26 -2.35 117.38 118.83 3dfk n GLN 202 Ca 0.14 0.74 0.00 0.00 -2.00 0.00 0.00 57.00 55.88 3dfk n GLN 202 Cb 0.50 -2.38 0.00 0.00 -4.06 0.00 0.00 30.24 24.29 3dfk n GLN 202 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3dfk n GLY 203 N 1.80 0.96 3.50 1.69 0.00 -1.26 -5.07 105.19 106.81 3dfk n GLY 203 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 3dfk n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dfk s PHE 204 N -2.22 2.63 0.10 1.61 0.08 -0.99 -0.76 117.98 118.44 3dfk s PHE 204 Ca 0.00 -0.21 -0.12 0.00 0.12 0.00 0.00 56.93 56.72 3dfk s PHE 204 Cb 0.00 -1.45 0.01 0.00 -0.57 0.00 0.00 43.02 41.02 3dfk s PHE 204 CO 0.00 0.33 0.28 -0.98 -0.10 0.00 0.00 175.22 174.75 3dfk s ARG 205 N -1.76 0.93 0.15 0.44 1.70 -0.06 -4.72 118.95 115.63 3dfk s ARG 205 Ca 0.17 -0.85 -0.25 0.00 -0.47 0.00 0.00 55.73 54.34 3dfk s ARG 205 Cb -0.11 0.39 -0.08 0.00 -0.57 0.00 0.00 34.95 34.59 3dfk s ARG 205 CO 0.08 -0.33 0.75 -0.51 -1.08 0.00 0.00 175.30 174.22 3dfk s LEU 206 N -2.81 4.59 0.00 -1.89 1.43 -1.26 -0.60 118.68 118.13 3dfk s LEU 206 Ca 0.04 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 3dfk s LEU 206 Cb 0.03 -3.24 0.00 0.00 0.03 0.00 0.00 46.19 43.01 3dfk s LEU 206 CO -0.11 0.22 0.00 0.61 0.23 0.00 0.00 176.35 177.30 3dfk n GLY 207 N 1.61 -0.10 3.77 -3.19 0.00 0.16 -4.91 105.19 102.53 3dfk n GLY 207 Ca -0.06 -1.77 -0.39 0.00 0.00 0.00 0.00 46.02 43.79 3dfk n GLY 207 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dfk s SER 208 N -1.00 6.82 0.56 1.61 0.01 -1.26 -4.60 113.70 115.83 3dfk s SER 208 Ca 0.00 2.42 -0.21 0.00 1.31 0.00 0.00 55.95 59.47 3dfk s SER 208 Cb 0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 3dfk s SER 208 CO 0.00 -0.48 1.27 0.00 0.41 0.00 0.00 173.24 174.45 3dfk s ALA 209 N -1.27 2.71 -0.10 1.44 0.00 -1.26 -4.34 121.76 118.94 3dfk s ALA 209 Ca 0.51 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.64 3dfk s ALA 209 Cb -0.33 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.27 3dfk s ALA 209 CO 0.43 -1.22 -0.14 0.34 0.00 0.00 0.00 175.76 175.18 3dfk s ASP 210 N -1.27 3.99 -0.26 0.00 2.15 0.63 -4.99 116.67 116.92 3dfk s ASP 210 Ca 0.73 -0.29 -0.04 0.00 0.43 0.00 0.00 52.55 53.38 3dfk s ASP 210 Cb -0.35 -1.32 0.01 0.00 -0.30 0.00 0.00 42.92 40.96 3dfk s ASP 210 CO 0.40 0.23 0.00 -0.69 -0.17 0.00 0.00 175.17 174.95 3dfk s VAL 211 N -0.05 3.47 0.70 1.11 1.01 -1.26 -1.26 120.40 124.13 3dfk s VAL 211 Ca -0.03 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.09 3dfk s VAL 211 Cb -0.14 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.52 3dfk s VAL 211 CO 0.04 0.20 1.06 -0.94 0.00 0.00 0.00 175.10 175.47 3dfk s SER 212 N 1.44 5.37 -0.24 3.32 1.04 -0.47 -4.88 113.70 119.27 3dfk s SER 212 Ca 0.03 1.50 0.02 0.00 0.48 0.00 0.00 55.95 57.98 3dfk s SER 212 Cb -0.16 -2.38 0.05 0.00 0.10 0.00 0.00 66.02 63.63 3dfk s SER 212 CO -0.01 -1.44 -0.13 -0.55 0.98 0.00 0.00 173.24 172.10 3dfk s SER 213 N -3.91 4.17 -0.02 7.02 0.15 -1.26 -3.94 113.70 115.91 3dfk s SER 213 Ca 0.58 -1.22 0.01 0.00 0.70 0.00 0.00 55.95 56.02 3dfk s SER 213 Cb -0.13 -1.54 -0.04 0.00 -1.71 0.00 0.00 66.02 62.60 3dfk s SER 213 CO 0.55 -0.15 0.01 0.68 1.20 0.00 0.00 173.24 175.53 3dfk s VAL 214 N 1.15 4.23 0.55 4.45 -7.23 0.17 -5.00 120.40 118.73 3dfk s VAL 214 Ca -0.06 -0.52 -0.20 0.00 -1.81 0.00 0.00 61.98 59.40 3dfk s VAL 214 Cb -0.18 -2.87 -0.05 0.00 0.56 0.00 0.00 36.38 33.83 3dfk s VAL 214 CO -0.07 0.42 1.18 -0.54 -0.31 0.00 0.00 175.10 175.78 3dfk s LYS 215 N -1.45 3.24 0.50 4.82 1.02 -1.26 -4.10 119.74 122.50 3dfk s LYS 215 Ca 0.19 1.76 0.25 0.00 0.02 0.00 0.00 55.97 58.18 3dfk s LYS 215 Cb -0.12 -2.04 1.33 0.00 -0.52 0.00 0.00 37.83 36.48 3dfk s LYS 215 CO 0.09 -0.98 1.93 -1.00 -0.92 0.00 0.00 175.35 174.48 3dfk h PRO 216 N 1.20 0.12 -1.12 -1.68 0.13 -1.98 -2.66 132.00 126.01 3dfk h PRO 216 Ca -0.50 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3dfk h PRO 216 Cb 1.28 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3dfk h PRO 216 CO 0.57 0.08 0.00 0.39 -0.23 0.00 0.00 178.00 178.81 3dfk n GLU 217 N -4.38 0.14 0.00 0.86 4.71 -1.26 -1.11 120.64 119.60 3dfk n GLU 217 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 3dfk n GLU 217 Cb 0.72 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.88 3dfk n GLU 217 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 3dfk n ARG 219 N 0.72 0.00 -0.28 3.49 0.63 -1.00 -1.36 116.66 118.85 3dfk n ARG 219 Ca 0.00 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.88 3dfk n ARG 219 Cb 0.05 0.00 0.07 0.00 0.45 0.00 0.00 32.46 33.03 3dfk n ARG 219 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3dfk h SER 220 N 0.00 0.91 -0.40 6.15 0.87 -1.40 -0.75 113.55 118.93 3dfk h SER 220 Ca 0.00 -0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.37 3dfk h SER 220 Cb 0.00 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 3dfk h SER 220 CO 0.00 0.69 -0.30 -0.61 -0.53 0.00 0.00 176.83 176.08 3dfk h GLN 221 N 1.05 0.91 0.36 2.24 4.15 -1.48 -0.74 115.11 121.60 3dfk h GLN 221 Ca 0.28 -0.45 -0.01 0.00 0.77 0.00 0.00 58.65 59.24 3dfk h GLN 221 Cb -0.07 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.61 3dfk h GLN 221 CO -0.06 1.10 -0.21 -0.22 -1.93 0.00 0.00 178.83 177.52 3dfk h LYS 222 N 0.74 -0.51 -0.92 1.69 3.64 -1.74 -0.90 116.57 118.56 3dfk h LYS 222 Ca 0.08 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 3dfk h LYS 222 Cb 0.89 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.77 3dfk h LYS 222 CO 0.08 -0.34 0.61 0.74 -2.27 0.00 0.00 179.45 178.26 3dfk h PHE 223 N -0.53 1.13 -0.80 1.91 -1.00 -1.02 0.10 116.94 116.74 3dfk h PHE 223 Ca -0.04 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.72 3dfk h PHE 223 Cb 0.43 -0.38 -0.04 0.00 3.61 0.00 0.00 35.95 39.58 3dfk h PHE 223 CO -0.08 0.68 0.33 1.96 -1.61 0.00 0.00 178.31 179.59 3dfk h GLN 224 N 1.19 1.19 -0.63 1.51 4.20 -1.02 -2.56 115.11 118.98 3dfk h GLN 224 Ca 0.35 -0.21 -0.09 0.00 0.06 0.00 0.00 58.65 58.77 3dfk h GLN 224 Cb -0.05 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.51 3dfk h GLN 224 CO -0.10 0.96 0.05 0.00 -0.67 0.00 0.00 178.83 179.07 3dfk h ALA 225 N 1.19 0.85 -0.87 3.87 0.00 -0.03 -2.56 119.26 121.71 3dfk h ALA 225 Ca 0.27 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.96 3dfk h ALA 225 Cb 0.20 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 3dfk h ALA 225 CO -0.02 0.66 0.53 0.28 0.00 0.00 0.00 179.25 180.70 3dfk h VAL 226 N 1.00 1.00 0.00 0.00 2.07 -0.61 -1.43 116.25 118.28 3dfk h VAL 226 Ca 0.19 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3dfk h VAL 226 Cb 0.51 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3dfk h VAL 226 CO 0.02 0.17 0.00 -0.33 0.02 0.00 0.00 177.57 177.46 3dfk h GLU 227 N 0.94 0.00 0.00 1.57 5.08 -1.05 -0.89 114.58 120.23 3dfk h GLU 227 Ca 0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.75 3dfk h GLU 227 Cb 0.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3dfk h GLU 227 CO -0.20 0.00 -0.02 0.00 -1.00 0.00 0.00 179.01 177.79 3dfk h ARG 228 N 0.00 0.00 -3.23 2.33 -0.00 -1.23 -3.30 114.38 108.95 3dfk h ARG 228 Ca 0.00 0.00 -0.72 0.00 -0.50 0.00 0.00 59.98 58.76 3dfk h ARG 228 Cb 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 29.97 30.01 3dfk h ARG 228 CO 0.00 0.02 2.82 0.66 0.00 0.00 0.00 179.97 183.47 3dfk n TYR 229 N -3.16 2.83 -0.29 3.04 4.01 -0.34 -4.70 117.16 118.55 3dfk n TYR 229 Ca -0.01 -2.91 0.09 0.00 -0.16 0.00 0.00 57.90 54.90 3dfk n TYR 229 Cb 0.22 -2.18 0.24 0.00 -0.31 0.00 0.00 39.34 37.32 3dfk n TYR 229 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3dfk h SER 230 N 5.29 0.44 0.09 7.72 0.02 -1.83 0.34 113.55 125.62 3dfk h SER 230 Ca 0.64 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.69 3dfk h SER 230 Cb 0.45 0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.05 3dfk h SER 230 CO 1.68 0.14 -0.02 0.77 -1.14 0.00 0.00 176.83 178.26 3dfk h SER 231 N 0.54 0.00 -2.06 3.07 4.64 -1.86 -3.40 113.55 114.48 3dfk h SER 231 Ca 0.48 0.00 -0.78 0.00 -0.47 0.00 0.00 61.79 61.02 3dfk h SER 231 Cb 0.76 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.60 3dfk h SER 231 CO -0.41 0.02 1.13 0.00 -0.87 0.00 0.00 176.83 176.70 3dfk n GLN 232 N -3.66 4.60 0.00 4.77 1.13 0.11 -4.31 117.38 120.01 3dfk n GLN 232 Ca -0.03 -4.20 0.00 0.00 -1.94 0.00 0.00 57.00 50.83 3dfk n GLN 232 Cb 0.11 -2.42 0.00 0.00 0.11 0.00 0.00 30.24 28.04 3dfk n GLN 232 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3dfk n VAL 234 N -0.01 0.00 -0.12 5.09 0.31 -1.26 -0.65 118.33 121.69 3dfk n VAL 234 Ca 0.50 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.74 3dfk n VAL 234 Cb 0.26 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.18 3dfk n VAL 234 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3dfk h LEU 235 N 0.00 0.48 -0.42 7.52 5.85 -1.86 -2.75 115.31 124.12 3dfk h LEU 235 Ca 0.00 -0.11 -0.18 0.00 0.84 0.00 0.00 57.88 58.43 3dfk h LEU 235 Cb 0.00 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3dfk h LEU 235 CO 0.00 0.45 -0.75 -0.07 -0.34 0.00 0.00 178.44 177.73 3dfk h LEU 236 N 0.47 0.36 -0.87 2.25 3.38 -1.27 -3.26 115.31 116.36 3dfk h LEU 236 Ca 0.13 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 3dfk h LEU 236 Cb 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3dfk h LEU 236 CO -0.02 0.98 -0.55 0.78 0.09 0.00 0.00 178.44 179.72 3dfk h ASN 237 N 0.19 0.00 -1.79 -0.43 2.35 -1.78 -3.41 115.58 110.72 3dfk h ASN 237 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3dfk h ASN 237 Cb 1.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.70 3dfk h ASN 237 CO 0.12 0.55 0.00 0.61 -1.65 0.00 0.00 177.43 177.06 3dfk n GLY 238 N 0.11 -1.16 0.03 2.83 0.00 -1.04 -2.36 105.19 103.59 3dfk n GLY 238 Ca -0.01 -1.17 0.07 0.00 0.00 0.00 0.00 46.02 44.91 3dfk n GLY 238 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dfk n SER 239 N -1.16 0.08 -0.08 1.61 3.41 -1.26 -2.99 113.62 113.23 3dfk n SER 239 Ca 0.00 -1.60 0.03 0.00 -0.26 0.00 0.00 58.87 57.04 3dfk n SER 239 Cb 0.00 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 63.93 3dfk n SER 239 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dfk n GLU 240 N -0.66 3.48 -3.88 4.33 -0.58 -1.25 -5.02 120.64 117.06 3dfk n GLU 240 Ca 0.10 -0.28 -0.27 0.00 -0.42 0.00 0.00 57.16 56.29 3dfk n GLU 240 Cb 0.06 -0.88 0.02 0.00 -0.57 0.00 0.00 31.44 30.06 3dfk n GLU 240 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3dfk n ASN 241 N -0.67 -2.75 -1.35 1.62 4.13 -1.05 -4.92 115.26 110.27 3dfk n ASN 241 Ca 0.02 -0.85 0.02 0.00 1.68 0.00 0.00 54.58 55.45 3dfk n ASN 241 Cb 0.11 -3.71 0.09 0.00 -1.54 0.00 0.00 39.78 34.73 3dfk n ASN 241 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 3dfk n ASN 242 N -2.92 1.65 0.08 6.41 6.94 -0.99 -4.87 115.26 121.57 3dfk n ASN 242 Ca -0.12 -2.86 -0.12 0.00 -0.02 0.00 0.00 54.58 51.46 3dfk n ASN 242 Cb 0.60 -0.41 -0.05 0.00 -2.36 0.00 0.00 39.78 37.56 3dfk n ASN 242 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3dfk h LEU 243 N 1.26 -0.65 -1.05 -4.53 5.85 -1.79 -1.22 115.31 113.18 3dfk h LEU 243 Ca -0.08 0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3dfk h LEU 243 Cb 1.47 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 3dfk h LEU 243 CO 0.13 -0.30 -0.27 -0.26 -0.34 0.00 0.00 178.44 177.40 3dfk h PHE 244 N -0.39 0.38 -0.70 1.25 0.04 -1.94 -0.58 116.94 115.00 3dfk h PHE 244 Ca 0.04 -0.08 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 3dfk h PHE 244 Cb 0.44 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 3dfk h PHE 244 CO -0.24 0.59 0.43 -0.44 -0.60 0.00 0.00 178.31 178.05 3dfk h ASP 245 N 0.31 0.83 -0.48 2.17 3.32 -1.87 0.05 116.42 120.74 3dfk h ASP 245 Ca 0.05 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3dfk h ASP 245 Cb 0.64 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3dfk h ASP 245 CO 0.05 0.63 -0.20 0.03 -1.72 0.00 0.00 179.24 178.03 3dfk h ARG 246 N 0.95 0.99 -0.57 3.56 3.08 -0.67 -0.50 114.38 121.21 3dfk h ARG 246 Ca 0.25 -0.42 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 3dfk h ARG 246 Cb -0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3dfk h ARG 246 CO -0.05 1.09 0.15 -0.07 -1.07 0.00 0.00 179.97 180.02 3dfk h LEU 247 N 0.84 0.86 -0.53 3.04 3.38 -0.98 -1.19 115.31 120.73 3dfk h LEU 247 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3dfk h LEU 247 Cb 0.78 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3dfk h LEU 247 CO 0.06 0.86 0.28 0.44 0.09 0.00 0.00 178.44 180.18 3dfk h ASP 248 N 0.82 0.68 -0.49 -0.43 3.32 -0.81 -1.67 116.42 117.84 3dfk h ASP 248 Ca 0.18 -0.11 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 3dfk h ASP 248 Cb 0.33 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3dfk h ASP 248 CO -0.00 0.59 0.00 -0.08 -1.72 0.00 0.00 179.24 178.04 3dfk h GLU 249 N 0.71 0.91 -0.37 3.56 4.57 -0.97 0.20 114.58 123.19 3dfk h GLU 249 Ca 0.19 -0.26 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 3dfk h GLU 249 Cb 0.08 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 3dfk h GLU 249 CO -0.03 0.90 0.05 1.25 -1.18 0.00 0.00 179.01 180.00 3dfk h HIS 250 N 0.85 0.68 -0.62 0.92 2.76 -1.04 -0.52 115.15 118.18 3dfk h HIS 250 Ca 0.16 -0.10 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 3dfk h HIS 250 Cb 0.49 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 3dfk h HIS 250 CO 0.03 0.69 0.36 0.00 -1.30 0.00 0.00 177.93 177.70 3dfk h ALA 251 N 0.90 0.79 -0.80 5.26 0.00 -1.06 -2.96 119.26 121.40 3dfk h ALA 251 Ca 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3dfk h ALA 251 Cb 0.39 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3dfk h ALA 251 CO 0.01 0.29 0.41 -0.09 0.00 0.00 0.00 179.25 179.87 3dfk h ARG 252 N 0.84 1.12 -0.60 0.00 2.43 -0.57 -2.00 114.38 115.60 3dfk h ARG 252 Ca 0.22 -0.15 0.10 0.00 -0.81 0.00 0.00 59.98 59.34 3dfk h ARG 252 Cb 0.01 -0.21 -0.07 0.00 -0.42 0.00 0.00 29.97 29.27 3dfk h ARG 252 CO -0.04 0.85 0.21 1.96 -1.51 0.00 0.00 179.97 181.44 3dfk h GLN 253 N 1.11 0.36 -0.00 0.20 4.20 -0.97 -1.31 115.11 118.70 3dfk h GLN 253 Ca 0.28 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.97 3dfk h GLN 253 Cb 0.07 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3dfk h GLN 253 CO -0.04 0.24 -0.08 0.09 -0.67 0.00 0.00 178.83 178.37 3dfk n ASN 254 N -5.02 0.13 -2.90 1.46 3.02 -0.97 -4.26 115.26 106.71 3dfk n ASN 254 Ca 0.09 0.14 -0.11 0.00 -0.03 0.00 0.00 54.58 54.66 3dfk n ASN 254 Cb 0.28 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 39.15 3dfk n ASN 254 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dfk n ALA 255 N -1.39 -0.47 0.30 5.41 0.00 -0.79 -4.99 120.51 118.56 3dfk n ALA 255 Ca 0.09 -1.77 0.13 0.00 0.00 0.00 0.00 53.44 51.90 3dfk n ALA 255 Cb 0.31 -1.24 0.61 0.00 0.00 0.00 0.00 19.45 19.13 3dfk n ALA 255 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3dfk h PRO 256 N 4.61 0.00 -0.56 0.00 0.11 -1.43 -1.41 132.00 133.32 3dfk h PRO 256 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3dfk h PRO 256 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3dfk h PRO 256 CO 0.23 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.74 3dfk n HIS 257 N -2.42 0.74 -4.17 0.65 8.25 -1.26 -5.02 115.22 111.99 3dfk n HIS 257 Ca 0.00 -0.49 -0.08 0.00 -0.26 0.00 0.00 57.72 56.89 3dfk n HIS 257 Cb 0.16 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 3dfk n HIS 257 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dfk n GLY 258 N 1.14 3.95 0.00 -1.41 0.00 -0.53 -5.16 105.19 103.18 3dfk n GLY 258 Ca 0.19 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 44.09 3dfk n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfk n GLY 259 N 2.42 1.75 3.82 -0.02 0.00 -1.26 -4.99 105.19 106.90 3dfk n GLY 259 Ca -0.04 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.26 3dfk n GLY 259 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dfk s TYR 260 N 4.77 3.14 0.19 1.61 5.04 -1.26 -4.65 117.35 126.19 3dfk s TYR 260 Ca 0.00 1.50 -0.23 0.00 -2.44 0.00 0.00 57.07 55.90 3dfk s TYR 260 Cb 0.00 -2.94 0.07 0.00 0.35 0.00 0.00 41.96 39.44 3dfk s TYR 260 CO 0.00 -0.87 0.97 0.20 -1.34 0.00 0.00 175.55 174.51 3dfk s GLY 261 N -2.85 -0.04 -0.01 8.97 0.00 -1.26 -0.65 107.32 111.48 3dfk s GLY 261 Ca 0.62 -0.15 0.02 0.00 0.00 0.00 0.00 44.72 45.22 3dfk s GLY 261 CO 0.35 0.85 -0.08 -0.54 0.00 0.00 0.00 173.10 173.68 3dfk s GLU 262 N -2.79 0.69 -0.10 2.90 2.02 -1.25 -4.76 118.70 115.40 3dfk s GLU 262 Ca 0.16 -0.26 -0.17 0.00 0.02 0.00 0.00 54.97 54.71 3dfk s GLU 262 Cb -0.02 -0.66 -0.04 0.00 0.10 0.00 0.00 34.13 33.50 3dfk s GLU 262 CO 0.04 0.14 0.46 0.99 0.02 0.00 0.00 175.26 176.91 3dfk s THR 263 N -0.04 5.17 0.05 3.63 2.01 -1.26 -1.37 115.64 123.84 3dfk s THR 263 Ca 0.01 0.91 0.01 0.00 0.31 0.00 0.00 61.69 62.94 3dfk s THR 263 Cb -0.05 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 3dfk s THR 263 CO -0.00 0.36 -0.06 0.42 -0.69 0.00 0.00 174.62 174.65 3dfk s THR 264 N 0.38 0.44 0.03 -0.82 -4.23 -0.39 -1.17 115.64 109.89 3dfk s THR 264 Ca 0.25 -1.36 0.06 0.00 -1.18 0.00 0.00 61.69 59.45 3dfk s THR 264 Cb -0.15 -0.93 -0.02 0.00 1.34 0.00 0.00 72.50 72.73 3dfk s THR 264 CO 0.10 -0.62 -0.17 0.26 -0.54 0.00 0.00 174.62 173.66 3dfk s TRP 265 N -2.32 1.46 0.43 3.99 0.51 -0.40 -0.27 118.94 122.33 3dfk s TRP 265 Ca -0.03 -0.34 -0.22 0.00 -2.12 0.00 0.00 56.10 53.39 3dfk s TRP 265 Cb -0.04 -0.88 -0.10 0.00 -0.81 0.00 0.00 33.47 31.65 3dfk s TRP 265 CO -0.03 0.04 1.00 -1.25 -0.51 0.00 0.00 176.95 176.21 3dfk s PRO 266 N -0.99 4.11 -0.19 4.98 0.04 -1.26 -0.36 135.00 141.32 3dfk s PRO 266 Ca 0.04 1.31 -0.06 0.00 0.04 0.00 0.00 61.00 62.33 3dfk s PRO 266 Cb -0.08 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 32.13 3dfk s PRO 266 CO 0.01 -0.16 0.04 0.08 0.04 0.00 0.00 177.00 177.01 3dfk s VAL 267 N -1.94 4.44 0.34 -0.36 1.01 -0.68 -0.67 120.40 122.53 3dfk s VAL 267 Ca 0.62 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.48 3dfk s VAL 267 Cb -0.15 -3.01 -0.06 0.00 0.00 0.00 0.00 36.38 33.16 3dfk s VAL 267 CO 0.20 0.43 0.06 0.68 0.00 0.00 0.00 175.10 176.47 3dfk s VAL 268 N 0.71 1.20 0.23 2.92 -7.23 0.23 -4.60 120.40 113.86 3dfk s VAL 268 Ca 0.02 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.92 3dfk s VAL 268 Cb -0.14 -2.78 -0.09 0.00 0.56 0.00 0.00 36.38 33.94 3dfk s VAL 268 CO 0.02 0.00 0.87 -0.13 -0.31 0.00 0.00 175.10 175.55 3dfk s ARG 269 N -3.87 4.66 0.60 4.82 1.81 -1.26 -0.88 118.95 124.82 3dfk s ARG 269 Ca 0.36 1.30 -0.18 0.00 -1.72 0.00 0.00 55.73 55.49 3dfk s ARG 269 Cb 0.08 -3.15 -0.03 0.00 -0.45 0.00 0.00 34.95 31.41 3dfk s ARG 269 CO 0.15 0.48 1.14 -1.12 -0.68 0.00 0.00 175.30 175.27 3dfk s SER 270 N -1.29 5.39 0.49 0.23 0.01 0.07 -4.77 113.70 113.81 3dfk s SER 270 Ca 0.41 2.15 -0.24 0.00 1.31 0.00 0.00 55.95 59.59 3dfk s SER 270 Cb -0.23 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.36 3dfk s SER 270 CO 0.28 -1.45 1.35 0.47 0.41 0.00 0.00 173.24 174.30 3dfk n ASP 271 N -1.76 2.79 -1.33 2.44 8.00 -1.26 -2.67 116.55 122.75 3dfk n ASP 271 Ca 0.12 1.05 -0.15 0.00 0.71 0.00 0.00 54.79 56.51 3dfk n ASP 271 Cb 0.51 -1.56 -0.05 0.00 -0.02 0.00 0.00 41.12 40.00 3dfk n ASP 271 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3dfk n ASP 272 N -0.41 -4.76 0.00 -2.24 8.00 -1.26 -5.08 116.55 110.80 3dfk n ASP 272 Ca 0.08 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.84 3dfk n ASP 272 Cb 0.42 -3.69 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 3dfk n ASP 272 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27