#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ffk s HIS 29 N 0.00 3.63 0.38 4.31 2.46 -1.26 -4.83 115.29 119.98 3ffk s HIS 29 Ca 0.00 1.08 0.17 0.00 0.47 0.00 0.00 55.06 56.77 3ffk s HIS 29 Cb 0.00 -2.37 1.06 0.00 -0.13 0.00 0.00 32.58 31.14 3ffk s HIS 29 CO 0.00 0.46 1.76 -1.00 -2.47 0.00 0.00 174.74 173.49 3ffk h PRO 30 N 3.73 0.42 -0.02 2.88 0.13 -2.00 0.20 132.00 137.34 3ffk h PRO 30 Ca -0.49 -0.03 -0.15 0.00 -0.87 0.00 0.00 66.00 64.46 3ffk h PRO 30 Cb 1.20 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 3ffk h PRO 30 CO 0.65 0.28 -0.69 0.93 -0.23 0.00 0.00 178.00 178.94 3ffk h GLU 31 N 0.43 0.10 -0.44 0.86 4.39 -1.97 -2.78 114.58 115.17 3ffk h GLU 31 Ca 0.60 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 60.09 3ffk h GLU 31 Cb 1.45 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.11 3ffk h GLU 31 CO -0.33 0.75 -0.23 0.74 -1.16 0.00 0.00 179.01 178.78 3ffk h PHE 32 N 0.07 1.04 -0.92 4.33 -1.00 -1.02 -3.01 116.94 116.42 3ffk h PHE 32 Ca -0.01 -0.25 0.04 0.00 2.81 0.00 0.00 57.97 60.55 3ffk h PHE 32 Cb 1.22 -0.24 -0.05 0.00 3.61 0.00 0.00 35.95 40.49 3ffk h PHE 32 CO 0.01 1.04 0.60 -0.07 -1.61 0.00 0.00 178.31 178.28 3ffk h LEU 33 N 0.78 0.99 0.00 1.54 -0.00 -1.04 -2.32 115.31 115.26 3ffk h LEU 33 Ca 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 3ffk h LEU 33 Cb 0.79 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 41.22 3ffk h LEU 33 CO 0.07 0.68 0.00 0.29 -0.00 0.00 0.00 178.44 179.47 3ffk n LYS 34 N -4.44 0.13 -5.05 1.13 5.02 -1.06 -4.87 118.16 109.02 3ffk n LYS 34 Ca 0.12 0.12 -0.29 0.00 -2.02 0.00 0.00 58.31 56.24 3ffk n LYS 34 Cb 0.11 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.46 3ffk n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ffk s ALA 35 N -2.82 1.84 -0.18 7.82 0.00 -0.87 -4.13 121.76 123.41 3ffk s ALA 35 Ca 0.14 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 3ffk s ALA 35 Cb 0.14 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 3ffk s ALA 35 CO 0.36 0.34 -0.01 0.20 0.00 0.00 0.00 175.76 176.65 3ffk s GLY 36 N -0.05 1.73 0.02 0.00 0.00 -1.26 -4.92 107.32 102.84 3ffk s GLY 36 Ca -0.04 -0.92 0.22 0.00 0.00 0.00 0.00 44.72 43.99 3ffk s GLY 36 CO 0.03 0.11 0.92 0.28 0.00 0.00 0.00 173.10 174.45 3ffk n LYS 37 N 3.95 0.26 -3.84 2.90 5.02 -1.26 -4.96 118.16 120.23 3ffk n LYS 37 Ca -0.17 -0.03 -0.10 0.00 -2.02 0.00 0.00 58.31 55.99 3ffk n LYS 37 Cb 0.52 -1.55 -0.06 0.00 -0.02 0.00 0.00 35.03 33.92 3ffk n LYS 37 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3ffk s GLU 38 N -3.19 1.17 0.46 1.97 -1.05 -1.26 -5.13 118.70 111.67 3ffk s GLU 38 Ca 0.03 -0.99 -0.20 0.00 -0.15 0.00 0.00 54.97 53.66 3ffk s GLU 38 Cb 0.15 0.43 -0.14 0.00 -0.44 0.00 0.00 34.13 34.12 3ffk s GLU 38 CO 0.83 -0.45 0.08 -2.30 0.95 0.00 0.00 175.26 174.37 3ffk n PRO 39 N -0.23 0.10 0.00 -4.83 -0.02 -1.26 -4.74 135.00 124.01 3ffk n PRO 39 Ca -0.10 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 3ffk n PRO 39 Cb 0.63 -1.11 0.00 0.00 -0.02 0.00 0.00 33.50 33.00 3ffk n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ffk n GLY 40 N 2.31 0.95 2.99 -1.23 0.00 -0.84 -4.95 105.19 104.42 3ffk n GLY 40 Ca 0.10 -1.96 -0.28 0.00 0.00 0.00 0.00 46.02 43.89 3ffk n GLY 40 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ffk s LEU 41 N 0.00 1.53 0.02 0.99 2.96 -1.26 -1.25 118.68 121.66 3ffk s LEU 41 Ca 0.00 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 3ffk s LEU 41 Cb 0.00 -1.00 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 3ffk s LEU 41 CO 0.00 -0.04 -0.17 -1.10 -1.32 0.00 0.00 176.35 173.72 3ffk s GLN 42 N 1.31 2.21 -0.06 1.98 -0.21 -0.23 -5.02 119.66 119.64 3ffk s GLN 42 Ca -0.01 -0.90 -0.00 0.00 0.02 0.00 0.00 55.36 54.47 3ffk s GLN 42 Cb -0.14 -2.25 0.03 0.00 1.00 0.00 0.00 33.01 31.65 3ffk s GLN 42 CO -0.05 0.56 -0.01 0.42 -2.12 0.00 0.00 175.29 174.08 3ffk s ILE 43 N -0.87 0.41 0.03 1.08 1.01 -1.26 -1.02 121.20 120.57 3ffk s ILE 43 Ca 0.14 0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.87 3ffk s ILE 43 Cb -0.11 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 3ffk s ILE 43 CO 0.04 0.23 -0.12 0.26 0.00 0.00 0.00 174.94 175.35 3ffk s TRP 44 N 1.46 2.73 -0.14 3.97 0.51 0.11 -0.71 118.94 126.88 3ffk s TRP 44 Ca -0.03 -0.14 -0.06 0.00 -2.12 0.00 0.00 56.10 53.75 3ffk s TRP 44 Cb -0.13 -1.53 -0.04 0.00 -0.81 0.00 0.00 33.47 30.96 3ffk s TRP 44 CO -0.03 0.32 0.06 0.50 -0.51 0.00 0.00 176.95 177.30 3ffk s ARG 45 N -1.49 3.61 -0.01 4.98 3.52 0.21 -0.08 118.95 129.68 3ffk s ARG 45 Ca 0.16 -0.31 -0.30 0.00 -0.13 0.00 0.00 55.73 55.15 3ffk s ARG 45 Cb -0.11 -3.10 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 3ffk s ARG 45 CO 0.07 0.50 1.44 0.08 -0.81 0.00 0.00 175.30 176.57 3ffk s VAL 46 N -0.26 3.69 -0.11 7.11 1.01 -0.30 -0.26 120.40 131.28 3ffk s VAL 46 Ca 0.08 1.04 -0.01 0.00 0.00 0.00 0.00 61.98 63.09 3ffk s VAL 46 Cb -0.12 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.62 3ffk s VAL 46 CO 0.01 -0.02 -0.02 -1.61 0.00 0.00 0.00 175.10 173.46 3ffk s GLU 47 N 2.70 0.96 -0.91 2.72 2.02 0.81 -4.64 118.70 122.37 3ffk s GLU 47 Ca 0.65 -0.15 -0.20 0.00 0.02 0.00 0.00 54.97 55.30 3ffk s GLU 47 Cb -0.31 -1.44 0.03 0.00 0.10 0.00 0.00 34.13 32.51 3ffk s GLU 47 CO 0.26 -0.36 0.55 1.63 0.02 0.00 0.00 175.26 177.36 3ffk n LYS 48 N 5.04 -0.66 -1.23 1.61 5.02 -1.26 -0.04 118.16 126.65 3ffk n LYS 48 Ca -0.09 0.19 -0.08 0.00 -2.02 0.00 0.00 58.31 56.30 3ffk n LYS 48 Cb 0.49 -1.87 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 3ffk n LYS 48 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3ffk n PHE 49 N -3.69 0.00 -4.24 2.13 3.01 -1.26 -4.98 117.46 108.42 3ffk n PHE 49 Ca -0.16 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.13 3ffk n PHE 49 Cb 0.51 -1.79 -0.11 0.00 -0.01 0.00 0.00 39.48 38.08 3ffk n PHE 49 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3ffk s ASP 50 N -2.62 1.96 -0.48 4.37 2.15 0.95 -5.11 116.67 117.88 3ffk s ASP 50 Ca 0.00 -0.86 -0.17 0.00 0.43 0.00 0.00 52.55 51.95 3ffk s ASP 50 Cb 0.00 -0.06 0.06 0.00 -0.30 0.00 0.00 42.92 42.62 3ffk s ASP 50 CO 0.00 -0.18 0.51 -0.76 -0.17 0.00 0.00 175.17 174.57 3ffk s LEU 51 N -2.62 5.22 -0.15 -1.34 1.43 -1.26 -0.13 118.68 119.83 3ffk s LEU 51 Ca 0.11 -1.06 -0.02 0.00 -1.03 0.00 0.00 54.13 52.14 3ffk s LEU 51 Cb -0.03 -2.33 -0.02 0.00 0.03 0.00 0.00 46.19 43.84 3ffk s LEU 51 CO 0.03 -0.76 -0.09 -0.69 0.23 0.00 0.00 176.35 175.07 3ffk s VAL 52 N 2.17 3.35 0.31 -1.59 1.01 0.64 -4.92 120.40 121.37 3ffk s VAL 52 Ca 0.10 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.24 3ffk s VAL 52 Cb -0.21 -2.44 -0.10 0.00 0.00 0.00 0.00 36.38 33.63 3ffk s VAL 52 CO 0.10 0.51 1.29 -2.16 0.00 0.00 0.00 175.10 174.83 3ffk s PRO 53 N 0.46 4.39 0.07 2.72 0.04 -1.26 0.68 135.00 142.11 3ffk s PRO 53 Ca -0.07 2.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.82 3ffk s PRO 53 Cb -0.15 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.24 3ffk s PRO 53 CO 0.04 -0.15 1.17 0.08 0.04 0.00 0.00 177.00 178.18 3ffk s VAL 54 N -1.02 4.06 0.06 -0.36 1.01 0.11 -4.78 120.40 119.49 3ffk s VAL 54 Ca 0.49 1.52 -0.38 0.00 0.00 0.00 0.00 61.98 63.62 3ffk s VAL 54 Cb -0.39 -3.97 -0.18 0.00 0.00 0.00 0.00 36.38 31.84 3ffk s VAL 54 CO 0.50 0.14 1.20 -2.65 0.00 0.00 0.00 175.10 174.30 3ffk n PRO 55 N 3.68 0.65 0.11 2.72 -0.02 -1.26 -4.82 135.00 136.06 3ffk n PRO 55 Ca 0.08 0.24 -0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3ffk n PRO 55 Cb 0.47 -1.80 0.28 0.00 -0.02 0.00 0.00 33.50 32.42 3ffk n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ffk h THR 56 N 3.12 1.28 -0.33 3.45 1.03 -1.98 -0.45 112.91 119.02 3ffk h THR 56 Ca -0.48 -1.32 0.00 0.00 -0.01 0.00 0.00 66.41 64.59 3ffk h THR 56 Cb 1.38 1.57 0.00 0.00 -1.07 0.00 0.00 68.15 70.03 3ffk h THR 56 CO 0.72 0.40 0.00 -0.46 -0.01 0.00 0.00 175.52 176.16 3ffk n ASN 57 N -4.09 2.35 -0.77 0.00 0.23 -1.26 -3.47 115.26 108.25 3ffk n ASN 57 Ca -0.01 -2.14 0.09 0.00 -0.53 0.00 0.00 54.58 51.99 3ffk n ASN 57 Cb 0.42 -0.35 0.09 0.00 -2.08 0.00 0.00 39.78 37.86 3ffk n ASN 57 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3ffk n LEU 58 N 0.47 2.63 -4.59 -4.53 7.99 -0.18 -4.98 117.00 113.82 3ffk n LEU 58 Ca 0.12 -1.06 -0.47 0.00 -0.01 0.00 0.00 56.01 54.60 3ffk n LEU 58 Cb 0.43 -0.02 -0.05 0.00 -0.11 0.00 0.00 43.42 43.67 3ffk n LEU 58 CO 0.11 0.47 1.71 -1.22 -1.51 0.00 0.00 177.39 176.95 3ffk n TYR 59 N 1.07 2.03 0.00 -1.77 4.02 -1.23 -1.17 117.16 120.11 3ffk n TYR 59 Ca 0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 3ffk n TYR 59 Cb 0.48 -2.67 0.00 0.00 -0.02 0.00 0.00 39.34 37.13 3ffk n TYR 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ffk n GLY 60 N 5.45 1.28 3.67 2.72 0.00 -1.26 -5.06 105.19 111.98 3ffk n GLY 60 Ca 0.30 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3ffk n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ffk s ASP 61 N -0.64 6.99 -0.12 1.61 1.11 -0.32 -1.56 116.67 123.73 3ffk s ASP 61 Ca 0.00 1.71 -0.01 0.00 0.18 0.00 0.00 52.55 54.44 3ffk s ASP 61 Cb 0.00 -2.54 0.03 0.00 1.07 0.00 0.00 42.92 41.48 3ffk s ASP 61 CO 0.00 -0.70 -0.04 -0.36 1.18 0.00 0.00 175.17 175.25 3ffk s PHE 62 N 3.08 1.27 0.02 4.23 0.40 -0.53 -4.97 117.98 121.47 3ffk s PHE 62 Ca 0.55 -0.67 -0.30 0.00 -0.60 0.00 0.00 56.93 55.90 3ffk s PHE 62 Cb -0.22 -1.12 -0.05 0.00 0.51 0.00 0.00 43.02 42.14 3ffk s PHE 62 CO 0.16 -0.50 1.32 -0.06 0.70 0.00 0.00 175.22 176.85 3ffk s PHE 63 N 1.78 3.09 -0.23 0.36 0.40 -1.26 -0.51 117.98 121.60 3ffk s PHE 63 Ca 0.03 1.01 0.28 0.00 -0.60 0.00 0.00 56.93 57.66 3ffk s PHE 63 Cb -0.13 -3.57 0.99 0.00 0.51 0.00 0.00 43.02 40.81 3ffk s PHE 63 CO -0.07 -1.99 1.82 1.79 0.70 0.00 0.00 175.22 177.46 3ffk h THR 64 N 4.76 0.00 -0.10 0.64 1.35 -0.71 -1.74 112.91 117.11 3ffk h THR 64 Ca -0.38 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 3ffk h THR 64 Cb 1.19 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 3ffk h THR 64 CO 0.88 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 3ffk n GLY 65 N 0.42 -0.28 3.58 5.82 0.00 -0.74 -0.20 105.19 113.80 3ffk n GLY 65 Ca 0.02 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 3ffk n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ffk s ASP 66 N -1.49 3.18 0.01 1.61 -0.00 -0.65 -3.71 116.67 115.62 3ffk s ASP 66 Ca 0.27 -1.62 0.02 0.00 -0.00 0.00 0.00 52.55 51.23 3ffk s ASP 66 Cb 0.14 0.39 -0.01 0.00 -0.00 0.00 0.00 42.92 43.44 3ffk s ASP 66 CO 0.22 -0.85 -0.08 0.00 -0.00 0.00 0.00 175.17 174.46 3ffk s ALA 67 N -3.10 0.62 0.09 5.23 0.00 -1.26 -1.28 121.76 122.05 3ffk s ALA 67 Ca 0.21 -0.44 0.03 0.00 0.00 0.00 0.00 51.96 51.76 3ffk s ALA 67 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 3ffk s ALA 67 CO 0.11 0.11 -0.10 0.71 0.00 0.00 0.00 175.76 176.60 3ffk s TYR 68 N -0.49 1.01 -0.08 0.00 1.51 -0.28 -1.15 117.35 117.87 3ffk s TYR 68 Ca -0.00 -0.63 0.04 0.00 -1.01 0.00 0.00 57.07 55.47 3ffk s TYR 68 Cb -0.05 -0.56 -0.01 0.00 -0.11 0.00 0.00 41.96 41.23 3ffk s TYR 68 CO 0.00 -0.02 -0.22 0.08 -1.11 0.00 0.00 175.55 174.28 3ffk s VAL 69 N -2.23 2.27 -0.17 0.71 1.01 0.88 -0.72 120.40 122.14 3ffk s VAL 69 Ca 0.03 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.05 3ffk s VAL 69 Cb -0.04 -1.86 0.03 0.00 0.00 0.00 0.00 36.38 34.50 3ffk s VAL 69 CO 0.00 0.56 -0.14 -0.63 0.00 0.00 0.00 175.10 174.89 3ffk s ILE 70 N 0.05 1.69 -0.19 2.22 1.09 0.16 0.10 121.20 126.32 3ffk s ILE 70 Ca -0.09 -0.83 -0.07 0.00 -1.10 0.00 0.00 60.65 58.55 3ffk s ILE 70 Cb -0.15 -1.64 -0.04 0.00 -1.06 0.00 0.00 42.46 39.57 3ffk s ILE 70 CO 0.06 0.36 0.06 -0.22 -0.10 0.00 0.00 174.94 175.10 3ffk s LEU 71 N 1.41 3.79 -0.15 2.97 2.96 -0.19 -0.24 118.68 129.24 3ffk s LEU 71 Ca 0.03 0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 53.98 3ffk s LEU 71 Cb -0.14 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 3ffk s LEU 71 CO -0.10 0.16 -0.09 -0.75 -1.32 0.00 0.00 176.35 174.25 3ffk s LYS 72 N 0.46 3.51 -0.15 1.98 2.47 -0.44 -1.07 119.74 126.50 3ffk s LYS 72 Ca 0.03 -0.61 0.01 0.00 -1.56 0.00 0.00 55.97 53.84 3ffk s LYS 72 Cb -0.13 -2.77 -0.00 0.00 -1.46 0.00 0.00 37.83 33.47 3ffk s LYS 72 CO 0.01 0.21 -0.16 0.99 0.16 0.00 0.00 175.35 176.56 3ffk s THR 73 N 0.41 2.64 0.00 3.43 2.01 -0.38 -1.80 115.64 121.94 3ffk s THR 73 Ca -0.07 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 61.22 3ffk s THR 73 Cb -0.15 -2.10 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 3ffk s THR 73 CO 0.04 0.52 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.55 3ffk s VAL 74 N 0.76 2.19 -0.16 3.82 1.01 -0.59 -1.99 120.40 125.43 3ffk s VAL 74 Ca -0.06 -1.17 -0.29 0.00 0.00 0.00 0.00 61.98 60.45 3ffk s VAL 74 Cb -0.15 -1.80 -0.00 0.00 0.00 0.00 0.00 36.38 34.42 3ffk s VAL 74 CO 0.01 0.51 1.06 -1.58 0.00 0.00 0.00 175.10 175.10 3ffk s GLN 75 N -0.85 4.32 -0.14 2.72 2.00 -1.26 -0.79 119.66 125.66 3ffk s GLN 75 Ca 0.11 1.43 -0.15 0.00 -2.00 0.00 0.00 55.36 54.75 3ffk s GLN 75 Cb -0.10 -3.61 -0.05 0.00 0.80 0.00 0.00 33.01 30.05 3ffk s GLN 75 CO 0.00 -0.51 0.35 -0.51 -0.50 0.00 0.00 175.29 174.13 3ffk s LEU 76 N 2.71 4.27 0.13 3.68 2.01 -0.85 -4.92 118.68 125.70 3ffk s LEU 76 Ca 0.48 0.62 0.06 0.00 0.01 0.00 0.00 54.13 55.30 3ffk s LEU 76 Cb -0.18 -2.48 0.33 0.00 0.01 0.00 0.00 46.19 43.88 3ffk s LEU 76 CO 0.13 0.09 1.07 -2.11 1.01 0.00 0.00 176.35 176.53 3ffk n ARG 77 N 3.49 0.04 -0.01 1.70 1.85 -1.26 0.16 116.66 122.62 3ffk n ARG 77 Ca -0.11 0.45 0.13 0.00 -1.00 0.00 0.00 57.85 57.32 3ffk n ARG 77 Cb 0.52 -1.80 0.39 0.00 -1.05 0.00 0.00 32.46 30.51 3ffk n ARG 77 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 3ffk n ASN 78 N -1.65 1.99 0.00 2.89 0.23 -1.26 -4.98 115.26 112.48 3ffk n ASN 78 Ca -0.00 -1.67 0.00 0.00 -0.53 0.00 0.00 54.58 52.37 3ffk n ASN 78 Cb 0.18 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 3ffk n ASN 78 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ffk n GLY 79 N 1.23 1.86 4.01 4.83 0.00 0.12 -5.08 105.19 112.16 3ffk n GLY 79 Ca 0.17 -0.37 -0.19 0.00 0.00 0.00 0.00 46.02 45.64 3ffk n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk s ASN 80 N -0.25 5.38 0.10 1.61 2.20 -1.25 -4.86 114.94 117.86 3ffk s ASN 80 Ca 0.00 -0.48 0.06 0.00 -0.94 0.00 0.00 52.86 51.50 3ffk s ASN 80 Cb 0.00 -0.38 -0.04 0.00 -2.00 0.00 0.00 41.25 38.83 3ffk s ASN 80 CO 0.00 -1.04 -0.05 -0.76 -2.94 0.00 0.00 177.10 172.31 3ffk s LEU 81 N -4.54 3.24 -0.23 3.54 1.02 -1.26 -2.01 118.68 118.44 3ffk s LEU 81 Ca 0.58 -0.29 -0.13 0.00 0.02 0.00 0.00 54.13 54.31 3ffk s LEU 81 Cb -0.09 -2.01 -0.04 0.00 0.02 0.00 0.00 46.19 44.07 3ffk s LEU 81 CO 0.36 0.18 0.27 -1.58 0.02 0.00 0.00 176.35 175.60 3ffk s GLN 82 N -2.27 4.10 -0.11 1.70 0.74 0.03 -4.92 119.66 118.94 3ffk s GLN 82 Ca 0.24 -0.06 -0.03 0.00 0.05 0.00 0.00 55.36 55.56 3ffk s GLN 82 Cb -0.11 -3.55 -0.03 0.00 1.10 0.00 0.00 33.01 30.41 3ffk s GLN 82 CO 0.16 -0.01 0.02 0.71 -0.55 0.00 0.00 175.29 175.61 3ffk s TYR 83 N 1.25 3.19 -0.11 1.67 1.51 -1.26 -1.55 117.35 122.06 3ffk s TYR 83 Ca 0.13 0.14 0.01 0.00 -1.01 0.00 0.00 57.07 56.34 3ffk s TYR 83 Cb -0.14 -1.86 0.02 0.00 -0.11 0.00 0.00 41.96 39.87 3ffk s TYR 83 CO 0.06 0.39 -0.11 -0.51 -1.11 0.00 0.00 175.55 174.28 3ffk s ASP 84 N -0.58 2.20 -0.28 2.29 1.01 -0.74 -2.44 116.67 118.11 3ffk s ASP 84 Ca 0.10 -0.35 -0.10 0.00 0.71 0.00 0.00 52.55 52.91 3ffk s ASP 84 Cb -0.12 -0.92 -0.04 0.00 1.01 0.00 0.00 42.92 42.85 3ffk s ASP 84 CO 0.02 -0.06 0.17 -0.76 0.21 0.00 0.00 175.17 174.75 3ffk s LEU 85 N 1.33 3.96 -0.17 1.23 1.43 -0.21 -1.33 118.68 124.92 3ffk s LEU 85 Ca -0.01 -0.16 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 3ffk s LEU 85 Cb -0.14 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.03 3ffk s LEU 85 CO -0.05 -0.09 -0.18 -1.00 0.23 0.00 0.00 176.35 175.26 3ffk s HIS 86 N 1.71 2.78 -0.21 0.29 3.76 0.66 0.38 115.29 124.65 3ffk s HIS 86 Ca 0.06 -1.45 -0.07 0.00 -0.15 0.00 0.00 55.06 53.45 3ffk s HIS 86 Cb -0.16 -1.91 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 3ffk s HIS 86 CO 0.09 -0.71 0.05 1.52 -0.85 0.00 0.00 174.74 174.84 3ffk s TYR 87 N 1.16 3.13 -0.09 1.40 -0.85 -0.63 0.37 117.35 121.84 3ffk s TYR 87 Ca 0.02 -0.21 -0.02 0.00 -0.52 0.00 0.00 57.07 56.33 3ffk s TYR 87 Cb -0.14 -2.14 -0.03 0.00 0.38 0.00 0.00 41.96 40.03 3ffk s TYR 87 CO -0.08 -0.12 0.01 -0.46 -1.52 0.00 0.00 175.55 173.38 3ffk s TRP 88 N 0.98 3.20 -0.16 -3.49 -0.00 0.10 -1.33 118.94 118.25 3ffk s TRP 88 Ca 0.03 0.21 -0.00 0.00 -0.00 0.00 0.00 56.10 56.34 3ffk s TRP 88 Cb -0.14 -1.81 0.04 0.00 -0.00 0.00 0.00 33.47 31.55 3ffk s TRP 88 CO 0.03 0.47 -0.06 -0.51 -0.00 0.00 0.00 176.95 176.88 3ffk s LEU 89 N -0.83 1.56 0.64 5.86 1.43 -0.65 -1.12 118.68 125.56 3ffk s LEU 89 Ca 0.13 -0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 52.47 3ffk s LEU 89 Cb -0.11 -0.92 -0.01 0.00 0.03 0.00 0.00 46.19 45.18 3ffk s LEU 89 CO 0.02 -0.17 1.11 -0.83 0.23 0.00 0.00 176.35 176.72 3ffk s GLY 90 N 1.64 2.21 0.50 -3.19 0.00 -0.41 -2.55 107.32 105.53 3ffk s GLY 90 Ca 0.02 0.57 0.34 0.00 0.00 0.00 0.00 44.72 45.65 3ffk s GLY 90 CO -0.08 0.92 2.02 3.43 0.00 0.00 0.00 173.10 179.40 3ffk h ASN 91 N 0.21 0.00 -0.25 1.64 2.35 -1.84 -2.74 115.58 114.94 3ffk h ASN 91 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 3ffk h ASN 91 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3ffk h ASN 91 CO 0.55 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.71 3ffk n GLU 92 N -2.79 2.23 -2.48 0.81 4.71 0.73 -5.03 120.64 118.82 3ffk n GLU 92 Ca -0.01 -1.80 -0.38 0.00 -0.01 0.00 0.00 57.16 54.96 3ffk n GLU 92 Cb 0.16 -1.25 -0.04 0.00 -1.01 0.00 0.00 31.44 29.30 3ffk n GLU 92 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ffk s SER 94 N -1.30 6.00 0.34 0.00 1.04 -1.26 -4.86 113.70 113.65 3ffk s SER 94 Ca 0.54 1.59 0.04 0.00 0.48 0.00 0.00 55.95 58.60 3ffk s SER 94 Cb -0.26 -2.50 0.66 0.00 0.10 0.00 0.00 66.02 64.02 3ffk s SER 94 CO 0.33 -1.02 1.94 -0.61 0.98 0.00 0.00 173.24 174.86 3ffk h GLN 95 N 0.01 0.84 -0.72 4.02 4.15 -1.99 -1.52 115.11 119.89 3ffk h GLN 95 Ca -0.45 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 3ffk h GLN 95 Cb 1.20 -0.19 -0.04 0.00 0.21 0.00 0.00 27.48 28.67 3ffk h GLN 95 CO 0.59 0.55 0.44 0.38 -1.93 0.00 0.00 178.83 178.87 3ffk h ASP 96 N 0.86 0.85 -0.05 -0.69 2.03 -1.98 0.54 116.42 117.98 3ffk h ASP 96 Ca 0.35 -0.04 -0.11 0.00 -0.73 0.00 0.00 57.03 56.50 3ffk h ASP 96 Cb 0.26 -0.21 0.01 0.00 -0.83 0.00 0.00 39.33 38.55 3ffk h ASP 96 CO -0.12 0.65 -0.38 -0.33 -1.03 0.00 0.00 179.24 178.02 3ffk h GLU 97 N 0.99 0.34 -0.50 4.15 5.08 -1.67 0.10 114.58 123.08 3ffk h GLU 97 Ca 0.26 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 3ffk h GLU 97 Cb -0.06 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3ffk h GLU 97 CO -0.05 0.96 -0.01 0.66 -1.00 0.00 0.00 179.01 179.57 3ffk h SER 98 N -0.17 0.87 -0.32 1.42 4.64 -1.39 0.18 113.55 118.78 3ffk h SER 98 Ca -0.03 -0.31 0.03 0.00 -0.47 0.00 0.00 61.79 61.00 3ffk h SER 98 Cb 1.06 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.88 3ffk h SER 98 CO 0.08 0.98 0.15 1.23 -0.87 0.00 0.00 176.83 178.39 3ffk h GLY 99 N 0.75 0.43 0.88 -0.77 0.00 -0.88 -1.82 103.07 101.66 3ffk h GLY 99 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 3ffk h GLY 99 CO 0.03 0.08 0.07 0.00 0.00 0.00 0.00 176.54 176.72 3ffk h ALA 100 N 1.18 0.34 -0.69 3.60 0.00 -0.65 -1.79 119.26 121.24 3ffk h ALA 100 Ca 0.14 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 55.03 3ffk h ALA 100 Cb 0.06 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 3ffk h ALA 100 CO -0.10 -0.02 0.18 0.00 0.00 0.00 0.00 179.25 179.31 3ffk h ALA 101 N 0.90 0.88 0.44 0.00 0.00 -0.49 0.28 119.26 121.27 3ffk h ALA 101 Ca 0.08 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3ffk h ALA 101 Cb 0.26 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ffk h ALA 101 CO -0.00 -0.30 -0.21 0.00 0.00 0.00 0.00 179.25 178.74 3ffk h ALA 102 N 1.55 -0.59 -0.79 0.00 0.00 -1.12 -2.55 119.26 115.76 3ffk h ALA 102 Ca 0.38 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3ffk h ALA 102 Cb 0.60 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 3ffk h ALA 102 CO -0.45 -0.79 0.47 0.82 0.00 0.00 0.00 179.25 179.30 3ffk h ILE 103 N -0.67 1.23 -0.99 0.00 2.04 -0.49 -1.73 117.51 116.90 3ffk h ILE 103 Ca -0.06 -0.51 0.08 0.00 1.00 0.00 0.00 64.86 65.37 3ffk h ILE 103 Cb 0.49 0.13 -0.07 0.00 -0.74 0.00 0.00 36.82 36.63 3ffk h ILE 103 CO 0.10 0.24 0.64 -0.26 0.00 0.00 0.00 178.15 178.87 3ffk h PHE 104 N 1.09 1.17 -0.50 1.37 0.05 -0.47 -1.01 116.94 118.64 3ffk h PHE 104 Ca 0.28 0.03 0.05 0.00 3.82 0.00 0.00 57.97 62.15 3ffk h PHE 104 Cb -0.02 -0.38 -0.05 0.00 2.00 0.00 0.00 35.95 37.50 3ffk h PHE 104 CO -0.00 0.57 0.24 1.15 -0.18 0.00 0.00 178.31 180.09 3ffk h THR 105 N 1.12 0.93 -0.18 -1.55 2.02 -0.88 0.13 112.91 114.50 3ffk h THR 105 Ca 0.44 -0.16 -0.17 0.00 0.77 0.00 0.00 66.41 67.29 3ffk h THR 105 Cb 0.25 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3ffk h THR 105 CO -0.19 0.08 -0.60 1.62 0.37 0.00 0.00 175.52 176.81 3ffk h VAL 106 N 0.46 1.32 -0.10 3.16 3.04 -1.05 -1.17 116.25 121.91 3ffk h VAL 106 Ca 0.22 -1.85 -0.07 0.00 -1.01 0.00 0.00 66.70 63.99 3ffk h VAL 106 Cb 0.16 1.82 -0.01 0.00 -2.01 0.00 0.00 31.29 31.24 3ffk h VAL 106 CO -0.17 0.58 -0.26 1.56 -1.01 0.00 0.00 177.57 178.26 3ffk h GLN 107 N 0.45 0.17 -0.01 4.17 4.20 -0.94 0.56 115.11 123.70 3ffk h GLN 107 Ca -0.00 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 3ffk h GLN 107 Cb 1.16 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.93 3ffk h GLN 107 CO 0.11 0.42 -0.22 1.25 -0.67 0.00 0.00 178.83 179.73 3ffk h LEU 108 N 0.15 0.21 -0.93 1.46 5.85 -0.79 -2.34 115.31 118.92 3ffk h LEU 108 Ca 0.02 -0.74 0.11 0.00 0.84 0.00 0.00 57.88 58.12 3ffk h LEU 108 Cb 0.55 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.43 3ffk h LEU 108 CO 0.04 0.92 0.57 -0.78 -0.34 0.00 0.00 178.44 178.85 3ffk h ASP 109 N -0.47 0.82 -0.52 1.25 3.58 -1.00 -1.03 116.42 119.05 3ffk h ASP 109 Ca -0.02 0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.40 3ffk h ASP 109 Cb 0.94 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.86 3ffk h ASP 109 CO 0.04 0.44 0.05 0.44 -2.88 0.00 0.00 179.24 177.34 3ffk h ASP 110 N 0.91 0.90 0.41 2.28 3.32 -0.87 0.17 116.42 123.54 3ffk h ASP 110 Ca 0.46 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 3ffk h ASP 110 Cb 0.46 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3ffk h ASP 110 CO -0.27 0.93 -0.45 0.22 -1.72 0.00 0.00 179.24 177.95 3ffk h TYR 111 N 0.88 0.06 -0.45 4.55 3.20 -0.71 -1.80 116.97 122.69 3ffk h TYR 111 Ca 0.17 -0.02 -0.27 0.00 3.14 0.00 0.00 58.73 61.76 3ffk h TYR 111 Cb 0.44 -0.01 -0.14 0.00 1.54 0.00 0.00 36.73 38.56 3ffk h TYR 111 CO 0.03 0.49 0.34 1.28 -1.64 0.00 0.00 178.16 178.66 3ffk n LEU 112 N -4.00 5.48 -4.06 2.82 4.32 -0.49 -4.88 117.00 116.19 3ffk n LEU 112 Ca -0.02 -2.82 -0.34 0.00 -0.02 0.00 0.00 56.01 52.82 3ffk n LEU 112 Cb 0.48 -0.84 -0.02 0.00 -1.62 0.00 0.00 43.42 41.42 3ffk n LEU 112 CO 0.40 0.96 -0.01 0.59 -1.22 0.00 0.00 177.39 178.12 3ffk n ASN 113 N 0.06 -3.57 -1.13 -1.43 4.13 -0.68 -0.93 115.26 111.71 3ffk n ASN 113 Ca 0.28 -0.89 -0.15 0.00 1.68 0.00 0.00 54.58 55.50 3ffk n ASN 113 Cb 0.82 -2.92 -0.06 0.00 -1.54 0.00 0.00 39.78 36.08 3ffk n ASN 113 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ffk n GLY 114 N -1.39 1.47 1.24 7.41 0.00 0.57 -4.88 105.19 109.61 3ffk n GLY 114 Ca 0.07 -0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.00 3ffk n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk n ARG 115 N -2.03 3.00 -4.24 1.61 1.74 -0.10 -4.90 116.66 111.74 3ffk n ARG 115 Ca -0.15 -2.08 -0.29 0.00 -0.77 0.00 0.00 57.85 54.56 3ffk n ARG 115 Cb 0.55 -1.73 -0.10 0.00 -1.02 0.00 0.00 32.46 30.16 3ffk n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ffk s ALA 116 N -1.77 2.93 -0.25 7.54 0.00 -1.26 -4.34 121.76 124.61 3ffk s ALA 116 Ca 0.37 -1.29 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 3ffk s ALA 116 Cb 0.24 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 3ffk s ALA 116 CO 0.18 0.61 0.08 0.08 0.00 0.00 0.00 175.76 176.71 3ffk s VAL 117 N -1.28 4.40 -0.08 0.00 1.01 -1.02 -4.89 120.40 118.54 3ffk s VAL 117 Ca 0.22 -0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.82 3ffk s VAL 117 Cb -0.11 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 3ffk s VAL 117 CO 0.14 0.34 0.68 -1.10 0.00 0.00 0.00 175.10 175.16 3ffk s GLN 118 N 1.55 4.42 -0.09 2.72 -0.21 -1.26 -1.04 119.66 125.75 3ffk s GLN 118 Ca 0.06 0.84 0.02 0.00 0.02 0.00 0.00 55.36 56.30 3ffk s GLN 118 Cb -0.15 -3.45 0.01 0.00 1.00 0.00 0.00 33.01 30.42 3ffk s GLN 118 CO 0.04 0.05 -0.15 -1.01 -2.12 0.00 0.00 175.29 172.11 3ffk s HIS 119 N 0.85 1.84 -0.25 0.91 3.76 0.16 -4.97 115.29 117.59 3ffk s HIS 119 Ca 0.36 -0.81 -0.19 0.00 -0.15 0.00 0.00 55.06 54.28 3ffk s HIS 119 Cb -0.17 -1.33 -0.02 0.00 1.11 0.00 0.00 32.58 32.16 3ffk s HIS 119 CO 0.17 -0.41 0.55 0.50 -0.85 0.00 0.00 174.74 174.70 3ffk s ARG 120 N 0.87 4.09 -0.29 1.40 3.52 -1.26 -1.61 118.95 125.67 3ffk s ARG 120 Ca -0.10 0.40 -0.02 0.00 -0.13 0.00 0.00 55.73 55.88 3ffk s ARG 120 Cb -0.15 -3.65 0.04 0.00 -1.56 0.00 0.00 34.95 29.63 3ffk s ARG 120 CO 0.01 -0.36 -0.01 -1.21 -0.81 0.00 0.00 175.30 172.92 3ffk s GLU 121 N 2.32 2.61 0.01 5.12 0.41 -0.44 -4.89 118.70 123.85 3ffk s GLU 121 Ca 0.23 -1.14 -0.18 0.00 -0.41 0.00 0.00 54.97 53.47 3ffk s GLU 121 Cb -0.16 -3.16 -0.06 0.00 -1.78 0.00 0.00 34.13 28.98 3ffk s GLU 121 CO 0.09 -0.54 0.50 0.08 -0.49 0.00 0.00 175.26 174.90 3ffk s VAL 122 N 1.30 4.92 0.13 2.63 1.01 -1.26 -1.64 120.40 127.49 3ffk s VAL 122 Ca -0.03 1.05 -0.35 0.00 0.00 0.00 0.00 61.98 62.65 3ffk s VAL 122 Cb -0.19 -3.83 -0.16 0.00 0.00 0.00 0.00 36.38 32.21 3ffk s VAL 122 CO -0.02 0.52 1.32 1.67 0.00 0.00 0.00 175.10 178.60 3ffk n GLN 123 N 2.12 1.31 -1.02 2.72 7.27 -1.06 -1.46 117.38 127.25 3ffk n GLN 123 Ca -0.11 0.47 -0.01 0.00 0.07 0.00 0.00 57.00 57.42 3ffk n GLN 123 Cb 0.51 -2.09 -0.00 0.00 2.41 0.00 0.00 30.24 31.07 3ffk n GLN 123 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3ffk n GLY 124 N 2.47 0.44 0.36 1.69 0.00 -1.26 -4.76 105.19 104.12 3ffk n GLY 124 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3ffk n GLY 124 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ffk n PHE 125 N -2.77 0.00 -1.72 1.61 3.01 -0.53 -5.12 117.46 111.94 3ffk n PHE 125 Ca -0.01 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.04 3ffk n PHE 125 Cb 0.13 0.04 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 3ffk n PHE 125 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3ffk n GLU 126 N 0.00 2.18 -1.64 -1.08 4.71 -1.03 -4.59 120.64 119.19 3ffk n GLU 126 Ca 0.00 0.77 -0.39 0.00 -0.01 0.00 0.00 57.16 57.53 3ffk n GLU 126 Cb 0.60 -2.44 0.03 0.00 -1.01 0.00 0.00 31.44 28.62 3ffk n GLU 126 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3ffk n SER 127 N 0.43 1.43 -0.16 1.62 2.88 -1.26 -4.78 113.62 113.78 3ffk n SER 127 Ca 0.05 0.94 -0.07 0.00 -1.33 0.00 0.00 58.87 58.45 3ffk n SER 127 Cb 0.38 -1.42 0.01 0.00 -0.75 0.00 0.00 64.21 62.44 3ffk n SER 127 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ffk h ALA 128 N 1.17 0.60 -0.81 -1.46 0.00 -1.99 0.42 119.26 117.18 3ffk h ALA 128 Ca -0.48 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.51 3ffk h ALA 128 Cb 1.34 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 3ffk h ALA 128 CO 0.55 0.05 0.44 1.15 0.00 0.00 0.00 179.25 181.43 3ffk h THR 129 N 0.64 0.84 0.37 0.00 2.02 -1.97 -0.01 112.91 114.80 3ffk h THR 129 Ca 0.17 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 3ffk h THR 129 Cb -0.07 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.42 3ffk h THR 129 CO -0.04 0.13 -0.18 0.15 0.37 0.00 0.00 175.52 175.95 3ffk h PHE 130 N 0.70 -0.46 -1.00 3.16 3.57 -1.67 -2.84 116.94 118.40 3ffk h PHE 130 Ca 0.41 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.09 3ffk h PHE 130 Cb 0.45 0.15 -0.11 0.00 2.79 0.00 0.00 35.95 39.24 3ffk h PHE 130 CO -0.08 -0.21 0.61 -0.07 -2.23 0.00 0.00 178.31 176.33 3ffk h LEU 131 N -0.61 0.77 0.00 0.59 3.38 -0.61 -0.87 115.31 117.96 3ffk h LEU 131 Ca -0.05 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3ffk h LEU 131 Cb 0.45 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3ffk h LEU 131 CO 0.08 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.49 3ffk n GLY 132 N -1.33 -0.56 0.00 0.83 0.00 -0.05 -1.84 105.19 102.25 3ffk n GLY 132 Ca 0.23 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.33 3ffk n GLY 132 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ffk n TYR 133 N -0.74 0.00 -3.94 1.61 4.01 -0.33 -4.78 117.16 112.99 3ffk n TYR 133 Ca 0.06 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.50 3ffk n TYR 133 Cb 0.03 -0.31 -0.15 0.00 -0.31 0.00 0.00 39.34 38.59 3ffk n TYR 133 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3ffk s PHE 134 N -2.99 2.66 0.54 -0.72 0.40 -0.76 -5.00 117.98 112.09 3ffk s PHE 134 Ca 0.12 -2.07 0.20 0.00 -0.60 0.00 0.00 56.93 54.58 3ffk s PHE 134 Cb 0.18 -1.92 1.41 0.00 0.51 0.00 0.00 43.02 43.19 3ffk s PHE 134 CO 0.65 -0.84 2.16 1.57 0.70 0.00 0.00 175.22 179.47 3ffk h LYS 135 N 7.89 0.00 0.00 0.44 2.10 -1.86 -2.16 116.57 122.98 3ffk h LYS 135 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 3ffk h LYS 135 Cb 1.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.38 3ffk h LYS 135 CO 0.45 0.00 -1.16 0.43 -2.00 0.00 0.00 179.45 177.17 3ffk n SER 136 N -4.36 0.58 0.00 7.07 7.64 -1.26 -5.09 113.62 118.19 3ffk n SER 136 Ca -0.02 -0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.62 3ffk n SER 136 Cb 0.13 0.96 0.00 0.00 -1.01 0.00 0.00 64.21 64.29 3ffk n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ffk n GLY 137 N 1.36 -1.03 3.59 0.23 0.00 -0.81 -5.01 105.19 103.52 3ffk n GLY 137 Ca 0.01 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 3ffk n GLY 137 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ffk n LEU 138 N -0.83 3.00 -3.81 0.99 4.77 -1.26 -4.97 117.00 114.89 3ffk n LEU 138 Ca 0.00 0.60 -0.28 0.00 -0.03 0.00 0.00 56.01 56.30 3ffk n LEU 138 Cb 0.00 -1.39 -0.16 0.00 -2.33 0.00 0.00 43.42 39.54 3ffk n LEU 138 CO 0.00 -2.26 -0.39 -0.54 -1.33 0.00 0.00 177.39 172.87 3ffk s LYS 139 N -3.49 1.02 0.44 3.23 1.02 -0.60 -5.01 119.74 116.35 3ffk s LYS 139 Ca 0.71 -0.58 -0.22 0.00 0.02 0.00 0.00 55.97 55.90 3ffk s LYS 139 Cb -0.32 -2.20 -0.09 0.00 -0.52 0.00 0.00 37.83 34.70 3ffk s LYS 139 CO 0.53 -0.59 1.03 0.71 -0.92 0.00 0.00 175.35 176.11 3ffk s TYR 140 N 1.70 3.15 -0.05 3.18 4.12 -1.26 -1.45 117.35 126.74 3ffk s TYR 140 Ca -0.02 1.61 0.01 0.00 0.02 0.00 0.00 57.07 58.69 3ffk s TYR 140 Cb -0.17 -3.06 0.02 0.00 -1.52 0.00 0.00 41.96 37.23 3ffk s TYR 140 CO -0.07 -0.65 -0.03 0.15 0.02 0.00 0.00 175.55 174.96 3ffk s LYS 141 N -2.91 0.76 0.48 -0.62 -0.14 0.33 -4.85 119.74 112.80 3ffk s LYS 141 Ca 0.63 -0.06 -0.24 0.00 -1.36 0.00 0.00 55.97 54.94 3ffk s LYS 141 Cb -0.18 -0.84 -0.07 0.00 -1.68 0.00 0.00 37.83 35.06 3ffk s LYS 141 CO 0.22 -0.12 1.33 0.21 -0.76 0.00 0.00 175.35 176.23 3ffk s LYS 142 N 1.11 3.54 1.36 1.68 2.47 -1.26 -0.29 119.74 128.34 3ffk s LYS 142 Ca -0.08 2.18 0.00 0.00 -1.56 0.00 0.00 55.97 56.51 3ffk s LYS 142 Cb -0.14 -2.48 0.00 0.00 -1.46 0.00 0.00 37.83 33.76 3ffk s LYS 142 CO -0.01 -0.86 0.00 0.41 0.16 0.00 0.00 175.35 175.05 3ffk n GLY 143 N 0.63 -1.64 0.00 5.54 0.00 -1.26 -4.77 105.19 103.69 3ffk n GLY 143 Ca 0.07 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3ffk n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ffk n GLY 144 N 0.00 0.21 3.77 -0.02 0.00 -1.26 -1.80 105.19 106.08 3ffk n GLY 144 Ca 0.00 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 3ffk n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk s VAL 145 N -2.44 4.94 0.24 1.61 0.11 -1.26 -5.03 120.40 118.57 3ffk s VAL 145 Ca 0.00 1.18 -0.31 0.00 -2.93 0.00 0.00 61.98 59.92 3ffk s VAL 145 Cb 0.00 -3.90 -0.14 0.00 -1.53 0.00 0.00 36.38 30.81 3ffk s VAL 145 CO 0.00 0.43 1.27 0.00 -3.33 0.00 0.00 175.10 173.47 3ffk n ALA 146 N 2.70 0.40 -1.30 1.54 0.00 -1.26 -4.93 120.51 117.66 3ffk n ALA 146 Ca -0.08 0.42 -0.37 0.00 0.00 0.00 0.00 53.44 53.41 3ffk n ALA 146 Cb 0.51 -2.17 0.05 0.00 0.00 0.00 0.00 19.45 17.84 3ffk n ALA 146 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ffk n SER 147 N 1.86 -1.85 0.13 0.00 2.88 -1.26 -4.62 113.62 110.75 3ffk n SER 147 Ca 0.12 0.62 0.05 0.00 -1.33 0.00 0.00 58.87 58.32 3ffk n SER 147 Cb 0.30 -1.11 0.03 0.00 -0.75 0.00 0.00 64.21 62.67 3ffk n SER 147 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3ffk h GLY 148 N -0.17 0.00 -4.52 0.46 0.00 -1.93 -3.47 103.07 93.44 3ffk h GLY 148 Ca -0.45 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.36 3ffk h GLY 148 CO 0.43 0.00 0.94 -1.36 0.00 0.00 0.00 176.54 176.55 3ffk s PHE 149 N -3.04 2.89 0.26 5.60 2.99 -1.26 -5.02 117.98 120.41 3ffk s PHE 149 Ca 0.03 0.55 -0.22 0.00 0.00 0.00 0.00 56.93 57.29 3ffk s PHE 149 Cb 0.07 -4.07 -0.09 0.00 0.00 0.00 0.00 43.02 38.94 3ffk s PHE 149 CO 0.75 -3.88 0.81 0.21 -0.00 0.00 0.00 175.22 173.10 3ffk s LYS 150 N 0.61 4.37 -0.21 0.44 2.20 -1.26 -5.07 119.74 120.82 3ffk s LYS 150 Ca 0.70 1.04 -0.10 0.00 -0.36 0.00 0.00 55.97 57.25 3ffk s LYS 150 Cb -0.48 -2.83 -0.05 0.00 -1.51 0.00 0.00 37.83 32.96 3ffk s LYS 150 CO 0.37 0.34 0.13 -1.58 -0.36 0.00 0.00 175.35 174.26 3ffk s HIS 151 N -1.57 3.36 0.05 4.03 5.65 -1.26 -5.09 115.29 120.46 3ffk s HIS 151 Ca 0.46 0.27 0.04 0.00 0.25 0.00 0.00 55.06 56.08 3ffk s HIS 151 Cb -0.17 -2.19 -0.02 0.00 -1.18 0.00 0.00 32.58 29.01 3ffk s HIS 151 CO 0.22 0.20 -0.13 0.14 -0.65 0.00 0.00 174.74 174.52 3ffk s VAL 152 N 0.61 1.00 -0.28 0.89 -7.23 -1.26 -5.12 120.40 109.01 3ffk s VAL 152 Ca 0.07 -1.09 -0.06 0.00 -1.81 0.00 0.00 61.98 59.10 3ffk s VAL 152 Cb -0.12 -0.95 0.01 0.00 0.56 0.00 0.00 36.38 35.88 3ffk s VAL 152 CO 0.00 -0.13 0.05 0.54 -0.31 0.00 0.00 175.10 175.26 3ffk s VAL 153 N -1.04 3.79 0.19 1.32 0.11 -1.26 -5.07 120.40 118.43 3ffk s VAL 153 Ca -0.01 -0.69 -0.32 0.00 -2.93 0.00 0.00 61.98 58.02 3ffk s VAL 153 Cb -0.09 -2.92 -0.15 0.00 -1.53 0.00 0.00 36.38 31.70 3ffk s VAL 153 CO 0.01 0.14 1.32 -2.65 -3.33 0.00 0.00 175.10 170.59 3ffk n PRO 154 N 4.84 1.63 -0.88 1.54 -0.02 -1.26 -1.94 135.00 138.90 3ffk n PRO 154 Ca -0.15 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3ffk n PRO 154 Cb 0.48 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3ffk n PRO 154 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ffk n ASN 155 N 2.24 -3.90 -4.74 2.55 3.02 -1.26 -4.96 115.26 108.21 3ffk n ASN 155 Ca 0.14 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.28 3ffk n ASN 155 Cb 0.27 -2.68 -0.03 0.00 -0.61 0.00 0.00 39.78 36.73 3ffk n ASN 155 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ffk s GLU 156 N -1.40 4.39 -0.03 3.52 2.12 -0.82 -5.04 118.70 121.45 3ffk s GLU 156 Ca 0.00 2.06 0.01 0.00 0.36 0.00 0.00 54.97 57.40 3ffk s GLU 156 Cb 0.00 -3.19 0.02 0.00 0.26 0.00 0.00 34.13 31.22 3ffk s GLU 156 CO 0.00 -0.24 -0.04 0.14 -0.54 0.00 0.00 175.26 174.58 3ffk s VAL 157 N 0.01 0.46 -0.33 3.70 -7.23 -1.26 -5.03 120.40 110.72 3ffk s VAL 157 Ca 0.56 -0.12 -0.00 0.00 -1.81 0.00 0.00 61.98 60.61 3ffk s VAL 157 Cb -0.37 -0.47 0.08 0.00 0.56 0.00 0.00 36.38 36.18 3ffk s VAL 157 CO 0.39 0.19 0.06 -0.69 -0.31 0.00 0.00 175.10 174.73 3ffk s VAL 158 N 0.66 2.81 -0.05 1.32 1.01 -1.26 -4.83 120.40 120.07 3ffk s VAL 158 Ca -0.08 -1.82 -0.02 0.00 0.00 0.00 0.00 61.98 60.05 3ffk s VAL 158 Cb -0.12 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.49 3ffk s VAL 158 CO -0.00 -0.37 0.11 -0.69 0.00 0.00 0.00 175.10 174.15 3ffk s VAL 159 N 1.12 -0.04 -0.27 2.92 1.01 -1.26 -5.03 120.40 118.85 3ffk s VAL 159 Ca 0.02 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 3ffk s VAL 159 Cb -0.20 -0.19 0.11 0.00 0.00 0.00 0.00 36.38 36.10 3ffk s VAL 159 CO -0.04 0.06 0.21 -1.58 0.00 0.00 0.00 175.10 173.75 3ffk s GLN 160 N 0.92 0.24 0.09 2.72 0.74 -1.25 -3.41 119.66 119.71 3ffk s GLN 160 Ca -0.07 -0.25 -0.06 0.00 0.05 0.00 0.00 55.36 55.03 3ffk s GLN 160 Cb -0.10 -0.99 -0.02 0.00 1.10 0.00 0.00 33.01 33.01 3ffk s GLN 160 CO -0.04 -0.96 0.12 -0.98 -0.55 0.00 0.00 175.29 172.88 3ffk s ARG 161 N 2.24 0.80 0.02 1.67 1.70 -0.82 -4.98 118.95 119.59 3ffk s ARG 161 Ca 0.09 -1.09 0.04 0.00 -0.47 0.00 0.00 55.73 54.29 3ffk s ARG 161 Cb -0.15 0.30 -0.02 0.00 -0.57 0.00 0.00 34.95 34.51 3ffk s ARG 161 CO -0.31 -0.23 -0.11 -1.17 -1.08 0.00 0.00 175.30 172.40 3ffk s LEU 162 N -2.90 2.12 0.02 -1.89 2.96 -1.26 -1.36 118.68 116.38 3ffk s LEU 162 Ca 0.08 -0.36 0.07 0.00 -0.22 0.00 0.00 54.13 53.70 3ffk s LEU 162 Cb 0.06 -0.49 -0.02 0.00 0.50 0.00 0.00 46.19 46.24 3ffk s LEU 162 CO -0.09 0.03 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.42 3ffk s PHE 163 N -0.67 1.71 -0.28 5.38 0.40 -0.17 -1.82 117.98 122.54 3ffk s PHE 163 Ca 0.01 -0.35 -0.10 0.00 -0.60 0.00 0.00 56.93 55.88 3ffk s PHE 163 Cb -0.06 -1.05 -0.04 0.00 0.51 0.00 0.00 43.02 42.37 3ffk s PHE 163 CO 0.00 0.04 0.17 -1.14 0.70 0.00 0.00 175.22 174.99 3ffk s GLN 164 N -0.90 3.85 -0.33 0.44 0.74 0.18 -1.77 119.66 121.86 3ffk s GLN 164 Ca 0.07 -0.38 -0.10 0.00 0.05 0.00 0.00 55.36 54.99 3ffk s GLN 164 Cb -0.08 -3.59 0.00 0.00 1.10 0.00 0.00 33.01 30.44 3ffk s GLN 164 CO 0.01 -0.20 0.18 0.08 -0.55 0.00 0.00 175.29 174.80 3ffk s VAL 165 N 1.72 4.68 -0.08 1.34 1.01 0.86 -1.77 120.40 128.16 3ffk s VAL 165 Ca 0.07 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 3ffk s VAL 165 Cb -0.16 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 32.80 3ffk s VAL 165 CO 0.09 -0.02 0.30 -0.75 0.00 0.00 0.00 175.10 174.72 3ffk s LYS 166 N 1.61 0.46 0.00 2.72 2.20 -1.09 -1.60 119.74 124.04 3ffk s LYS 166 Ca 0.04 0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 3ffk s LYS 166 Cb -0.18 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.36 3ffk s LYS 166 CO 0.07 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.38 3ffk n GLY 167 N 2.33 1.80 0.04 5.54 0.00 -1.26 -1.33 105.19 112.32 3ffk n GLY 167 Ca -0.16 -0.87 -0.02 0.00 0.00 0.00 0.00 46.02 44.97 3ffk n GLY 167 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ffk h ARG 168 N 0.00 0.00 0.00 1.61 2.43 -1.85 -3.43 114.38 113.13 3ffk h ARG 168 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ffk h ARG 168 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3ffk h ARG 168 CO 0.00 0.00 -0.85 0.54 -1.51 0.00 0.00 179.97 178.15 3ffk n ARG 169 N -3.96 1.90 -3.72 0.20 1.74 -1.26 -4.65 116.66 106.91 3ffk n ARG 169 Ca -0.03 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.68 3ffk n ARG 169 Cb 0.12 -0.92 -0.10 0.00 -1.02 0.00 0.00 32.46 30.54 3ffk n ARG 169 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3ffk s VAL 170 N -1.76 3.64 -0.03 1.55 1.01 -1.26 -5.04 120.40 118.51 3ffk s VAL 170 Ca 0.00 -2.63 -0.17 0.00 0.00 0.00 0.00 61.98 59.18 3ffk s VAL 170 Cb 0.00 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 3ffk s VAL 170 CO 0.00 -0.82 0.45 -0.69 0.00 0.00 0.00 175.10 174.04 3ffk s VAL 171 N 0.36 5.04 0.03 2.92 1.01 -1.26 -4.39 120.40 124.11 3ffk s VAL 171 Ca 0.14 0.93 0.01 0.00 0.00 0.00 0.00 61.98 63.06 3ffk s VAL 171 Cb -0.21 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3ffk s VAL 171 CO -0.04 0.49 -0.06 -0.13 0.00 0.00 0.00 175.10 175.37 3ffk s ARG 172 N -0.50 0.42 -0.16 2.72 1.81 -0.44 -4.94 118.95 117.85 3ffk s ARG 172 Ca 0.25 -0.60 -0.08 0.00 -1.72 0.00 0.00 55.73 53.58 3ffk s ARG 172 Cb -0.17 -0.16 -0.04 0.00 -0.45 0.00 0.00 34.95 34.13 3ffk s ARG 172 CO 0.13 0.02 0.11 0.00 -0.68 0.00 0.00 175.30 174.88 3ffk s ALA 173 N -1.17 3.65 -0.05 2.13 0.00 -1.26 -2.67 121.76 122.38 3ffk s ALA 173 Ca -0.10 -0.70 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 3ffk s ALA 173 Cb -0.08 -2.00 0.01 0.00 0.00 0.00 0.00 23.12 21.05 3ffk s ALA 173 CO -0.00 0.33 0.12 -0.08 0.00 0.00 0.00 175.76 176.12 3ffk s THR 174 N -0.12 -0.00 0.23 0.00 -1.32 -0.73 -4.97 115.64 108.72 3ffk s THR 174 Ca 0.09 0.01 -0.24 0.00 -1.21 0.00 0.00 61.69 60.35 3ffk s THR 174 Cb -0.12 -0.18 -0.09 0.00 -1.51 0.00 0.00 72.50 70.61 3ffk s THR 174 CO 0.00 0.01 0.80 -0.70 -2.21 0.00 0.00 174.62 172.52 3ffk s GLU 175 N 0.15 4.46 0.07 7.08 2.12 -1.26 -0.65 118.70 130.67 3ffk s GLU 175 Ca -0.01 1.10 -0.03 0.00 0.36 0.00 0.00 54.97 56.40 3ffk s GLU 175 Cb -0.02 -3.01 -0.03 0.00 0.26 0.00 0.00 34.13 31.33 3ffk s GLU 175 CO -0.00 0.44 0.03 0.14 -0.54 0.00 0.00 175.26 175.32 3ffk s VAL 176 N -1.40 0.19 0.57 3.70 -7.23 -0.75 -4.90 120.40 110.58 3ffk s VAL 176 Ca 0.42 -1.69 -0.20 0.00 -1.81 0.00 0.00 61.98 58.70 3ffk s VAL 176 Cb -0.20 -1.55 -0.06 0.00 0.56 0.00 0.00 36.38 35.14 3ffk s VAL 176 CO 0.24 -0.86 1.02 -2.65 -0.31 0.00 0.00 175.10 172.54 3ffk n PRO 177 N 0.05 1.07 -2.44 4.82 -0.02 -1.26 -4.08 135.00 133.13 3ffk n PRO 177 Ca -0.13 0.40 -0.41 0.00 -2.02 0.00 0.00 63.50 61.34 3ffk n PRO 177 Cb 0.62 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 3ffk n PRO 177 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3ffk n VAL 178 N -1.45 3.67 -3.60 -1.45 0.31 -1.26 -4.68 118.33 109.87 3ffk n VAL 178 Ca 0.13 -3.77 -0.13 0.00 -0.01 0.00 0.00 64.34 60.56 3ffk n VAL 178 Cb 0.46 -2.35 -0.05 0.00 -0.91 0.00 0.00 33.84 30.99 3ffk n VAL 178 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3ffk s SER 179 N 4.41 -0.37 0.59 4.52 0.15 -1.26 -4.94 113.70 116.80 3ffk s SER 179 Ca 0.55 0.02 0.30 0.00 0.70 0.00 0.00 55.95 57.52 3ffk s SER 179 Cb 0.04 0.48 1.82 0.00 -1.71 0.00 0.00 66.02 66.66 3ffk s SER 179 CO 0.07 -0.75 2.25 -0.50 1.20 0.00 0.00 173.24 175.51 3ffk h TRP 180 N 2.69 0.00 0.00 3.44 4.06 -1.89 -2.58 115.95 121.67 3ffk h TRP 180 Ca -0.32 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.63 3ffk h TRP 180 Cb 1.23 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.39 3ffk h TRP 180 CO 0.36 0.00 -0.01 0.93 -3.56 0.00 0.00 178.44 176.15 3ffk h GLU 181 N 0.00 0.00 0.00 0.49 5.08 -1.95 -0.74 114.58 117.45 3ffk h GLU 181 Ca 0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 3ffk h GLU 181 Cb 0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3ffk h GLU 181 CO -0.00 0.01 -0.14 0.77 -1.00 0.00 0.00 179.01 178.65 3ffk h SER 182 N 0.00 0.00 -3.92 1.42 0.02 -1.73 -3.46 113.55 105.88 3ffk h SER 182 Ca -0.00 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.47 3ffk h SER 182 Cb 0.04 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.59 3ffk h SER 182 CO 0.00 0.14 0.40 -0.36 -1.14 0.00 0.00 176.83 175.88 3ffk s PHE 183 N -3.34 3.43 0.00 3.45 0.08 -0.29 -5.05 117.98 116.27 3ffk s PHE 183 Ca 0.04 1.69 -0.08 0.00 0.12 0.00 0.00 56.93 58.70 3ffk s PHE 183 Cb 0.07 -3.08 0.00 0.00 -0.57 0.00 0.00 43.02 39.44 3ffk s PHE 183 CO 0.65 -0.36 0.16 0.54 -0.10 0.00 0.00 175.22 176.11 3ffk s ASN 184 N -1.50 0.00 0.00 1.36 2.20 -1.26 -4.51 114.94 111.23 3ffk s ASN 184 Ca 0.54 -0.19 0.00 0.00 -0.94 0.00 0.00 52.86 52.27 3ffk s ASN 184 Cb -0.22 0.22 0.00 0.00 -2.00 0.00 0.00 41.25 39.25 3ffk s ASN 184 CO 0.28 -0.40 0.47 0.59 -2.94 0.00 0.00 177.10 175.10 3ffk n ASN 185 N 1.36 0.06 -0.02 3.54 5.03 -0.61 -3.09 115.26 121.53 3ffk n ASN 185 Ca -0.22 -0.99 0.00 0.00 0.87 0.00 0.00 54.58 54.24 3ffk n ASN 185 Cb 0.56 -0.03 0.00 0.00 -1.02 0.00 0.00 39.78 39.29 3ffk n ASN 185 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ffk n GLY 186 N 0.03 -0.83 3.42 7.41 0.00 -1.26 -1.44 105.19 112.51 3ffk n GLY 186 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 3ffk n GLY 186 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ffk s ASP 187 N -0.31 2.13 0.25 1.61 -0.00 -1.18 -3.75 116.67 115.41 3ffk s ASP 187 Ca 0.01 -1.59 0.06 0.00 -0.00 0.00 0.00 52.55 51.03 3ffk s ASP 187 Cb 0.01 0.39 -0.03 0.00 -0.00 0.00 0.00 42.92 43.28 3ffk s ASP 187 CO 0.01 -0.88 0.28 0.00 -0.00 0.00 0.00 175.17 174.59 3ffk s PHE 189 N -2.06 -0.22 -0.29 0.00 0.40 0.19 -0.10 117.98 115.90 3ffk s PHE 189 Ca 0.34 0.55 -0.06 0.00 -0.60 0.00 0.00 56.93 57.16 3ffk s PHE 189 Cb -0.08 0.04 0.02 0.00 0.51 0.00 0.00 43.02 43.51 3ffk s PHE 189 CO 0.27 -0.14 0.05 0.42 0.70 0.00 0.00 175.22 176.53 3ffk s ILE 190 N 0.50 3.68 -0.47 0.64 1.01 -0.73 -0.69 121.20 125.15 3ffk s ILE 190 Ca -0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.60 3ffk s ILE 190 Cb -0.05 -2.94 0.08 0.00 0.01 0.00 0.00 42.46 39.56 3ffk s ILE 190 CO -0.02 0.04 0.38 -0.22 0.00 0.00 0.00 174.94 175.11 3ffk s LEU 191 N 1.44 5.57 -0.31 2.97 2.96 0.36 -0.99 118.68 130.67 3ffk s LEU 191 Ca 0.01 -1.37 -0.16 0.00 -0.22 0.00 0.00 54.13 52.39 3ffk s LEU 191 Cb -0.18 -2.15 -0.02 0.00 0.50 0.00 0.00 46.19 44.34 3ffk s LEU 191 CO 0.01 -0.64 0.39 -0.62 -1.32 0.00 0.00 176.35 174.18 3ffk s ASP 192 N 2.55 6.24 -0.18 3.68 2.15 -0.46 -0.15 116.67 130.49 3ffk s ASP 192 Ca 0.04 0.04 0.16 0.00 0.43 0.00 0.00 52.55 53.21 3ffk s ASP 192 Cb -0.24 -2.22 0.42 0.00 -0.30 0.00 0.00 42.92 40.58 3ffk s ASP 192 CO 0.06 -0.29 1.30 0.18 -0.17 0.00 0.00 175.17 176.24 3ffk n LEU 193 N 5.42 3.18 0.00 -1.34 4.77 0.25 -1.94 117.00 127.35 3ffk n LEU 193 Ca -0.08 -3.29 0.00 0.00 -0.03 0.00 0.00 56.01 52.61 3ffk n LEU 193 Cb 0.50 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3ffk n LEU 193 CO 0.40 0.88 0.00 0.61 -1.33 0.00 0.00 177.39 177.94 3ffk n GLY 194 N -1.05 1.12 0.00 -0.72 0.00 -1.22 -4.28 105.19 99.04 3ffk n GLY 194 Ca 0.21 -0.68 0.10 0.00 0.00 0.00 0.00 46.02 45.65 3ffk n GLY 194 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ffk n ASN 195 N 1.39 0.00 -3.85 1.61 3.02 -1.26 -4.69 115.26 111.49 3ffk n ASN 195 Ca 0.00 0.37 -0.19 0.00 -0.03 0.00 0.00 54.58 54.74 3ffk n ASN 195 Cb 0.00 -0.45 -0.16 0.00 -0.61 0.00 0.00 39.78 38.56 3ffk n ASN 195 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3ffk s ASN 196 N -2.89 0.75 -0.15 6.41 0.01 -1.26 0.92 114.94 118.73 3ffk s ASN 196 Ca 0.12 -0.08 0.01 0.00 -0.71 0.00 0.00 52.86 52.20 3ffk s ASN 196 Cb 0.13 -0.34 0.02 0.00 0.41 0.00 0.00 41.25 41.47 3ffk s ASN 196 CO 0.35 -0.08 -0.17 -0.63 -1.51 0.00 0.00 177.10 175.06 3ffk s ILE 197 N 1.04 1.76 -0.49 0.60 1.01 0.07 -0.58 121.20 124.60 3ffk s ILE 197 Ca -0.09 -0.76 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 3ffk s ILE 197 Cb -0.14 -1.61 0.08 0.00 0.01 0.00 0.00 42.46 40.80 3ffk s ILE 197 CO -0.01 0.49 0.47 -1.00 0.00 0.00 0.00 174.94 174.89 3ffk s HIS 198 N 1.28 3.19 -0.22 3.97 3.76 0.79 0.50 115.29 128.57 3ffk s HIS 198 Ca 0.02 -0.90 -0.23 0.00 -0.15 0.00 0.00 55.06 53.79 3ffk s HIS 198 Cb -0.13 -3.38 -0.01 0.00 1.11 0.00 0.00 32.58 30.17 3ffk s HIS 198 CO -0.09 -0.90 0.76 -1.14 -0.85 0.00 0.00 174.74 172.51 3ffk s GLN 199 N 1.89 4.21 -0.06 1.40 0.74 -0.65 -0.49 119.66 126.70 3ffk s GLN 199 Ca 0.06 0.83 0.01 0.00 0.05 0.00 0.00 55.36 56.32 3ffk s GLN 199 Cb -0.24 -3.61 0.02 0.00 1.10 0.00 0.00 33.01 30.28 3ffk s GLN 199 CO 0.07 -0.39 -0.07 -0.46 -0.55 0.00 0.00 175.29 173.89 3ffk s TRP 200 N 2.41 1.06 -0.04 1.67 -0.00 0.14 -0.35 118.94 123.82 3ffk s TRP 200 Ca 0.33 -0.38 0.06 0.00 -0.00 0.00 0.00 56.10 56.11 3ffk s TRP 200 Cb -0.16 -0.89 -0.01 0.00 -0.00 0.00 0.00 33.47 32.41 3ffk s TRP 200 CO 0.09 -0.28 -0.23 0.00 -0.00 0.00 0.00 176.95 176.53 3ffk s GLY 202 N -0.26 1.65 0.33 0.00 0.00 -0.91 -4.40 107.32 103.73 3ffk s GLY 202 Ca 0.01 -0.02 0.05 0.00 0.00 0.00 0.00 44.72 44.75 3ffk s GLY 202 CO 0.02 0.36 1.84 1.48 0.00 0.00 0.00 173.10 176.80 3ffk h SER 203 N -1.01 0.44 -0.38 1.64 4.64 -1.89 -2.67 113.55 114.33 3ffk h SER 203 Ca -0.46 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 3ffk h SER 203 Cb 1.24 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3ffk h SER 203 CO 0.57 0.57 0.00 0.59 -0.87 0.00 0.00 176.83 177.69 3ffk n ASN 204 N -4.24 2.28 -4.72 4.97 3.02 -0.52 -4.90 115.26 111.14 3ffk n ASN 204 Ca 0.01 -2.07 -0.41 0.00 -0.03 0.00 0.00 54.58 52.07 3ffk n ASN 204 Cb 0.29 -0.31 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 3ffk n ASN 204 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3ffk s SER 205 N -0.91 7.26 1.10 6.41 1.04 -1.01 -4.74 113.70 122.86 3ffk s SER 205 Ca 0.26 1.96 -0.18 0.00 0.48 0.00 0.00 55.95 58.48 3ffk s SER 205 Cb 0.15 -2.59 0.25 0.00 0.10 0.00 0.00 66.02 63.93 3ffk s SER 205 CO 0.16 -0.28 1.18 0.54 0.98 0.00 0.00 173.24 175.83 3ffk s ASN 206 N 0.43 1.83 0.22 7.02 2.20 -1.26 -4.89 114.94 120.48 3ffk s ASN 206 Ca 0.52 0.53 -0.05 0.00 -0.94 0.00 0.00 52.86 52.92 3ffk s ASN 206 Cb -0.27 -0.73 0.20 0.00 -2.00 0.00 0.00 41.25 38.45 3ffk s ASN 206 CO 0.31 -3.55 1.68 -0.09 -2.94 0.00 0.00 177.10 172.51 3ffk h ARG 207 N -2.20 0.89 -0.05 3.55 2.43 -1.95 -3.10 114.38 113.96 3ffk h ARG 207 Ca -0.45 -0.29 -0.13 0.00 -0.81 0.00 0.00 59.98 58.30 3ffk h ARG 207 Cb 1.28 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3ffk h ARG 207 CO 0.37 0.93 -0.57 1.88 -1.51 0.00 0.00 179.97 181.07 3ffk h TYR 208 N 0.81 0.19 -0.07 2.20 -1.99 -1.93 -2.84 116.97 113.34 3ffk h TYR 208 Ca 0.14 -0.07 -0.11 0.00 2.00 0.00 0.00 58.73 60.69 3ffk h TYR 208 Cb 0.57 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.25 3ffk h TYR 208 CO 0.03 0.68 -0.46 0.93 -0.00 0.00 0.00 178.16 179.35 3ffk h GLU 209 N 0.11 0.18 -0.06 4.88 5.08 -1.82 -2.63 114.58 120.32 3ffk h GLU 209 Ca -0.00 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 3ffk h GLU 209 Cb 1.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3ffk h GLU 209 CO 0.08 0.61 -0.05 0.00 -1.00 0.00 0.00 179.01 178.65 3ffk h ARG 210 N 0.15 0.14 -0.33 2.33 3.08 -1.43 -1.14 114.38 117.17 3ffk h ARG 210 Ca 0.01 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.02 3ffk h ARG 210 Cb 0.88 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 3ffk h ARG 210 CO 0.07 0.56 0.13 1.25 -1.07 0.00 0.00 179.97 180.91 3ffk h LEU 211 N -0.28 0.17 -0.71 3.04 5.85 -1.54 -1.94 115.31 119.90 3ffk h LEU 211 Ca 0.01 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.76 3ffk h LEU 211 Cb 0.53 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 3ffk h LEU 211 CO 0.01 0.13 0.46 0.50 -0.34 0.00 0.00 178.44 179.21 3ffk h LYS 212 N 0.29 0.94 -0.63 1.25 1.63 -1.46 0.44 116.57 119.02 3ffk h LYS 212 Ca 0.14 -0.06 0.10 0.00 -0.85 0.00 0.00 60.65 59.98 3ffk h LYS 212 Cb 0.09 -0.21 -0.07 0.00 -0.60 0.00 0.00 32.23 31.44 3ffk h LYS 212 CO -0.13 0.63 0.25 0.00 -3.45 0.00 0.00 179.45 176.75 3ffk h ALA 213 N 1.25 0.83 0.04 5.00 0.00 -0.91 0.07 119.26 125.53 3ffk h ALA 213 Ca 0.26 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 3ffk h ALA 213 Cb -0.10 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3ffk h ALA 213 CO -0.05 -0.17 -0.02 1.15 0.00 0.00 0.00 179.25 180.16 3ffk h THR 214 N 0.44 1.29 -0.48 0.00 2.02 -0.55 -0.91 112.91 114.72 3ffk h THR 214 Ca 0.32 -1.07 0.10 0.00 0.77 0.00 0.00 66.41 66.53 3ffk h THR 214 Cb 0.39 1.99 -0.10 0.00 -1.74 0.00 0.00 68.15 68.70 3ffk h THR 214 CO -0.31 0.27 -0.21 1.56 0.37 0.00 0.00 175.52 177.20 3ffk h GLN 215 N -0.52 -0.10 -0.20 6.66 4.20 0.12 -0.86 115.11 124.40 3ffk h GLN 215 Ca -0.00 0.01 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 3ffk h GLN 215 Cb 0.48 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.28 3ffk h GLN 215 CO 0.01 -0.07 -0.63 0.28 -0.67 0.00 0.00 178.83 177.75 3ffk h VAL 216 N -0.11 1.30 -0.16 -0.54 2.07 -1.01 -1.59 116.25 116.22 3ffk h VAL 216 Ca 0.22 -1.87 -0.00 0.00 0.82 0.00 0.00 66.70 65.88 3ffk h VAL 216 Cb 0.46 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 3ffk h VAL 216 CO -0.54 0.59 0.09 0.28 0.02 0.00 0.00 177.57 178.00 3ffk h SER 217 N 0.52 0.20 -0.71 0.57 0.02 -0.75 -0.38 113.55 113.02 3ffk h SER 217 Ca -0.01 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.80 3ffk h SER 217 Cb 1.22 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 3ffk h SER 217 CO 0.13 0.23 0.23 0.11 -1.14 0.00 0.00 176.83 176.39 3ffk h LYS 218 N 0.15 1.09 -0.20 3.45 1.57 -1.17 -1.40 116.57 120.06 3ffk h LYS 218 Ca 0.06 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3ffk h LYS 218 Cb 0.08 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.16 3ffk h LYS 218 CO -0.01 0.93 -0.23 0.78 -0.57 0.00 0.00 179.45 180.35 3ffk h GLY 219 N 1.03 -0.17 0.88 3.86 0.00 -1.01 0.22 103.07 107.88 3ffk h GLY 219 Ca 0.23 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.87 3ffk h GLY 219 CO -0.01 -0.19 0.43 -2.22 0.00 0.00 0.00 176.54 174.55 3ffk h ILE 220 N -0.26 1.09 0.38 2.60 2.04 -0.72 0.60 117.51 123.24 3ffk h ILE 220 Ca 0.12 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 3ffk h ILE 220 Cb 0.44 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3ffk h ILE 220 CO -0.35 0.15 -0.18 -0.09 0.00 0.00 0.00 178.15 177.68 3ffk h ARG 221 N 0.84 -0.49 0.07 2.37 2.43 -0.88 -1.26 114.38 117.46 3ffk h ARG 221 Ca 0.27 0.03 -0.26 0.00 -0.81 0.00 0.00 59.98 59.22 3ffk h ARG 221 Cb 0.01 0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3ffk h ARG 221 CO -0.11 -0.18 -1.10 -0.44 -1.51 0.00 0.00 179.97 176.63 3ffk h ASP 222 N -0.86 0.59 0.00 -3.80 3.32 -0.54 -0.80 116.42 114.33 3ffk h ASP 222 Ca -0.05 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.46 3ffk h ASP 222 Cb 0.54 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3ffk h ASP 222 CO 0.09 1.36 -0.50 -3.20 -1.72 0.00 0.00 179.24 175.27 3ffk n ASN 223 N -3.70 1.27 0.23 6.45 2.85 0.18 -2.80 115.26 119.75 3ffk n ASN 223 Ca -0.09 0.38 0.06 0.00 -0.11 0.00 0.00 54.58 54.83 3ffk n ASN 223 Cb 0.93 -0.71 0.54 0.00 1.24 0.00 0.00 39.78 41.78 3ffk n ASN 223 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3ffk h GLU 224 N -0.68 0.00 -0.15 1.20 5.08 -1.20 -3.04 114.58 115.79 3ffk h GLU 224 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ffk h GLU 224 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3ffk h GLU 224 CO 0.00 0.16 0.00 0.54 -1.00 0.00 0.00 179.01 178.71 3ffk n ARG 225 N -4.26 2.46 -2.32 2.33 5.12 -0.50 -4.99 116.66 114.49 3ffk n ARG 225 Ca -0.02 -2.31 -0.09 0.00 -1.93 0.00 0.00 57.85 53.49 3ffk n ARG 225 Cb 0.23 -1.44 -0.01 0.00 -1.16 0.00 0.00 32.46 30.08 3ffk n ARG 225 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 3ffk n SER 226 N -0.57 -3.14 0.00 0.55 7.64 -1.15 -0.45 113.62 116.51 3ffk n SER 226 Ca 0.13 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.28 3ffk n SER 226 Cb 0.59 -2.74 0.00 0.00 -1.01 0.00 0.00 64.21 61.05 3ffk n SER 226 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ffk n GLY 227 N -0.67 2.80 1.84 0.23 0.00 -0.31 -4.92 105.19 104.17 3ffk n GLY 227 Ca -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 3ffk n GLY 227 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk n ARG 228 N -2.00 1.02 -3.73 1.61 1.74 0.41 -4.78 116.66 110.92 3ffk n ARG 228 Ca 0.00 -0.30 -0.10 0.00 -0.77 0.00 0.00 57.85 56.68 3ffk n ARG 228 Cb 0.00 -1.44 -0.06 0.00 -1.02 0.00 0.00 32.46 29.94 3ffk n ARG 228 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ffk s ALA 229 N 0.97 -0.64 -0.07 7.54 0.00 -1.26 -4.60 121.76 123.69 3ffk s ALA 229 Ca 0.20 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 51.96 3ffk s ALA 229 Cb 0.10 0.56 -0.00 0.00 0.00 0.00 0.00 23.12 23.77 3ffk s ALA 229 CO 0.00 -0.56 -0.20 0.50 0.00 0.00 0.00 175.76 175.50 3ffk s ARG 230 N -3.62 2.33 -0.15 0.00 3.00 0.26 -4.94 118.95 115.84 3ffk s ARG 230 Ca 0.02 -0.73 -0.13 0.00 -1.00 0.00 0.00 55.73 53.89 3ffk s ARG 230 Cb 0.03 -1.90 -0.05 0.00 0.00 0.00 0.00 34.95 33.03 3ffk s ARG 230 CO -0.10 0.22 0.27 0.08 0.00 0.00 0.00 175.30 175.78 3ffk s VAL 231 N 0.18 5.31 -0.25 7.11 1.01 -1.26 -0.75 120.40 131.75 3ffk s VAL 231 Ca -0.10 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 3ffk s VAL 231 Cb -0.15 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.66 3ffk s VAL 231 CO 0.05 0.43 -0.08 -1.00 0.00 0.00 0.00 175.10 174.50 3ffk s HIS 232 N 0.21 3.09 0.02 5.22 0.09 0.18 -4.92 115.29 119.18 3ffk s HIS 232 Ca 0.16 -1.73 -0.23 0.00 -0.00 0.00 0.00 55.06 53.26 3ffk s HIS 232 Cb -0.13 -2.03 -0.05 0.00 -0.00 0.00 0.00 32.58 30.37 3ffk s HIS 232 CO 0.04 -0.77 0.69 0.08 -0.00 0.00 0.00 174.74 174.78 3ffk s VAL 233 N 1.28 4.81 0.17 -0.90 1.01 -1.26 -1.63 120.40 123.87 3ffk s VAL 233 Ca -0.01 1.45 -0.08 0.00 0.00 0.00 0.00 61.98 63.34 3ffk s VAL 233 Cb -0.17 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 3ffk s VAL 233 CO -0.05 0.39 0.27 -0.55 0.00 0.00 0.00 175.10 175.16 3ffk s SER 234 N -0.10 0.05 0.23 3.32 0.15 0.52 -4.97 113.70 112.91 3ffk s SER 234 Ca 0.35 -0.90 -0.02 0.00 0.70 0.00 0.00 55.95 56.08 3ffk s SER 234 Cb -0.19 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.56 3ffk s SER 234 CO 0.20 -0.89 0.34 -1.84 1.20 0.00 0.00 173.24 172.25 3ffk n GLU 235 N -0.22 0.49 -1.72 5.44 0.28 -1.26 -2.67 120.64 120.98 3ffk n GLU 235 Ca -0.07 -1.77 -0.63 0.00 -0.16 0.00 0.00 57.16 54.53 3ffk n GLU 235 Cb 0.63 1.75 -0.09 0.00 1.43 0.00 0.00 31.44 35.16 3ffk n GLU 235 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3ffk n GLU 236 N -0.37 0.45 -0.32 3.44 2.13 -1.26 -1.00 120.64 123.70 3ffk n GLU 236 Ca -0.00 0.17 0.00 0.00 0.66 0.00 0.00 57.16 57.98 3ffk n GLU 236 Cb 0.38 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 30.35 3ffk n GLU 236 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ffk n GLY 237 N 3.89 1.85 0.19 8.31 0.00 -1.26 -4.82 105.19 113.36 3ffk n GLY 237 Ca 0.28 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.36 3ffk n GLY 237 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ffk n THR 238 N -2.00 0.00 -1.83 2.61 -2.24 -0.17 -5.05 114.28 105.60 3ffk n THR 238 Ca 0.00 -0.37 -0.42 0.00 -2.27 0.00 0.00 64.05 61.00 3ffk n THR 238 Cb 0.00 1.10 -0.02 0.00 -2.10 0.00 0.00 70.33 69.31 3ffk n THR 238 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3ffk s GLU 239 N -1.51 4.16 0.78 -0.78 1.03 -1.20 -4.79 118.70 116.38 3ffk s GLU 239 Ca 0.08 2.51 -0.12 0.00 0.03 0.00 0.00 54.97 57.47 3ffk s GLU 239 Cb 0.08 -3.06 0.06 0.00 -0.80 0.00 0.00 34.13 30.41 3ffk s GLU 239 CO 0.29 -0.61 1.10 -2.14 -1.33 0.00 0.00 175.26 172.57 3ffk s PRO 240 N 0.03 2.27 0.18 -4.83 0.02 -1.26 -4.84 135.00 126.57 3ffk s PRO 240 Ca 0.65 0.56 -0.26 0.00 0.02 0.00 0.00 61.00 61.98 3ffk s PRO 240 Cb -0.47 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.15 3ffk s PRO 240 CO 0.42 -1.47 1.52 -1.91 -0.33 0.00 0.00 177.00 175.23 3ffk n GLU 241 N -3.32 -0.36 0.25 5.54 0.00 -1.26 -1.81 120.64 119.67 3ffk n GLU 241 Ca 0.07 1.50 0.07 0.00 0.00 0.00 0.00 57.16 58.80 3ffk n GLU 241 Cb 0.57 -2.21 0.60 0.00 0.00 0.00 0.00 31.44 30.39 3ffk n GLU 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3ffk h ALA 242 N 0.80 1.90 -0.04 4.31 0.00 -1.98 0.38 119.26 124.63 3ffk h ALA 242 Ca 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3ffk h ALA 242 Cb 0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3ffk h ALA 242 CO -0.95 0.07 -0.03 1.98 0.00 0.00 0.00 179.25 180.33 3ffk h MET 243 N 0.00 0.09 -0.37 0.00 1.85 -1.72 -3.17 114.93 111.61 3ffk h MET 243 Ca -0.00 -0.05 -0.05 0.00 -0.61 0.00 0.00 59.70 59.00 3ffk h MET 243 Cb 0.11 -0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.12 3ffk h MET 243 CO 0.01 0.52 0.02 -0.07 -0.40 0.00 0.00 176.91 177.00 3ffk h LEU 244 N -0.34 0.54 -1.84 3.39 3.38 -0.67 -1.93 115.31 117.83 3ffk h LEU 244 Ca 0.01 -0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.06 3ffk h LEU 244 Cb 0.50 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3ffk h LEU 244 CO 0.01 0.59 0.48 1.56 0.09 0.00 0.00 178.44 181.17 3ffk h GLN 245 N 0.55 0.14 0.00 1.13 1.08 -0.31 0.17 115.11 117.88 3ffk h GLN 245 Ca 0.12 -0.01 -0.25 0.00 -1.45 0.00 0.00 58.65 57.06 3ffk h GLN 245 Cb 0.32 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.68 3ffk h GLN 245 CO 0.01 0.09 -1.43 0.28 -0.95 0.00 0.00 178.83 176.83 3ffk n VAL 246 N -4.40 1.52 0.20 -0.54 0.31 -0.96 -4.57 118.33 109.90 3ffk n VAL 246 Ca 0.13 -0.07 0.10 0.00 -0.01 0.00 0.00 64.34 64.49 3ffk n VAL 246 Cb 0.66 -2.06 0.21 0.00 -0.91 0.00 0.00 33.84 31.74 3ffk n VAL 246 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3ffk h LEU 247 N -1.00 0.00 0.00 7.52 3.38 -1.29 -3.50 115.31 120.42 3ffk h LEU 247 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3ffk h LEU 247 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3ffk h LEU 247 CO -0.23 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.08 3ffk n GLY 248 N 0.94 -2.67 3.69 0.83 0.00 0.60 -4.48 105.19 104.11 3ffk n GLY 248 Ca 0.03 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 3ffk n GLY 248 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ffk s PRO 249 N -0.58 4.29 -0.00 1.61 0.05 -1.26 -4.76 135.00 134.35 3ffk s PRO 249 Ca 0.00 1.97 -0.32 0.00 0.05 0.00 0.00 61.00 62.71 3ffk s PRO 249 Cb 0.00 -3.53 -0.10 0.00 0.05 0.00 0.00 34.50 30.92 3ffk s PRO 249 CO 0.00 -0.55 1.93 1.17 0.05 0.00 0.00 177.00 179.60 3ffk n LYS 250 N 5.16 2.62 -2.59 4.56 4.81 -1.26 -5.00 118.16 126.46 3ffk n LYS 250 Ca 0.13 0.96 -0.22 0.00 -0.87 0.00 0.00 58.31 58.31 3ffk n LYS 250 Cb 0.44 -2.87 0.05 0.00 0.02 0.00 0.00 35.03 32.66 3ffk n LYS 250 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3ffk s PRO 251 N 4.20 2.35 0.07 1.64 0.04 -1.26 -5.03 135.00 137.00 3ffk s PRO 251 Ca 0.90 -0.80 -0.32 0.00 0.04 0.00 0.00 61.00 60.82 3ffk s PRO 251 Cb -0.53 -2.43 -0.11 0.00 0.04 0.00 0.00 34.50 31.47 3ffk s PRO 251 CO 0.45 -0.90 1.87 0.00 0.04 0.00 0.00 177.00 178.46 3ffk n ALA 252 N -2.49 1.74 -2.50 8.56 0.00 -1.26 -4.98 120.51 119.59 3ffk n ALA 252 Ca 0.09 0.29 -0.35 0.00 0.00 0.00 0.00 53.44 53.47 3ffk n ALA 252 Cb 0.60 -2.59 -0.06 0.00 0.00 0.00 0.00 19.45 17.41 3ffk n ALA 252 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ffk s LEU 253 N 3.32 4.36 0.75 0.00 1.43 -1.26 -5.08 118.68 122.20 3ffk s LEU 253 Ca 0.86 0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 54.75 3ffk s LEU 253 Cb -0.52 -3.04 0.04 0.00 0.03 0.00 0.00 46.19 42.70 3ffk s LEU 253 CO 0.41 0.16 1.08 -2.16 0.23 0.00 0.00 176.35 176.07 3ffk s PRO 254 N -1.85 2.44 4.76 1.29 0.04 -1.26 -4.72 135.00 135.69 3ffk s PRO 254 Ca 0.34 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.28 3ffk s PRO 254 Cb -0.15 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.46 3ffk s PRO 254 CO 0.18 -1.44 0.00 0.00 0.04 0.00 0.00 177.00 175.78 3ffk n ALA 255 N -3.35 0.00 -2.57 8.56 0.00 -1.26 -1.57 120.51 120.32 3ffk n ALA 255 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.25 3ffk n ALA 255 Cb 0.54 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.88 3ffk n ALA 255 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ffk s GLY 256 N -1.27 2.33 0.36 0.00 0.00 -1.26 -4.21 107.32 103.27 3ffk s GLY 256 Ca 0.00 -2.19 -0.28 0.00 0.00 0.00 0.00 44.72 42.25 3ffk s GLY 256 CO 0.00 -2.04 1.48 -0.51 0.00 0.00 0.00 173.10 172.03 3ffk s THR 257 N -2.74 2.10 0.86 0.90 -4.23 -1.26 -4.79 115.64 106.49 3ffk s THR 257 Ca 0.34 0.10 -0.10 0.00 -1.18 0.00 0.00 61.69 60.85 3ffk s THR 257 Cb 0.07 -3.06 0.11 0.00 1.34 0.00 0.00 72.50 70.96 3ffk s THR 257 CO 0.17 0.02 1.13 -1.61 -0.54 0.00 0.00 174.62 173.79 3ffk s GLU 258 N -1.91 1.44 -0.13 3.99 8.01 -1.26 -4.94 118.70 123.89 3ffk s GLU 258 Ca 0.53 1.44 -0.28 0.00 0.01 0.00 0.00 54.97 56.68 3ffk s GLU 258 Cb -0.46 -1.78 -0.01 0.00 -4.31 0.00 0.00 34.13 27.56 3ffk s GLU 258 CO 0.61 -2.30 0.92 -0.51 0.01 0.00 0.00 175.26 173.99 3ffk s ASP 259 N -2.87 7.11 0.32 -0.19 1.11 -1.26 -5.04 116.67 115.85 3ffk s ASP 259 Ca 0.65 1.37 -0.09 0.00 0.18 0.00 0.00 52.55 54.66 3ffk s ASP 259 Cb -0.21 -2.51 -0.07 0.00 1.07 0.00 0.00 42.92 41.20 3ffk s ASP 259 CO 0.57 -0.42 0.66 0.42 1.18 0.00 0.00 175.17 177.58 3ffk s THR 260 N 2.05 4.87 0.28 -1.27 -4.23 -1.26 -4.76 115.64 111.32 3ffk s THR 260 Ca 0.44 0.48 0.34 0.00 -1.18 0.00 0.00 61.69 61.76 3ffk s THR 260 Cb -0.17 -3.69 0.34 0.00 1.34 0.00 0.00 72.50 70.31 3ffk s THR 260 CO 0.15 -0.32 2.03 0.00 -0.54 0.00 0.00 174.62 175.95 3ffk h ALA 261 N 1.81 1.02 0.22 3.99 0.00 -1.99 -1.92 119.26 122.38 3ffk h ALA 261 Ca -0.47 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.11 3ffk h ALA 261 Cb 1.18 0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.00 3ffk h ALA 261 CO 0.66 -0.02 -1.48 0.87 0.00 0.00 0.00 179.25 179.28 3ffk h LYS 262 N 0.00 0.46 0.00 0.00 1.79 -1.99 -2.73 116.57 114.10 3ffk h LYS 262 Ca 0.00 -0.79 -0.08 0.00 -2.18 0.00 0.00 60.65 57.60 3ffk h LYS 262 Cb 0.04 0.29 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 3ffk h LYS 262 CO 0.00 1.37 -0.38 1.49 -1.08 0.00 0.00 179.45 180.85 3ffk h GLU 263 N 0.13 0.00 -0.29 3.15 4.22 -1.79 -2.75 114.58 117.25 3ffk h GLU 263 Ca -0.25 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.15 3ffk h GLU 263 Cb 2.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.36 3ffk h GLU 263 CO 0.25 0.38 -0.00 0.22 -2.18 0.00 0.00 179.01 177.67 3ffk h ASP 264 N 0.00 0.50 0.82 1.04 3.58 -1.34 -2.64 116.42 118.38 3ffk h ASP 264 Ca -0.00 -0.31 0.00 0.00 0.42 0.00 0.00 57.03 57.13 3ffk h ASP 264 Cb 0.68 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.59 3ffk h ASP 264 CO 0.05 0.69 0.00 0.00 -2.88 0.00 0.00 179.24 177.10 3ffk h ALA 265 N 0.83 1.00 0.02 -0.78 0.00 -1.35 -2.14 119.26 116.84 3ffk h ALA 265 Ca 0.08 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 3ffk h ALA 265 Cb 0.44 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.24 3ffk h ALA 265 CO 0.02 0.00 -0.59 0.00 0.00 0.00 0.00 179.25 178.68 3ffk h ALA 266 N 2.24 0.05 0.00 0.00 0.00 -1.19 -3.20 119.26 117.15 3ffk h ALA 266 Ca 0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 3ffk h ALA 266 Cb 0.41 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3ffk h ALA 266 CO 0.00 0.32 -0.00 -0.91 0.00 0.00 0.00 179.25 178.66 3ffk h ASN 267 N -0.19 0.00 0.83 0.00 -0.26 -1.09 -0.97 115.58 113.91 3ffk h ASN 267 Ca -0.08 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.66 3ffk h ASN 267 Cb 1.32 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.58 3ffk h ASN 267 CO 0.11 0.00 0.00 0.03 -1.06 0.00 0.00 177.43 176.52 3ffk h ARG 268 N 0.00 0.00 -0.05 0.81 2.47 -1.40 -3.12 114.38 113.09 3ffk h ARG 268 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3ffk h ARG 268 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3ffk h ARG 268 CO 0.00 0.00 0.00 1.63 0.56 0.00 0.00 179.97 182.16 3ffk n LYS 269 N -2.34 2.67 0.23 0.04 4.76 -0.39 0.10 118.16 123.24 3ffk n LYS 269 Ca 0.02 -1.80 0.09 0.00 -2.87 0.00 0.00 58.31 53.75 3ffk n LYS 269 Cb 0.26 -1.15 0.54 0.00 -1.84 0.00 0.00 35.03 32.84 3ffk n LYS 269 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3ffk h LEU 270 N 0.29 0.00 -7.88 -0.35 3.38 -1.44 -3.45 115.31 105.86 3ffk h LEU 270 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 3ffk h LEU 270 Cb 0.65 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.19 3ffk h LEU 270 CO 0.01 0.23 -0.61 0.00 0.09 0.00 0.00 178.44 178.16 3ffk s ALA 271 N -4.08 -0.07 0.18 1.53 0.00 -1.26 -4.80 121.76 113.26 3ffk s ALA 271 Ca -0.02 -0.40 0.10 0.00 0.00 0.00 0.00 51.96 51.65 3ffk s ALA 271 Cb 0.13 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 3ffk s ALA 271 CO 0.64 -0.18 -0.18 0.15 0.00 0.00 0.00 175.76 176.19 3ffk s LYS 272 N -1.43 1.73 -0.22 0.00 1.02 -0.94 -4.37 119.74 115.53 3ffk s LYS 272 Ca -0.15 -1.41 -0.00 0.00 0.02 0.00 0.00 55.97 54.42 3ffk s LYS 272 Cb -0.09 -1.97 0.06 0.00 -0.52 0.00 0.00 37.83 35.31 3ffk s LYS 272 CO 0.00 0.42 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.65 3ffk s LEU 273 N -2.70 2.21 0.14 3.17 2.96 0.66 -1.18 118.68 123.95 3ffk s LEU 273 Ca 0.22 -1.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.08 3ffk s LEU 273 Cb -0.08 -1.03 -0.04 0.00 0.50 0.00 0.00 46.19 45.54 3ffk s LEU 273 CO 0.12 -0.25 0.20 -0.31 -1.32 0.00 0.00 176.35 174.79 3ffk s TYR 274 N 1.51 3.33 -0.23 5.38 2.02 0.26 0.11 117.35 129.73 3ffk s TYR 274 Ca -0.05 0.07 -0.01 0.00 -0.37 0.00 0.00 57.07 56.72 3ffk s TYR 274 Cb -0.18 -1.60 0.03 0.00 -0.40 0.00 0.00 41.96 39.80 3ffk s TYR 274 CO -0.07 0.52 -0.10 0.21 -1.57 0.00 0.00 175.55 174.55 3ffk s LYS 275 N -3.08 2.83 -0.36 -0.62 2.20 0.33 -0.94 119.74 120.11 3ffk s LYS 275 Ca 0.33 -0.97 -0.19 0.00 -0.36 0.00 0.00 55.97 54.78 3ffk s LYS 275 Cb -0.11 -2.87 0.00 0.00 -1.51 0.00 0.00 37.83 33.34 3ffk s LYS 275 CO 0.26 -0.36 0.58 0.08 -0.36 0.00 0.00 175.35 175.55 3ffk s VAL 276 N 1.30 4.94 0.02 4.02 1.01 -0.55 -1.68 120.40 129.46 3ffk s VAL 276 Ca 0.01 0.40 -0.10 0.00 0.00 0.00 0.00 61.98 62.28 3ffk s VAL 276 Cb -0.16 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.19 3ffk s VAL 276 CO -0.07 -0.31 0.21 -0.55 0.00 0.00 0.00 175.10 174.39 3ffk s SER 277 N 1.80 -0.03 -0.08 3.32 0.15 -0.63 -2.55 113.70 115.68 3ffk s SER 277 Ca 0.21 -0.21 0.12 0.00 0.70 0.00 0.00 55.95 56.78 3ffk s SER 277 Cb -0.15 0.27 0.21 0.00 -1.71 0.00 0.00 66.02 64.64 3ffk s SER 277 CO 0.15 -0.48 1.10 -0.46 1.20 0.00 0.00 173.24 174.75 3ffk n ASN 278 N 1.04 1.39 -0.06 5.45 6.94 -1.26 -0.01 115.26 128.74 3ffk n ASN 278 Ca -0.21 -2.71 0.09 0.00 -0.02 0.00 0.00 54.58 51.73 3ffk n ASN 278 Cb 0.57 -0.35 0.46 0.00 -2.36 0.00 0.00 39.78 38.10 3ffk n ASN 278 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3ffk h GLY 279 N 0.14 0.62 -2.24 4.83 0.00 -1.95 -0.97 103.07 103.50 3ffk h GLY 279 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3ffk h GLY 279 CO 0.01 0.15 0.00 0.00 0.00 0.00 0.00 176.54 176.70 3ffk n ALA 280 N -2.49 3.17 0.00 3.60 0.00 -1.26 -4.88 120.51 118.65 3ffk n ALA 280 Ca 0.08 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.59 3ffk n ALA 280 Cb 0.25 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3ffk n ALA 280 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ffk n GLY 281 N 0.31 2.35 3.10 0.00 0.00 -0.37 -5.04 105.19 105.54 3ffk n GLY 281 Ca 0.14 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 3ffk n GLY 281 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ffk s THR 282 N -2.37 0.69 -0.61 2.61 -1.32 -1.24 -5.01 115.64 108.40 3ffk s THR 282 Ca 0.00 -1.22 -0.26 0.00 -1.21 0.00 0.00 61.69 59.00 3ffk s THR 282 Cb 0.00 -0.82 -0.04 0.00 -1.51 0.00 0.00 72.50 70.13 3ffk s THR 282 CO 0.00 -0.39 2.01 -0.04 -2.21 0.00 0.00 174.62 173.99 3ffk s MET 283 N -1.83 2.47 -0.12 7.08 -1.94 -1.26 -4.09 119.30 119.61 3ffk s MET 283 Ca -0.06 0.73 -0.00 0.00 -1.71 0.00 0.00 55.69 54.65 3ffk s MET 283 Cb -0.09 -4.49 -0.02 0.00 2.01 0.00 0.00 34.83 32.25 3ffk s MET 283 CO 0.00 -2.95 -0.11 -1.54 -0.01 0.00 0.00 175.02 170.41 3ffk s SER 284 N 9.13 4.17 -0.59 3.03 1.04 0.98 -4.97 113.70 126.48 3ffk s SER 284 Ca 0.75 -0.27 -0.14 0.00 0.48 0.00 0.00 55.95 56.78 3ffk s SER 284 Cb -0.13 -1.53 0.15 0.00 0.10 0.00 0.00 66.02 64.61 3ffk s SER 284 CO 0.20 0.20 0.52 -0.69 0.98 0.00 0.00 173.24 174.45 3ffk s VAL 285 N 0.17 5.04 0.08 5.02 1.01 -1.26 -1.60 120.40 128.86 3ffk s VAL 285 Ca -0.06 -1.83 -0.08 0.00 0.00 0.00 0.00 61.98 60.01 3ffk s VAL 285 Cb -0.15 -4.22 -0.06 0.00 0.00 0.00 0.00 36.38 31.96 3ffk s VAL 285 CO 0.04 -0.89 0.37 -0.94 0.00 0.00 0.00 175.10 173.69 3ffk s SER 286 N 2.99 6.57 -0.32 3.32 1.04 -0.68 -4.89 113.70 121.73 3ffk s SER 286 Ca 0.07 0.69 -0.24 0.00 0.48 0.00 0.00 55.95 56.95 3ffk s SER 286 Cb -0.25 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 63.74 3ffk s SER 286 CO -0.01 0.15 0.83 -0.22 0.98 0.00 0.00 173.24 174.97 3ffk s LEU 287 N -2.10 4.07 -0.09 2.42 2.96 -1.26 -0.51 118.68 124.17 3ffk s LEU 287 Ca 0.34 0.64 -0.22 0.00 -0.22 0.00 0.00 54.13 54.67 3ffk s LEU 287 Cb -0.13 -3.13 -0.29 0.00 0.50 0.00 0.00 46.19 43.14 3ffk s LEU 287 CO 0.20 -0.68 0.75 0.58 -1.32 0.00 0.00 176.35 175.88 3ffk h VAL 288 N 5.66 1.44 -2.15 1.68 2.07 -0.66 -3.48 116.25 120.81 3ffk h VAL 288 Ca -0.24 -2.45 -0.05 0.00 0.82 0.00 0.00 66.70 64.78 3ffk h VAL 288 Cb 1.09 3.09 -0.22 0.00 -1.52 0.00 0.00 31.29 33.73 3ffk h VAL 288 CO 0.91 0.66 0.05 0.00 0.02 0.00 0.00 177.57 179.21 3ffk s ALA 289 N -2.39 -1.63 -0.09 1.67 0.00 -1.06 -5.01 121.76 113.26 3ffk s ALA 289 Ca -0.17 1.88 0.01 0.00 0.00 0.00 0.00 51.96 53.68 3ffk s ALA 289 Cb 0.01 -1.09 0.03 0.00 0.00 0.00 0.00 23.12 22.07 3ffk s ALA 289 CO 0.77 -0.31 1.00 -0.40 0.00 0.00 0.00 175.76 176.82 3ffk n ASP 290 N 2.84 2.04 -4.02 0.00 5.75 -1.26 -0.25 116.55 121.65 3ffk n ASP 290 Ca -0.14 -1.95 -0.25 0.00 -0.01 0.00 0.00 54.79 52.43 3ffk n ASP 290 Cb 0.56 -0.02 -0.17 0.00 -1.03 0.00 0.00 41.12 40.46 3ffk n ASP 290 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 3ffk s GLU 291 N -0.95 1.75 0.25 0.11 2.12 -1.26 -4.49 118.70 116.22 3ffk s GLU 291 Ca 0.02 -0.42 -0.08 0.00 0.36 0.00 0.00 54.97 54.86 3ffk s GLU 291 Cb 0.01 -1.47 -0.06 0.00 0.26 0.00 0.00 34.13 32.86 3ffk s GLU 291 CO 0.02 -0.01 0.55 1.21 -0.54 0.00 0.00 175.26 176.49 3ffk s ASN 292 N 0.78 6.56 0.39 -1.70 3.84 0.28 -4.28 114.94 120.81 3ffk s ASN 292 Ca -0.12 0.85 -0.24 0.00 0.21 0.00 0.00 52.86 53.56 3ffk s ASN 292 Cb -0.15 -2.20 -0.09 0.00 -0.55 0.00 0.00 41.25 38.25 3ffk s ASN 292 CO 0.02 -0.12 1.03 -2.16 -2.79 0.00 0.00 177.10 173.08 3ffk s PRO 293 N -3.08 4.24 0.63 0.43 0.04 -1.26 -4.73 135.00 131.28 3ffk s PRO 293 Ca 0.46 1.46 -0.11 0.00 0.04 0.00 0.00 61.00 62.85 3ffk s PRO 293 Cb -0.11 -2.56 -0.03 0.00 0.04 0.00 0.00 34.50 31.84 3ffk s PRO 293 CO 0.24 -0.06 1.04 -0.06 0.04 0.00 0.00 177.00 178.20 3ffk s PHE 294 N -1.68 3.57 -0.24 0.56 0.08 0.20 -4.58 117.98 115.89 3ffk s PHE 294 Ca 0.57 1.24 -0.25 0.00 0.12 0.00 0.00 56.93 58.60 3ffk s PHE 294 Cb -0.21 -2.78 -0.00 0.00 -0.57 0.00 0.00 43.02 39.46 3ffk s PHE 294 CO 0.26 -0.77 0.87 0.00 -0.10 0.00 0.00 175.22 175.48 3ffk s ALA 295 N -3.21 3.65 0.27 5.36 0.00 -1.26 -1.76 121.76 124.82 3ffk s ALA 295 Ca 0.55 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 52.43 3ffk s ALA 295 Cb -0.11 -3.34 0.62 0.00 0.00 0.00 0.00 23.12 20.29 3ffk s ALA 295 CO 0.53 -0.96 1.66 0.37 0.00 0.00 0.00 175.76 177.36 3ffk h GLN 296 N 7.65 0.22 -0.63 0.00 4.15 -1.94 0.19 115.11 124.74 3ffk h GLN 296 Ca -0.22 -0.01 0.18 0.00 0.77 0.00 0.00 58.65 59.37 3ffk h GLN 296 Cb 1.09 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.70 3ffk h GLN 296 CO 0.89 0.14 0.77 0.78 -1.93 0.00 0.00 178.83 179.48 3ffk h GLY 297 N 0.22 0.00 1.81 2.39 0.00 -1.96 -1.38 103.07 104.16 3ffk h GLY 297 Ca 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.77 3ffk h GLY 297 CO -0.62 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 175.72 3ffk h ALA 298 N 1.06 1.41 -1.47 3.60 0.00 -1.01 -3.39 119.26 119.46 3ffk h ALA 298 Ca 0.30 -0.26 -0.52 0.00 0.00 0.00 0.00 54.91 54.43 3ffk h ALA 298 Cb 1.83 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.48 3ffk h ALA 298 CO -0.00 0.41 1.21 -0.51 0.00 0.00 0.00 179.25 180.36 3ffk s LEU 299 N -8.63 3.27 -0.11 0.00 1.02 -0.52 -4.98 118.68 108.72 3ffk s LEU 299 Ca -0.05 0.09 -0.02 0.00 0.02 0.00 0.00 54.13 54.17 3ffk s LEU 299 Cb 0.15 -2.65 -0.03 0.00 0.02 0.00 0.00 46.19 43.68 3ffk s LEU 299 CO 0.74 -2.07 -0.05 -0.54 0.02 0.00 0.00 176.35 174.45 3ffk s LYS 300 N 6.32 3.25 0.61 1.70 1.02 -1.26 -5.02 119.74 126.37 3ffk s LYS 300 Ca 0.54 -0.52 0.35 0.00 0.02 0.00 0.00 55.97 56.37 3ffk s LYS 300 Cb -0.11 -2.78 2.00 0.00 -0.52 0.00 0.00 37.83 36.42 3ffk s LYS 300 CO 0.20 0.45 2.28 0.77 -0.92 0.00 0.00 175.35 178.13 3ffk h SER 301 N 5.98 0.00 0.42 2.83 0.02 -1.94 -1.79 113.55 119.08 3ffk h SER 301 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3ffk h SER 301 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3ffk h SER 301 CO 0.58 0.01 -0.01 -0.62 -1.14 0.00 0.00 176.83 175.65 3ffk n GLU 302 N -3.53 0.59 -4.29 3.45 4.71 -1.26 -0.79 120.64 119.52 3ffk n GLU 302 Ca -0.03 -0.04 -0.17 0.00 -0.01 0.00 0.00 57.16 56.92 3ffk n GLU 302 Cb 0.10 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.94 3ffk n GLU 302 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3ffk s ASP 303 N -2.43 1.11 0.29 1.62 1.01 -0.67 -3.54 116.67 114.06 3ffk s ASP 303 Ca 0.33 -1.50 0.07 0.00 0.71 0.00 0.00 52.55 52.16 3ffk s ASP 303 Cb 0.21 0.36 -0.03 0.00 1.01 0.00 0.00 42.92 44.47 3ffk s ASP 303 CO 0.44 -0.86 0.27 0.00 0.21 0.00 0.00 175.17 175.23 3ffk s PHE 305 N -2.20 0.26 -0.11 0.00 0.40 0.33 -1.48 117.98 115.18 3ffk s PHE 305 Ca 0.37 -0.56 0.03 0.00 -0.60 0.00 0.00 56.93 56.17 3ffk s PHE 305 Cb -0.07 -0.19 0.01 0.00 0.51 0.00 0.00 43.02 43.28 3ffk s PHE 305 CO 0.26 -0.29 -0.20 0.42 0.70 0.00 0.00 175.22 176.12 3ffk s ILE 306 N -2.19 1.82 -0.45 0.64 1.01 -0.12 0.06 121.20 121.97 3ffk s ILE 306 Ca -0.09 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.59 3ffk s ILE 306 Cb -0.04 -1.60 0.09 0.00 0.01 0.00 0.00 42.46 40.91 3ffk s ILE 306 CO -0.03 0.51 0.32 -0.22 0.00 0.00 0.00 174.94 175.51 3ffk s LEU 307 N 0.61 5.41 -0.49 2.97 1.98 -0.05 -0.57 118.68 128.54 3ffk s LEU 307 Ca -0.13 -1.55 -0.24 0.00 -2.89 0.00 0.00 54.13 49.32 3ffk s LEU 307 Cb -0.17 -2.05 0.03 0.00 0.66 0.00 0.00 46.19 44.67 3ffk s LEU 307 CO 0.04 -0.61 0.86 -0.62 -1.89 0.00 0.00 176.35 174.13 3ffk s ASP 308 N 2.41 6.39 -0.40 3.68 3.68 -0.32 -0.97 116.67 131.13 3ffk s ASP 308 Ca 0.04 -0.19 0.05 0.00 2.13 0.00 0.00 52.55 54.58 3ffk s ASP 308 Cb -0.24 -2.41 0.43 0.00 -1.45 0.00 0.00 42.92 39.25 3ffk s ASP 308 CO 0.03 -1.05 1.17 1.57 0.13 0.00 0.00 175.17 177.02 3ffk n HIS 309 N 7.03 3.18 0.13 -5.34 -0.00 -0.00 -2.20 115.22 118.02 3ffk n HIS 309 Ca 0.02 -2.80 0.03 0.00 0.46 0.00 0.00 57.72 55.44 3ffk n HIS 309 Cb 0.48 -0.21 0.42 0.00 -0.12 0.00 0.00 29.99 30.56 3ffk n HIS 309 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 3ffk h GLY 310 N 2.45 0.24 1.20 1.57 0.00 -1.84 -1.89 103.07 104.81 3ffk h GLY 310 Ca 0.33 -0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.60 3ffk h GLY 310 CO 0.85 0.13 0.33 0.07 0.00 0.00 0.00 176.54 177.91 3ffk h LYS 311 N 0.22 0.00 -0.03 4.80 -0.00 -1.89 0.51 116.57 120.18 3ffk h LYS 311 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.70 3ffk h LYS 311 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.53 3ffk h LYS 311 CO 0.02 0.00 -0.04 -3.47 -0.00 0.00 0.00 179.45 175.95 3ffk n ASP 312 N -3.60 2.71 0.00 7.07 2.03 -0.74 -4.93 116.55 119.09 3ffk n ASP 312 Ca 0.04 -1.86 0.00 0.00 0.52 0.00 0.00 54.79 53.49 3ffk n ASP 312 Cb 0.46 0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 3ffk n ASP 312 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3ffk n GLY 313 N 1.23 0.78 2.65 0.27 0.00 0.18 -4.81 105.19 105.47 3ffk n GLY 313 Ca 0.12 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 3ffk n GLY 313 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffk s LYS 314 N -3.04 -0.02 -0.08 1.61 1.02 -1.00 -0.18 119.74 118.04 3ffk s LYS 314 Ca 0.00 0.19 0.03 0.00 0.02 0.00 0.00 55.97 56.21 3ffk s LYS 314 Cb 0.00 -1.06 -0.01 0.00 -0.52 0.00 0.00 37.83 36.24 3ffk s LYS 314 CO 0.00 -0.47 -0.18 0.42 -0.92 0.00 0.00 175.35 174.20 3ffk s ILE 315 N 2.16 2.65 -0.10 2.17 1.01 -0.88 -0.82 121.20 127.39 3ffk s ILE 315 Ca 0.04 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3ffk s ILE 315 Cb -0.14 -2.05 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 3ffk s ILE 315 CO -0.05 0.56 -0.13 -0.36 0.00 0.00 0.00 174.94 174.95 3ffk s PHE 316 N -0.08 2.78 -0.33 3.97 0.08 -0.14 -1.77 117.98 122.49 3ffk s PHE 316 Ca -0.04 -0.45 -0.04 0.00 0.12 0.00 0.00 56.93 56.53 3ffk s PHE 316 Cb -0.14 -1.76 0.06 0.00 -0.57 0.00 0.00 43.02 40.60 3ffk s PHE 316 CO 0.04 -0.05 0.07 0.08 -0.10 0.00 0.00 175.22 175.26 3ffk s VAL 317 N -0.07 3.33 -0.40 -0.44 1.01 -0.56 -0.87 120.40 122.39 3ffk s VAL 317 Ca -0.02 -1.40 -0.18 0.00 0.00 0.00 0.00 61.98 60.38 3ffk s VAL 317 Cb -0.14 -2.96 0.01 0.00 0.00 0.00 0.00 36.38 33.29 3ffk s VAL 317 CO 0.04 -0.22 0.49 0.86 0.00 0.00 0.00 175.10 176.26 3ffk s TRP 318 N 1.29 3.15 -0.29 5.22 -0.00 0.11 0.80 118.94 129.23 3ffk s TRP 318 Ca -0.02 -0.15 -0.17 0.00 -0.00 0.00 0.00 56.10 55.76 3ffk s TRP 318 Cb -0.20 -2.97 -0.02 0.00 -0.00 0.00 0.00 33.47 30.28 3ffk s TRP 318 CO -0.00 -0.67 0.47 0.15 -0.00 0.00 0.00 176.95 176.90 3ffk s LYS 319 N 2.32 3.94 0.39 5.86 1.02 0.11 -0.51 119.74 132.86 3ffk s LYS 319 Ca 0.16 0.11 -0.24 0.00 0.02 0.00 0.00 55.97 56.01 3ffk s LYS 319 Cb -0.16 -3.69 -0.09 0.00 -0.52 0.00 0.00 37.83 33.37 3ffk s LYS 319 CO 0.14 -0.40 1.04 0.20 -0.92 0.00 0.00 175.35 175.42 3ffk s GLY 320 N 1.63 2.75 0.57 -3.33 0.00 -0.80 -0.83 107.32 107.31 3ffk s GLY 320 Ca 0.18 0.69 0.33 0.00 0.00 0.00 0.00 44.72 45.92 3ffk s GLY 320 CO 0.10 1.12 2.16 0.07 0.00 0.00 0.00 173.10 176.56 3ffk h LYS 321 N 2.60 0.00 -0.02 2.90 2.10 -1.83 -2.11 116.57 120.21 3ffk h LYS 321 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 3ffk h LYS 321 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3ffk h LYS 321 CO 0.63 0.05 -0.17 1.04 -2.00 0.00 0.00 179.45 179.00 3ffk n GLN 322 N -3.44 1.54 -1.75 0.07 6.02 0.03 -4.97 117.38 114.88 3ffk n GLN 322 Ca -0.02 -1.18 -0.41 0.00 -0.01 0.00 0.00 57.00 55.37 3ffk n GLN 322 Cb 0.18 -1.31 -0.00 0.00 1.02 0.00 0.00 30.24 30.13 3ffk n GLN 322 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ffk n ALA 323 N 0.44 2.09 -1.95 -1.58 0.00 -0.64 -4.72 120.51 114.15 3ffk n ALA 323 Ca 0.09 0.35 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 3ffk n ALA 323 Cb 0.39 -2.38 0.04 0.00 0.00 0.00 0.00 19.45 17.51 3ffk n ALA 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ffk s ASN 324 N -0.16 5.48 0.40 0.00 2.20 -1.26 -4.93 114.94 116.67 3ffk s ASN 324 Ca 0.54 0.98 0.09 0.00 -0.94 0.00 0.00 52.86 53.53 3ffk s ASN 324 Cb -0.50 -1.84 0.84 0.00 -2.00 0.00 0.00 41.25 37.75 3ffk s ASN 324 CO 0.63 -1.25 1.97 0.00 -2.94 0.00 0.00 177.10 175.51 3ffk h THR 325 N -0.49 1.14 -0.42 0.54 1.03 -2.00 -1.75 112.91 110.96 3ffk h THR 325 Ca -0.45 -0.55 -0.12 0.00 -0.01 0.00 0.00 66.41 65.28 3ffk h THR 325 Cb 1.26 0.99 -0.01 0.00 -1.07 0.00 0.00 68.15 69.32 3ffk h THR 325 CO 0.63 0.18 -0.22 -0.33 -0.01 0.00 0.00 175.52 175.77 3ffk h GLU 326 N 0.30 0.83 -0.75 0.00 3.07 -2.00 -2.45 114.58 113.59 3ffk h GLU 326 Ca 0.07 -0.34 0.04 0.00 -0.50 0.00 0.00 59.36 58.63 3ffk h GLU 326 Cb 0.22 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 3ffk h GLU 326 CO 0.01 0.97 0.50 0.93 -1.40 0.00 0.00 179.01 180.02 3ffk h GLU 327 N 0.73 0.86 -0.06 2.33 5.08 -1.70 -1.60 114.58 120.21 3ffk h GLU 327 Ca 0.10 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3ffk h GLU 327 Cb 0.75 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 3ffk h GLU 327 CO 0.06 0.57 -0.07 0.00 -1.00 0.00 0.00 179.01 178.57 3ffk h ARG 328 N 0.88 0.16 -0.70 2.33 3.08 -1.23 -1.77 114.38 117.14 3ffk h ARG 328 Ca 0.31 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 3ffk h ARG 328 Cb 0.11 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 3ffk h ARG 328 CO -0.09 0.61 0.28 0.87 -1.07 0.00 0.00 179.97 180.56 3ffk h LYS 329 N -0.29 1.03 0.34 0.04 1.57 -1.29 -2.02 116.57 115.96 3ffk h LYS 329 Ca 0.01 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3ffk h LYS 329 Cb 0.58 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3ffk h LYS 329 CO 0.02 0.84 -0.17 0.00 -0.57 0.00 0.00 179.45 179.57 3ffk h ALA 330 N 1.29 -0.46 -0.43 3.86 0.00 -1.31 -1.09 119.26 121.13 3ffk h ALA 330 Ca 0.24 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.09 3ffk h ALA 330 Cb 0.19 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 3ffk h ALA 330 CO -0.02 -0.70 -0.22 0.00 0.00 0.00 0.00 179.25 178.31 3ffk h ALA 331 N 0.03 0.07 -0.51 0.00 0.00 -1.20 0.40 119.26 118.05 3ffk h ALA 331 Ca -0.05 0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.08 3ffk h ALA 331 Cb 0.43 0.53 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 3ffk h ALA 331 CO 0.08 -0.59 0.17 1.25 0.00 0.00 0.00 179.25 180.16 3ffk h LEU 332 N -0.14 0.16 0.68 0.00 7.12 -1.32 0.92 115.31 122.73 3ffk h LEU 332 Ca 0.20 0.07 -0.03 0.00 0.13 0.00 0.00 57.88 58.25 3ffk h LEU 332 Cb 0.46 0.06 0.01 0.00 -0.53 0.00 0.00 40.66 40.65 3ffk h LEU 332 CO -0.51 0.12 -0.33 0.50 -0.13 0.00 0.00 178.44 178.08 3ffk h LYS 333 N 0.34 -0.89 -0.64 1.25 3.11 0.00 -2.74 116.57 117.00 3ffk h LYS 333 Ca 0.25 0.06 0.14 0.00 -2.81 0.00 0.00 60.65 58.28 3ffk h LYS 333 Cb 0.28 0.20 -0.11 0.00 -1.00 0.00 0.00 32.23 31.60 3ffk h LYS 333 CO -0.26 -0.56 -0.02 1.15 -2.81 0.00 0.00 179.45 176.95 3ffk h THR 334 N -1.07 0.45 -0.70 1.00 2.02 -0.09 0.13 112.91 114.64 3ffk h THR 334 Ca -0.09 -0.03 0.07 0.00 0.77 0.00 0.00 66.41 67.12 3ffk h THR 334 Cb 0.74 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 3ffk h THR 334 CO 0.15 0.02 0.39 0.00 0.37 0.00 0.00 175.52 176.45 3ffk h ALA 335 N 1.60 0.95 0.00 6.16 0.00 -0.80 -2.41 119.26 124.76 3ffk h ALA 335 Ca 0.34 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3ffk h ALA 335 Cb 0.55 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3ffk h ALA 335 CO -0.57 0.06 -0.66 0.66 0.00 0.00 0.00 179.25 178.74 3ffk h SER 336 N 0.70 0.00 -0.44 0.00 4.64 -0.88 -3.07 113.55 114.50 3ffk h SER 336 Ca 0.32 -0.09 -0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3ffk h SER 336 Cb 0.23 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 3ffk h SER 336 CO -0.20 0.04 0.27 0.44 -0.87 0.00 0.00 176.83 176.51 3ffk h ASP 337 N 0.00 0.53 -0.93 4.97 3.32 -0.62 -3.18 116.42 120.50 3ffk h ASP 337 Ca 0.00 -0.05 0.27 0.00 0.02 0.00 0.00 57.03 57.26 3ffk h ASP 337 Cb 0.88 -0.13 -0.14 0.00 0.22 0.00 0.00 39.33 40.16 3ffk h ASP 337 CO 0.00 0.42 0.38 -0.26 -1.72 0.00 0.00 179.24 178.06 3ffk h PHE 338 N 0.58 0.61 -0.41 4.55 0.04 -1.34 0.35 116.94 121.32 3ffk h PHE 338 Ca 0.16 0.04 0.08 0.00 2.80 0.00 0.00 57.97 61.06 3ffk h PHE 338 Cb -0.01 -0.12 -0.08 0.00 2.20 0.00 0.00 35.95 37.94 3ffk h PHE 338 CO -0.03 -0.17 -0.15 0.82 -0.60 0.00 0.00 178.31 178.17 3ffk h ILE 339 N 0.28 0.50 0.09 -0.55 2.04 -1.66 -0.03 117.51 118.18 3ffk h ILE 339 Ca 0.62 0.00 -0.30 0.00 1.00 0.00 0.00 64.86 66.18 3ffk h ILE 339 Cb 1.31 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 3ffk h ILE 339 CO -0.62 0.00 -1.55 0.71 0.00 0.00 0.00 178.15 176.69 3ffk h THR 340 N -0.06 1.11 -0.81 -0.27 1.35 -1.46 0.18 112.91 112.95 3ffk h THR 340 Ca 0.20 -2.79 0.03 0.00 -0.55 0.00 0.00 66.41 63.29 3ffk h THR 340 Cb 0.36 2.70 -0.05 0.00 -1.73 0.00 0.00 68.15 69.44 3ffk h THR 340 CO -0.45 0.79 0.53 0.50 -0.25 0.00 0.00 175.52 176.63 3ffk h LYS 341 N 0.05 1.01 -0.33 4.72 3.64 -0.83 -2.89 116.57 121.94 3ffk h LYS 341 Ca -0.25 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 3ffk h LYS 341 Cb 2.00 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 3ffk h LYS 341 CO 0.14 0.67 0.00 -0.12 -2.27 0.00 0.00 179.45 177.87 3ffk n MET 342 N -4.56 2.45 -3.71 1.90 1.56 -0.04 -4.96 117.12 109.76 3ffk n MET 342 Ca 0.09 -2.18 -0.24 0.00 -0.27 0.00 0.00 57.70 55.10 3ffk n MET 342 Cb 0.07 -1.50 0.05 0.00 2.15 0.00 0.00 33.22 33.99 3ffk n MET 342 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 3ffk n ASP 343 N 1.42 -4.01 -4.78 6.12 2.03 -1.06 -4.96 116.55 111.30 3ffk n ASP 343 Ca 0.19 -0.70 -0.33 0.00 0.52 0.00 0.00 54.79 54.46 3ffk n ASP 343 Cb 0.59 -4.43 0.02 0.00 -0.72 0.00 0.00 41.12 36.58 3ffk n ASP 343 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3ffk s TYR 344 N -3.40 2.76 -0.96 -0.67 4.12 0.62 -4.91 117.35 114.91 3ffk s TYR 344 Ca 0.39 1.54 -0.23 0.00 0.02 0.00 0.00 57.07 58.80 3ffk s TYR 344 Cb -0.19 -3.14 0.06 0.00 -1.52 0.00 0.00 41.96 37.17 3ffk s TYR 344 CO 0.78 -1.45 1.35 -1.25 0.02 0.00 0.00 175.55 175.00 3ffk s PRO 345 N -3.85 3.53 0.24 -1.71 0.04 -1.26 -4.83 135.00 127.15 3ffk s PRO 345 Ca 0.67 -1.15 -0.31 0.00 0.04 0.00 0.00 61.00 60.26 3ffk s PRO 345 Cb -0.20 -5.11 -0.14 0.00 0.04 0.00 0.00 34.50 29.10 3ffk s PRO 345 CO 0.36 -2.10 1.27 1.17 0.04 0.00 0.00 177.00 177.74 3ffk n LYS 346 N 8.42 1.71 -1.82 4.56 3.00 -1.26 -2.94 118.16 129.83 3ffk n LYS 346 Ca 0.27 0.60 -0.40 0.00 -0.00 0.00 0.00 58.31 58.78 3ffk n LYS 346 Cb 0.50 -2.17 -0.03 0.00 0.00 0.00 0.00 35.03 33.34 3ffk n LYS 346 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3ffk n GLN 347 N 1.62 2.34 -2.24 1.64 1.13 -1.26 -5.16 117.38 115.46 3ffk n GLN 347 Ca 0.12 -2.52 -0.41 0.00 -1.94 0.00 0.00 57.00 52.24 3ffk n GLN 347 Cb 0.30 -3.31 -0.03 0.00 0.11 0.00 0.00 30.24 27.31 3ffk n GLN 347 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3ffk s THR 348 N 5.27 3.22 -0.30 5.09 2.01 -1.15 -5.00 115.64 124.78 3ffk s THR 348 Ca 0.55 1.03 -0.09 0.00 0.31 0.00 0.00 61.69 63.49 3ffk s THR 348 Cb 0.09 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.94 3ffk s THR 348 CO 0.05 0.17 0.13 -1.58 -0.69 0.00 0.00 174.62 172.69 3ffk s GLN 349 N -0.33 3.36 -0.42 4.92 2.00 0.75 -4.97 119.66 124.97 3ffk s GLN 349 Ca 0.55 -0.69 -0.19 0.00 -2.00 0.00 0.00 55.36 53.03 3ffk s GLN 349 Cb -0.36 -3.50 0.02 0.00 0.80 0.00 0.00 33.01 29.97 3ffk s GLN 349 CO 0.39 -0.38 0.54 0.08 -0.50 0.00 0.00 175.29 175.43 3ffk s VAL 350 N 1.60 4.95 -0.03 1.34 1.01 -1.26 -2.07 120.40 125.94 3ffk s VAL 350 Ca 0.05 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 3ffk s VAL 350 Cb -0.17 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 3ffk s VAL 350 CO 0.05 -0.49 0.22 -0.44 0.00 0.00 0.00 175.10 174.44 3ffk s SER 351 N 1.90 6.46 -0.13 3.32 0.01 -0.73 -5.01 113.70 119.53 3ffk s SER 351 Ca 0.18 0.51 0.01 0.00 1.31 0.00 0.00 55.95 57.96 3ffk s SER 351 Cb -0.15 -2.08 -0.01 0.00 0.21 0.00 0.00 66.02 63.99 3ffk s SER 351 CO 0.16 0.30 -0.15 0.68 0.41 0.00 0.00 173.24 174.65 3ffk s VAL 352 N -1.21 2.88 -0.13 3.43 -7.23 -1.26 -1.50 120.40 115.37 3ffk s VAL 352 Ca 0.24 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.70 3ffk s VAL 352 Cb -0.13 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.62 3ffk s VAL 352 CO 0.13 0.53 -0.19 -0.76 -0.31 0.00 0.00 175.10 174.50 3ffk s LEU 353 N 0.35 2.29 0.42 1.32 1.43 0.24 -4.93 118.68 119.79 3ffk s LEU 353 Ca -0.12 -0.52 -0.23 0.00 -1.03 0.00 0.00 54.13 52.23 3ffk s LEU 353 Cb -0.16 -1.49 -0.09 0.00 0.03 0.00 0.00 46.19 44.47 3ffk s LEU 353 CO 0.06 0.11 1.02 -2.16 0.23 0.00 0.00 176.35 175.62 3ffk s PRO 354 N 0.63 4.11 -0.11 1.29 0.04 -1.26 -0.71 135.00 138.99 3ffk s PRO 354 Ca -0.10 1.40 -0.38 0.00 0.04 0.00 0.00 61.00 61.96 3ffk s PRO 354 Cb -0.16 -2.39 -0.15 0.00 0.04 0.00 0.00 34.50 31.83 3ffk s PRO 354 CO 0.02 -0.17 1.64 -1.91 0.04 0.00 0.00 177.00 176.63 3ffk n GLU 355 N -0.34 1.40 0.00 4.56 2.13 -0.01 0.39 120.64 128.78 3ffk n GLU 355 Ca 0.06 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.39 3ffk n GLU 355 Cb 0.51 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 30.00 3ffk n GLU 355 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ffk n GLY 356 N 3.70 1.37 1.37 8.31 0.00 -1.26 -4.89 105.19 113.78 3ffk n GLY 356 Ca 0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.27 3ffk n GLY 356 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ffk n GLY 357 N -2.00 3.97 3.76 -0.02 0.00 0.16 -5.05 105.19 106.02 3ffk n GLY 357 Ca 0.00 -1.05 -0.39 0.00 0.00 0.00 0.00 46.02 44.58 3ffk n GLY 357 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ffk s GLU 358 N -2.94 3.67 0.30 1.61 8.01 -1.25 -4.62 118.70 123.47 3ffk s GLU 358 Ca 0.48 2.21 0.06 0.00 0.01 0.00 0.00 54.97 57.73 3ffk s GLU 358 Cb 0.39 -2.57 -0.02 0.00 -4.31 0.00 0.00 34.13 27.62 3ffk s GLU 358 CO 0.09 -0.76 0.40 0.95 0.01 0.00 0.00 175.26 175.95 3ffk s THR 359 N -1.29 4.34 0.10 3.63 -4.23 -1.26 -4.94 115.64 111.99 3ffk s THR 359 Ca 0.62 -1.07 -0.18 0.00 -1.18 0.00 0.00 61.69 59.88 3ffk s THR 359 Cb -0.39 -3.50 -0.06 0.00 1.34 0.00 0.00 72.50 69.89 3ffk s THR 359 CO 0.49 -0.22 1.58 -0.65 -0.54 0.00 0.00 174.62 175.28 3ffk h PRO 360 N 1.05 0.47 0.00 3.99 0.11 -1.95 0.25 132.00 135.93 3ffk h PRO 360 Ca -0.47 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.51 3ffk h PRO 360 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ffk h PRO 360 CO 0.56 0.58 0.00 1.28 -0.21 0.00 0.00 178.00 180.21 3ffk n LEU 361 N -4.65 0.00 -0.07 2.35 4.77 -1.26 -0.78 117.00 117.36 3ffk n LEU 361 Ca -0.03 0.43 -0.07 0.00 -0.03 0.00 0.00 56.01 56.31 3ffk n LEU 361 Cb 0.21 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.76 3ffk n LEU 361 CO 0.37 -0.34 -0.95 0.33 -1.33 0.00 0.00 177.39 175.47 3ffk n PHE 362 N -1.43 0.00 0.30 -1.77 7.35 -0.93 -4.52 117.46 116.46 3ffk n PHE 362 Ca 0.02 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.86 3ffk n PHE 362 Cb 0.06 -0.66 0.53 0.00 0.35 0.00 0.00 39.48 39.75 3ffk n PHE 362 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 3ffk h LYS 363 N 0.00 0.00 0.00 -4.13 1.57 0.13 -3.13 116.57 111.01 3ffk h LYS 363 Ca -0.37 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.41 3ffk h LYS 363 Cb 1.80 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.11 3ffk h LYS 363 CO 0.01 0.00 -0.02 -0.56 -0.57 0.00 0.00 179.45 178.31 3ffk h GLN 364 N 0.00 0.00 -0.43 3.15 3.07 -1.19 -2.41 115.11 117.30 3ffk h GLN 364 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3ffk h GLN 364 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.18 3ffk h GLN 364 CO 0.00 0.02 0.00 1.19 0.09 0.00 0.00 178.83 180.13 3ffk n PHE 365 N -3.15 0.57 -4.50 0.06 3.01 -1.18 -4.90 117.46 107.37 3ffk n PHE 365 Ca -0.01 -0.26 -0.30 0.00 1.01 0.00 0.00 57.45 57.89 3ffk n PHE 365 Cb 0.22 -0.05 -0.12 0.00 -0.01 0.00 0.00 39.48 39.53 3ffk n PHE 365 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3ffk s PHE 366 N -1.56 2.58 -0.40 1.38 0.40 -0.91 -0.63 117.98 118.84 3ffk s PHE 366 Ca 0.25 -0.24 -0.29 0.00 -0.60 0.00 0.00 56.93 56.05 3ffk s PHE 366 Cb 0.14 -1.43 0.02 0.00 0.51 0.00 0.00 43.02 42.26 3ffk s PHE 366 CO 0.15 0.31 1.11 0.21 0.70 0.00 0.00 175.22 177.71 3ffk s LYS 367 N -1.72 3.88 -0.94 0.44 2.20 -0.72 -4.41 119.74 118.46 3ffk s LYS 367 Ca 0.16 0.81 -0.06 0.00 -0.36 0.00 0.00 55.97 56.52 3ffk s LYS 367 Cb -0.11 -3.83 -0.03 0.00 -1.51 0.00 0.00 37.83 32.36 3ffk s LYS 367 CO 0.08 -1.16 0.80 0.09 -0.36 0.00 0.00 175.35 174.80 3ffk n ASN 368 N 7.40 -6.71 -4.71 1.43 5.03 -1.26 -4.59 115.26 111.84 3ffk n ASN 368 Ca 0.12 -0.56 -0.42 0.00 0.87 0.00 0.00 54.58 54.59 3ffk n ASN 368 Cb 0.48 -4.70 -0.03 0.00 -1.02 0.00 0.00 39.78 34.51 3ffk n ASN 368 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 3ffk n TRP 369 N -2.85 2.70 -3.75 3.10 -0.00 -1.26 -4.96 117.44 110.42 3ffk n TRP 369 Ca -0.07 -0.00 -0.37 0.00 -0.00 0.00 0.00 57.50 57.06 3ffk n TRP 369 Cb 0.58 -2.69 -0.13 0.00 -0.00 0.00 0.00 31.31 29.08 3ffk n TRP 369 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 177.69 178.19 3ffk s ARG 370 N 1.59 3.23 -0.26 5.87 6.06 -1.26 -5.07 118.95 129.11 3ffk s ARG 370 Ca 0.77 -0.76 -0.29 0.00 -2.50 0.00 0.00 55.73 52.95 3ffk s ARG 370 Cb -0.51 -3.37 -0.01 0.00 0.06 0.00 0.00 34.95 31.12 3ffk s ARG 370 CO 0.34 -0.38 1.44 0.34 -2.50 0.00 0.00 175.30 174.54 3ffk s ASP 371 N 1.53 6.54 0.16 -2.12 3.68 -1.26 -4.94 116.67 120.26 3ffk s ASP 371 Ca 0.04 1.40 -0.28 0.00 2.13 0.00 0.00 52.55 55.84 3ffk s ASP 371 Cb -0.17 -2.54 -0.00 0.00 -1.45 0.00 0.00 42.92 38.76 3ffk s ASP 371 CO 0.03 -1.16 1.56 1.55 0.13 0.00 0.00 175.17 177.28 3ffk h PRO 372 N 9.93 -0.26 -4.40 4.34 0.13 -1.98 -3.20 132.00 136.57 3ffk h PRO 372 Ca -0.30 0.02 -0.75 0.00 -0.87 0.00 0.00 66.00 64.11 3ffk h PRO 372 Cb 1.12 0.06 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 3ffk h PRO 372 CO 1.02 -0.17 0.65 0.16 -0.23 0.00 0.00 178.00 179.42 3ffk s ASP 373 N -5.14 6.85 0.00 1.44 3.84 -1.26 -5.30 116.67 117.10 3ffk s ASP 373 Ca -0.14 -2.64 0.00 0.00 -0.00 0.00 0.00 52.55 49.77 3ffk s ASP 373 Cb 0.12 -2.31 0.00 0.00 -1.38 0.00 0.00 42.92 39.34 3ffk s ASP 373 CO 0.65 -0.74 0.00 0.00 -0.00 0.00 0.00 175.17 175.08