#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fki s PHE 2 N 0.00 3.47 0.03 1.12 0.40 -1.26 -4.48 117.98 117.26 3fki s PHE 2 Ca 0.00 0.60 0.05 0.00 -0.60 0.00 0.00 56.93 56.98 3fki s PHE 2 Cb 0.00 -2.06 -0.02 0.00 0.51 0.00 0.00 43.02 41.45 3fki s PHE 2 CO 0.00 0.28 -0.14 -0.06 0.70 0.00 0.00 175.22 176.00 3fki s PHE 3 N -1.91 1.23 -0.28 0.36 0.40 0.17 -5.00 117.98 112.96 3fki s PHE 3 Ca 0.43 -0.34 -0.02 0.00 -0.60 0.00 0.00 56.93 56.39 3fki s PHE 3 Cb -0.11 -0.74 0.03 0.00 0.51 0.00 0.00 43.02 42.71 3fki s PHE 3 CO 0.27 0.03 -0.02 0.42 0.70 0.00 0.00 175.22 176.63 3fki s ILE 4 N -0.80 3.06 0.06 0.64 1.01 -1.26 0.81 121.20 124.71 3fki s ILE 4 Ca 0.02 -1.15 0.04 0.00 0.00 0.00 0.00 60.65 59.56 3fki s ILE 4 Cb -0.08 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 3fki s ILE 4 CO 0.01 0.05 -0.11 -0.75 0.00 0.00 0.00 174.94 174.14 3fki s LYS 5 N 1.31 0.68 -0.15 2.79 2.20 -1.13 -4.99 119.74 120.46 3fki s LYS 5 Ca -0.02 -0.88 -0.19 0.00 -0.36 0.00 0.00 55.97 54.52 3fki s LYS 5 Cb -0.18 -0.53 -0.04 0.00 -1.51 0.00 0.00 37.83 35.57 3fki s LYS 5 CO -0.02 0.11 0.53 -0.51 -0.36 0.00 0.00 175.35 175.09 3fki s ASP 6 N -1.75 6.67 0.25 1.43 1.01 -1.26 -2.97 116.67 120.04 3fki s ASP 6 Ca -0.05 0.80 -0.09 0.00 0.71 0.00 0.00 52.55 53.92 3fki s ASP 6 Cb -0.09 -2.31 -0.01 0.00 1.01 0.00 0.00 42.92 41.52 3fki s ASP 6 CO 0.01 -0.10 0.40 -1.48 0.21 0.00 0.00 175.17 174.21 3fki s LEU 7 N 1.12 0.59 0.15 1.23 2.34 -1.07 -5.03 118.68 118.01 3fki s LEU 7 Ca 0.27 -1.10 0.02 0.00 0.06 0.00 0.00 54.13 53.37 3fki s LEU 7 Cb -0.15 1.42 -0.04 0.00 -0.56 0.00 0.00 46.19 46.85 3fki s LEU 7 CO 0.11 -1.09 -0.02 -0.44 -1.06 0.00 0.00 176.35 173.85 3fki s SER 8 N -3.08 1.17 -0.05 1.48 0.01 -1.26 -2.53 113.70 109.45 3fki s SER 8 Ca 0.27 -1.13 -0.04 0.00 1.31 0.00 0.00 55.95 56.37 3fki s SER 8 Cb 0.01 0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.38 3fki s SER 8 CO 0.11 -0.54 0.13 -0.22 0.41 0.00 0.00 173.24 173.13 3fki s LEU 9 N -3.13 1.24 -0.32 2.44 2.96 -1.17 -4.97 118.68 115.74 3fki s LEU 9 Ca 0.21 0.26 -0.13 0.00 -0.22 0.00 0.00 54.13 54.25 3fki s LEU 9 Cb 0.06 0.39 -0.03 0.00 0.50 0.00 0.00 46.19 47.11 3fki s LEU 9 CO 0.02 -0.08 0.27 0.20 -1.32 0.00 0.00 176.35 175.43 3fki s ASN 10 N 0.46 6.10 -0.15 3.68 0.01 -1.26 -2.43 114.94 121.35 3fki s ASN 10 Ca -0.03 -0.19 -0.02 0.00 -0.71 0.00 0.00 52.86 51.90 3fki s ASN 10 Cb -0.05 -2.15 -0.02 0.00 0.41 0.00 0.00 41.25 39.44 3fki s ASN 10 CO -0.02 -0.20 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.66 3fki s ILE 11 N 1.84 3.41 -0.24 0.60 1.01 -1.04 -4.93 121.20 121.85 3fki s ILE 11 Ca 0.09 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 3fki s ILE 11 Cb -0.17 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 3fki s ILE 11 CO 0.11 0.50 0.44 -0.89 0.00 0.00 0.00 174.94 175.10 3fki s THR 12 N 0.51 5.14 -0.12 2.92 2.01 -1.26 -2.35 115.64 122.50 3fki s THR 12 Ca -0.06 0.75 0.02 0.00 0.31 0.00 0.00 61.69 62.71 3fki s THR 12 Cb -0.15 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.61 3fki s THR 12 CO 0.03 0.17 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.74 3fki s LEU 13 N 1.86 1.81 0.36 4.42 0.20 -0.63 -4.95 118.68 121.75 3fki s LEU 13 Ca 0.19 -0.47 -0.28 0.00 0.69 0.00 0.00 54.13 54.26 3fki s LEU 13 Cb -0.15 -1.18 -0.10 0.00 -0.43 0.00 0.00 46.19 44.33 3fki s LEU 13 CO 0.09 0.03 1.37 -2.28 -0.29 0.00 0.00 176.35 175.26 3fki s HIS 14 N 0.98 2.84 0.53 5.38 5.65 -1.26 -1.90 115.29 127.50 3fki s HIS 14 Ca -0.06 1.33 0.38 0.00 0.25 0.00 0.00 55.06 56.96 3fki s HIS 14 Cb -0.15 -3.80 1.55 0.00 -1.18 0.00 0.00 32.58 29.00 3fki s HIS 14 CO -0.02 -2.30 1.74 -1.35 -0.65 0.00 0.00 174.74 172.15 3fki h PRO 15 N 3.10 0.04 -0.85 2.88 0.11 -1.95 -2.44 132.00 132.88 3fki h PRO 15 Ca -0.50 -0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.77 3fki h PRO 15 Cb 1.24 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 3fki h PRO 15 CO 0.64 0.02 0.55 1.03 -0.21 0.00 0.00 178.00 180.04 3fki h SER 16 N 0.04 0.51 -1.00 -2.05 0.87 -1.95 -2.13 113.55 107.83 3fki h SER 16 Ca 0.67 0.04 -0.67 0.00 -1.23 0.00 0.00 61.79 60.59 3fki h SER 16 Cb 2.56 -0.06 -0.30 0.00 -0.44 0.00 0.00 62.40 64.15 3fki h SER 16 CO -0.06 0.25 0.71 0.49 -0.53 0.00 0.00 176.83 177.69 3fki n PHE 17 N -4.52 3.19 -0.49 2.24 3.01 -0.92 -4.52 117.46 115.44 3fki n PHE 17 Ca 0.17 -2.94 -0.15 0.00 1.01 0.00 0.00 57.45 55.54 3fki n PHE 17 Cb 0.54 -1.34 0.07 0.00 -0.01 0.00 0.00 39.48 38.74 3fki n PHE 17 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3fki n PHE 18 N -0.89 1.57 -1.32 1.38 3.01 -0.80 -4.65 117.46 115.76 3fki n PHE 18 Ca 0.61 -1.57 -0.22 0.00 1.01 0.00 0.00 57.45 57.28 3fki n PHE 18 Cb 0.68 -0.78 0.16 0.00 -0.01 0.00 0.00 39.48 39.54 3fki n PHE 18 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fki n GLY 19 N -0.03 -1.99 0.35 1.37 0.00 -1.26 -4.95 105.19 98.69 3fki n GLY 19 Ca 0.31 -1.60 0.05 0.00 0.00 0.00 0.00 46.02 44.77 3fki n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fki h PRO 20 N 0.00 0.83 -2.25 1.61 0.13 -2.00 -3.16 132.00 127.15 3fki h PRO 20 Ca -0.31 -0.05 -0.60 0.00 -0.87 0.00 0.00 66.00 64.17 3fki h PRO 20 Cb 0.89 -0.19 -0.41 0.00 0.13 0.00 0.00 31.00 31.42 3fki h PRO 20 CO 0.21 0.55 -0.55 0.54 -0.23 0.00 0.00 178.00 178.51 3fki n ARG 21 N -4.47 2.94 0.18 0.86 5.12 -1.26 -4.75 116.66 115.28 3fki n ARG 21 Ca 0.11 -4.76 0.07 0.00 -1.93 0.00 0.00 57.85 51.34 3fki n ARG 21 Cb 0.18 -2.26 0.18 0.00 -1.16 0.00 0.00 32.46 29.41 3fki n ARG 21 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fki h MET 22 N 3.69 0.00 -0.43 5.56 -0.00 -1.81 -3.09 114.93 118.85 3fki h MET 22 Ca 0.18 0.00 0.07 0.00 -0.00 0.00 0.00 59.70 59.94 3fki h MET 22 Cb 0.58 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.16 3fki h MET 22 CO 0.85 0.30 0.29 -0.22 -0.00 0.00 0.00 176.91 178.13 3fki h LYS 23 N 0.00 0.29 -0.01 -0.10 3.64 -1.89 0.18 116.57 118.67 3fki h LYS 23 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3fki h LYS 23 Cb 1.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3fki h LYS 23 CO 0.04 0.19 -0.02 0.37 -2.27 0.00 0.00 179.45 177.76 3fki h GLN 24 N 0.29 0.03 -0.23 1.90 5.75 -1.93 -3.10 115.11 117.83 3fki h GLN 24 Ca 0.19 -0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 58.57 3fki h GLN 24 Cb 0.38 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.92 3fki h GLN 24 CO -0.04 0.60 -0.32 -0.92 -2.65 0.00 0.00 178.83 175.50 3fki h TYR 25 N -0.54 0.54 -0.75 3.99 3.20 -1.46 -0.37 116.97 121.58 3fki h TYR 25 Ca 0.00 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.73 3fki h TYR 25 Cb 0.60 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 3fki h TYR 25 CO 0.13 0.74 0.42 -0.07 -1.64 0.00 0.00 178.16 177.74 3fki h LEU 26 N 0.41 0.93 -0.63 2.82 3.38 -0.78 0.81 115.31 122.25 3fki h LEU 26 Ca 0.05 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 3fki h LEU 26 Cb 0.76 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3fki h LEU 26 CO 0.06 0.75 -0.67 0.11 0.09 0.00 0.00 178.44 178.78 3fki h LYS 27 N 1.04 0.06 0.01 1.13 1.57 -1.41 -2.41 116.57 116.55 3fki h LYS 27 Ca 0.27 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3fki h LYS 27 Cb 0.02 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3fki h LYS 27 CO -0.04 0.71 -0.01 1.15 -0.57 0.00 0.00 179.45 180.69 3fki h THR 28 N 0.04 1.36 0.00 -0.16 2.02 -0.59 -2.64 112.91 112.94 3fki h THR 28 Ca -0.01 -1.13 -0.04 0.00 0.77 0.00 0.00 66.41 66.00 3fki h THR 28 Cb 1.20 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 69.72 3fki h THR 28 CO 0.09 0.29 -0.19 0.50 0.37 0.00 0.00 175.52 176.58 3fki h LYS 29 N -0.50 0.00 0.08 6.66 3.64 -0.93 -2.19 116.57 123.33 3fki h LYS 29 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3fki h LYS 29 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3fki h LYS 29 CO 0.00 0.19 -0.04 1.25 -2.27 0.00 0.00 179.45 178.59 3fki h LEU 30 N 0.00 -0.09 -1.11 5.20 5.85 -1.41 -3.01 115.31 120.74 3fki h LEU 30 Ca -0.00 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.52 3fki h LEU 30 Cb 0.65 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 3fki h LEU 30 CO 0.03 0.07 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.01 3fki h LEU 31 N -0.25 0.47 -1.23 2.25 3.38 -1.15 -0.09 115.31 118.69 3fki h LEU 31 Ca -0.01 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 3fki h LEU 31 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3fki h LEU 31 CO 0.02 0.63 -0.34 -0.33 0.09 0.00 0.00 178.44 178.51 3fki h GLU 32 N 0.46 0.08 0.01 1.13 5.08 -1.39 -2.27 114.58 117.68 3fki h GLU 32 Ca 0.09 -0.03 -0.37 0.00 -1.00 0.00 0.00 59.36 58.04 3fki h GLU 32 Cb 0.48 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 3fki h GLU 32 CO 0.03 0.41 -2.35 0.39 -1.00 0.00 0.00 179.01 176.48 3fki n GLU 33 N -4.12 0.67 -0.07 2.33 1.02 -1.14 -4.72 120.64 114.61 3fki n GLU 33 Ca -0.02 0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 57.11 3fki n GLU 33 Cb 0.39 -1.55 -0.10 0.00 -0.02 0.00 0.00 31.44 30.16 3fki n GLU 33 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fki h VAL 34 N 0.01 1.33 -2.55 2.62 2.07 -1.05 -3.39 116.25 115.29 3fki h VAL 34 Ca -0.54 -2.04 -0.56 0.00 0.82 0.00 0.00 66.70 64.38 3fki h VAL 34 Cb 2.05 2.56 -0.03 0.00 -1.52 0.00 0.00 31.29 34.35 3fki h VAL 34 CO -0.02 0.45 1.29 -1.61 0.02 0.00 0.00 177.57 177.71 3fki s GLU 35 N -2.10 3.21 0.00 1.57 2.02 -0.86 -1.85 118.70 120.69 3fki s GLU 35 Ca -0.16 1.29 0.00 0.00 0.02 0.00 0.00 54.97 56.12 3fki s GLU 35 Cb -0.02 -4.23 0.00 0.00 0.10 0.00 0.00 34.13 29.98 3fki s GLU 35 CO 0.54 -2.01 0.00 0.41 0.02 0.00 0.00 175.26 174.21 3fki n GLY 36 N 5.47 0.76 3.80 -1.39 0.00 -0.16 -4.89 105.19 108.77 3fki n GLY 36 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 3fki n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fki s SER 37 N -1.63 5.51 -0.09 1.61 1.04 -0.77 -4.84 113.70 114.53 3fki s SER 37 Ca 0.00 1.83 -0.03 0.00 0.48 0.00 0.00 55.95 58.22 3fki s SER 37 Cb 0.00 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 63.64 3fki s SER 37 CO 0.00 -1.36 0.17 0.00 0.98 0.00 0.00 173.24 173.03 3fki s THR 39 N 2.06 1.64 0.34 0.00 2.01 -1.07 -4.60 115.64 116.02 3fki s THR 39 Ca 0.00 -1.90 0.07 0.00 0.31 0.00 0.00 61.69 60.17 3fki s THR 39 Cb -0.12 -1.78 0.11 0.00 0.01 0.00 0.00 72.50 70.72 3fki s THR 39 CO -0.06 -0.40 1.82 1.23 -0.69 0.00 0.00 174.62 176.52 3fki h GLY 40 N 3.22 0.31 0.00 4.40 0.00 -1.90 0.59 103.07 109.69 3fki h GLY 40 Ca -0.41 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 3fki h GLY 40 CO 0.53 0.21 -0.10 0.50 0.00 0.00 0.00 176.54 177.67 3fki h LYS 41 N 0.26 0.00 0.09 4.80 1.57 -2.02 -3.41 116.57 117.86 3fki h LYS 41 Ca 0.04 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.47 3fki h LYS 41 Cb 0.55 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 3fki h LYS 41 CO 0.04 0.57 -1.98 1.19 -0.57 0.00 0.00 179.45 178.70 3fki n PHE 42 N -4.66 1.13 -0.93 -1.35 3.01 -1.25 -5.09 117.46 108.32 3fki n PHE 42 Ca -0.07 0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.65 3fki n PHE 42 Cb 0.30 -1.16 0.00 0.00 -0.01 0.00 0.00 39.48 38.61 3fki n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fki n GLY 43 N 1.93 -0.84 3.61 1.37 0.00 0.20 -4.49 105.19 106.96 3fki n GLY 43 Ca -0.30 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 3fki n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fki s TYR 44 N 0.00 1.94 -0.57 1.61 1.51 0.73 -2.58 117.35 119.99 3fki s TYR 44 Ca 0.00 0.60 -0.25 0.00 -1.01 0.00 0.00 57.07 56.42 3fki s TYR 44 Cb 0.00 -4.13 0.04 0.00 -0.11 0.00 0.00 41.96 37.77 3fki s TYR 44 CO 0.00 -2.85 0.99 0.42 -1.11 0.00 0.00 175.55 173.00 3fki s ILE 45 N 6.33 4.31 -0.15 2.71 -1.09 -0.21 -1.61 121.20 131.48 3fki s ILE 45 Ca 0.76 0.29 -0.14 0.00 -2.23 0.00 0.00 60.65 59.32 3fki s ILE 45 Cb -0.22 -4.59 -0.11 0.00 -1.58 0.00 0.00 42.46 35.96 3fki s ILE 45 CO 0.33 -1.21 0.13 -0.07 -1.23 0.00 0.00 174.94 172.89 3fki h LEU 46 N 11.20 0.00 -7.52 2.97 3.38 -1.62 -0.40 115.31 123.32 3fki h LEU 46 Ca -0.26 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.25 3fki h LEU 46 Cb 1.07 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.59 3fki h LEU 46 CO 1.12 0.96 -0.38 0.00 0.09 0.00 0.00 178.44 180.23 3fki s VAL 48 N -0.54 4.45 0.48 0.00 1.01 -1.26 0.62 120.40 125.16 3fki s VAL 48 Ca -0.06 1.56 -0.20 0.00 0.00 0.00 0.00 61.98 63.27 3fki s VAL 48 Cb -0.04 -4.45 -0.09 0.00 0.00 0.00 0.00 36.38 31.81 3fki s VAL 48 CO 0.02 -0.60 1.03 -0.76 0.00 0.00 0.00 175.10 174.79 3fki s LEU 49 N 3.80 3.85 -0.56 3.92 1.43 -0.67 -4.54 118.68 125.92 3fki s LEU 49 Ca 0.45 1.92 -0.17 0.00 -1.03 0.00 0.00 54.13 55.29 3fki s LEU 49 Cb -0.11 -4.56 0.02 0.00 0.03 0.00 0.00 46.19 41.58 3fki s LEU 49 CO 0.19 -0.75 0.64 -0.67 0.23 0.00 0.00 176.35 175.99 3fki n ASP 50 N -0.94 -6.75 -4.75 2.29 2.03 -1.26 -4.35 116.55 102.81 3fki n ASP 50 Ca 0.09 -0.01 -0.34 0.00 0.52 0.00 0.00 54.79 55.05 3fki n ASP 50 Cb 0.53 -3.74 0.06 0.00 -0.72 0.00 0.00 41.12 37.24 3fki n ASP 50 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 3fki s TYR 51 N -2.42 2.42 0.11 -0.67 5.04 -1.26 -4.72 117.35 115.84 3fki s TYR 51 Ca 0.20 1.57 0.00 0.00 -2.44 0.00 0.00 57.07 56.40 3fki s TYR 51 Cb -0.04 -3.28 0.00 0.00 0.35 0.00 0.00 41.96 38.99 3fki s TYR 51 CO 0.82 -2.01 0.00 -3.47 -1.34 0.00 0.00 175.55 169.55 3fki n ASP 52 N -2.46 -1.42 -1.55 4.32 -0.08 -1.26 -4.87 116.55 109.22 3fki n ASP 52 Ca 0.11 0.24 -0.06 0.00 -1.51 0.00 0.00 54.79 53.57 3fki n ASP 52 Cb 0.51 -0.87 -0.02 0.00 2.34 0.00 0.00 41.12 43.08 3fki n ASP 52 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3fki n ASN 53 N -2.52 -1.91 -4.55 1.67 0.23 -1.26 -4.88 115.26 102.03 3fki n ASN 53 Ca -0.01 0.21 -0.39 0.00 -0.53 0.00 0.00 54.58 53.85 3fki n ASN 53 Cb 0.12 -1.93 -0.03 0.00 -2.08 0.00 0.00 39.78 35.86 3fki n ASN 53 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 3fki s ILE 54 N -1.76 3.64 -0.53 1.53 1.01 -1.26 -4.93 121.20 118.90 3fki s ILE 54 Ca 0.00 0.09 -0.26 0.00 0.00 0.00 0.00 60.65 60.48 3fki s ILE 54 Cb 0.00 -4.62 -0.05 0.00 0.01 0.00 0.00 42.46 37.79 3fki s ILE 54 CO 0.00 -1.56 2.24 -0.62 0.00 0.00 0.00 174.94 175.00 3fki s ASP 55 N 5.41 4.68 0.31 3.58 2.15 -1.26 -4.81 116.67 126.74 3fki s ASP 55 Ca 0.48 0.85 0.12 0.00 0.43 0.00 0.00 52.55 54.43 3fki s ASP 55 Cb -0.08 -2.51 0.50 0.00 -0.30 0.00 0.00 42.92 40.54 3fki s ASP 55 CO 0.11 -2.74 1.69 0.40 -0.17 0.00 0.00 175.17 174.46 3fki h ILE 56 N 7.45 1.34 -2.01 4.11 2.04 -1.88 -3.25 117.51 125.31 3fki h ILE 56 Ca -0.25 -1.80 0.20 0.00 1.00 0.00 0.00 64.86 64.02 3fki h ILE 56 Cb 1.24 1.98 -0.11 0.00 -0.74 0.00 0.00 36.82 39.19 3fki h ILE 56 CO 1.18 0.51 -0.71 0.00 0.00 0.00 0.00 178.15 179.13 3fki n GLN 57 N -3.87 -1.91 -2.28 2.37 6.02 -1.26 -4.14 117.38 112.30 3fki n GLN 57 Ca -0.01 1.55 -0.42 0.00 -0.01 0.00 0.00 57.00 58.10 3fki n GLN 57 Cb 0.54 -2.24 -0.02 0.00 1.02 0.00 0.00 30.24 29.53 3fki n GLN 57 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3fki s ARG 58 N -3.59 3.39 0.16 -1.09 0.52 -1.26 -4.88 118.95 112.20 3fki s ARG 58 Ca 0.00 0.87 -0.19 0.00 -0.52 0.00 0.00 55.73 55.89 3fki s ARG 58 Cb 0.00 -4.11 -0.07 0.00 0.52 0.00 0.00 34.95 31.29 3fki s ARG 58 CO 0.00 -1.80 0.64 0.20 0.02 0.00 0.00 175.30 174.36 3fki s GLY 59 N 4.73 2.62 0.27 -3.53 0.00 -1.26 -4.97 107.32 105.18 3fki s GLY 59 Ca 0.62 0.07 -0.12 0.00 0.00 0.00 0.00 44.72 45.30 3fki s GLY 59 CO 0.30 0.44 0.63 1.09 0.00 0.00 0.00 173.10 175.56 3fki s ARG 60 N -1.68 3.88 0.09 2.90 1.70 -1.15 -4.84 118.95 119.85 3fki s ARG 60 Ca 0.37 0.43 -0.20 0.00 -0.47 0.00 0.00 55.73 55.87 3fki s ARG 60 Cb -0.17 -2.55 -0.07 0.00 -0.57 0.00 0.00 34.95 31.59 3fki s ARG 60 CO 0.20 0.24 0.60 0.42 -1.08 0.00 0.00 175.30 175.68 3fki s ILE 61 N -1.91 4.68 0.55 4.99 1.01 -1.26 -1.20 121.20 128.06 3fki s ILE 61 Ca 0.50 1.28 -0.20 0.00 0.00 0.00 0.00 60.65 62.23 3fki s ILE 61 Cb -0.11 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.38 3fki s ILE 61 CO 0.20 0.53 1.21 -0.76 0.00 0.00 0.00 174.94 176.12 3fki s LEU 62 N -1.16 3.78 0.34 2.97 1.43 0.14 -4.95 118.68 121.22 3fki s LEU 62 Ca 0.31 2.40 0.02 0.00 -1.03 0.00 0.00 54.13 55.82 3fki s LEU 62 Cb -0.20 -4.47 0.59 0.00 0.03 0.00 0.00 46.19 42.13 3fki s LEU 62 CO 0.20 -1.39 1.97 1.55 0.23 0.00 0.00 176.35 178.91 3fki h PRO 63 N 1.27 0.81 0.00 1.29 0.13 -1.97 -3.39 132.00 130.14 3fki h PRO 63 Ca -0.50 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 3fki h PRO 63 Cb 1.28 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3fki h PRO 63 CO 0.57 0.59 -0.29 2.41 -0.23 0.00 0.00 178.00 181.05 3fki n THR 64 N -4.40 0.48 -3.20 1.56 -1.04 -1.26 -5.00 114.28 101.43 3fki n THR 64 Ca 0.06 0.35 -0.32 0.00 -2.04 0.00 0.00 64.05 62.10 3fki n THR 64 Cb 0.09 -1.71 -0.06 0.00 -1.82 0.00 0.00 70.33 66.84 3fki n THR 64 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 3fki s ASP 65 N -4.71 6.70 0.00 8.00 -4.77 -1.26 -4.96 116.67 115.67 3fki s ASP 65 Ca -0.08 1.15 0.00 0.00 -3.30 0.00 0.00 52.55 50.32 3fki s ASP 65 Cb 0.01 -2.32 0.00 0.00 -1.09 0.00 0.00 42.92 39.52 3fki s ASP 65 CO 0.12 -0.18 0.38 0.61 0.70 0.00 0.00 175.17 176.81 3fki n GLY 66 N -0.39 0.27 3.79 2.12 0.00 -1.26 -4.05 105.19 105.67 3fki n GLY 66 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3fki n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fki s SER 67 N -0.85 5.21 0.09 1.61 0.15 -1.26 -4.34 113.70 114.30 3fki s SER 67 Ca 0.00 1.79 0.10 0.00 0.70 0.00 0.00 55.95 58.54 3fki s SER 67 Cb 0.00 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.76 3fki s SER 67 CO 0.00 -1.56 -0.26 0.00 1.20 0.00 0.00 173.24 172.62 3fki s ALA 68 N -2.74 2.23 -0.19 5.45 0.00 -0.80 0.25 121.76 125.97 3fki s ALA 68 Ca 0.62 -1.34 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 3fki s ALA 68 Cb -0.16 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 3fki s ALA 68 CO 0.48 0.51 -0.05 -2.00 0.00 0.00 0.00 175.76 174.70 3fki s GLU 69 N -1.64 3.46 -0.16 0.00 2.12 -0.34 -1.61 118.70 120.53 3fki s GLU 69 Ca 0.12 -0.61 0.00 0.00 0.36 0.00 0.00 54.97 54.85 3fki s GLU 69 Cb -0.10 -2.93 0.00 0.00 0.26 0.00 0.00 34.13 31.36 3fki s GLU 69 CO 0.04 -0.02 -0.16 -0.06 -0.54 0.00 0.00 175.26 174.52 3fki s PHE 70 N 1.01 2.77 -0.49 5.30 0.40 -0.99 -2.94 117.98 123.05 3fki s PHE 70 Ca 0.00 -1.14 -0.21 0.00 -0.60 0.00 0.00 56.93 54.99 3fki s PHE 70 Cb -0.15 -1.89 0.04 0.00 0.51 0.00 0.00 43.02 41.54 3fki s PHE 70 CO 0.00 -0.53 0.71 1.21 0.70 0.00 0.00 175.22 177.31 3fki s ASN 71 N 0.90 6.28 -0.40 1.36 3.84 -1.26 -2.50 114.94 123.16 3fki s ASN 71 Ca -0.04 -0.59 -0.12 0.00 0.21 0.00 0.00 52.86 52.32 3fki s ASN 71 Cb -0.15 -2.33 0.03 0.00 -0.55 0.00 0.00 41.25 38.25 3fki s ASN 71 CO -0.02 -0.94 0.26 -0.69 -2.79 0.00 0.00 177.10 172.92 3fki s VAL 72 N 3.01 4.81 -0.16 -5.21 1.01 -1.02 -4.48 120.40 118.36 3fki s VAL 72 Ca 0.21 -0.87 -0.21 0.00 0.00 0.00 0.00 61.98 61.11 3fki s VAL 72 Cb -0.16 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 3fki s VAL 72 CO 0.16 -0.32 0.63 -0.54 0.00 0.00 0.00 175.10 175.04 3fki s LYS 73 N 1.59 4.28 0.05 2.72 1.02 -1.23 -3.04 119.74 125.13 3fki s LYS 73 Ca 0.03 0.67 -0.17 0.00 0.02 0.00 0.00 55.97 56.52 3fki s LYS 73 Cb -0.20 -3.53 0.03 0.00 -0.52 0.00 0.00 37.83 33.61 3fki s LYS 73 CO 0.07 -0.13 0.39 1.52 -0.92 0.00 0.00 175.35 176.28 3fki s TYR 74 N 1.52 -0.22 0.18 3.18 -0.85 -1.05 -4.00 117.35 116.12 3fki s TYR 74 Ca 0.31 0.14 -0.09 0.00 -0.52 0.00 0.00 57.07 56.91 3fki s TYR 74 Cb -0.16 0.19 -0.07 0.00 0.38 0.00 0.00 41.96 42.31 3fki s TYR 74 CO 0.12 -0.57 0.49 1.03 -1.52 0.00 0.00 175.55 175.10 3fki s ARG 75 N -2.62 3.76 0.03 -3.49 0.52 -1.26 -2.61 118.95 113.28 3fki s ARG 75 Ca -0.04 0.18 -0.16 0.00 -0.52 0.00 0.00 55.73 55.19 3fki s ARG 75 Cb -0.01 -2.76 0.03 0.00 0.52 0.00 0.00 34.95 32.73 3fki s ARG 75 CO -0.03 0.40 0.34 0.00 0.02 0.00 0.00 175.30 176.03 3fki s ALA 76 N -1.70 -0.82 -0.46 2.13 0.00 -1.16 -1.66 121.76 118.09 3fki s ALA 76 Ca 0.43 0.18 -0.28 0.00 0.00 0.00 0.00 51.96 52.29 3fki s ALA 76 Cb -0.12 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.31 3fki s ALA 76 CO 0.22 -0.40 1.07 0.08 0.00 0.00 0.00 175.76 176.72 3fki s VAL 77 N -2.29 4.31 0.03 0.00 1.01 0.20 -2.83 120.40 120.83 3fki s VAL 77 Ca -0.07 1.12 0.03 0.00 0.00 0.00 0.00 61.98 63.06 3fki s VAL 77 Cb -0.02 -4.54 -0.04 0.00 0.00 0.00 0.00 36.38 31.79 3fki s VAL 77 CO -0.01 -0.92 -0.01 -0.69 0.00 0.00 0.00 175.10 173.47 3fki s VAL 78 N 4.18 4.03 -0.19 2.92 1.01 0.24 -1.65 120.40 130.95 3fki s VAL 78 Ca 0.44 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 3fki s VAL 78 Cb -0.08 -2.84 0.06 0.00 0.00 0.00 0.00 36.38 33.52 3fki s VAL 78 CO 0.29 0.29 0.46 0.12 0.00 0.00 0.00 175.10 176.25 3fki s PHE 79 N -1.16 -0.67 -0.04 5.22 5.36 -0.64 0.45 117.98 126.50 3fki s PHE 79 Ca 0.21 1.42 -0.25 0.00 -0.96 0.00 0.00 56.93 57.36 3fki s PHE 79 Cb -0.12 0.32 0.05 0.00 -0.34 0.00 0.00 43.02 42.94 3fki s PHE 79 CO 0.13 -0.37 0.54 -1.59 -1.46 0.00 0.00 175.22 172.47 3fki s LYS 80 N 1.38 0.90 0.91 10.12 -2.85 -1.26 -0.19 119.74 128.75 3fki s LYS 80 Ca -0.09 0.12 -0.14 0.00 -1.00 0.00 0.00 55.97 54.86 3fki s LYS 80 Cb -0.08 0.42 0.16 0.00 -2.06 0.00 0.00 37.83 36.28 3fki s LYS 80 CO -0.13 -0.27 1.26 -1.25 0.10 0.00 0.00 175.35 175.06 3fki s PRO 81 N -1.17 1.05 0.02 1.78 0.04 -1.26 -4.98 135.00 130.48 3fki s PRO 81 Ca -0.11 -0.32 -0.02 0.00 0.04 0.00 0.00 61.00 60.58 3fki s PRO 81 Cb -0.02 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 3fki s PRO 81 CO 0.08 -2.14 0.02 -0.06 0.04 0.00 0.00 177.00 174.94 3fki s PHE 82 N -3.76 0.25 -0.51 0.56 0.40 -1.26 -5.06 117.98 108.60 3fki s PHE 82 Ca 0.70 -0.54 -0.06 0.00 -0.60 0.00 0.00 56.93 56.44 3fki s PHE 82 Cb -0.06 -0.19 -0.15 0.00 0.51 0.00 0.00 43.02 43.14 3fki s PHE 82 CO 0.51 -0.27 2.71 1.63 0.70 0.00 0.00 175.22 180.50 3fki n LYS 83 N 1.20 2.04 0.00 0.44 5.02 -1.26 -2.26 118.16 123.34 3fki n LYS 83 Ca -0.21 -1.18 0.00 0.00 -2.02 0.00 0.00 58.31 54.90 3fki n LYS 83 Cb 0.57 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 3fki n LYS 83 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fki n GLY 84 N 3.06 0.00 3.82 0.72 0.00 -0.80 -4.81 105.19 107.18 3fki n GLY 84 Ca 0.44 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.09 3fki n GLY 84 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3fki s GLU 85 N 0.00 4.21 -0.23 1.61 2.12 -0.96 -4.84 118.70 120.62 3fki s GLU 85 Ca 0.00 0.79 -0.02 0.00 0.36 0.00 0.00 54.97 56.10 3fki s GLU 85 Cb 0.00 -2.98 0.01 0.00 0.26 0.00 0.00 34.13 31.42 3fki s GLU 85 CO 0.00 0.47 -0.07 0.08 -0.54 0.00 0.00 175.26 175.20 3fki s VAL 86 N -1.41 2.98 0.33 3.70 1.01 -1.26 -0.58 120.40 125.17 3fki s VAL 86 Ca 0.39 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.62 3fki s VAL 86 Cb -0.17 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 3fki s VAL 86 CO 0.21 0.34 0.10 -0.69 0.00 0.00 0.00 175.10 175.06 3fki s VAL 87 N 1.39 0.76 0.04 2.92 1.01 -0.53 -4.98 120.40 121.01 3fki s VAL 87 Ca 0.03 -2.00 0.03 0.00 0.00 0.00 0.00 61.98 60.04 3fki s VAL 87 Cb -0.15 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 3fki s VAL 87 CO -0.05 0.00 -0.09 1.51 0.00 0.00 0.00 175.10 176.47 3fki s ASP 88 N -3.47 1.01 0.00 3.32 3.84 -1.26 0.71 116.67 120.82 3fki s ASP 88 Ca 0.33 -0.53 0.00 0.00 -0.00 0.00 0.00 52.55 52.35 3fki s ASP 88 Cb 0.06 0.01 0.00 0.00 -1.38 0.00 0.00 42.92 41.61 3fki s ASP 88 CO 0.15 -0.16 0.00 0.61 -0.00 0.00 0.00 175.17 175.77 3fki n GLY 89 N 1.55 2.09 3.67 2.12 0.00 -0.81 -4.83 105.19 108.98 3fki n GLY 89 Ca -0.22 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 3fki n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fki s THR 90 N -2.81 4.48 0.47 2.61 2.01 -0.88 -2.43 115.64 119.10 3fki s THR 90 Ca 0.00 -0.17 -0.20 0.00 0.31 0.00 0.00 61.69 61.63 3fki s THR 90 Cb 0.00 -2.93 -0.09 0.00 0.01 0.00 0.00 72.50 69.49 3fki s THR 90 CO 0.00 0.57 1.00 -0.69 -0.69 0.00 0.00 174.62 174.81 3fki s VAL 91 N -0.52 4.08 0.00 3.82 1.01 -1.21 -0.24 120.40 127.35 3fki s VAL 91 Ca 0.09 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.33 3fki s VAL 91 Cb -0.12 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.74 3fki s VAL 91 CO 0.02 -0.32 0.00 0.52 0.00 0.00 0.00 175.10 175.32 3fki n VAL 92 N -0.94 0.00 -2.76 2.92 0.31 -0.12 -4.58 118.33 113.16 3fki n VAL 92 Ca 0.08 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.10 3fki n VAL 92 Cb 0.53 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.42 3fki n VAL 92 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3fki s SER 93 N 1.00 6.65 -0.04 4.52 1.04 -1.26 -4.71 113.70 120.91 3fki s SER 93 Ca 0.00 1.37 -0.02 0.00 0.48 0.00 0.00 55.95 57.78 3fki s SER 93 Cb 0.00 -2.42 0.02 0.00 0.10 0.00 0.00 66.02 63.72 3fki s SER 93 CO 0.00 -0.42 0.09 0.00 0.98 0.00 0.00 173.24 173.89 3fki n SER 95 N 3.70 -0.02 0.25 0.00 3.41 0.05 -4.97 113.62 116.03 3fki n SER 95 Ca -0.21 -1.62 0.17 0.00 -0.26 0.00 0.00 58.87 56.95 3fki n SER 95 Cb 0.55 0.45 0.73 0.00 -0.26 0.00 0.00 64.21 65.68 3fki n SER 95 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3fki h GLN 96 N 0.00 0.00 0.00 4.33 4.20 -2.00 -3.10 115.11 118.53 3fki h GLN 96 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3fki h GLN 96 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3fki h GLN 96 CO 0.10 0.00 -0.81 0.72 -0.67 0.00 0.00 178.83 178.17 3fki n HIS 97 N -2.86 0.00 -0.49 2.96 8.25 -1.26 -4.88 115.22 116.95 3fki n HIS 97 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3fki n HIS 97 Cb 0.23 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.33 3fki n HIS 97 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fki n GLY 98 N 1.39 0.71 3.45 -1.41 0.00 -1.17 -0.91 105.19 107.25 3fki n GLY 98 Ca 0.03 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 43.98 3fki n GLY 98 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3fki s PHE 99 N -2.15 2.25 -0.38 1.61 -0.12 -1.06 -0.77 117.98 117.36 3fki s PHE 99 Ca 0.00 -0.35 -0.07 0.00 -0.05 0.00 0.00 56.93 56.46 3fki s PHE 99 Cb 0.00 -1.00 0.06 0.00 -0.63 0.00 0.00 43.02 41.46 3fki s PHE 99 CO 0.00 0.66 0.18 -2.00 -0.05 0.00 0.00 175.22 174.01 3fki s GLU 100 N -3.39 2.53 -0.12 1.99 2.12 -0.55 -1.35 118.70 119.93 3fki s GLU 100 Ca 0.28 -1.38 -0.20 0.00 0.36 0.00 0.00 54.97 54.03 3fki s GLU 100 Cb -0.05 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 3fki s GLU 100 CO 0.14 -0.83 0.58 0.08 -0.54 0.00 0.00 175.26 174.68 3fki s VAL 101 N 1.38 5.11 -0.26 3.70 1.01 0.14 -0.95 120.40 130.53 3fki s VAL 101 Ca 0.01 1.15 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 3fki s VAL 101 Cb -0.21 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 3fki s VAL 101 CO 0.02 0.26 0.19 -1.58 0.00 0.00 0.00 175.10 173.98 3fki s GLN 102 N 0.95 4.01 -0.38 2.72 0.74 0.67 -0.23 119.66 128.15 3fki s GLN 102 Ca 0.30 -0.28 -0.01 0.00 0.05 0.00 0.00 55.36 55.42 3fki s GLN 102 Cb -0.16 -3.61 0.10 0.00 1.10 0.00 0.00 33.01 30.44 3fki s GLN 102 CO 0.13 -0.08 0.14 0.08 -0.55 0.00 0.00 175.29 175.02 3fki s VAL 103 N 1.46 3.04 0.00 1.34 1.01 -0.37 -2.07 120.40 124.80 3fki s VAL 103 Ca 0.08 -2.03 0.00 0.00 0.00 0.00 0.00 61.98 60.03 3fki s VAL 103 Cb -0.15 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3fki s VAL 103 CO 0.08 -0.59 0.00 0.61 0.00 0.00 0.00 175.10 175.20 3fki n GLY 104 N 4.53 3.29 0.12 4.51 0.00 -1.26 -1.94 105.19 114.43 3fki n GLY 104 Ca -0.02 -0.13 0.15 0.00 0.00 0.00 0.00 46.02 46.01 3fki n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fki n PRO 105 N 13.42 0.81 -4.10 1.61 -0.04 -1.26 -4.91 135.00 140.54 3fki n PRO 105 Ca 0.00 -0.24 -0.33 0.00 -0.04 0.00 0.00 63.50 62.88 3fki n PRO 105 Cb 0.00 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 31.90 3fki n PRO 105 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 3fki s MET 106 N -2.35 3.10 -0.25 0.54 0.00 -0.82 -4.98 119.30 114.53 3fki s MET 106 Ca 0.33 -0.45 -0.03 0.00 0.00 0.00 0.00 55.69 55.54 3fki s MET 106 Cb 0.20 -2.88 0.02 0.00 0.00 0.00 0.00 34.83 32.17 3fki s MET 106 CO 0.44 0.66 -0.04 0.15 0.00 0.00 0.00 175.02 176.23 3fki s LYS 107 N -1.65 2.95 -0.19 4.11 1.02 -1.26 -1.23 119.74 123.49 3fki s LYS 107 Ca 0.22 -0.91 -0.04 0.00 0.02 0.00 0.00 55.97 55.27 3fki s LYS 107 Cb -0.12 -3.03 -0.02 0.00 -0.52 0.00 0.00 37.83 34.14 3fki s LYS 107 CO 0.13 -0.37 -0.04 0.08 -0.92 0.00 0.00 175.35 174.23 3fki s VAL 108 N 1.37 3.58 -0.11 3.17 1.01 0.68 -3.67 120.40 126.43 3fki s VAL 108 Ca 0.01 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 3fki s VAL 108 Cb -0.16 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 3fki s VAL 108 CO -0.04 0.45 0.25 0.12 0.00 0.00 0.00 175.10 175.88 3fki s PHE 109 N 1.03 3.57 -0.11 5.22 5.36 -0.27 0.24 117.98 133.03 3fki s PHE 109 Ca 0.01 0.64 0.01 0.00 -0.96 0.00 0.00 56.93 56.63 3fki s PHE 109 Cb -0.15 -2.16 -0.02 0.00 -0.34 0.00 0.00 43.02 40.36 3fki s PHE 109 CO 0.00 0.53 -0.15 0.08 -1.46 0.00 0.00 175.22 174.22 3fki s VAL 110 N -0.48 2.91 -0.02 3.12 1.01 -0.46 -0.14 120.40 126.34 3fki s VAL 110 Ca 0.17 -0.73 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 3fki s VAL 110 Cb -0.13 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 3fki s VAL 110 CO 0.06 0.54 0.38 -0.89 0.00 0.00 0.00 175.10 175.18 3fki s THR 111 N 0.11 5.09 0.30 3.92 2.01 -1.26 -2.56 115.64 123.25 3fki s THR 111 Ca -0.07 0.76 0.05 0.00 0.31 0.00 0.00 61.69 62.74 3fki s THR 111 Cb -0.15 -3.67 0.29 0.00 0.01 0.00 0.00 72.50 68.97 3fki s THR 111 CO 0.05 0.58 1.72 0.50 -0.69 0.00 0.00 174.62 176.78 3fki h LYS 112 N 4.78 0.50 -1.27 4.92 1.63 -1.36 -0.66 116.57 125.11 3fki h LYS 112 Ca -0.52 -0.03 -0.12 0.00 -0.85 0.00 0.00 60.65 59.14 3fki h LYS 112 Cb 1.22 -0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 32.68 3fki h LYS 112 CO 0.61 0.33 0.15 0.72 -3.45 0.00 0.00 179.45 177.81 3fki n HIS 113 N -4.95 0.64 -1.39 1.91 8.25 -1.26 -2.45 115.22 115.96 3fki n HIS 113 Ca 0.23 -0.99 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 3fki n HIS 113 Cb 0.64 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 31.26 3fki n HIS 113 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3fki n LEU 114 N 0.45 0.00 -4.83 2.41 7.94 -0.26 -5.11 117.00 117.60 3fki n LEU 114 Ca 0.12 -0.22 -0.22 0.00 -1.11 0.00 0.00 56.01 54.58 3fki n LEU 114 Cb 0.67 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.57 3fki n LEU 114 CO 0.14 0.20 -0.05 -0.04 -1.11 0.00 0.00 177.39 176.52 3fki s MET 115 N 0.00 2.41 0.45 1.96 -1.94 -1.03 -3.41 119.30 117.75 3fki s MET 115 Ca 0.00 -1.66 -0.24 0.00 -1.71 0.00 0.00 55.69 52.07 3fki s MET 115 Cb 0.00 -2.23 -0.09 0.00 2.01 0.00 0.00 34.83 34.52 3fki s MET 115 CO 0.00 -0.18 1.23 -0.35 -0.01 0.00 0.00 175.02 175.71 3fki n PRO 116 N -1.45 1.76 -0.25 2.03 -0.04 -1.26 -4.86 135.00 130.94 3fki n PRO 116 Ca 0.02 0.63 -0.02 0.00 -0.04 0.00 0.00 63.50 64.10 3fki n PRO 116 Cb 0.63 -2.36 0.10 0.00 -0.04 0.00 0.00 33.50 31.83 3fki n PRO 116 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3fki h GLN 117 N 1.83 0.76 -3.24 0.54 7.50 -1.99 -3.24 115.11 117.27 3fki h GLN 117 Ca -0.48 -0.05 -0.62 0.00 0.50 0.00 0.00 58.65 58.00 3fki h GLN 117 Cb 1.31 -0.17 0.02 0.00 0.05 0.00 0.00 27.48 28.68 3fki h GLN 117 CO 0.59 0.50 3.51 -0.40 -1.50 0.00 0.00 178.83 181.53 3fki n ASP 118 N -4.72 7.34 -3.44 1.46 3.85 -1.26 -4.74 116.55 115.03 3fki n ASP 118 Ca 0.09 -2.56 -0.12 0.00 -0.71 0.00 0.00 54.79 51.49 3fki n ASP 118 Cb 0.15 -1.48 -0.10 0.00 -1.35 0.00 0.00 41.12 38.35 3fki n ASP 118 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 3fki s LEU 119 N 0.43 -0.45 0.03 -2.12 2.96 -1.23 -4.57 118.68 113.74 3fki s LEU 119 Ca 0.61 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.71 3fki s LEU 119 Cb 0.16 0.87 -0.04 0.00 0.50 0.00 0.00 46.19 47.69 3fki s LEU 119 CO -0.05 -0.30 0.12 0.42 -1.32 0.00 0.00 176.35 175.21 3fki s THR 120 N 2.47 4.86 -0.36 3.68 -4.23 -0.21 -4.91 115.64 116.95 3fki s THR 120 Ca 0.09 -0.50 -0.19 0.00 -1.18 0.00 0.00 61.69 59.91 3fki s THR 120 Cb -0.15 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.40 3fki s THR 120 CO -0.14 0.24 0.59 0.12 -0.54 0.00 0.00 174.62 174.88 3fki s PHE 121 N -1.33 3.15 0.07 3.99 2.19 -1.26 -0.85 117.98 123.94 3fki s PHE 121 Ca 0.28 0.24 -0.30 0.00 0.33 0.00 0.00 56.93 57.47 3fki s PHE 121 Cb -0.12 -3.07 -0.05 0.00 -1.31 0.00 0.00 43.02 38.47 3fki s PHE 121 CO 0.20 -0.62 1.06 1.21 1.83 0.00 0.00 175.22 178.90 3fki s ASN 122 N 1.80 7.30 -0.08 6.13 3.84 -0.96 -4.99 114.94 127.97 3fki s ASN 122 Ca 0.22 1.86 -0.05 0.00 0.21 0.00 0.00 52.86 55.10 3fki s ASN 122 Cb -0.15 -2.58 -0.03 0.00 -0.55 0.00 0.00 41.25 37.94 3fki s ASN 122 CO 0.15 -0.27 0.19 0.00 -2.79 0.00 0.00 177.10 174.38 3fki h ALA 123 N 6.27 -0.17 -0.16 1.71 0.00 -1.97 -3.36 119.26 121.58 3fki h ALA 123 Ca -0.42 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3fki h ALA 123 Cb 1.22 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3fki h ALA 123 CO 0.76 -0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.26 3fki n GLY 124 N 1.36 1.61 3.73 0.00 0.00 -1.26 -4.90 105.19 105.72 3fki n GLY 124 Ca -0.02 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 3fki n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fki s SER 125 N -0.33 7.25 -0.18 1.61 1.04 -1.26 -5.04 113.70 116.79 3fki s SER 125 Ca 0.15 1.97 -0.04 0.00 0.48 0.00 0.00 55.95 58.50 3fki s SER 125 Cb 0.11 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.70 3fki s SER 125 CO 0.05 -0.29 0.07 0.21 0.98 0.00 0.00 173.24 174.27 3fki s ASN 126 N 0.43 2.61 0.65 7.02 3.04 -1.26 -2.59 114.94 124.84 3fki s ASN 126 Ca 0.52 -0.72 -0.16 0.00 0.04 0.00 0.00 52.86 52.54 3fki s ASN 126 Cb -0.27 -0.38 -0.00 0.00 -1.54 0.00 0.00 41.25 39.06 3fki s ASN 126 CO 0.32 -0.34 1.14 -2.84 -3.04 0.00 0.00 177.10 172.33 3fki s PRO 127 N 2.03 2.78 0.30 0.43 0.02 -1.26 -5.10 135.00 134.20 3fki s PRO 127 Ca 0.01 1.52 -0.28 0.00 0.02 0.00 0.00 61.00 62.27 3fki s PRO 127 Cb -0.16 -1.94 -0.14 0.00 0.02 0.00 0.00 34.50 32.28 3fki s PRO 127 CO -0.10 -1.29 1.06 -2.30 -0.33 0.00 0.00 177.00 174.04 3fki n PRO 128 N -2.23 1.47 -4.00 5.54 -0.02 -1.07 -4.98 135.00 129.70 3fki n PRO 128 Ca 0.11 0.51 -0.10 0.00 -2.02 0.00 0.00 63.50 62.01 3fki n PRO 128 Cb 0.51 -1.92 -0.07 0.00 -0.02 0.00 0.00 33.50 32.00 3fki n PRO 128 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3fki s SER 129 N -0.51 0.03 -0.06 2.55 1.04 -1.26 -4.65 113.70 110.83 3fki s SER 129 Ca 0.58 -0.95 0.04 0.00 0.48 0.00 0.00 55.95 56.10 3fki s SER 129 Cb -0.68 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 65.88 3fki s SER 129 CO 0.60 -0.94 -0.17 -0.31 0.98 0.00 0.00 173.24 173.40 3fki s TYR 130 N -4.01 2.65 0.09 5.02 1.51 -0.28 -2.27 117.35 120.06 3fki s TYR 130 Ca 0.21 -0.33 0.10 0.00 -1.01 0.00 0.00 57.07 56.04 3fki s TYR 130 Cb 0.03 -1.65 -0.03 0.00 -0.11 0.00 0.00 41.96 40.20 3fki s TYR 130 CO 0.04 0.05 -0.25 -0.65 -1.11 0.00 0.00 175.55 173.63 3fki s GLN 131 N -0.48 1.67 0.00 -0.62 -0.21 -0.03 -2.20 119.66 117.79 3fki s GLN 131 Ca 0.06 -1.20 0.00 0.00 0.02 0.00 0.00 55.36 54.24 3fki s GLN 131 Cb -0.12 -1.99 0.00 0.00 1.00 0.00 0.00 33.01 31.90 3fki s GLN 131 CO 0.02 0.49 0.00 0.45 -2.12 0.00 0.00 175.29 174.12 3fki n SER 132 N 1.28 0.00 0.02 5.90 2.88 -1.14 -1.04 113.62 121.52 3fki n SER 132 Ca -0.17 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.36 3fki n SER 132 Cb 0.52 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.98 3fki n SER 132 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3fki h SER 133 N 0.00 -0.07 0.00 -3.46 0.02 -2.00 -3.43 113.55 104.60 3fki h SER 133 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fki h SER 133 Cb 0.00 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3fki h SER 133 CO 0.00 0.09 -0.09 -1.84 -1.14 0.00 0.00 176.83 173.85 3fki n GLU 134 N -3.01 4.51 -2.19 3.45 0.28 -1.26 -5.08 120.64 117.34 3fki n GLU 134 Ca -0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.58 3fki n GLU 134 Cb 0.03 -0.41 -0.03 0.00 1.43 0.00 0.00 31.44 32.46 3fki n GLU 134 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3fki s ASP 135 N -0.79 6.86 -0.09 -1.84 1.01 -1.26 -5.04 116.67 115.53 3fki s ASP 135 Ca 0.00 2.46 0.03 0.00 0.71 0.00 0.00 52.55 55.75 3fki s ASP 135 Cb 0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 3fki s ASP 135 CO 0.00 -0.54 -0.17 0.68 0.21 0.00 0.00 175.17 175.35 3fki s VAL 136 N -0.07 1.55 -0.29 -1.27 -7.23 -1.26 -2.90 120.40 108.92 3fki s VAL 136 Ca 0.56 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 60.05 3fki s VAL 136 Cb -0.37 -1.38 0.08 0.00 0.56 0.00 0.00 36.38 35.26 3fki s VAL 136 CO 0.40 0.45 -0.02 -0.63 -0.31 0.00 0.00 175.10 175.00 3fki s ILE 137 N 0.66 1.93 0.00 -0.62 1.01 -0.94 -4.90 121.20 118.35 3fki s ILE 137 Ca -0.14 -1.78 0.00 0.00 0.00 0.00 0.00 60.65 58.73 3fki s ILE 137 Cb -0.16 -2.26 0.00 0.00 0.01 0.00 0.00 42.46 40.05 3fki s ILE 137 CO 0.04 -0.33 0.00 0.41 0.00 0.00 0.00 174.94 175.06 3fki n THR 138 N 4.46 0.00 -0.04 2.92 -1.04 -1.26 -1.12 114.28 118.20 3fki n THR 138 Ca -0.06 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.88 3fki n THR 138 Cb 0.42 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.87 3fki n THR 138 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3fki h ILE 139 N 0.00 0.85 0.00 12.58 2.04 -1.84 -3.36 117.51 127.77 3fki h ILE 139 Ca 0.00 -1.56 0.00 0.00 1.00 0.00 0.00 64.86 64.30 3fki h ILE 139 Cb 0.00 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3fki h ILE 139 CO 0.00 0.28 0.00 0.29 0.00 0.00 0.00 178.15 178.72 3fki n LYS 140 N -4.73 0.45 -1.95 2.37 4.76 -1.26 -3.28 118.16 114.52 3fki n LYS 140 Ca -0.05 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.02 3fki n LYS 140 Cb 0.23 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.90 3fki n LYS 140 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3fki s SER 141 N -2.38 6.57 -0.24 4.39 1.04 -1.26 -4.87 113.70 116.95 3fki s SER 141 Ca 0.26 2.75 -0.17 0.00 0.48 0.00 0.00 55.95 59.27 3fki s SER 141 Cb 0.15 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 63.61 3fki s SER 141 CO 0.32 -0.76 0.45 -0.13 0.98 0.00 0.00 173.24 174.10 3fki s ARG 142 N -0.45 4.09 -0.05 4.02 0.52 -1.26 -3.42 118.95 122.39 3fki s ARG 142 Ca 0.60 0.23 0.02 0.00 -0.52 0.00 0.00 55.73 56.06 3fki s ARG 142 Cb -0.44 -3.62 0.01 0.00 0.52 0.00 0.00 34.95 31.43 3fki s ARG 142 CO 0.45 -0.24 -0.11 0.42 0.02 0.00 0.00 175.30 175.85 3fki s ILE 143 N 1.94 0.98 -0.24 1.52 1.01 -1.02 -3.03 121.20 122.37 3fki s ILE 143 Ca 0.19 -0.41 -0.17 0.00 0.00 0.00 0.00 60.65 60.26 3fki s ILE 143 Cb -0.15 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 3fki s ILE 143 CO 0.09 0.32 0.49 -0.60 0.00 0.00 0.00 174.94 175.23 3fki s ARG 144 N 0.60 4.11 -0.03 2.79 3.52 -1.13 -1.93 118.95 126.88 3fki s ARG 144 Ca -0.12 0.30 0.05 0.00 -0.13 0.00 0.00 55.73 55.83 3fki s ARG 144 Cb -0.14 -3.61 -0.03 0.00 -1.56 0.00 0.00 34.95 29.61 3fki s ARG 144 CO 0.02 -0.25 -0.15 0.08 -0.81 0.00 0.00 175.30 174.19 3fki s VAL 145 N 1.98 2.99 -0.27 7.11 1.01 0.22 -3.61 120.40 129.83 3fki s VAL 145 Ca 0.21 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 3fki s VAL 145 Cb -0.15 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 3fki s VAL 145 CO 0.09 0.53 0.21 -0.75 0.00 0.00 0.00 175.10 175.18 3fki s LYS 146 N -0.91 3.99 -0.16 2.72 2.20 -1.06 -1.46 119.74 125.05 3fki s LYS 146 Ca 0.12 -0.26 -0.29 0.00 -0.36 0.00 0.00 55.97 55.18 3fki s LYS 146 Cb -0.11 -3.63 -0.01 0.00 -1.51 0.00 0.00 37.83 32.58 3fki s LYS 146 CO 0.02 -0.14 1.09 0.42 -0.36 0.00 0.00 175.35 176.38 3fki s ILE 147 N 1.65 4.58 -0.26 5.43 1.01 0.25 -1.72 121.20 132.14 3fki s ILE 147 Ca 0.08 1.89 -0.11 0.00 0.00 0.00 0.00 60.65 62.52 3fki s ILE 147 Cb -0.15 -4.22 -0.14 0.00 0.01 0.00 0.00 42.46 37.95 3fki s ILE 147 CO 0.10 -0.10 -0.24 1.21 0.00 0.00 0.00 174.94 175.91 3fki n GLU 148 N 5.85 0.61 -4.15 2.79 4.07 -0.61 -1.90 120.64 127.29 3fki n GLU 148 Ca 0.11 0.27 -0.16 0.00 -0.06 0.00 0.00 57.16 57.33 3fki n GLU 148 Cb 0.47 -1.53 -0.12 0.00 -0.06 0.00 0.00 31.44 30.19 3fki n GLU 148 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 3fki s GLY 149 N -5.67 0.56 -0.17 8.31 0.00 -1.21 -4.59 107.32 104.54 3fki s GLY 149 Ca -0.36 -0.70 -0.01 0.00 0.00 0.00 0.00 44.72 43.64 3fki s GLY 149 CO 0.54 -0.72 -0.11 0.00 0.00 0.00 0.00 173.10 172.81 3fki s ILE 151 N 0.90 1.96 -0.03 0.00 1.01 0.27 -5.02 121.20 120.29 3fki s ILE 151 Ca -0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.65 3fki s ILE 151 Cb -0.15 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.51 3fki s ILE 151 CO -0.00 0.53 0.25 -0.94 0.00 0.00 0.00 174.94 174.77 3fki s SER 152 N 1.17 6.52 0.00 3.58 1.04 -1.26 -0.54 113.70 124.21 3fki s SER 152 Ca 0.01 0.60 0.00 0.00 0.48 0.00 0.00 55.95 57.04 3fki s SER 152 Cb -0.14 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.87 3fki s SER 152 CO -0.09 0.32 0.00 1.67 0.98 0.00 0.00 173.24 176.12 3fki n GLN 153 N 1.52 2.65 0.00 4.02 7.27 0.17 -4.98 117.38 128.02 3fki n GLN 153 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.92 3fki n GLN 153 Cb 0.53 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.18 3fki n GLN 153 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3fki n VAL 154 N 0.00 0.00 -1.61 1.69 0.31 -1.26 -4.50 118.33 112.96 3fki n VAL 154 Ca 0.00 0.61 -0.02 0.00 -0.01 0.00 0.00 64.34 64.91 3fki n VAL 154 Cb 0.00 -1.29 0.18 0.00 -0.91 0.00 0.00 33.84 31.82 3fki n VAL 154 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3fki n SER 155 N -1.28 2.50 -3.70 4.52 3.41 -1.26 -4.69 113.62 113.13 3fki n SER 155 Ca 0.00 -3.85 -0.14 0.00 -0.26 0.00 0.00 58.87 54.61 3fki n SER 155 Cb 0.00 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.32 3fki n SER 155 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3fki s SER 156 N -3.04 -0.33 -0.07 4.04 0.01 -1.26 -4.75 113.70 108.29 3fki s SER 156 Ca 0.42 0.31 0.04 0.00 1.31 0.00 0.00 55.95 58.03 3fki s SER 156 Cb 0.39 0.42 0.00 0.00 0.21 0.00 0.00 66.02 67.04 3fki s SER 156 CO -0.03 -0.46 -0.19 -0.63 0.41 0.00 0.00 173.24 172.33 3fki s ILE 157 N -1.16 1.67 0.20 1.44 1.01 -1.26 -0.65 121.20 122.44 3fki s ILE 157 Ca -0.12 -0.81 0.10 0.00 0.00 0.00 0.00 60.65 59.82 3fki s ILE 157 Cb -0.04 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 3fki s ILE 157 CO 0.05 0.47 -0.19 -1.00 0.00 0.00 0.00 174.94 174.28 3fki s HIS 158 N 0.32 1.99 0.02 3.97 3.76 0.30 -4.24 115.29 121.40 3fki s HIS 158 Ca -0.13 -0.44 0.01 0.00 -0.15 0.00 0.00 55.06 54.35 3fki s HIS 158 Cb -0.16 -0.95 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 3fki s HIS 158 CO 0.06 0.45 -0.05 0.00 -0.85 0.00 0.00 174.74 174.35 3fki s ALA 159 N -2.24 0.32 -0.25 -1.40 0.00 -1.24 -0.56 121.76 116.39 3fki s ALA 159 Ca 0.21 -0.47 -0.16 0.00 0.00 0.00 0.00 51.96 51.54 3fki s ALA 159 Cb -0.05 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 3fki s ALA 159 CO 0.09 -0.03 0.44 0.42 0.00 0.00 0.00 175.76 176.68 3fki s ILE 160 N -0.88 5.14 0.29 0.00 1.01 -1.06 -1.12 121.20 124.59 3fki s ILE 160 Ca -0.07 0.74 0.07 0.00 0.00 0.00 0.00 60.65 61.39 3fki s ILE 160 Cb -0.06 -3.76 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 3fki s ILE 160 CO -0.00 0.16 0.22 -0.83 0.00 0.00 0.00 174.94 174.48 3fki s GLY 161 N 1.43 1.62 -0.02 6.18 0.00 0.80 -1.58 107.32 115.75 3fki s GLY 161 Ca 0.19 -1.56 -0.02 0.00 0.00 0.00 0.00 44.72 43.32 3fki s GLY 161 CO 0.09 -1.55 0.06 -1.35 0.00 0.00 0.00 173.10 170.35 3fki s SER 162 N -3.90 -0.06 -0.10 1.64 1.04 -0.70 -4.12 113.70 107.51 3fki s SER 162 Ca 0.36 0.12 0.14 0.00 0.48 0.00 0.00 55.95 57.05 3fki s SER 162 Cb -0.06 0.12 0.29 0.00 0.10 0.00 0.00 66.02 66.47 3fki s SER 162 CO 0.25 -0.03 1.14 2.30 0.98 0.00 0.00 173.24 177.89 3fki n ILE 163 N 3.03 1.17 0.08 -1.02 -5.35 -1.22 -2.57 119.36 113.47 3fki n ILE 163 Ca -0.12 -1.78 -0.08 0.00 -0.27 0.00 0.00 62.75 60.50 3fki n ILE 163 Cb 0.60 0.18 0.03 0.00 -1.74 0.00 0.00 39.64 38.71 3fki n ILE 163 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3fki h LYS 164 N 0.49 0.22 -7.33 6.28 3.64 -1.89 -3.40 116.57 114.60 3fki h LYS 164 Ca -0.05 -0.21 -0.51 0.00 -1.27 0.00 0.00 60.65 58.61 3fki h LYS 164 Cb 1.28 0.05 0.12 0.00 -0.41 0.00 0.00 32.23 33.27 3fki h LYS 164 CO 0.02 0.90 0.32 -1.21 -2.27 0.00 0.00 179.45 177.21 3fki s GLU 165 N -3.40 2.29 0.84 1.90 0.41 -1.26 -4.86 118.70 114.62 3fki s GLU 165 Ca -0.03 1.05 -0.11 0.00 -0.41 0.00 0.00 54.97 55.47 3fki s GLU 165 Cb 0.11 -1.91 0.09 0.00 -1.78 0.00 0.00 34.13 30.64 3fki s GLU 165 CO 0.82 -1.58 1.09 -0.51 -0.49 0.00 0.00 175.26 174.59 3fki s ASP 166 N -3.52 4.06 0.00 -0.19 1.01 -1.26 -3.77 116.67 113.01 3fki s ASP 166 Ca 0.61 1.39 0.00 0.00 0.71 0.00 0.00 52.55 55.26 3fki s ASP 166 Cb -0.16 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 41.66 3fki s ASP 166 CO 0.56 -2.25 0.00 -1.22 0.21 0.00 0.00 175.17 172.46 3fki n TYR 167 N -3.62 0.00 -0.28 4.23 4.02 -1.26 -4.92 117.16 115.32 3fki n TYR 167 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 3fki n TYR 167 Cb 0.56 -0.81 0.00 0.00 -0.02 0.00 0.00 39.34 39.06 3fki n TYR 167 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3fki n LEU 168 N 0.00 0.00 0.00 7.72 4.77 -1.25 -4.95 117.00 123.30 3fki n LEU 168 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3fki n LEU 168 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3fki n LEU 168 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3fki n GLY 169 N 5.00 1.66 3.41 -0.72 0.00 -1.24 -4.83 105.19 108.46 3fki n GLY 169 Ca 0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 3fki n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fki s ALA 170 N -1.00 2.38 -1.13 4.61 0.00 -1.26 -2.82 121.76 122.54 3fki s ALA 170 Ca 0.00 -1.76 0.09 0.00 0.00 0.00 0.00 51.96 50.29 3fki s ALA 170 Cb 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 23.12 23.01 3fki s ALA 170 CO 0.00 0.18 0.79 -0.89 0.00 0.00 0.00 175.76 175.84