#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kfk n MET 12 N 0.00 0.57 -4.10 -3.83 2.81 -1.26 -4.96 117.12 106.35 3kfk n MET 12 Ca 0.00 0.00 -0.22 0.00 -1.81 0.00 0.00 57.70 55.67 3kfk n MET 12 Cb 0.00 -0.98 -0.17 0.00 -0.71 0.00 0.00 33.22 31.36 3kfk n MET 12 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3kfk s LYS 13 N -1.96 0.96 -0.15 0.03 1.02 -1.04 -5.04 119.74 113.56 3kfk s LYS 13 Ca 0.00 -0.11 -0.13 0.00 0.02 0.00 0.00 55.97 55.75 3kfk s LYS 13 Cb 0.00 -1.02 0.04 0.00 -0.52 0.00 0.00 37.83 36.33 3kfk s LYS 13 CO 0.00 -0.14 0.39 0.50 -0.92 0.00 0.00 175.35 175.19 3kfk s ARG 14 N 1.21 0.44 -0.02 1.68 3.52 -1.26 -2.39 118.95 122.13 3kfk s ARG 14 Ca -0.06 0.60 0.05 0.00 -0.13 0.00 0.00 55.73 56.19 3kfk s ARG 14 Cb -0.14 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.39 3kfk s ARG 14 CO -0.02 -0.08 -0.16 0.71 -0.81 0.00 0.00 175.30 174.95 3kfk s TYR 15 N 0.50 2.65 -0.33 5.12 2.02 -1.26 -5.03 117.35 121.03 3kfk s TYR 15 Ca -0.02 -0.20 -0.12 0.00 -0.37 0.00 0.00 57.07 56.36 3kfk s TYR 15 Cb -0.04 -1.57 -0.02 0.00 -0.40 0.00 0.00 41.96 39.92 3kfk s TYR 15 CO -0.03 0.20 0.22 -1.64 -1.57 0.00 0.00 175.55 172.73 3kfk s MET 16 N -0.97 3.55 1.70 -0.62 -1.94 -1.26 -4.18 119.30 115.58 3kfk s MET 16 Ca 0.13 -0.60 0.00 0.00 -1.71 0.00 0.00 55.69 53.51 3kfk s MET 16 Cb -0.11 -3.75 0.00 0.00 2.01 0.00 0.00 34.83 32.99 3kfk s MET 16 CO 0.02 -0.39 0.00 0.41 -0.01 0.00 0.00 175.02 175.05 3kfk n GLY 17 N 5.08 0.36 0.18 -0.03 0.00 -1.12 -1.41 105.19 108.26 3kfk n GLY 17 Ca -0.13 0.56 0.03 0.00 0.00 0.00 0.00 46.02 46.48 3kfk n GLY 17 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3kfk h ARG 18 N 0.00 0.00 0.00 1.61 3.08 -1.93 -1.49 114.38 115.65 3kfk h ARG 18 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3kfk h ARG 18 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3kfk h ARG 18 CO 0.00 0.39 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.78 3kfk h ASP 19 N 0.00 0.00 0.11 7.04 3.32 -1.58 -3.07 116.42 122.24 3kfk h ASP 19 Ca -0.00 -0.02 -0.37 0.00 0.02 0.00 0.00 57.03 56.66 3kfk h ASP 19 Cb 0.71 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.21 3kfk h ASP 19 CO 0.05 0.01 -2.19 0.00 -1.72 0.00 0.00 179.24 175.39 3kfk n ALA 20 N -1.82 1.25 -0.14 3.45 0.00 -0.96 -3.53 120.51 118.75 3kfk n ALA 20 Ca 0.05 -0.90 -0.11 0.00 0.00 0.00 0.00 53.44 52.48 3kfk n ALA 20 Cb 0.44 -0.42 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 3kfk n ALA 20 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3kfk h GLN 21 N 0.03 0.82 0.00 0.00 4.20 -1.39 -2.68 115.11 116.09 3kfk h GLN 21 Ca -0.48 -0.32 -0.10 0.00 0.06 0.00 0.00 58.65 57.81 3kfk h GLN 21 Cb 2.01 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.73 3kfk h GLN 21 CO 0.01 0.94 -0.50 -0.09 -0.67 0.00 0.00 178.83 178.53 3kfk h ARG 22 N 0.65 0.00 -0.21 1.46 2.43 -1.74 -2.48 114.38 114.48 3kfk h ARG 22 Ca 0.11 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.14 3kfk h ARG 22 Cb 0.64 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 3kfk h ARG 22 CO 0.04 0.50 -0.46 1.98 -1.51 0.00 0.00 179.97 180.52 3kfk h MET 23 N 0.00 0.54 0.09 0.20 4.05 -1.58 -2.45 114.93 115.78 3kfk h MET 23 Ca -0.00 -0.29 -0.27 0.00 -0.28 0.00 0.00 59.70 58.86 3kfk h MET 23 Cb 1.06 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.86 3kfk h MET 23 CO 0.06 0.88 -1.25 -0.91 0.23 0.00 0.00 176.91 175.93 3kfk h ASN 24 N 0.43 0.30 -0.25 1.39 4.21 -1.41 -3.06 115.58 117.18 3kfk h ASN 24 Ca 0.03 -0.34 -0.16 0.00 1.21 0.00 0.00 56.30 57.03 3kfk h ASN 24 Cb 0.97 -0.10 0.00 0.00 -1.12 0.00 0.00 38.32 38.07 3kfk h ASN 24 CO 0.09 1.27 -0.47 0.40 -1.29 0.00 0.00 177.43 177.43 3kfk h ILE 25 N 0.05 1.30 -0.27 2.81 2.04 -1.49 -2.96 117.51 118.99 3kfk h ILE 25 Ca -0.13 -1.67 -0.09 0.00 1.00 0.00 0.00 64.86 63.97 3kfk h ILE 25 Cb 1.93 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 39.72 3kfk h ILE 25 CO 0.17 0.53 -0.21 0.25 0.00 0.00 0.00 178.15 178.90 3kfk h LEU 26 N 0.51 0.50 -0.87 1.44 6.46 -1.56 -2.28 115.31 119.51 3kfk h LEU 26 Ca 0.01 -0.16 -0.12 0.00 -0.12 0.00 0.00 57.88 57.50 3kfk h LEU 26 Cb 1.07 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.86 3kfk h LEU 26 CO 0.11 0.71 -0.50 0.00 -0.62 0.00 0.00 178.44 178.14 3kfk h ALA 27 N 1.33 1.05 0.02 1.25 0.00 -1.55 -1.87 119.26 119.49 3kfk h ALA 27 Ca 0.07 -0.47 -0.21 0.00 0.00 0.00 0.00 54.91 54.31 3kfk h ALA 27 Cb 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3kfk h ALA 27 CO 0.04 0.65 -0.96 0.78 0.00 0.00 0.00 179.25 179.76 3kfk h GLY 28 N 1.41 0.08 1.69 0.00 0.00 -1.35 -3.31 103.07 101.59 3kfk h GLY 28 Ca 0.00 -0.17 -0.24 0.00 0.00 0.00 0.00 47.33 46.92 3kfk h GLY 28 CO 0.07 0.15 -1.07 3.21 0.00 0.00 0.00 176.54 178.91 3kfk h ARG 29 N 0.03 0.25 -0.07 4.80 3.08 -1.31 -3.12 114.38 118.04 3kfk h ARG 29 Ca -0.03 -0.35 -0.11 0.00 0.07 0.00 0.00 59.98 59.55 3kfk h ARG 29 Cb 1.66 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.82 3kfk h ARG 29 CO 0.13 1.11 -0.47 0.97 -1.07 0.00 0.00 179.97 180.64 3kfk h ILE 30 N 0.11 1.34 0.00 2.04 2.10 -1.45 -2.33 117.51 119.31 3kfk h ILE 30 Ca -0.09 -1.65 0.00 0.00 1.08 0.00 0.00 64.86 64.20 3kfk h ILE 30 Cb 1.75 1.81 0.00 0.00 -1.09 0.00 0.00 36.82 39.29 3kfk h ILE 30 CO 0.17 0.49 -0.47 0.16 -1.08 0.00 0.00 178.15 177.42 3kfk h ILE 31 N 0.13 0.00 -0.02 2.19 3.07 -1.68 -3.28 117.51 117.93 3kfk h ILE 31 Ca 0.01 -0.77 -0.21 0.00 1.55 0.00 0.00 64.86 65.44 3kfk h ILE 31 Cb 0.88 1.51 -0.00 0.00 -0.27 0.00 0.00 36.82 38.94 3kfk h ILE 31 CO 0.07 0.00 -0.86 0.00 -1.05 0.00 0.00 178.15 176.30 3kfk h ALA 32 N 2.23 0.46 0.00 0.16 0.00 -1.40 -3.15 119.26 117.56 3kfk h ALA 32 Ca 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 3kfk h ALA 32 Cb 0.89 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3kfk h ALA 32 CO 0.00 0.82 -0.02 0.93 0.00 0.00 0.00 179.25 180.98 3kfk h GLU 33 N 0.22 0.00 -0.08 0.00 5.08 -1.51 -2.28 114.58 116.01 3kfk h GLU 33 Ca -0.06 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 3kfk h GLU 33 Cb 1.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 3kfk h GLU 33 CO 0.15 0.02 -0.46 1.15 -1.00 0.00 0.00 179.01 178.86 3kfk h THR 34 N 0.00 1.33 -0.34 1.13 2.02 -1.60 -3.18 112.91 112.28 3kfk h THR 34 Ca -0.00 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 65.55 3kfk h THR 34 Cb 0.66 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 3kfk h THR 34 CO 0.00 0.48 0.00 1.33 0.37 0.00 0.00 175.52 177.70 3kfk n VAL 35 N -3.99 1.01 0.16 3.16 0.24 -1.15 -4.62 118.33 113.14 3kfk n VAL 35 Ca -0.02 -1.01 0.04 0.00 -2.04 0.00 0.00 64.34 61.32 3kfk n VAL 35 Cb 0.51 0.49 0.14 0.00 -1.47 0.00 0.00 33.84 33.51 3kfk n VAL 35 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3kfk h ARG 36 N 1.98 0.00 0.00 7.34 2.43 -1.38 -3.22 114.38 121.53 3kfk h ARG 36 Ca 0.00 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 3kfk h ARG 36 Cb 0.73 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 3kfk h ARG 36 CO 0.00 0.43 -0.63 0.66 -1.51 0.00 0.00 179.97 178.92 3kfk h SER 37 N 0.00 0.00 0.96 -3.80 4.64 -1.82 -3.33 113.55 110.20 3kfk h SER 37 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3kfk h SER 37 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3kfk h SER 37 CO 0.06 0.24 -0.08 0.71 -0.87 0.00 0.00 176.83 176.89 3kfk h THR 38 N 0.00 0.20 -3.60 2.95 1.35 -1.72 -2.06 112.91 110.03 3kfk h THR 38 Ca -0.03 -0.70 -0.52 0.00 -0.55 0.00 0.00 66.41 64.61 3kfk h THR 38 Cb 1.21 1.58 0.03 0.00 -1.73 0.00 0.00 68.15 69.24 3kfk h THR 38 CO 0.03 0.07 0.56 -0.22 -0.25 0.00 0.00 175.52 175.71 3kfk s LEU 39 N -6.42 4.47 0.00 3.87 0.20 -1.25 -4.05 118.68 115.49 3kfk s LEU 39 Ca 0.01 2.33 0.00 0.00 0.69 0.00 0.00 54.13 57.16 3kfk s LEU 39 Cb 0.10 -3.62 0.00 0.00 -0.43 0.00 0.00 46.19 42.24 3kfk s LEU 39 CO 0.57 -0.36 0.00 0.61 -0.29 0.00 0.00 176.35 176.88 3kfk n GLY 40 N 1.78 2.25 0.28 7.98 0.00 -1.26 -4.12 105.19 112.11 3kfk n GLY 40 Ca 0.03 -1.90 0.14 0.00 0.00 0.00 0.00 46.02 44.29 3kfk n GLY 40 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3kfk h PRO 41 N 0.00 0.00 -1.00 1.61 0.11 -1.90 -0.40 132.00 130.42 3kfk h PRO 41 Ca 0.00 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.56 3kfk h PRO 41 Cb 0.00 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 30.80 3kfk h PRO 41 CO 0.00 0.05 0.70 1.63 -0.21 0.00 0.00 178.00 180.17 3kfk n LYS 42 N -3.78 2.33 -2.02 1.05 4.76 -1.26 -5.01 118.16 114.22 3kfk n LYS 42 Ca -0.03 -3.06 -0.28 0.00 -2.87 0.00 0.00 58.31 52.07 3kfk n LYS 42 Cb 0.15 -2.20 0.07 0.00 -1.84 0.00 0.00 35.03 31.21 3kfk n LYS 42 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3kfk s GLY 43 N -1.41 1.62 0.29 0.72 0.00 -0.16 -4.53 107.32 103.85 3kfk s GLY 43 Ca 0.58 -0.66 0.07 0.00 0.00 0.00 0.00 44.72 44.72 3kfk s GLY 43 CO 0.09 -0.24 0.25 1.06 0.00 0.00 0.00 173.10 174.26 3kfk s MET 44 N -5.39 2.86 0.22 2.90 1.00 -0.78 -4.95 119.30 115.17 3kfk s MET 44 Ca 0.60 -1.15 0.08 0.00 0.00 0.00 0.00 55.69 55.22 3kfk s MET 44 Cb -0.11 -2.54 -0.04 0.00 0.00 0.00 0.00 34.83 32.14 3kfk s MET 44 CO 0.48 0.26 0.04 -0.51 0.00 0.00 0.00 175.02 175.29 3kfk s ASP 45 N -3.92 4.83 -0.06 3.03 1.11 -1.26 -4.20 116.67 116.20 3kfk s ASP 45 Ca 0.37 -0.46 0.05 0.00 0.18 0.00 0.00 52.55 52.69 3kfk s ASP 45 Cb -0.07 -1.03 -0.01 0.00 1.07 0.00 0.00 42.92 42.89 3kfk s ASP 45 CO 0.26 0.03 -0.22 -0.54 1.18 0.00 0.00 175.17 175.88 3kfk s LYS 46 N -3.40 2.36 -0.21 8.23 -0.14 -0.89 -4.98 119.74 120.71 3kfk s LYS 46 Ca 0.30 -0.81 -0.07 0.00 -1.36 0.00 0.00 55.97 54.04 3kfk s LYS 46 Cb -0.08 -1.98 -0.03 0.00 -1.68 0.00 0.00 37.83 34.06 3kfk s LYS 46 CO 0.20 0.31 0.05 1.41 -0.76 0.00 0.00 175.35 176.57 3kfk s MET 47 N -0.04 3.77 -0.23 1.68 -2.45 -1.26 -1.76 119.30 119.02 3kfk s MET 47 Ca -0.05 -0.44 -0.02 0.00 -1.25 0.00 0.00 55.69 53.92 3kfk s MET 47 Cb -0.14 -3.22 0.01 0.00 1.25 0.00 0.00 34.83 32.74 3kfk s MET 47 CO 0.04 0.05 -0.07 -0.51 1.05 0.00 0.00 175.02 175.58 3kfk s LEU 48 N 0.96 2.93 -0.32 4.11 1.02 -1.02 -5.03 118.68 121.33 3kfk s LEU 48 Ca 0.03 -0.63 -0.03 0.00 0.02 0.00 0.00 54.13 53.52 3kfk s LEU 48 Cb -0.14 -1.68 0.05 0.00 0.02 0.00 0.00 46.19 44.44 3kfk s LEU 48 CO 0.03 -0.07 0.04 -0.69 0.02 0.00 0.00 176.35 175.68 3kfk s VAL 49 N 1.39 3.27 0.00 -1.59 1.01 -1.26 -3.64 120.40 119.57 3kfk s VAL 49 Ca 0.03 -1.32 0.00 0.00 0.00 0.00 0.00 61.98 60.69 3kfk s VAL 49 Cb -0.15 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.35 3kfk s VAL 49 CO -0.05 -0.15 0.00 -0.90 0.00 0.00 0.00 175.10 174.00 3kfk n ASP 50 N 4.69 0.00 0.07 3.32 5.75 -1.25 -4.94 116.55 124.18 3kfk n ASP 50 Ca -0.12 -0.33 -0.02 0.00 -0.01 0.00 0.00 54.79 54.30 3kfk n ASP 50 Cb 0.44 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.77 3kfk n ASP 50 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 3kfk h ASP 51 N 0.00 0.34 1.53 -1.12 3.04 -1.97 -3.02 116.42 115.22 3kfk h ASP 51 Ca 0.00 -0.12 0.00 0.00 -3.24 0.00 0.00 57.03 53.67 3kfk h ASP 51 Cb 0.00 -0.09 0.00 0.00 -1.04 0.00 0.00 39.33 38.20 3kfk h ASP 51 CO 0.00 0.63 0.00 -0.07 -2.04 0.00 0.00 179.24 177.76 3kfk h LEU 52 N 0.30 0.00 0.00 0.15 3.38 -2.03 -3.46 115.31 113.64 3kfk h LEU 52 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3kfk h LEU 52 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3kfk h LEU 52 CO 0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.19 3kfk n GLY 53 N 0.64 0.69 3.70 0.83 0.00 -1.14 -5.04 105.19 104.87 3kfk n GLY 53 Ca 0.03 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3kfk n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kfk s ASP 54 N -2.11 7.00 -0.14 1.61 1.01 -1.26 -4.90 116.67 117.88 3kfk s ASP 54 Ca 0.00 2.03 -0.09 0.00 0.71 0.00 0.00 52.55 55.21 3kfk s ASP 54 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 3kfk s ASP 54 CO 0.00 -0.57 0.16 0.54 0.21 0.00 0.00 175.17 175.51 3kfk s VAL 55 N 1.57 5.45 -0.21 -1.27 0.11 -1.26 -3.96 120.40 120.83 3kfk s VAL 55 Ca 0.60 0.25 -0.10 0.00 -2.93 0.00 0.00 61.98 59.79 3kfk s VAL 55 Cb -0.30 -3.45 0.08 0.00 -1.53 0.00 0.00 36.38 31.18 3kfk s VAL 55 CO 0.27 0.55 0.50 0.54 -3.33 0.00 0.00 175.10 173.64 3kfk s VAL 56 N -0.55 -0.23 -0.19 2.04 0.11 -1.24 -5.05 120.40 115.29 3kfk s VAL 56 Ca 0.13 0.08 -0.04 0.00 -2.93 0.00 0.00 61.98 59.22 3kfk s VAL 56 Cb -0.12 -0.75 -0.02 0.00 -1.53 0.00 0.00 36.38 33.96 3kfk s VAL 56 CO 0.03 0.03 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.11 3kfk s VAL 57 N 1.84 3.68 -0.06 2.04 1.01 -1.26 -2.42 120.40 125.23 3kfk s VAL 57 Ca -0.08 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 3kfk s VAL 57 Cb -0.09 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.66 3kfk s VAL 57 CO -0.15 0.44 0.23 0.28 0.00 0.00 0.00 175.10 175.90 3kfk s THR 58 N 0.99 0.03 -0.06 3.92 -1.32 -0.72 -4.97 115.64 113.50 3kfk s THR 58 Ca 0.01 -0.22 0.11 0.00 -1.21 0.00 0.00 61.69 60.37 3kfk s THR 58 Cb -0.15 -0.40 -0.24 0.00 -1.51 0.00 0.00 72.50 70.21 3kfk s THR 58 CO 0.01 -0.12 0.58 -3.20 -2.21 0.00 0.00 174.62 169.68 3kfk n ASN 59 N 2.39 0.98 -4.69 8.08 2.85 -1.26 -2.09 115.26 121.52 3kfk n ASN 59 Ca -0.16 0.36 -0.50 0.00 -0.11 0.00 0.00 54.58 54.17 3kfk n ASN 59 Cb 0.57 -0.09 -0.05 0.00 1.24 0.00 0.00 39.78 41.45 3kfk n ASN 59 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3kfk n ASP 60 N -3.08 3.26 0.04 1.20 2.03 -1.26 -4.89 116.55 113.85 3kfk n ASP 60 Ca -0.20 0.99 0.00 0.00 0.52 0.00 0.00 54.79 56.11 3kfk n ASP 60 Cb 1.06 -1.33 0.32 0.00 -0.72 0.00 0.00 41.12 40.45 3kfk n ASP 60 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 3kfk h GLY 61 N 8.82 0.46 1.69 0.27 0.00 -1.92 -3.14 103.07 109.25 3kfk h GLY 61 Ca -0.48 -0.28 -0.20 0.00 0.00 0.00 0.00 47.33 46.37 3kfk h GLY 61 CO 0.95 0.26 -0.87 -0.24 0.00 0.00 0.00 176.54 176.64 3kfk h VAL 62 N 0.40 1.45 0.00 4.60 3.04 -1.90 -3.20 116.25 120.64 3kfk h VAL 62 Ca 0.08 -2.50 -0.05 0.00 -1.01 0.00 0.00 66.70 63.22 3kfk h VAL 62 Cb 0.37 2.40 -0.01 0.00 -2.01 0.00 0.00 31.29 32.05 3kfk h VAL 62 CO 0.02 0.74 -0.25 0.71 -1.01 0.00 0.00 177.57 177.78 3kfk h THR 63 N 0.16 0.54 0.01 3.17 1.35 -1.95 -3.01 112.91 113.19 3kfk h THR 63 Ca -0.05 -1.29 -0.00 0.00 -0.55 0.00 0.00 66.41 64.52 3kfk h THR 63 Cb 1.50 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.81 3kfk h THR 63 CO 0.14 0.24 -0.01 0.40 -0.25 0.00 0.00 175.52 176.05 3kfk h ILE 64 N 0.00 1.44 0.00 6.82 2.04 -1.57 -3.29 117.51 122.95 3kfk h ILE 64 Ca -0.00 -1.41 -0.06 0.00 1.00 0.00 0.00 64.86 64.39 3kfk h ILE 64 Cb 0.88 2.38 -0.01 0.00 -0.74 0.00 0.00 36.82 39.32 3kfk h ILE 64 CO 0.03 0.36 -0.30 -0.07 0.00 0.00 0.00 178.15 178.17 3kfk h LEU 65 N -0.63 0.00 0.06 1.44 3.38 -1.55 -3.01 115.31 115.00 3kfk h LEU 65 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 3kfk h LEU 65 Cb 0.60 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.37 3kfk h LEU 65 CO 0.00 0.30 -0.85 0.03 0.09 0.00 0.00 178.44 178.02 3kfk h ARG 66 N 0.00 0.47 -0.06 1.13 3.08 -1.65 -3.37 114.38 113.97 3kfk h ARG 66 Ca -0.00 -0.58 0.00 0.00 0.07 0.00 0.00 59.98 59.46 3kfk h ARG 66 Cb 0.63 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.87 3kfk h ARG 66 CO 0.04 1.22 0.00 0.39 -1.07 0.00 0.00 179.97 180.55 3kfk n GLU 67 N -4.06 2.19 -3.48 0.04 1.02 -1.23 -4.94 120.64 110.18 3kfk n GLU 67 Ca -0.12 -1.90 -0.24 0.00 -0.02 0.00 0.00 57.16 54.88 3kfk n GLU 67 Cb 0.80 -1.44 -0.02 0.00 -0.02 0.00 0.00 31.44 30.76 3kfk n GLU 67 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kfk s MET 68 N -1.86 3.49 -0.66 3.49 0.23 -1.14 -4.93 119.30 117.92 3kfk s MET 68 Ca 0.28 -0.37 -0.27 0.00 -1.03 0.00 0.00 55.69 54.30 3kfk s MET 68 Cb 0.19 -2.71 0.01 0.00 -1.53 0.00 0.00 34.83 30.80 3kfk s MET 68 CO 0.29 0.21 1.45 -1.12 -2.03 0.00 0.00 175.02 173.82 3kfk s SER 69 N -3.89 5.94 -0.10 -1.18 0.01 -1.26 -4.98 113.70 108.24 3kfk s SER 69 Ca 0.39 -0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.62 3kfk s SER 69 Cb -0.10 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.58 3kfk s SER 69 CO 0.34 -1.93 -0.24 -0.69 0.41 0.00 0.00 173.24 171.13 3kfk s VAL 70 N 6.62 2.05 0.00 3.43 1.01 -1.26 -5.02 120.40 127.22 3kfk s VAL 70 Ca 0.47 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.44 3kfk s VAL 70 Cb -0.10 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.51 3kfk s VAL 70 CO 0.19 0.56 0.00 -0.62 0.00 0.00 0.00 175.10 175.23 3kfk n GLU 71 N 3.52 2.55 -2.20 2.72 -0.58 -1.26 -4.98 120.64 120.41 3kfk n GLU 71 Ca -0.19 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.13 3kfk n GLU 71 Cb 0.53 -0.73 -0.03 0.00 -0.57 0.00 0.00 31.44 30.64 3kfk n GLU 71 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 3kfk s HIS 72 N -1.22 3.24 0.32 -0.32 2.46 -1.26 -4.93 115.29 113.58 3kfk s HIS 72 Ca 0.00 0.98 0.03 0.00 0.47 0.00 0.00 55.06 56.54 3kfk s HIS 72 Cb 0.00 -3.66 0.61 0.00 -0.13 0.00 0.00 32.58 29.40 3kfk s HIS 72 CO 0.00 -2.28 1.90 -1.35 -2.47 0.00 0.00 174.74 170.53 3kfk h PRO 73 N 6.86 0.90 0.00 2.88 0.11 -2.00 -2.11 132.00 138.64 3kfk h PRO 73 Ca -0.42 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 3kfk h PRO 73 Cb 1.21 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 3kfk h PRO 73 CO 0.86 0.60 -0.66 0.00 -0.21 0.00 0.00 178.00 178.59 3kfk h ALA 74 N 1.54 0.83 -0.00 -0.75 0.00 -1.93 -3.22 119.26 115.74 3kfk h ALA 74 Ca 0.41 -0.60 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 3kfk h ALA 74 Cb 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3kfk h ALA 74 CO -0.17 0.82 -0.82 0.00 0.00 0.00 0.00 179.25 179.08 3kfk h ALA 75 N 1.34 0.62 0.00 0.00 0.00 -1.64 -3.24 119.26 116.35 3kfk h ALA 75 Ca -0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 54.91 54.12 3kfk h ALA 75 Cb 1.22 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3kfk h ALA 75 CO 0.09 0.96 -0.32 0.87 0.00 0.00 0.00 179.25 180.84 3kfk h LYS 76 N 0.05 0.00 0.00 0.00 1.57 -1.45 -2.94 116.57 113.80 3kfk h LYS 76 Ca -0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3kfk h LYS 76 Cb 1.44 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.75 3kfk h LYS 76 CO 0.12 0.32 -0.12 0.52 -0.57 0.00 0.00 179.45 179.72 3kfk h MET 77 N 0.00 0.00 0.00 3.15 2.86 -1.61 -3.14 114.93 116.19 3kfk h MET 77 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3kfk h MET 77 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 3kfk h MET 77 CO 0.04 0.12 -0.50 -0.11 1.06 0.00 0.00 176.91 177.52 3kfk n LEU 78 N -3.17 0.54 -0.08 1.22 7.94 -1.11 -3.49 117.00 118.85 3kfk n LEU 78 Ca 0.02 0.15 0.16 0.00 -1.11 0.00 0.00 56.01 55.23 3kfk n LEU 78 Cb 0.49 -0.25 0.85 0.00 0.53 0.00 0.00 43.42 45.04 3kfk n LEU 78 CO 0.33 0.03 1.05 -0.38 -1.11 0.00 0.00 177.39 177.32 3kfk n ILE 79 N -1.76 0.00 0.46 1.96 5.41 -1.19 -3.04 119.36 121.20 3kfk n ILE 79 Ca 0.05 -0.04 0.12 0.00 1.00 0.00 0.00 62.75 63.87 3kfk n ILE 79 Cb 0.38 -0.33 0.13 0.00 -0.71 0.00 0.00 39.64 39.11 3kfk n ILE 79 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3kfk h GLU 80 N 0.38 0.00 0.04 0.38 4.39 -1.71 -3.18 114.58 114.87 3kfk h GLU 80 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 3kfk h GLU 80 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3kfk h GLU 80 CO 0.00 0.00 -0.02 0.28 -1.16 0.00 0.00 179.01 178.11 3kfk h VAL 81 N 0.00 1.38 0.00 3.13 2.07 -1.76 -2.68 116.25 118.39 3kfk h VAL 81 Ca 0.00 -1.53 -0.12 0.00 0.82 0.00 0.00 66.70 65.88 3kfk h VAL 81 Cb 0.81 2.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 3kfk h VAL 81 CO 0.00 0.38 -0.56 0.00 0.02 0.00 0.00 177.57 177.41 3kfk h ALA 82 N 0.14 1.08 -0.16 1.67 0.00 -1.73 -1.49 119.26 118.77 3kfk h ALA 82 Ca -0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3kfk h ALA 82 Cb 0.65 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3kfk h ALA 82 CO 0.01 0.70 -0.31 -0.22 0.00 0.00 0.00 179.25 179.42 3kfk h LYS 83 N 0.00 0.32 -0.01 0.00 3.64 -1.63 -1.32 116.57 117.57 3kfk h LYS 83 Ca -0.01 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3kfk h LYS 83 Cb 0.99 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 3kfk h LYS 83 CO 0.07 0.61 -0.15 0.25 -2.27 0.00 0.00 179.45 177.96 3kfk n THR 84 N -4.10 0.00 0.03 1.00 -2.24 -1.01 -3.11 114.28 104.86 3kfk n THR 84 Ca -0.01 -0.21 -0.22 0.00 -2.27 0.00 0.00 64.05 61.34 3kfk n THR 84 Cb 0.42 0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 69.08 3kfk n THR 84 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3kfk h GLN 85 N 1.99 0.31 0.00 -0.78 5.75 -0.64 -3.06 115.11 118.69 3kfk h GLN 85 Ca 0.00 -0.53 -0.03 0.00 -0.15 0.00 0.00 58.65 57.94 3kfk h GLN 85 Cb 0.56 0.20 -0.00 0.00 1.07 0.00 0.00 27.48 29.30 3kfk h GLN 85 CO 0.00 1.25 -0.13 1.05 -2.65 0.00 0.00 178.83 178.35 3kfk h GLU 86 N 0.00 0.00 0.16 1.69 4.11 -1.39 0.16 114.58 119.31 3kfk h GLU 86 Ca -0.37 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.75 3kfk h GLU 86 Cb 2.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.26 3kfk h GLU 86 CO 0.11 0.13 -1.43 -0.22 0.07 0.00 0.00 179.01 177.67 3kfk h LYS 87 N 0.00 0.34 0.04 1.06 1.63 -1.68 -3.32 116.57 114.64 3kfk h LYS 87 Ca -0.00 -0.58 -0.34 0.00 -0.85 0.00 0.00 60.65 58.89 3kfk h LYS 87 Cb 0.84 0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 32.65 3kfk h LYS 87 CO 0.02 1.25 -1.88 0.39 -3.45 0.00 0.00 179.45 175.77 3kfk n GLU 88 N -3.55 0.65 -0.01 1.90 -0.58 -1.15 -4.88 120.64 113.02 3kfk n GLU 88 Ca -0.14 0.36 -0.02 0.00 -0.42 0.00 0.00 57.16 56.94 3kfk n GLU 88 Cb 1.05 -1.66 -0.01 0.00 -0.57 0.00 0.00 31.44 30.25 3kfk n GLU 88 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3kfk n VAL 89 N -3.92 0.71 0.00 2.62 0.31 -0.26 -5.08 118.33 112.71 3kfk n VAL 89 Ca -0.38 0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3kfk n VAL 89 Cb 0.88 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 3kfk n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kfk n GLY 90 N 2.61 2.68 3.84 2.92 0.00 0.38 -4.89 105.19 112.73 3kfk n GLY 90 Ca -0.03 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 3kfk n GLY 90 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kfk s ASP 91 N 0.00 6.80 0.00 1.61 2.15 -1.26 -4.39 116.67 121.58 3kfk s ASP 91 Ca 0.00 0.95 0.00 0.00 0.43 0.00 0.00 52.55 53.93 3kfk s ASP 91 Cb 0.00 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 3kfk s ASP 91 CO 0.00 0.32 0.00 0.61 -0.17 0.00 0.00 175.17 175.93 3kfk n GLY 92 N 1.84 1.64 0.13 2.66 0.00 -1.26 -4.80 105.19 105.40 3kfk n GLY 92 Ca -0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 3kfk n GLY 92 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3kfk h THR 93 N 0.00 1.48 -0.21 2.61 1.35 -1.91 -2.91 112.91 113.32 3kfk h THR 93 Ca 0.00 -2.46 -0.13 0.00 -0.55 0.00 0.00 66.41 63.26 3kfk h THR 93 Cb 0.00 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 3kfk h THR 93 CO 0.00 0.72 -0.40 0.74 -0.25 0.00 0.00 175.52 176.33 3kfk h THR 94 N 0.10 1.32 -0.11 6.82 2.02 -1.95 -3.27 112.91 117.84 3kfk h THR 94 Ca -0.03 -1.62 -0.07 0.00 0.77 0.00 0.00 66.41 65.46 3kfk h THR 94 Cb 1.38 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.61 3kfk h THR 94 CO 0.12 0.50 -0.26 0.71 0.37 0.00 0.00 175.52 176.97 3kfk h THR 95 N 0.33 1.23 0.00 3.16 1.35 -1.95 -2.90 112.91 114.14 3kfk h THR 95 Ca 0.01 -1.08 -0.07 0.00 -0.55 0.00 0.00 66.41 64.72 3kfk h THR 95 Cb 0.99 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 3kfk h THR 95 CO 0.09 0.33 -0.31 0.00 -0.25 0.00 0.00 175.52 175.37 3kfk h ALA 96 N 1.56 1.10 0.12 6.62 0.00 -1.56 -3.02 119.26 124.07 3kfk h ALA 96 Ca 0.03 -0.29 -0.27 0.00 0.00 0.00 0.00 54.91 54.38 3kfk h ALA 96 Cb 0.55 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3kfk h ALA 96 CO 0.04 0.39 -1.37 0.28 0.00 0.00 0.00 179.25 178.59 3kfk h VAL 97 N 0.00 1.06 -0.80 0.00 2.07 -1.58 -3.30 116.25 113.70 3kfk h VAL 97 Ca -0.00 -2.41 -0.03 0.00 0.82 0.00 0.00 66.70 65.07 3kfk h VAL 97 Cb 0.75 2.75 -0.04 0.00 -1.52 0.00 0.00 31.29 33.23 3kfk h VAL 97 CO 0.04 0.70 0.36 0.58 0.02 0.00 0.00 177.57 179.28 3kfk h VAL 98 N -0.31 1.25 -0.52 2.57 2.07 -1.56 -2.40 116.25 117.35 3kfk h VAL 98 Ca -0.29 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 3kfk h VAL 98 Cb 1.75 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 3kfk h VAL 98 CO 0.06 0.31 0.29 0.58 0.02 0.00 0.00 177.57 178.84 3kfk h VAL 99 N 1.14 1.17 -0.23 2.57 2.07 -1.71 -2.34 116.25 118.93 3kfk h VAL 99 Ca 0.27 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 3kfk h VAL 99 Cb 0.15 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3kfk h VAL 99 CO -0.03 0.18 0.10 0.00 0.02 0.00 0.00 177.57 177.84 3kfk h ALA 100 N 1.13 1.74 -0.16 1.67 0.00 -1.56 -0.86 119.26 121.22 3kfk h ALA 100 Ca 0.18 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 3kfk h ALA 100 Cb 0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3kfk h ALA 100 CO -0.03 0.21 -0.65 0.78 0.00 0.00 0.00 179.25 179.56 3kfk h GLY 101 N 0.43 0.66 1.97 0.00 0.00 -1.10 -3.00 103.07 102.03 3kfk h GLY 101 Ca 0.08 -0.85 -0.16 0.00 0.00 0.00 0.00 47.33 46.40 3kfk h GLY 101 CO -0.01 0.76 -0.73 -2.09 0.00 0.00 0.00 176.54 174.47 3kfk h GLU 102 N 0.44 0.03 0.00 4.80 4.57 -0.92 -2.42 114.58 121.08 3kfk h GLU 102 Ca -0.02 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.09 3kfk h GLU 102 Cb 1.23 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.82 3kfk h GLU 102 CO 0.12 0.75 -0.20 -0.07 -1.18 0.00 0.00 179.01 178.44 3kfk h LEU 103 N 0.02 0.00 0.00 1.64 3.38 -1.18 -1.09 115.31 118.09 3kfk h LEU 103 Ca -0.01 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.71 3kfk h LEU 103 Cb 1.29 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 3kfk h LEU 103 CO 0.10 0.20 -1.31 -0.07 0.09 0.00 0.00 178.44 177.45 3kfk h LEU 104 N 0.00 0.01 -0.19 1.67 3.38 -1.37 -3.01 115.31 115.79 3kfk h LEU 104 Ca -0.00 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 3kfk h LEU 104 Cb 0.59 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3kfk h LEU 104 CO 0.03 1.01 -0.54 -0.09 0.09 0.00 0.00 178.44 178.93 3kfk h ARG 105 N 0.00 0.71 0.00 1.13 2.43 -1.12 -2.56 114.38 114.97 3kfk h ARG 105 Ca -0.13 -0.50 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 3kfk h ARG 105 Cb 1.88 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.51 3kfk h ARG 105 CO 0.11 1.12 0.00 0.87 -1.51 0.00 0.00 179.97 180.56 3kfk h LYS 106 N 0.41 0.00 0.13 0.20 1.79 -1.34 -3.18 116.57 114.58 3kfk h LYS 106 Ca -0.01 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.22 3kfk h LYS 106 Cb 1.16 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.82 3kfk h LYS 106 CO 0.12 0.00 -1.14 0.00 -1.08 0.00 0.00 179.45 177.35 3kfk h ALA 107 N 2.31 0.04 0.00 3.86 0.00 -1.46 -3.33 119.26 120.69 3kfk h ALA 107 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 3kfk h ALA 107 Cb 0.62 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3kfk h ALA 107 CO 0.00 0.61 0.00 1.05 0.00 0.00 0.00 179.25 180.91 3kfk h GLU 108 N -0.33 0.00 -0.08 0.00 4.11 -1.50 -1.21 114.58 115.57 3kfk h GLU 108 Ca -0.23 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.09 3kfk h GLU 108 Cb 1.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.95 3kfk h GLU 108 CO 0.11 0.00 -0.46 0.93 0.07 0.00 0.00 179.01 179.65 3kfk h GLU 109 N 0.00 0.19 0.00 1.06 5.08 -1.68 -2.64 114.58 116.59 3kfk h GLU 109 Ca 0.00 -0.10 -0.21 0.00 -1.00 0.00 0.00 59.36 58.05 3kfk h GLU 109 Cb 0.52 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 3kfk h GLU 109 CO 0.00 0.62 -1.09 -0.07 -1.00 0.00 0.00 179.01 177.47 3kfk h LEU 110 N 0.16 0.00 -0.68 1.33 3.38 -1.40 -3.33 115.31 114.77 3kfk h LEU 110 Ca 0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 3kfk h LEU 110 Cb 0.88 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 3kfk h LEU 110 CO 0.07 0.92 -0.60 -0.07 0.09 0.00 0.00 178.44 178.84 3kfk h LEU 111 N 0.00 0.22 -0.99 1.67 3.38 -1.18 -2.44 115.31 115.97 3kfk h LEU 111 Ca -0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3kfk h LEU 111 Cb 1.76 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 3kfk h LEU 111 CO 0.11 0.77 -0.03 0.44 0.09 0.00 0.00 178.44 179.82 3kfk h ASP 112 N 0.14 0.00 -0.46 -0.43 5.19 -1.59 -2.87 116.42 116.40 3kfk h ASP 112 Ca -0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 3kfk h ASP 112 Cb 1.10 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.61 3kfk h ASP 112 CO 0.09 0.03 0.00 0.00 -3.12 0.00 0.00 179.24 176.24 3kfk n GLN 113 N -3.12 2.10 -2.14 3.56 6.02 -1.11 -4.94 117.38 117.76 3kfk n GLN 113 Ca 0.02 -1.71 -0.16 0.00 -0.01 0.00 0.00 57.00 55.13 3kfk n GLN 113 Cb 0.39 -1.38 -0.02 0.00 1.02 0.00 0.00 30.24 30.25 3kfk n GLN 113 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3kfk n ASN 114 N 0.90 -4.78 -4.63 1.08 3.02 -1.08 -4.99 115.26 104.77 3kfk n ASN 114 Ca 0.16 0.06 -0.42 0.00 -0.03 0.00 0.00 54.58 54.36 3kfk n ASN 114 Cb 0.41 -3.86 -0.04 0.00 -0.61 0.00 0.00 39.78 35.68 3kfk n ASN 114 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3kfk s VAL 115 N -2.75 4.73 0.29 2.41 1.01 -0.94 -5.01 120.40 120.14 3kfk s VAL 115 Ca 0.00 1.41 -0.29 0.00 0.00 0.00 0.00 61.98 63.10 3kfk s VAL 115 Cb 0.00 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 32.06 3kfk s VAL 115 CO 0.00 -0.28 1.41 -2.28 0.00 0.00 0.00 175.10 173.95 3kfk s HIS 116 N 3.12 2.96 0.44 5.22 2.46 -1.26 -4.40 115.29 123.84 3kfk s HIS 116 Ca 0.36 1.17 0.25 0.00 0.47 0.00 0.00 55.06 57.31 3kfk s HIS 116 Cb -0.14 -3.81 1.27 0.00 -0.13 0.00 0.00 32.58 29.77 3kfk s HIS 116 CO 0.12 -2.47 1.76 -1.35 -2.47 0.00 0.00 174.74 170.33 3kfk h PRO 117 N 4.22 0.24 0.00 2.88 0.11 -1.95 -0.52 132.00 136.98 3kfk h PRO 117 Ca -0.48 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3kfk h PRO 117 Cb 1.22 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3kfk h PRO 117 CO 0.72 0.16 -0.05 1.79 -0.21 0.00 0.00 178.00 180.41 3kfk h THR 118 N 0.24 0.09 0.00 -1.15 1.35 -1.91 0.16 112.91 111.70 3kfk h THR 118 Ca 0.62 -0.97 -0.21 0.00 -0.55 0.00 0.00 66.41 65.30 3kfk h THR 118 Cb 1.86 1.89 -0.03 0.00 -1.73 0.00 0.00 68.15 70.14 3kfk h THR 118 CO -0.23 0.05 -1.05 0.40 -0.25 0.00 0.00 175.52 174.43 3kfk h ILE 119 N 0.00 1.58 -0.16 6.82 1.08 -1.48 -2.62 117.51 122.73 3kfk h ILE 119 Ca -0.00 -3.29 -0.07 0.00 -0.39 0.00 0.00 64.86 61.11 3kfk h ILE 119 Cb 0.89 2.78 -0.00 0.00 -3.07 0.00 0.00 36.82 37.42 3kfk h ILE 119 CO 0.01 0.90 -0.18 0.58 -0.69 0.00 0.00 178.15 178.76 3kfk h VAL 120 N 0.00 1.35 0.00 1.67 2.07 -1.00 -2.83 116.25 117.51 3kfk h VAL 120 Ca -0.04 -1.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 3kfk h VAL 120 Cb 1.78 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 33.42 3kfk h VAL 120 CO 0.12 0.41 -0.01 1.62 0.02 0.00 0.00 177.57 179.73 3kfk h VAL 121 N 0.05 0.02 -0.08 2.57 3.04 -0.78 -1.02 116.25 120.04 3kfk h VAL 121 Ca 0.02 -0.51 -0.23 0.00 -1.01 0.00 0.00 66.70 64.97 3kfk h VAL 121 Cb 0.73 1.50 0.01 0.00 -2.01 0.00 0.00 31.29 31.52 3kfk h VAL 121 CO 0.04 0.01 -0.87 0.50 -1.01 0.00 0.00 177.57 176.24 3kfk h LYS 122 N 0.00 0.68 0.12 4.17 3.64 -1.39 -3.01 116.57 120.77 3kfk h LYS 122 Ca -0.00 -0.62 -0.30 0.00 -1.27 0.00 0.00 60.65 58.46 3kfk h LYS 122 Cb 0.50 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 3kfk h LYS 122 CO 0.00 1.23 -1.45 0.78 -2.27 0.00 0.00 179.45 177.74 3kfk h GLY 123 N 0.68 0.28 1.25 5.01 0.00 -1.26 -3.15 103.07 105.88 3kfk h GLY 123 Ca -0.08 -0.71 -0.06 0.00 0.00 0.00 0.00 47.33 46.48 3kfk h GLY 123 CO 0.17 0.62 0.14 -0.97 0.00 0.00 0.00 176.54 176.50 3kfk h TYR 124 N 0.07 0.97 -0.12 5.60 0.99 -1.30 -0.73 116.97 122.46 3kfk h TYR 124 Ca -0.21 -0.10 -0.20 0.00 2.00 0.00 0.00 58.73 60.21 3kfk h TYR 124 Cb 2.00 -0.28 0.01 0.00 1.00 0.00 0.00 36.73 39.46 3kfk h TYR 124 CO 0.06 0.81 -0.72 0.37 -0.00 0.00 0.00 178.16 178.68 3kfk h GLN 125 N 0.89 0.70 -0.13 4.88 4.15 -1.67 -2.64 115.11 121.30 3kfk h GLN 125 Ca 0.19 -0.59 -0.09 0.00 0.77 0.00 0.00 58.65 58.92 3kfk h GLN 125 Cb 0.33 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 3kfk h GLN 125 CO 0.00 1.20 -0.34 0.00 -1.93 0.00 0.00 178.83 177.77 3kfk h ALA 126 N 0.50 1.20 -0.04 3.38 0.00 -1.48 -0.85 119.26 121.97 3kfk h ALA 126 Ca -0.06 -0.36 -0.25 0.00 0.00 0.00 0.00 54.91 54.24 3kfk h ALA 126 Cb 1.36 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.08 3kfk h ALA 126 CO 0.15 0.53 -0.96 0.00 0.00 0.00 0.00 179.25 178.98 3kfk h ALA 127 N 1.43 0.23 0.00 0.00 0.00 -1.19 -2.73 119.26 117.00 3kfk h ALA 127 Ca 0.03 -0.67 -0.07 0.00 0.00 0.00 0.00 54.91 54.19 3kfk h ALA 127 Cb 0.71 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3kfk h ALA 127 CO 0.05 0.71 -0.34 0.00 0.00 0.00 0.00 179.25 179.67 3kfk h ALA 128 N 0.52 1.09 -0.03 0.00 0.00 -1.34 0.13 119.26 119.63 3kfk h ALA 128 Ca -0.10 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.35 3kfk h ALA 128 Cb 1.60 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 3kfk h ALA 128 CO 0.19 0.43 -0.66 0.37 0.00 0.00 0.00 179.25 179.57 3kfk h GLN 129 N 0.00 0.13 0.02 0.00 4.15 -1.14 -3.06 115.11 115.20 3kfk h GLN 129 Ca -0.00 -0.10 -0.27 0.00 0.77 0.00 0.00 58.65 59.05 3kfk h GLN 129 Cb 0.79 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.46 3kfk h GLN 129 CO 0.04 0.74 -1.49 -0.22 -1.93 0.00 0.00 178.83 175.98 3kfk h LYS 130 N 0.09 0.04 -0.17 1.69 1.63 -1.16 -3.34 116.57 115.35 3kfk h LYS 130 Ca -0.01 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 3kfk h LYS 130 Cb 1.19 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.83 3kfk h LYS 130 CO 0.10 0.74 -0.05 0.00 -3.45 0.00 0.00 179.45 176.79 3kfk h ALA 131 N 0.91 1.61 -0.03 5.00 0.00 -0.76 -1.50 119.26 124.50 3kfk h ALA 131 Ca -0.20 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 3kfk h ALA 131 Cb 1.94 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 3kfk h ALA 131 CO 0.10 0.29 -0.81 1.96 0.00 0.00 0.00 179.25 180.79 3kfk h GLN 132 N 0.24 0.27 0.00 0.00 1.08 -1.66 -2.47 115.11 112.57 3kfk h GLN 132 Ca 0.06 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 3kfk h GLN 132 Cb 0.25 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 3kfk h GLN 132 CO 0.01 0.94 -0.45 -0.85 -0.95 0.00 0.00 178.83 177.53 3kfk n GLU 133 N -3.74 0.08 -0.00 1.46 0.28 -1.06 -3.54 120.64 114.12 3kfk n GLU 133 Ca -0.04 0.03 -0.05 0.00 -0.16 0.00 0.00 57.16 56.94 3kfk n GLU 133 Cb 0.76 -1.55 -0.12 0.00 1.43 0.00 0.00 31.44 31.95 3kfk n GLU 133 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3kfk n LEU 134 N -1.68 0.80 0.19 -1.84 4.77 -0.59 -4.10 117.00 114.55 3kfk n LEU 134 Ca 0.05 0.37 0.05 0.00 -0.03 0.00 0.00 56.01 56.45 3kfk n LEU 134 Cb 0.37 0.15 0.35 0.00 -2.33 0.00 0.00 43.42 41.95 3kfk n LEU 134 CO 0.34 0.29 0.69 -0.07 -1.33 0.00 0.00 177.39 177.30 3kfk h LEU 135 N 0.00 0.00 -0.83 2.23 3.38 -1.51 -3.11 115.31 115.46 3kfk h LEU 135 Ca -0.25 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.60 3kfk h LEU 135 Cb 1.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.57 3kfk h LEU 135 CO 0.06 0.39 -0.46 0.11 0.09 0.00 0.00 178.44 178.64 3kfk h LYS 136 N 0.00 0.29 0.02 1.13 1.57 -1.71 -2.37 116.57 115.50 3kfk h LYS 136 Ca -0.00 -0.15 -0.21 0.00 -1.87 0.00 0.00 60.65 58.42 3kfk h LYS 136 Cb 0.83 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 3kfk h LYS 136 CO 0.05 0.69 -0.93 1.79 -0.57 0.00 0.00 179.45 180.48 3kfk h THR 137 N 0.24 1.55 -0.01 -0.16 1.35 -1.71 -3.27 112.91 110.90 3kfk h THR 137 Ca 0.02 -2.83 0.00 0.00 -0.55 0.00 0.00 66.41 63.04 3kfk h THR 137 Cb 0.90 2.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.91 3kfk h THR 137 CO 0.07 0.82 -0.33 2.30 -0.25 0.00 0.00 175.52 178.14 3kfk n ILE 138 N -3.58 0.00 -2.67 6.82 -5.35 -1.18 -4.90 119.36 108.49 3kfk n ILE 138 Ca -0.03 -0.10 -0.40 0.00 -0.27 0.00 0.00 62.75 61.94 3kfk n ILE 138 Cb 0.85 0.40 -0.05 0.00 -1.74 0.00 0.00 39.64 39.10 3kfk n ILE 138 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kfk s ALA 139 N -2.61 3.34 0.05 -1.28 0.00 -0.90 -4.90 121.76 115.46 3kfk s ALA 139 Ca 0.21 0.69 -0.14 0.00 0.00 0.00 0.00 51.96 52.71 3kfk s ALA 139 Cb 0.19 -3.26 -0.06 0.00 0.00 0.00 0.00 23.12 19.99 3kfk s ALA 139 CO 0.56 0.05 0.46 0.00 0.00 0.00 0.00 175.76 176.83 3kfk s GLU 141 N -1.41 4.21 -0.76 0.00 0.41 -1.26 -1.01 118.70 118.89 3kfk s GLU 141 Ca 0.29 0.48 0.03 0.00 -0.41 0.00 0.00 54.97 55.36 3kfk s GLU 141 Cb -0.16 -3.56 0.19 0.00 -1.78 0.00 0.00 34.13 28.82 3kfk s GLU 141 CO 0.16 -0.15 0.61 0.28 -0.49 0.00 0.00 175.26 175.67 3kfk n VAL 142 N 4.53 2.13 0.00 2.63 0.31 0.39 -4.98 118.33 123.33 3kfk n VAL 142 Ca -0.04 -4.99 0.00 0.00 -0.01 0.00 0.00 64.34 59.30 3kfk n VAL 142 Cb 0.50 -2.22 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 3kfk n VAL 142 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kfk n GLY 143 N 1.90 0.00 0.50 2.92 0.00 -1.26 -4.55 105.19 104.70 3kfk n GLY 143 Ca 0.22 0.00 0.30 0.00 0.00 0.00 0.00 46.02 46.54 3kfk n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk h ALA 144 N 0.00 2.83 -0.14 4.61 0.00 -1.87 0.67 119.26 125.35 3kfk h ALA 144 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3kfk h ALA 144 Cb 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3kfk h ALA 144 CO 0.00 -1.32 -0.17 1.04 0.00 0.00 0.00 179.25 178.80 3kfk n GLN 145 N -3.86 1.80 -2.57 0.00 6.02 -1.26 -4.67 117.38 112.83 3kfk n GLN 145 Ca 0.20 -3.01 -0.42 0.00 -0.01 0.00 0.00 57.00 53.76 3kfk n GLN 145 Cb 1.14 -1.68 -0.02 0.00 1.02 0.00 0.00 30.24 30.71 3kfk n GLN 145 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3kfk s ASP 146 N -2.74 6.67 0.46 1.08 3.68 0.23 -4.85 116.67 121.20 3kfk s ASP 146 Ca 0.39 -1.94 0.18 0.00 2.13 0.00 0.00 52.55 53.30 3kfk s ASP 146 Cb 0.35 -2.57 1.09 0.00 -1.45 0.00 0.00 42.92 40.33 3kfk s ASP 146 CO 0.00 -1.34 1.99 0.11 0.13 0.00 0.00 175.17 176.06 3kfk h LYS 147 N 8.71 0.00 -0.04 4.34 1.57 -1.91 -1.49 116.57 127.76 3kfk h LYS 147 Ca 0.32 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.99 3kfk h LYS 147 Cb 0.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 3kfk h LYS 147 CO 1.44 0.19 -0.51 1.05 -0.57 0.00 0.00 179.45 181.05 3kfk h GLU 148 N 0.00 0.10 0.15 3.15 4.11 -1.99 -1.53 114.58 118.57 3kfk h GLU 148 Ca -0.00 -0.05 -0.33 0.00 0.07 0.00 0.00 59.36 59.05 3kfk h GLU 148 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3kfk h GLU 148 CO 0.02 0.59 -1.62 0.82 0.07 0.00 0.00 179.01 178.89 3kfk h ILE 149 N 0.08 1.07 -0.19 -1.06 2.04 -1.86 -3.25 117.51 114.34 3kfk h ILE 149 Ca -0.00 -2.67 -0.01 0.00 1.00 0.00 0.00 64.86 63.17 3kfk h ILE 149 Cb 0.93 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.77 3kfk h ILE 149 CO 0.07 0.83 0.06 -0.07 0.00 0.00 0.00 178.15 179.04 3kfk h LEU 150 N 0.09 0.23 -0.55 1.44 3.38 -1.23 -0.13 115.31 118.53 3kfk h LEU 150 Ca -0.29 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.54 3kfk h LEU 150 Cb 2.06 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.74 3kfk h LEU 150 CO 0.17 0.22 -0.23 0.74 0.09 0.00 0.00 178.44 179.44 3kfk h THR 151 N 0.26 1.27 -0.45 0.22 2.02 -1.39 -1.73 112.91 113.11 3kfk h THR 151 Ca 0.07 -1.38 -0.12 0.00 0.77 0.00 0.00 66.41 65.74 3kfk h THR 151 Cb 0.08 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 3kfk h THR 151 CO -0.01 0.47 -0.18 0.11 0.37 0.00 0.00 175.52 176.28 3kfk h LYS 152 N 0.80 0.88 -0.55 6.66 1.57 -1.31 0.13 116.57 124.76 3kfk h LYS 152 Ca 0.10 -0.35 -0.07 0.00 -1.87 0.00 0.00 60.65 58.47 3kfk h LYS 152 Cb 0.79 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 3kfk h LYS 152 CO 0.07 0.99 0.07 0.82 -0.57 0.00 0.00 179.45 180.83 3kfk h ILE 153 N 0.78 1.26 -0.45 1.86 2.04 -1.01 -0.16 117.51 121.81 3kfk h ILE 153 Ca 0.11 -0.99 -0.11 0.00 1.00 0.00 0.00 64.86 64.87 3kfk h ILE 153 Cb 0.72 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 3kfk h ILE 153 CO 0.06 0.36 -0.17 0.00 0.00 0.00 0.00 178.15 178.39 3kfk h ALA 154 N 0.99 0.85 -0.61 1.87 0.00 -1.19 -2.62 119.26 118.55 3kfk h ALA 154 Ca 0.16 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3kfk h ALA 154 Cb 0.43 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3kfk h ALA 154 CO 0.01 0.64 0.11 1.98 0.00 0.00 0.00 179.25 182.00 3kfk h MET 155 N 0.77 0.98 0.00 0.00 -1.53 -0.50 -2.21 114.93 112.44 3kfk h MET 155 Ca 0.11 -0.24 -0.08 0.00 -3.44 0.00 0.00 59.70 56.06 3kfk h MET 155 Cb 0.70 -0.13 -0.01 0.00 -0.55 0.00 0.00 31.60 31.61 3kfk h MET 155 CO 0.05 0.90 -0.37 1.15 0.14 0.00 0.00 176.91 178.78 3kfk h THR 156 N 0.93 1.11 0.00 -0.77 2.02 -0.94 -1.85 112.91 113.42 3kfk h THR 156 Ca 0.19 -1.35 -0.26 0.00 0.77 0.00 0.00 66.41 65.76 3kfk h THR 156 Cb 0.39 1.76 0.02 0.00 -1.74 0.00 0.00 68.15 68.58 3kfk h THR 156 CO 0.01 0.37 -1.04 -1.28 0.37 0.00 0.00 175.52 173.95 3kfk h SER 157 N 0.00 0.90 -0.41 4.18 0.87 -1.08 -3.26 113.55 114.75 3kfk h SER 157 Ca -0.00 -0.74 -0.13 0.00 -1.23 0.00 0.00 61.79 59.68 3kfk h SER 157 Cb 0.73 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 3kfk h SER 157 CO 0.05 1.53 -0.25 0.40 -0.53 0.00 0.00 176.83 178.03 3kfk h ILE 158 N 0.37 1.27 -3.90 2.23 2.04 -1.35 -3.43 117.51 114.75 3kfk h ILE 158 Ca -0.13 -1.40 -0.52 0.00 1.00 0.00 0.00 64.86 63.80 3kfk h ILE 158 Cb 1.69 1.19 0.06 0.00 -0.74 0.00 0.00 36.82 39.02 3kfk h ILE 158 CO 0.20 0.48 0.61 -0.89 0.00 0.00 0.00 178.15 178.55 3kfk s THR 159 N -4.61 2.79 0.00 -0.27 2.01 -0.70 -2.91 115.64 111.95 3kfk s THR 159 Ca -0.11 0.76 0.00 0.00 0.31 0.00 0.00 61.69 62.66 3kfk s THR 159 Cb 0.12 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 69.16 3kfk s THR 159 CO 0.86 0.16 0.00 0.61 -0.69 0.00 0.00 174.62 175.56 3kfk n GLY 160 N 0.78 2.57 0.08 4.40 0.00 -1.26 -4.78 105.19 106.98 3kfk n GLY 160 Ca 0.01 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.44 3kfk n GLY 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kfk n LYS 161 N 0.00 0.58 0.00 1.61 5.02 -1.15 -4.74 118.16 119.48 3kfk n LYS 161 Ca 0.00 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 3kfk n LYS 161 Cb 0.00 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.27 3kfk n LYS 161 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kfk n GLY 162 N 1.22 2.99 0.15 0.72 0.00 -1.22 -4.95 105.19 104.10 3kfk n GLY 162 Ca -0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 3kfk n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk h ALA 163 N 0.00 0.72 0.00 4.61 0.00 -1.92 -2.72 119.26 119.95 3kfk h ALA 163 Ca 0.00 -0.61 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 3kfk h ALA 163 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3kfk h ALA 163 CO 0.00 0.80 -0.34 1.05 0.00 0.00 0.00 179.25 180.76 3kfk h GLU 164 N 0.15 0.00 -0.03 0.00 9.09 -1.97 -2.66 114.58 119.17 3kfk h GLU 164 Ca -0.02 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.23 3kfk h GLU 164 Cb 1.26 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.35 3kfk h GLU 164 CO 0.11 0.34 -0.69 0.87 0.05 0.00 0.00 179.01 179.70 3kfk h LYS 165 N 0.00 0.13 -5.89 1.06 1.57 -1.88 -3.40 116.57 108.16 3kfk h LYS 165 Ca -0.00 -0.11 -0.62 0.00 -1.87 0.00 0.00 60.65 58.05 3kfk h LYS 165 Cb 0.88 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.10 3kfk h LYS 165 CO 0.04 0.77 1.38 0.00 -0.57 0.00 0.00 179.45 181.07 3kfk s ALA 166 N -3.54 2.85 0.03 3.86 0.00 -1.00 -4.97 121.76 118.99 3kfk s ALA 166 Ca -0.03 -2.37 0.07 0.00 0.00 0.00 0.00 51.96 49.63 3kfk s ALA 166 Cb 0.12 -4.44 -0.03 0.00 0.00 0.00 0.00 23.12 18.77 3kfk s ALA 166 CO 0.79 -3.49 -0.18 0.21 0.00 0.00 0.00 175.76 173.10 3kfk s LYS 167 N 4.51 2.11 0.30 0.00 2.20 -1.26 -4.95 119.74 122.65 3kfk s LYS 167 Ca 0.44 -0.95 0.05 0.00 -0.36 0.00 0.00 55.97 55.14 3kfk s LYS 167 Cb -0.01 -2.21 0.76 0.00 -1.51 0.00 0.00 37.83 34.86 3kfk s LYS 167 CO -0.10 0.55 1.72 0.93 -0.36 0.00 0.00 175.35 178.09 3kfk h GLU 168 N 4.61 0.50 0.00 4.03 4.39 -1.99 -2.14 114.58 123.99 3kfk h GLU 168 Ca -0.47 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.09 3kfk h GLU 168 Cb 1.15 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.68 3kfk h GLU 168 CO 0.48 0.33 -0.50 0.87 -1.16 0.00 0.00 179.01 179.03 3kfk h LYS 169 N 0.52 0.00 -0.33 2.33 1.57 -1.99 -3.26 116.57 115.41 3kfk h LYS 169 Ca 0.58 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.23 3kfk h LYS 169 Cb 1.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 3kfk h LYS 169 CO -0.48 0.50 -0.29 1.25 -0.57 0.00 0.00 179.45 179.86 3kfk h LEU 170 N 0.00 0.83 -1.10 2.94 5.85 -1.76 -3.16 115.31 118.91 3kfk h LEU 170 Ca -0.01 -0.46 -0.09 0.00 0.84 0.00 0.00 57.88 58.17 3kfk h LEU 170 Cb 1.03 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 3kfk h LEU 170 CO 0.07 1.12 -0.42 0.00 -0.34 0.00 0.00 178.44 178.86 3kfk h ALA 171 N 0.74 1.18 0.00 1.25 0.00 -1.60 -2.86 119.26 117.97 3kfk h ALA 171 Ca 0.06 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 3kfk h ALA 171 Cb 0.87 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3kfk h ALA 171 CO 0.07 0.53 -0.50 0.93 0.00 0.00 0.00 179.25 180.29 3kfk h GLU 172 N 0.00 0.00 -0.09 0.00 5.08 -1.59 -3.16 114.58 114.82 3kfk h GLU 172 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 3kfk h GLU 172 Cb 0.81 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.07 3kfk h GLU 172 CO 0.06 0.50 -0.64 0.82 -1.00 0.00 0.00 179.01 178.74 3kfk h ILE 173 N 0.00 1.34 -0.53 3.13 2.04 -1.47 -3.31 117.51 118.71 3kfk h ILE 173 Ca -0.00 -1.94 -0.06 0.00 1.00 0.00 0.00 64.86 63.86 3kfk h ILE 173 Cb 0.94 2.21 -0.02 0.00 -0.74 0.00 0.00 36.82 39.20 3kfk h ILE 173 CO 0.06 0.59 0.11 0.40 0.00 0.00 0.00 178.15 179.32 3kfk h ILE 174 N 0.23 1.25 -0.76 -0.67 2.04 -1.54 -3.06 117.51 115.00 3kfk h ILE 174 Ca -0.05 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3kfk h ILE 174 Cb 1.30 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 3kfk h ILE 174 CO 0.13 0.33 0.41 0.58 0.00 0.00 0.00 178.15 179.60 3kfk h VAL 175 N 0.75 1.23 -0.11 1.67 2.07 -1.68 -2.50 116.25 117.69 3kfk h VAL 175 Ca 0.16 -0.58 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 3kfk h VAL 175 Cb 0.37 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3kfk h VAL 175 CO 0.01 0.26 -0.20 -0.08 0.02 0.00 0.00 177.57 177.57 3kfk h GLU 176 N 1.06 0.18 -0.02 1.57 4.81 -1.62 -2.38 114.58 118.18 3kfk h GLU 176 Ca 0.27 -0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 59.25 3kfk h GLU 176 Cb 0.04 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.41 3kfk h GLU 176 CO -0.04 0.38 -0.77 0.00 -0.73 0.00 0.00 179.01 177.86 3kfk h ALA 177 N 1.63 0.12 -0.18 2.92 0.00 -1.43 -3.21 119.26 119.11 3kfk h ALA 177 Ca 0.03 -0.61 -0.19 0.00 0.00 0.00 0.00 54.91 54.14 3kfk h ALA 177 Cb 0.46 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3kfk h ALA 177 CO 0.03 0.50 -0.66 0.28 0.00 0.00 0.00 179.25 179.40 3kfk h VAL 178 N 0.15 1.31 0.00 0.00 2.07 -1.42 -2.95 116.25 115.41 3kfk h VAL 178 Ca -0.09 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.52 3kfk h VAL 178 Cb 1.44 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.09 3kfk h VAL 178 CO 0.15 0.60 0.00 0.28 0.02 0.00 0.00 177.57 178.62 3kfk h SER 179 N 0.48 0.00 0.50 0.57 0.02 -1.55 -3.10 113.55 110.47 3kfk h SER 179 Ca -0.02 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.64 3kfk h SER 179 Cb 1.25 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.75 3kfk h SER 179 CO 0.13 0.00 -1.62 0.00 -1.14 0.00 0.00 176.83 174.20 3kfk h ALA 180 N 2.03 0.56 -0.11 3.77 0.00 -1.53 -3.35 119.26 120.64 3kfk h ALA 180 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.60 3kfk h ALA 180 Cb 0.46 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3kfk h ALA 180 CO 0.00 1.41 0.00 1.33 0.00 0.00 0.00 179.25 181.99 3kfk n VAL 181 N -3.24 0.14 -2.36 0.00 0.24 -1.13 -4.55 118.33 107.43 3kfk n VAL 181 Ca -0.17 -0.18 -0.43 0.00 -2.04 0.00 0.00 64.34 61.52 3kfk n VAL 181 Cb 1.03 0.05 -0.02 0.00 -1.47 0.00 0.00 33.84 33.43 3kfk n VAL 181 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3kfk s VAL 182 N -1.86 4.09 -0.58 3.34 1.01 -1.24 -4.46 120.40 120.70 3kfk s VAL 182 Ca 0.23 1.25 -0.26 0.00 0.00 0.00 0.00 61.98 63.20 3kfk s VAL 182 Cb 0.11 -4.03 0.04 0.00 0.00 0.00 0.00 36.38 32.50 3kfk s VAL 182 CO 0.18 -0.36 1.09 1.51 0.00 0.00 0.00 175.10 177.52 3kfk s ASP 183 N 2.84 6.38 -0.02 3.32 -4.77 -1.17 -4.99 116.67 118.26 3kfk s ASP 183 Ca 0.59 -0.14 -0.30 0.00 -3.30 0.00 0.00 52.55 49.40 3kfk s ASP 183 Cb -0.19 -2.50 -0.05 0.00 -1.09 0.00 0.00 42.92 39.09 3kfk s ASP 183 CO 0.22 -1.40 1.34 -1.81 0.70 0.00 0.00 175.17 174.23 3kfk s ASP 184 N 2.97 6.91 -0.05 2.11 1.01 -1.26 -3.11 116.67 125.25 3kfk s ASP 184 Ca 0.37 2.01 0.04 0.00 0.71 0.00 0.00 52.55 55.68 3kfk s ASP 184 Cb -0.10 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.27 3kfk s ASP 184 CO 0.22 -0.69 -0.17 -1.61 0.21 0.00 0.00 175.17 173.13 3kfk s GLU 185 N 2.43 1.85 -0.24 8.23 2.02 -1.26 -5.06 118.70 126.68 3kfk s GLU 185 Ca 0.61 -0.61 0.09 0.00 0.02 0.00 0.00 54.97 55.09 3kfk s GLU 185 Cb -0.29 -1.58 0.28 0.00 0.10 0.00 0.00 34.13 32.64 3kfk s GLU 185 CO 0.25 0.22 1.24 0.41 0.02 0.00 0.00 175.26 177.40 3kfk n GLY 186 N 3.23 1.18 3.90 -1.39 0.00 -1.18 -5.17 105.19 105.77 3kfk n GLY 186 Ca -0.19 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 3kfk n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kfk s LYS 187 N 0.09 2.39 -0.19 1.61 -0.14 -1.23 -4.68 119.74 117.59 3kfk s LYS 187 Ca 0.06 0.14 -0.00 0.00 -1.36 0.00 0.00 55.97 54.80 3kfk s LYS 187 Cb 0.31 -2.05 0.01 0.00 -1.68 0.00 0.00 37.83 34.42 3kfk s LYS 187 CO -0.09 -1.25 -0.15 0.08 -0.76 0.00 0.00 175.35 173.17 3kfk s VAL 188 N -3.38 2.46 -0.28 3.17 1.01 -1.26 -3.04 120.40 119.08 3kfk s VAL 188 Ca 0.59 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 3kfk s VAL 188 Cb -0.11 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3kfk s VAL 188 CO 0.49 0.50 0.33 -0.62 0.00 0.00 0.00 175.10 175.79 3kfk s ASP 189 N 1.35 6.18 0.49 3.32 3.68 -1.26 -4.97 116.67 125.46 3kfk s ASP 189 Ca 0.05 0.15 0.28 0.00 2.13 0.00 0.00 52.55 55.17 3kfk s ASP 189 Cb -0.13 -2.19 0.90 0.00 -1.45 0.00 0.00 42.92 40.05 3kfk s ASP 189 CO -0.10 -0.17 1.81 0.11 0.13 0.00 0.00 175.17 176.95 3kfk h LYS 190 N 8.26 0.00 0.00 4.34 6.56 -1.97 -3.11 116.57 130.64 3kfk h LYS 190 Ca -0.32 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 3kfk h LYS 190 Cb 1.17 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 3kfk h LYS 190 CO 0.63 0.03 0.00 -0.44 -2.06 0.00 0.00 179.45 177.61 3kfk h ASP 191 N 0.00 0.00 0.97 0.86 3.32 -2.02 -3.18 116.42 116.37 3kfk h ASP 191 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3kfk h ASP 191 Cb 0.74 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 3kfk h ASP 191 CO 0.00 0.00 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.34 3kfk h LEU 192 N 0.00 0.00 -8.80 1.55 3.38 -1.89 -3.41 115.31 106.14 3kfk h LEU 192 Ca 0.00 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.33 3kfk h LEU 192 Cb 0.65 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.26 3kfk h LEU 192 CO 0.00 0.12 0.01 -0.63 0.09 0.00 0.00 178.44 178.02 3kfk s ILE 193 N -3.67 4.99 0.01 1.22 1.01 -1.20 -2.36 121.20 121.20 3kfk s ILE 193 Ca 0.01 0.49 -0.21 0.00 0.00 0.00 0.00 60.65 60.93 3kfk s ILE 193 Cb 0.10 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 3kfk s ILE 193 CO 0.59 -0.20 0.63 -0.54 0.00 0.00 0.00 174.94 175.43 3kfk s LYS 194 N 2.46 4.35 -0.21 2.79 -0.14 0.16 -4.95 119.74 124.21 3kfk s LYS 194 Ca 0.21 0.81 -0.05 0.00 -1.36 0.00 0.00 55.97 55.57 3kfk s LYS 194 Cb -0.15 -3.34 -0.02 0.00 -1.68 0.00 0.00 37.83 32.64 3kfk s LYS 194 CO 0.13 0.37 -0.00 0.42 -0.76 0.00 0.00 175.35 175.50 3kfk s ILE 195 N -0.22 3.86 -0.10 2.17 1.01 -1.26 0.39 121.20 127.04 3kfk s ILE 195 Ca 0.33 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.66 3kfk s ILE 195 Cb -0.19 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.52 3kfk s ILE 195 CO 0.19 0.42 -0.18 -0.70 0.00 0.00 0.00 174.94 174.66 3kfk s GLU 196 N 1.15 3.10 -0.43 2.79 2.56 -0.56 -4.97 118.70 122.34 3kfk s GLU 196 Ca 0.03 -0.78 -0.07 0.00 0.00 0.00 0.00 54.97 54.15 3kfk s GLU 196 Cb -0.14 -2.45 0.11 0.00 2.00 0.00 0.00 34.13 33.64 3kfk s GLU 196 CO 0.01 0.26 0.27 0.15 -0.56 0.00 0.00 175.26 175.39 3kfk s LYS 197 N 0.19 2.34 0.11 4.30 1.02 -1.26 -1.48 119.74 124.96 3kfk s LYS 197 Ca -0.11 -1.71 0.05 0.00 0.02 0.00 0.00 55.97 54.23 3kfk s LYS 197 Cb -0.16 -3.76 -0.04 0.00 -0.52 0.00 0.00 37.83 33.36 3kfk s LYS 197 CO 0.06 -1.09 -0.13 0.15 -0.92 0.00 0.00 175.35 173.43 3kfk s LYS 198 N 1.30 0.93 0.00 1.68 -0.14 -1.10 -5.06 119.74 117.35 3kfk s LYS 198 Ca 0.06 -1.17 0.00 0.00 -1.36 0.00 0.00 55.97 53.50 3kfk s LYS 198 Cb -0.24 -0.78 0.00 0.00 -1.68 0.00 0.00 37.83 35.13 3kfk s LYS 198 CO -0.01 0.15 0.00 -1.13 -0.76 0.00 0.00 175.35 173.59 3kfk n SER 199 N 0.67 0.00 0.00 2.83 3.41 -1.26 -3.27 113.62 116.00 3kfk n SER 199 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 3kfk n SER 199 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 3kfk n SER 199 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kfk n GLY 200 N 5.00 2.19 3.55 5.00 0.00 -1.16 -4.50 105.19 115.28 3kfk n GLY 200 Ca 0.00 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.06 3kfk n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk s ALA 201 N -1.61 1.33 0.00 4.61 0.00 -1.26 -3.72 121.76 121.11 3kfk s ALA 201 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3kfk s ALA 201 Cb 0.00 -4.42 0.00 0.00 0.00 0.00 0.00 23.12 18.70 3kfk s ALA 201 CO 0.00 -4.94 0.00 0.45 0.00 0.00 0.00 175.76 171.27 3kfk n SER 202 N 16.80 0.00 0.00 0.00 2.88 -1.26 -4.74 113.62 127.30 3kfk n SER 202 Ca 0.40 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.94 3kfk n SER 202 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 3kfk n SER 202 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3kfk n ILE 203 N 0.00 0.00 -0.00 2.46 5.41 -0.99 -4.03 119.36 122.22 3kfk n ILE 203 Ca 0.00 0.00 0.04 0.00 1.00 0.00 0.00 62.75 63.79 3kfk n ILE 203 Cb 0.00 0.00 -0.12 0.00 -0.71 0.00 0.00 39.64 38.81 3kfk n ILE 203 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3kfk n ASP 204 N 0.94 0.33 -0.13 4.38 9.92 -1.26 -4.23 116.55 126.50 3kfk n ASP 204 Ca 0.00 0.14 0.05 0.00 -0.53 0.00 0.00 54.79 54.45 3kfk n ASP 204 Cb 0.00 1.14 0.25 0.00 -0.64 0.00 0.00 41.12 41.87 3kfk n ASP 204 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3kfk n ASP 205 N -2.57 0.39 -4.66 -2.24 9.92 -1.26 -4.85 116.55 111.30 3kfk n ASP 205 Ca -0.10 -1.76 -0.42 0.00 -0.53 0.00 0.00 54.79 51.97 3kfk n ASP 205 Cb 0.74 -0.04 -0.03 0.00 -0.64 0.00 0.00 41.12 41.16 3kfk n ASP 205 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3kfk s THR 206 N -1.92 3.45 0.09 -3.53 -4.23 -1.26 -4.95 115.64 103.28 3kfk s THR 206 Ca 0.16 0.54 0.09 0.00 -1.18 0.00 0.00 61.69 61.30 3kfk s THR 206 Cb 0.08 -3.36 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 3kfk s THR 206 CO 0.12 -0.06 -0.19 -1.83 -0.54 0.00 0.00 174.62 172.12 3kfk s GLU 207 N 4.20 1.84 -0.30 3.99 -1.05 -1.25 -5.06 118.70 121.07 3kfk s GLU 207 Ca 0.77 -1.13 -0.25 0.00 -0.15 0.00 0.00 54.97 54.22 3kfk s GLU 207 Cb -0.35 -2.11 0.00 0.00 -0.44 0.00 0.00 34.13 31.23 3kfk s GLU 207 CO 0.32 0.50 0.85 -1.17 0.95 0.00 0.00 175.26 176.71 3kfk s LEU 208 N -1.86 4.06 0.29 1.83 2.96 -1.26 -3.50 118.68 121.21 3kfk s LEU 208 Ca 0.16 0.78 0.11 0.00 -0.22 0.00 0.00 54.13 54.95 3kfk s LEU 208 Cb -0.10 -3.18 -0.05 0.00 0.50 0.00 0.00 46.19 43.36 3kfk s LEU 208 CO 0.08 -0.65 -0.10 -0.63 -1.32 0.00 0.00 176.35 173.72 3kfk s ILE 209 N 3.07 2.75 -0.51 6.68 -1.09 -0.52 -5.03 121.20 126.56 3kfk s ILE 209 Ca 0.35 -2.18 0.05 0.00 -2.23 0.00 0.00 60.65 56.63 3kfk s ILE 209 Cb -0.14 -2.56 0.08 0.00 -1.58 0.00 0.00 42.46 38.26 3kfk s ILE 209 CO 0.12 -0.34 0.85 0.29 -1.23 0.00 0.00 174.94 174.63 3kfk n LYS 210 N -0.77 1.11 -3.84 2.79 4.01 -1.26 -2.46 118.16 117.74 3kfk n LYS 210 Ca -0.05 -1.20 -0.12 0.00 -0.51 0.00 0.00 58.31 56.42 3kfk n LYS 210 Cb 0.60 -1.10 -0.13 0.00 -0.51 0.00 0.00 35.03 33.89 3kfk n LYS 210 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3kfk s GLY 211 N -0.66 -0.06 0.32 0.72 0.00 -1.25 -2.53 107.32 103.86 3kfk s GLY 211 Ca 0.07 0.22 -0.27 0.00 0.00 0.00 0.00 44.72 44.74 3kfk s GLY 211 CO 0.06 0.18 1.05 -0.62 0.00 0.00 0.00 173.10 173.78 3kfk n VAL 212 N 2.95 2.05 -3.65 1.40 0.31 -1.26 -4.66 118.33 115.46 3kfk n VAL 212 Ca -0.13 -0.50 -0.39 0.00 -0.01 0.00 0.00 64.34 63.31 3kfk n VAL 212 Cb 0.59 -1.12 -0.10 0.00 -0.91 0.00 0.00 33.84 32.31 3kfk n VAL 212 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3kfk s LEU 213 N 0.08 5.40 -0.13 7.52 2.96 -1.26 -3.36 118.68 129.89 3kfk s LEU 213 Ca 0.59 -1.88 -0.24 0.00 -0.22 0.00 0.00 54.13 52.37 3kfk s LEU 213 Cb -0.66 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.08 3kfk s LEU 213 CO 0.60 -0.60 0.78 -0.69 -1.32 0.00 0.00 176.35 175.11 3kfk s VAL 214 N 1.28 4.95 -1.49 1.68 1.01 -1.08 -4.97 120.40 121.79 3kfk s VAL 214 Ca 0.06 1.55 -0.13 0.00 0.00 0.00 0.00 61.98 63.45 3kfk s VAL 214 Cb -0.24 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.06 3kfk s VAL 214 CO -0.02 0.11 2.36 -0.67 0.00 0.00 0.00 175.10 176.88 3kfk n ASP 215 N 4.69 4.78 -3.13 3.32 2.03 -1.26 -2.20 116.55 124.78 3kfk n ASP 215 Ca 0.02 -2.80 -0.10 0.00 0.52 0.00 0.00 54.79 52.43 3kfk n ASP 215 Cb 0.50 -1.64 -0.00 0.00 -0.72 0.00 0.00 41.12 39.26 3kfk n ASP 215 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3kfk s LYS 216 N 2.97 2.09 0.00 -0.67 2.20 -1.26 -5.01 119.74 120.05 3kfk s LYS 216 Ca 0.51 -1.48 0.00 0.00 -0.36 0.00 0.00 55.97 54.64 3kfk s LYS 216 Cb 0.15 0.57 0.00 0.00 -1.51 0.00 0.00 37.83 37.04 3kfk s LYS 216 CO -0.08 -0.95 0.00 0.39 -0.36 0.00 0.00 175.35 174.35 3kfk n GLU 217 N -0.53 3.25 -3.35 4.03 1.02 -1.26 -3.15 120.64 120.65 3kfk n GLU 217 Ca -0.05 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.72 3kfk n GLU 217 Cb 0.60 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.96 3kfk n GLU 217 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3kfk s ARG 218 N 0.57 4.05 0.40 3.49 1.70 -1.26 -4.63 118.95 123.28 3kfk s ARG 218 Ca 0.00 0.57 0.18 0.00 -0.47 0.00 0.00 55.73 56.01 3kfk s ARG 218 Cb 0.00 -3.09 0.86 0.00 -0.57 0.00 0.00 34.95 32.15 3kfk s ARG 218 CO 0.00 0.57 1.84 -0.24 -1.08 0.00 0.00 175.30 176.39 3kfk h VAL 219 N 3.21 0.96 -3.87 4.99 3.04 -1.48 -3.43 116.25 119.67 3kfk h VAL 219 Ca -0.49 -1.22 -0.33 0.00 -1.01 0.00 0.00 66.70 63.64 3kfk h VAL 219 Cb 1.20 1.71 -0.29 0.00 -2.01 0.00 0.00 31.29 31.91 3kfk h VAL 219 CO 0.64 0.31 -0.75 -0.55 -1.01 0.00 0.00 177.57 176.21 3kfk s SER 220 N -6.56 0.62 0.00 3.17 0.15 -1.26 -5.02 113.70 104.80 3kfk s SER 220 Ca -0.02 -0.09 0.17 0.00 0.70 0.00 0.00 55.95 56.71 3kfk s SER 220 Cb 0.13 -0.09 0.80 0.00 -1.71 0.00 0.00 66.02 65.14 3kfk s SER 220 CO 0.68 0.05 1.53 0.00 1.20 0.00 0.00 173.24 176.70 3kfk n ALA 221 N 3.06 1.86 0.20 5.45 0.00 -1.26 -2.47 120.51 127.34 3kfk n ALA 221 Ca -0.14 -0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.32 3kfk n ALA 221 Cb 0.57 -1.28 0.15 0.00 0.00 0.00 0.00 19.45 18.89 3kfk n ALA 221 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3kfk h GLN 222 N 0.00 0.00 -7.05 0.00 4.15 -1.96 -3.47 115.11 106.78 3kfk h GLN 222 Ca 0.00 0.00 -0.45 0.00 0.77 0.00 0.00 58.65 58.97 3kfk h GLN 222 Cb 0.23 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 3kfk h GLN 222 CO 0.00 0.14 0.35 -1.64 -1.93 0.00 0.00 178.83 175.75 3kfk s MET 223 N -3.16 4.16 0.49 1.69 -1.94 -1.03 -5.00 119.30 114.51 3kfk s MET 223 Ca 0.06 1.18 -0.23 0.00 -1.71 0.00 0.00 55.69 54.99 3kfk s MET 223 Cb 0.06 -2.19 -0.08 0.00 2.01 0.00 0.00 34.83 34.62 3kfk s MET 223 CO 0.69 -0.10 1.13 -2.30 -0.01 0.00 0.00 175.02 174.43 3kfk n PRO 224 N -0.65 1.46 0.14 2.03 -0.02 -1.26 -4.94 135.00 131.76 3kfk n PRO 224 Ca 0.07 0.53 0.07 0.00 -2.02 0.00 0.00 63.50 62.15 3kfk n PRO 224 Cb 0.53 -2.26 0.04 0.00 -0.02 0.00 0.00 33.50 31.80 3kfk n PRO 224 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3kfk h LYS 225 N 1.42 0.00 -3.45 -0.52 1.57 -1.96 -3.46 116.57 110.17 3kfk h LYS 225 Ca -0.47 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.11 3kfk h LYS 225 Cb 1.33 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.37 3kfk h LYS 225 CO 0.56 0.19 -0.58 0.21 -0.57 0.00 0.00 179.45 179.26 3kfk s LYS 226 N -3.13 0.15 0.04 3.15 2.20 -1.26 -2.20 119.74 118.70 3kfk s LYS 226 Ca 0.03 0.14 0.06 0.00 -0.36 0.00 0.00 55.97 55.84 3kfk s LYS 226 Cb 0.07 0.07 -0.02 0.00 -1.51 0.00 0.00 37.83 36.44 3kfk s LYS 226 CO 0.75 -0.02 -0.18 0.08 -0.36 0.00 0.00 175.35 175.61 3kfk s VAL 227 N 0.00 1.48 -0.14 4.02 1.01 -1.09 -5.05 120.40 120.63 3kfk s VAL 227 Ca -0.01 -1.13 -0.16 0.00 0.00 0.00 0.00 61.98 60.69 3kfk s VAL 227 Cb -0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3kfk s VAL 227 CO 0.00 0.14 0.37 -0.89 0.00 0.00 0.00 175.10 174.72 3kfk s THR 228 N -0.81 5.25 -1.27 3.92 2.01 -1.26 -4.12 115.64 119.35 3kfk s THR 228 Ca 0.05 0.72 -0.05 0.00 0.31 0.00 0.00 61.69 62.72 3kfk s THR 228 Cb -0.08 -3.71 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 3kfk s THR 228 CO 0.02 0.37 0.67 0.47 -0.69 0.00 0.00 174.62 175.45 3kfk n ASP 229 N 3.56 -2.25 -4.65 3.53 8.00 -1.26 -4.81 116.55 118.67 3kfk n ASP 229 Ca -0.10 -0.90 -0.43 0.00 0.71 0.00 0.00 54.79 54.07 3kfk n ASP 229 Cb 0.52 -3.74 -0.03 0.00 -0.02 0.00 0.00 41.12 37.85 3kfk n ASP 229 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kfk s ALA 230 N -3.67 3.47 -0.46 2.24 0.00 -1.26 -4.90 121.76 117.17 3kfk s ALA 230 Ca 0.14 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.58 3kfk s ALA 230 Cb -0.04 -3.79 0.02 0.00 0.00 0.00 0.00 23.12 19.31 3kfk s ALA 230 CO 0.84 -1.63 1.25 0.15 0.00 0.00 0.00 175.76 176.37 3kfk s LYS 231 N 4.33 3.65 -0.33 0.00 3.01 -1.26 -3.62 119.74 125.52 3kfk s LYS 231 Ca 0.73 0.69 -0.13 0.00 -1.01 0.00 0.00 55.97 56.26 3kfk s LYS 231 Cb -0.30 -3.96 -0.02 0.00 -1.01 0.00 0.00 37.83 32.53 3kfk s LYS 231 CO 0.29 -1.48 0.26 0.42 0.51 0.00 0.00 175.35 175.35 3kfk s ILE 232 N 4.90 5.26 -0.47 2.17 1.01 -0.88 -2.97 121.20 130.22 3kfk s ILE 232 Ca 0.53 -0.07 -0.21 0.00 0.00 0.00 0.00 60.65 60.90 3kfk s ILE 232 Cb -0.10 -3.70 0.03 0.00 0.01 0.00 0.00 42.46 38.70 3kfk s ILE 232 CO 0.32 0.03 0.68 0.00 0.00 0.00 0.00 174.94 175.96 3kfk s ALA 233 N 1.80 3.33 -0.61 9.38 0.00 -0.55 -2.00 121.76 133.12 3kfk s ALA 233 Ca 0.08 -1.32 -0.23 0.00 0.00 0.00 0.00 51.96 50.48 3kfk s ALA 233 Cb -0.17 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.64 3kfk s ALA 233 CO 0.11 -1.91 0.96 -0.51 0.00 0.00 0.00 175.76 174.41 3kfk s LEU 234 N 2.93 4.20 -0.23 0.00 1.02 -1.26 -2.08 118.68 123.26 3kfk s LEU 234 Ca 0.22 -0.68 -0.09 0.00 0.02 0.00 0.00 54.13 53.60 3kfk s LEU 234 Cb -0.15 -2.61 -0.04 0.00 0.02 0.00 0.00 46.19 43.41 3kfk s LEU 234 CO 0.18 -1.35 0.12 -0.76 0.02 0.00 0.00 176.35 174.56 3kfk s LEU 235 N 4.07 3.94 0.02 1.79 1.43 -0.50 -1.19 118.68 128.24 3kfk s LEU 235 Ca 0.26 0.05 0.13 0.00 -1.03 0.00 0.00 54.13 53.55 3kfk s LEU 235 Cb -0.15 -2.05 -0.19 0.00 0.03 0.00 0.00 46.19 43.84 3kfk s LEU 235 CO 0.14 0.07 0.83 -1.13 0.23 0.00 0.00 176.35 176.49 3kfk h ASN 236 N 7.45 0.00 -4.20 2.29 -1.24 -0.30 -1.73 115.58 117.84 3kfk h ASN 236 Ca -0.38 0.00 -0.49 0.00 0.71 0.00 0.00 56.30 56.14 3kfk h ASN 236 Cb 1.17 0.00 0.06 0.00 0.73 0.00 0.00 38.32 40.28 3kfk h ASN 236 CO 0.65 0.87 0.38 0.00 -1.29 0.00 0.00 177.43 178.04 3kfk s ALA 238 N -2.49 3.37 -0.80 0.00 0.00 -1.26 -4.63 121.76 115.94 3kfk s ALA 238 Ca 0.63 0.38 -0.04 0.00 0.00 0.00 0.00 51.96 52.93 3kfk s ALA 238 Cb -0.15 -3.04 0.16 0.00 0.00 0.00 0.00 23.12 20.08 3kfk s ALA 238 CO 0.37 0.13 2.44 -0.89 0.00 0.00 0.00 175.76 177.81 3kfk n ILE 239 N 2.36 4.16 -2.66 0.00 5.41 -1.24 -4.97 119.36 122.42 3kfk n ILE 239 Ca -0.03 -3.90 -0.19 0.00 1.00 0.00 0.00 62.75 59.64 3kfk n ILE 239 Cb 0.49 -1.64 0.09 0.00 -0.71 0.00 0.00 39.64 37.87 3kfk n ILE 239 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3kfk n GLU 240 N 0.72 0.16 -1.87 0.38 1.02 -1.26 -3.65 120.64 116.14 3kfk n GLU 240 Ca 0.53 -2.35 0.00 0.00 -0.02 0.00 0.00 57.16 55.32 3kfk n GLU 240 Cb 0.39 -0.48 0.00 0.00 -0.02 0.00 0.00 31.44 31.33 3kfk n GLU 240 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3kfk n GLU 263 N -2.43 0.00 0.00 3.49 -0.00 -1.26 -4.79 120.64 115.65 3kfk n GLU 263 Ca 0.14 -0.02 0.00 0.00 -0.00 0.00 0.00 57.16 57.28 3kfk n GLU 263 Cb 0.50 0.02 0.00 0.00 -0.00 0.00 0.00 31.44 31.96 3kfk n GLU 263 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3kfk n THR 264 N -0.02 0.00 -2.08 3.84 -2.24 -1.26 -5.07 114.28 107.45 3kfk n THR 264 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 3kfk n THR 264 Cb 0.01 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.19 3kfk n THR 264 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kfk n ALA 265 N -3.00 3.35 -2.75 6.98 0.00 -1.26 -4.99 120.51 118.84 3kfk n ALA 265 Ca 0.00 -0.92 -0.13 0.00 0.00 0.00 0.00 53.44 52.39 3kfk n ALA 265 Cb 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 19.45 19.09 3kfk n ALA 265 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3kfk n SER 266 N 0.08 1.77 -3.77 0.00 2.88 -1.26 -5.02 113.62 108.31 3kfk n SER 266 Ca -0.19 -2.91 -0.23 0.00 -1.33 0.00 0.00 58.87 54.21 3kfk n SER 266 Cb 0.76 -0.54 -0.02 0.00 -0.75 0.00 0.00 64.21 63.66 3kfk n SER 266 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3kfk n GLU 267 N -0.04 -0.74 -0.24 -1.46 0.28 -1.26 -4.81 120.64 112.36 3kfk n GLU 267 Ca 0.16 -0.09 0.05 0.00 -0.16 0.00 0.00 57.16 57.13 3kfk n GLU 267 Cb 0.76 -1.47 0.17 0.00 1.43 0.00 0.00 31.44 32.33 3kfk n GLU 267 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 3kfk n MET 268 N -3.22 2.09 0.00 3.44 2.81 -1.26 -3.79 117.12 117.19 3kfk n MET 268 Ca -0.12 -1.36 0.03 0.00 -1.81 0.00 0.00 57.70 54.45 3kfk n MET 268 Cb 0.36 -1.42 -0.04 0.00 -0.71 0.00 0.00 33.22 31.41 3kfk n MET 268 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3kfk n LEU 269 N 0.50 0.35 0.28 4.03 4.32 -1.26 -4.52 117.00 120.70 3kfk n LEU 269 Ca 0.12 -0.50 0.12 0.00 -0.02 0.00 0.00 56.01 55.73 3kfk n LEU 269 Cb 0.40 0.00 0.80 0.00 -1.62 0.00 0.00 43.42 43.00 3kfk n LEU 269 CO 0.10 0.09 1.08 0.11 -1.22 0.00 0.00 177.39 177.55 3kfk h LYS 270 N 0.01 0.00 -0.02 3.23 1.57 -1.96 0.41 116.57 119.81 3kfk h LYS 270 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 3kfk h LYS 270 Cb 0.17 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.49 3kfk h LYS 270 CO 0.00 0.02 -0.53 -0.44 -0.57 0.00 0.00 179.45 177.93 3kfk h ASP 271 N 0.00 0.50 -0.40 0.86 3.45 -1.85 -2.85 116.42 116.13 3kfk h ASP 271 Ca -0.00 -0.74 -0.07 0.00 0.43 0.00 0.00 57.03 56.65 3kfk h ASP 271 Cb 0.05 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.65 3kfk h ASP 271 CO 0.00 1.17 0.02 0.24 -1.57 0.00 0.00 179.24 179.10 3kfk h MET 272 N -0.12 0.78 -0.23 3.56 2.86 -1.36 -0.10 114.93 120.32 3kfk h MET 272 Ca -0.06 -0.20 -0.16 0.00 -2.06 0.00 0.00 59.70 57.22 3kfk h MET 272 Cb 1.23 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.80 3kfk h MET 272 CO 0.10 0.77 -0.48 0.28 1.06 0.00 0.00 176.91 178.65 3kfk h VAL 273 N 0.73 1.31 0.00 -2.22 2.07 -0.39 -3.07 116.25 114.67 3kfk h VAL 273 Ca 0.15 -1.69 -0.09 0.00 0.82 0.00 0.00 66.70 65.89 3kfk h VAL 273 Cb 0.42 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 3kfk h VAL 273 CO 0.02 0.53 -0.43 0.00 0.02 0.00 0.00 177.57 177.71 3kfk h ALA 274 N 0.62 1.21 -0.10 1.67 0.00 -1.28 -1.60 119.26 119.77 3kfk h ALA 274 Ca 0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 3kfk h ALA 274 Cb 1.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3kfk h ALA 274 CO 0.11 0.54 -0.42 0.93 0.00 0.00 0.00 179.25 180.40 3kfk h GLU 275 N 0.00 0.23 -0.04 0.00 5.08 -1.03 0.24 114.58 119.06 3kfk h GLU 275 Ca -0.00 -0.11 -0.21 0.00 -1.00 0.00 0.00 59.36 58.04 3kfk h GLU 275 Cb 0.80 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 3kfk h GLU 275 CO 0.06 0.61 -0.84 0.82 -1.00 0.00 0.00 179.01 178.66 3kfk h ILE 276 N 0.19 1.38 0.00 3.13 2.04 -1.40 -3.15 117.51 119.71 3kfk h ILE 276 Ca 0.02 -2.28 -0.07 0.00 1.00 0.00 0.00 64.86 63.53 3kfk h ILE 276 Cb 0.83 2.26 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 3kfk h ILE 276 CO 0.06 0.69 -0.31 0.50 0.00 0.00 0.00 178.15 179.09 3kfk h LYS 277 N 0.27 0.00 -0.28 2.37 3.64 -0.95 -3.02 116.57 118.60 3kfk h LYS 277 Ca -0.06 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 3kfk h LYS 277 Cb 1.45 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.25 3kfk h LYS 277 CO 0.15 0.31 -0.15 0.00 -2.27 0.00 0.00 179.45 177.50 3kfk h ALA 278 N 1.69 1.22 0.01 5.00 0.00 -0.49 -2.76 119.26 123.93 3kfk h ALA 278 Ca -0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 54.91 54.43 3kfk h ALA 278 Cb 0.79 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3kfk h ALA 278 CO 0.04 0.50 -0.87 0.66 0.00 0.00 0.00 179.25 179.58 3kfk h SER 279 N 0.45 0.17 -0.57 0.00 4.64 -1.56 -3.48 113.55 113.20 3kfk h SER 279 Ca 0.08 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3kfk h SER 279 Cb 0.52 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3kfk h SER 279 CO 0.03 0.96 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 3kfk n GLY 280 N 0.89 0.72 3.28 -0.77 0.00 -1.04 -4.56 105.19 103.71 3kfk n GLY 280 Ca -0.03 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 3kfk n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk s ALA 281 N -2.04 3.07 -0.72 4.61 0.00 -1.19 -4.70 121.76 120.79 3kfk s ALA 281 Ca 0.00 -1.78 0.25 0.00 0.00 0.00 0.00 51.96 50.44 3kfk s ALA 281 Cb 0.00 -2.31 0.62 0.00 0.00 0.00 0.00 23.12 21.43 3kfk s ALA 281 CO 0.00 -1.36 1.57 0.27 0.00 0.00 0.00 175.76 176.23 3kfk n ASN 282 N 4.82 0.70 -4.14 0.00 0.23 -1.16 -4.76 115.26 110.95 3kfk n ASN 282 Ca -0.12 0.33 -0.27 0.00 -0.53 0.00 0.00 54.58 53.99 3kfk n ASN 282 Cb 0.45 -0.30 -0.16 0.00 -2.08 0.00 0.00 39.78 37.68 3kfk n ASN 282 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3kfk s VAL 283 N -3.12 1.50 -0.17 3.53 1.01 -1.20 -1.14 120.40 120.81 3kfk s VAL 283 Ca 0.09 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 3kfk s VAL 283 Cb 0.13 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 35.26 3kfk s VAL 283 CO 0.65 0.43 -0.02 -0.22 0.00 0.00 0.00 175.10 175.94 3kfk s LEU 284 N 0.13 1.49 -0.40 3.92 2.96 0.52 -1.48 118.68 125.82 3kfk s LEU 284 Ca -0.06 -0.69 -0.15 0.00 -0.22 0.00 0.00 54.13 53.01 3kfk s LEU 284 Cb -0.13 -0.81 0.02 0.00 0.50 0.00 0.00 46.19 45.77 3kfk s LEU 284 CO 0.03 -0.22 0.29 -0.36 -1.32 0.00 0.00 176.35 174.77 3kfk s PHE 285 N 1.70 3.24 -0.18 5.38 0.40 -0.88 -2.21 117.98 125.43 3kfk s PHE 285 Ca 0.00 -0.57 -0.07 0.00 -0.60 0.00 0.00 56.93 55.70 3kfk s PHE 285 Cb -0.16 -2.57 -0.04 0.00 0.51 0.00 0.00 43.02 40.77 3kfk s PHE 285 CO -0.07 -0.57 0.04 0.00 0.70 0.00 0.00 175.22 175.32 3kfk h GLN 287 N 6.68 0.37 0.00 0.00 4.15 -1.57 -2.89 115.11 121.85 3kfk h GLN 287 Ca -0.36 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 58.57 3kfk h GLN 287 Cb 1.17 0.16 0.00 0.00 0.21 0.00 0.00 27.48 29.02 3kfk h GLN 287 CO 0.69 1.18 0.00 1.63 -1.93 0.00 0.00 178.83 180.40 3kfk n LYS 288 N -3.66 1.68 -3.37 1.69 4.76 -1.26 -3.83 118.16 114.17 3kfk n LYS 288 Ca -0.08 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 54.98 3kfk n LYS 288 Cb 0.93 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 34.06 3kfk n LYS 288 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3kfk s GLY 289 N -1.46 2.56 -0.21 0.72 0.00 -1.26 -1.53 107.32 106.15 3kfk s GLY 289 Ca 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 44.72 44.53 3kfk s GLY 289 CO 0.00 0.38 0.12 -0.42 0.00 0.00 0.00 173.10 173.19 3kfk s ILE 290 N -0.86 5.27 0.59 0.90 1.01 -1.26 -3.71 121.20 123.15 3kfk s ILE 290 Ca 0.27 0.14 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 3kfk s ILE 290 Cb -0.18 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 3kfk s ILE 290 CO 0.16 0.42 1.06 -0.62 0.00 0.00 0.00 174.94 175.95 3kfk s ASP 291 N 0.54 5.82 0.44 3.58 -1.08 -1.24 -4.92 116.67 119.80 3kfk s ASP 291 Ca 0.07 1.82 0.13 0.00 -0.52 0.00 0.00 52.55 54.05 3kfk s ASP 291 Cb -0.12 -2.53 0.96 0.00 -1.46 0.00 0.00 42.92 39.77 3kfk s ASP 291 CO -0.00 -1.14 1.99 -0.78 0.52 0.00 0.00 175.17 175.76 3kfk h ASP 292 N 0.49 0.09 -0.37 -0.34 -0.00 -1.97 -2.47 116.42 111.85 3kfk h ASP 292 Ca -0.47 -0.01 -0.11 0.00 -0.00 0.00 0.00 57.03 56.44 3kfk h ASP 292 Cb 1.22 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 40.52 3kfk h ASP 292 CO 0.58 0.23 -0.18 -0.07 -0.00 0.00 0.00 179.24 179.79 3kfk h LEU 293 N 0.09 0.80 -1.60 2.28 3.38 -1.94 -3.03 115.31 115.29 3kfk h LEU 293 Ca 0.02 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 3kfk h LEU 293 Cb 0.28 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3kfk h LEU 293 CO 0.02 1.03 -0.19 0.00 0.09 0.00 0.00 178.44 179.39 3kfk h ALA 294 N 0.79 1.25 -0.60 1.53 0.00 -1.78 -2.94 119.26 117.51 3kfk h ALA 294 Ca 0.08 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3kfk h ALA 294 Cb 0.73 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3kfk h ALA 294 CO 0.06 0.24 0.17 1.96 0.00 0.00 0.00 179.25 181.68 3kfk h GLN 295 N 0.00 0.92 -0.16 0.00 4.20 -1.34 -1.48 115.11 117.25 3kfk h GLN 295 Ca -0.00 -0.18 -0.14 0.00 0.06 0.00 0.00 58.65 58.38 3kfk h GLN 295 Cb 0.49 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.13 3kfk h GLN 295 CO 0.03 0.80 -0.45 1.25 -0.67 0.00 0.00 178.83 179.79 3kfk h HIS 296 N 0.89 0.75 -0.28 2.96 2.76 -1.56 -2.89 115.15 117.78 3kfk h HIS 296 Ca 0.20 -0.30 -0.16 0.00 -2.20 0.00 0.00 60.37 57.91 3kfk h HIS 296 Cb 0.28 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 3kfk h HIS 296 CO 0.02 1.06 -0.46 1.88 -1.30 0.00 0.00 177.93 179.13 3kfk h TYR 297 N 0.23 0.89 -0.13 5.26 0.05 -1.49 -0.61 116.97 121.16 3kfk h TYR 297 Ca -0.01 -0.29 -0.10 0.00 0.05 0.00 0.00 58.73 58.38 3kfk h TYR 297 Cb 1.07 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.62 3kfk h TYR 297 CO 0.10 1.05 -0.36 -0.07 -1.05 0.00 0.00 178.16 177.84 3kfk h LEU 298 N 0.58 0.28 -0.62 3.88 3.38 -1.38 -2.30 115.31 119.13 3kfk h LEU 298 Ca 0.03 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 3kfk h LEU 298 Cb 1.02 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 3kfk h LEU 298 CO 0.10 0.62 -0.59 0.00 0.09 0.00 0.00 178.44 178.66 3kfk h ALA 299 N 1.40 0.85 -0.08 1.53 0.00 -1.29 0.16 119.26 121.83 3kfk h ALA 299 Ca 0.03 -0.53 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 3kfk h ALA 299 Cb 0.74 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3kfk h ALA 299 CO 0.06 0.73 -0.68 -0.22 0.00 0.00 0.00 179.25 179.14 3kfk h LYS 300 N 0.00 0.37 -0.05 0.00 3.64 -0.80 -3.12 116.57 116.61 3kfk h LYS 300 Ca -0.01 -0.28 -0.19 0.00 -1.27 0.00 0.00 60.65 58.90 3kfk h LYS 300 Cb 1.17 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3kfk h LYS 300 CO 0.08 0.91 -0.78 0.93 -2.27 0.00 0.00 179.45 178.32 3kfk h GLU 301 N 0.26 0.37 0.00 1.90 4.39 -1.40 -3.48 114.58 116.62 3kfk h GLU 301 Ca -0.02 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.35 3kfk h GLU 301 Cb 1.24 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 3kfk h GLU 301 CO 0.11 0.98 0.00 0.41 -1.16 0.00 0.00 179.01 179.36 3kfk n GLY 302 N 0.66 1.28 3.69 -3.84 0.00 -0.88 -5.10 105.19 101.00 3kfk n GLY 302 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 3kfk n GLY 302 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kfk s ILE 303 N -2.00 5.05 -0.04 -0.61 1.01 0.52 -4.74 121.20 120.38 3kfk s ILE 303 Ca 0.00 1.30 -0.21 0.00 0.00 0.00 0.00 60.65 61.73 3kfk s ILE 303 Cb 0.00 -3.98 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 3kfk s ILE 303 CO 0.00 0.20 0.62 -0.69 0.00 0.00 0.00 174.94 175.07 3kfk s VAL 304 N 1.26 4.99 0.11 2.92 1.01 -0.30 -4.11 120.40 126.28 3kfk s VAL 304 Ca 0.33 1.29 0.05 0.00 0.00 0.00 0.00 61.98 63.65 3kfk s VAL 304 Cb -0.17 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 3kfk s VAL 304 CO 0.14 0.34 -0.12 0.00 0.00 0.00 0.00 175.10 175.46 3kfk s ALA 305 N 0.29 1.30 -0.03 5.51 0.00 -1.26 -0.36 121.76 127.21 3kfk s ALA 305 Ca 0.33 -1.22 0.01 0.00 0.00 0.00 0.00 51.96 51.08 3kfk s ALA 305 Cb -0.18 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 22.93 3kfk s ALA 305 CO 0.17 0.05 -0.04 0.00 0.00 0.00 0.00 175.76 175.93 3kfk s ALA 306 N -2.20 0.57 -0.16 0.00 0.00 -0.94 -1.06 121.76 117.97 3kfk s ALA 306 Ca 0.06 -0.05 -0.07 0.00 0.00 0.00 0.00 51.96 51.90 3kfk s ALA 306 Cb -0.04 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3kfk s ALA 306 CO 0.02 0.01 0.08 -0.98 0.00 0.00 0.00 175.76 174.89 3kfk s ARG 307 N 0.70 3.78 -0.94 0.00 1.70 -1.26 -2.31 118.95 120.61 3kfk s ARG 307 Ca -0.09 -0.29 -0.05 0.00 -0.47 0.00 0.00 55.73 54.84 3kfk s ARG 307 Cb -0.12 -3.19 -0.06 0.00 -0.57 0.00 0.00 34.95 31.01 3kfk s ARG 307 CO -0.00 0.44 0.83 0.54 -1.08 0.00 0.00 175.30 176.02 3kfk n ARG 308 N 3.03 -2.17 -2.88 3.89 1.74 -0.58 -4.99 116.66 114.70 3kfk n ARG 308 Ca -0.17 0.78 -0.40 0.00 -0.77 0.00 0.00 57.85 57.29 3kfk n ARG 308 Cb 0.53 -5.38 -0.06 0.00 -1.02 0.00 0.00 32.46 26.53 3kfk n ARG 308 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3kfk s VAL 309 N -3.35 4.28 0.43 1.55 1.01 -1.14 -5.02 120.40 118.17 3kfk s VAL 309 Ca 0.39 1.87 -0.24 0.00 0.00 0.00 0.00 61.98 64.00 3kfk s VAL 309 Cb -0.05 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 32.01 3kfk s VAL 309 CO 0.66 0.49 1.11 0.29 0.00 0.00 0.00 175.10 177.66 3kfk n LYS 310 N 1.69 1.54 0.21 2.72 4.76 -1.26 -4.68 118.16 123.14 3kfk n LYS 310 Ca -0.04 0.55 0.06 0.00 -2.87 0.00 0.00 58.31 56.01 3kfk n LYS 310 Cb 0.48 -2.18 0.53 0.00 -1.84 0.00 0.00 35.03 32.02 3kfk n LYS 310 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 3kfk h LYS 311 N 1.67 0.07 -0.45 1.97 3.64 -1.95 -1.61 116.57 119.91 3kfk h LYS 311 Ca -0.46 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 58.81 3kfk h LYS 311 Cb 1.32 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 3kfk h LYS 311 CO 0.58 0.15 -0.15 0.66 -2.27 0.00 0.00 179.45 178.42 3kfk h SER 312 N 0.07 0.84 0.94 4.20 4.64 -2.00 -2.90 113.55 119.33 3kfk h SER 312 Ca 0.02 -0.28 -0.14 0.00 -0.47 0.00 0.00 61.79 60.92 3kfk h SER 312 Cb 0.18 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3kfk h SER 312 CO 0.01 0.99 -0.68 0.44 -0.87 0.00 0.00 176.83 176.72 3kfk h ASP 313 N 0.75 0.00 -0.12 4.97 3.32 -1.69 -2.99 116.42 120.66 3kfk h ASP 313 Ca 0.12 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.03 3kfk h ASP 313 Cb 0.66 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 3kfk h ASP 313 CO 0.05 0.68 -0.38 0.24 -1.72 0.00 0.00 179.24 178.10 3kfk h MET 314 N 0.00 0.65 0.00 3.56 2.86 -1.28 -1.66 114.93 119.06 3kfk h MET 314 Ca -0.01 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.23 3kfk h MET 314 Cb 1.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.99 3kfk h MET 314 CO 0.09 0.92 -0.38 0.93 1.06 0.00 0.00 176.91 179.54 3kfk h GLU 315 N 0.54 0.00 -0.12 1.72 5.08 -1.52 -2.72 114.58 117.55 3kfk h GLU 315 Ca 0.05 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.25 3kfk h GLU 315 Cb 0.90 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.16 3kfk h GLU 315 CO 0.08 0.38 -0.55 0.87 -1.00 0.00 0.00 179.01 178.79 3kfk h LYS 316 N 0.00 0.59 -0.05 2.33 1.79 -1.35 -3.25 116.57 116.63 3kfk h LYS 316 Ca -0.00 -0.47 -0.06 0.00 -2.18 0.00 0.00 60.65 57.94 3kfk h LYS 316 Cb 0.89 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.63 3kfk h LYS 316 CO 0.05 1.09 -0.26 -0.07 -1.08 0.00 0.00 179.45 179.18 3kfk h LEU 317 N 0.22 0.08 -0.62 2.94 3.38 -1.22 -2.06 115.31 118.03 3kfk h LEU 317 Ca -0.03 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 3kfk h LEU 317 Cb 1.19 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 3kfk h LEU 317 CO 0.11 0.35 -0.60 0.00 0.09 0.00 0.00 178.44 178.39 3kfk h ALA 318 N 1.66 0.81 0.00 1.53 0.00 -1.56 -3.08 119.26 118.63 3kfk h ALA 318 Ca 0.01 -0.54 -0.25 0.00 0.00 0.00 0.00 54.91 54.13 3kfk h ALA 318 Cb 0.50 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3kfk h ALA 318 CO 0.04 0.72 -1.74 1.63 0.00 0.00 0.00 179.25 179.90 3kfk n LYS 319 N -3.88 0.64 -0.04 0.00 5.02 -1.14 -0.41 118.16 118.35 3kfk n LYS 319 Ca -0.03 0.19 -0.13 0.00 -2.02 0.00 0.00 58.31 56.33 3kfk n LYS 319 Cb 0.62 -1.74 -0.11 0.00 -0.02 0.00 0.00 35.03 33.79 3kfk n LYS 319 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kfk h ALA 320 N 1.21 -0.02 0.00 7.82 0.00 -1.47 -3.35 119.26 123.44 3kfk h ALA 320 Ca -0.28 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 3kfk h ALA 320 Cb 1.85 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.65 3kfk h ALA 320 CO 0.05 -0.10 -0.46 1.79 0.00 0.00 0.00 179.25 180.54 3kfk h THR 321 N -0.86 0.06 -1.58 0.00 1.35 -1.75 -3.41 112.91 106.72 3kfk h THR 321 Ca -0.00 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 3kfk h THR 321 Cb 0.76 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 3kfk h THR 321 CO 0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 3kfk n GLY 322 N 1.15 0.58 3.64 5.82 0.00 -1.18 -0.94 105.19 114.25 3kfk n GLY 322 Ca 0.02 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 3kfk n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk s ALA 323 N -2.47 3.20 -0.12 4.61 0.00 0.45 -3.88 121.76 123.56 3kfk s ALA 323 Ca 0.00 -1.81 0.01 0.00 0.00 0.00 0.00 51.96 50.16 3kfk s ALA 323 Cb 0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 3kfk s ALA 323 CO 0.00 0.16 -0.15 -0.80 0.00 0.00 0.00 175.76 174.96 3kfk s ASN 324 N -3.70 3.85 -0.47 0.00 0.01 -0.33 -4.59 114.94 109.70 3kfk s ASN 324 Ca 0.34 -0.36 -0.29 0.00 -0.71 0.00 0.00 52.86 51.84 3kfk s ASN 324 Cb -0.03 -1.49 0.03 0.00 0.41 0.00 0.00 41.25 40.16 3kfk s ASN 324 CO 0.20 0.18 1.13 -0.69 -1.51 0.00 0.00 177.10 176.41 3kfk s VAL 325 N 0.24 4.23 -0.19 1.60 1.01 -1.26 -4.27 120.40 121.75 3kfk s VAL 325 Ca -0.10 1.24 -0.07 0.00 0.00 0.00 0.00 61.98 63.05 3kfk s VAL 325 Cb -0.16 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.59 3kfk s VAL 325 CO 0.06 -0.98 0.05 -0.63 0.00 0.00 0.00 175.10 173.60 3kfk s ILE 326 N 4.39 4.67 -0.27 2.22 -1.09 -0.34 -4.86 121.20 125.93 3kfk s ILE 326 Ca 0.48 -0.07 0.12 0.00 -2.23 0.00 0.00 60.65 58.94 3kfk s ILE 326 Cb -0.07 -3.11 0.69 0.00 -1.58 0.00 0.00 42.46 38.38 3kfk s ILE 326 CO 0.31 0.45 1.67 0.41 -1.23 0.00 0.00 174.94 176.55 3kfk n THR 327 N 3.66 2.72 -3.67 2.92 -1.04 -1.26 0.44 114.28 118.05 3kfk n THR 327 Ca -0.17 -1.78 -0.09 0.00 -2.04 0.00 0.00 64.05 59.98 3kfk n THR 327 Cb 0.52 -0.32 -0.10 0.00 -1.82 0.00 0.00 70.33 68.62 3kfk n THR 327 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3kfk s ASN 328 N -1.37 -0.41 0.43 8.00 2.47 -1.26 -4.45 114.94 118.35 3kfk s ASN 328 Ca 0.51 1.00 0.24 0.00 0.42 0.00 0.00 52.86 55.03 3kfk s ASN 328 Cb 0.41 1.18 0.70 0.00 -1.45 0.00 0.00 41.25 42.10 3kfk s ASN 328 CO 0.11 -0.22 1.73 -0.29 -3.72 0.00 0.00 177.10 174.72 3kfk h ILE 329 N 5.89 0.37 0.00 -5.21 2.10 -1.93 -3.16 117.51 115.57 3kfk h ILE 329 Ca -0.24 -1.18 0.00 0.00 1.08 0.00 0.00 64.86 64.52 3kfk h ILE 329 Cb 1.14 1.90 0.00 0.00 -1.09 0.00 0.00 36.82 38.77 3kfk h ILE 329 CO 0.18 0.18 0.00 0.11 -1.08 0.00 0.00 178.15 177.54 3kfk h LYS 330 N 0.00 0.00 0.00 2.19 1.79 -1.97 -3.29 116.57 115.30 3kfk h LYS 330 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3kfk h LYS 330 Cb 0.88 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 3kfk h LYS 330 CO 0.02 0.00 -0.04 -3.47 -1.08 0.00 0.00 179.45 174.88 3kfk n ASP 331 N -2.41 1.95 -4.65 0.86 4.64 -1.19 -5.04 116.55 110.72 3kfk n ASP 331 Ca 0.04 -2.61 -0.42 0.00 -1.38 0.00 0.00 54.79 50.42 3kfk n ASP 331 Cb 0.36 -0.27 -0.03 0.00 -1.04 0.00 0.00 41.12 40.14 3kfk n ASP 331 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 3kfk s LEU 332 N -1.99 4.23 0.21 -2.67 2.96 -1.24 -4.99 118.68 115.19 3kfk s LEU 332 Ca 0.19 2.26 0.05 0.00 -0.22 0.00 0.00 54.13 56.41 3kfk s LEU 332 Cb 0.17 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 3kfk s LEU 332 CO 0.02 -1.09 0.22 -0.55 -1.32 0.00 0.00 176.35 173.63 3kfk s SER 333 N 4.19 5.79 0.42 3.68 0.15 -1.26 -4.70 113.70 121.97 3kfk s SER 333 Ca 0.80 -0.09 0.23 0.00 0.70 0.00 0.00 55.95 57.59 3kfk s SER 333 Cb -0.35 -1.57 0.71 0.00 -1.71 0.00 0.00 66.02 63.09 3kfk s SER 333 CO 0.34 0.00 1.73 0.00 1.20 0.00 0.00 173.24 176.51 3kfk h ALA 334 N 1.81 0.94 -0.11 5.45 0.00 -1.93 -2.93 119.26 122.49 3kfk h ALA 334 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3kfk h ALA 334 Cb 1.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3kfk h ALA 334 CO 0.63 0.28 0.00 1.04 0.00 0.00 0.00 179.25 181.19 3kfk n GLN 335 N -3.28 1.65 -0.23 0.00 3.00 -1.26 -3.48 117.38 113.79 3kfk n GLN 335 Ca 0.01 -0.97 0.11 0.00 -0.01 0.00 0.00 57.00 56.14 3kfk n GLN 335 Cb 0.49 -1.41 0.23 0.00 0.00 0.00 0.00 30.24 29.55 3kfk n GLN 335 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 3kfk n ASP 336 N 0.18 3.50 -4.85 1.08 10.43 -1.11 -4.90 116.55 120.88 3kfk n ASP 336 Ca 0.17 -1.97 -0.37 0.00 2.57 0.00 0.00 54.79 55.18 3kfk n ASP 336 Cb 0.31 -0.30 -0.06 0.00 1.84 0.00 0.00 41.12 42.92 3kfk n ASP 336 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3kfk s LEU 337 N -1.30 4.41 0.70 0.64 1.43 -1.23 -1.19 118.68 122.14 3kfk s LEU 337 Ca 0.39 0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 54.11 3kfk s LEU 337 Cb 0.22 -2.31 0.06 0.00 0.03 0.00 0.00 46.19 44.20 3kfk s LEU 337 CO 0.30 0.35 1.00 -0.83 0.23 0.00 0.00 176.35 177.40 3kfk s GLY 338 N -0.92 1.70 -0.12 -3.19 0.00 -0.84 -4.67 107.32 99.28 3kfk s GLY 338 Ca 0.19 -0.99 -0.00 0.00 0.00 0.00 0.00 44.72 43.92 3kfk s GLY 338 CO 0.08 -0.58 -0.10 -0.35 0.00 0.00 0.00 173.10 172.15 3kfk s ASP 339 N -4.52 2.34 0.44 1.64 2.15 -0.12 -2.06 116.67 116.53 3kfk s ASP 339 Ca 0.60 -0.36 0.07 0.00 0.43 0.00 0.00 52.55 53.30 3kfk s ASP 339 Cb -0.10 -0.94 -0.01 0.00 -0.30 0.00 0.00 42.92 41.56 3kfk s ASP 339 CO 0.44 -0.10 0.38 0.00 -0.17 0.00 0.00 175.17 175.72 3kfk s ALA 340 N 1.64 4.09 -0.02 3.66 0.00 -1.24 -4.58 121.76 125.31 3kfk s ALA 340 Ca 0.05 -1.83 0.04 0.00 0.00 0.00 0.00 51.96 50.23 3kfk s ALA 340 Cb -0.13 -0.91 -0.07 0.00 0.00 0.00 0.00 23.12 22.02 3kfk s ALA 340 CO -0.09 -0.28 0.10 0.41 0.00 0.00 0.00 175.76 175.91 3kfk n GLY 341 N -1.57 -0.13 3.18 0.00 0.00 0.58 -4.47 105.19 102.79 3kfk n GLY 341 Ca 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 45.96 3kfk n GLY 341 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kfk s LEU 342 N -3.20 -1.30 -0.27 0.99 0.20 0.43 -4.81 118.68 110.72 3kfk s LEU 342 Ca -0.01 0.90 -0.02 0.00 0.69 0.00 0.00 54.13 55.70 3kfk s LEU 342 Cb 0.03 2.10 0.03 0.00 -0.43 0.00 0.00 46.19 47.92 3kfk s LEU 342 CO 0.18 -0.26 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.25 3kfk s VAL 343 N 2.84 2.90 -0.14 1.68 1.01 -1.16 0.15 120.40 127.67 3kfk s VAL 343 Ca 0.17 -1.16 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 3kfk s VAL 343 Cb -0.15 -2.55 0.05 0.00 0.00 0.00 0.00 36.38 33.74 3kfk s VAL 343 CO -0.20 0.09 0.35 -0.70 0.00 0.00 0.00 175.10 174.64 3kfk s GLU 344 N 1.30 0.35 -1.19 2.72 2.12 0.61 -2.68 118.70 121.91 3kfk s GLU 344 Ca -0.02 0.65 -0.16 0.00 0.36 0.00 0.00 54.97 55.79 3kfk s GLU 344 Cb -0.18 0.00 0.12 0.00 0.26 0.00 0.00 34.13 34.34 3kfk s GLU 344 CO -0.03 -0.13 1.50 -2.00 -0.54 0.00 0.00 175.26 174.05 3kfk s GLU 345 N 1.08 3.96 0.25 4.30 2.12 -0.93 -0.04 118.70 129.44 3kfk s GLU 345 Ca -0.07 -2.18 -0.22 0.00 0.36 0.00 0.00 54.97 52.86 3kfk s GLU 345 Cb -0.08 -5.23 -0.09 0.00 0.26 0.00 0.00 34.13 29.00 3kfk s GLU 345 CO -0.08 -1.96 0.80 1.03 -0.54 0.00 0.00 175.26 174.50 3kfk s ARG 346 N 2.84 4.37 -1.06 4.30 0.52 -1.09 -4.83 118.95 124.01 3kfk s ARG 346 Ca 0.46 1.03 -0.04 0.00 -0.52 0.00 0.00 55.73 56.65 3kfk s ARG 346 Cb -0.01 -2.87 0.13 0.00 0.52 0.00 0.00 34.95 32.73 3kfk s ARG 346 CO 0.01 0.36 2.42 1.63 0.02 0.00 0.00 175.30 179.74 3kfk n LYS 347 N 0.70 4.07 -2.49 3.54 5.02 -1.26 -1.91 118.16 125.83 3kfk n LYS 347 Ca -0.01 -3.30 -0.41 0.00 -2.02 0.00 0.00 58.31 52.57 3kfk n LYS 347 Cb 0.51 -2.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.00 3kfk n LYS 347 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3kfk s ILE 348 N -1.86 3.92 -1.32 -0.18 1.10 -1.06 -3.08 121.20 118.71 3kfk s ILE 348 Ca 0.54 1.58 0.00 0.00 -0.51 0.00 0.00 60.65 62.25 3kfk s ILE 348 Cb 0.24 -4.01 0.00 0.00 0.15 0.00 0.00 42.46 38.85 3kfk s ILE 348 CO -0.14 0.23 0.00 -0.24 -2.11 0.00 0.00 174.94 172.68 3kfk n SER 349 N 2.75 -4.50 0.00 4.50 2.88 -1.26 -2.41 113.62 115.57 3kfk n SER 349 Ca 0.04 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 3kfk n SER 349 Cb 0.46 -3.82 0.00 0.00 -0.75 0.00 0.00 64.21 60.10 3kfk n SER 349 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kfk n GLY 350 N -0.82 2.41 3.70 0.46 0.00 -1.18 -4.96 105.19 104.82 3kfk n GLY 350 Ca -0.18 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 3kfk n GLY 350 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kfk s ASP 351 N 0.00 7.02 -0.58 1.61 1.01 -1.01 -4.87 116.67 119.85 3kfk s ASP 351 Ca 0.00 2.01 -0.24 0.00 0.71 0.00 0.00 52.55 55.03 3kfk s ASP 351 Cb 0.00 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.40 3kfk s ASP 351 CO 0.00 -0.54 0.98 -0.94 0.21 0.00 0.00 175.17 174.88 3kfk s SER 352 N 1.25 6.31 0.21 0.27 1.04 -1.26 -2.57 113.70 118.95 3kfk s SER 352 Ca 0.59 -0.43 0.11 0.00 0.48 0.00 0.00 55.95 56.70 3kfk s SER 352 Cb -0.29 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.34 3kfk s SER 352 CO 0.27 -1.30 -0.21 -0.04 0.98 0.00 0.00 173.24 172.94 3kfk s MET 353 N 4.11 1.49 -0.52 4.02 -1.94 -0.80 -4.43 119.30 121.22 3kfk s MET 353 Ca 0.30 -1.56 -0.28 0.00 -1.71 0.00 0.00 55.69 52.44 3kfk s MET 353 Cb -0.13 -1.65 0.03 0.00 2.01 0.00 0.00 34.83 35.09 3kfk s MET 353 CO 0.18 0.34 1.10 0.42 -0.01 0.00 0.00 175.02 177.04 3kfk s ILE 354 N -2.05 4.21 -0.83 2.53 1.01 -0.94 -2.65 121.20 122.48 3kfk s ILE 354 Ca 0.22 0.93 -0.25 0.00 0.00 0.00 0.00 60.65 61.55 3kfk s ILE 354 Cb -0.06 -4.61 0.04 0.00 0.01 0.00 0.00 42.46 37.84 3kfk s ILE 354 CO 0.10 -1.10 1.30 -0.36 0.00 0.00 0.00 174.94 174.88 3kfk s PHE 355 N 4.45 2.41 0.62 3.97 0.40 0.95 -2.62 117.98 128.15 3kfk s PHE 355 Ca 0.42 -0.38 -0.19 0.00 -0.60 0.00 0.00 56.93 56.19 3kfk s PHE 355 Cb -0.08 -4.61 -0.02 0.00 0.51 0.00 0.00 43.02 38.81 3kfk s PHE 355 CO 0.27 -1.99 1.30 0.08 0.70 0.00 0.00 175.22 175.59 3kfk s VAL 356 N 5.28 2.12 0.00 -0.44 1.01 -1.21 0.22 120.40 127.38 3kfk s VAL 356 Ca 0.37 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.43 3kfk s VAL 356 Cb -0.06 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.29 3kfk s VAL 356 CO 0.06 -0.01 0.00 -1.84 0.00 0.00 0.00 175.10 173.31 3kfk n GLU 357 N -1.66 -2.10 -0.34 2.72 0.28 0.12 -3.77 120.64 115.88 3kfk n GLU 357 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 3kfk n GLU 357 Cb 0.48 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.35 3kfk n GLU 357 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3kfk n GLU 358 N -0.30 -0.69 -3.63 3.44 1.02 -1.05 0.16 120.64 119.59 3kfk n GLU 358 Ca 0.00 0.59 -0.12 0.00 -0.02 0.00 0.00 57.16 57.61 3kfk n GLU 358 Cb 0.00 -0.54 -0.07 0.00 -0.02 0.00 0.00 31.44 30.81 3kfk n GLU 358 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kfk h LYS 360 N 5.46 -0.46 -3.16 0.00 1.79 -1.97 -3.41 116.57 114.82 3kfk h LYS 360 Ca -0.29 0.03 -0.63 0.00 -2.18 0.00 0.00 60.65 57.58 3kfk h LYS 360 Cb 1.18 0.11 -0.41 0.00 -1.58 0.00 0.00 32.23 31.52 3kfk h LYS 360 CO 0.08 -0.31 -0.63 -1.58 -1.08 0.00 0.00 179.45 175.92 3kfk s HIS 361 N -3.69 3.13 -0.09 -1.35 2.46 -1.26 -5.10 115.29 109.39 3kfk s HIS 361 Ca -0.07 -3.13 -0.22 0.00 0.47 0.00 0.00 55.06 52.11 3kfk s HIS 361 Cb 0.01 -2.58 -0.04 0.00 -0.13 0.00 0.00 32.58 29.84 3kfk s HIS 361 CO 0.21 -0.66 0.63 -1.25 -2.47 0.00 0.00 174.74 171.20 3kfk s PRO 362 N -0.73 4.40 0.04 2.88 0.05 -1.26 -4.93 135.00 135.44 3kfk s PRO 362 Ca 0.21 0.73 0.24 0.00 0.05 0.00 0.00 61.00 62.24 3kfk s PRO 362 Cb -0.15 -3.45 0.25 0.00 0.05 0.00 0.00 34.50 31.20 3kfk s PRO 362 CO -0.08 0.08 1.22 1.63 0.05 0.00 0.00 177.00 179.89 3kfk n LYS 363 N 3.81 0.15 -4.72 4.56 4.76 -1.26 -4.40 118.16 121.06 3kfk n LYS 363 Ca -0.03 0.01 -0.26 0.00 -2.87 0.00 0.00 58.31 55.17 3kfk n LYS 363 Cb 0.51 -1.56 -0.16 0.00 -1.84 0.00 0.00 35.03 31.98 3kfk n LYS 363 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3kfk s ALA 364 N -3.10 1.42 -0.01 7.82 0.00 -1.26 -4.62 121.76 122.01 3kfk s ALA 364 Ca 0.07 -0.55 0.06 0.00 0.00 0.00 0.00 51.96 51.54 3kfk s ALA 364 Cb 0.16 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 3kfk s ALA 364 CO 0.75 0.18 -0.19 0.08 0.00 0.00 0.00 175.76 176.58 3kfk s VAL 365 N 0.42 1.53 -0.09 0.00 1.01 -0.99 -4.92 120.40 117.36 3kfk s VAL 365 Ca -0.11 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 3kfk s VAL 365 Cb -0.14 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 3kfk s VAL 365 CO 0.04 0.42 -0.02 -0.89 0.00 0.00 0.00 175.10 174.65 3kfk s THR 366 N -0.47 4.10 -0.30 3.92 2.01 -1.03 0.39 115.64 124.26 3kfk s THR 366 Ca 0.07 -0.32 -0.02 0.00 0.31 0.00 0.00 61.69 61.73 3kfk s THR 366 Cb -0.08 -2.72 0.05 0.00 0.01 0.00 0.00 72.50 69.76 3kfk s THR 366 CO -0.01 0.59 0.01 -0.04 -0.69 0.00 0.00 174.62 174.48 3kfk s MET 367 N -0.67 2.44 -1.28 4.92 -1.94 0.16 -1.43 119.30 121.49 3kfk s MET 367 Ca 0.11 -1.26 -0.17 0.00 -1.71 0.00 0.00 55.69 52.66 3kfk s MET 367 Cb -0.12 -3.20 0.09 0.00 2.01 0.00 0.00 34.83 33.62 3kfk s MET 367 CO 0.02 -0.62 1.69 -0.11 -0.01 0.00 0.00 175.02 175.98 3kfk n LEU 368 N 4.64 5.10 -4.64 -0.03 7.94 -1.23 -1.50 117.00 127.28 3kfk n LEU 368 Ca -0.13 -4.07 -0.43 0.00 -1.11 0.00 0.00 56.01 50.27 3kfk n LEU 368 Cb 0.43 -1.71 -0.02 0.00 0.53 0.00 0.00 43.42 42.65 3kfk n LEU 368 CO 0.27 0.34 1.11 -0.63 -1.11 0.00 0.00 177.39 177.37 3kfk s ILE 369 N 3.50 4.20 0.13 1.96 1.01 -0.55 -3.91 121.20 127.53 3kfk s ILE 369 Ca 0.51 1.38 0.07 0.00 0.00 0.00 0.00 60.65 62.61 3kfk s ILE 369 Cb 0.03 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 3kfk s ILE 369 CO 0.05 -0.38 -0.16 -0.13 0.00 0.00 0.00 174.94 174.32 3kfk s ARG 370 N 3.97 1.10 0.24 2.79 0.52 -1.26 -2.71 118.95 123.60 3kfk s ARG 370 Ca 0.55 -1.26 -0.21 0.00 -0.52 0.00 0.00 55.73 54.29 3kfk s ARG 370 Cb -0.18 -1.09 0.06 0.00 0.52 0.00 0.00 34.95 34.26 3kfk s ARG 370 CO 0.20 0.22 0.94 0.20 0.02 0.00 0.00 175.30 176.88 3kfk s GLY 371 N -2.40 0.11 0.01 -3.53 0.00 -1.20 -2.33 107.32 97.97 3kfk s GLY 371 Ca 0.10 -0.37 -0.22 0.00 0.00 0.00 0.00 44.72 44.23 3kfk s GLY 371 CO 0.04 1.06 1.05 -0.91 0.00 0.00 0.00 173.10 174.34 3kfk h THR 372 N 2.00 0.00 -2.89 0.90 1.35 -1.91 -3.07 112.91 109.29 3kfk h THR 372 Ca -0.28 -0.23 -0.60 0.00 -0.55 0.00 0.00 66.41 64.75 3kfk h THR 372 Cb 1.23 0.00 -0.09 0.00 -1.73 0.00 0.00 68.15 67.56 3kfk h THR 372 CO 0.35 0.00 -0.61 0.42 -0.25 0.00 0.00 175.52 175.43 3kfk s THR 373 N -4.30 4.20 0.49 6.82 -4.23 -1.26 -4.47 115.64 112.89 3kfk s THR 373 Ca -0.12 -1.14 0.14 0.00 -1.18 0.00 0.00 61.69 59.39 3kfk s THR 373 Cb 0.01 -3.10 0.27 0.00 1.34 0.00 0.00 72.50 71.02 3kfk s THR 373 CO 0.35 -0.05 2.13 -0.08 -0.54 0.00 0.00 174.62 176.42 3kfk h GLU 374 N 2.73 0.13 0.00 3.99 4.57 -1.97 -0.75 114.58 123.27 3kfk h GLU 374 Ca -0.47 -0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 57.59 3kfk h GLU 374 Cb 1.19 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 3kfk h GLU 374 CO 0.61 0.08 -0.51 0.45 -1.18 0.00 0.00 179.01 178.47 3kfk h HIS 375 N 0.13 0.00 -0.06 0.92 3.86 -1.99 -1.89 115.15 116.12 3kfk h HIS 375 Ca 0.04 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.11 3kfk h HIS 375 Cb 0.01 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.49 3kfk h HIS 375 CO -0.00 0.51 -0.50 0.28 0.86 0.00 0.00 177.93 179.08 3kfk h VAL 376 N 0.00 1.40 -0.56 2.45 2.07 -1.60 -3.18 116.25 116.84 3kfk h VAL 376 Ca -0.01 -1.89 0.06 0.00 0.82 0.00 0.00 66.70 65.68 3kfk h VAL 376 Cb 0.95 2.36 -0.05 0.00 -1.52 0.00 0.00 31.29 33.03 3kfk h VAL 376 CO 0.07 0.56 0.27 0.40 0.02 0.00 0.00 177.57 178.88 3kfk h ILE 377 N -0.01 0.91 -0.29 4.57 2.04 -1.11 -0.35 117.51 123.27 3kfk h ILE 377 Ca -0.04 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 3kfk h ILE 377 Cb 1.17 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 3kfk h ILE 377 CO 0.10 0.09 -0.00 -0.08 0.00 0.00 0.00 178.15 178.26 3kfk h GLU 378 N 0.51 0.43 -0.13 2.37 4.81 -1.45 0.26 114.58 121.39 3kfk h GLU 378 Ca 0.26 -0.08 -0.21 0.00 -0.13 0.00 0.00 59.36 59.19 3kfk h GLU 378 Cb 0.20 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.52 3kfk h GLU 378 CO -0.20 0.47 -0.76 1.49 -0.73 0.00 0.00 179.01 179.28 3kfk h GLU 379 N 0.42 0.66 0.00 1.92 4.57 -1.36 -1.76 114.58 119.03 3kfk h GLU 379 Ca 0.09 -0.53 -0.04 0.00 -1.18 0.00 0.00 59.36 57.70 3kfk h GLU 379 Cb 0.28 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 3kfk h GLU 379 CO 0.01 1.15 -0.18 0.28 -1.18 0.00 0.00 179.01 179.09 3kfk h VAL 380 N 0.45 0.42 -0.09 0.32 2.07 -0.61 -1.77 116.25 117.04 3kfk h VAL 380 Ca -0.04 -1.09 -0.22 0.00 0.82 0.00 0.00 66.70 66.17 3kfk h VAL 380 Cb 1.37 1.79 0.01 0.00 -1.52 0.00 0.00 31.29 32.94 3kfk h VAL 380 CO 0.15 0.18 -0.79 0.00 0.02 0.00 0.00 177.57 177.13 3kfk h ALA 381 N 1.82 0.22 0.00 1.67 0.00 -0.34 -3.13 119.26 119.49 3kfk h ALA 381 Ca -0.00 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 3kfk h ALA 381 Cb 0.78 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3kfk h ALA 381 CO 0.02 0.61 -0.23 0.00 0.00 0.00 0.00 179.25 179.65 3kfk h ARG 382 N 0.38 0.00 -0.09 0.00 3.08 -1.21 -2.92 114.38 113.62 3kfk h ARG 382 Ca -0.07 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.82 3kfk h ARG 382 Cb 1.44 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.48 3kfk h ARG 382 CO 0.16 0.23 -0.61 0.00 -1.07 0.00 0.00 179.97 178.68 3kfk h ALA 383 N 1.77 0.78 -0.08 0.04 0.00 -1.38 -3.08 119.26 117.31 3kfk h ALA 383 Ca -0.00 -0.55 -0.18 0.00 0.00 0.00 0.00 54.91 54.19 3kfk h ALA 383 Cb 1.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3kfk h ALA 383 CO 0.03 0.72 -0.71 0.28 0.00 0.00 0.00 179.25 179.58 3kfk h VAL 384 N 0.24 1.39 -0.97 0.00 2.07 -1.50 -3.06 116.25 114.42 3kfk h VAL 384 Ca -0.01 -2.13 0.13 0.00 0.82 0.00 0.00 66.70 65.51 3kfk h VAL 384 Cb 1.13 2.10 -0.09 0.00 -1.52 0.00 0.00 31.29 32.92 3kfk h VAL 384 CO 0.10 0.64 0.59 0.44 0.02 0.00 0.00 177.57 179.36 3kfk h ASP 385 N 0.25 0.85 0.50 0.57 3.32 -1.43 0.21 116.42 120.69 3kfk h ASP 385 Ca -0.03 0.06 -0.19 0.00 0.02 0.00 0.00 57.03 56.89 3kfk h ASP 385 Cb 1.27 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 3kfk h ASP 385 CO 0.12 0.44 -0.83 0.44 -1.72 0.00 0.00 179.24 177.68 3kfk h ASP 386 N 0.92 0.30 0.59 6.45 5.19 -1.58 -3.09 116.42 125.20 3kfk h ASP 386 Ca 0.49 -0.23 -0.14 0.00 -0.62 0.00 0.00 57.03 56.53 3kfk h ASP 386 Cb 0.52 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 3kfk h ASP 386 CO -0.28 1.00 -0.65 0.00 -3.12 0.00 0.00 179.24 176.19 3kfk h ALA 387 N 0.98 0.90 -0.24 3.45 0.00 -1.09 -2.97 119.26 120.29 3kfk h ALA 387 Ca -0.04 -0.59 -0.17 0.00 0.00 0.00 0.00 54.91 54.11 3kfk h ALA 387 Cb 1.44 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3kfk h ALA 387 CO 0.13 0.80 -0.53 0.28 0.00 0.00 0.00 179.25 179.93 3kfk h VAL 388 N 0.04 1.29 -0.04 0.00 2.07 -0.70 -3.25 116.25 115.67 3kfk h VAL 388 Ca -0.01 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 65.78 3kfk h VAL 388 Cb 1.15 1.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 3kfk h VAL 388 CO 0.09 0.55 0.02 1.23 0.02 0.00 0.00 177.57 179.48 3kfk h GLY 389 N 0.53 0.05 1.01 2.17 0.00 -1.48 -1.55 103.07 103.81 3kfk h GLY 389 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 3kfk h GLY 389 CO 0.12 0.02 0.18 -0.39 0.00 0.00 0.00 176.54 176.47 3kfk h VAL 390 N 0.00 1.24 -0.33 4.60 -1.51 -1.64 0.12 116.25 118.73 3kfk h VAL 390 Ca 0.01 -0.84 -0.14 0.00 -1.23 0.00 0.00 66.70 64.50 3kfk h VAL 390 Cb 0.05 0.65 -0.01 0.00 -2.13 0.00 0.00 31.29 29.85 3kfk h VAL 390 CO -0.00 0.32 -0.37 0.58 -1.23 0.00 0.00 177.57 176.87 3kfk h VAL 391 N 0.86 1.28 -0.20 7.19 2.07 -1.58 -1.46 116.25 124.40 3kfk h VAL 391 Ca 0.19 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 66.10 3kfk h VAL 391 Cb 0.30 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3kfk h VAL 391 CO -0.00 0.50 -0.23 1.23 0.02 0.00 0.00 177.57 179.09 3kfk h GLY 392 N 0.92 0.39 1.89 2.17 0.00 -1.01 -2.56 103.07 104.86 3kfk h GLY 392 Ca 0.06 -0.29 -0.18 0.00 0.00 0.00 0.00 47.33 46.92 3kfk h GLY 392 CO 0.08 0.27 -0.82 0.00 0.00 0.00 0.00 176.54 176.07 3kfk h THR 394 N 0.06 1.30 -0.41 0.00 2.02 -1.09 -0.77 112.91 114.02 3kfk h THR 394 Ca -0.02 -1.66 -0.14 0.00 0.77 0.00 0.00 66.41 65.36 3kfk h THR 394 Cb 1.43 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 69.44 3kfk h THR 394 CO 0.12 0.52 -0.30 0.40 0.37 0.00 0.00 175.52 176.63 3kfk h ILE 395 N 0.49 1.27 -0.15 3.11 2.04 -1.51 0.22 117.51 122.99 3kfk h ILE 395 Ca 0.03 -1.47 -0.20 0.00 1.00 0.00 0.00 64.86 64.22 3kfk h ILE 395 Cb 0.99 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 3kfk h ILE 395 CO 0.09 0.50 -0.72 -0.33 0.00 0.00 0.00 178.15 177.69 3kfk h GLU 396 N 0.76 0.67 0.00 2.37 5.08 -1.46 -3.40 114.58 118.60 3kfk h GLU 396 Ca 0.08 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 3kfk h GLU 396 Cb 0.89 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.24 3kfk h GLU 396 CO 0.08 1.14 -0.71 -0.25 -1.00 0.00 0.00 179.01 178.28 3kfk n ASP 397 N -3.92 1.67 0.00 1.42 10.43 -0.30 -5.04 116.55 120.81 3kfk n ASP 397 Ca -0.06 0.41 0.00 0.00 2.57 0.00 0.00 54.79 57.72 3kfk n ASP 397 Cb 0.71 -0.76 0.00 0.00 1.84 0.00 0.00 41.12 42.91 3kfk n ASP 397 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3kfk n GLY 398 N 1.53 0.92 2.85 0.44 0.00 0.07 -5.06 105.19 105.95 3kfk n GLY 398 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 3kfk n GLY 398 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kfk s ARG 399 N 0.00 1.10 0.14 1.61 0.52 -1.26 0.15 118.95 121.20 3kfk s ARG 399 Ca 0.00 -0.10 0.06 0.00 -0.52 0.00 0.00 55.73 55.17 3kfk s ARG 399 Cb 0.00 -1.27 -0.04 0.00 0.52 0.00 0.00 34.95 34.17 3kfk s ARG 399 CO 0.00 -0.25 -0.14 0.96 0.02 0.00 0.00 175.30 175.89 3kfk s ILE 400 N 1.71 1.39 0.12 1.52 -4.36 -0.18 -2.09 121.20 119.31 3kfk s ILE 400 Ca 0.03 -1.82 0.05 0.00 -0.26 0.00 0.00 60.65 58.65 3kfk s ILE 400 Cb -0.13 -1.64 -0.04 0.00 1.25 0.00 0.00 42.46 41.90 3kfk s ILE 400 CO -0.06 -0.47 -0.13 0.68 0.24 0.00 0.00 174.94 175.21 3kfk s VAL 401 N -2.36 1.21 0.14 8.37 -7.23 0.27 -0.43 120.40 120.38 3kfk s VAL 401 Ca 0.12 -1.73 -0.31 0.00 -1.81 0.00 0.00 61.98 58.25 3kfk s VAL 401 Cb -0.04 -1.51 -0.08 0.00 0.56 0.00 0.00 36.38 35.32 3kfk s VAL 401 CO 0.03 -0.48 1.30 -0.94 -0.31 0.00 0.00 175.10 174.70 3kfk s SER 402 N -2.51 6.93 0.32 4.85 1.04 -1.26 -0.29 113.70 122.77 3kfk s SER 402 Ca 0.09 2.27 0.00 0.00 0.48 0.00 0.00 55.95 58.79 3kfk s SER 402 Cb -0.04 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.49 3kfk s SER 402 CO 0.02 -0.54 0.03 0.61 0.98 0.00 0.00 173.24 174.34 3kfk n GLY 403 N 2.91 1.00 2.21 7.32 0.00 -0.88 -3.33 105.19 114.43 3kfk n GLY 403 Ca 0.08 -1.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.02 3kfk n GLY 403 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kfk n GLY 404 N 4.75 0.05 2.72 -0.02 0.00 -1.26 -3.42 105.19 108.01 3kfk n GLY 404 Ca 0.01 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 3kfk n GLY 404 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kfk n GLY 405 N -1.03 0.07 0.12 -0.02 0.00 -1.26 -2.94 105.19 100.12 3kfk n GLY 405 Ca -0.09 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 3kfk n GLY 405 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3kfk n SER 406 N -1.13 1.92 0.10 1.61 2.88 -1.22 -4.28 113.62 113.50 3kfk n SER 406 Ca 0.00 0.38 0.12 0.00 -1.33 0.00 0.00 58.87 58.04 3kfk n SER 406 Cb 0.54 -0.87 0.45 0.00 -0.75 0.00 0.00 64.21 63.58 3kfk n SER 406 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3kfk n THR 407 N -4.34 0.69 0.16 2.46 -2.24 -1.21 -2.95 114.28 106.84 3kfk n THR 407 Ca -0.43 -0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.36 3kfk n THR 407 Cb 0.78 -0.87 0.24 0.00 -2.10 0.00 0.00 70.33 68.38 3kfk n THR 407 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3kfk h GLU 408 N 0.00 0.00 0.23 -0.78 3.07 -1.88 -2.19 114.58 113.02 3kfk h GLU 408 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.52 3kfk h GLU 408 Cb 0.52 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.46 3kfk h GLU 408 CO 0.00 0.53 -1.57 0.28 -1.40 0.00 0.00 179.01 176.85 3kfk h VAL 409 N 0.00 1.15 -0.68 3.13 2.07 -1.71 -3.00 116.25 117.22 3kfk h VAL 409 Ca -0.01 -2.62 -0.02 0.00 0.82 0.00 0.00 66.70 64.87 3kfk h VAL 409 Cb 1.00 2.94 -0.03 0.00 -1.52 0.00 0.00 31.29 33.68 3kfk h VAL 409 CO 0.07 0.82 0.33 -0.08 0.02 0.00 0.00 177.57 178.73 3kfk h GLU 410 N 0.11 0.97 0.00 1.57 4.57 -1.54 -2.29 114.58 117.96 3kfk h GLU 410 Ca -0.29 -0.14 -0.12 0.00 -1.18 0.00 0.00 59.36 57.63 3kfk h GLU 410 Cb 2.13 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 30.52 3kfk h GLU 410 CO 0.23 0.76 -0.58 1.25 -1.18 0.00 0.00 179.01 179.50 3kfk h LEU 411 N 0.94 0.00 -0.26 1.64 5.85 -1.53 -2.91 115.31 119.03 3kfk h LEU 411 Ca 0.23 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.82 3kfk h LEU 411 Cb 0.11 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 3kfk h LEU 411 CO -0.03 0.58 -0.34 -1.28 -0.34 0.00 0.00 178.44 177.03 3kfk h SER 412 N 0.00 0.75 1.00 1.25 0.87 -1.33 -2.73 113.55 113.37 3kfk h SER 412 Ca -0.01 -0.50 -0.12 0.00 -1.23 0.00 0.00 61.79 59.93 3kfk h SER 412 Cb 1.10 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.83 3kfk h SER 412 CO 0.08 1.10 -0.58 0.00 -0.53 0.00 0.00 176.83 176.90 3kfk h MET 413 N 0.42 0.00 0.00 2.24 -0.00 -1.47 -2.92 114.93 113.19 3kfk h MET 413 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.73 3kfk h MET 413 Cb 0.92 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.52 3kfk h MET 413 CO 0.08 0.58 0.00 0.87 -0.00 0.00 0.00 176.91 178.44 3kfk h LYS 414 N 0.00 0.00 0.00 -0.10 1.79 -1.52 -3.14 116.57 113.59 3kfk h LYS 414 Ca -0.01 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.42 3kfk h LYS 414 Cb 1.24 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.88 3kfk h LYS 414 CO 0.08 0.00 -1.40 1.28 -1.08 0.00 0.00 179.45 178.33 3kfk n LEU 415 N -3.07 0.59 0.03 2.94 4.77 -1.03 -3.00 117.00 118.23 3kfk n LEU 415 Ca 0.04 0.23 -0.13 0.00 -0.03 0.00 0.00 56.01 56.12 3kfk n LEU 415 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 3kfk n LEU 415 CO 0.34 -0.06 0.29 0.03 -1.33 0.00 0.00 177.39 176.66 3kfk h ARG 416 N 0.00 0.52 0.00 3.23 3.08 -1.55 -0.50 114.38 119.16 3kfk h ARG 416 Ca -0.05 -0.45 -0.07 0.00 0.07 0.00 0.00 59.98 59.48 3kfk h ARG 416 Cb 1.14 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 3kfk h ARG 416 CO 0.01 1.08 -0.32 1.05 -1.07 0.00 0.00 179.97 180.72 3kfk h GLU 417 N 0.34 0.00 -0.05 0.04 4.11 -1.70 -2.81 114.58 114.51 3kfk h GLU 417 Ca -0.05 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.22 3kfk h GLU 417 Cb 1.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 3kfk h GLU 417 CO 0.14 0.32 -0.67 -0.92 0.07 0.00 0.00 179.01 177.96 3kfk h TYR 418 N 0.00 0.31 -0.03 2.06 3.20 -1.44 -3.13 116.97 117.94 3kfk h TYR 418 Ca -0.00 -0.13 -0.09 0.00 3.14 0.00 0.00 58.73 61.65 3kfk h TYR 418 Cb 1.07 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 3kfk h TYR 418 CO 0.00 0.83 -0.39 0.00 -1.64 0.00 0.00 178.16 176.96 3kfk h ALA 419 N 1.14 1.29 -0.09 1.82 0.00 -0.91 -3.05 119.26 119.46 3kfk h ALA 419 Ca -0.01 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 3kfk h ALA 419 Cb 1.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3kfk h ALA 419 CO 0.10 0.52 0.00 0.93 0.00 0.00 0.00 179.25 180.80 3kfk h GLU 420 N 0.05 0.12 -0.66 0.00 5.08 -1.44 -2.04 114.58 115.70 3kfk h GLU 420 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3kfk h GLU 420 Cb 0.72 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3kfk h GLU 420 CO 0.05 0.14 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 3kfk n GLY 421 N -1.36 1.89 3.24 -3.84 0.00 -1.15 -4.82 105.19 99.14 3kfk n GLY 421 Ca -0.02 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 3kfk n GLY 421 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kfk s ILE 422 N -1.81 2.69 -0.08 -0.61 1.01 -0.77 -5.12 121.20 116.51 3kfk s ILE 422 Ca 0.29 -0.75 -0.11 0.00 0.00 0.00 0.00 60.65 60.09 3kfk s ILE 422 Cb 0.20 -2.16 -0.05 0.00 0.01 0.00 0.00 42.46 40.47 3kfk s ILE 422 CO 0.12 0.50 0.27 -0.94 0.00 0.00 0.00 174.94 174.89 3kfk s SER 423 N 1.07 6.56 0.00 3.58 1.04 -1.26 -4.66 113.70 120.02 3kfk s SER 423 Ca -0.00 0.66 0.00 0.00 0.48 0.00 0.00 55.95 57.09 3kfk s SER 423 Cb -0.15 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 63.82 3kfk s SER 423 CO -0.04 0.33 0.00 0.61 0.98 0.00 0.00 173.24 175.12 3kfk n GLY 424 N 2.15 0.24 0.03 7.32 0.00 -1.26 -4.74 105.19 108.93 3kfk n GLY 424 Ca -0.16 -2.30 0.12 0.00 0.00 0.00 0.00 46.02 43.68 3kfk n GLY 424 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kfk n ARG 425 N 0.00 0.13 0.17 1.61 0.63 -1.26 -3.63 116.66 114.32 3kfk n ARG 425 Ca 0.00 0.04 0.14 0.00 -0.92 0.00 0.00 57.85 57.11 3kfk n ARG 425 Cb 0.00 -1.59 0.53 0.00 0.45 0.00 0.00 32.46 31.85 3kfk n ARG 425 CO 0.00 0.00 0.00 1.05 -2.51 0.00 0.00 177.63 176.17 3kfk h GLU 426 N 0.00 0.00 -0.51 -0.14 4.11 -1.85 -3.03 114.58 113.15 3kfk h GLU 426 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 3kfk h GLU 426 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3kfk h GLU 426 CO 0.00 0.00 0.29 0.37 0.07 0.00 0.00 179.01 179.74 3kfk h GLN 427 N 0.00 0.71 0.00 1.06 4.15 -1.83 -2.69 115.11 116.50 3kfk h GLN 427 Ca 0.00 -0.08 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 3kfk h GLN 427 Cb 0.46 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.00 3kfk h GLN 427 CO 0.00 0.54 -0.14 -0.07 -1.93 0.00 0.00 178.83 177.22 3kfk h LEU 428 N 0.68 0.00 -0.37 -2.39 3.38 -1.78 0.12 115.31 114.94 3kfk h LEU 428 Ca 0.18 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.96 3kfk h LEU 428 Cb 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3kfk h LEU 428 CO -0.03 0.14 -0.75 0.00 0.09 0.00 0.00 178.44 177.90 3kfk h ALA 429 N 1.86 0.56 -0.11 1.53 0.00 -1.62 -1.56 119.26 119.92 3kfk h ALA 429 Ca -0.00 -0.61 -0.20 0.00 0.00 0.00 0.00 54.91 54.10 3kfk h ALA 429 Cb 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3kfk h ALA 429 CO 0.02 0.76 -0.74 0.28 0.00 0.00 0.00 179.25 179.57 3kfk h VAL 430 N 0.29 1.34 -0.62 0.00 2.07 -0.97 -1.44 116.25 116.93 3kfk h VAL 430 Ca -0.03 -2.07 -0.07 0.00 0.82 0.00 0.00 66.70 65.35 3kfk h VAL 430 Cb 1.33 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 33.12 3kfk h VAL 430 CO 0.13 0.63 0.13 0.03 0.02 0.00 0.00 177.57 178.51 3kfk h ARG 431 N 0.38 1.01 0.00 1.57 3.08 -0.81 -0.66 114.38 118.95 3kfk h ARG 431 Ca -0.04 -0.26 -0.09 0.00 0.07 0.00 0.00 59.98 59.66 3kfk h ARG 431 Cb 1.33 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3kfk h ARG 431 CO 0.14 0.93 -0.44 0.00 -1.07 0.00 0.00 179.97 179.53 3kfk h ALA 432 N 1.04 1.05 -0.30 0.04 0.00 -1.27 -0.88 119.26 118.94 3kfk h ALA 432 Ca 0.19 -0.40 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 3kfk h ALA 432 Cb 0.39 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3kfk h ALA 432 CO 0.01 0.55 -0.52 0.35 0.00 0.00 0.00 179.25 179.64 3kfk h PHE 433 N 0.00 1.06 0.03 0.00 3.57 -0.92 -2.58 116.94 118.11 3kfk h PHE 433 Ca -0.00 -0.37 -0.23 0.00 3.53 0.00 0.00 57.97 60.90 3kfk h PHE 433 Cb 0.91 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 3kfk h PHE 433 CO 0.00 1.19 -0.98 0.00 -2.23 0.00 0.00 178.31 176.29 3kfk h ALA 434 N 0.74 0.36 0.00 2.41 0.00 -0.99 -3.16 119.26 118.62 3kfk h ALA 434 Ca 0.02 -0.75 -0.02 0.00 0.00 0.00 0.00 54.91 54.16 3kfk h ALA 434 Cb 1.12 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3kfk h ALA 434 CO 0.12 0.88 -0.11 -0.44 0.00 0.00 0.00 179.25 179.69 3kfk h ASP 435 N 0.16 0.00 1.73 0.00 5.19 -1.21 -2.86 116.42 119.43 3kfk h ASP 435 Ca -0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 3kfk h ASP 435 Cb 1.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.14 3kfk h ASP 435 CO 0.16 0.11 0.00 0.00 -3.12 0.00 0.00 179.24 176.39 3kfk h ALA 436 N 1.89 1.00 0.00 3.45 0.00 -1.42 -3.26 119.26 120.92 3kfk h ALA 436 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kfk h ALA 436 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3kfk h ALA 436 CO 0.01 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.19 3kfk h LEU 437 N 0.00 0.00 -1.31 0.00 3.38 -1.50 -3.11 115.31 112.77 3kfk h LEU 437 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3kfk h LEU 437 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3kfk h LEU 437 CO 0.00 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.91 3kfk n GLU 438 N -2.49 1.87 0.07 1.13 1.02 -1.23 -4.11 120.64 116.90 3kfk n GLU 438 Ca 0.03 -1.18 -0.16 0.00 -0.02 0.00 0.00 57.16 55.83 3kfk n GLU 438 Cb 0.33 -1.33 -0.08 0.00 -0.02 0.00 0.00 31.44 30.34 3kfk n GLU 438 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 3kfk h VAL 439 N 1.84 1.36 -0.07 2.62 3.04 -1.78 -3.00 116.25 120.26 3kfk h VAL 439 Ca 0.00 -2.44 -0.01 0.00 -1.01 0.00 0.00 66.70 63.25 3kfk h VAL 439 Cb 0.53 2.47 -0.00 0.00 -2.01 0.00 0.00 31.29 32.28 3kfk h VAL 439 CO 0.03 0.73 0.01 0.40 -1.01 0.00 0.00 177.57 177.73 3kfk h ILE 440 N 0.27 1.22 0.00 3.17 1.08 -1.84 0.84 117.51 122.24 3kfk h ILE 440 Ca -0.11 -0.67 -0.04 0.00 -0.39 0.00 0.00 64.86 63.65 3kfk h ILE 440 Cb 1.68 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 36.96 3kfk h ILE 440 CO 0.19 0.19 -0.17 -0.65 -0.69 0.00 0.00 178.15 177.02 3kfk h PRO 441 N -0.13 0.00 -0.07 2.37 0.11 -1.83 -1.77 132.00 130.69 3kfk h PRO 441 Ca 0.02 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.91 3kfk h PRO 441 Cb 0.29 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.41 3kfk h PRO 441 CO 0.00 0.17 -0.83 -0.09 -0.21 0.00 0.00 178.00 177.04 3kfk h ARG 442 N 0.00 0.68 0.00 1.05 2.43 -1.34 -3.24 114.38 113.96 3kfk h ARG 442 Ca -0.00 -0.64 -0.07 0.00 -0.81 0.00 0.00 59.98 58.46 3kfk h ARG 442 Cb 0.43 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3kfk h ARG 442 CO 0.02 1.24 -0.34 1.79 -1.51 0.00 0.00 179.97 181.17 3kfk h THR 443 N 0.35 0.73 0.00 0.20 1.35 -0.66 -2.61 112.91 112.27 3kfk h THR 443 Ca -0.08 -1.53 -0.06 0.00 -0.55 0.00 0.00 66.41 64.18 3kfk h THR 443 Cb 1.48 1.99 -0.01 0.00 -1.73 0.00 0.00 68.15 69.88 3kfk h THR 443 CO 0.17 0.33 -0.29 -0.07 -0.25 0.00 0.00 175.52 175.41 3kfk h LEU 444 N 0.00 0.00 0.00 3.87 3.38 -1.37 -2.66 115.31 118.53 3kfk h LEU 444 Ca -0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 3kfk h LEU 444 Cb 0.97 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.68 3kfk h LEU 444 CO 0.04 0.29 -1.36 0.00 0.09 0.00 0.00 178.44 177.50 3kfk h ALA 445 N 1.71 0.61 -0.87 1.53 0.00 -1.55 -3.13 119.26 117.55 3kfk h ALA 445 Ca -0.00 -1.15 -0.02 0.00 0.00 0.00 0.00 54.91 53.74 3kfk h ALA 445 Cb 0.60 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 3kfk h ALA 445 CO 0.04 1.35 0.48 0.93 0.00 0.00 0.00 179.25 182.05 3kfk h GLU 446 N 0.00 1.21 0.00 0.00 5.08 -1.14 -2.54 114.58 117.19 3kfk h GLU 446 Ca -0.16 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3kfk h GLU 446 Cb 1.85 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.86 3kfk h GLU 446 CO 0.09 0.88 -0.81 0.09 -1.00 0.00 0.00 179.01 178.27 3kfk n ASN 447 N -4.34 0.66 0.10 1.42 3.02 -1.04 -4.22 115.26 110.86 3kfk n ASN 447 Ca 0.09 -0.01 -0.23 0.00 -0.03 0.00 0.00 54.58 54.41 3kfk n ASN 447 Cb 0.09 0.44 -0.13 0.00 -0.61 0.00 0.00 39.78 39.57 3kfk n ASN 447 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kfk h ALA 448 N 2.50 -0.03 0.00 5.41 0.00 -1.44 -3.43 119.26 122.27 3kfk h ALA 448 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.12 3kfk h ALA 448 Cb 0.75 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3kfk h ALA 448 CO 0.00 0.69 0.00 0.41 0.00 0.00 0.00 179.25 180.35 3kfk n GLY 449 N 1.43 1.39 3.85 0.00 0.00 -0.98 -5.05 105.19 105.83 3kfk n GLY 449 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 3kfk n GLY 449 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kfk s LEU 450 N 0.00 2.82 0.08 0.99 1.02 -1.20 -5.00 118.68 117.39 3kfk s LEU 450 Ca 0.00 1.22 -0.31 0.00 0.02 0.00 0.00 54.13 55.06 3kfk s LEU 450 Cb 0.00 -3.97 -0.07 0.00 0.02 0.00 0.00 46.19 42.17 3kfk s LEU 450 CO 0.00 -1.54 1.34 -0.62 0.02 0.00 0.00 176.35 175.54 3kfk s ASP 451 N -4.17 6.90 0.00 2.29 3.68 -1.26 -4.40 116.67 119.70 3kfk s ASP 451 Ca 0.59 2.21 0.30 0.00 2.13 0.00 0.00 52.55 57.78 3kfk s ASP 451 Cb -0.12 -2.58 1.44 0.00 -1.45 0.00 0.00 42.92 40.20 3kfk s ASP 451 CO 0.53 -0.61 2.01 0.00 0.13 0.00 0.00 175.17 177.22 3kfk n ALA 452 N 4.15 2.52 -0.09 3.66 0.00 -1.26 -3.41 120.51 126.08 3kfk n ALA 452 Ca 0.11 -0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.27 3kfk n ALA 452 Cb 0.44 -1.46 -0.15 0.00 0.00 0.00 0.00 19.45 18.28 3kfk n ALA 452 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3kfk n ILE 453 N -1.28 1.47 -0.01 0.00 5.41 -1.26 -4.08 119.36 119.61 3kfk n ILE 453 Ca 0.13 -0.78 -0.17 0.00 1.00 0.00 0.00 62.75 62.94 3kfk n ILE 453 Cb 0.26 -0.83 -0.13 0.00 -0.71 0.00 0.00 39.64 38.23 3kfk n ILE 453 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3kfk h GLU 454 N 0.00 0.18 -0.07 0.38 4.57 -1.98 -3.34 114.58 114.32 3kfk h GLU 454 Ca -0.51 -0.25 -0.13 0.00 -1.18 0.00 0.00 59.36 57.29 3kfk h GLU 454 Cb 2.12 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 30.79 3kfk h GLU 454 CO 0.02 1.06 -0.55 0.82 -1.18 0.00 0.00 179.01 179.17 3kfk h ILE 455 N -0.58 1.37 -0.00 2.32 2.04 -1.81 -2.89 117.51 117.97 3kfk h ILE 455 Ca -0.06 -1.86 0.00 0.00 1.00 0.00 0.00 64.86 63.94 3kfk h ILE 455 Cb 1.23 1.93 -0.00 0.00 -0.74 0.00 0.00 36.82 39.23 3kfk h ILE 455 CO 0.07 0.55 0.02 0.25 0.00 0.00 0.00 178.15 179.04 3kfk h LEU 456 N 0.16 0.00 0.09 1.44 5.85 -1.71 -1.35 115.31 119.79 3kfk h LEU 456 Ca 0.00 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.35 3kfk h LEU 456 Cb 1.02 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 3kfk h LEU 456 CO 0.08 0.00 -2.08 0.52 -0.34 0.00 0.00 178.44 176.62 3kfk n VAL 457 N -3.18 1.71 -0.24 1.05 0.31 -1.11 -3.78 118.33 113.09 3kfk n VAL 457 Ca -0.03 -0.65 -0.06 0.00 -0.01 0.00 0.00 64.34 63.59 3kfk n VAL 457 Cb 0.09 -1.61 0.04 0.00 -0.91 0.00 0.00 33.84 31.46 3kfk n VAL 457 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3kfk h LYS 458 N 0.05 0.93 0.03 5.55 1.57 -1.09 -1.74 116.57 121.87 3kfk h LYS 458 Ca -0.45 -0.11 -0.24 0.00 -1.87 0.00 0.00 60.65 57.97 3kfk h LYS 458 Cb 2.01 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 34.15 3kfk h LYS 458 CO 0.05 0.71 -1.02 0.28 -0.57 0.00 0.00 179.45 178.90 3kfk h VAL 459 N 0.91 1.38 -0.80 0.50 2.07 -1.56 -2.94 116.25 115.80 3kfk h VAL 459 Ca 0.23 -2.48 -0.03 0.00 0.82 0.00 0.00 66.70 65.25 3kfk h VAL 459 Cb 0.05 2.49 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 3kfk h VAL 459 CO -0.04 0.74 0.39 -0.09 0.02 0.00 0.00 177.57 178.60 3kfk h ARG 460 N 0.25 1.15 0.00 1.57 2.43 -1.61 -2.13 114.38 116.03 3kfk h ARG 460 Ca -0.10 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 58.85 3kfk h ARG 460 Cb 1.67 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 31.00 3kfk h ARG 460 CO 0.18 0.88 -0.26 0.00 -1.51 0.00 0.00 179.97 179.26 3kfk h ALA 461 N 1.29 0.88 -0.29 2.80 0.00 -1.39 -3.16 119.26 119.39 3kfk h ALA 461 Ca 0.28 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3kfk h ALA 461 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3kfk h ALA 461 CO -0.04 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.54 3kfk n ALA 462 N -2.18 2.46 0.09 0.00 0.00 -0.83 -3.64 120.51 116.42 3kfk n ALA 462 Ca 0.02 -0.55 0.04 0.00 0.00 0.00 0.00 53.44 52.95 3kfk n ALA 462 Cb 0.56 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 3kfk n ALA 462 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3kfk n HIS 463 N 0.40 0.00 -0.66 0.00 -0.00 -1.05 -1.72 115.22 112.19 3kfk n HIS 463 Ca 0.12 0.00 -0.31 0.00 -0.00 0.00 0.00 57.72 57.53 3kfk n HIS 463 Cb 0.28 -0.14 0.17 0.00 -0.00 0.00 0.00 29.99 30.30 3kfk n HIS 463 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3kfk n ALA 464 N -1.64 -1.16 -0.87 -1.41 0.00 -1.24 -4.43 120.51 109.76 3kfk n ALA 464 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3kfk n ALA 464 Cb 0.19 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.50 3kfk n ALA 464 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3kfk n SER 465 N -4.08 0.00 0.00 0.00 3.41 -1.26 -4.01 113.62 107.68 3kfk n SER 465 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 3kfk n SER 465 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3kfk n SER 465 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3kfk n ASN 466 N 3.03 0.00 -4.78 4.04 4.13 -1.26 -5.09 115.26 115.32 3kfk n ASN 466 Ca 0.00 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.94 3kfk n ASN 466 Cb 0.00 -0.01 0.05 0.00 -1.54 0.00 0.00 39.78 38.27 3kfk n ASN 466 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 3kfk s GLY 467 N -2.08 2.04 -0.17 7.41 0.00 -1.26 -4.39 107.32 108.87 3kfk s GLY 467 Ca 0.00 0.44 0.14 0.00 0.00 0.00 0.00 44.72 45.29 3kfk s GLY 467 CO 0.00 0.78 0.04 0.70 0.00 0.00 0.00 173.10 174.62 3kfk n ASN 468 N -2.57 1.03 0.00 1.64 3.02 -0.70 -3.67 115.26 114.01 3kfk n ASN 468 Ca 0.10 -0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 3kfk n ASN 468 Cb 0.52 0.81 0.00 0.00 -0.61 0.00 0.00 39.78 40.51 3kfk n ASN 468 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3kfk n LYS 469 N -2.65 0.00 -0.24 3.52 4.81 -1.26 -4.63 118.16 117.71 3kfk n LYS 469 Ca -0.28 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.23 3kfk n LYS 469 Cb 1.03 -0.26 0.17 0.00 0.02 0.00 0.00 35.03 35.99 3kfk n LYS 469 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3kfk s ALA 471 N -1.89 3.35 0.34 0.00 0.00 -1.26 -0.40 121.76 121.90 3kfk s ALA 471 Ca 0.28 0.27 -0.04 0.00 0.00 0.00 0.00 51.96 52.47 3kfk s ALA 471 Cb 0.20 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 20.09 3kfk s ALA 471 CO 0.09 -0.40 0.49 0.20 0.00 0.00 0.00 175.76 176.14 3kfk s GLY 472 N 1.02 1.37 -0.22 0.00 0.00 -0.53 -4.44 107.32 104.52 3kfk s GLY 472 Ca 0.44 -1.44 -0.16 0.00 0.00 0.00 0.00 44.72 43.55 3kfk s GLY 472 CO 0.19 -0.94 0.42 -2.27 0.00 0.00 0.00 173.10 170.50 3kfk s LEU 473 N -3.21 4.13 -0.38 0.66 2.96 -1.15 -1.31 118.68 120.37 3kfk s LEU 473 Ca 0.29 0.51 -0.15 0.00 -0.22 0.00 0.00 54.13 54.56 3kfk s LEU 473 Cb -0.01 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.14 3kfk s LEU 473 CO 0.19 -0.13 0.34 0.21 -1.32 0.00 0.00 176.35 175.64 3kfk s ASN 474 N 1.19 6.14 0.50 3.68 2.47 -1.25 -4.83 114.94 122.84 3kfk s ASN 474 Ca 0.19 -0.56 0.27 0.00 0.42 0.00 0.00 52.86 53.19 3kfk s ASN 474 Cb -0.15 -2.18 1.32 0.00 -1.45 0.00 0.00 41.25 38.79 3kfk s ASN 474 CO 0.09 -0.41 2.00 -0.37 -3.72 0.00 0.00 177.10 174.69 3kfk h VAL 475 N 5.60 0.50 0.19 -5.21 -1.51 -1.91 0.63 116.25 114.54 3kfk h VAL 475 Ca -0.29 -0.70 -0.34 0.00 -1.23 0.00 0.00 66.70 64.15 3kfk h VAL 475 Cb 1.13 1.47 0.02 0.00 -2.13 0.00 0.00 31.29 31.78 3kfk h VAL 475 CO 0.72 0.14 -1.63 -0.26 -1.23 0.00 0.00 177.57 175.31 3kfk h PHE 476 N 0.00 0.74 0.04 5.19 0.04 -1.97 -3.37 116.94 117.61 3kfk h PHE 476 Ca -0.00 -0.54 -0.13 0.00 2.80 0.00 0.00 57.97 60.10 3kfk h PHE 476 Cb 0.46 -0.03 0.01 0.00 2.20 0.00 0.00 35.95 38.59 3kfk h PHE 476 CO 0.00 1.63 -0.52 1.15 -0.60 0.00 0.00 178.31 179.97 3kfk h THR 477 N 0.05 1.52 0.00 -1.55 2.02 -1.96 -3.48 112.91 109.50 3kfk h THR 477 Ca -0.32 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 64.66 3kfk h THR 477 Cb 2.06 2.89 0.00 0.00 -1.74 0.00 0.00 68.15 71.36 3kfk h THR 477 CO 0.19 0.62 0.00 0.61 0.37 0.00 0.00 175.52 177.31 3kfk n GLY 478 N 1.29 3.07 3.84 2.16 0.00 0.20 -5.05 105.19 110.69 3kfk n GLY 478 Ca -0.11 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 3kfk n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kfk s ALA 479 N -0.10 3.01 -0.03 4.61 0.00 -1.26 -4.77 121.76 123.23 3kfk s ALA 479 Ca 0.00 0.16 -0.30 0.00 0.00 0.00 0.00 51.96 51.82 3kfk s ALA 479 Cb 0.00 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 3kfk s ALA 479 CO 0.00 -0.43 1.50 0.54 0.00 0.00 0.00 175.76 177.37 3kfk s VAL 480 N -2.72 3.63 0.23 0.00 0.11 -1.26 -3.95 120.40 116.44 3kfk s VAL 480 Ca 0.59 0.93 0.08 0.00 -2.93 0.00 0.00 61.98 60.65 3kfk s VAL 480 Cb -0.11 -3.60 -0.05 0.00 -1.53 0.00 0.00 36.38 31.09 3kfk s VAL 480 CO 0.37 -0.04 -0.14 -1.61 -3.33 0.00 0.00 175.10 170.36 3kfk s GLU 481 N 3.08 1.41 -0.25 1.54 2.02 -0.43 -4.95 118.70 121.12 3kfk s GLU 481 Ca 0.67 -1.65 -0.29 0.00 0.02 0.00 0.00 54.97 53.73 3kfk s GLU 481 Cb -0.32 -1.21 -0.00 0.00 0.10 0.00 0.00 34.13 32.70 3kfk s GLU 481 CO 0.27 0.18 1.29 0.34 0.02 0.00 0.00 175.26 177.36 3kfk s ASP 482 N -3.36 6.77 0.47 -0.19 -1.08 -1.26 -1.45 116.67 116.56 3kfk s ASP 482 Ca 0.25 1.40 0.26 0.00 -0.52 0.00 0.00 52.55 53.93 3kfk s ASP 482 Cb -0.00 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 39.81 3kfk s ASP 482 CO 0.09 -0.96 1.81 0.24 0.52 0.00 0.00 175.17 176.86 3kfk h MET 483 N 8.90 0.00 -0.33 4.34 2.86 -1.05 -2.86 114.93 126.79 3kfk h MET 483 Ca -0.26 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.24 3kfk h MET 483 Cb 1.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 3kfk h MET 483 CO 1.01 0.13 -0.35 0.00 1.06 0.00 0.00 176.91 178.75 3kfk h GLU 485 N 0.62 0.00 0.00 0.00 5.08 -1.91 -3.31 114.58 115.06 3kfk h GLU 485 Ca 0.06 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.24 3kfk h GLU 485 Cb 0.89 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 3kfk h GLU 485 CO 0.08 0.19 -0.82 -0.91 -1.00 0.00 0.00 179.01 176.55 3kfk h ASN 486 N 0.00 0.08 0.00 1.42 4.21 -1.45 -3.48 115.58 116.36 3kfk h ASN 486 Ca -0.02 -0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.42 3kfk h ASN 486 Cb 1.20 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.38 3kfk h ASN 486 CO 0.03 0.86 0.00 0.61 -1.29 0.00 0.00 177.43 177.64 3kfk n GLY 487 N 0.79 0.96 3.35 2.83 0.00 -1.07 -5.05 105.19 107.01 3kfk n GLY 487 Ca -0.02 -0.06 -0.46 0.00 0.00 0.00 0.00 46.02 45.48 3kfk n GLY 487 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kfk s VAL 488 N -2.00 5.33 -0.00 1.61 1.01 -1.01 -4.44 120.40 120.90 3kfk s VAL 488 Ca 0.00 -2.05 0.03 0.00 0.00 0.00 0.00 61.98 59.96 3kfk s VAL 488 Cb 0.00 -4.51 -0.01 0.00 0.00 0.00 0.00 36.38 31.86 3kfk s VAL 488 CO 0.00 -1.10 -0.10 0.68 0.00 0.00 0.00 175.10 174.58 3kfk s VAL 489 N 1.03 0.76 0.07 2.92 -7.23 -1.26 -2.06 120.40 114.63 3kfk s VAL 489 Ca 0.18 -0.47 0.07 0.00 -1.81 0.00 0.00 61.98 59.95 3kfk s VAL 489 Cb -0.13 -0.65 -0.03 0.00 0.56 0.00 0.00 36.38 36.13 3kfk s VAL 489 CO -0.06 0.17 -0.19 -1.61 -0.31 0.00 0.00 175.10 173.09 3kfk s GLU 490 N -0.35 1.17 0.72 4.82 2.02 0.60 -4.72 118.70 122.95 3kfk s GLU 490 Ca 0.03 -1.02 -0.16 0.00 0.02 0.00 0.00 54.97 53.84 3kfk s GLU 490 Cb -0.04 -1.33 0.03 0.00 0.10 0.00 0.00 34.13 32.89 3kfk s GLU 490 CO -0.00 0.32 1.23 -2.14 0.02 0.00 0.00 175.26 174.69 3kfk s PRO 491 N -1.56 2.19 0.45 0.39 0.02 -1.26 0.97 135.00 136.20 3kfk s PRO 491 Ca 0.05 1.85 0.18 0.00 0.02 0.00 0.00 61.00 63.10 3kfk s PRO 491 Cb -0.09 -1.83 1.04 0.00 0.02 0.00 0.00 34.50 33.64 3kfk s PRO 491 CO 0.03 -1.82 1.96 1.25 -0.33 0.00 0.00 177.00 178.09 3kfk h LEU 492 N -0.13 0.00 -1.48 -5.54 5.85 -1.72 -2.62 115.31 109.67 3kfk h LEU 492 Ca -0.48 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 3kfk h LEU 492 Cb 1.31 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 3kfk h LEU 492 CO 0.50 0.23 -0.21 -0.09 -0.34 0.00 0.00 178.44 178.53 3kfk h ARG 493 N 0.00 0.00 -0.21 1.25 2.43 -1.91 -0.19 114.38 115.75 3kfk h ARG 493 Ca -0.00 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.08 3kfk h ARG 493 Cb 0.45 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3kfk h ARG 493 CO 0.03 0.21 -0.23 0.28 -1.51 0.00 0.00 179.97 178.75 3kfk h VAL 494 N 0.00 1.25 0.07 0.20 2.07 -1.77 -2.62 116.25 115.45 3kfk h VAL 494 Ca -0.00 -1.17 -0.37 0.00 0.82 0.00 0.00 66.70 65.98 3kfk h VAL 494 Cb 0.56 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.64 3kfk h VAL 494 CO 0.03 0.37 -2.17 0.29 0.02 0.00 0.00 177.57 176.11 3kfk n LYS 495 N -4.15 0.71 -0.07 1.57 4.76 -0.98 -3.78 118.16 116.22 3kfk n LYS 495 Ca -0.00 0.22 -0.12 0.00 -2.87 0.00 0.00 58.31 55.53 3kfk n LYS 495 Cb 0.37 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 3kfk n LYS 495 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 3kfk h THR 496 N 0.04 1.28 -0.24 -0.18 1.35 -1.13 -2.69 112.91 111.35 3kfk h THR 496 Ca -0.48 -1.67 -0.12 0.00 -0.55 0.00 0.00 66.41 63.60 3kfk h THR 496 Cb 1.99 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.97 3kfk h THR 496 CO 0.02 0.54 -0.30 -0.61 -0.25 0.00 0.00 175.52 174.92 3kfk h GLN 497 N 0.63 0.63 -0.48 4.72 5.75 -1.69 -2.78 115.11 121.89 3kfk h GLN 497 Ca 0.03 -0.36 -0.03 0.00 -0.15 0.00 0.00 58.65 58.15 3kfk h GLN 497 Cb 1.06 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.61 3kfk h GLN 497 CO 0.10 0.96 0.18 0.00 -2.65 0.00 0.00 178.83 177.42 3kfk h ALA 498 N 0.66 1.41 -0.05 3.38 0.00 -1.65 0.22 119.26 123.23 3kfk h ALA 498 Ca 0.03 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3kfk h ALA 498 Cb 0.88 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3kfk h ALA 498 CO 0.07 0.45 -0.32 0.82 0.00 0.00 0.00 179.25 180.27 3kfk h ILE 499 N 0.69 1.45 -0.26 0.00 2.04 -1.53 -2.82 117.51 117.08 3kfk h ILE 499 Ca 0.17 -1.79 -0.11 0.00 1.00 0.00 0.00 64.86 64.13 3kfk h ILE 499 Cb 0.16 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 3kfk h ILE 499 CO -0.01 0.51 -0.29 -0.61 0.00 0.00 0.00 178.15 177.75 3kfk h GLN 500 N -0.24 0.52 -0.06 2.37 5.75 -1.30 0.20 115.11 122.36 3kfk h GLN 500 Ca -0.03 -0.21 -0.16 0.00 -0.15 0.00 0.00 58.65 58.10 3kfk h GLN 500 Cb 0.99 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.51 3kfk h GLN 500 CO 0.07 0.76 -0.67 0.66 -2.65 0.00 0.00 178.83 177.00 3kfk h SER 501 N 0.45 0.28 0.62 -0.69 4.64 -1.06 -2.51 113.55 115.28 3kfk h SER 501 Ca 0.06 -0.17 -0.28 0.00 -0.47 0.00 0.00 61.79 60.93 3kfk h SER 501 Cb 0.73 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3kfk h SER 501 CO 0.06 0.86 -1.26 0.00 -0.87 0.00 0.00 176.83 175.62 3kfk h ALA 502 N 1.13 0.11 -0.14 5.18 0.00 -1.32 -3.15 119.26 121.08 3kfk h ALA 502 Ca -0.01 -0.90 -0.05 0.00 0.00 0.00 0.00 54.91 53.95 3kfk h ALA 502 Cb 1.20 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3kfk h ALA 502 CO 0.10 0.99 -0.10 0.00 0.00 0.00 0.00 179.25 180.25 3kfk h ALA 503 N 0.58 0.20 -0.09 0.00 0.00 -0.99 -2.25 119.26 116.71 3kfk h ALA 503 Ca -0.14 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 3kfk h ALA 503 Cb 1.98 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 3kfk h ALA 503 CO 0.20 0.02 -0.21 0.93 0.00 0.00 0.00 179.25 180.19 3kfk h GLU 504 N -0.05 0.15 -0.03 0.00 5.08 -1.59 -1.37 114.58 116.77 3kfk h GLU 504 Ca 0.03 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 3kfk h GLU 504 Cb 0.59 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.84 3kfk h GLU 504 CO 0.03 0.37 -0.59 0.66 -1.00 0.00 0.00 179.01 178.47 3kfk h SER 505 N 0.14 0.57 0.53 1.42 4.64 -1.55 -3.06 113.55 116.24 3kfk h SER 505 Ca 0.02 -0.72 -0.12 0.00 -0.47 0.00 0.00 61.79 60.51 3kfk h SER 505 Cb 0.47 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 3kfk h SER 505 CO 0.03 1.22 -0.54 0.71 -0.87 0.00 0.00 176.83 177.38 3kfk h THR 506 N -0.02 1.39 -0.42 2.95 1.35 -1.30 -1.93 112.91 114.93 3kfk h THR 506 Ca -0.07 -1.86 -0.10 0.00 -0.55 0.00 0.00 66.41 63.84 3kfk h THR 506 Cb 1.28 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 69.68 3kfk h THR 506 CO 0.12 0.53 -0.13 -0.33 -0.25 0.00 0.00 175.52 175.46 3kfk h GLU 507 N 0.01 0.77 -0.09 4.72 5.08 -1.33 -2.13 114.58 121.61 3kfk h GLU 507 Ca -0.00 -0.26 -0.21 0.00 -1.00 0.00 0.00 59.36 57.88 3kfk h GLU 507 Cb 0.96 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.16 3kfk h GLU 507 CO 0.07 0.86 -0.80 1.98 -1.00 0.00 0.00 179.01 180.12 3kfk h MET 508 N 0.69 0.58 -0.01 2.33 4.05 -1.41 -3.27 114.93 117.89 3kfk h MET 508 Ca 0.11 -0.50 -0.11 0.00 -0.28 0.00 0.00 59.70 58.92 3kfk h MET 508 Cb 0.61 0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.51 3kfk h MET 508 CO 0.04 1.13 -0.50 -0.07 0.23 0.00 0.00 176.91 177.73 3kfk h LEU 509 N 0.38 0.04 -0.06 3.39 3.38 -1.28 -2.54 115.31 118.62 3kfk h LEU 509 Ca -0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3kfk h LEU 509 Cb 1.41 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3kfk h LEU 509 CO 0.15 0.54 0.00 0.18 0.09 0.00 0.00 178.44 179.40 3kfk n LEU 510 N -3.94 0.10 -1.23 1.67 4.77 -0.81 -3.32 117.00 114.24 3kfk n LEU 510 Ca -0.02 -0.04 0.04 0.00 -0.03 0.00 0.00 56.01 55.96 3kfk n LEU 510 Cb 0.52 -0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.88 3kfk n LEU 510 CO 0.41 0.02 0.78 0.54 -1.33 0.00 0.00 177.39 177.81 3kfk n ARG 511 N -0.76 3.05 -4.68 3.23 1.74 -0.95 -4.90 116.66 113.39 3kfk n ARG 511 Ca 0.16 -2.98 -0.33 0.00 -0.77 0.00 0.00 57.85 53.93 3kfk n ARG 511 Cb 0.09 -1.95 -0.16 0.00 -1.02 0.00 0.00 32.46 29.42 3kfk n ARG 511 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3kfk s ILE 512 N -2.93 2.45 0.00 0.55 1.01 -1.21 -4.97 121.20 116.10 3kfk s ILE 512 Ca 0.46 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3kfk s ILE 512 Cb 0.38 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.84 3kfk s ILE 512 CO 0.09 0.53 0.00 -0.90 0.00 0.00 0.00 174.94 174.66 3kfk n ASP 513 N 3.95 1.17 -3.88 3.58 5.75 -1.26 -4.53 116.55 121.32 3kfk n ASP 513 Ca -0.19 -0.25 -0.17 0.00 -0.01 0.00 0.00 54.79 54.16 3kfk n ASP 513 Cb 0.52 0.74 -0.16 0.00 -1.03 0.00 0.00 41.12 41.19 3kfk n ASP 513 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3kfk s ASP 514 N -0.98 0.60 -0.16 -1.12 -1.08 -1.26 -2.81 116.67 109.86 3kfk s ASP 514 Ca 0.00 -0.07 0.00 0.00 -0.52 0.00 0.00 52.55 51.96 3kfk s ASP 514 Cb 0.00 -0.25 0.00 0.00 -1.46 0.00 0.00 42.92 41.21 3kfk s ASP 514 CO 0.00 -0.04 -0.15 -0.69 0.52 0.00 0.00 175.17 174.81 3kfk s VAL 515 N 0.67 2.63 -0.33 1.11 1.01 -1.26 -5.05 120.40 119.19 3kfk s VAL 515 Ca -0.08 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 3kfk s VAL 515 Cb -0.11 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.21 3kfk s VAL 515 CO -0.01 0.51 0.06 -0.63 0.00 0.00 0.00 175.10 175.04 3kfk s ILE 516 N 0.94 3.33 -0.29 2.22 1.01 -1.26 -4.06 121.20 123.09 3kfk s ILE 516 Ca -0.03 -1.37 0.02 0.00 0.00 0.00 0.00 60.65 59.27 3kfk s ILE 516 Cb -0.15 -2.94 0.08 0.00 0.01 0.00 0.00 42.46 39.46 3kfk s ILE 516 CO -0.02 -0.20 0.01 0.00 0.00 0.00 0.00 174.94 174.73 3kfk s ALA 517 N 1.30 2.19 0.82 9.38 0.00 -1.01 -5.04 121.76 129.41 3kfk s ALA 517 Ca -0.02 -1.82 -0.11 0.00 0.00 0.00 0.00 51.96 50.00 3kfk s ALA 517 Cb -0.20 -1.65 0.11 0.00 0.00 0.00 0.00 23.12 21.37 3kfk s ALA 517 CO 0.00 -1.46 1.17 0.00 0.00 0.00 0.00 175.76 175.47 3kfk s ALA 518 N 1.27 2.70 0.00 0.00 0.00 -1.26 -2.49 121.76 121.98 3kfk s ALA 518 Ca 0.03 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.10 3kfk s ALA 518 Cb -0.19 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.14 3kfk s ALA 518 CO -0.11 -1.77 0.00 -1.91 0.00 0.00 0.00 175.76 171.97