#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ffk s THR 6 N 0.00 4.93 0.31 1.09 2.01 -1.26 -4.90 115.64 117.81 3ffk s THR 6 Ca 0.00 1.06 -0.28 0.00 0.31 0.00 0.00 61.69 62.78 3ffk s THR 6 Cb 0.00 -3.83 -0.09 0.00 0.01 0.00 0.00 72.50 68.59 3ffk s THR 6 CO 0.00 0.51 1.05 0.00 -0.69 0.00 0.00 174.62 175.48 3ffk s ALA 7 N -0.69 3.30 -0.14 7.40 0.00 -1.26 -4.28 121.76 126.09 3ffk s ALA 7 Ca 0.27 0.77 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 3ffk s ALA 7 Cb -0.18 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 3ffk s ALA 7 CO 0.16 -0.09 0.13 -0.51 0.00 0.00 0.00 175.76 175.45 3ffk s LEU 8 N -1.75 4.29 -0.14 0.00 1.43 0.05 -1.37 118.68 121.18 3ffk s LEU 8 Ca 0.48 0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 53.95 3ffk s LEU 8 Cb -0.27 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 3ffk s LEU 8 CO 0.35 0.35 -0.11 -0.69 0.23 0.00 0.00 176.35 176.48 3ffk s VAL 9 N -0.67 3.17 -0.31 -1.59 1.01 0.20 0.06 120.40 122.28 3ffk s VAL 9 Ca 0.13 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 3ffk s VAL 9 Cb -0.12 -2.35 0.10 0.00 0.00 0.00 0.00 36.38 34.01 3ffk s VAL 9 CO 0.02 0.51 0.11 0.00 0.00 0.00 0.00 175.10 175.75 3ffk s ASP 11 N 1.66 6.22 -0.53 0.00 3.68 0.23 -3.00 116.67 124.93 3ffk s ASP 11 Ca 0.10 -0.96 -0.19 0.00 2.13 0.00 0.00 52.55 53.63 3ffk s ASP 11 Cb -0.17 -2.31 0.07 0.00 -1.45 0.00 0.00 42.92 39.05 3ffk s ASP 11 CO -0.26 -1.00 0.64 0.20 0.13 0.00 0.00 175.17 174.88 3ffk s ASN 12 N 2.94 6.21 0.56 -0.34 0.01 -1.26 -1.20 114.94 121.86 3ffk s ASN 12 Ca 0.16 -1.09 0.09 0.00 -0.71 0.00 0.00 52.86 51.31 3ffk s ASN 12 Cb -0.19 -2.29 0.08 0.00 0.41 0.00 0.00 41.25 39.25 3ffk s ASN 12 CO 0.11 -0.95 0.72 -0.83 -1.51 0.00 0.00 177.10 174.65 3ffk s GLY 13 N 2.97 1.84 0.04 0.66 0.00 -0.95 -4.89 107.32 106.98 3ffk s GLY 13 Ca 0.13 -1.99 -0.24 0.00 0.00 0.00 0.00 44.72 42.62 3ffk s GLY 13 CO 0.10 -1.72 1.50 1.76 0.00 0.00 0.00 173.10 174.74 3ffk h SER 14 N 0.29 0.04 0.00 1.64 0.02 -1.91 -3.39 113.55 110.24 3ffk h SER 14 Ca -0.31 -0.26 -0.26 0.00 -0.84 0.00 0.00 61.79 60.12 3ffk h SER 14 Cb 1.29 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.78 3ffk h SER 14 CO 0.44 0.29 -1.52 0.61 -1.14 0.00 0.00 176.83 175.50 3ffk n GLY 15 N -0.40 -0.74 3.45 -3.77 0.00 -1.26 -4.61 105.19 97.85 3ffk n GLY 15 Ca -0.07 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 3ffk n GLY 15 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ffk s LEU 16 N -7.81 2.60 -0.09 0.99 1.43 -1.26 0.22 118.68 114.75 3ffk s LEU 16 Ca -0.30 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.32 3ffk s LEU 16 Cb 0.08 -1.52 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 3ffk s LEU 16 CO 0.52 0.29 0.27 -0.69 0.23 0.00 0.00 176.35 176.97 3ffk s VAL 17 N -0.84 5.29 -0.25 -1.59 1.01 0.14 -2.23 120.40 121.93 3ffk s VAL 17 Ca 0.13 0.51 0.01 0.00 0.00 0.00 0.00 61.98 62.63 3ffk s VAL 17 Cb -0.10 -3.57 0.07 0.00 0.00 0.00 0.00 36.38 32.77 3ffk s VAL 17 CO 0.03 0.54 -0.04 -0.54 0.00 0.00 0.00 175.10 175.09 3ffk s LYS 18 N -0.58 1.59 0.08 2.72 1.02 -0.34 -1.46 119.74 122.77 3ffk s LYS 18 Ca 0.18 -1.11 0.06 0.00 0.02 0.00 0.00 55.97 55.12 3ffk s LYS 18 Cb -0.14 -2.63 -0.03 0.00 -0.52 0.00 0.00 37.83 34.51 3ffk s LYS 18 CO 0.07 -0.65 -0.16 0.00 -0.92 0.00 0.00 175.35 173.68 3ffk s ALA 19 N 1.34 1.34 0.00 5.17 0.00 0.62 -0.60 121.76 129.63 3ffk s ALA 19 Ca -0.03 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.86 3ffk s ALA 19 Cb -0.19 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.80 3ffk s ALA 19 CO -0.08 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.31 3ffk n GLY 20 N 1.22 -0.84 3.73 0.00 0.00 -0.68 -0.88 105.19 107.75 3ffk n GLY 20 Ca -0.21 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 3ffk n GLY 20 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ffk s PHE 21 N -3.00 3.21 0.22 1.61 0.08 -1.26 -0.63 117.98 118.21 3ffk s PHE 21 Ca 0.00 0.20 -0.30 0.00 0.12 0.00 0.00 56.93 56.95 3ffk s PHE 21 Cb 0.00 -1.76 -0.09 0.00 -0.57 0.00 0.00 43.02 40.61 3ffk s PHE 21 CO 0.00 0.51 1.25 0.00 -0.10 0.00 0.00 175.22 176.88 3ffk s ALA 22 N -1.04 3.48 0.00 5.36 0.00 -0.47 -2.70 121.76 126.39 3ffk s ALA 22 Ca 0.18 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.19 3ffk s ALA 22 Cb -0.12 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.56 3ffk s ALA 22 CO 0.08 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.79 3ffk n GLY 23 N 2.03 0.46 3.86 0.00 0.00 -1.18 -4.80 105.19 105.56 3ffk n GLY 23 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3ffk n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ffk s ASP 24 N -2.52 6.58 0.44 1.61 1.11 -1.10 -5.01 116.67 117.78 3ffk s ASP 24 Ca 0.00 0.68 0.37 0.00 0.18 0.00 0.00 52.55 53.79 3ffk s ASP 24 Cb 0.00 -2.15 1.44 0.00 1.07 0.00 0.00 42.92 43.28 3ffk s ASP 24 CO 0.00 0.35 1.39 0.47 1.18 0.00 0.00 175.17 178.56 3ffk n ASP 25 N 1.79 0.09 -3.63 0.27 10.43 -1.26 -4.82 116.55 119.43 3ffk n ASP 25 Ca -0.16 1.05 -0.04 0.00 2.57 0.00 0.00 54.79 58.21 3ffk n ASP 25 Cb 0.54 -0.52 -0.04 0.00 1.84 0.00 0.00 41.12 42.94 3ffk n ASP 25 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3ffk s ALA 26 N -4.85 -2.09 0.35 2.24 0.00 -1.26 -4.90 121.76 111.26 3ffk s ALA 26 Ca -0.05 1.82 -0.28 0.00 0.00 0.00 0.00 51.96 53.44 3ffk s ALA 26 Cb 0.26 -1.17 -0.10 0.00 0.00 0.00 0.00 23.12 22.10 3ffk s ALA 26 CO 0.76 -0.31 1.36 -1.25 0.00 0.00 0.00 175.76 176.33 3ffk s PRO 27 N -1.24 4.25 0.46 0.00 0.04 -1.26 -4.88 135.00 132.37 3ffk s PRO 27 Ca 0.07 2.32 0.28 0.00 0.04 0.00 0.00 61.00 63.72 3ffk s PRO 27 Cb -0.01 -3.02 0.92 0.00 0.04 0.00 0.00 34.50 32.43 3ffk s PRO 27 CO -0.06 -0.32 1.81 -0.09 0.04 0.00 0.00 177.00 178.39 3ffk h ARG 28 N 3.21 0.00 -3.59 4.56 2.43 -1.69 -3.44 114.38 115.87 3ffk h ARG 28 Ca -0.50 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.31 3ffk h ARG 28 Cb 1.23 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 30.42 3ffk h ARG 28 CO 0.65 0.00 -0.75 0.00 -1.51 0.00 0.00 179.97 178.36 3ffk s ALA 29 N -3.43 0.35 -0.16 2.80 0.00 -0.06 -5.03 121.76 116.24 3ffk s ALA 29 Ca 0.04 0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.13 3ffk s ALA 29 Cb 0.08 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.75 3ffk s ALA 29 CO 0.58 -0.27 -0.09 0.08 0.00 0.00 0.00 175.76 176.07 3ffk s VAL 30 N 1.53 1.30 0.01 0.00 1.01 -1.26 -0.28 120.40 122.72 3ffk s VAL 30 Ca -0.03 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 3ffk s VAL 30 Cb -0.13 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.88 3ffk s VAL 30 CO -0.03 0.25 0.17 0.72 0.00 0.00 0.00 175.10 176.21 3ffk s PHE 31 N 1.57 0.03 0.05 5.22 -0.12 -0.54 -4.97 117.98 119.22 3ffk s PHE 31 Ca 0.02 -0.16 -0.38 0.00 -0.05 0.00 0.00 56.93 56.37 3ffk s PHE 31 Cb -0.14 -0.03 -0.18 0.00 -0.63 0.00 0.00 43.02 42.03 3ffk s PHE 31 CO -0.08 -0.34 1.27 -2.30 -0.05 0.00 0.00 175.22 173.71 3ffk n PRO 32 N 1.17 0.81 -2.18 1.99 -0.02 -1.26 0.26 135.00 135.77 3ffk n PRO 32 Ca -0.21 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.14 3ffk n PRO 32 Cb 0.57 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 3ffk n PRO 32 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ffk n SER 33 N 2.28 4.86 -3.93 2.55 2.88 0.13 -3.75 113.62 118.64 3ffk n SER 33 Ca 0.19 -3.05 -0.10 0.00 -1.33 0.00 0.00 58.87 54.59 3ffk n SER 33 Cb 0.16 -1.52 -0.10 0.00 -0.75 0.00 0.00 64.21 62.00 3ffk n SER 33 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 3ffk s ILE 34 N 1.02 0.12 -0.10 2.46 -4.36 -1.26 -4.15 121.20 114.93 3ffk s ILE 34 Ca 0.42 -1.00 -0.01 0.00 -0.26 0.00 0.00 60.65 59.79 3ffk s ILE 34 Cb 0.11 -0.69 0.03 0.00 1.25 0.00 0.00 42.46 43.16 3ffk s ILE 34 CO -0.02 -0.55 -0.03 -0.69 0.24 0.00 0.00 174.94 173.89 3ffk s VAL 35 N -2.16 0.65 -0.15 8.37 1.01 -0.29 -2.56 120.40 125.28 3ffk s VAL 35 Ca -0.09 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 3ffk s VAL 35 Cb -0.04 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 3ffk s VAL 35 CO -0.03 0.28 0.12 -0.83 0.00 0.00 0.00 175.10 174.64 3ffk s GLY 36 N 1.86 2.07 0.10 4.51 0.00 0.33 -1.89 107.32 114.30 3ffk s GLY 36 Ca 0.05 -0.68 0.06 0.00 0.00 0.00 0.00 44.72 44.15 3ffk s GLY 36 CO -0.07 -0.20 -0.05 0.50 0.00 0.00 0.00 173.10 173.28 3ffk s ARG 37 N -0.47 2.34 0.38 2.90 3.00 -1.16 -0.94 118.95 125.00 3ffk s ARG 37 Ca 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 55.73 54.92 3ffk s ARG 37 Cb -0.12 -2.42 0.00 0.00 0.00 0.00 0.00 34.95 32.41 3ffk s ARG 37 CO 0.02 0.53 0.00 -0.35 0.00 0.00 0.00 175.30 175.49 3ffk n PRO 38 N 0.65 1.81 0.00 3.54 -0.04 -1.26 -0.90 135.00 138.80 3ffk n PRO 38 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 3ffk n PRO 38 Cb 0.52 -0.76 0.00 0.00 -0.04 0.00 0.00 33.50 33.22 3ffk n PRO 38 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3ffk n LYS 50 N 2.28 0.00 -0.07 0.54 5.02 -1.26 -4.66 118.16 120.01 3ffk n LYS 50 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 3ffk n LYS 50 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.88 3ffk n LYS 50 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3ffk n ASP 51 N 0.00 1.70 -4.12 4.39 5.68 -1.26 -5.00 116.55 117.94 3ffk n ASP 51 Ca 0.00 0.04 -0.17 0.00 -0.50 0.00 0.00 54.79 54.16 3ffk n ASP 51 Cb 0.00 -0.37 -0.12 0.00 -1.14 0.00 0.00 41.12 39.49 3ffk n ASP 51 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3ffk s SER 52 N -6.54 1.41 0.02 -1.12 1.04 -1.26 -4.40 113.70 102.84 3ffk s SER 52 Ca -0.25 -0.52 0.03 0.00 0.48 0.00 0.00 55.95 55.68 3ffk s SER 52 Cb 0.08 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 3ffk s SER 52 CO 0.70 -0.07 -0.09 -0.31 0.98 0.00 0.00 173.24 174.46 3ffk s TYR 53 N -1.10 0.77 0.05 5.02 2.02 -0.12 -4.98 117.35 119.00 3ffk s TYR 53 Ca -0.03 -0.29 0.06 0.00 -0.37 0.00 0.00 57.07 56.44 3ffk s TYR 53 Cb -0.09 -0.47 -0.03 0.00 -0.40 0.00 0.00 41.96 40.98 3ffk s TYR 53 CO 0.01 -0.02 -0.16 0.08 -1.57 0.00 0.00 175.55 173.89 3ffk s VAL 54 N -0.71 1.30 0.00 0.71 1.01 -1.26 -0.51 120.40 120.94 3ffk s VAL 54 Ca -0.02 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 60.80 3ffk s VAL 54 Cb -0.06 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.14 3ffk s VAL 54 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.71 3ffk n GLY 55 N 1.67 3.06 0.33 4.51 0.00 -1.06 -3.02 105.19 110.69 3ffk n GLY 55 Ca -0.19 -0.32 0.09 0.00 0.00 0.00 0.00 46.02 45.60 3ffk n GLY 55 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ffk h ASP 56 N 7.83 0.37 -0.36 1.61 3.32 -1.93 -0.20 116.42 127.06 3ffk h ASP 56 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3ffk h ASP 56 Cb 0.00 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3ffk h ASP 56 CO 0.00 0.24 0.16 -0.08 -1.72 0.00 0.00 179.24 177.84 3ffk h GLU 57 N 0.42 0.59 -0.18 3.56 4.81 -1.94 0.48 114.58 122.32 3ffk h GLU 57 Ca 0.21 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 3ffk h GLU 57 Cb 0.29 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 3ffk h GLU 57 CO -0.05 0.49 -0.31 0.00 -0.73 0.00 0.00 179.01 178.41 3ffk h ALA 58 N 1.59 0.28 -0.38 2.92 0.00 -1.10 -2.25 119.26 120.32 3ffk h ALA 58 Ca 0.14 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.69 3ffk h ALA 58 Cb 0.13 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 3ffk h ALA 58 CO -0.01 0.31 0.11 1.96 0.00 0.00 0.00 179.25 181.61 3ffk h GLN 59 N 0.18 0.24 -0.46 0.00 1.08 -0.97 -0.53 115.11 114.66 3ffk h GLN 59 Ca 0.01 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 3ffk h GLN 59 Cb 0.90 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 28.25 3ffk h GLN 59 CO 0.07 0.16 0.10 0.77 -0.95 0.00 0.00 178.83 178.98 3ffk h SER 60 N 0.24 0.64 -0.66 1.46 0.02 -0.94 -2.66 113.55 111.65 3ffk h SER 60 Ca 0.18 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.92 3ffk h SER 60 Cb 0.19 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 3ffk h SER 60 CO -0.21 0.64 0.14 0.29 -1.14 0.00 0.00 176.83 176.55 3ffk n LYS 61 N -4.30 4.37 -0.21 3.45 5.02 -0.85 -4.79 118.16 120.86 3ffk n LYS 61 Ca 0.03 -3.14 -0.06 0.00 -2.02 0.00 0.00 58.31 53.12 3ffk n LYS 61 Cb 0.21 -2.26 -0.05 0.00 -0.02 0.00 0.00 35.03 32.91 3ffk n LYS 61 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3ffk h ARG 62 N 3.38 -0.03 0.00 1.97 2.43 -0.73 -1.60 114.38 119.81 3ffk h ARG 62 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3ffk h ARG 62 Cb 2.18 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.73 3ffk h ARG 62 CO 0.62 -0.02 0.00 0.41 -1.51 0.00 0.00 179.97 179.48 3ffk n GLY 63 N -1.15 0.00 0.00 2.80 0.00 -1.26 -1.10 105.19 104.48 3ffk n GLY 63 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3ffk n GLY 63 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ffk n ILE 64 N -0.68 0.00 -4.15 -0.61 5.41 -0.60 -5.09 119.36 113.63 3ffk n ILE 64 Ca 0.00 -0.37 -0.14 0.00 1.00 0.00 0.00 62.75 63.24 3ffk n ILE 64 Cb 0.00 1.23 -0.07 0.00 -0.71 0.00 0.00 39.64 40.09 3ffk n ILE 64 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 3ffk s LEU 65 N -0.16 1.11 -0.35 1.39 -0.00 -0.26 -4.63 118.68 115.77 3ffk s LEU 65 Ca 0.00 -1.43 -0.10 0.00 -0.00 0.00 0.00 54.13 52.60 3ffk s LEU 65 Cb 0.00 1.02 0.02 0.00 -0.00 0.00 0.00 46.19 47.23 3ffk s LEU 65 CO 0.00 -1.10 0.18 -0.89 -0.00 0.00 0.00 176.35 174.54 3ffk s THR 66 N -3.59 4.47 -0.48 5.48 2.01 -0.08 -4.88 115.64 118.56 3ffk s THR 66 Ca 0.34 -0.79 -0.28 0.00 0.31 0.00 0.00 61.69 61.27 3ffk s THR 66 Cb 0.02 -3.45 0.03 0.00 0.01 0.00 0.00 72.50 69.11 3ffk s THR 66 CO 0.18 -0.15 1.07 -0.76 -0.69 0.00 0.00 174.62 174.27 3ffk s LEU 67 N 1.55 3.75 0.03 4.42 1.02 -1.26 -3.00 118.68 125.18 3ffk s LEU 67 Ca 0.02 0.32 0.02 0.00 0.02 0.00 0.00 54.13 54.51 3ffk s LEU 67 Cb -0.19 -3.41 -0.04 0.00 0.02 0.00 0.00 46.19 42.58 3ffk s LEU 67 CO 0.06 -1.21 0.02 -0.54 0.02 0.00 0.00 176.35 174.70 3ffk s LYS 68 N 4.27 2.78 -0.28 1.70 1.02 -0.79 -4.94 119.74 123.50 3ffk s LYS 68 Ca 0.44 -0.66 -0.09 0.00 0.02 0.00 0.00 55.97 55.68 3ffk s LYS 68 Cb -0.08 -2.67 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 3ffk s LYS 68 CO 0.30 0.60 0.14 0.71 -0.92 0.00 0.00 175.35 176.17 3ffk s TYR 69 N -1.19 3.16 0.01 3.18 1.51 -1.26 -1.13 117.35 121.62 3ffk s TYR 69 Ca 0.23 -0.26 0.26 0.00 -1.01 0.00 0.00 57.07 56.29 3ffk s TYR 69 Cb -0.12 -2.32 0.90 0.00 -0.11 0.00 0.00 41.96 40.31 3ffk s TYR 69 CO 0.14 -0.31 1.81 -1.35 -1.11 0.00 0.00 175.55 174.73 3ffk h PRO 70 N 8.32 0.00 -4.95 -1.71 0.11 -1.88 -3.42 132.00 128.47 3ffk h PRO 70 Ca -0.36 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.10 3ffk h PRO 70 Cb 1.17 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.06 3ffk h PRO 70 CO 0.58 0.14 -0.62 0.42 -0.21 0.00 0.00 178.00 178.31 3ffk s ILE 71 N -3.53 4.31 -0.14 4.15 1.01 -1.26 -1.13 121.20 124.61 3ffk s ILE 71 Ca 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 3ffk s ILE 71 Cb 0.09 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 3ffk s ILE 71 CO 0.62 0.34 -0.05 -1.61 0.00 0.00 0.00 174.94 174.24 3ffk s GLU 72 N 1.62 3.56 -0.96 2.79 2.02 -0.38 -4.62 118.70 122.73 3ffk s GLU 72 Ca 0.06 -0.54 -0.12 0.00 0.02 0.00 0.00 54.97 54.39 3ffk s GLU 72 Cb -0.15 -2.85 0.12 0.00 0.10 0.00 0.00 34.13 31.35 3ffk s GLU 72 CO 0.04 0.28 0.31 0.72 0.02 0.00 0.00 175.26 176.62 3ffk n HIS 73 N 3.41 -1.42 0.00 1.61 8.25 -1.26 -1.18 115.22 124.63 3ffk n HIS 73 Ca -0.18 0.35 0.00 0.00 -0.26 0.00 0.00 57.72 57.64 3ffk n HIS 73 Cb 0.53 -1.36 0.00 0.00 1.12 0.00 0.00 29.99 30.27 3ffk n HIS 73 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ffk n GLY 74 N -0.77 2.85 3.85 -1.41 0.00 -1.26 -4.64 105.19 103.81 3ffk n GLY 74 Ca 0.06 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3ffk n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ffk s ILE 75 N -2.74 5.05 -0.01 -0.61 -1.09 -0.33 -4.40 121.20 117.07 3ffk s ILE 75 Ca 0.00 0.67 -0.30 0.00 -2.23 0.00 0.00 60.65 58.79 3ffk s ILE 75 Cb 0.00 -3.68 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 3ffk s ILE 75 CO 0.00 0.43 1.35 -0.63 -1.23 0.00 0.00 174.94 174.86 3ffk s ILE 76 N -1.25 3.84 -0.00 2.92 1.01 -1.26 -1.24 121.20 125.21 3ffk s ILE 76 Ca 0.29 1.21 0.01 0.00 0.00 0.00 0.00 60.65 62.16 3ffk s ILE 76 Cb -0.15 -3.78 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 3ffk s ILE 76 CO 0.16 0.00 0.01 0.35 0.00 0.00 0.00 174.94 175.46 3ffk n THR 77 N 4.62 0.03 -3.68 2.92 -2.24 -0.28 -4.92 114.28 110.73 3ffk n THR 77 Ca 0.12 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.50 3ffk n THR 77 Cb 0.44 -0.36 -0.09 0.00 -2.10 0.00 0.00 70.33 68.22 3ffk n THR 77 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ffk s ASN 78 N -2.66 5.43 0.17 3.42 3.84 -1.02 -4.99 114.94 119.13 3ffk s ASN 78 Ca -0.00 -2.42 -0.10 0.00 0.21 0.00 0.00 52.86 50.55 3ffk s ASN 78 Cb 0.00 -1.90 0.05 0.00 -0.55 0.00 0.00 41.25 38.85 3ffk s ASN 78 CO 0.03 -0.50 1.61 -0.50 -2.79 0.00 0.00 177.10 174.96 3ffk h TRP 79 N 7.65 1.14 0.09 0.43 4.06 -1.91 -0.91 115.95 126.50 3ffk h TRP 79 Ca -0.08 -0.22 0.02 0.00 2.06 0.00 0.00 58.89 60.67 3ffk h TRP 79 Cb 1.01 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.85 3ffk h TRP 79 CO 0.67 1.04 -0.21 -0.44 -3.56 0.00 0.00 178.44 175.93 3ffk h ASP 80 N 0.92 -0.60 0.37 -3.49 5.19 -1.99 0.20 116.42 117.02 3ffk h ASP 80 Ca 0.16 0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.62 3ffk h ASP 80 Cb 0.61 0.23 -0.00 0.00 0.18 0.00 0.00 39.33 40.35 3ffk h ASP 80 CO 0.04 -0.29 -0.09 0.44 -3.12 0.00 0.00 179.24 176.21 3ffk h ASP 81 N -0.39 0.00 0.22 6.45 3.32 -1.95 -2.12 116.42 121.95 3ffk h ASP 81 Ca 0.03 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.79 3ffk h ASP 81 Cb 0.42 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.00 3ffk h ASP 81 CO -0.13 0.09 -1.24 -0.03 -1.72 0.00 0.00 179.24 176.20 3ffk h MET 82 N 0.00 0.56 -0.88 3.56 4.05 -0.18 -1.15 114.93 120.89 3ffk h MET 82 Ca -0.00 -0.77 0.14 0.00 -0.28 0.00 0.00 59.70 58.79 3ffk h MET 82 Cb 0.30 0.26 -0.09 0.00 -0.80 0.00 0.00 31.60 31.27 3ffk h MET 82 CO 0.01 1.35 0.49 0.93 0.23 0.00 0.00 176.91 179.92 3ffk h GLU 83 N 0.24 0.70 0.00 0.39 5.08 -0.04 -1.59 114.58 119.36 3ffk h GLU 83 Ca -0.18 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 57.95 3ffk h GLU 83 Cb 1.92 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.99 3ffk h GLU 83 CO 0.23 0.46 -0.88 1.57 -1.00 0.00 0.00 179.01 179.39 3ffk h LYS 84 N 0.72 0.00 -0.43 2.33 2.10 -1.31 0.38 116.57 120.35 3ffk h LYS 84 Ca 0.47 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 59.14 3ffk h LYS 84 Cb 0.61 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.91 3ffk h LYS 84 CO -0.33 0.88 0.24 0.82 -2.00 0.00 0.00 179.45 179.06 3ffk h ILE 85 N 0.00 1.01 -0.15 0.07 2.04 -0.88 -0.56 117.51 119.04 3ffk h ILE 85 Ca -0.01 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 3ffk h ILE 85 Cb 1.59 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.16 3ffk h ILE 85 CO 0.11 0.09 -0.07 -0.50 0.00 0.00 0.00 178.15 177.78 3ffk h TRP 86 N 0.48 0.35 -0.85 1.37 6.55 -1.20 -1.32 115.95 121.34 3ffk h TRP 86 Ca 0.18 -0.09 0.18 0.00 0.95 0.00 0.00 58.89 60.12 3ffk h TRP 86 Cb 0.05 -0.08 -0.11 0.00 -0.86 0.00 0.00 29.16 28.15 3ffk h TRP 86 CO -0.08 0.63 0.37 1.25 -1.05 0.00 0.00 178.44 179.56 3ffk h HIS 87 N -0.03 0.62 -0.39 0.49 2.76 -0.81 0.31 115.15 118.10 3ffk h HIS 87 Ca 0.03 0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.16 3ffk h HIS 87 Cb 0.54 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.34 3ffk h HIS 87 CO 0.07 0.02 -0.09 1.25 -1.30 0.00 0.00 177.93 177.87 3ffk h HIS 88 N 0.45 0.74 0.14 5.26 -0.00 -0.89 -1.95 115.15 118.89 3ffk h HIS 88 Ca 0.50 -0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.74 3ffk h HIS 88 Cb 0.86 -0.20 0.00 0.00 -0.00 0.00 0.00 27.41 28.08 3ffk h HIS 88 CO -0.14 0.75 -0.07 1.15 -0.00 0.00 0.00 177.93 179.62 3ffk h THR 89 N 0.63 0.93 0.01 6.26 2.02 0.71 -1.13 112.91 122.34 3ffk h THR 89 Ca 0.11 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 3ffk h THR 89 Cb 0.53 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3ffk h THR 89 CO 0.03 0.07 -0.00 -0.26 0.37 0.00 0.00 175.52 175.73 3ffk h PHE 90 N -0.32 -0.01 0.00 3.16 0.05 -0.94 -1.14 116.94 117.74 3ffk h PHE 90 Ca -0.02 -0.00 -0.08 0.00 3.82 0.00 0.00 57.97 61.69 3ffk h PHE 90 Cb 0.25 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.19 3ffk h PHE 90 CO -0.03 0.55 -1.29 0.66 -0.18 0.00 0.00 178.31 178.02 3ffk n TYR 91 N -4.83 0.89 0.00 -0.55 4.02 -0.74 -1.25 117.16 114.71 3ffk n TYR 91 Ca -0.09 0.28 -0.03 0.00 -0.01 0.00 0.00 57.90 58.05 3ffk n TYR 91 Cb 0.28 -0.99 -0.01 0.00 -0.02 0.00 0.00 39.34 38.60 3ffk n TYR 91 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3ffk n ASN 92 N -2.75 1.32 -0.03 7.72 2.85 -0.85 -3.93 115.26 119.59 3ffk n ASN 92 Ca -0.05 0.19 -0.03 0.00 -0.11 0.00 0.00 54.58 54.58 3ffk n ASN 92 Cb 0.70 -0.45 0.21 0.00 1.24 0.00 0.00 39.78 41.48 3ffk n ASN 92 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3ffk h GLU 93 N -0.31 0.59 0.00 1.20 4.39 -1.22 -3.22 114.58 116.01 3ffk h GLU 93 Ca -0.02 -0.17 -0.11 0.00 0.34 0.00 0.00 59.36 59.40 3ffk h GLU 93 Cb 0.38 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 3ffk h GLU 93 CO -0.01 0.69 -1.69 1.28 -1.16 0.00 0.00 179.01 178.12 3ffk n LEU 94 N -4.20 0.00 -3.56 1.33 4.77 -0.43 -4.84 117.00 110.07 3ffk n LEU 94 Ca 0.01 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.81 3ffk n LEU 94 Cb 0.33 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3ffk n LEU 94 CO 0.41 0.14 -0.04 -1.14 -1.33 0.00 0.00 177.39 175.43 3ffk n ARG 95 N -2.18 -1.40 -3.89 3.23 0.63 -0.47 -4.98 116.66 107.59 3ffk n ARG 95 Ca -0.11 0.94 -0.09 0.00 -0.92 0.00 0.00 57.85 57.67 3ffk n ARG 95 Cb 0.60 -3.56 -0.08 0.00 0.45 0.00 0.00 32.46 29.87 3ffk n ARG 95 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 3ffk s VAL 96 N -3.06 0.14 -0.22 5.15 -7.23 -0.38 -5.00 120.40 109.81 3ffk s VAL 96 Ca 0.06 -1.19 -0.29 0.00 -1.81 0.00 0.00 61.98 58.76 3ffk s VAL 96 Cb -0.03 -1.21 0.00 0.00 0.56 0.00 0.00 36.38 35.70 3ffk s VAL 96 CO 0.85 -0.65 1.16 0.00 -0.31 0.00 0.00 175.10 176.14 3ffk s ALA 97 N -3.43 3.64 0.26 1.32 0.00 -1.26 -4.41 121.76 117.88 3ffk s ALA 97 Ca 0.02 0.27 -0.04 0.00 0.00 0.00 0.00 51.96 52.21 3ffk s ALA 97 Cb 0.03 -3.61 0.31 0.00 0.00 0.00 0.00 23.12 19.85 3ffk s ALA 97 CO -0.09 -1.20 1.83 -1.35 0.00 0.00 0.00 175.76 174.95 3ffk h PRO 98 N 7.97 1.01 0.00 0.00 0.11 -1.90 -2.67 132.00 136.52 3ffk h PRO 98 Ca -0.23 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.71 3ffk h PRO 98 Cb 1.08 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3ffk h PRO 98 CO 0.98 0.83 0.01 -0.85 -0.21 0.00 0.00 178.00 178.77 3ffk n GLU 99 N -4.29 0.00 -0.00 1.05 0.00 -1.25 -1.03 120.64 115.12 3ffk n GLU 99 Ca 0.06 0.06 0.06 0.00 0.00 0.00 0.00 57.16 57.34 3ffk n GLU 99 Cb 0.18 -1.51 -0.07 0.00 0.00 0.00 0.00 31.44 30.05 3ffk n GLU 99 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3ffk n GLU 100 N -1.01 2.91 -4.09 3.44 1.02 -1.00 -4.15 120.64 117.76 3ffk n GLU 100 Ca 0.00 -0.01 -0.24 0.00 -0.02 0.00 0.00 57.16 56.89 3ffk n GLU 100 Cb 0.01 -1.07 -0.17 0.00 -0.02 0.00 0.00 31.44 30.19 3ffk n GLU 100 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3ffk s HIS 101 N -2.16 1.21 0.30 -0.32 3.76 -0.20 -3.49 115.29 114.38 3ffk s HIS 101 Ca 0.04 -0.50 -0.29 0.00 -0.15 0.00 0.00 55.06 54.15 3ffk s HIS 101 Cb 0.09 -1.02 -0.13 0.00 1.11 0.00 0.00 32.58 32.63 3ffk s HIS 101 CO 0.48 -0.37 1.29 -0.35 -0.85 0.00 0.00 174.74 174.94 3ffk n PRO 102 N 4.55 1.97 -4.58 8.40 -0.04 -1.26 -4.33 135.00 139.71 3ffk n PRO 102 Ca -0.16 0.69 -0.32 0.00 -0.04 0.00 0.00 63.50 63.67 3ffk n PRO 102 Cb 0.51 -2.27 -0.16 0.00 -0.04 0.00 0.00 33.50 31.53 3ffk n PRO 102 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3ffk s THR 103 N -0.72 1.94 -0.32 0.52 2.01 -0.74 -0.77 115.64 117.55 3ffk s THR 103 Ca 0.60 -0.90 -0.17 0.00 0.31 0.00 0.00 61.69 61.53 3ffk s THR 103 Cb -0.62 -1.73 -0.01 0.00 0.01 0.00 0.00 72.50 70.15 3ffk s THR 103 CO 0.58 0.53 0.46 -0.22 -0.69 0.00 0.00 174.62 175.27 3ffk s LEU 104 N 0.90 4.28 0.27 4.42 0.20 0.11 -1.96 118.68 126.89 3ffk s LEU 104 Ca -0.06 0.05 0.07 0.00 0.69 0.00 0.00 54.13 54.88 3ffk s LEU 104 Cb -0.15 -2.52 -0.03 0.00 -0.43 0.00 0.00 46.19 43.06 3ffk s LEU 104 CO -0.03 -0.38 0.23 -0.76 -0.29 0.00 0.00 176.35 175.13 3ffk s LEU 105 N 2.25 3.81 0.27 -0.68 1.43 0.46 -0.55 118.68 125.67 3ffk s LEU 105 Ca 0.17 -0.28 0.11 0.00 -1.03 0.00 0.00 54.13 53.10 3ffk s LEU 105 Cb -0.16 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 3ffk s LEU 105 CO 0.12 -0.11 -0.19 0.42 0.23 0.00 0.00 176.35 176.82 3ffk s THR 106 N -2.16 2.35 0.09 5.49 -4.23 -1.16 -0.69 115.64 115.32 3ffk s THR 106 Ca 0.35 -2.37 -0.10 0.00 -1.18 0.00 0.00 61.69 58.38 3ffk s THR 106 Cb -0.08 -2.26 0.01 0.00 1.34 0.00 0.00 72.50 71.51 3ffk s THR 106 CO 0.26 -0.43 0.24 -1.83 -0.54 0.00 0.00 174.62 172.31 3ffk s GLU 107 N -3.53 0.86 0.46 3.99 -1.05 -0.29 -4.58 118.70 114.56 3ffk s GLU 107 Ca 0.29 -0.84 -0.21 0.00 -0.15 0.00 0.00 54.97 54.05 3ffk s GLU 107 Cb -0.04 0.36 -0.09 0.00 -0.44 0.00 0.00 34.13 33.91 3ffk s GLU 107 CO 0.14 -0.28 1.01 0.00 0.95 0.00 0.00 175.26 177.08 3ffk s ALA 108 N -3.60 2.95 0.20 -0.84 0.00 -1.26 -1.18 121.76 118.03 3ffk s ALA 108 Ca 0.03 0.56 -0.10 0.00 0.00 0.00 0.00 51.96 52.45 3ffk s ALA 108 Cb 0.03 -3.23 0.29 0.00 0.00 0.00 0.00 23.12 20.21 3ffk s ALA 108 CO -0.10 -0.17 1.23 -2.30 0.00 0.00 0.00 175.76 174.42 3ffk n PRO 109 N -0.74 -0.12 -1.75 0.00 -0.02 -1.26 -1.07 135.00 130.04 3ffk n PRO 109 Ca 0.08 1.22 -0.29 0.00 -2.02 0.00 0.00 63.50 62.49 3ffk n PRO 109 Cb 0.53 -1.82 0.05 0.00 -0.02 0.00 0.00 33.50 32.23 3ffk n PRO 109 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3ffk n LEU 110 N -5.23 6.20 -4.68 2.45 4.77 -1.26 -5.02 117.00 114.22 3ffk n LEU 110 Ca 0.11 -4.58 -0.42 0.00 -0.03 0.00 0.00 56.01 51.09 3ffk n LEU 110 Cb 0.36 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.78 3ffk n LEU 110 CO -0.10 1.83 1.50 0.21 -1.33 0.00 0.00 177.39 179.50 3ffk s ASN 111 N -2.75 6.43 0.58 -1.43 2.47 -0.23 -4.92 114.94 115.09 3ffk s ASN 111 Ca 0.57 2.74 -0.20 0.00 0.42 0.00 0.00 52.86 56.38 3ffk s ASN 111 Cb 0.45 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.66 3ffk s ASN 111 CO -0.01 -1.01 1.34 -2.65 -3.72 0.00 0.00 177.10 171.04 3ffk n PRO 112 N 6.05 1.50 -0.07 0.43 -0.02 -1.26 -4.85 135.00 136.77 3ffk n PRO 112 Ca 0.18 0.56 -0.07 0.00 -2.02 0.00 0.00 63.50 62.15 3ffk n PRO 112 Cb 0.39 -2.56 -0.01 0.00 -0.02 0.00 0.00 33.50 31.30 3ffk n PRO 112 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3ffk h LYS 113 N 1.13 -0.15 -0.96 -0.52 1.57 -2.00 -2.07 116.57 113.57 3ffk h LYS 113 Ca -0.51 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.45 3ffk h LYS 113 Cb 1.32 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 33.56 3ffk h LYS 113 CO 0.56 -0.10 0.56 0.00 -0.57 0.00 0.00 179.45 179.90 3ffk h ALA 114 N 1.01 1.54 0.72 3.86 0.00 -1.98 0.56 119.26 124.97 3ffk h ALA 114 Ca 0.16 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3ffk h ALA 114 Cb 0.40 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.12 3ffk h ALA 114 CO -0.39 -0.03 -0.35 -0.91 0.00 0.00 0.00 179.25 177.57 3ffk h ASN 115 N 0.75 -0.83 -0.52 0.00 4.21 -1.75 -1.37 115.58 116.07 3ffk h ASN 115 Ca 0.54 0.03 0.05 0.00 1.21 0.00 0.00 56.30 58.13 3ffk h ASN 115 Cb 0.79 0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 38.17 3ffk h ASN 115 CO -0.37 -0.59 0.35 -0.09 -1.29 0.00 0.00 177.43 175.44 3ffk h ARG 116 N -0.97 0.50 -0.17 0.81 2.43 -1.09 -0.59 114.38 115.30 3ffk h ARG 116 Ca -0.10 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.91 3ffk h ARG 116 Cb 0.75 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 3ffk h ARG 116 CO 0.16 0.33 -0.46 0.93 -1.51 0.00 0.00 179.97 179.42 3ffk h GLU 117 N 0.51 0.42 -0.30 0.20 5.08 -0.75 -0.72 114.58 119.03 3ffk h GLU 117 Ca 0.22 -0.23 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 3ffk h GLU 117 Cb 0.23 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3ffk h GLU 117 CO -0.06 0.80 -0.34 0.87 -1.00 0.00 0.00 179.01 179.28 3ffk h LYS 118 N 0.34 0.76 -0.17 2.33 1.79 -0.33 -0.68 116.57 120.61 3ffk h LYS 118 Ca 0.02 -0.41 0.05 0.00 -2.18 0.00 0.00 60.65 58.13 3ffk h LYS 118 Cb 0.94 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.55 3ffk h LYS 118 CO 0.08 1.04 -0.20 1.98 -1.08 0.00 0.00 179.45 181.27 3ffk h MET 119 N 0.52 -0.22 0.01 3.15 4.05 -1.02 0.93 114.93 122.35 3ffk h MET 119 Ca 0.04 0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.49 3ffk h MET 119 Cb 0.92 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.75 3ffk h MET 119 CO 0.08 -0.15 -0.06 1.15 0.23 0.00 0.00 176.91 178.16 3ffk h THR 120 N -0.23 0.84 -0.14 -0.77 2.02 -1.06 -1.91 112.91 111.65 3ffk h THR 120 Ca 0.11 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.34 3ffk h THR 120 Cb 0.40 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.58 3ffk h THR 120 CO -0.30 0.00 -0.26 -0.61 0.37 0.00 0.00 175.52 174.72 3ffk h GLN 121 N -0.12 -0.31 -0.25 6.66 4.15 -0.71 -2.13 115.11 122.40 3ffk h GLN 121 Ca 0.02 0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.49 3ffk h GLN 121 Cb 0.14 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 3ffk h GLN 121 CO -0.06 -0.20 0.07 0.82 -1.93 0.00 0.00 178.83 177.52 3ffk h ILE 122 N -0.32 0.91 -0.99 2.39 2.04 -0.63 0.25 117.51 121.17 3ffk h ILE 122 Ca 0.10 -0.06 0.06 0.00 1.00 0.00 0.00 64.86 65.96 3ffk h ILE 122 Cb 0.48 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 3ffk h ILE 122 CO -0.33 0.03 0.64 0.24 0.00 0.00 0.00 178.15 178.73 3ffk h MET 123 N 0.17 1.15 0.13 2.37 2.86 -1.15 -0.19 114.93 120.27 3ffk h MET 123 Ca 0.11 -0.07 -0.30 0.00 -2.06 0.00 0.00 59.70 57.38 3ffk h MET 123 Cb 0.10 -0.26 -0.00 0.00 0.06 0.00 0.00 31.60 31.50 3ffk h MET 123 CO -0.13 0.76 -1.46 0.74 1.06 0.00 0.00 176.91 177.88 3ffk h PHE 124 N 1.19 0.50 0.00 -0.22 0.04 -0.69 -1.55 116.94 116.21 3ffk h PHE 124 Ca 0.41 -0.36 -0.36 0.00 2.80 0.00 0.00 57.97 60.46 3ffk h PHE 124 Cb 0.11 -0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.17 3ffk h PHE 124 CO -0.00 1.37 -2.29 0.39 -0.60 0.00 0.00 178.31 177.18 3ffk n GLU 125 N -3.49 0.68 -0.10 1.51 1.02 0.82 -3.01 120.64 118.07 3ffk n GLU 125 Ca -0.14 0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 56.93 3ffk n GLU 125 Cb 1.04 -1.56 -0.15 0.00 -0.02 0.00 0.00 31.44 30.76 3ffk n GLU 125 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3ffk n THR 126 N -2.79 1.31 0.41 2.62 -2.24 -0.11 -4.61 114.28 108.88 3ffk n THR 126 Ca -0.31 -0.78 0.09 0.00 -2.27 0.00 0.00 64.05 60.78 3ffk n THR 126 Cb 1.14 -0.57 -0.12 0.00 -2.10 0.00 0.00 70.33 68.68 3ffk n THR 126 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3ffk n PHE 127 N -2.75 0.00 -3.50 4.78 3.01 -1.05 -5.01 117.46 112.95 3ffk n PHE 127 Ca -0.32 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 57.88 3ffk n PHE 127 Cb 1.11 -0.22 0.02 0.00 -0.01 0.00 0.00 39.48 40.38 3ffk n PHE 127 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3ffk n ASN 128 N -1.80 -4.97 -4.73 4.37 4.05 -0.61 -3.83 115.26 107.76 3ffk n ASN 128 Ca -0.00 -0.52 -0.39 0.00 0.45 0.00 0.00 54.58 54.12 3ffk n ASN 128 Cb 0.39 -4.01 0.04 0.00 1.23 0.00 0.00 39.78 37.43 3ffk n ASN 128 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 3ffk n VAL 129 N -4.45 3.66 0.06 3.44 0.24 -1.08 -4.15 118.33 116.05 3ffk n VAL 129 Ca -0.02 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.34 61.75 3ffk n VAL 129 Cb 0.56 -1.61 0.18 0.00 -1.47 0.00 0.00 33.84 31.50 3ffk n VAL 129 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3ffk h PRO 130 N 1.43 0.35 -3.25 7.34 0.13 -1.76 -3.42 132.00 132.82 3ffk h PRO 130 Ca -0.50 -0.17 -0.02 0.00 -0.87 0.00 0.00 66.00 64.44 3ffk h PRO 130 Cb 1.31 -0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.34 3ffk h PRO 130 CO 0.57 0.71 0.06 0.00 -0.23 0.00 0.00 178.00 179.10 3ffk s ALA 131 N -4.17 -1.03 0.30 -0.56 0.00 -1.26 -0.11 121.76 114.93 3ffk s ALA 131 Ca -0.05 -0.13 -0.20 0.00 0.00 0.00 0.00 51.96 51.58 3ffk s ALA 131 Cb 0.13 0.85 0.04 0.00 0.00 0.00 0.00 23.12 24.14 3ffk s ALA 131 CO 0.79 -0.81 0.78 0.00 0.00 0.00 0.00 175.76 176.52 3ffk s MET 132 N -3.86 1.88 -0.15 0.00 0.23 -0.72 -1.80 119.30 114.88 3ffk s MET 132 Ca 0.08 -1.11 -0.29 0.00 -1.03 0.00 0.00 55.69 53.34 3ffk s MET 132 Cb -0.01 0.59 0.09 0.00 -1.53 0.00 0.00 34.83 33.97 3ffk s MET 132 CO -0.04 -0.87 0.80 -0.47 -2.03 0.00 0.00 175.02 172.41 3ffk s TYR 133 N -3.24 -0.60 -0.22 3.16 6.14 -0.83 -1.07 117.35 120.70 3ffk s TYR 133 Ca 0.13 1.20 -0.02 0.00 0.64 0.00 0.00 57.07 59.03 3ffk s TYR 133 Cb -0.05 0.38 0.01 0.00 0.42 0.00 0.00 41.96 42.72 3ffk s TYR 133 CO 0.08 -0.45 -0.09 0.08 0.64 0.00 0.00 175.55 175.80 3ffk s VAL 134 N -0.64 2.85 -0.01 3.14 1.01 -1.26 -0.40 120.40 125.09 3ffk s VAL 134 Ca -0.05 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 3ffk s VAL 134 Cb -0.02 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3ffk s VAL 134 CO 0.04 0.40 0.07 0.00 0.00 0.00 0.00 175.10 175.61 3ffk s ALA 135 N 1.38 3.53 -0.13 5.51 0.00 0.13 -4.96 121.76 127.21 3ffk s ALA 135 Ca 0.04 -0.88 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 3ffk s ALA 135 Cb -0.14 -1.55 -0.01 0.00 0.00 0.00 0.00 23.12 21.42 3ffk s ALA 135 CO -0.06 0.68 1.12 0.42 0.00 0.00 0.00 175.76 177.91 3ffk s ILE 136 N -1.16 4.52 0.18 0.00 1.01 -1.26 -1.13 121.20 123.36 3ffk s ILE 136 Ca 0.22 1.82 -0.19 0.00 0.00 0.00 0.00 60.65 62.50 3ffk s ILE 136 Cb -0.12 -4.17 0.13 0.00 0.01 0.00 0.00 42.46 38.31 3ffk s ILE 136 CO 0.13 -0.07 1.61 1.56 0.00 0.00 0.00 174.94 178.17 3ffk h GLN 137 N 7.49 -0.13 -0.53 2.79 4.20 -1.48 -2.11 115.11 125.33 3ffk h GLN 137 Ca -0.28 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 3ffk h GLN 137 Cb 1.12 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.90 3ffk h GLN 137 CO 0.92 -0.09 0.30 0.00 -0.67 0.00 0.00 178.83 179.29 3ffk h ALA 138 N 1.13 1.52 -0.39 3.87 0.00 -1.92 -2.69 119.26 120.78 3ffk h ALA 138 Ca 0.23 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 3ffk h ALA 138 Cb 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ffk h ALA 138 CO -0.59 0.40 -0.19 0.28 0.00 0.00 0.00 179.25 179.15 3ffk h VAL 139 N 0.74 1.28 -0.84 0.00 2.07 -1.79 -2.44 116.25 115.28 3ffk h VAL 139 Ca 0.19 -1.33 0.05 0.00 0.82 0.00 0.00 66.70 66.44 3ffk h VAL 139 Cb 0.01 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3ffk h VAL 139 CO -0.03 0.44 0.55 -0.07 0.02 0.00 0.00 177.57 178.48 3ffk h LEU 140 N 0.63 0.84 -0.92 2.57 3.38 -1.27 -0.14 115.31 120.41 3ffk h LEU 140 Ca 0.09 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3ffk h LEU 140 Cb 0.75 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 3ffk h LEU 140 CO 0.06 0.55 0.35 0.28 0.09 0.00 0.00 178.44 179.78 3ffk h SER 141 N 0.96 1.03 0.18 -0.43 0.02 -1.34 0.54 113.55 114.52 3ffk h SER 141 Ca 0.35 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 3ffk h SER 141 Cb 0.16 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.43 3ffk h SER 141 CO -0.12 0.89 -0.09 0.25 -1.14 0.00 0.00 176.83 176.62 3ffk h LEU 142 N 1.12 -0.21 -0.53 5.07 5.85 -0.73 -1.38 115.31 124.51 3ffk h LEU 142 Ca 0.27 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.93 3ffk h LEU 142 Cb 0.15 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 3ffk h LEU 142 CO -0.03 0.02 0.16 1.88 -0.34 0.00 0.00 178.44 180.13 3ffk h TYR 143 N -0.43 0.27 -1.01 1.25 0.99 -0.93 -0.09 116.97 117.03 3ffk h TYR 143 Ca -0.02 0.03 0.27 0.00 2.00 0.00 0.00 58.73 61.00 3ffk h TYR 143 Cb 0.33 -0.04 -0.13 0.00 1.00 0.00 0.00 36.73 37.89 3ffk h TYR 143 CO -0.01 0.06 0.59 0.00 -0.00 0.00 0.00 178.16 178.80 3ffk h ALA 144 N 1.38 1.85 -0.00 3.88 0.00 0.32 0.31 119.26 127.01 3ffk h ALA 144 Ca 0.26 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3ffk h ALA 144 Cb 0.32 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ffk h ALA 144 CO -0.30 -0.36 -0.10 -1.13 0.00 0.00 0.00 179.25 177.36 3ffk n SER 145 N -4.92 0.20 -0.93 0.00 3.41 -0.11 -4.94 113.62 106.33 3ffk n SER 145 Ca 0.28 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 3ffk n SER 145 Cb 0.82 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 3ffk n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ffk n GLY 146 N 1.40 0.48 2.99 5.00 0.00 0.11 -5.09 105.19 110.08 3ffk n GLY 146 Ca 0.10 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 3ffk n GLY 146 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ffk s ARG 147 N -3.90 0.20 -0.02 1.61 0.52 -1.05 -5.02 118.95 111.29 3ffk s ARG 147 Ca 0.00 -0.05 0.18 0.00 -0.52 0.00 0.00 55.73 55.34 3ffk s ARG 147 Cb 0.00 0.08 -0.26 0.00 0.52 0.00 0.00 34.95 35.29 3ffk s ARG 147 CO 0.00 -0.03 0.45 0.25 0.02 0.00 0.00 175.30 175.99 3ffk n THR 148 N 2.59 0.00 -4.74 0.02 -2.24 -1.26 -3.66 114.28 104.99 3ffk n THR 148 Ca -0.15 -0.35 -0.24 0.00 -2.27 0.00 0.00 64.05 61.03 3ffk n THR 148 Cb 0.58 0.25 -0.15 0.00 -2.10 0.00 0.00 70.33 68.91 3ffk n THR 148 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3ffk s THR 149 N -3.13 1.25 -4.17 4.28 2.01 -1.26 0.74 115.64 115.36 3ffk s THR 149 Ca -0.04 -0.66 0.00 0.00 0.31 0.00 0.00 61.69 61.30 3ffk s THR 149 Cb 0.12 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.57 3ffk s THR 149 CO 0.74 0.36 0.00 0.61 -0.69 0.00 0.00 174.62 175.63 3ffk n GLY 150 N 2.84 -1.88 2.80 4.40 0.00 0.45 -4.91 105.19 108.90 3ffk n GLY 150 Ca -0.16 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.39 3ffk n GLY 150 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3ffk s ILE 151 N -2.60 0.70 -0.15 -0.61 2.07 0.26 0.61 121.20 121.48 3ffk s ILE 151 Ca 0.00 -0.40 -0.17 0.00 -1.41 0.00 0.00 60.65 58.67 3ffk s ILE 151 Cb 0.00 -0.99 -0.04 0.00 0.13 0.00 0.00 42.46 41.56 3ffk s ILE 151 CO 0.00 0.05 0.45 -0.69 -1.91 0.00 0.00 174.94 172.84 3ffk s VAL 152 N 1.81 5.19 -0.36 4.00 1.01 0.36 -1.68 120.40 130.73 3ffk s VAL 152 Ca 0.01 0.86 -0.17 0.00 0.00 0.00 0.00 61.98 62.69 3ffk s VAL 152 Cb -0.15 -3.78 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 3ffk s VAL 152 CO -0.07 0.29 0.44 -0.22 0.00 0.00 0.00 175.10 175.54 3ffk s LEU 153 N 0.92 4.46 -0.33 3.92 2.96 -0.16 -1.40 118.68 129.05 3ffk s LEU 153 Ca 0.23 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 53.90 3ffk s LEU 153 Cb -0.15 -2.45 0.06 0.00 0.50 0.00 0.00 46.19 44.15 3ffk s LEU 153 CO 0.09 -0.44 0.07 -0.62 -1.32 0.00 0.00 176.35 174.14 3ffk s ASP 154 N 1.76 5.10 -0.16 3.68 3.68 -0.64 0.34 116.67 130.43 3ffk s ASP 154 Ca 0.15 -1.39 -0.01 0.00 2.13 0.00 0.00 52.55 53.43 3ffk s ASP 154 Cb -0.16 -1.78 0.05 0.00 -1.45 0.00 0.00 42.92 39.57 3ffk s ASP 154 CO 0.13 -0.34 -0.01 -0.55 0.13 0.00 0.00 175.17 174.53 3ffk s SER 155 N 1.43 2.65 0.00 -0.34 0.15 0.08 -0.58 113.70 117.09 3ffk s SER 155 Ca -0.01 -0.63 0.00 0.00 0.70 0.00 0.00 55.95 56.01 3ffk s SER 155 Cb -0.20 -0.71 0.00 0.00 -1.71 0.00 0.00 66.02 63.39 3ffk s SER 155 CO -0.01 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.81 3ffk n GLY 156 N 4.98 3.72 0.09 9.45 0.00 -0.75 -0.88 105.19 121.81 3ffk n GLY 156 Ca -0.10 -1.05 -0.04 0.00 0.00 0.00 0.00 46.02 44.84 3ffk n GLY 156 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ffk n ASP 157 N 0.00 0.78 -0.02 1.61 2.03 -1.26 -0.24 116.55 119.45 3ffk n ASP 157 Ca 0.00 0.36 -0.02 0.00 0.52 0.00 0.00 54.79 55.65 3ffk n ASP 157 Cb 0.00 0.18 -0.03 0.00 -0.72 0.00 0.00 41.12 40.55 3ffk n ASP 157 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3ffk n GLY 158 N 1.48 -0.18 3.22 0.27 0.00 -1.26 -1.96 105.19 106.75 3ffk n GLY 158 Ca -0.14 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 3ffk n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk s VAL 159 N -2.09 0.13 -0.07 1.61 0.11 -1.26 -4.29 120.40 114.54 3ffk s VAL 159 Ca -0.02 -1.29 0.01 0.00 -2.93 0.00 0.00 61.98 57.75 3ffk s VAL 159 Cb 0.01 -1.47 0.02 0.00 -1.53 0.00 0.00 36.38 33.41 3ffk s VAL 159 CO 0.15 -0.61 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.33 3ffk s THR 160 N -3.89 0.92 0.07 5.04 2.01 -0.70 -1.80 115.64 117.29 3ffk s THR 160 Ca 0.08 -0.33 0.09 0.00 0.31 0.00 0.00 61.69 61.84 3ffk s THR 160 Cb 0.05 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.65 3ffk s THR 160 CO -0.08 0.31 -0.23 -1.00 -0.69 0.00 0.00 174.62 172.93 3ffk s HIS 161 N 0.92 2.02 -0.28 4.92 3.76 0.26 -0.94 115.29 125.95 3ffk s HIS 161 Ca -0.10 -0.39 -0.10 0.00 -0.15 0.00 0.00 55.06 54.32 3ffk s HIS 161 Cb -0.15 -1.16 -0.03 0.00 1.11 0.00 0.00 32.58 32.34 3ffk s HIS 161 CO 0.01 0.17 0.15 -0.80 -0.85 0.00 0.00 174.74 173.42 3ffk s ASN 162 N -1.52 5.65 -0.29 1.40 -0.87 0.27 -1.61 114.94 117.97 3ffk s ASN 162 Ca 0.09 -0.18 0.01 0.00 -1.57 0.00 0.00 52.86 51.21 3ffk s ASN 162 Cb -0.10 -2.04 0.08 0.00 -0.02 0.00 0.00 41.25 39.18 3ffk s ASN 162 CO 0.03 -0.08 0.03 -0.69 -2.57 0.00 0.00 177.10 173.82 3ffk s VAL 163 N 1.69 1.48 0.13 1.60 1.01 -0.49 -0.99 120.40 124.82 3ffk s VAL 163 Ca 0.06 -1.56 -0.30 0.00 0.00 0.00 0.00 61.98 60.19 3ffk s VAL 163 Cb -0.16 -1.96 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 3ffk s VAL 163 CO 0.08 -0.43 1.00 -2.16 0.00 0.00 0.00 175.10 173.59 3ffk s PRO 164 N 1.35 4.67 -0.02 2.72 0.04 -1.26 -0.48 135.00 142.02 3ffk s PRO 164 Ca 0.04 1.53 0.04 0.00 0.04 0.00 0.00 61.00 62.65 3ffk s PRO 164 Cb -0.18 -3.35 -0.01 0.00 0.04 0.00 0.00 34.50 31.00 3ffk s PRO 164 CO -0.13 0.17 -0.14 0.42 0.04 0.00 0.00 177.00 177.37 3ffk s ILE 165 N -0.05 1.10 -0.06 0.56 1.01 0.20 -2.23 121.20 121.73 3ffk s ILE 165 Ca 0.48 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 60.56 3ffk s ILE 165 Cb -0.25 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.31 3ffk s ILE 165 CO 0.31 0.32 -0.06 -0.47 0.00 0.00 0.00 174.94 175.03 3ffk s TYR 166 N -0.20 1.02 -1.34 3.97 6.14 -0.25 -0.41 117.35 126.28 3ffk s TYR 166 Ca 0.03 -0.36 -0.11 0.00 0.64 0.00 0.00 57.07 57.26 3ffk s TYR 166 Cb -0.07 -0.87 0.09 0.00 0.42 0.00 0.00 41.96 41.54 3ffk s TYR 166 CO -0.00 -0.28 0.54 0.39 0.64 0.00 0.00 175.55 176.84 3ffk n GLU 167 N 4.26 -3.28 0.00 4.97 1.02 -0.80 -2.05 120.64 124.75 3ffk n GLU 167 Ca -0.20 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 3ffk n GLU 167 Cb 0.51 -5.13 0.00 0.00 -0.02 0.00 0.00 31.44 26.80 3ffk n GLU 167 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ffk n GLY 168 N -1.19 0.20 3.09 0.62 0.00 0.23 -4.97 105.19 103.17 3ffk n GLY 168 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 3ffk n GLY 168 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ffk s TYR 169 N -2.00 1.42 0.67 1.61 1.51 -0.87 -5.07 117.35 114.61 3ffk s TYR 169 Ca 0.00 -0.36 -0.14 0.00 -1.01 0.00 0.00 57.07 55.56 3ffk s TYR 169 Cb 0.00 -0.96 0.00 0.00 -0.11 0.00 0.00 41.96 40.90 3ffk s TYR 169 CO 0.00 -0.11 1.09 0.00 -1.11 0.00 0.00 175.55 175.41 3ffk s ALA 170 N -0.01 2.52 -0.53 3.71 0.00 -1.26 -1.09 121.76 125.10 3ffk s ALA 170 Ca -0.01 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.25 3ffk s ALA 170 Cb -0.09 -3.27 0.14 0.00 0.00 0.00 0.00 23.12 19.90 3ffk s ALA 170 CO 0.01 -1.26 0.39 -0.51 0.00 0.00 0.00 175.76 174.39 3ffk s LEU 171 N -5.10 5.65 0.22 0.00 1.43 -0.95 -4.89 118.68 115.04 3ffk s LEU 171 Ca 0.64 -2.21 -0.09 0.00 -1.03 0.00 0.00 54.13 51.43 3ffk s LEU 171 Cb -0.18 -1.97 0.34 0.00 0.03 0.00 0.00 46.19 44.41 3ffk s LEU 171 CO 0.45 -0.59 1.67 -0.65 0.23 0.00 0.00 176.35 177.46 3ffk h PRO 172 N 8.03 0.15 0.00 1.29 0.11 -1.95 -1.16 132.00 138.46 3ffk h PRO 172 Ca -0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3ffk h PRO 172 Cb 1.04 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3ffk h PRO 172 CO 0.80 0.10 0.00 0.45 -0.21 0.00 0.00 178.00 179.13 3ffk h HIS 173 N 0.15 0.00 -0.19 0.65 3.86 -1.95 -2.12 115.15 115.54 3ffk h HIS 173 Ca 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 3ffk h HIS 173 Cb 0.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 3ffk h HIS 173 CO -0.34 0.00 0.00 0.00 0.86 0.00 0.00 177.93 178.45 3ffk n ALA 174 N -1.99 2.42 -1.76 2.45 0.00 -0.45 -4.99 120.51 116.18 3ffk n ALA 174 Ca -0.01 -0.83 -0.39 0.00 0.00 0.00 0.00 53.44 52.20 3ffk n ALA 174 Cb 0.13 -0.66 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 3ffk n ALA 174 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ffk s ILE 175 N -1.39 3.52 -0.07 0.00 1.01 -0.80 -4.68 121.20 118.79 3ffk s ILE 175 Ca 0.27 1.44 0.02 0.00 0.00 0.00 0.00 60.65 62.38 3ffk s ILE 175 Cb 0.17 -3.88 0.02 0.00 0.01 0.00 0.00 42.46 38.77 3ffk s ILE 175 CO 0.24 0.28 -0.11 -0.32 0.00 0.00 0.00 174.94 175.03 3ffk s MET 176 N -1.69 1.64 -0.13 2.79 1.75 -0.17 -4.97 119.30 118.52 3ffk s MET 176 Ca 0.48 -0.38 0.01 0.00 -1.25 0.00 0.00 55.69 54.54 3ffk s MET 176 Cb -0.30 -1.41 -0.01 0.00 2.84 0.00 0.00 34.83 35.96 3ffk s MET 176 CO 0.38 -0.02 -0.16 0.50 -0.65 0.00 0.00 175.02 175.07 3ffk s ARG 177 N 0.81 3.26 -0.20 4.11 3.52 -1.26 -0.57 118.95 128.62 3ffk s ARG 177 Ca -0.12 -0.75 0.01 0.00 -0.13 0.00 0.00 55.73 54.75 3ffk s ARG 177 Cb -0.15 -2.57 0.04 0.00 -1.56 0.00 0.00 34.95 30.71 3ffk s ARG 177 CO 0.02 0.13 -0.12 -1.17 -0.81 0.00 0.00 175.30 173.35 3ffk s LEU 178 N 0.53 2.43 -0.12 -0.88 2.96 -0.11 -5.03 118.68 118.46 3ffk s LEU 178 Ca -0.10 -0.93 -0.06 0.00 -0.22 0.00 0.00 54.13 52.82 3ffk s LEU 178 Cb -0.16 -1.31 -0.24 0.00 0.50 0.00 0.00 46.19 44.98 3ffk s LEU 178 CO 0.04 -0.13 3.36 0.47 -1.32 0.00 0.00 176.35 178.76 3ffk n ASP 179 N 4.64 5.11 -3.75 3.68 10.43 -1.26 -1.72 116.55 133.68 3ffk n ASP 179 Ca -0.15 -2.42 -0.23 0.00 2.57 0.00 0.00 54.79 54.56 3ffk n ASP 179 Cb 0.46 -1.33 -0.17 0.00 1.84 0.00 0.00 41.12 41.92 3ffk n ASP 179 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3ffk s LEU 180 N 0.01 0.58 0.30 0.64 0.20 -1.26 -4.98 118.68 114.17 3ffk s LEU 180 Ca 0.62 -0.14 -0.19 0.00 0.69 0.00 0.00 54.13 55.12 3ffk s LEU 180 Cb 0.29 -0.42 0.05 0.00 -0.43 0.00 0.00 46.19 45.68 3ffk s LEU 180 CO -0.00 -0.21 0.84 0.00 -0.29 0.00 0.00 176.35 176.69 3ffk s ALA 181 N 1.99 -1.09 0.00 5.97 0.00 -1.26 -4.15 121.76 123.22 3ffk s ALA 181 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3ffk s ALA 181 Cb -0.13 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.71 3ffk s ALA 181 CO -0.05 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.10 3ffk n GLY 182 N -0.55 0.00 0.22 0.00 0.00 0.67 -0.13 105.19 105.41 3ffk n GLY 182 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 3ffk n GLY 182 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ffk h ARG 183 N 0.00 0.71 -0.60 1.61 2.43 -1.65 0.26 114.38 117.15 3ffk h ARG 183 Ca 0.00 -0.18 0.12 0.00 -0.81 0.00 0.00 59.98 59.11 3ffk h ARG 183 Cb 0.00 -0.09 -0.09 0.00 -0.42 0.00 0.00 29.97 29.37 3ffk h ARG 183 CO 0.00 0.73 0.08 -0.44 -1.51 0.00 0.00 179.97 178.83 3ffk h ASP 184 N 0.58 -0.10 -0.68 -3.80 5.19 -0.75 -0.50 116.42 116.36 3ffk h ASP 184 Ca 0.14 0.13 -0.05 0.00 -0.62 0.00 0.00 57.03 56.62 3ffk h ASP 184 Cb 0.34 0.20 -0.03 0.00 0.18 0.00 0.00 39.33 40.02 3ffk h ASP 184 CO 0.00 -0.04 0.23 -0.07 -3.12 0.00 0.00 179.24 176.25 3ffk h LEU 185 N 0.20 0.98 0.56 1.55 4.07 -1.27 -0.68 115.31 120.73 3ffk h LEU 185 Ca 0.32 -0.20 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 3ffk h LEU 185 Cb 0.49 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 3ffk h LEU 185 CO -0.45 0.91 -0.44 0.74 -1.08 0.00 0.00 178.44 178.13 3ffk h THR 186 N 0.99 0.13 -0.76 0.22 2.02 -0.23 -1.33 112.91 113.94 3ffk h THR 186 Ca 0.22 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.56 3ffk h THR 186 Cb 0.27 0.13 -0.10 0.00 -1.74 0.00 0.00 68.15 66.71 3ffk h THR 186 CO -0.01 0.00 0.28 0.44 0.37 0.00 0.00 175.52 176.60 3ffk h ASP 187 N -0.97 0.23 -0.90 4.18 3.32 -1.00 0.11 116.42 121.38 3ffk h ASP 187 Ca -0.07 0.12 0.03 0.00 0.02 0.00 0.00 57.03 57.13 3ffk h ASP 187 Cb 0.82 0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.44 3ffk h ASP 187 CO 0.01 0.06 0.59 0.22 -1.72 0.00 0.00 179.24 178.41 3ffk h TYR 188 N 0.40 1.10 0.00 4.55 3.20 -0.90 -1.00 116.97 124.32 3ffk h TYR 188 Ca 0.43 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 62.23 3ffk h TYR 188 Cb 0.69 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3ffk h TYR 188 CO -0.18 0.66 -0.45 1.25 -1.64 0.00 0.00 178.16 177.80 3ffk h LEU 189 N 1.16 0.00 -0.24 2.82 5.85 0.35 -0.41 115.31 124.84 3ffk h LEU 189 Ca 0.35 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.06 3ffk h LEU 189 Cb -0.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3ffk h LEU 189 CO -0.10 0.45 0.11 0.24 -0.34 0.00 0.00 178.44 178.80 3ffk h MET 190 N 0.00 0.36 -0.33 1.25 2.86 -0.31 -1.15 114.93 117.61 3ffk h MET 190 Ca -0.00 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.47 3ffk h MET 190 Cb 0.81 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 3ffk h MET 190 CO 0.06 0.38 -0.23 -0.22 1.06 0.00 0.00 176.91 177.95 3ffk h LYS 191 N 0.25 0.74 -0.32 1.72 3.64 -0.84 -0.88 116.57 120.89 3ffk h LYS 191 Ca 0.08 -0.35 -0.10 0.00 -1.27 0.00 0.00 60.65 59.01 3ffk h LYS 191 Cb 0.14 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3ffk h LYS 191 CO -0.01 0.97 -0.22 0.82 -2.27 0.00 0.00 179.45 178.74 3ffk h ILE 192 N 0.50 1.27 -0.18 2.00 5.03 -1.12 -0.15 117.51 124.86 3ffk h ILE 192 Ca 0.06 -1.27 -0.17 0.00 -0.12 0.00 0.00 64.86 63.37 3ffk h ILE 192 Cb 0.79 1.26 -0.00 0.00 -3.03 0.00 0.00 36.82 35.84 3ffk h ILE 192 CO 0.06 0.41 -0.58 -0.07 -0.68 0.00 0.00 178.15 177.29 3ffk h LEU 193 N 0.54 0.65 -0.55 1.44 4.07 -1.11 -3.17 115.31 117.18 3ffk h LEU 193 Ca 0.08 -0.36 -0.13 0.00 0.08 0.00 0.00 57.88 57.54 3ffk h LEU 193 Cb 0.67 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.20 3ffk h LEU 193 CO 0.05 1.09 -0.64 0.74 -1.08 0.00 0.00 178.44 178.60 3ffk h THR 194 N 0.44 1.33 0.00 0.22 2.02 -0.89 -2.50 112.91 113.52 3ffk h THR 194 Ca 0.00 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 64.88 3ffk h THR 194 Cb 1.14 2.29 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 3ffk h THR 194 CO 0.11 0.63 0.00 -0.33 0.37 0.00 0.00 175.52 176.30 3ffk h GLU 195 N 0.00 0.00 0.00 6.66 5.08 -1.00 -1.47 114.58 123.86 3ffk h GLU 195 Ca -0.01 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 3ffk h GLU 195 Cb 1.23 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 3ffk h GLU 195 CO 0.08 0.00 -0.95 -0.09 -1.00 0.00 0.00 179.01 177.05 3ffk h ARG 196 N 0.00 0.00 0.00 2.33 2.43 -1.46 -3.48 114.38 114.20 3ffk h ARG 196 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ffk h ARG 196 Cb 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3ffk h ARG 196 CO 0.00 0.46 0.00 0.41 -1.51 0.00 0.00 179.97 179.33 3ffk n GLY 197 N 1.31 0.85 3.69 2.80 0.00 -0.55 -5.15 105.19 108.15 3ffk n GLY 197 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 3ffk n GLY 197 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ffk s TYR 198 N -0.71 1.32 -0.24 1.61 4.12 -1.21 -5.01 117.35 117.23 3ffk s TYR 198 Ca 0.00 0.62 0.02 0.00 0.02 0.00 0.00 57.07 57.74 3ffk s TYR 198 Cb 0.00 -3.50 0.06 0.00 -1.52 0.00 0.00 41.96 36.99 3ffk s TYR 198 CO 0.00 -3.25 -0.10 -1.12 0.02 0.00 0.00 175.55 171.10 3ffk s SER 199 N -3.98 4.12 -0.40 2.29 0.01 -1.26 -4.47 113.70 110.01 3ffk s SER 199 Ca 0.69 -1.25 0.08 0.00 1.31 0.00 0.00 55.95 56.78 3ffk s SER 199 Cb -0.11 -1.42 0.26 0.00 0.21 0.00 0.00 66.02 64.95 3ffk s SER 199 CO 0.55 -0.19 0.58 0.49 0.41 0.00 0.00 173.24 175.08 3ffk n PHE 200 N 4.53 -0.66 -0.04 2.43 3.72 -1.26 -4.95 117.46 121.23 3ffk n PHE 200 Ca -0.14 -3.38 -0.10 0.00 -0.05 0.00 0.00 57.45 53.78 3ffk n PHE 200 Cb 0.43 -0.14 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 3ffk n PHE 200 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3ffk n VAL 201 N 1.35 0.80 -1.39 -4.37 0.31 -1.26 -4.75 118.33 109.01 3ffk n VAL 201 Ca 0.20 -0.04 -0.37 0.00 -0.01 0.00 0.00 64.34 64.12 3ffk n VAL 201 Cb 0.55 -1.71 0.06 0.00 -0.91 0.00 0.00 33.84 31.83 3ffk n VAL 201 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3ffk n THR 202 N -3.60 2.50 0.21 2.52 -2.24 -1.26 -4.86 114.28 107.55 3ffk n THR 202 Ca -0.18 -0.43 0.10 0.00 -2.27 0.00 0.00 64.05 61.26 3ffk n THR 202 Cb 0.54 -0.88 0.36 0.00 -2.10 0.00 0.00 70.33 68.25 3ffk n THR 202 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3ffk h THR 203 N -0.06 0.48 -0.17 4.28 1.35 -2.01 -2.68 112.91 114.10 3ffk h THR 203 Ca -0.46 -1.25 0.05 0.00 -0.55 0.00 0.00 66.41 64.20 3ffk h THR 203 Cb 1.36 1.89 -0.07 0.00 -1.73 0.00 0.00 68.15 69.61 3ffk h THR 203 CO 0.46 0.22 -0.35 0.00 -0.25 0.00 0.00 175.52 175.60 3ffk h ALA 204 N 1.78 -0.40 0.00 6.62 0.00 -2.02 -2.65 119.26 122.58 3ffk h ALA 204 Ca -0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3ffk h ALA 204 Cb 0.88 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3ffk h ALA 204 CO 0.03 -0.82 -0.03 0.93 0.00 0.00 0.00 179.25 179.35 3ffk h GLU 205 N -0.40 0.00 -0.92 0.00 5.08 -1.83 -2.71 114.58 113.80 3ffk h GLU 205 Ca 0.10 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3ffk h GLU 205 Cb 0.57 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 3ffk h GLU 205 CO -0.39 0.03 0.61 -0.09 -1.00 0.00 0.00 179.01 178.17 3ffk h ARG 206 N 0.00 1.21 -0.76 2.33 2.43 -1.38 -1.96 114.38 116.25 3ffk h ARG 206 Ca -0.00 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 3ffk h ARG 206 Cb 0.09 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 3ffk h ARG 206 CO 0.00 0.80 0.34 0.93 -1.51 0.00 0.00 179.97 180.53 3ffk h GLU 207 N 1.24 1.10 -0.10 0.20 4.39 -1.56 -1.37 114.58 118.48 3ffk h GLU 207 Ca 0.34 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 3ffk h GLU 207 Cb -0.13 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.32 3ffk h GLU 207 CO -0.08 0.88 0.06 0.82 -1.16 0.00 0.00 179.01 179.53 3ffk h ILE 208 N 1.07 1.05 -0.77 3.13 2.04 -1.59 -3.04 117.51 119.41 3ffk h ILE 208 Ca 0.26 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 3ffk h ILE 208 Cb 0.16 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 3ffk h ILE 208 CO -0.03 0.05 0.45 0.58 0.00 0.00 0.00 178.15 179.20 3ffk h VAL 209 N 0.10 1.22 -0.62 1.67 2.07 -1.11 -0.63 116.25 118.95 3ffk h VAL 209 Ca 0.04 -0.51 0.12 0.00 0.82 0.00 0.00 66.70 67.17 3ffk h VAL 209 Cb 0.03 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 29.91 3ffk h VAL 209 CO -0.01 0.24 0.42 -0.09 0.02 0.00 0.00 177.57 178.15 3ffk h ARG 210 N 1.07 0.32 0.09 1.57 2.43 -1.14 0.39 114.38 119.11 3ffk h ARG 210 Ca 0.28 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 3ffk h ARG 210 Cb -0.02 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3ffk h ARG 210 CO -0.05 0.21 -0.04 0.22 -1.51 0.00 0.00 179.97 178.80 3ffk h ASP 211 N 0.33 -0.10 -0.34 -3.80 1.82 -1.04 -2.35 116.42 110.93 3ffk h ASP 211 Ca 0.30 -0.48 0.07 0.00 -0.39 0.00 0.00 57.03 56.53 3ffk h ASP 211 Cb 0.71 0.03 -0.07 0.00 0.68 0.00 0.00 39.33 40.68 3ffk h ASP 211 CO -0.08 0.50 -0.13 0.40 -1.61 0.00 0.00 179.24 178.33 3ffk h ILE 212 N -0.79 0.57 -0.00 2.25 2.04 -1.05 0.87 117.51 121.40 3ffk h ILE 212 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 3ffk h ILE 212 Cb 0.58 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 3ffk h ILE 212 CO 0.02 0.00 -0.42 0.50 0.00 0.00 0.00 178.15 178.25 3ffk h LYS 213 N -0.06 -0.55 0.00 2.37 3.64 -1.01 0.32 116.57 121.28 3ffk h LYS 213 Ca 0.17 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3ffk h LYS 213 Cb 0.32 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3ffk h LYS 213 CO -0.39 -0.37 0.00 -0.85 -2.27 0.00 0.00 179.45 175.58 3ffk n GLU 214 N -5.45 0.32 -0.09 1.90 0.28 -0.89 -1.69 120.64 115.02 3ffk n GLU 214 Ca -0.06 0.01 -0.11 0.00 -0.16 0.00 0.00 57.16 56.85 3ffk n GLU 214 Cb 0.37 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 31.62 3ffk n GLU 214 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3ffk n LYS 215 N -1.34 1.02 -0.00 3.44 5.02 0.27 -4.77 118.16 121.79 3ffk n LYS 215 Ca 0.12 0.04 0.06 0.00 -2.02 0.00 0.00 58.31 56.51 3ffk n LYS 215 Cb 0.26 -1.43 -0.09 0.00 -0.02 0.00 0.00 35.03 33.75 3ffk n LYS 215 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3ffk n LEU 216 N -2.80 0.13 -4.83 -0.35 4.77 0.11 -5.04 117.00 108.99 3ffk n LEU 216 Ca -0.31 -0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.23 3ffk n LEU 216 Cb 0.99 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.05 3ffk n LEU 216 CO 0.30 0.03 0.68 0.00 -1.33 0.00 0.00 177.39 177.08 3ffk s TYR 218 N -2.52 -0.23 -0.23 0.00 1.13 -0.79 -4.52 117.35 110.19 3ffk s TYR 218 Ca 0.60 -0.08 -0.12 0.00 -1.41 0.00 0.00 57.07 56.06 3ffk s TYR 218 Cb -0.11 0.39 -0.05 0.00 -1.10 0.00 0.00 41.96 41.10 3ffk s TYR 218 CO 0.29 -0.85 0.24 0.08 -2.51 0.00 0.00 175.55 172.80 3ffk s VAL 219 N -3.83 5.30 0.32 -3.49 1.01 -0.31 -3.70 120.40 115.70 3ffk s VAL 219 Ca 0.06 0.34 -0.28 0.00 0.00 0.00 0.00 61.98 62.10 3ffk s VAL 219 Cb -0.00 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 3ffk s VAL 219 CO -0.07 0.30 1.08 0.00 0.00 0.00 0.00 175.10 176.40 3ffk s ALA 220 N 1.24 3.29 0.14 5.51 0.00 -1.26 -4.42 121.76 126.25 3ffk s ALA 220 Ca 0.11 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.72 3ffk s ALA 220 Cb -0.14 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 3ffk s ALA 220 CO 0.06 -0.17 1.78 1.25 0.00 0.00 0.00 175.76 178.69 3ffk h LEU 221 N 3.36 0.38 -7.55 0.00 5.85 -1.96 -3.39 115.31 112.00 3ffk h LEU 221 Ca -0.47 -0.03 -0.51 0.00 0.84 0.00 0.00 57.88 57.71 3ffk h LEU 221 Cb 1.21 -0.10 -0.38 0.00 0.37 0.00 0.00 40.66 41.77 3ffk h LEU 221 CO 0.65 0.30 -0.78 -0.62 -0.34 0.00 0.00 178.44 177.65 3ffk s ASP 222 N -5.52 2.33 0.06 1.25 -1.08 -1.26 -4.82 116.67 107.62 3ffk s ASP 222 Ca -0.13 -0.43 -0.32 0.00 -0.52 0.00 0.00 52.55 51.15 3ffk s ASP 222 Cb 0.10 -0.72 -0.18 0.00 -1.46 0.00 0.00 42.92 40.66 3ffk s ASP 222 CO 0.71 -0.19 1.54 0.15 0.52 0.00 0.00 175.17 177.91 3ffk h PHE 223 N 8.21 -0.80 -0.27 -5.34 3.57 -2.00 -2.81 116.94 117.50 3ffk h PHE 223 Ca -0.23 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.23 3ffk h PHE 223 Cb 1.12 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 40.11 3ffk h PHE 223 CO 0.44 -0.48 0.10 0.93 -2.23 0.00 0.00 178.31 177.08 3ffk h GLU 224 N -0.92 0.37 -0.45 1.11 4.39 -1.98 -0.96 114.58 116.14 3ffk h GLU 224 Ca -0.09 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.45 3ffk h GLU 224 Cb 0.68 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.24 3ffk h GLU 224 CO 0.15 0.31 -0.21 -0.91 -1.16 0.00 0.00 179.01 177.19 3ffk h ASN 225 N 0.37 0.93 -0.48 1.42 2.35 -1.99 -1.91 115.58 116.28 3ffk h ASN 225 Ca 0.09 -0.34 -0.10 0.00 -0.55 0.00 0.00 56.30 55.40 3ffk h ASN 225 Cb 0.08 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3ffk h ASN 225 CO -0.01 1.10 -0.10 -0.33 -1.65 0.00 0.00 177.43 176.45 3ffk h GLU 226 N 0.79 0.90 -0.54 0.81 4.39 -1.11 -2.14 114.58 117.69 3ffk h GLU 226 Ca 0.11 -0.34 0.11 0.00 0.34 0.00 0.00 59.36 59.58 3ffk h GLU 226 Cb 0.76 -0.06 -0.11 0.00 -0.10 0.00 0.00 28.75 29.25 3ffk h GLU 226 CO 0.06 0.99 -0.22 0.52 -1.16 0.00 0.00 179.01 179.20 3ffk h MET 227 N 0.75 -0.09 -0.22 2.33 2.86 -1.01 0.35 114.93 119.91 3ffk h MET 227 Ca 0.12 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 3ffk h MET 227 Cb 0.64 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 3ffk h MET 227 CO 0.04 -0.06 -0.03 0.00 1.06 0.00 0.00 176.91 177.92 3ffk h ALA 228 N 1.29 1.53 -0.07 6.32 0.00 -1.16 -2.07 119.26 125.10 3ffk h ALA 228 Ca 0.25 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3ffk h ALA 228 Cb 0.48 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ffk h ALA 228 CO -0.60 0.34 -0.13 1.15 0.00 0.00 0.00 179.25 180.01 3ffk h THR 229 N 0.33 1.41 -0.03 0.00 2.02 -0.58 -3.04 112.91 113.02 3ffk h THR 229 Ca 0.07 -1.42 0.01 0.00 0.77 0.00 0.00 66.41 65.84 3ffk h THR 229 Cb 0.27 2.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.87 3ffk h THR 229 CO 0.01 0.40 0.03 0.00 0.37 0.00 0.00 175.52 176.33 3ffk h ALA 230 N 0.49 1.55 0.00 6.16 0.00 -0.03 -1.86 119.26 125.57 3ffk h ALA 230 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ffk h ALA 230 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3ffk h ALA 230 CO 0.03 -0.04 -0.63 0.00 0.00 0.00 0.00 179.25 178.61 3ffk h ALA 231 N 1.96 0.61 0.00 0.00 0.00 -1.30 -3.40 119.26 117.14 3ffk h ALA 231 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 3ffk h ALA 231 Cb 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3ffk h ALA 231 CO -0.00 0.00 -1.45 0.43 0.00 0.00 0.00 179.25 178.23 3ffk n SER 232 N -2.29 1.88 -4.51 0.00 7.64 -0.72 -5.02 113.62 110.59 3ffk n SER 232 Ca 0.03 0.42 -0.31 0.00 1.01 0.00 0.00 58.87 60.02 3ffk n SER 232 Cb 0.47 -0.93 -0.07 0.00 -1.01 0.00 0.00 64.21 62.67 3ffk n SER 232 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3ffk s SER 233 N -6.88 3.69 -0.68 6.43 1.04 -1.11 -5.08 113.70 111.12 3ffk s SER 233 Ca -0.30 -1.70 0.05 0.00 0.48 0.00 0.00 55.95 54.49 3ffk s SER 233 Cb 0.07 0.61 0.23 0.00 0.10 0.00 0.00 66.02 67.03 3ffk s SER 233 CO 0.54 -0.93 0.70 -1.54 0.98 0.00 0.00 173.24 172.99 3ffk n SER 234 N -1.34 3.64 -0.02 7.02 3.41 -1.26 -4.68 113.62 120.39 3ffk n SER 234 Ca -0.15 -3.37 -0.02 0.00 -0.26 0.00 0.00 58.87 55.06 3ffk n SER 234 Cb 0.66 -0.73 -0.04 0.00 -0.26 0.00 0.00 64.21 63.85 3ffk n SER 234 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ffk n SER 235 N 1.23 3.76 0.07 4.04 3.41 -1.26 -4.49 113.62 120.38 3ffk n SER 235 Ca 0.27 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 59.00 3ffk n SER 235 Cb 0.39 0.66 0.46 0.00 -0.26 0.00 0.00 64.21 65.47 3ffk n SER 235 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ffk n LEU 236 N -2.15 0.49 -4.76 1.04 4.32 -1.26 -4.89 117.00 109.79 3ffk n LEU 236 Ca -0.08 0.57 -0.40 0.00 -0.02 0.00 0.00 56.01 56.08 3ffk n LEU 236 Cb 0.63 -0.44 -0.04 0.00 -1.62 0.00 0.00 43.42 41.95 3ffk n LEU 236 CO 0.11 -0.23 0.78 -1.61 -1.22 0.00 0.00 177.39 175.22 3ffk s GLU 237 N -3.11 4.65 0.24 3.23 2.02 -1.26 -4.81 118.70 119.65 3ffk s GLU 237 Ca 0.10 1.79 0.05 0.00 0.02 0.00 0.00 54.97 56.92 3ffk s GLU 237 Cb 0.13 -3.19 -0.05 0.00 0.10 0.00 0.00 34.13 31.12 3ffk s GLU 237 CO 0.50 0.23 -0.05 0.15 0.02 0.00 0.00 175.26 176.10 3ffk s LYS 238 N -1.44 1.39 0.30 1.61 -0.14 -0.76 -4.98 119.74 115.73 3ffk s LYS 238 Ca 0.44 -1.69 0.10 0.00 -1.36 0.00 0.00 55.97 53.47 3ffk s LYS 238 Cb -0.32 -0.88 -0.05 0.00 -1.68 0.00 0.00 37.83 34.90 3ffk s LYS 238 CO 0.41 0.00 -0.08 -1.12 -0.76 0.00 0.00 175.35 173.80 3ffk s SER 239 N -3.35 3.99 -0.17 2.83 0.01 -1.26 -0.00 113.70 115.75 3ffk s SER 239 Ca 0.27 -0.96 -0.09 0.00 1.31 0.00 0.00 55.95 56.48 3ffk s SER 239 Cb 0.04 -0.49 0.06 0.00 0.21 0.00 0.00 66.02 65.84 3ffk s SER 239 CO 0.09 -0.09 0.40 -0.47 0.41 0.00 0.00 173.24 173.59 3ffk s TYR 240 N -2.49 -0.63 -0.13 2.43 6.14 0.63 -4.96 117.35 118.33 3ffk s TYR 240 Ca 0.32 1.31 -0.17 0.00 0.64 0.00 0.00 57.07 59.17 3ffk s TYR 240 Cb -0.03 0.26 -0.04 0.00 0.42 0.00 0.00 41.96 42.57 3ffk s TYR 240 CO 0.18 -0.37 0.44 -2.00 0.64 0.00 0.00 175.55 174.44 3ffk s GLU 241 N 1.66 4.32 0.31 4.97 2.12 -1.26 -0.34 118.70 130.47 3ffk s GLU 241 Ca -0.08 0.37 -0.17 0.00 0.36 0.00 0.00 54.97 55.45 3ffk s GLU 241 Cb -0.09 -3.44 -0.09 0.00 0.26 0.00 0.00 34.13 30.77 3ffk s GLU 241 CO -0.13 0.16 0.76 -0.51 -0.54 0.00 0.00 175.26 175.00 3ffk s LEU 242 N 0.65 4.13 0.27 2.70 1.43 -0.52 -4.97 118.68 122.36 3ffk s LEU 242 Ca 0.24 1.37 -0.03 0.00 -1.03 0.00 0.00 54.13 54.68 3ffk s LEU 242 Cb -0.15 -4.00 0.54 0.00 0.03 0.00 0.00 46.19 42.61 3ffk s LEU 242 CO 0.09 -0.16 1.43 -2.65 0.23 0.00 0.00 176.35 175.29 3ffk n PRO 243 N -0.09 -0.08 0.00 1.29 -0.02 -1.26 0.31 135.00 135.16 3ffk n PRO 243 Ca 0.02 1.40 0.10 0.00 -2.02 0.00 0.00 63.50 63.01 3ffk n PRO 243 Cb 0.53 -2.15 0.58 0.00 -0.02 0.00 0.00 33.50 32.44 3ffk n PRO 243 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3ffk n ASP 244 N -5.43 0.00 0.00 2.55 5.75 -1.26 -4.89 116.55 113.27 3ffk n ASP 244 Ca 0.17 -0.47 0.00 0.00 -0.01 0.00 0.00 54.79 54.48 3ffk n ASP 244 Cb 0.56 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 3ffk n ASP 244 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ffk n GLY 245 N 0.31 2.72 3.76 6.12 0.00 0.15 -5.08 105.19 113.17 3ffk n GLY 245 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3ffk n GLY 245 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3ffk s GLN 246 N -0.45 4.73 -0.23 1.61 -2.07 -1.26 -4.71 119.66 117.27 3ffk s GLN 246 Ca 0.00 1.55 -0.18 0.00 -1.82 0.00 0.00 55.36 54.91 3ffk s GLN 246 Cb 0.00 -3.15 -0.03 0.00 -1.09 0.00 0.00 33.01 28.74 3ffk s GLN 246 CO 0.00 0.37 0.49 0.08 -1.32 0.00 0.00 175.29 174.91 3ffk s VAL 247 N -1.26 5.10 -0.07 3.63 1.01 -1.26 -1.44 120.40 126.11 3ffk s VAL 247 Ca 0.44 0.86 -0.13 0.00 0.00 0.00 0.00 61.98 63.15 3ffk s VAL 247 Cb -0.26 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 3ffk s VAL 247 CO 0.33 0.14 0.32 0.27 0.00 0.00 0.00 175.10 176.16 3ffk s ILE 248 N 1.95 5.22 -0.14 2.22 -4.36 0.54 -4.93 121.20 121.69 3ffk s ILE 248 Ca 0.21 0.63 -0.03 0.00 -0.26 0.00 0.00 60.65 61.20 3ffk s ILE 248 Cb -0.15 -3.62 -0.03 0.00 1.25 0.00 0.00 42.46 39.90 3ffk s ILE 248 CO 0.09 0.53 -0.04 0.28 0.24 0.00 0.00 174.94 176.05 3ffk s THR 249 N -0.63 3.90 -0.06 8.37 -1.32 -1.26 -0.27 115.64 124.37 3ffk s THR 249 Ca 0.20 -0.36 0.05 0.00 -1.21 0.00 0.00 61.69 60.37 3ffk s THR 249 Cb -0.15 -2.69 -0.00 0.00 -1.51 0.00 0.00 72.50 68.15 3ffk s THR 249 CO 0.09 0.51 -0.21 -0.51 -2.21 0.00 0.00 174.62 172.29 3ffk s ILE 250 N 0.15 1.79 0.00 5.08 2.07 1.00 -4.99 121.20 126.29 3ffk s ILE 250 Ca -0.01 -0.90 0.00 0.00 -1.41 0.00 0.00 60.65 58.32 3ffk s ILE 250 Cb -0.14 -1.53 0.00 0.00 0.13 0.00 0.00 42.46 40.92 3ffk s ILE 250 CO 0.03 0.50 0.00 0.61 -1.91 0.00 0.00 174.94 174.17 3ffk n GLY 251 N 3.17 1.09 0.29 1.50 0.00 -1.26 -1.82 105.19 108.16 3ffk n GLY 251 Ca -0.18 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.01 3ffk n GLY 251 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3ffk h ASN 252 N 0.00 0.00 0.31 1.61 7.08 -1.90 -2.36 115.58 120.31 3ffk h ASN 252 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 3ffk h ASN 252 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 3ffk h ASN 252 CO 0.00 0.04 0.00 1.05 -2.08 0.00 0.00 177.43 176.44 3ffk h GLU 253 N 0.00 0.00 -0.53 4.14 9.09 -1.97 -0.80 114.58 124.51 3ffk h GLU 253 Ca -0.00 0.00 0.11 0.00 0.05 0.00 0.00 59.36 59.52 3ffk h GLU 253 Cb 0.27 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.27 3ffk h GLU 253 CO 0.01 0.00 -0.11 0.00 0.05 0.00 0.00 179.01 178.96 3ffk h ARG 254 N 0.00 0.02 0.00 1.06 3.08 -1.74 -2.74 114.38 114.06 3ffk h ARG 254 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ffk h ARG 254 Cb 0.15 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3ffk h ARG 254 CO 0.00 0.01 -1.09 1.97 -1.07 0.00 0.00 179.97 179.79 3ffk n PHE 255 N -5.36 0.00 0.01 3.04 1.16 -0.80 -1.88 117.46 113.63 3ffk n PHE 255 Ca 0.05 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.58 3ffk n PHE 255 Cb 0.28 -0.13 0.15 0.00 -1.61 0.00 0.00 39.48 38.17 3ffk n PHE 255 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3ffk h ARG 256 N 0.00 0.51 0.01 3.97 3.08 -1.14 -2.64 114.38 118.17 3ffk h ARG 256 Ca 0.00 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 3ffk h ARG 256 Cb 0.50 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 3ffk h ARG 256 CO 0.00 0.78 -0.00 0.00 -1.07 0.00 0.00 179.97 179.68 3ffk n PRO 258 N -2.15 0.14 -0.09 0.00 -0.04 -1.25 -1.89 135.00 129.72 3ffk n PRO 258 Ca -0.00 0.14 0.22 0.00 -0.04 0.00 0.00 63.50 63.82 3ffk n PRO 258 Cb 0.00 -1.50 0.67 0.00 -0.04 0.00 0.00 33.50 32.64 3ffk n PRO 258 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3ffk h GLU 259 N 0.00 0.07 -1.07 0.54 4.57 -1.42 -1.85 114.58 115.41 3ffk h GLU 259 Ca 0.00 -0.00 0.29 0.00 -1.18 0.00 0.00 59.36 58.46 3ffk h GLU 259 Cb 0.26 -0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.75 3ffk h GLU 259 CO 0.00 0.04 0.71 1.15 -1.18 0.00 0.00 179.01 179.73 3ffk h THR 260 N 0.07 0.49 -0.48 0.32 2.02 -1.47 0.16 112.91 114.01 3ffk h THR 260 Ca 0.33 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.48 3ffk h THR 260 Cb 1.23 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 3ffk h THR 260 CO -0.03 0.05 0.32 -0.07 0.37 0.00 0.00 175.52 176.17 3ffk h LEU 261 N 0.29 0.35 0.01 2.58 3.38 -1.57 -0.84 115.31 119.50 3ffk h LEU 261 Ca 0.59 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 58.25 3ffk h LEU 261 Cb 1.70 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.32 3ffk h LEU 261 CO -0.23 0.23 -1.89 0.49 0.09 0.00 0.00 178.44 177.13 3ffk n PHE 262 N -4.47 0.77 -3.35 1.13 3.72 0.18 -0.41 117.46 115.03 3ffk n PHE 262 Ca 0.06 0.27 -0.26 0.00 -0.05 0.00 0.00 57.45 57.48 3ffk n PHE 262 Cb 0.26 -1.14 -0.08 0.00 -0.94 0.00 0.00 39.48 37.58 3ffk n PHE 262 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ffk n GLN 263 N -3.00 1.85 0.26 -1.08 6.02 0.31 -3.55 117.38 118.19 3ffk n GLN 263 Ca -0.21 -4.14 0.14 0.00 -0.01 0.00 0.00 57.00 52.78 3ffk n GLN 263 Cb 1.08 -1.88 0.76 0.00 1.02 0.00 0.00 30.24 31.22 3ffk n GLN 263 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 3ffk h PRO 264 N 4.15 0.00 0.00 -1.09 0.11 -1.41 -0.19 132.00 133.57 3ffk h PRO 264 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3ffk h PRO 264 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 3ffk h PRO 264 CO 0.70 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.36 3ffk n SER 265 N -2.60 0.47 0.23 -2.05 3.41 -1.20 -1.88 113.62 110.00 3ffk n SER 265 Ca -0.02 0.68 0.06 0.00 -0.26 0.00 0.00 58.87 59.33 3ffk n SER 265 Cb 0.21 -0.76 0.53 0.00 -0.26 0.00 0.00 64.21 63.93 3ffk n SER 265 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 3ffk h PHE 266 N 0.00 0.01 -0.24 7.33 0.05 -1.36 -0.52 116.94 122.22 3ffk h PHE 266 Ca 0.00 -0.00 -0.09 0.00 3.82 0.00 0.00 57.97 61.70 3ffk h PHE 266 Cb 0.12 -0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.01 3ffk h PHE 266 CO 0.00 0.15 -0.10 0.44 -0.18 0.00 0.00 178.31 178.62 3ffk n ILE 267 N -4.37 2.35 -1.09 -0.55 -5.35 -0.95 -4.99 119.36 104.42 3ffk n ILE 267 Ca -0.02 -2.52 -0.03 0.00 -0.27 0.00 0.00 62.75 59.90 3ffk n ILE 267 Cb 0.21 -0.28 -0.01 0.00 -1.74 0.00 0.00 39.64 37.81 3ffk n ILE 267 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ffk n GLY 268 N -1.01 0.61 3.82 3.28 0.00 -0.20 -5.02 105.19 106.66 3ffk n GLY 268 Ca 0.26 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 3ffk n GLY 268 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ffk s MET 269 N -1.89 3.97 0.36 1.61 -1.94 -0.79 -4.91 119.30 115.70 3ffk s MET 269 Ca 0.00 0.39 0.09 0.00 -1.71 0.00 0.00 55.69 54.46 3ffk s MET 269 Cb 0.00 -3.25 0.67 0.00 2.01 0.00 0.00 34.83 34.26 3ffk s MET 269 CO 0.00 0.61 1.84 0.93 -0.01 0.00 0.00 175.02 178.39 3ffk h GLU 270 N 5.03 0.22 -6.92 2.03 4.39 -1.96 -3.18 114.58 114.19 3ffk h GLU 270 Ca -0.50 -0.07 -0.55 0.00 0.34 0.00 0.00 59.36 58.58 3ffk h GLU 270 Cb 1.21 -0.02 0.18 0.00 -0.10 0.00 0.00 28.75 30.02 3ffk h GLU 270 CO 0.64 0.45 0.01 0.43 -1.16 0.00 0.00 179.01 179.38 3ffk n SER 271 N -4.18 0.13 -4.79 1.42 7.64 -1.26 -4.98 113.62 107.60 3ffk n SER 271 Ca -0.01 0.63 -0.32 0.00 1.01 0.00 0.00 58.87 60.18 3ffk n SER 271 Cb 0.35 -1.37 0.06 0.00 -1.01 0.00 0.00 64.21 62.23 3ffk n SER 271 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ffk s ALA 272 N -1.89 2.48 0.93 -0.43 0.00 -1.26 -4.53 121.76 117.07 3ffk s ALA 272 Ca 0.71 0.32 -0.13 0.00 0.00 0.00 0.00 51.96 52.86 3ffk s ALA 272 Cb -0.33 -3.26 0.15 0.00 0.00 0.00 0.00 23.12 19.68 3ffk s ALA 272 CO 0.52 -1.37 1.16 0.20 0.00 0.00 0.00 175.76 176.28 3ffk s GLY 273 N -3.18 1.60 0.36 0.00 0.00 -1.23 -4.71 107.32 100.16 3ffk s GLY 273 Ca 0.62 -0.66 0.06 0.00 0.00 0.00 0.00 44.72 44.75 3ffk s GLY 273 CO 0.49 -0.05 1.95 0.16 0.00 0.00 0.00 173.10 175.65 3ffk h ILE 274 N -1.57 1.01 -0.01 0.90 3.07 -0.99 0.30 117.51 120.22 3ffk h ILE 274 Ca -0.49 -0.26 0.02 0.00 1.55 0.00 0.00 64.86 65.69 3ffk h ILE 274 Cb 1.32 0.19 -0.03 0.00 -0.27 0.00 0.00 36.82 38.03 3ffk h ILE 274 CO 0.57 0.14 -0.12 1.12 -1.05 0.00 0.00 178.15 178.80 3ffk h HIS 275 N 0.75 -0.31 -0.66 0.16 2.07 -1.92 -1.25 115.15 113.99 3ffk h HIS 275 Ca 0.32 0.01 -0.06 0.00 -2.85 0.00 0.00 60.37 57.80 3ffk h HIS 275 Cb 0.30 0.14 -0.03 0.00 2.57 0.00 0.00 27.41 30.39 3ffk h HIS 275 CO -0.00 -0.19 0.19 0.93 -3.07 0.00 0.00 177.93 175.79 3ffk h GLU 276 N -0.20 1.04 -0.16 5.12 5.08 -1.51 -1.98 114.58 121.96 3ffk h GLU 276 Ca 0.05 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.08 3ffk h GLU 276 Cb 0.27 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3ffk h GLU 276 CO -0.13 0.92 -0.32 1.79 -1.00 0.00 0.00 179.01 180.27 3ffk h THR 277 N 0.97 1.27 0.24 1.13 1.35 -0.91 0.45 112.91 117.40 3ffk h THR 277 Ca 0.21 -1.32 -0.01 0.00 -0.55 0.00 0.00 66.41 64.74 3ffk h THR 277 Cb 0.32 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3ffk h THR 277 CO -0.00 0.40 -0.11 0.74 -0.25 0.00 0.00 175.52 176.30 3ffk h THR 278 N 0.28 0.81 0.16 6.82 2.02 -0.94 -0.57 112.91 121.49 3ffk h THR 278 Ca 0.04 -0.26 0.01 0.00 0.77 0.00 0.00 66.41 66.97 3ffk h THR 278 Cb 0.70 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 68.03 3ffk h THR 278 CO 0.05 0.06 -0.44 0.22 0.37 0.00 0.00 175.52 175.78 3ffk h TYR 279 N -0.45 -1.24 -0.97 3.16 3.20 -1.06 0.03 116.97 119.64 3ffk h TYR 279 Ca -0.03 0.03 0.17 0.00 3.14 0.00 0.00 58.73 62.03 3ffk h TYR 279 Cb 0.34 0.52 -0.09 0.00 1.54 0.00 0.00 36.73 39.04 3ffk h TYR 279 CO -0.02 -0.54 0.61 -0.91 -1.64 0.00 0.00 178.16 175.65 3ffk h ASN 280 N -0.70 0.74 0.18 -2.11 -0.26 -0.89 0.17 115.58 112.71 3ffk h ASN 280 Ca 0.01 0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.80 3ffk h ASN 280 Cb 0.71 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 3ffk h ASN 280 CO -0.23 0.33 -0.09 -1.28 -1.06 0.00 0.00 177.43 175.10 3ffk h SER 281 N 0.76 -0.21 -0.84 5.81 0.87 -0.35 -1.72 113.55 117.86 3ffk h SER 281 Ca 0.52 -0.12 0.14 0.00 -1.23 0.00 0.00 61.79 61.09 3ffk h SER 281 Cb 0.80 0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 62.72 3ffk h SER 281 CO -0.29 -0.00 0.44 0.40 -0.53 0.00 0.00 176.83 176.85 3ffk h ILE 282 N -0.41 0.75 0.00 2.23 2.04 0.23 -1.52 117.51 120.82 3ffk h ILE 282 Ca -0.03 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.62 3ffk h ILE 282 Cb 0.32 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 3ffk h ILE 282 CO 0.04 0.12 0.00 0.23 0.00 0.00 0.00 178.15 178.54 3ffk n MET 283 N -4.86 0.16 -0.13 2.37 2.81 0.46 -2.05 117.12 115.89 3ffk n MET 283 Ca 0.17 0.30 0.06 0.00 -1.81 0.00 0.00 57.70 56.42 3ffk n MET 283 Cb 0.42 -1.76 0.20 0.00 -0.71 0.00 0.00 33.22 31.37 3ffk n MET 283 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3ffk n LYS 284 N -2.06 1.67 -4.27 0.03 5.02 -0.57 -4.89 118.16 113.08 3ffk n LYS 284 Ca 0.04 -1.04 -0.23 0.00 -2.02 0.00 0.00 58.31 55.06 3ffk n LYS 284 Cb 0.28 -1.27 -0.08 0.00 -0.02 0.00 0.00 35.03 33.95 3ffk n LYS 284 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ffk n ASP 286 N -0.95 1.64 0.23 0.00 9.92 -1.26 -4.83 116.55 121.29 3ffk n ASP 286 Ca -0.05 1.19 0.17 0.00 -0.53 0.00 0.00 54.79 55.56 3ffk n ASP 286 Cb 0.60 -1.33 0.85 0.00 -0.64 0.00 0.00 41.12 40.60 3ffk n ASP 286 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 3ffk h ILE 287 N 2.13 0.47 0.00 0.53 2.10 -1.95 -2.20 117.51 118.60 3ffk h ILE 287 Ca -0.41 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.50 3ffk h ILE 287 Cb 1.33 0.87 -0.00 0.00 -1.09 0.00 0.00 36.82 37.92 3ffk h ILE 287 CO 0.61 0.00 -0.12 0.44 -1.08 0.00 0.00 178.15 178.01 3ffk h ASP 288 N 0.00 0.00 -0.08 2.19 5.19 -2.01 -3.24 116.42 118.46 3ffk h ASP 288 Ca 0.07 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 3ffk h ASP 288 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 3ffk h ASP 288 CO -0.00 0.12 0.00 2.30 -3.12 0.00 0.00 179.24 178.54 3ffk n ILE 289 N -3.37 0.42 -0.05 0.35 -5.35 -0.83 -4.69 119.36 105.84 3ffk n ILE 289 Ca -0.01 -0.71 -0.13 0.00 -0.27 0.00 0.00 62.75 61.64 3ffk n ILE 289 Cb 0.31 0.86 -0.07 0.00 -1.74 0.00 0.00 39.64 39.00 3ffk n ILE 289 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 3ffk h ARG 290 N 1.12 0.31 -0.93 6.28 3.08 -1.59 -2.66 114.38 119.99 3ffk h ARG 290 Ca 0.00 -0.14 0.18 0.00 0.07 0.00 0.00 59.98 60.09 3ffk h ARG 290 Cb 0.40 -0.01 -0.17 0.00 0.08 0.00 0.00 29.97 30.27 3ffk h ARG 290 CO 0.00 0.65 -0.25 1.17 -1.07 0.00 0.00 179.97 180.47 3ffk n LYS 291 N -4.64 -0.10 -0.10 0.04 4.81 -1.26 -0.58 118.16 116.33 3ffk n LYS 291 Ca -0.06 1.45 -0.11 0.00 -0.87 0.00 0.00 58.31 58.73 3ffk n LYS 291 Cb 0.31 -2.17 -0.03 0.00 0.02 0.00 0.00 35.03 33.15 3ffk n LYS 291 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3ffk h ASP 292 N 0.00 0.53 0.20 3.14 3.45 -1.86 -2.90 116.42 118.97 3ffk h ASP 292 Ca 0.43 -0.31 0.01 0.00 0.43 0.00 0.00 57.03 57.59 3ffk h ASP 292 Cb 0.67 -0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 39.26 3ffk h ASP 292 CO -0.96 0.71 -0.42 -0.07 -1.57 0.00 0.00 179.24 176.94 3ffk h LEU 293 N 0.33 -1.21 -0.84 1.55 4.07 -0.48 -2.40 115.31 116.33 3ffk h LEU 293 Ca 0.09 0.13 0.21 0.00 0.08 0.00 0.00 57.88 58.38 3ffk h LEU 293 Cb 0.44 0.44 -0.13 0.00 1.08 0.00 0.00 40.66 42.49 3ffk h LEU 293 CO 0.02 -0.51 0.19 1.88 -1.08 0.00 0.00 178.44 178.94 3ffk h TYR 294 N -0.70 0.28 -0.01 1.13 0.05 -0.92 -0.73 116.97 116.07 3ffk h TYR 294 Ca 0.01 0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.83 3ffk h TYR 294 Cb 0.70 0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.45 3ffk h TYR 294 CO -0.33 -0.19 -0.01 0.00 -1.05 0.00 0.00 178.16 176.59 3ffk n ALA 295 N -2.73 2.65 -3.08 3.88 0.00 -1.07 -3.10 120.51 117.06 3ffk n ALA 295 Ca 0.19 -0.29 -0.18 0.00 0.00 0.00 0.00 53.44 53.15 3ffk n ALA 295 Cb 0.61 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 3ffk n ALA 295 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ffk n ASN 296 N -0.57 1.45 -4.47 0.00 3.02 -0.28 -4.26 115.26 110.15 3ffk n ASN 296 Ca 0.22 -3.08 -0.43 0.00 -0.03 0.00 0.00 54.58 51.25 3ffk n ASN 296 Cb 0.21 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 38.73 3ffk n ASN 296 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3ffk s ASN 297 N -2.67 6.26 -0.12 6.41 3.04 -1.07 -0.57 114.94 126.22 3ffk s ASN 297 Ca 0.40 -0.74 -0.09 0.00 0.04 0.00 0.00 52.86 52.47 3ffk s ASN 297 Cb 0.35 -2.36 -0.04 0.00 -1.54 0.00 0.00 41.25 37.66 3ffk s ASN 297 CO -0.08 -1.10 0.18 -0.69 -3.04 0.00 0.00 177.10 172.37 3ffk s VAL 298 N 3.31 5.43 -0.19 -5.21 1.01 -0.68 0.43 120.40 124.50 3ffk s VAL 298 Ca 0.22 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.42 3ffk s VAL 298 Cb -0.17 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 3ffk s VAL 298 CO 0.14 0.58 0.07 -0.04 0.00 0.00 0.00 175.10 175.85 3ffk s MET 299 N -0.75 3.97 0.01 2.72 1.00 0.00 -0.99 119.30 125.26 3ffk s MET 299 Ca 0.15 -0.34 0.04 0.00 0.00 0.00 0.00 55.69 55.54 3ffk s MET 299 Cb -0.12 -3.24 -0.01 0.00 0.00 0.00 0.00 34.83 31.45 3ffk s MET 299 CO 0.04 0.24 -0.14 0.45 0.00 0.00 0.00 175.02 175.62 3ffk s SER 300 N 0.45 1.64 0.00 3.03 0.15 0.15 -4.53 113.70 114.59 3ffk s SER 300 Ca 0.04 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.37 3ffk s SER 300 Cb -0.12 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 3ffk s SER 300 CO 0.00 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.18 3ffk n GLY 301 N 2.48 2.14 0.39 9.45 0.00 -0.43 -0.74 105.19 118.47 3ffk n GLY 301 Ca -0.15 -1.81 0.18 0.00 0.00 0.00 0.00 46.02 44.24 3ffk n GLY 301 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ffk h GLY 302 N 0.00 0.59 1.23 -0.02 0.00 -1.73 -1.15 103.07 101.99 3ffk h GLY 302 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3ffk h GLY 302 CO 0.00 0.03 -0.06 2.41 0.00 0.00 0.00 176.54 178.93 3ffk n THR 303 N -4.46 0.00 1.04 4.70 -1.04 -0.06 -2.56 114.28 111.90 3ffk n THR 303 Ca 0.15 -0.03 0.08 0.00 -2.04 0.00 0.00 64.05 62.22 3ffk n THR 303 Cb 0.61 -0.31 0.27 0.00 -1.82 0.00 0.00 70.33 69.08 3ffk n THR 303 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3ffk n THR 304 N -1.12 0.35 0.34 12.58 -2.24 -0.43 -4.37 114.28 119.38 3ffk n THR 304 Ca 0.15 -0.42 0.13 0.00 -2.27 0.00 0.00 64.05 61.64 3ffk n THR 304 Cb 0.25 0.31 0.36 0.00 -2.10 0.00 0.00 70.33 69.15 3ffk n THR 304 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3ffk h MET 305 N 2.18 0.00 -6.17 -0.78 2.86 -1.65 -3.47 114.93 107.89 3ffk h MET 305 Ca 0.00 0.00 -0.73 0.00 -2.06 0.00 0.00 59.70 56.91 3ffk h MET 305 Cb 0.49 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.19 3ffk h MET 305 CO 0.00 0.00 0.54 0.66 1.06 0.00 0.00 176.91 179.17 3ffk n TYR 306 N -2.83 1.55 -1.56 -0.22 4.01 -1.26 -4.91 117.16 111.93 3ffk n TYR 306 Ca 0.03 0.72 -0.48 0.00 -0.16 0.00 0.00 57.90 58.01 3ffk n TYR 306 Cb 0.43 -2.32 -0.03 0.00 -0.31 0.00 0.00 39.34 37.11 3ffk n TYR 306 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3ffk n PRO 307 N 3.27 1.06 0.00 -0.72 -0.02 -1.26 -2.53 135.00 134.80 3ffk n PRO 307 Ca 0.22 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3ffk n PRO 307 Cb 0.14 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3ffk n PRO 307 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ffk n GLY 308 N 1.76 2.81 0.35 -1.23 0.00 -1.26 -1.16 105.19 106.46 3ffk n GLY 308 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3ffk n GLY 308 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3ffk h ILE 309 N 0.00 1.14 -0.44 -0.61 2.10 -1.71 -1.99 117.51 116.00 3ffk h ILE 309 Ca 0.00 -0.40 -0.04 0.00 1.08 0.00 0.00 64.86 65.50 3ffk h ILE 309 Cb 0.00 -0.13 -0.02 0.00 -1.09 0.00 0.00 36.82 35.59 3ffk h ILE 309 CO 0.00 0.21 0.12 0.00 -1.08 0.00 0.00 178.15 177.40 3ffk h ALA 310 N 1.40 0.57 -0.15 0.18 0.00 -1.91 -0.79 119.26 118.57 3ffk h ALA 310 Ca 0.38 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3ffk h ALA 310 Cb 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3ffk h ALA 310 CO -0.13 0.24 -0.13 -0.44 0.00 0.00 0.00 179.25 178.79 3ffk h ASP 311 N 0.57 0.22 0.37 0.00 3.32 -1.91 0.02 116.42 119.01 3ffk h ASP 311 Ca 0.14 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 3ffk h ASP 311 Cb 0.29 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3ffk h ASP 311 CO -0.00 0.38 -0.18 0.03 -1.72 0.00 0.00 179.24 177.74 3ffk h ARG 312 N 0.22 -0.48 -0.56 3.56 2.47 -1.03 -1.57 114.38 116.99 3ffk h ARG 312 Ca 0.05 0.03 0.11 0.00 -1.26 0.00 0.00 59.98 58.91 3ffk h ARG 312 Cb 0.37 0.11 -0.11 0.00 -1.65 0.00 0.00 29.97 28.69 3ffk h ARG 312 CO 0.02 -0.17 -0.20 0.52 0.56 0.00 0.00 179.97 180.70 3ffk h MET 313 N -0.85 -0.07 -0.82 0.04 2.86 -1.04 0.46 114.93 115.52 3ffk h MET 313 Ca -0.05 0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.77 3ffk h MET 313 Cb 0.54 0.01 -0.11 0.00 0.06 0.00 0.00 31.60 32.10 3ffk h MET 313 CO 0.08 -0.04 0.30 0.37 1.06 0.00 0.00 176.91 178.68 3ffk h GLN 314 N -0.07 0.36 0.09 1.72 5.75 -0.97 -1.09 115.11 120.89 3ffk h GLN 314 Ca 0.26 -0.02 -0.29 0.00 -0.15 0.00 0.00 58.65 58.45 3ffk h GLN 314 Cb 0.47 -0.08 0.03 0.00 1.07 0.00 0.00 27.48 28.97 3ffk h GLN 314 CO -0.61 0.24 -1.18 -0.22 -2.65 0.00 0.00 178.83 174.41 3ffk h LYS 315 N 0.37 0.65 -0.00 1.69 3.64 0.20 -3.08 116.57 120.03 3ffk h LYS 315 Ca 0.48 -0.81 -0.19 0.00 -1.27 0.00 0.00 60.65 58.86 3ffk h LYS 315 Cb 0.84 0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 3ffk h LYS 315 CO -0.50 1.36 -0.86 0.93 -2.27 0.00 0.00 179.45 178.12 3ffk h GLU 316 N 0.30 0.20 -0.18 1.90 4.39 0.18 -2.68 114.58 118.70 3ffk h GLU 316 Ca -0.17 -0.21 -0.11 0.00 0.34 0.00 0.00 59.36 59.20 3ffk h GLU 316 Cb 1.84 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.55 3ffk h GLU 316 CO 0.23 0.94 -0.33 0.82 -1.16 0.00 0.00 179.01 179.50 3ffk h ILE 317 N 0.12 1.34 -0.48 3.13 1.08 -1.35 -3.05 117.51 118.30 3ffk h ILE 317 Ca -0.04 -1.57 0.07 0.00 -0.39 0.00 0.00 64.86 62.93 3ffk h ILE 317 Cb 1.47 1.90 -0.03 0.00 -3.07 0.00 0.00 36.82 37.10 3ffk h ILE 317 CO 0.13 0.48 0.32 0.74 -0.69 0.00 0.00 178.15 179.13 3ffk h THR 318 N 0.20 0.95 -0.20 -0.27 2.02 -1.47 0.59 112.91 114.71 3ffk h THR 318 Ca 0.01 -0.13 -0.17 0.00 0.77 0.00 0.00 66.41 66.90 3ffk h THR 318 Cb 0.92 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 3ffk h THR 318 CO 0.07 0.07 -0.55 0.00 0.37 0.00 0.00 175.52 175.48 3ffk h ALA 319 N 1.75 0.65 0.00 6.16 0.00 -1.49 -3.29 119.26 123.04 3ffk h ALA 319 Ca 0.21 -0.51 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 3ffk h ALA 319 Cb 0.37 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3ffk h ALA 319 CO -0.05 0.69 -0.94 -0.07 0.00 0.00 0.00 179.25 178.87 3ffk h LEU 320 N 0.47 0.00-10.34 0.00 3.38 -0.92 -3.47 115.31 104.42 3ffk h LEU 320 Ca 0.01 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.47 3ffk h LEU 320 Cb 1.11 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.93 3ffk h LEU 320 CO 0.11 0.80 0.40 0.00 0.09 0.00 0.00 178.44 179.84 3ffk s ALA 321 N -2.80 2.93 -0.66 1.53 0.00 0.19 -4.94 121.76 118.02 3ffk s ALA 321 Ca 0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 3ffk s ALA 321 Cb 0.09 -3.12 -0.05 0.00 0.00 0.00 0.00 23.12 20.04 3ffk s ALA 321 CO 0.80 -0.88 1.90 -0.35 0.00 0.00 0.00 175.76 177.22 3ffk n PRO 322 N -2.84 1.60 0.00 0.00 -0.04 -1.26 -4.87 135.00 127.59 3ffk n PRO 322 Ca 0.07 -1.18 0.00 0.00 -0.04 0.00 0.00 63.50 62.35 3ffk n PRO 322 Cb 0.54 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.71 3ffk n PRO 322 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3ffk n SER 323 N 4.18 0.00 0.25 3.54 3.41 -1.26 -3.01 113.62 120.73 3ffk n SER 323 Ca 0.34 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 59.06 3ffk n SER 323 Cb 0.14 0.00 0.67 0.00 -0.26 0.00 0.00 64.21 64.76 3ffk n SER 323 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3ffk h THR 324 N 0.00 0.70 -3.11 6.66 1.35 -1.97 -3.46 112.91 113.08 3ffk h THR 324 Ca 0.00 -0.57 -0.57 0.00 -0.55 0.00 0.00 66.41 64.72 3ffk h THR 324 Cb 0.00 1.35 0.10 0.00 -1.73 0.00 0.00 68.15 67.87 3ffk h THR 324 CO 0.00 0.14 0.54 0.80 -0.25 0.00 0.00 175.52 176.74 3ffk n MET 325 N -3.80 2.10 -3.30 4.72 0.00 -1.16 -4.97 117.12 110.71 3ffk n MET 325 Ca -0.02 0.74 -0.38 0.00 0.00 0.00 0.00 57.70 58.04 3ffk n MET 325 Cb 0.24 -2.34 -0.07 0.00 0.00 0.00 0.00 33.22 31.05 3ffk n MET 325 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 3ffk s LYS 326 N -1.42 4.24 -0.03 2.12 2.47 -1.26 -4.98 119.74 120.88 3ffk s LYS 326 Ca 0.59 0.39 0.05 0.00 -1.56 0.00 0.00 55.97 55.44 3ffk s LYS 326 Cb -0.59 -3.51 -0.01 0.00 -1.46 0.00 0.00 37.83 32.26 3ffk s LYS 326 CO 0.58 -0.01 -0.19 0.42 0.16 0.00 0.00 175.35 176.32 3ffk s ILE 327 N 1.18 1.52 -0.00 5.43 1.01 -1.26 -3.83 121.20 125.25 3ffk s ILE 327 Ca 0.24 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 60.11 3ffk s ILE 327 Cb -0.15 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.04 3ffk s ILE 327 CO 0.09 0.43 -0.02 -0.75 0.00 0.00 0.00 174.94 174.70 3ffk s LYS 328 N -0.18 0.18 -0.15 2.79 2.20 -1.18 -4.95 119.74 118.44 3ffk s LYS 328 Ca 0.01 -0.06 0.01 0.00 -0.36 0.00 0.00 55.97 55.57 3ffk s LYS 328 Cb -0.10 -0.19 0.01 0.00 -1.51 0.00 0.00 37.83 36.03 3ffk s LYS 328 CO 0.01 0.03 -0.18 0.42 -0.36 0.00 0.00 175.35 175.26 3ffk s ILE 329 N 0.06 2.37 -0.32 5.43 -1.09 -1.26 -2.61 121.20 123.79 3ffk s ILE 329 Ca -0.00 -0.87 -0.10 0.00 -2.23 0.00 0.00 60.65 57.45 3ffk s ILE 329 Cb -0.02 -1.98 -0.00 0.00 -1.58 0.00 0.00 42.46 38.87 3ffk s ILE 329 CO -0.00 0.53 0.16 -0.63 -1.23 0.00 0.00 174.94 173.76 3ffk s ILE 330 N 0.89 4.58 -0.64 2.92 1.09 0.17 -4.98 121.20 125.22 3ffk s ILE 330 Ca -0.05 -0.48 0.05 0.00 -1.10 0.00 0.00 60.65 59.07 3ffk s ILE 330 Cb -0.15 -3.36 0.15 0.00 -1.06 0.00 0.00 42.46 38.04 3ffk s ILE 330 CO -0.02 0.03 0.41 0.00 -0.10 0.00 0.00 174.94 175.26 3ffk s ALA 331 N 1.60 3.63 0.48 9.38 0.00 -1.26 -0.82 121.76 134.78 3ffk s ALA 331 Ca 0.04 -3.64 -0.24 0.00 0.00 0.00 0.00 51.96 48.13 3ffk s ALA 331 Cb -0.17 -2.16 -0.07 0.00 0.00 0.00 0.00 23.12 20.71 3ffk s ALA 331 CO 0.06 -2.07 1.40 -2.30 0.00 0.00 0.00 175.76 172.86 3ffk n PRO 332 N 2.38 2.05 -0.09 0.00 -0.02 -1.26 -4.91 135.00 133.17 3ffk n PRO 332 Ca 0.14 0.74 0.01 0.00 -2.02 0.00 0.00 63.50 62.37 3ffk n PRO 332 Cb 0.34 -2.60 0.31 0.00 -0.02 0.00 0.00 33.50 31.53 3ffk n PRO 332 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3ffk h PRO 333 N 1.99 0.72 -0.88 0.52 0.11 -1.99 -2.38 132.00 130.09 3ffk h PRO 333 Ca -0.51 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.46 3ffk h PRO 333 Cb 1.28 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 3ffk h PRO 333 CO 0.60 0.54 0.09 -0.85 -0.21 0.00 0.00 178.00 178.16 3ffk n GLU 334 N -4.40 2.32 0.00 1.05 0.00 -1.26 -4.58 120.64 113.78 3ffk n GLU 334 Ca 0.04 -1.32 0.08 0.00 0.00 0.00 0.00 57.16 55.96 3ffk n GLU 334 Cb 0.11 -1.73 0.44 0.00 0.00 0.00 0.00 31.44 30.26 3ffk n GLU 334 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 3ffk n ARG 335 N 0.12 0.35 0.20 3.44 1.85 -0.90 -0.92 116.66 120.80 3ffk n ARG 335 Ca 0.16 0.08 0.05 0.00 -1.00 0.00 0.00 57.85 57.14 3ffk n ARG 335 Cb 0.76 -1.50 0.43 0.00 -1.05 0.00 0.00 32.46 31.10 3ffk n ARG 335 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 3ffk h LYS 336 N 0.00 0.00 0.00 2.89 1.57 -1.84 -1.14 116.57 118.04 3ffk h LYS 336 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ffk h LYS 336 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3ffk h LYS 336 CO 0.00 0.32 -0.01 0.66 -0.57 0.00 0.00 179.45 179.84 3ffk n TYR 337 N -3.95 0.00 -0.20 -1.35 4.01 -0.10 -4.63 117.16 110.94 3ffk n TYR 337 Ca -0.02 -0.67 -0.01 0.00 -0.16 0.00 0.00 57.90 57.04 3ffk n TYR 337 Cb 0.38 -0.09 0.05 0.00 -0.31 0.00 0.00 39.34 39.38 3ffk n TYR 337 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3ffk h SER 338 N 0.00 -0.65 -0.14 7.72 0.02 -1.64 0.13 113.55 118.98 3ffk h SER 338 Ca 0.00 0.19 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 3ffk h SER 338 Cb 0.75 0.41 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 3ffk h SER 338 CO 0.00 -0.22 0.04 0.58 -1.14 0.00 0.00 176.83 176.09 3ffk h VAL 339 N -0.03 0.95 -0.77 2.27 2.07 -1.85 -0.34 116.25 118.56 3ffk h VAL 339 Ca 0.29 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.78 3ffk h VAL 339 Cb 0.47 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3ffk h VAL 339 CO -0.64 0.02 0.49 -0.25 0.02 0.00 0.00 177.57 177.21 3ffk h TRP 340 N 0.11 0.98 -0.66 1.57 7.01 -1.72 -3.00 115.95 120.24 3ffk h TRP 340 Ca 0.06 0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.01 3ffk h TRP 340 Cb 0.04 -0.33 -0.03 0.00 -2.10 0.00 0.00 29.16 26.75 3ffk h TRP 340 CO -0.11 0.64 0.15 0.82 -2.79 0.00 0.00 178.44 177.14 3ffk h ILE 341 N 1.05 1.26 -0.39 2.65 2.04 0.04 -1.38 117.51 122.78 3ffk h ILE 341 Ca 0.28 -0.96 0.08 0.00 1.00 0.00 0.00 64.86 65.27 3ffk h ILE 341 Cb -0.09 0.61 -0.08 0.00 -0.74 0.00 0.00 36.82 36.52 3ffk h ILE 341 CO -0.06 0.36 -0.18 1.23 0.00 0.00 0.00 178.15 179.51 3ffk h GLY 342 N 0.98 0.12 1.00 5.37 0.00 -0.98 -1.62 103.07 107.95 3ffk h GLY 342 Ca 0.21 0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.73 3ffk h GLY 342 CO 0.00 -0.19 0.31 -1.33 0.00 0.00 0.00 176.54 175.34 3ffk h GLY 343 N -0.10 1.03 0.89 4.60 0.00 -1.33 0.34 103.07 108.51 3ffk h GLY 343 Ca 0.19 -0.52 0.07 0.00 0.00 0.00 0.00 47.33 47.07 3ffk h GLY 343 CO -0.45 0.49 0.54 0.23 0.00 0.00 0.00 176.54 177.35 3ffk h SER 344 N 0.92 0.79 0.16 0.19 0.87 -0.77 0.26 113.55 115.98 3ffk h SER 344 Ca 0.23 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 3ffk h SER 344 Cb 0.13 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 3ffk h SER 344 CO -0.03 0.50 -0.08 0.40 -0.53 0.00 0.00 176.83 177.10 3ffk h ILE 345 N 0.89 0.68 -0.42 2.23 2.04 -0.70 -2.94 117.51 119.29 3ffk h ILE 345 Ca 0.37 -1.15 0.07 0.00 1.00 0.00 0.00 64.86 65.15 3ffk h ILE 345 Cb 0.27 1.17 -0.09 0.00 -0.74 0.00 0.00 36.82 37.43 3ffk h ILE 345 CO -0.14 0.19 -0.42 0.25 0.00 0.00 0.00 178.15 178.03 3ffk h LEU 346 N -0.94 -1.41 -2.21 1.44 5.85 -0.12 -1.27 115.31 116.65 3ffk h LEU 346 Ca -0.02 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3ffk h LEU 346 Cb 0.47 0.62 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 3ffk h LEU 346 CO 0.04 -0.36 -0.03 0.00 -0.34 0.00 0.00 178.44 177.75 3ffk h ALA 347 N 0.46 1.07 0.00 1.25 0.00 -0.60 -2.04 119.26 119.40 3ffk h ALA 347 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3ffk h ALA 347 Cb 0.58 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3ffk h ALA 347 CO -0.58 0.03 -0.49 0.77 0.00 0.00 0.00 179.25 178.99 3ffk h SER 348 N 0.00 0.00 -3.99 0.00 0.02 -1.06 -3.46 113.55 105.06 3ffk h SER 348 Ca -0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 3ffk h SER 348 Cb 0.25 0.00 0.12 0.00 0.14 0.00 0.00 62.40 62.91 3ffk h SER 348 CO 0.00 0.03 0.69 -0.76 -1.14 0.00 0.00 176.83 175.65 3ffk s LEU 349 N -5.84 4.10 0.39 5.07 1.43 -0.77 -4.90 118.68 118.17 3ffk s LEU 349 Ca 0.03 2.89 0.08 0.00 -1.03 0.00 0.00 54.13 56.10 3ffk s LEU 349 Cb 0.07 -3.96 0.80 0.00 0.03 0.00 0.00 46.19 43.14 3ffk s LEU 349 CO 0.73 -1.18 1.98 0.77 0.23 0.00 0.00 176.35 178.88 3ffk h SER 350 N 2.29 0.38 1.35 2.29 4.64 -1.91 -1.99 113.55 120.60 3ffk h SER 350 Ca -0.51 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 60.76 3ffk h SER 350 Cb 1.27 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3ffk h SER 350 CO 0.61 0.38 -0.04 0.71 -0.87 0.00 0.00 176.83 177.62 3ffk h THR 351 N 0.42 0.08 0.00 2.95 1.35 -1.94 -3.22 112.91 112.55 3ffk h THR 351 Ca 0.10 -0.79 -0.10 0.00 -0.55 0.00 0.00 66.41 65.07 3ffk h THR 351 Cb 0.15 1.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 3ffk h THR 351 CO -0.01 0.04 -0.48 0.15 -0.25 0.00 0.00 175.52 174.97 3ffk h PHE 352 N 0.00 0.00 0.00 4.73 3.57 -1.63 -2.87 116.94 120.74 3ffk h PHE 352 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3ffk h PHE 352 Cb 0.73 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.47 3ffk h PHE 352 CO 0.00 0.48 0.22 1.96 -2.23 0.00 0.00 178.31 178.74 3ffk h GLN 353 N 0.00 0.00 -0.00 1.11 1.08 -1.67 0.26 115.11 115.89 3ffk h GLN 353 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3ffk h GLN 353 Cb 1.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 3ffk h GLN 353 CO 0.06 0.00 -0.55 1.04 -0.95 0.00 0.00 178.83 178.43 3ffk n GLN 354 N -2.62 0.03 -0.00 1.46 6.02 -1.08 -4.30 117.38 116.89 3ffk n GLN 354 Ca -0.02 -0.02 0.08 0.00 -0.01 0.00 0.00 57.00 57.03 3ffk n GLN 354 Cb 0.26 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 29.93 3ffk n GLN 354 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3ffk n MET 355 N -1.47 1.66 -1.06 -1.09 2.81 0.90 -4.97 117.12 113.90 3ffk n MET 355 Ca 0.06 -0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.60 3ffk n MET 355 Cb 0.34 -1.26 0.12 0.00 -0.71 0.00 0.00 33.22 31.70 3ffk n MET 355 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 3ffk n TRP 356 N -1.40 0.32 -3.62 2.03 7.02 -1.20 -4.93 117.44 115.66 3ffk n TRP 356 Ca 0.03 0.36 -0.38 0.00 -1.02 0.00 0.00 57.50 56.50 3ffk n TRP 356 Cb 0.25 -2.00 -0.11 0.00 -2.42 0.00 0.00 31.31 27.03 3ffk n TRP 356 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3ffk s ILE 357 N -2.15 5.13 0.70 -0.99 1.01 -0.23 -4.93 121.20 119.73 3ffk s ILE 357 Ca 0.68 0.11 -0.11 0.00 0.00 0.00 0.00 60.65 61.33 3ffk s ILE 357 Cb -0.29 -3.43 0.02 0.00 0.01 0.00 0.00 42.46 38.76 3ffk s ILE 357 CO 0.56 0.27 1.08 0.42 0.00 0.00 0.00 174.94 177.27 3ffk s THR 358 N 1.72 3.46 0.23 2.92 -4.23 -1.26 -1.75 115.64 116.73 3ffk s THR 358 Ca 0.07 0.42 -0.06 0.00 -1.18 0.00 0.00 61.69 60.94 3ffk s THR 358 Cb -0.16 -3.46 0.19 0.00 1.34 0.00 0.00 72.50 70.41 3ffk s THR 358 CO 0.10 -0.60 1.83 0.50 -0.54 0.00 0.00 174.62 175.91 3ffk h LYS 359 N -0.62 0.82 -0.41 3.99 3.11 -0.77 -2.45 116.57 120.23 3ffk h LYS 359 Ca -0.45 -0.05 -0.13 0.00 -2.81 0.00 0.00 60.65 57.21 3ffk h LYS 359 Cb 1.26 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 32.29 3ffk h LYS 359 CO 0.64 0.54 -0.26 0.37 -2.81 0.00 0.00 179.45 177.93 3ffk h GLN 360 N 0.84 0.91 -0.87 1.90 4.15 -1.93 -0.14 115.11 119.96 3ffk h GLN 360 Ca 0.36 -0.42 0.08 0.00 0.77 0.00 0.00 58.65 59.43 3ffk h GLN 360 Cb 0.22 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.84 3ffk h GLN 360 CO -0.19 1.08 0.53 0.93 -1.93 0.00 0.00 178.83 179.24 3ffk h GLU 361 N 0.73 0.91 0.25 1.69 5.08 -1.91 -1.37 114.58 119.97 3ffk h GLU 361 Ca 0.08 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3ffk h GLU 361 Cb 0.84 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3ffk h GLU 361 CO 0.07 0.60 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.64 3ffk h TYR 362 N 0.94 -0.31 -0.72 4.33 3.20 -0.90 0.46 116.97 123.97 3ffk h TYR 362 Ca 0.39 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.39 3ffk h TYR 362 Cb 0.25 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 3ffk h TYR 362 CO -0.04 -0.17 0.48 -0.44 -1.64 0.00 0.00 178.16 176.35 3ffk h ASP 363 N -0.36 0.39 0.06 -2.11 3.45 -0.68 0.37 116.42 117.53 3ffk h ASP 363 Ca -0.03 0.02 -0.12 0.00 0.43 0.00 0.00 57.03 57.33 3ffk h ASP 363 Cb 0.28 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 38.99 3ffk h ASP 363 CO 0.06 0.21 -0.55 -0.33 -1.57 0.00 0.00 179.24 177.06 3ffk h GLU 364 N 0.42 0.13 0.00 3.56 5.08 -1.03 -3.40 114.58 119.33 3ffk h GLU 364 Ca 0.35 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3ffk h GLU 364 Cb 0.77 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3ffk h GLU 364 CO -0.11 1.11 -1.33 0.00 -1.00 0.00 0.00 179.01 177.69 3ffk n ALA 365 N -2.74 3.32 0.00 3.43 0.00 0.13 -5.10 120.51 119.55 3ffk n ALA 365 Ca -0.15 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.86 3ffk n ALA 365 Cb 0.66 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.52 3ffk n ALA 365 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ffk n GLY 366 N 1.47 -2.73 0.30 0.00 0.00 0.13 -4.55 105.19 99.80 3ffk n GLY 366 Ca -0.00 -1.78 0.06 0.00 0.00 0.00 0.00 46.02 44.29 3ffk n GLY 366 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ffk h PRO 367 N 0.00 0.36 0.00 1.61 0.11 -1.89 -3.03 132.00 129.15 3ffk h PRO 367 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3ffk h PRO 367 Cb 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3ffk h PRO 367 CO 0.00 0.24 0.00 0.66 -0.21 0.00 0.00 178.00 178.69 3ffk h SER 368 N 0.37 0.00 -2.32 -2.05 4.64 -1.92 -3.44 113.55 108.83 3ffk h SER 368 Ca 0.11 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.86 3ffk h SER 368 Cb -0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 3ffk h SER 368 CO -0.02 0.00 0.89 0.00 -0.87 0.00 0.00 176.83 176.82 3ffk n ILE 369 N -2.47 0.09 -0.46 0.95 3.06 -1.15 -5.10 119.36 114.29 3ffk n ILE 369 Ca -0.01 -0.02 0.00 0.00 -2.50 0.00 0.00 62.75 60.22 3ffk n ILE 369 Cb 0.09 -1.69 0.00 0.00 0.54 0.00 0.00 39.64 38.59 3ffk n ILE 369 CO 0.00 0.00 0.00 1.33 -2.50 0.00 0.00 176.55 175.38