#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k8c n ILE 5 N 0.00 0.24 -1.75 2.46 5.41 -1.26 -4.91 119.36 119.55 1k8c n ILE 5 Ca 0.00 -0.40 -0.40 0.00 1.00 0.00 0.00 62.75 62.96 1k8c n ILE 5 Cb 0.00 -2.17 0.03 0.00 -0.71 0.00 0.00 39.64 36.78 1k8c n ILE 5 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1k8c n PRO 6 N 8.56 2.01 -3.91 0.38 -0.02 -1.26 -4.76 135.00 135.99 1k8c n PRO 6 Ca 0.36 0.72 -0.23 0.00 -2.02 0.00 0.00 63.50 62.34 1k8c n PRO 6 Cb 0.36 -2.59 -0.02 0.00 -0.02 0.00 0.00 33.50 31.23 1k8c n PRO 6 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1k8c s ASP 7 N -0.64 6.32 -0.08 2.55 1.01 -1.26 -1.26 116.67 123.31 1k8c s ASP 7 Ca 0.65 0.13 0.04 0.00 0.71 0.00 0.00 52.55 54.08 1k8c s ASP 7 Cb -0.44 -1.89 0.00 0.00 1.01 0.00 0.00 42.92 41.60 1k8c s ASP 7 CO 0.54 -0.06 -0.20 -0.63 0.21 0.00 0.00 175.17 175.03 1k8c s ILE 8 N -1.95 1.74 -0.24 0.77 1.01 0.57 -4.85 121.20 118.26 1k8c s ILE 8 Ca 0.35 -0.84 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 1k8c s ILE 8 Cb -0.10 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.85 1k8c s ILE 8 CO 0.29 0.49 0.80 -0.75 0.00 0.00 0.00 174.94 175.78 1k8c s LYS 9 N 0.40 4.18 0.60 2.79 2.20 -1.26 -0.27 119.74 128.38 1k8c s LYS 9 Ca -0.16 0.90 -0.10 0.00 -0.36 0.00 0.00 55.97 56.25 1k8c s LYS 9 Cb -0.17 -3.64 -0.03 0.00 -1.51 0.00 0.00 37.83 32.48 1k8c s LYS 9 CO 0.07 -0.49 0.99 -0.51 -0.36 0.00 0.00 175.35 175.05 1k8c s LEU 10 N 2.74 3.28 0.16 5.43 1.43 0.04 -4.91 118.68 126.83 1k8c s LEU 10 Ca 0.34 1.29 0.10 0.00 -1.03 0.00 0.00 54.13 54.83 1k8c s LEU 10 Cb -0.15 -4.30 0.54 0.00 0.03 0.00 0.00 46.19 42.31 1k8c s LEU 10 CO 0.08 -0.86 1.28 -1.54 0.23 0.00 0.00 176.35 175.54 1k8c n SER 11 N -2.68 0.26 -0.08 2.29 3.41 -1.26 -0.15 113.62 115.41 1k8c n SER 11 Ca 0.05 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.39 1k8c n SER 11 Cb 0.55 -0.62 0.41 0.00 -0.26 0.00 0.00 64.21 64.28 1k8c n SER 11 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1k8c n SER 12 N -1.84 0.54 0.00 4.04 3.41 -1.26 -4.93 113.62 113.58 1k8c n SER 12 Ca -0.01 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 1k8c n SER 12 Cb 0.05 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1k8c n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k8c n GLY 13 N 1.41 3.03 3.77 5.00 0.00 0.79 -5.05 105.19 114.15 1k8c n GLY 13 Ca 0.09 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1k8c n GLY 13 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k8c s HIS 14 N -1.82 2.59 0.22 1.61 4.02 -1.26 -4.61 115.29 116.05 1k8c s HIS 14 Ca 0.00 1.54 -0.08 0.00 1.02 0.00 0.00 55.06 57.54 1k8c s HIS 14 Cb 0.00 -3.31 -0.07 0.00 -1.02 0.00 0.00 32.58 28.19 1k8c s HIS 14 CO 0.00 -1.74 0.52 -0.51 1.02 0.00 0.00 174.74 174.03 1k8c s LEU 15 N -4.10 4.17 -0.05 0.89 1.43 -1.26 -0.78 118.68 118.98 1k8c s LEU 15 Ca 0.72 0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 54.66 1k8c s LEU 15 Cb -0.25 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.40 1k8c s LEU 15 CO 0.31 -0.07 0.01 -0.32 0.23 0.00 0.00 176.35 176.51 1k8c s MET 16 N -2.90 0.35 0.53 1.70 -2.45 0.63 -4.92 119.30 112.24 1k8c s MET 16 Ca 0.46 0.14 -0.21 0.00 -1.25 0.00 0.00 55.69 54.83 1k8c s MET 16 Cb -0.11 -0.67 -0.07 0.00 1.25 0.00 0.00 34.83 35.23 1k8c s MET 16 CO 0.23 -0.23 0.94 -2.30 1.05 0.00 0.00 175.02 174.72 1k8c n PRO 17 N 4.71 1.06 0.04 4.11 -0.02 -1.26 -0.31 135.00 143.32 1k8c n PRO 17 Ca -0.15 0.40 0.12 0.00 -2.02 0.00 0.00 63.50 61.84 1k8c n PRO 17 Cb 0.50 -2.08 0.19 0.00 -0.02 0.00 0.00 33.50 32.09 1k8c n PRO 17 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1k8c n SER 18 N -0.14 0.61 -4.04 2.55 3.41 -0.39 -4.73 113.62 110.89 1k8c n SER 18 Ca 0.12 -0.01 -0.27 0.00 -0.26 0.00 0.00 58.87 58.44 1k8c n SER 18 Cb 0.44 0.23 -0.17 0.00 -0.26 0.00 0.00 64.21 64.46 1k8c n SER 18 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1k8c s ILE 19 N -3.12 1.36 0.31 -1.33 1.01 -1.26 -0.57 121.20 117.61 1k8c s ILE 19 Ca 0.08 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.19 1k8c s ILE 19 Cb 0.15 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 1k8c s ILE 19 CO 0.72 0.41 0.13 0.61 0.00 0.00 0.00 174.94 176.81 1k8c n GLY 20 N 4.09 3.37 3.16 6.18 0.00 0.65 -4.54 105.19 118.12 1k8c n GLY 20 Ca -0.20 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 1k8c n GLY 20 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1k8c s PHE 21 N -2.82 2.98 0.30 1.61 5.36 0.06 -3.40 117.98 122.06 1k8c s PHE 21 Ca 0.19 -1.63 -0.29 0.00 -0.96 0.00 0.00 56.93 54.24 1k8c s PHE 21 Cb 0.01 -1.99 -0.10 0.00 -0.34 0.00 0.00 43.02 40.60 1k8c s PHE 21 CO 0.13 -0.76 1.15 0.20 -1.46 0.00 0.00 175.22 174.49 1k8c s GLY 22 N 1.30 3.04 0.00 13.12 0.00 -1.03 -1.50 107.32 122.25 1k8c s GLY 22 Ca 0.01 0.99 0.11 0.00 0.00 0.00 0.00 44.72 45.84 1k8c s GLY 22 CO -0.08 1.60 1.00 0.00 0.00 0.00 0.00 173.10 175.63 1k8c s TRP 24 N -0.98 3.04 0.00 0.00 -0.00 -1.26 -2.45 118.94 117.30 1k8c s TRP 24 Ca 0.17 0.75 0.00 0.00 -0.00 0.00 0.00 56.10 57.02 1k8c s TRP 24 Cb 0.11 -3.80 0.00 0.00 -0.00 0.00 0.00 33.47 29.78 1k8c s TRP 24 CO 0.15 -2.93 0.00 1.63 -0.00 0.00 0.00 176.95 175.81 1k8c n LYS 25 N 4.29 -0.49 -2.10 5.86 4.76 -1.26 -4.97 118.16 124.25 1k8c n LYS 25 Ca 0.13 0.12 -0.43 0.00 -2.87 0.00 0.00 58.31 55.26 1k8c n LYS 25 Cb 0.41 -3.50 -0.03 0.00 -1.84 0.00 0.00 35.03 30.08 1k8c n LYS 25 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1k8c s LEU 26 N 0.00 3.90 0.29 -0.35 1.02 -1.03 -4.91 118.68 117.60 1k8c s LEU 26 Ca 0.00 1.63 -0.29 0.00 0.02 0.00 0.00 54.13 55.49 1k8c s LEU 26 Cb 0.00 -3.53 -0.13 0.00 0.02 0.00 0.00 46.19 42.55 1k8c s LEU 26 CO 0.00 -1.26 1.21 0.00 0.02 0.00 0.00 176.35 176.32 1k8c n ALA 27 N 8.46 0.62 -0.33 4.21 0.00 -1.26 -4.71 120.51 127.50 1k8c n ALA 27 Ca 0.19 0.39 0.02 0.00 0.00 0.00 0.00 53.44 54.04 1k8c n ALA 27 Cb 0.45 -2.16 0.20 0.00 0.00 0.00 0.00 19.45 17.94 1k8c n ALA 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1k8c h ASN 28 N 2.74 0.99 0.33 0.00 4.21 -1.93 0.15 115.58 122.07 1k8c h ASN 28 Ca -0.43 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.04 1k8c h ASN 28 Cb 1.30 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 38.29 1k8c h ASN 28 CO 0.65 0.65 -0.18 0.00 -1.29 0.00 0.00 177.43 177.26 1k8c h ALA 29 N 1.47 1.40 0.00 -0.83 0.00 -2.02 -3.23 119.26 116.06 1k8c h ALA 29 Ca 0.39 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1k8c h ALA 29 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1k8c h ALA 29 CO -0.14 0.23 0.00 0.25 0.00 0.00 0.00 179.25 179.59 1k8c n THR 30 N -3.89 0.35 -0.26 0.00 -2.24 -0.93 -4.77 114.28 102.55 1k8c n THR 30 Ca -0.02 -0.64 -0.05 0.00 -2.27 0.00 0.00 64.05 61.07 1k8c n THR 30 Cb 0.27 0.86 0.06 0.00 -2.10 0.00 0.00 70.33 69.43 1k8c n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k8c h ALA 31 N 0.00 0.91 -0.09 6.98 0.00 -0.73 -0.32 119.26 126.01 1k8c h ALA 31 Ca 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1k8c h ALA 31 Cb 0.22 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1k8c h ALA 31 CO 0.00 0.31 -0.04 0.78 0.00 0.00 0.00 179.25 180.30 1k8c h GLY 32 N 0.95 0.04 0.98 0.00 0.00 -1.78 -0.07 103.07 103.20 1k8c h GLY 32 Ca 0.26 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 1k8c h GLY 32 CO -0.06 -0.05 0.21 -2.09 0.00 0.00 0.00 176.54 174.54 1k8c h GLU 33 N -0.03 0.81 -0.71 4.80 4.57 -1.81 -1.11 114.58 121.10 1k8c h GLU 33 Ca 0.05 -0.15 -0.06 0.00 -1.18 0.00 0.00 59.36 58.02 1k8c h GLU 33 Cb 0.11 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 1k8c h GLU 33 CO -0.11 0.71 0.19 1.96 -1.18 0.00 0.00 179.01 180.58 1k8c h GLN 34 N 0.73 1.12 -0.42 1.92 4.20 -0.80 0.10 115.11 121.97 1k8c h GLN 34 Ca 0.18 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1k8c h GLN 34 Cb 0.21 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1k8c h GLN 34 CO -0.01 0.98 0.12 0.28 -0.67 0.00 0.00 178.83 179.53 1k8c h VAL 35 N 1.06 1.22 -0.37 -0.54 2.07 -0.89 -0.29 116.25 118.52 1k8c h VAL 35 Ca 0.23 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1k8c h VAL 35 Cb 0.35 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1k8c h VAL 35 CO -0.00 0.26 0.17 0.22 0.02 0.00 0.00 177.57 178.24 1k8c h TYR 36 N 0.53 0.31 -0.83 1.57 3.20 -0.76 -0.01 116.97 120.99 1k8c h TYR 36 Ca 0.13 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 1k8c h TYR 36 Cb 0.28 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 1k8c h TYR 36 CO 0.01 0.16 0.40 1.96 -1.64 0.00 0.00 178.16 179.06 1k8c h GLN 37 N 0.35 1.19 -0.77 1.82 1.08 -0.62 -1.19 115.11 116.98 1k8c h GLN 37 Ca 0.16 -0.17 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 1k8c h GLN 37 Cb 0.08 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.26 1k8c h GLN 37 CO -0.12 0.91 0.36 0.00 -0.95 0.00 0.00 178.83 179.03 1k8c h ALA 38 N 1.26 1.00 -0.23 3.87 0.00 -0.41 0.82 119.26 125.57 1k8c h ALA 38 Ca 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1k8c h ALA 38 Cb 0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1k8c h ALA 38 CO -0.04 0.57 0.11 0.82 0.00 0.00 0.00 179.25 180.72 1k8c h ILE 39 N 1.10 1.14 0.00 0.00 2.04 -0.36 -0.93 117.51 120.50 1k8c h ILE 39 Ca 0.26 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1k8c h ILE 39 Cb 0.13 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1k8c h ILE 39 CO -0.03 0.14 -0.00 0.11 0.00 0.00 0.00 178.15 178.37 1k8c h LYS 40 N 0.24 0.00 -0.00 2.37 1.57 -0.76 -1.13 116.57 118.86 1k8c h LYS 40 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1k8c h LYS 40 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1k8c h LYS 40 CO -0.01 0.00 -0.02 0.00 -0.57 0.00 0.00 179.45 178.85 1k8c n ALA 41 N -2.49 2.63 0.00 3.86 0.00 0.24 -4.90 120.51 119.85 1k8c n ALA 41 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1k8c n ALA 41 Cb 0.09 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.09 1k8c n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k8c n GLY 42 N 1.17 0.91 3.77 0.00 0.00 -0.43 -4.98 105.19 105.63 1k8c n GLY 42 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1k8c n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k8c s TYR 43 N -2.00 3.75 0.00 1.61 1.51 -0.44 -4.95 117.35 116.82 1k8c s TYR 43 Ca 0.00 1.81 0.00 0.00 -1.01 0.00 0.00 57.07 57.87 1k8c s TYR 43 Cb 0.00 -3.00 0.00 0.00 -0.11 0.00 0.00 41.96 38.85 1k8c s TYR 43 CO 0.00 0.14 0.00 0.54 -1.11 0.00 0.00 175.55 175.12 1k8c n ARG 44 N 0.90 1.99 -4.14 -0.62 5.12 -1.26 -4.23 116.66 114.42 1k8c n ARG 44 Ca 0.00 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 1k8c n ARG 44 Cb 0.48 -0.84 -0.11 0.00 -1.16 0.00 0.00 32.46 30.83 1k8c n ARG 44 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1k8c s LEU 45 N -2.21 3.60 -0.21 0.55 0.20 -1.26 0.07 118.68 119.42 1k8c s LEU 45 Ca 0.00 -0.01 0.02 0.00 0.69 0.00 0.00 54.13 54.83 1k8c s LEU 45 Cb 0.00 -1.90 0.04 0.00 -0.43 0.00 0.00 46.19 43.90 1k8c s LEU 45 CO 0.00 0.16 -0.14 -0.36 -0.29 0.00 0.00 176.35 175.73 1k8c s PHE 46 N 0.41 2.78 -0.53 5.38 0.40 -0.54 -0.76 117.98 125.12 1k8c s PHE 46 Ca 0.01 -1.82 -0.23 0.00 -0.60 0.00 0.00 56.93 54.28 1k8c s PHE 46 Cb -0.13 -1.81 0.04 0.00 0.51 0.00 0.00 43.02 41.63 1k8c s PHE 46 CO 0.01 -0.80 0.88 0.34 0.70 0.00 0.00 175.22 176.35 1k8c s ASP 47 N 1.28 6.34 0.00 1.36 2.15 -0.56 -1.63 116.67 125.60 1k8c s ASP 47 Ca -0.01 -0.39 0.00 0.00 0.43 0.00 0.00 52.55 52.58 1k8c s ASP 47 Cb -0.16 -2.41 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1k8c s ASP 47 CO -0.09 -1.14 0.00 0.61 -0.17 0.00 0.00 175.17 174.39 1k8c n GLY 48 N 5.10 4.25 3.61 2.66 0.00 0.47 -1.04 105.19 120.25 1k8c n GLY 48 Ca 0.01 -2.20 -0.06 0.00 0.00 0.00 0.00 46.02 43.76 1k8c n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k8c s ALA 49 N -2.00 -2.02 0.22 4.61 0.00 -1.26 -3.80 121.76 117.51 1k8c s ALA 49 Ca 0.00 1.72 -0.09 0.00 0.00 0.00 0.00 51.96 53.60 1k8c s ALA 49 Cb 0.00 -1.05 0.19 0.00 0.00 0.00 0.00 23.12 22.25 1k8c s ALA 49 CO 0.00 -0.29 1.88 0.93 0.00 0.00 0.00 175.76 178.28 1k8c h GLU 50 N 2.31 1.12 0.00 0.00 5.08 -1.91 -1.99 114.58 119.19 1k8c h GLU 50 Ca -0.13 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1k8c h GLU 50 Cb 1.17 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 1k8c h GLU 50 CO 0.27 0.76 -0.01 0.22 -1.00 0.00 0.00 179.01 179.25 1k8c h ASP 51 N 1.14 0.00 0.76 1.42 3.58 -1.96 -1.98 116.42 119.38 1k8c h ASP 51 Ca 0.30 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.75 1k8c h ASP 51 Cb -0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 40.96 1k8c h ASP 51 CO -0.06 0.01 0.00 -1.22 -2.88 0.00 0.00 179.24 175.09 1k8c n TYR 52 N -3.89 0.85 -1.46 0.28 4.01 -0.75 -4.89 117.16 111.32 1k8c n TYR 52 Ca -0.03 0.33 -0.16 0.00 -0.16 0.00 0.00 57.90 57.89 1k8c n TYR 52 Cb 0.09 -1.04 -0.07 0.00 -0.31 0.00 0.00 39.34 38.02 1k8c n TYR 52 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k8c n GLY 53 N 0.03 1.53 0.32 2.72 0.00 -0.75 -4.75 105.19 104.30 1k8c n GLY 53 Ca 0.02 -0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.04 1k8c n GLY 53 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1k8c n ASN 54 N -1.13 1.21 -0.04 1.61 0.23 -1.26 -4.83 115.26 111.05 1k8c n ASN 54 Ca -0.16 -2.58 0.03 0.00 -0.53 0.00 0.00 54.58 51.34 1k8c n ASN 54 Cb 0.61 -0.32 0.38 0.00 -2.08 0.00 0.00 39.78 38.37 1k8c n ASN 54 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1k8c h GLU 55 N 0.06 0.62 -0.52 -3.83 5.08 -1.88 0.83 114.58 114.94 1k8c h GLU 55 Ca -0.01 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1k8c h GLU 55 Cb 1.21 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 1k8c h GLU 55 CO 0.00 0.42 0.32 -0.22 -1.00 0.00 0.00 179.01 178.54 1k8c h LYS 56 N 0.63 0.63 -0.12 2.33 3.64 -1.88 0.13 116.57 121.93 1k8c h LYS 56 Ca 0.17 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.31 1k8c h LYS 56 Cb -0.04 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1k8c h LYS 56 CO -0.03 0.42 -0.75 0.93 -2.27 0.00 0.00 179.45 177.75 1k8c h GLU 57 N 0.65 0.62 -0.53 1.90 3.07 -1.60 -0.72 114.58 117.97 1k8c h GLU 57 Ca 0.20 -0.50 -0.02 0.00 -0.50 0.00 0.00 59.36 58.54 1k8c h GLU 57 Cb -0.03 0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 1k8c h GLU 57 CO -0.07 1.12 0.24 0.28 -1.40 0.00 0.00 179.01 179.18 1k8c h VAL 58 N 0.43 1.18 -0.56 3.13 2.07 -0.62 -1.66 116.25 120.21 1k8c h VAL 58 Ca -0.04 -0.54 -0.09 0.00 0.82 0.00 0.00 66.70 66.85 1k8c h VAL 58 Cb 1.35 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1k8c h VAL 58 CO 0.14 0.22 -0.01 1.23 0.02 0.00 0.00 177.57 179.17 1k8c h GLY 59 N 0.86 1.06 0.96 2.17 0.00 -0.29 -2.09 103.07 105.74 1k8c h GLY 59 Ca 0.18 -0.77 -0.02 0.00 0.00 0.00 0.00 47.33 46.72 1k8c h GLY 59 CO -0.02 0.71 0.20 -0.55 0.00 0.00 0.00 176.54 176.88 1k8c h ASP 60 N 0.90 0.64 -0.13 0.19 3.32 -0.35 0.16 116.42 121.14 1k8c h ASP 60 Ca 0.16 -0.16 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1k8c h ASP 60 Cb 0.54 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1k8c h ASP 60 CO 0.03 0.62 -0.03 1.23 -1.72 0.00 0.00 179.24 179.37 1k8c h GLY 61 N 0.62 0.10 1.05 2.75 0.00 -1.06 0.31 103.07 106.83 1k8c h GLY 61 Ca 0.16 0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 1k8c h GLY 61 CO -0.02 -0.05 0.13 -2.08 0.00 0.00 0.00 176.54 174.53 1k8c h VAL 62 N 0.01 1.26 -0.43 4.60 2.07 -1.22 -2.02 116.25 120.52 1k8c h VAL 62 Ca 0.06 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.55 1k8c h VAL 62 Cb 0.09 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1k8c h VAL 62 CO -0.13 0.37 0.06 0.50 0.02 0.00 0.00 177.57 178.38 1k8c h LYS 63 N 0.97 0.67 -0.42 1.57 3.64 -0.61 -1.91 116.57 120.47 1k8c h LYS 63 Ca 0.20 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.33 1k8c h LYS 63 Cb 0.40 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1k8c h LYS 63 CO 0.01 0.65 -0.17 -0.09 -2.27 0.00 0.00 179.45 177.58 1k8c h ARG 64 N 0.64 0.86 -0.23 1.90 2.43 -0.62 0.36 114.38 119.72 1k8c h ARG 64 Ca 0.14 -0.36 -0.05 0.00 -0.81 0.00 0.00 59.98 58.90 1k8c h ARG 64 Cb 0.32 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1k8c h ARG 64 CO 0.01 1.00 -0.08 0.00 -1.51 0.00 0.00 179.97 179.38 1k8c h ALA 65 N 0.84 1.43 0.13 2.80 0.00 -1.04 -1.45 119.26 121.96 1k8c h ALA 65 Ca 0.10 -0.21 -0.30 0.00 0.00 0.00 0.00 54.91 54.50 1k8c h ALA 65 Cb 0.72 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 18.43 1k8c h ALA 65 CO 0.05 0.40 -1.26 0.82 0.00 0.00 0.00 179.25 179.27 1k8c h ILE 66 N 0.35 1.29 -0.16 0.00 2.04 -1.12 0.12 117.51 120.02 1k8c h ILE 66 Ca 0.07 -2.49 -0.06 0.00 1.00 0.00 0.00 64.86 63.38 1k8c h ILE 66 Cb 0.37 2.71 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 1k8c h ILE 66 CO 0.02 0.76 -0.17 0.44 0.00 0.00 0.00 178.15 179.20 1k8c h ASP 67 N 0.26 0.26 -0.03 1.72 3.32 -0.73 -1.10 116.42 120.13 1k8c h ASP 67 Ca -0.19 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.80 1k8c h ASP 67 Cb 1.93 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.41 1k8c h ASP 67 CO 0.24 0.45 0.00 -0.62 -1.72 0.00 0.00 179.24 177.59 1k8c n GLU 68 N -4.23 1.28 -1.14 3.56 1.02 -0.56 -4.91 120.64 115.65 1k8c n GLU 68 Ca -0.01 -0.40 -0.05 0.00 -0.02 0.00 0.00 57.16 56.68 1k8c n GLU 68 Cb 0.30 -1.44 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 1k8c n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1k8c n GLY 69 N 1.02 0.72 0.16 0.62 0.00 -0.42 -4.90 105.19 102.40 1k8c n GLY 69 Ca 0.20 -0.35 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 1k8c n GLY 69 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1k8c h LEU 70 N 0.00 0.26 -8.18 0.99 3.38 -0.99 -3.47 115.31 107.30 1k8c h LEU 70 Ca -0.10 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 1k8c h LEU 70 Cb 0.51 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 41.08 1k8c h LEU 70 CO 0.15 0.83 -0.20 0.68 0.09 0.00 0.00 178.44 180.00 1k8c s VAL 71 N -3.68 0.02 0.12 1.22 -7.23 -1.15 -5.02 120.40 104.68 1k8c s VAL 71 Ca -0.04 -1.39 0.09 0.00 -1.81 0.00 0.00 61.98 58.83 1k8c s VAL 71 Cb 0.12 -2.08 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1k8c s VAL 71 CO 0.80 -0.08 -0.19 -0.54 -0.31 0.00 0.00 175.10 174.78 1k8c s LYS 72 N -4.00 1.73 0.29 4.82 1.02 -1.26 -4.15 119.74 118.19 1k8c s LYS 72 Ca 0.21 -1.22 -0.01 0.00 0.02 0.00 0.00 55.97 54.97 1k8c s LYS 72 Cb 0.01 -2.08 0.65 0.00 -0.52 0.00 0.00 37.83 35.89 1k8c s LYS 72 CO 0.06 0.47 1.58 -0.09 -0.92 0.00 0.00 175.35 176.46 1k8c h ARG 73 N 3.71 0.03 0.00 1.68 9.65 -1.96 0.16 114.38 127.65 1k8c h ARG 73 Ca -0.50 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 1k8c h ARG 73 Cb 1.17 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 1k8c h ARG 73 CO 0.45 0.02 0.00 -0.85 2.80 0.00 0.00 179.97 182.39 1k8c n GLU 74 N -5.47 0.65 0.00 0.20 0.00 -1.26 -1.99 120.64 112.76 1k8c n GLU 74 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.46 1k8c n GLU 74 Cb 0.66 -1.43 0.04 0.00 0.00 0.00 0.00 31.44 30.71 1k8c n GLU 74 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1k8c n GLU 75 N -0.93 1.63 -4.60 3.44 1.02 0.55 -4.89 120.64 116.87 1k8c n GLU 75 Ca 0.13 -1.28 -0.33 0.00 -0.02 0.00 0.00 57.16 55.65 1k8c n GLU 75 Cb 0.06 -1.38 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 1k8c n GLU 75 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1k8c s ILE 76 N -1.94 3.51 -0.34 -3.67 -1.09 -0.84 -4.83 121.20 111.99 1k8c s ILE 76 Ca 0.19 -0.51 -0.09 0.00 -2.23 0.00 0.00 60.65 58.01 1k8c s ILE 76 Cb 0.16 -2.49 0.02 0.00 -1.58 0.00 0.00 42.46 38.57 1k8c s ILE 76 CO 0.37 0.52 0.16 0.12 -1.23 0.00 0.00 174.94 174.89 1k8c s PHE 77 N 0.15 3.21 -0.23 3.97 2.19 0.11 -4.95 117.98 122.44 1k8c s PHE 77 Ca -0.04 -0.92 -0.08 0.00 0.33 0.00 0.00 56.93 56.21 1k8c s PHE 77 Cb -0.14 -2.37 -0.04 0.00 -1.31 0.00 0.00 43.02 39.16 1k8c s PHE 77 CO 0.04 -0.60 0.10 -0.51 1.83 0.00 0.00 175.22 176.08 1k8c s LEU 78 N 1.54 3.78 -0.12 6.12 1.43 -1.26 -1.47 118.68 128.70 1k8c s LEU 78 Ca 0.02 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1k8c s LEU 78 Cb -0.18 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 1k8c s LEU 78 CO 0.05 0.06 -0.05 -0.89 0.23 0.00 0.00 176.35 175.75 1k8c s THR 79 N 1.09 3.82 0.38 5.49 2.01 -0.64 -1.27 115.64 126.52 1k8c s THR 79 Ca 0.05 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 61.69 1k8c s THR 79 Cb -0.14 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 1k8c s THR 79 CO 0.04 0.54 0.13 -0.55 -0.69 0.00 0.00 174.62 174.08 1k8c s SER 80 N -0.08 2.56 -0.03 3.53 0.15 -0.06 -0.40 113.70 119.38 1k8c s SER 80 Ca 0.02 -1.62 -0.02 0.00 0.70 0.00 0.00 55.95 55.03 1k8c s SER 80 Cb -0.13 0.42 0.02 0.00 -1.71 0.00 0.00 66.02 64.61 1k8c s SER 80 CO 0.03 -0.89 0.06 -0.54 1.20 0.00 0.00 173.24 173.10 1k8c s LYS 81 N -3.74 0.04 -0.29 5.44 1.02 -1.25 -1.56 119.74 119.40 1k8c s LYS 81 Ca 0.27 0.14 -0.29 0.00 0.02 0.00 0.00 55.97 56.11 1k8c s LYS 81 Cb 0.04 -0.06 0.01 0.00 -0.52 0.00 0.00 37.83 37.29 1k8c s LYS 81 CO 0.15 -0.06 1.16 -1.17 -0.92 0.00 0.00 175.35 174.50 1k8c s LEU 82 N 0.42 3.95 0.86 3.17 2.96 0.49 -2.84 118.68 127.68 1k8c s LEU 82 Ca -0.03 1.18 -0.11 0.00 -0.22 0.00 0.00 54.13 54.94 1k8c s LEU 82 Cb -0.05 -3.54 0.11 0.00 0.50 0.00 0.00 46.19 43.21 1k8c s LEU 82 CO -0.01 -0.91 1.09 0.86 -1.32 0.00 0.00 176.35 176.05 1k8c s TRP 83 N 3.81 2.41 0.54 5.38 -0.11 -1.26 -2.18 118.94 127.53 1k8c s TRP 83 Ca 0.49 1.31 0.22 0.00 1.22 0.00 0.00 56.10 59.35 1k8c s TRP 83 Cb -0.15 -3.13 1.39 0.00 -1.50 0.00 0.00 33.47 30.08 1k8c s TRP 83 CO 0.17 -2.22 2.08 -0.91 -4.62 0.00 0.00 176.95 171.45 1k8c h ASN 84 N -1.42 0.00 0.63 5.86 2.35 -1.90 -2.56 115.58 118.53 1k8c h ASN 84 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1k8c h ASN 84 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1k8c h ASN 84 CO 0.54 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.91 1k8c n ASN 85 N -4.36 0.00 -1.36 5.81 4.13 -1.26 -0.44 115.26 117.79 1k8c n ASN 85 Ca 0.03 0.08 -0.10 0.00 1.68 0.00 0.00 54.58 56.28 1k8c n ASN 85 Cb 0.35 -0.35 0.14 0.00 -1.54 0.00 0.00 39.78 38.38 1k8c n ASN 85 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1k8c n TYR 86 N -1.35 1.45 0.08 3.10 4.01 -0.96 -3.83 117.16 119.66 1k8c n TYR 86 Ca 0.11 -1.87 -0.09 0.00 -0.16 0.00 0.00 57.90 55.89 1k8c n TYR 86 Cb 0.24 -0.47 -0.06 0.00 -0.31 0.00 0.00 39.34 38.73 1k8c n TYR 86 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1k8c h HIS 87 N 1.39 0.23 -2.20 -0.72 3.86 -1.75 -3.29 115.15 112.67 1k8c h HIS 87 Ca 0.24 -0.15 -0.58 0.00 -1.16 0.00 0.00 60.37 58.72 1k8c h HIS 87 Cb 1.41 -0.02 0.03 0.00 1.06 0.00 0.00 27.41 29.90 1k8c h HIS 87 CO 0.96 1.03 1.04 -3.47 0.86 0.00 0.00 177.93 178.35 1k8c n ASP 88 N -3.54 3.52 -0.36 2.45 -0.08 -1.26 -4.23 116.55 113.05 1k8c n ASP 88 Ca -0.03 1.00 0.27 0.00 -1.51 0.00 0.00 54.79 54.51 1k8c n ASP 88 Cb 0.89 -1.43 0.53 0.00 2.34 0.00 0.00 41.12 43.45 1k8c n ASP 88 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1k8c h PRO 89 N 8.38 0.27 0.00 -0.67 0.11 -1.86 0.25 132.00 138.47 1k8c h PRO 89 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1k8c h PRO 89 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1k8c h PRO 89 CO 0.93 0.18 0.00 0.36 -0.21 0.00 0.00 178.00 179.26 1k8c n LYS 90 N -4.83 0.18 -0.00 1.05 2.85 -1.26 -2.68 118.16 113.46 1k8c n LYS 90 Ca 0.32 0.17 0.01 0.00 -1.05 0.00 0.00 58.31 57.75 1k8c n LYS 90 Cb 1.08 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.95 1k8c n LYS 90 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1k8c n ASN 91 N -1.30 2.94 -0.02 -5.58 5.03 0.84 -4.72 115.26 112.45 1k8c n ASN 91 Ca 0.06 -0.20 -0.09 0.00 0.87 0.00 0.00 54.58 55.23 1k8c n ASN 91 Cb 0.11 1.06 -0.02 0.00 -1.02 0.00 0.00 39.78 39.90 1k8c n ASN 91 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1k8c h VAL 92 N 0.00 0.65 -0.14 2.41 2.07 -1.22 -1.39 116.25 118.63 1k8c h VAL 92 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1k8c h VAL 92 Cb 0.07 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1k8c h VAL 92 CO 0.00 0.00 -0.16 -0.08 0.02 0.00 0.00 177.57 177.35 1k8c h GLU 93 N -0.12 0.23 -0.28 1.57 4.81 -1.86 -0.98 114.58 117.94 1k8c h GLU 93 Ca 0.10 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1k8c h GLU 93 Cb 0.27 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1k8c h GLU 93 CO -0.25 0.40 0.18 1.15 -0.73 0.00 0.00 179.01 179.76 1k8c h THR 94 N 0.21 1.09 -0.15 0.32 2.02 -1.59 0.24 112.91 115.05 1k8c h THR 94 Ca 0.04 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 1k8c h THR 94 Cb 0.42 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1k8c h THR 94 CO 0.03 0.09 0.05 0.00 0.37 0.00 0.00 175.52 176.05 1k8c h ALA 95 N 1.08 0.20 -0.75 6.16 0.00 -0.82 -2.43 119.26 122.70 1k8c h ALA 95 Ca 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1k8c h ALA 95 Cb -0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1k8c h ALA 95 CO -0.02 -0.19 0.42 1.25 0.00 0.00 0.00 179.25 180.71 1k8c h LEU 96 N 0.07 0.93 -1.29 0.00 5.85 -0.93 -1.47 115.31 118.47 1k8c h LEU 96 Ca 0.05 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 1k8c h LEU 96 Cb 0.21 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1k8c h LEU 96 CO -0.00 0.75 -0.00 0.78 -0.34 0.00 0.00 178.44 179.62 1k8c h ASN 97 N 1.05 0.44 -0.25 1.25 2.35 -0.35 0.27 115.58 120.34 1k8c h ASN 97 Ca 0.27 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.87 1k8c h ASN 97 Cb 0.02 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1k8c h ASN 97 CO -0.04 0.51 -0.11 0.50 -1.65 0.00 0.00 177.43 176.64 1k8c h LYS 98 N 0.46 0.51 -0.50 0.81 1.63 -0.89 0.11 116.57 118.69 1k8c h LYS 98 Ca 0.10 -0.22 0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1k8c h LYS 98 Cb 0.30 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.89 1k8c h LYS 98 CO 0.01 0.77 0.33 1.15 -3.45 0.00 0.00 179.45 178.25 1k8c h THR 99 N 0.24 1.11 -0.43 1.00 2.02 -0.72 0.39 112.91 116.53 1k8c h THR 99 Ca 0.06 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1k8c h THR 99 Cb 0.61 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1k8c h THR 99 CO 0.03 0.12 0.17 -0.07 0.37 0.00 0.00 175.52 176.15 1k8c h LEU 100 N 0.67 0.59 -0.55 2.58 3.38 -0.85 0.62 115.31 121.73 1k8c h LEU 100 Ca 0.19 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1k8c h LEU 100 Cb -0.06 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1k8c h LEU 100 CO -0.05 0.60 0.30 0.00 0.09 0.00 0.00 178.44 179.38 1k8c h ALA 101 N 1.01 0.71 -0.02 1.53 0.00 -0.72 -0.13 119.26 121.64 1k8c h ALA 101 Ca 0.14 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1k8c h ALA 101 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1k8c h ALA 101 CO -0.01 0.23 0.01 -0.44 0.00 0.00 0.00 179.25 179.04 1k8c h ASP 102 N 0.75 0.04 0.72 0.00 3.32 -0.63 -2.71 116.42 117.89 1k8c h ASP 102 Ca 0.20 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1k8c h ASP 102 Cb 0.05 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1k8c h ASP 102 CO -0.03 0.25 0.00 0.18 -1.72 0.00 0.00 179.24 177.92 1k8c n LEU 103 N -4.96 0.21 -3.48 1.55 4.77 0.18 -3.84 117.00 111.43 1k8c n LEU 103 Ca -0.07 0.54 -0.18 0.00 -0.03 0.00 0.00 56.01 56.27 1k8c n LEU 103 Cb 0.13 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.79 1k8c n LEU 103 CO 0.34 -0.27 0.04 0.29 -1.33 0.00 0.00 177.39 176.46 1k8c n LYS 104 N -1.72 -5.09 -4.18 3.23 5.02 -0.10 -4.57 118.16 110.76 1k8c n LYS 104 Ca 0.04 0.77 -0.11 0.00 -2.02 0.00 0.00 58.31 57.00 1k8c n LYS 104 Cb 0.23 -5.60 -0.10 0.00 -0.02 0.00 0.00 35.03 29.55 1k8c n LYS 104 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1k8c s VAL 105 N -3.45 0.37 -0.70 -0.18 -7.23 -0.99 -5.02 120.40 103.19 1k8c s VAL 105 Ca 0.11 -1.92 0.24 0.00 -1.81 0.00 0.00 61.98 58.60 1k8c s VAL 105 Cb -0.02 -1.97 0.04 0.00 0.56 0.00 0.00 36.38 34.99 1k8c s VAL 105 CO 0.76 -0.57 1.34 0.47 -0.31 0.00 0.00 175.10 176.79 1k8c n ASP 106 N -0.12 0.65 -3.54 4.85 8.00 -1.26 -4.65 116.55 120.49 1k8c n ASP 106 Ca -0.07 0.07 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 1k8c n ASP 106 Cb 0.63 0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.88 1k8c n ASP 106 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1k8c s TYR 107 N -3.14 -0.36 0.11 1.24 -0.85 -1.26 -4.53 117.35 108.56 1k8c s TYR 107 Ca 0.07 0.16 0.07 0.00 -0.52 0.00 0.00 57.07 56.85 1k8c s TYR 107 Cb 0.14 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 43.01 1k8c s TYR 107 CO 0.71 -0.73 -0.11 0.14 -1.52 0.00 0.00 175.55 174.05 1k8c s VAL 108 N -3.40 3.30 0.16 -3.49 -7.23 -0.68 -4.97 120.40 104.10 1k8c s VAL 108 Ca 0.05 -1.32 -0.05 0.00 -1.81 0.00 0.00 61.98 58.86 1k8c s VAL 108 Cb -0.01 -2.55 -0.11 0.00 0.56 0.00 0.00 36.38 34.27 1k8c s VAL 108 CO -0.08 0.10 1.41 0.44 -0.31 0.00 0.00 175.10 176.66 1k8c h ASP 109 N 3.58 0.62 -3.43 4.85 3.32 -1.52 -1.77 116.42 122.08 1k8c h ASP 109 Ca -0.49 -0.40 -0.32 0.00 0.02 0.00 0.00 57.03 55.84 1k8c h ASP 109 Cb 1.17 -0.18 -0.36 0.00 0.22 0.00 0.00 39.33 40.18 1k8c h ASP 109 CO 0.51 1.15 -0.72 -0.22 -1.72 0.00 0.00 179.24 178.24 1k8c s LEU 110 N -8.12 0.69 -0.19 1.55 2.96 -0.92 -0.36 118.68 114.29 1k8c s LEU 110 Ca -0.07 0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 1k8c s LEU 110 Cb 0.10 -0.05 0.03 0.00 0.50 0.00 0.00 46.19 46.77 1k8c s LEU 110 CO 0.86 -0.18 -0.16 0.12 -1.32 0.00 0.00 176.35 175.67 1k8c s PHE 111 N 1.50 2.70 0.01 5.38 5.36 -0.70 -0.88 117.98 131.35 1k8c s PHE 111 Ca -0.04 -1.67 0.02 0.00 -0.96 0.00 0.00 56.93 54.28 1k8c s PHE 111 Cb -0.13 -1.83 -0.04 0.00 -0.34 0.00 0.00 43.02 40.69 1k8c s PHE 111 CO -0.03 -0.79 0.01 -0.51 -1.46 0.00 0.00 175.22 172.44 1k8c s LEU 112 N 1.31 3.56 -0.25 6.12 1.43 -0.60 -2.28 118.68 127.96 1k8c s LEU 112 Ca 0.02 -0.02 -0.29 0.00 -1.03 0.00 0.00 54.13 52.81 1k8c s LEU 112 Cb -0.14 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 1k8c s LEU 112 CO -0.11 0.26 1.30 -0.63 0.23 0.00 0.00 176.35 177.40 1k8c s ILE 113 N -1.14 4.18 0.14 -0.59 1.01 -0.77 -0.38 121.20 123.64 1k8c s ILE 113 Ca 0.21 1.36 -0.16 0.00 0.00 0.00 0.00 60.65 62.07 1k8c s ILE 113 Cb -0.12 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.28 1k8c s ILE 113 CO 0.12 -0.34 1.73 -0.74 0.00 0.00 0.00 174.94 175.71 1k8c h HIS 114 N 8.95 0.57 -3.62 3.97 2.76 -1.72 -0.49 115.15 125.57 1k8c h HIS 114 Ca -0.26 -0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 57.74 1k8c h HIS 114 Cb 1.10 -0.18 -0.20 0.00 1.55 0.00 0.00 27.41 29.68 1k8c h HIS 114 CO 0.85 0.46 -0.53 -0.06 -1.30 0.00 0.00 177.93 177.35 1k8c s PHE 115 N -5.78 0.09 -0.95 5.26 0.08 -1.26 -4.28 117.98 111.14 1k8c s PHE 115 Ca -0.13 -0.23 -0.07 0.00 0.12 0.00 0.00 56.93 56.62 1k8c s PHE 115 Cb 0.10 -0.08 -0.05 0.00 -0.57 0.00 0.00 43.02 42.43 1k8c s PHE 115 CO 0.74 -0.28 2.93 -0.35 -0.10 0.00 0.00 175.22 178.16 1k8c n PRO 116 N 1.43 3.31 -3.97 0.24 -0.04 -1.26 -4.77 135.00 129.95 1k8c n PRO 116 Ca -0.23 -2.30 -0.16 0.00 -0.04 0.00 0.00 63.50 60.77 1k8c n PRO 116 Cb 0.56 -2.45 -0.16 0.00 -0.04 0.00 0.00 33.50 31.41 1k8c n PRO 116 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1k8c s ILE 117 N 0.16 0.21 -0.40 0.52 1.01 -1.26 -5.01 121.20 116.43 1k8c s ILE 117 Ca 0.63 0.03 -0.01 0.00 0.00 0.00 0.00 60.65 61.29 1k8c s ILE 117 Cb 0.25 -0.27 0.11 0.00 0.01 0.00 0.00 42.46 42.56 1k8c s ILE 117 CO -0.09 0.13 0.18 0.00 0.00 0.00 0.00 174.94 175.16 1k8c s ALA 118 N 0.78 3.11 0.50 9.38 0.00 -1.26 -4.54 121.76 129.73 1k8c s ALA 118 Ca -0.08 -2.55 -0.18 0.00 0.00 0.00 0.00 51.96 49.15 1k8c s ALA 118 Cb -0.11 -2.33 -0.08 0.00 0.00 0.00 0.00 23.12 20.60 1k8c s ALA 118 CO -0.01 -1.79 1.00 -0.06 0.00 0.00 0.00 175.76 174.90 1k8c s PHE 119 N 1.07 3.22 0.31 0.00 0.08 0.42 -0.85 117.98 122.23 1k8c s PHE 119 Ca 0.09 1.54 -0.29 0.00 0.12 0.00 0.00 56.93 58.39 1k8c s PHE 119 Cb -0.22 -2.91 -0.12 0.00 -0.57 0.00 0.00 43.02 39.20 1k8c s PHE 119 CO -0.05 -0.55 1.41 1.17 -0.10 0.00 0.00 175.22 177.10 1k8c n LYS 120 N -1.28 2.31 -1.84 0.44 4.81 0.98 -4.24 118.16 119.34 1k8c n LYS 120 Ca 0.08 0.82 -0.41 0.00 -0.87 0.00 0.00 58.31 57.92 1k8c n LYS 120 Cb 0.53 -2.48 -0.01 0.00 0.02 0.00 0.00 35.03 33.09 1k8c n LYS 120 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1k8c s PHE 121 N -0.62 2.74 -0.09 5.64 5.36 -1.25 -4.73 117.98 125.03 1k8c s PHE 121 Ca 0.60 1.00 0.01 0.00 -0.96 0.00 0.00 56.93 57.58 1k8c s PHE 121 Cb -0.56 -4.00 0.02 0.00 -0.34 0.00 0.00 43.02 38.14 1k8c s PHE 121 CO 0.57 -3.14 -0.10 0.08 -1.46 0.00 0.00 175.22 171.17 1k8c s VAL 122 N -0.52 1.08 0.62 3.12 1.01 -1.26 -4.83 120.40 119.62 1k8c s VAL 122 Ca 0.58 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.99 1k8c s VAL 122 Cb -0.46 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1k8c s VAL 122 CO 0.54 0.36 1.10 -2.65 0.00 0.00 0.00 175.10 174.44 1k8c n PRO 123 N 4.37 0.98 -0.36 2.72 -0.02 -1.26 -4.86 135.00 136.56 1k8c n PRO 123 Ca -0.18 0.38 0.01 0.00 -2.02 0.00 0.00 63.50 61.69 1k8c n PRO 123 Cb 0.51 -2.32 0.15 0.00 -0.02 0.00 0.00 33.50 31.82 1k8c n PRO 123 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1k8c h ILE 124 N 0.49 1.13 -0.04 4.25 1.08 -2.00 -1.55 117.51 120.87 1k8c h ILE 124 Ca -0.49 -0.41 -0.07 0.00 -0.39 0.00 0.00 64.86 63.50 1k8c h ILE 124 Cb 1.35 -0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 1k8c h ILE 124 CO 0.52 0.22 -0.30 -0.33 -0.69 0.00 0.00 178.15 177.56 1k8c h GLU 125 N 1.19 0.06 -0.21 2.37 3.07 -2.01 -3.11 114.58 115.94 1k8c h GLU 125 Ca 0.40 -0.02 -0.15 0.00 -0.50 0.00 0.00 59.36 59.10 1k8c h GLU 125 Cb 0.08 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1k8c h GLU 125 CO -0.15 0.36 -0.44 1.49 -1.40 0.00 0.00 179.01 178.88 1k8c h GLU 126 N 0.06 0.67 -1.45 2.33 4.57 -1.63 -3.46 114.58 115.66 1k8c h GLU 126 Ca 0.01 -0.44 0.12 0.00 -1.18 0.00 0.00 59.36 57.87 1k8c h GLU 126 Cb 0.57 0.06 -0.25 0.00 -0.16 0.00 0.00 28.75 28.96 1k8c h GLU 126 CO 0.04 1.05 0.29 0.21 -1.18 0.00 0.00 179.01 179.42 1k8c s LYS 127 N -4.05 0.39 -0.12 1.92 2.20 -1.08 -5.04 119.74 113.96 1k8c s LYS 127 Ca -0.12 0.76 -0.05 0.00 -0.36 0.00 0.00 55.97 56.20 1k8c s LYS 127 Cb 0.08 0.22 0.06 0.00 -1.51 0.00 0.00 37.83 36.67 1k8c s LYS 127 CO 0.84 -0.10 0.27 -0.47 -0.36 0.00 0.00 175.35 175.54 1k8c s TYR 128 N 1.75 -0.40 0.42 4.03 5.04 -1.24 -3.62 117.35 123.32 1k8c s TYR 128 Ca -0.07 0.92 -0.23 0.00 -2.44 0.00 0.00 57.07 55.25 1k8c s TYR 128 Cb -0.05 0.05 -0.09 0.00 0.35 0.00 0.00 41.96 42.22 1k8c s TYR 128 CO -0.16 -0.29 1.05 -2.14 -1.34 0.00 0.00 175.55 172.67 1k8c s PRO 129 N 1.73 4.08 0.38 4.97 0.02 -1.26 -5.07 135.00 139.84 1k8c s PRO 129 Ca -0.05 1.49 0.19 0.00 0.02 0.00 0.00 61.00 62.65 1k8c s PRO 129 Cb -0.11 -2.45 0.68 0.00 0.02 0.00 0.00 34.50 32.64 1k8c s PRO 129 CO -0.09 -0.21 1.73 -1.00 -0.33 0.00 0.00 177.00 177.10 1k8c h PRO 130 N 2.30 0.00 0.00 5.54 0.13 -1.91 -3.48 132.00 134.57 1k8c h PRO 130 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1k8c h PRO 130 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1k8c h PRO 130 CO 0.62 0.36 0.00 0.41 -0.23 0.00 0.00 178.00 179.16 1k8c n GLY 131 N 0.26 3.26 0.23 1.56 0.00 -1.26 -1.37 105.19 107.87 1k8c n GLY 131 Ca -0.00 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 45.94 1k8c n GLY 131 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1k8c n PHE 132 N 13.86 0.05 -2.31 1.61 3.72 -1.26 -4.86 117.46 128.27 1k8c n PHE 132 Ca 0.00 -0.03 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 1k8c n PHE 132 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1k8c n PHE 132 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1k8c s TYR 133 N -1.95 3.06 -0.23 1.38 5.04 -0.47 -4.80 117.35 119.39 1k8c s TYR 133 Ca 0.35 1.01 0.11 0.00 -2.44 0.00 0.00 57.07 56.11 1k8c s TYR 133 Cb 0.18 -3.56 0.44 0.00 0.35 0.00 0.00 41.96 39.37 1k8c s TYR 133 CO 0.28 -1.95 1.30 0.00 -1.34 0.00 0.00 175.55 173.85 1k8c n GLY 135 N -1.13 0.54 2.65 0.00 0.00 -1.26 -4.67 105.19 101.31 1k8c n GLY 135 Ca 0.24 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 1k8c n GLY 135 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1k8c n ASP 136 N 1.00 -2.45 0.00 1.61 2.03 -1.26 -5.11 116.55 112.36 1k8c n ASP 136 Ca -0.02 -3.02 0.00 0.00 0.52 0.00 0.00 54.79 52.27 1k8c n ASP 136 Cb 0.08 1.27 0.00 0.00 -0.72 0.00 0.00 41.12 41.75 1k8c n ASP 136 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k8c n GLY 137 N 2.13 2.95 1.23 0.27 0.00 -1.26 -2.09 105.19 108.43 1k8c n GLY 137 Ca 0.15 -0.34 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1k8c n GLY 137 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k8c n ASN 138 N 2.26 3.59 -4.76 1.61 3.02 -1.26 -4.58 115.26 115.14 1k8c n ASN 138 Ca 0.00 -1.99 -0.40 0.00 -0.03 0.00 0.00 54.58 52.16 1k8c n ASN 138 Cb 0.00 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 38.70 1k8c n ASN 138 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1k8c s ASN 139 N -1.08 7.27 0.04 6.41 0.01 -0.89 -4.98 114.94 121.73 1k8c s ASN 139 Ca 0.45 2.21 -0.25 0.00 -0.71 0.00 0.00 52.86 54.56 1k8c s ASN 139 Cb 0.24 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 39.22 1k8c s ASN 139 CO 0.31 -0.14 0.77 -0.36 -1.51 0.00 0.00 177.10 176.18 1k8c s PHE 140 N -1.21 3.72 -0.01 2.20 0.40 -1.26 -4.19 117.98 117.63 1k8c s PHE 140 Ca 0.45 1.48 0.03 0.00 -0.60 0.00 0.00 56.93 58.28 1k8c s PHE 140 Cb -0.30 -2.84 -0.00 0.00 0.51 0.00 0.00 43.02 40.39 1k8c s PHE 140 CO 0.39 0.25 -0.09 0.08 0.70 0.00 0.00 175.22 176.55 1k8c s VAL 141 N 0.05 0.72 0.34 -0.44 1.01 -1.26 -5.06 120.40 115.75 1k8c s VAL 141 Ca 0.39 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 62.09 1k8c s VAL 141 Cb -0.20 -0.61 -0.06 0.00 0.00 0.00 0.00 36.38 35.50 1k8c s VAL 141 CO 0.23 0.21 -0.04 -0.31 0.00 0.00 0.00 175.10 175.19 1k8c s TYR 142 N -0.09 2.48 0.06 5.22 2.02 -1.26 -0.02 117.35 125.76 1k8c s TYR 142 Ca 0.02 -0.46 0.09 0.00 -0.37 0.00 0.00 57.07 56.34 1k8c s TYR 142 Cb -0.05 -1.44 -0.03 0.00 -0.40 0.00 0.00 41.96 40.04 1k8c s TYR 142 CO -0.00 0.53 -0.23 -1.21 -1.57 0.00 0.00 175.55 173.07 1k8c s GLU 143 N -3.67 1.84 -1.41 -0.62 2.02 -0.03 -4.52 118.70 112.32 1k8c s GLU 143 Ca 0.34 -1.11 -0.15 0.00 0.02 0.00 0.00 54.97 54.07 1k8c s GLU 143 Cb 0.01 -2.06 0.06 0.00 0.10 0.00 0.00 34.13 32.24 1k8c s GLU 143 CO 0.18 0.51 2.08 -0.25 0.02 0.00 0.00 175.26 177.80 1k8c n ASP 144 N 1.47 4.23 -4.02 -0.19 8.00 -1.26 -4.75 116.55 120.02 1k8c n ASP 144 Ca -0.17 -2.88 -0.31 0.00 0.71 0.00 0.00 54.79 52.14 1k8c n ASP 144 Cb 0.52 -1.67 -0.15 0.00 -0.02 0.00 0.00 41.12 39.80 1k8c n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1k8c s VAL 145 N 3.22 2.19 0.69 2.53 1.01 -1.26 -5.10 120.40 123.69 1k8c s VAL 145 Ca 0.48 -2.14 -0.17 0.00 0.00 0.00 0.00 61.98 60.16 1k8c s VAL 145 Cb 0.11 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.95 1k8c s VAL 145 CO -0.04 -0.47 1.16 -2.65 0.00 0.00 0.00 175.10 173.11 1k8c n PRO 146 N 4.32 0.77 -0.17 2.72 -0.02 -1.26 -4.87 135.00 136.49 1k8c n PRO 146 Ca -0.01 0.32 -0.02 0.00 -2.02 0.00 0.00 63.50 61.78 1k8c n PRO 146 Cb 0.42 -2.40 0.07 0.00 -0.02 0.00 0.00 33.50 31.56 1k8c n PRO 146 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1k8c h ILE 147 N 0.06 0.60 -0.29 4.25 1.08 -1.98 -2.15 117.51 119.09 1k8c h ILE 147 Ca -0.49 -0.04 0.04 0.00 -0.39 0.00 0.00 64.86 63.98 1k8c h ILE 147 Cb 1.33 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 35.53 1k8c h ILE 147 CO 0.50 0.02 0.19 0.25 -0.69 0.00 0.00 178.15 178.43 1k8c h LEU 148 N 0.13 0.18 -0.11 1.44 5.85 -1.98 0.70 115.31 121.52 1k8c h LEU 148 Ca 0.26 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 1k8c h LEU 148 Cb 0.40 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1k8c h LEU 148 CO -0.43 0.12 0.02 -0.33 -0.34 0.00 0.00 178.44 177.49 1k8c h GLU 149 N 0.21 0.18 -0.68 1.25 4.39 -1.74 0.46 114.58 118.65 1k8c h GLU 149 Ca 0.12 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.79 1k8c h GLU 149 Cb 0.23 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 1k8c h GLU 149 CO -0.02 0.37 0.44 1.15 -1.16 0.00 0.00 179.01 179.79 1k8c h THR 150 N -0.04 1.13 -0.40 1.13 2.02 -1.28 -1.98 112.91 113.50 1k8c h THR 150 Ca 0.03 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1k8c h THR 150 Cb 0.28 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1k8c h THR 150 CO 0.00 0.16 0.25 -0.25 0.37 0.00 0.00 175.52 176.05 1k8c h TRP 151 N 0.88 0.51 -0.42 3.16 2.91 -0.59 -1.89 115.95 120.52 1k8c h TRP 151 Ca 0.26 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.28 1k8c h TRP 151 Cb -0.05 -0.17 -0.02 0.00 -0.51 0.00 0.00 29.16 28.41 1k8c h TRP 151 CO -0.03 0.35 0.25 0.87 -1.03 0.00 0.00 178.44 178.84 1k8c h LYS 152 N 0.53 0.56 -0.18 2.65 1.57 -0.54 0.36 116.57 121.53 1k8c h LYS 152 Ca 0.14 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.81 1k8c h LYS 152 Cb -0.03 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 1k8c h LYS 152 CO -0.03 0.40 -0.22 0.00 -0.57 0.00 0.00 179.45 179.02 1k8c h ALA 153 N 1.70 1.30 -0.12 3.86 0.00 -0.65 -2.11 119.26 123.23 1k8c h ALA 153 Ca 0.15 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 1k8c h ALA 153 Cb -0.02 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.68 1k8c h ALA 153 CO -0.03 0.47 -0.65 -0.07 0.00 0.00 0.00 179.25 178.98 1k8c h LEU 154 N 0.28 0.77 -1.19 0.00 3.38 -0.38 -2.56 115.31 115.62 1k8c h LEU 154 Ca 0.05 -0.64 0.07 0.00 0.09 0.00 0.00 57.88 57.45 1k8c h LEU 154 Cb 0.56 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1k8c h LEU 154 CO 0.04 1.29 0.57 -0.33 0.09 0.00 0.00 178.44 180.10 1k8c h GLU 155 N 0.31 0.92 -0.67 1.13 5.08 -0.75 -0.08 114.58 120.52 1k8c h GLU 155 Ca -0.05 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 1k8c h GLU 155 Cb 1.29 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1k8c h GLU 155 CO 0.13 0.61 0.11 -0.22 -1.00 0.00 0.00 179.01 178.64 1k8c h LYS 156 N 0.95 1.11 0.00 2.33 3.64 -1.31 -2.20 116.57 121.08 1k8c h LYS 156 Ca 0.38 -0.30 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1k8c h LYS 156 Cb 0.26 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1k8c h LYS 156 CO -0.15 1.01 -0.31 -0.07 -2.27 0.00 0.00 179.45 177.66 1k8c h LEU 157 N 1.03 0.00 -0.29 5.20 3.38 -0.76 -1.29 115.31 122.57 1k8c h LEU 157 Ca 0.20 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 1k8c h LEU 157 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1k8c h LEU 157 CO 0.01 0.31 -0.16 0.58 0.09 0.00 0.00 178.44 179.28 1k8c h VAL 158 N 0.00 1.30 0.00 1.22 2.07 -0.58 -2.31 116.25 117.95 1k8c h VAL 158 Ca -0.00 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 1k8c h VAL 158 Cb 0.72 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1k8c h VAL 158 CO 0.04 0.40 -0.10 0.00 0.02 0.00 0.00 177.57 177.94 1k8c h ALA 159 N 0.75 1.13 -0.00 1.67 0.00 -0.87 -0.96 119.26 120.97 1k8c h ALA 159 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1k8c h ALA 159 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1k8c h ALA 159 CO 0.05 0.12 -0.00 0.00 0.00 0.00 0.00 179.25 179.41 1k8c n ALA 160 N -2.20 2.44 -0.74 0.00 0.00 -0.54 -4.89 120.51 114.58 1k8c n ALA 160 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1k8c n ALA 160 Cb 0.27 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1k8c n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k8c n GLY 161 N 1.36 0.80 0.04 0.00 0.00 -0.37 -4.93 105.19 102.10 1k8c n GLY 161 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 1k8c n GLY 161 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k8c n LYS 162 N -2.22 0.13 -3.78 1.61 5.02 -0.90 -4.66 118.16 113.36 1k8c n LYS 162 Ca 0.00 0.08 -0.14 0.00 -2.02 0.00 0.00 58.31 56.23 1k8c n LYS 162 Cb 0.00 -1.62 -0.15 0.00 -0.02 0.00 0.00 35.03 33.24 1k8c n LYS 162 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k8c s ILE 163 N -3.06 -0.04 -0.12 -0.18 1.01 -1.22 -1.68 121.20 115.91 1k8c s ILE 163 Ca 0.11 0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.72 1k8c s ILE 163 Cb 0.16 -0.14 -0.17 0.00 0.01 0.00 0.00 42.46 42.31 1k8c s ILE 163 CO 0.61 0.06 0.56 0.11 0.00 0.00 0.00 174.94 176.29 1k8c h LYS 164 N 7.00 -0.02 -4.62 2.79 1.79 -1.40 -3.40 116.57 118.71 1k8c h LYS 164 Ca -0.40 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 57.76 1k8c h LYS 164 Cb 1.15 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.57 1k8c h LYS 164 CO 0.46 0.64 -0.75 -1.12 -1.08 0.00 0.00 179.45 177.60 1k8c s SER 165 N -5.96 0.92 0.23 0.86 0.01 0.52 -5.02 113.70 105.27 1k8c s SER 165 Ca -0.13 -0.43 0.11 0.00 1.31 0.00 0.00 55.95 56.81 1k8c s SER 165 Cb -0.02 -0.01 -0.05 0.00 0.21 0.00 0.00 66.02 66.16 1k8c s SER 165 CO 0.47 -0.11 -0.15 0.27 0.41 0.00 0.00 173.24 174.14 1k8c s ILE 166 N -1.01 2.80 0.00 1.44 -4.36 -1.26 -1.73 121.20 117.09 1k8c s ILE 166 Ca -0.05 -2.05 0.00 0.00 -0.26 0.00 0.00 60.65 58.28 1k8c s ILE 166 Cb -0.08 -2.43 0.00 0.00 1.25 0.00 0.00 42.46 41.20 1k8c s ILE 166 CO 0.00 -0.26 0.00 0.61 0.24 0.00 0.00 174.94 175.53 1k8c n GLY 167 N -0.32 1.77 3.19 6.27 0.00 -0.97 -1.26 105.19 113.88 1k8c n GLY 167 Ca -0.08 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 1k8c n GLY 167 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1k8c s VAL 168 N -2.79 0.82 0.02 1.61 -7.23 0.21 -1.85 120.40 111.19 1k8c s VAL 168 Ca 0.00 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 1k8c s VAL 168 Cb 0.00 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 1k8c s VAL 168 CO 0.00 -0.84 -0.10 -0.55 -0.31 0.00 0.00 175.10 173.30 1k8c s SER 169 N -3.08 1.15 -1.58 4.85 0.15 -0.19 -0.58 113.70 114.43 1k8c s SER 169 Ca 0.13 -0.35 -0.04 0.00 0.70 0.00 0.00 55.95 56.39 1k8c s SER 169 Cb 0.05 -0.07 0.01 0.00 -1.71 0.00 0.00 66.02 64.29 1k8c s SER 169 CO -0.03 0.00 0.58 0.59 1.20 0.00 0.00 173.24 175.58 1k8c n ASN 170 N 2.21 -6.14 -4.69 5.45 3.02 -0.35 -4.13 115.26 110.64 1k8c n ASN 170 Ca -0.17 -0.27 -0.36 0.00 -0.03 0.00 0.00 54.58 53.75 1k8c n ASN 170 Cb 0.56 -4.97 -0.09 0.00 -0.61 0.00 0.00 39.78 34.68 1k8c n ASN 170 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1k8c s PHE 171 N -3.18 3.36 0.72 3.10 0.40 -1.26 -4.50 117.98 116.62 1k8c s PHE 171 Ca 0.29 0.28 -0.10 0.00 -0.60 0.00 0.00 56.93 56.80 1k8c s PHE 171 Cb -0.13 -2.22 0.04 0.00 0.51 0.00 0.00 43.02 41.22 1k8c s PHE 171 CO 0.36 0.17 1.08 -1.25 0.70 0.00 0.00 175.22 176.28 1k8c s PRO 172 N 0.73 2.52 0.23 0.24 0.04 -1.26 -4.83 135.00 132.66 1k8c s PRO 172 Ca 0.08 0.20 -0.09 0.00 0.04 0.00 0.00 61.00 61.23 1k8c s PRO 172 Cb -0.12 -2.05 0.36 0.00 0.04 0.00 0.00 34.50 32.72 1k8c s PRO 172 CO 0.02 -1.18 1.66 0.78 0.04 0.00 0.00 177.00 178.31 1k8c h GLY 173 N -0.70 0.75 1.08 0.56 0.00 -1.97 -1.99 103.07 100.80 1k8c h GLY 173 Ca -0.45 0.08 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1k8c h GLY 173 CO 0.64 -0.23 0.42 0.00 0.00 0.00 0.00 176.54 177.37 1k8c h ALA 174 N 1.61 1.15 -0.33 3.60 0.00 -1.99 -0.58 119.26 122.72 1k8c h ALA 174 Ca 0.36 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 1k8c h ALA 174 Cb 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1k8c h ALA 174 CO -0.57 0.65 -0.27 1.25 0.00 0.00 0.00 179.25 180.31 1k8c h LEU 175 N 1.19 0.81 -0.55 0.00 5.85 -1.84 -1.91 115.31 118.87 1k8c h LEU 175 Ca 0.29 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 1k8c h LEU 175 Cb 0.09 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1k8c h LEU 175 CO -0.04 1.09 0.24 0.25 -0.34 0.00 0.00 178.44 179.64 1k8c h LEU 176 N 0.54 0.73 -0.29 2.25 5.85 -1.13 -1.17 115.31 122.08 1k8c h LEU 176 Ca 0.06 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.68 1k8c h LEU 176 Cb 0.83 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1k8c h LEU 176 CO 0.07 0.68 0.04 0.25 -0.34 0.00 0.00 178.44 179.14 1k8c h LEU 177 N 0.74 -0.03 -0.50 2.25 5.85 -0.99 -0.17 115.31 122.46 1k8c h LEU 177 Ca 0.18 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 1k8c h LEU 177 Cb 0.15 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1k8c h LEU 177 CO -0.02 0.02 0.19 -0.78 -0.34 0.00 0.00 178.44 177.51 1k8c h ASP 178 N 0.14 0.69 -0.94 1.25 3.58 -1.08 -2.46 116.42 117.61 1k8c h ASP 178 Ca 0.14 -0.18 0.04 0.00 0.42 0.00 0.00 57.03 57.45 1k8c h ASP 178 Cb 0.16 -0.18 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 1k8c h ASP 178 CO -0.20 0.68 0.61 0.25 -2.88 0.00 0.00 179.24 177.70 1k8c h LEU 179 N 0.66 1.01 -1.73 2.28 5.85 -0.69 -1.54 115.31 121.15 1k8c h LEU 179 Ca 0.16 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.90 1k8c h LEU 179 Cb 0.21 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1k8c h LEU 179 CO -0.01 0.69 0.21 -0.07 -0.34 0.00 0.00 178.44 178.92 1k8c h LEU 180 N 1.17 0.31 -1.35 2.25 3.38 -0.59 0.11 115.31 120.60 1k8c h LEU 180 Ca 0.38 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.29 1k8c h LEU 180 Cb 0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1k8c h LEU 180 CO -0.13 0.22 -0.26 0.03 0.09 0.00 0.00 178.44 178.40 1k8c h ARG 181 N 0.36 0.00 0.00 1.13 3.08 -0.95 -3.26 114.38 114.74 1k8c h ARG 181 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1k8c h ARG 181 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1k8c h ARG 181 CO -0.03 0.26 -0.99 0.41 -1.07 0.00 0.00 179.97 178.55 1k8c n GLY 182 N -0.19 -0.47 3.74 0.04 0.00 -0.33 -5.01 105.19 102.96 1k8c n GLY 182 Ca -0.01 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 1k8c n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k8c s ALA 183 N -2.58 3.36 -0.20 4.61 0.00 0.25 -4.94 121.76 122.26 1k8c s ALA 183 Ca 0.02 0.79 -0.22 0.00 0.00 0.00 0.00 51.96 52.55 1k8c s ALA 183 Cb 0.11 -3.35 -0.20 0.00 0.00 0.00 0.00 23.12 19.68 1k8c s ALA 183 CO 0.61 -0.19 0.30 1.15 0.00 0.00 0.00 175.76 177.63 1k8c h THR 184 N 3.79 1.04 -3.63 0.00 2.02 -1.91 -3.42 112.91 110.80 1k8c h THR 184 Ca -0.44 -2.21 -0.62 0.00 0.77 0.00 0.00 66.41 63.91 1k8c h THR 184 Cb 1.21 2.40 -0.13 0.00 -1.74 0.00 0.00 68.15 69.89 1k8c h THR 184 CO 0.73 0.37 -0.13 -0.63 0.37 0.00 0.00 175.52 176.22 1k8c s ILE 185 N -2.35 5.13 0.30 3.11 1.01 -1.26 -5.04 121.20 122.10 1k8c s ILE 185 Ca -0.27 0.73 -0.29 0.00 0.00 0.00 0.00 60.65 60.82 1k8c s ILE 185 Cb 0.05 -3.76 -0.10 0.00 0.01 0.00 0.00 42.46 38.66 1k8c s ILE 185 CO 0.61 0.14 1.12 -0.54 0.00 0.00 0.00 174.94 176.27 1k8c s LYS 186 N 2.09 4.55 0.10 2.79 -0.14 -1.26 -4.92 119.74 122.95 1k8c s LYS 186 Ca 0.18 1.84 -0.31 0.00 -1.36 0.00 0.00 55.97 56.32 1k8c s LYS 186 Cb -0.16 -3.11 -0.10 0.00 -1.68 0.00 0.00 37.83 32.78 1k8c s LYS 186 CO 0.09 0.12 1.89 -0.35 -0.76 0.00 0.00 175.35 176.34 1k8c n PRO 187 N 1.02 2.84 0.14 -1.68 -0.04 -1.26 -4.82 135.00 131.20 1k8c n PRO 187 Ca -0.00 1.04 0.02 0.00 -0.04 0.00 0.00 63.50 64.51 1k8c n PRO 187 Cb 0.45 -2.95 0.08 0.00 -0.04 0.00 0.00 33.50 31.04 1k8c n PRO 187 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k8c h ALA 188 N 9.20 0.71 -3.31 0.55 0.00 -1.54 -3.44 119.26 121.43 1k8c h ALA 188 Ca -0.47 -0.48 -0.32 0.00 0.00 0.00 0.00 54.91 53.64 1k8c h ALA 188 Cb 1.23 -0.08 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 1k8c h ALA 188 CO 0.95 0.66 -0.75 0.08 0.00 0.00 0.00 179.25 180.18 1k8c s VAL 189 N -3.08 0.68 -0.23 0.00 1.01 -1.26 -0.90 120.40 116.62 1k8c s VAL 189 Ca 0.03 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 60.96 1k8c s VAL 189 Cb 0.09 -0.70 0.06 0.00 0.00 0.00 0.00 36.38 35.82 1k8c s VAL 189 CO 0.74 -0.29 -0.03 -0.22 0.00 0.00 0.00 175.10 175.30 1k8c s LEU 190 N -1.47 2.40 -0.34 3.92 2.96 0.16 -0.62 118.68 125.69 1k8c s LEU 190 Ca -0.07 -1.17 -0.11 0.00 -0.22 0.00 0.00 54.13 52.56 1k8c s LEU 190 Cb -0.09 -1.09 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 1k8c s LEU 190 CO 0.01 -0.26 0.20 -1.58 -1.32 0.00 0.00 176.35 173.40 1k8c s GLN 191 N 1.46 3.32 0.14 1.98 0.74 0.26 -1.76 119.66 125.79 1k8c s GLN 191 Ca -0.04 -0.75 0.02 0.00 0.05 0.00 0.00 55.36 54.64 1k8c s GLN 191 Cb -0.19 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 30.18 1k8c s GLN 191 CO -0.07 -0.48 -0.03 0.14 -0.55 0.00 0.00 175.29 174.30 1k8c s VAL 192 N 1.65 0.67 0.25 1.34 -7.23 -0.86 -1.21 120.40 115.02 1k8c s VAL 192 Ca 0.05 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 57.96 1k8c s VAL 192 Cb -0.18 -1.91 -0.10 0.00 0.56 0.00 0.00 36.38 34.75 1k8c s VAL 192 CO 0.08 -0.66 1.46 -0.70 -0.31 0.00 0.00 175.10 174.97 1k8c s GLU 193 N -3.88 4.25 -0.24 4.82 2.12 -1.26 -1.71 118.70 122.79 1k8c s GLU 193 Ca 0.18 2.34 -0.07 0.00 0.36 0.00 0.00 54.97 57.78 1k8c s GLU 193 Cb 0.06 -3.10 0.11 0.00 0.26 0.00 0.00 34.13 31.46 1k8c s GLU 193 CO -0.00 -0.45 0.51 -1.58 -0.54 0.00 0.00 175.26 173.20 1k8c s HIS 194 N 0.01 -1.04 0.31 5.30 2.46 -0.54 -4.82 115.29 116.96 1k8c s HIS 194 Ca 0.60 1.79 -0.19 0.00 0.47 0.00 0.00 55.06 57.72 1k8c s HIS 194 Cb -0.43 0.48 0.03 0.00 -0.13 0.00 0.00 32.58 32.53 1k8c s HIS 194 CO 0.44 -0.58 0.73 -3.38 -2.47 0.00 0.00 174.74 169.47 1k8c s HIS 195 N 2.73 -0.08 0.62 3.88 -3.43 -1.18 -3.94 115.29 113.89 1k8c s HIS 195 Ca -0.01 -0.43 0.32 0.00 -0.80 0.00 0.00 55.06 54.14 1k8c s HIS 195 Cb -0.12 0.72 1.79 0.00 -1.43 0.00 0.00 32.58 33.54 1k8c s HIS 195 CO -0.16 -1.32 2.11 -1.35 -2.00 0.00 0.00 174.74 172.03 1k8c h PRO 196 N 2.01 0.00 0.00 -0.38 0.11 -1.93 -1.19 132.00 130.61 1k8c h PRO 196 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1k8c h PRO 196 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1k8c h PRO 196 CO 0.28 0.00 -0.59 1.88 -0.21 0.00 0.00 178.00 179.36 1k8c h TYR 197 N 0.00 0.00 -2.51 0.65 0.05 -1.89 -2.38 116.97 110.88 1k8c h TYR 197 Ca 0.06 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.24 1k8c h TYR 197 Cb 0.45 0.00 -0.39 0.00 1.01 0.00 0.00 36.73 37.80 1k8c h TYR 197 CO 0.00 0.00 -0.86 -0.11 -1.05 0.00 0.00 178.16 176.14 1k8c n LEU 198 N -2.80 0.79 0.05 3.88 7.94 -0.46 -0.36 117.00 126.04 1k8c n LEU 198 Ca 0.02 -4.70 -0.06 0.00 -1.11 0.00 0.00 56.01 50.16 1k8c n LEU 198 Cb 0.54 0.13 -0.10 0.00 0.53 0.00 0.00 43.42 44.51 1k8c n LEU 198 CO 0.37 1.87 -0.02 1.56 -1.11 0.00 0.00 177.39 180.05 1k8c h GLN 199 N 5.31 0.00 -6.74 1.96 4.20 -1.73 -3.11 115.11 114.99 1k8c h GLN 199 Ca 0.21 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.40 1k8c h GLN 199 Cb 0.85 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.43 1k8c h GLN 199 CO 0.50 0.75 -0.81 1.04 -0.67 0.00 0.00 178.83 179.64 1k8c n GLN 200 N -3.22 -0.93 -0.34 1.46 6.02 -1.26 -4.80 117.38 114.31 1k8c n GLN 200 Ca -0.05 0.08 0.21 0.00 -0.01 0.00 0.00 57.00 57.23 1k8c n GLN 200 Cb 0.94 -3.14 0.45 0.00 1.02 0.00 0.00 30.24 29.51 1k8c n GLN 200 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1k8c h PRO 201 N -1.28 0.46 -0.12 -1.09 0.13 -2.00 -0.82 132.00 127.28 1k8c h PRO 201 Ca -0.55 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.44 1k8c h PRO 201 Cb 1.18 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1k8c h PRO 201 CO 0.62 0.31 -0.40 0.87 -0.23 0.00 0.00 178.00 179.17 1k8c h LYS 202 N 0.48 0.27 -0.20 0.86 1.57 -1.99 -0.51 116.57 117.04 1k8c h LYS 202 Ca 0.63 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 59.16 1k8c h LYS 202 Cb 1.40 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1k8c h LYS 202 CO -0.39 0.63 -0.35 1.25 -0.57 0.00 0.00 179.45 180.02 1k8c h LEU 203 N 0.23 0.65 -0.07 2.94 5.85 -1.53 -0.81 115.31 122.56 1k8c h LEU 203 Ca 0.02 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.21 1k8c h LEU 203 Cb 0.80 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1k8c h LEU 203 CO 0.06 1.06 0.03 0.40 -0.34 0.00 0.00 178.44 179.65 1k8c h ILE 204 N 0.26 0.99 -0.41 4.05 1.08 -1.25 -0.22 117.51 122.01 1k8c h ILE 204 Ca 0.01 -0.02 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1k8c h ILE 204 Cb 0.94 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.58 1k8c h ILE 204 CO 0.08 0.01 0.27 -0.08 -0.69 0.00 0.00 178.15 177.74 1k8c h GLU 205 N 0.07 0.54 -0.16 2.37 4.81 -1.09 0.69 114.58 121.81 1k8c h GLU 205 Ca 0.03 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1k8c h GLU 205 Cb 0.01 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1k8c h GLU 205 CO -0.03 0.36 0.08 0.35 -0.73 0.00 0.00 179.01 179.04 1k8c h PHE 206 N 0.55 0.23 0.09 0.92 3.57 -0.92 -1.60 116.94 119.79 1k8c h PHE 206 Ca 0.15 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 1k8c h PHE 206 Cb -0.06 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.61 1k8c h PHE 206 CO -0.05 0.25 -0.04 0.00 -2.23 0.00 0.00 178.31 176.23 1k8c h ALA 207 N 0.96 -0.12 -0.63 2.41 0.00 -0.73 -1.02 119.26 120.13 1k8c h ALA 207 Ca 0.06 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1k8c h ALA 207 Cb 0.10 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1k8c h ALA 207 CO -0.01 -0.55 0.39 1.96 0.00 0.00 0.00 179.25 181.04 1k8c h GLN 208 N -0.16 0.75 0.00 0.00 4.20 -0.86 -0.78 115.11 118.26 1k8c h GLN 208 Ca -0.01 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1k8c h GLN 208 Cb 0.13 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 1k8c h GLN 208 CO 0.02 0.49 -0.15 -0.22 -0.67 0.00 0.00 178.83 178.31 1k8c h LYS 209 N 0.77 0.00 -0.01 1.46 3.64 -1.01 -0.35 116.57 121.07 1k8c h LYS 209 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1k8c h LYS 209 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1k8c h LYS 209 CO -0.10 0.15 0.00 0.00 -2.27 0.00 0.00 179.45 177.23 1k8c n ALA 210 N -2.40 2.64 -0.55 5.00 0.00 -0.41 -4.87 120.51 119.92 1k8c n ALA 210 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1k8c n ALA 210 Cb 0.23 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1k8c n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k8c n GLY 211 N 1.02 0.73 3.76 0.00 0.00 -0.14 -5.05 105.19 105.51 1k8c n GLY 211 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 1k8c n GLY 211 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k8c s VAL 212 N -2.15 4.93 0.05 1.61 1.01 -0.43 -4.47 120.40 120.94 1k8c s VAL 212 Ca 0.00 1.21 -0.21 0.00 0.00 0.00 0.00 61.98 62.98 1k8c s VAL 212 Cb 0.00 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 1k8c s VAL 212 CO 0.00 0.42 0.61 -0.89 0.00 0.00 0.00 175.10 175.25 1k8c s THR 213 N -0.20 4.78 -0.13 3.92 2.01 -0.08 -3.72 115.64 122.22 1k8c s THR 213 Ca 0.30 1.30 -0.14 0.00 0.31 0.00 0.00 61.69 63.47 1k8c s THR 213 Cb -0.18 -3.95 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 1k8c s THR 213 CO 0.17 0.48 0.32 -0.63 -0.69 0.00 0.00 174.62 174.26 1k8c s ILE 214 N -0.65 5.27 -0.17 1.82 -1.09 -1.26 -0.67 121.20 124.45 1k8c s ILE 214 Ca 0.31 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 1k8c s ILE 214 Cb -0.19 -3.64 0.01 0.00 -1.58 0.00 0.00 42.46 37.05 1k8c s ILE 214 CO 0.19 0.43 -0.17 -0.89 -1.23 0.00 0.00 174.94 173.27 1k8c s THR 215 N 0.11 2.39 0.13 2.92 2.01 -0.72 -0.37 115.64 122.12 1k8c s THR 215 Ca 0.18 -0.84 -0.12 0.00 0.31 0.00 0.00 61.69 61.22 1k8c s THR 215 Cb -0.14 -2.01 -0.07 0.00 0.01 0.00 0.00 72.50 70.29 1k8c s THR 215 CO 0.06 0.52 0.50 0.00 -0.69 0.00 0.00 174.62 175.01 1k8c s ALA 216 N 1.14 3.62 0.11 7.40 0.00 0.56 -2.03 121.76 132.57 1k8c s ALA 216 Ca 0.01 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 51.79 1k8c s ALA 216 Cb -0.14 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.51 1k8c s ALA 216 CO -0.07 0.50 -0.12 1.52 0.00 0.00 0.00 175.76 177.59 1k8c s TYR 217 N -1.48 1.23 -1.15 0.00 -0.85 -0.70 -3.92 117.35 110.49 1k8c s TYR 217 Ca 0.37 -0.62 -0.02 0.00 -0.52 0.00 0.00 57.07 56.28 1k8c s TYR 217 Cb -0.14 -0.65 0.00 0.00 0.38 0.00 0.00 41.96 41.55 1k8c s TYR 217 CO 0.19 0.08 0.97 0.43 -1.52 0.00 0.00 175.55 175.70 1k8c n SER 218 N 0.45 -2.93 0.33 -0.18 7.64 -1.26 -1.46 113.62 116.21 1k8c n SER 218 Ca -0.15 -0.56 0.21 0.00 1.01 0.00 0.00 58.87 59.38 1k8c n SER 218 Cb 0.58 -4.80 1.12 0.00 -1.01 0.00 0.00 64.21 60.10 1k8c n SER 218 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1k8c h SER 219 N -1.94 0.00 -0.64 6.43 0.02 -1.87 -0.97 113.55 114.58 1k8c h SER 219 Ca -0.55 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.28 1k8c h SER 219 Cb 1.32 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.79 1k8c h SER 219 CO 0.48 0.01 0.15 0.49 -1.14 0.00 0.00 176.83 176.81 1k8c n PHE 220 N -3.20 2.21 0.00 3.45 0.99 -1.26 -4.76 117.46 114.89 1k8c n PHE 220 Ca -0.03 -1.01 0.00 0.00 -0.00 0.00 0.00 57.45 56.41 1k8c n PHE 220 Cb 0.10 -0.60 0.00 0.00 -1.00 0.00 0.00 39.48 37.98 1k8c n PHE 220 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1k8c n GLY 221 N 0.10 3.27 0.40 1.37 0.00 -0.37 -2.21 105.19 107.76 1k8c n GLY 221 Ca 0.35 0.10 0.21 0.00 0.00 0.00 0.00 46.02 46.68 1k8c n GLY 221 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k8c h PRO 222 N 0.00 0.00 -5.98 1.61 0.13 -1.89 -3.34 132.00 122.53 1k8c h PRO 222 Ca 0.00 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.58 1k8c h PRO 222 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 1k8c h PRO 222 CO 0.00 0.00 1.45 -0.65 -0.23 0.00 0.00 178.00 178.57 1k8c s GLN 223 N -4.52 3.42 0.00 0.86 -1.52 -0.94 -3.11 119.66 113.86 1k8c s GLN 223 Ca -0.04 -1.10 0.00 0.00 -1.95 0.00 0.00 55.36 52.27 1k8c s GLN 223 Cb 0.14 -5.33 0.00 0.00 -0.22 0.00 0.00 33.01 27.60 1k8c s GLN 223 CO 0.49 -2.50 0.00 0.45 -0.25 0.00 0.00 175.29 173.48 1k8c n SER 224 N 9.97 0.00 -0.06 5.90 2.88 -1.26 -4.66 113.62 126.39 1k8c n SER 224 Ca 0.37 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.96 1k8c n SER 224 Cb 0.49 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.02 1k8c n SER 224 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1k8c n PHE 225 N 0.00 0.00 -2.45 0.66 3.01 -1.18 -5.00 117.46 112.50 1k8c n PHE 225 Ca 0.00 -0.69 -0.43 0.00 1.01 0.00 0.00 57.45 57.34 1k8c n PHE 225 Cb 0.00 -0.10 0.01 0.00 -0.01 0.00 0.00 39.48 39.38 1k8c n PHE 225 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1k8c n VAL 226 N -0.90 4.53 -2.23 -4.37 0.24 -1.24 -0.56 118.33 113.80 1k8c n VAL 226 Ca 0.08 -4.68 -0.28 0.00 -2.04 0.00 0.00 64.34 57.42 1k8c n VAL 226 Cb 0.47 -2.30 0.01 0.00 -1.47 0.00 0.00 33.84 30.55 1k8c n VAL 226 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1k8c n ASN 229 N 3.38 5.23 -4.71 -1.34 5.15 -1.26 -5.03 115.26 116.68 1k8c n ASN 229 Ca 0.37 -3.74 -0.42 0.00 -0.60 0.00 0.00 54.58 50.19 1k8c n ASN 229 Cb 0.36 -0.52 -0.03 0.00 -0.53 0.00 0.00 39.78 39.06 1k8c n ASN 229 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 1k8c s GLN 230 N -3.63 4.49 0.18 1.20 0.74 0.27 -4.96 119.66 117.96 1k8c s GLN 230 Ca 0.50 1.56 -0.13 0.00 0.05 0.00 0.00 55.36 57.34 1k8c s GLN 230 Cb 0.41 -3.43 0.10 0.00 1.10 0.00 0.00 33.01 31.19 1k8c s GLN 230 CO -0.14 -0.17 1.83 0.78 -0.55 0.00 0.00 175.29 177.04 1k8c h GLY 231 N 6.97 0.77 0.07 2.59 0.00 -1.98 -1.85 103.07 109.64 1k8c h GLY 231 Ca -0.40 -0.26 0.09 0.00 0.00 0.00 0.00 47.33 46.76 1k8c h GLY 231 CO 0.79 0.23 -0.14 -0.09 0.00 0.00 0.00 176.54 177.33 1k8c h ARG 232 N 0.67 -0.04 -0.13 4.80 2.43 -1.95 0.49 114.38 120.66 1k8c h ARG 232 Ca 0.21 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1k8c h ARG 232 Cb -0.01 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1k8c h ARG 232 CO -0.08 -0.02 -0.01 0.00 -1.51 0.00 0.00 179.97 178.34 1k8c h ALA 233 N 1.36 0.18 -0.91 2.80 0.00 -1.83 -3.11 119.26 117.75 1k8c h ALA 233 Ca 0.21 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1k8c h ALA 233 Cb 0.36 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 1k8c h ALA 233 CO -0.47 -0.11 0.59 -0.07 0.00 0.00 0.00 179.25 179.19 1k8c h LEU 234 N -0.05 0.83 -2.37 0.00 3.38 -0.87 -0.99 115.31 115.25 1k8c h LEU 234 Ca 0.04 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1k8c h LEU 234 Cb 0.40 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1k8c h LEU 234 CO 0.01 0.49 0.08 0.59 0.09 0.00 0.00 178.44 179.70 1k8c n ASN 235 N -4.53 3.23 -4.38 -0.43 3.02 0.12 -4.84 115.26 107.46 1k8c n ASN 235 Ca 0.15 -2.51 -0.33 0.00 -0.03 0.00 0.00 54.58 51.87 1k8c n ASN 235 Cb 0.30 -0.60 -0.14 0.00 -0.61 0.00 0.00 39.78 38.72 1k8c n ASN 235 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1k8c s THR 236 N -1.74 3.04 0.14 3.41 2.01 -0.38 -5.03 115.64 117.10 1k8c s THR 236 Ca 0.25 -0.67 -0.33 0.00 0.31 0.00 0.00 61.69 61.25 1k8c s THR 236 Cb 0.20 -2.27 -0.13 0.00 0.01 0.00 0.00 72.50 70.31 1k8c s THR 236 CO 0.07 0.53 1.65 -2.65 -0.69 0.00 0.00 174.62 173.53 1k8c n PRO 237 N 3.44 2.32 -1.77 4.92 -0.02 -1.26 -4.90 135.00 137.73 1k8c n PRO 237 Ca -0.18 0.84 -0.40 0.00 -2.02 0.00 0.00 63.50 61.74 1k8c n PRO 237 Cb 0.53 -2.64 0.02 0.00 -0.02 0.00 0.00 33.50 31.38 1k8c n PRO 237 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1k8c s THR 238 N 1.39 2.02 0.05 3.45 -1.32 -1.26 -4.92 115.64 115.05 1k8c s THR 238 Ca 0.80 0.02 0.15 0.00 -1.21 0.00 0.00 61.69 61.44 1k8c s THR 238 Cb -0.63 -3.01 0.04 0.00 -1.51 0.00 0.00 72.50 67.39 1k8c s THR 238 CO 0.38 0.00 1.54 -0.07 -2.21 0.00 0.00 174.62 174.26 1k8c h LEU 239 N 2.31 0.00 -1.19 9.08 3.38 -1.90 -2.67 115.31 124.30 1k8c h LEU 239 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1k8c h LEU 239 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1k8c h LEU 239 CO 0.61 0.55 0.00 -0.26 0.09 0.00 0.00 178.44 179.43 1k8c h PHE 240 N 0.00 0.00 -0.02 1.13 0.04 -1.91 -2.46 116.94 113.72 1k8c h PHE 240 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1k8c h PHE 240 Cb 1.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.39 1k8c h PHE 240 CO 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.71 1k8c n ALA 241 N -1.90 2.02 -2.32 2.45 0.00 -1.15 -4.79 120.51 114.81 1k8c n ALA 241 Ca 0.01 -1.05 -0.42 0.00 0.00 0.00 0.00 53.44 51.98 1k8c n ALA 241 Cb 0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.61 1k8c n ALA 241 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1k8c s HIS 242 N -1.05 3.24 0.31 0.00 5.04 -0.93 -4.91 115.29 116.99 1k8c s HIS 242 Ca 0.02 1.11 0.08 0.00 -1.54 0.00 0.00 55.06 54.72 1k8c s HIS 242 Cb 0.01 -3.53 0.85 0.00 0.04 0.00 0.00 32.58 29.95 1k8c s HIS 242 CO 0.01 -1.79 1.70 -0.44 -2.34 0.00 0.00 174.74 171.88 1k8c h ASP 243 N 7.09 0.47 -0.46 9.88 3.32 -1.91 -0.76 116.42 134.05 1k8c h ASP 243 Ca -0.40 0.16 -0.10 0.00 0.02 0.00 0.00 57.03 56.71 1k8c h ASP 243 Cb 1.20 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 1k8c h ASP 243 CO 0.85 0.01 -0.11 0.74 -1.72 0.00 0.00 179.24 179.01 1k8c h THR 244 N 0.44 1.27 -0.18 0.35 2.02 -1.95 -1.57 112.91 113.29 1k8c h THR 244 Ca 0.62 -1.23 -0.05 0.00 0.77 0.00 0.00 66.41 66.52 1k8c h THR 244 Cb 1.23 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 1k8c h THR 244 CO -0.53 0.42 -0.09 0.40 0.37 0.00 0.00 175.52 176.09 1k8c h ILE 245 N 0.72 1.31 0.06 3.11 1.08 -1.48 -2.60 117.51 119.71 1k8c h ILE 245 Ca 0.12 -1.15 0.02 0.00 -0.39 0.00 0.00 64.86 63.45 1k8c h ILE 245 Cb 0.65 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 36.06 1k8c h ILE 245 CO 0.04 0.34 -0.17 0.11 -0.69 0.00 0.00 178.15 177.79 1k8c h LYS 246 N 0.06 -0.29 -0.61 2.37 1.57 -1.21 0.17 116.57 118.63 1k8c h LYS 246 Ca 0.04 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 58.96 1k8c h LYS 246 Cb 0.58 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 32.83 1k8c h LYS 246 CO 0.03 -0.20 -0.21 0.00 -0.57 0.00 0.00 179.45 178.50 1k8c h ALA 247 N 0.57 0.29 -0.21 3.86 0.00 -1.27 0.89 119.26 123.38 1k8c h ALA 247 Ca 0.03 0.22 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 1k8c h ALA 247 Cb 0.34 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1k8c h ALA 247 CO -0.11 -0.50 -0.42 0.82 0.00 0.00 0.00 179.25 179.04 1k8c h ILE 248 N -0.05 1.31 -0.25 0.00 2.04 -1.13 -1.25 117.51 118.18 1k8c h ILE 248 Ca 0.28 -1.59 -0.10 0.00 1.00 0.00 0.00 64.86 64.45 1k8c h ILE 248 Cb 0.49 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 38.17 1k8c h ILE 248 CO -0.66 0.50 -0.23 0.00 0.00 0.00 0.00 178.15 177.76 1k8c h ALA 249 N 1.12 0.36 0.00 1.87 0.00 0.14 -2.75 119.26 120.01 1k8c h ALA 249 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1k8c h ALA 249 Cb 0.91 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1k8c h ALA 249 CO 0.08 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1k8c h ALA 250 N 0.68 1.00 0.00 0.00 0.00 0.72 0.16 119.26 121.82 1k8c h ALA 250 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1k8c h ALA 250 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1k8c h ALA 250 CO 0.06 0.00 -0.20 1.17 0.00 0.00 0.00 179.25 180.28 1k8c n LYS 251 N -2.52 0.11 0.00 0.00 4.81 -0.47 -3.65 118.16 116.44 1k8c n LYS 251 Ca 0.03 0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1k8c n LYS 251 Cb 0.31 -1.60 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1k8c n LYS 251 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1k8c n TYR 252 N -1.78 0.00 -3.41 5.64 4.01 -1.03 -5.01 117.16 115.59 1k8c n TYR 252 Ca 0.06 -0.01 -0.20 0.00 -0.16 0.00 0.00 57.90 57.60 1k8c n TYR 252 Cb 0.38 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.48 1k8c n TYR 252 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1k8c n ASN 253 N -0.01 -5.01 -4.52 7.72 4.05 -0.04 -5.02 115.26 112.42 1k8c n ASN 253 Ca 0.00 -0.48 -0.25 0.00 0.45 0.00 0.00 54.58 54.29 1k8c n ASN 253 Cb 0.10 -4.45 -0.10 0.00 1.23 0.00 0.00 39.78 36.55 1k8c n ASN 253 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1k8c s LYS 254 N -5.94 1.78 0.60 1.20 -0.14 0.36 -5.02 119.74 112.59 1k8c s LYS 254 Ca 0.40 -1.89 -0.11 0.00 -1.36 0.00 0.00 55.97 53.00 1k8c s LYS 254 Cb -0.18 -1.72 -0.04 0.00 -1.68 0.00 0.00 37.83 34.21 1k8c s LYS 254 CO 0.63 0.19 1.01 0.95 -0.76 0.00 0.00 175.35 177.37 1k8c s THR 255 N -2.59 4.70 0.27 2.17 -4.23 -1.26 -4.26 115.64 110.44 1k8c s THR 255 Ca 0.32 0.87 -0.03 0.00 -1.18 0.00 0.00 61.69 61.67 1k8c s THR 255 Cb 0.01 -3.85 0.27 0.00 1.34 0.00 0.00 72.50 70.27 1k8c s THR 255 CO 0.16 -1.07 1.90 -0.65 -0.54 0.00 0.00 174.62 174.42 1k8c h PRO 256 N -0.11 1.18 -0.87 3.99 0.11 -1.89 -1.24 132.00 133.18 1k8c h PRO 256 Ca -0.45 -0.07 0.09 0.00 0.11 0.00 0.00 66.00 65.69 1k8c h PRO 256 Cb 1.19 -0.27 -0.07 0.00 0.11 0.00 0.00 31.00 31.96 1k8c h PRO 256 CO 0.62 0.78 0.51 0.00 -0.21 0.00 0.00 178.00 179.70 1k8c h ALA 257 N 1.44 1.24 0.00 -0.75 0.00 -1.94 -0.46 119.26 118.80 1k8c h ALA 257 Ca 0.41 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.27 1k8c h ALA 257 Cb 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1k8c h ALA 257 CO -0.15 0.15 -0.39 0.93 0.00 0.00 0.00 179.25 179.79 1k8c h GLU 258 N 0.86 0.00 0.01 0.00 5.08 -1.61 -2.29 114.58 116.62 1k8c h GLU 258 Ca 0.41 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.55 1k8c h GLU 258 Cb 0.36 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.63 1k8c h GLU 258 CO -0.24 0.39 -0.89 0.28 -1.00 0.00 0.00 179.01 177.55 1k8c h VAL 259 N 0.00 1.33 -0.70 3.13 2.07 -0.67 -1.91 116.25 119.51 1k8c h VAL 259 Ca -0.00 -2.20 0.01 0.00 0.82 0.00 0.00 66.70 65.33 1k8c h VAL 259 Cb 0.74 2.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.96 1k8c h VAL 259 CO 0.05 0.67 0.46 -0.07 0.02 0.00 0.00 177.57 178.70 1k8c h LEU 260 N 0.20 0.79 -0.26 2.57 3.38 -0.96 -0.31 115.31 120.72 1k8c h LEU 260 Ca -0.11 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 1k8c h LEU 260 Cb 1.57 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 1k8c h LEU 260 CO 0.18 0.57 -0.31 -0.07 0.09 0.00 0.00 178.44 178.89 1k8c h LEU 261 N 0.94 0.73 -1.00 1.67 3.38 -1.47 -3.22 115.31 116.33 1k8c h LEU 261 Ca 0.26 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 1k8c h LEU 261 Cb -0.10 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 1k8c h LEU 261 CO -0.06 1.07 0.19 -0.09 0.09 0.00 0.00 178.44 179.64 1k8c h ARG 262 N 0.40 0.91 -0.70 1.13 9.65 -1.09 -1.07 114.38 123.59 1k8c h ARG 262 Ca 0.03 -0.17 0.11 0.00 -1.10 0.00 0.00 59.98 58.86 1k8c h ARG 262 Cb 0.89 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 29.28 1k8c h ARG 262 CO 0.08 0.78 0.47 2.35 2.80 0.00 0.00 179.97 186.44 1k8c h TRP 263 N 0.88 0.55 0.03 2.20 7.01 -1.06 0.34 115.95 125.89 1k8c h TRP 263 Ca 0.20 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 61.09 1k8c h TRP 263 Cb 0.25 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.12 1k8c h TRP 263 CO 0.02 0.24 -0.64 0.00 -2.79 0.00 0.00 178.44 175.27 1k8c h ALA 264 N 1.65 0.10 -0.62 2.65 0.00 -1.49 -3.37 119.26 118.19 1k8c h ALA 264 Ca 0.33 -0.82 0.07 0.00 0.00 0.00 0.00 54.91 54.49 1k8c h ALA 264 Cb 0.61 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 1k8c h ALA 264 CO -0.11 0.36 0.31 0.00 0.00 0.00 0.00 179.25 179.81 1k8c h ALA 265 N -0.16 0.82 0.00 0.00 0.00 -0.85 -1.10 119.26 117.97 1k8c h ALA 265 Ca -0.16 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1k8c h ALA 265 Cb 1.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1k8c h ALA 265 CO -0.05 -0.05 0.00 0.94 0.00 0.00 0.00 179.25 180.09 1k8c n GLN 266 N -4.87 0.00 -0.39 0.00 7.27 0.08 -1.02 117.38 118.46 1k8c n GLN 266 Ca 0.08 0.36 0.08 0.00 0.07 0.00 0.00 57.00 57.59 1k8c n GLN 266 Cb 0.20 -1.51 0.26 0.00 2.41 0.00 0.00 30.24 31.60 1k8c n GLN 266 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1k8c n ARG 267 N -1.52 3.16 -1.01 3.69 1.74 -0.46 -4.94 116.66 117.31 1k8c n ARG 267 Ca 0.02 -2.55 -0.00 0.00 -0.77 0.00 0.00 57.85 54.55 1k8c n ARG 267 Cb 0.10 -1.62 -0.00 0.00 -1.02 0.00 0.00 32.46 29.92 1k8c n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k8c n GLY 268 N 0.59 0.42 3.71 -0.13 0.00 -0.18 -5.04 105.19 104.56 1k8c n GLY 268 Ca 0.19 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 1k8c n GLY 268 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k8c s ILE 269 N -2.02 5.25 0.47 -0.61 1.01 -0.95 -4.61 121.20 119.75 1k8c s ILE 269 Ca 0.00 0.13 -0.22 0.00 0.00 0.00 0.00 60.65 60.57 1k8c s ILE 269 Cb 0.00 -3.39 -0.08 0.00 0.01 0.00 0.00 42.46 39.00 1k8c s ILE 269 CO 0.00 0.45 1.08 0.00 0.00 0.00 0.00 174.94 176.47 1k8c s ALA 270 N 0.34 2.92 0.14 9.38 0.00 0.51 -3.65 121.76 131.39 1k8c s ALA 270 Ca 0.07 0.73 0.07 0.00 0.00 0.00 0.00 51.96 52.82 1k8c s ALA 270 Cb -0.11 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1k8c s ALA 270 CO -0.01 -0.42 -0.15 0.14 0.00 0.00 0.00 175.76 175.32 1k8c s VAL 271 N -1.78 1.50 -0.36 0.00 -7.23 0.26 -0.32 120.40 112.46 1k8c s VAL 271 Ca 0.65 -1.80 0.13 0.00 -1.81 0.00 0.00 61.98 59.14 1k8c s VAL 271 Cb -0.21 -1.66 0.36 0.00 0.56 0.00 0.00 36.38 35.43 1k8c s VAL 271 CO 0.26 -0.40 0.76 2.30 -0.31 0.00 0.00 175.10 177.71 1k8c n ILE 272 N 0.41 -0.03 -1.29 -0.62 -5.35 -1.25 -0.25 119.36 110.98 1k8c n ILE 272 Ca -0.14 -4.41 -0.34 0.00 -0.27 0.00 0.00 62.75 57.58 1k8c n ILE 272 Cb 0.57 -0.15 0.11 0.00 -1.74 0.00 0.00 39.64 38.43 1k8c n ILE 272 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1k8c s PRO 273 N -2.51 1.90 -0.06 6.28 0.04 -1.22 -2.67 135.00 136.76 1k8c s PRO 273 Ca 0.38 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 63.22 1k8c s PRO 273 Cb 0.36 -1.80 0.03 0.00 0.04 0.00 0.00 34.50 33.13 1k8c s PRO 273 CO -0.07 -2.03 0.03 0.21 0.04 0.00 0.00 177.00 175.18 1k8c s LYS 274 N -3.96 0.29 -0.02 4.56 2.36 -1.26 -2.46 119.74 119.24 1k8c s LYS 274 Ca 0.75 0.23 0.02 0.00 -2.55 0.00 0.00 55.97 54.42 1k8c s LYS 274 Cb -0.30 -0.74 0.00 0.00 -1.05 0.00 0.00 37.83 35.74 1k8c s LYS 274 CO 0.48 -0.31 -0.08 0.45 1.55 0.00 0.00 175.35 177.44 1k8c s SER 275 N 2.02 1.07 0.03 1.43 0.15 -1.26 -4.99 113.70 112.15 1k8c s SER 275 Ca 0.04 -0.16 0.28 0.00 0.70 0.00 0.00 55.95 56.81 1k8c s SER 275 Cb -0.12 -0.29 1.02 0.00 -1.71 0.00 0.00 66.02 64.92 1k8c s SER 275 CO -0.04 0.05 1.80 0.59 1.20 0.00 0.00 173.24 176.84 1k8c n ASN 276 N 3.31 0.22 -4.59 5.45 5.03 -1.26 -4.74 115.26 118.69 1k8c n ASN 276 Ca -0.18 0.37 -0.37 0.00 0.87 0.00 0.00 54.58 55.26 1k8c n ASN 276 Cb 0.54 -0.39 -0.11 0.00 -1.02 0.00 0.00 39.78 38.81 1k8c n ASN 276 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1k8c s LEU 277 N -3.26 3.96 0.27 3.41 2.96 -1.26 -5.01 118.68 119.75 1k8c s LEU 277 Ca 0.13 -0.01 -0.00 0.00 -0.22 0.00 0.00 54.13 54.02 1k8c s LEU 277 Cb 0.18 -2.09 0.61 0.00 0.50 0.00 0.00 46.19 45.39 1k8c s LEU 277 CO 0.58 -0.02 1.68 1.55 -1.32 0.00 0.00 176.35 178.81 1k8c h PRO 278 N 8.12 0.28 0.53 0.98 0.13 -1.99 -0.69 132.00 139.37 1k8c h PRO 278 Ca -0.36 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 1k8c h PRO 278 Cb 1.18 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1k8c h PRO 278 CO 0.58 0.19 -0.34 1.05 -0.23 0.00 0.00 178.00 179.25 1k8c h GLU 279 N 0.29 -0.80 -0.35 0.86 9.09 -1.98 -2.13 114.58 119.56 1k8c h GLU 279 Ca 0.50 0.05 0.02 0.00 0.05 0.00 0.00 59.36 59.99 1k8c h GLU 279 Cb 0.92 0.18 -0.02 0.00 -1.65 0.00 0.00 28.75 28.19 1k8c h GLU 279 CO -0.56 -0.53 0.24 0.00 0.05 0.00 0.00 179.01 178.21 1k8c h ARG 280 N -0.83 0.38 -0.85 1.06 3.08 -1.84 -0.10 114.38 115.28 1k8c h ARG 280 Ca -0.06 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.08 1k8c h ARG 280 Cb 0.68 -0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.56 1k8c h ARG 280 CO 0.05 0.25 0.48 1.25 -1.07 0.00 0.00 179.97 180.93 1k8c h LEU 281 N 0.39 0.65 0.07 3.04 5.85 -0.56 0.16 115.31 124.91 1k8c h LEU 281 Ca 0.14 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 1k8c h LEU 281 Cb 0.09 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1k8c h LEU 281 CO -0.03 0.34 -0.03 0.58 -0.34 0.00 0.00 178.44 178.96 1k8c h VAL 282 N 0.76 1.23 -0.82 1.05 2.07 -0.44 -3.26 116.25 116.84 1k8c h VAL 282 Ca 0.43 -1.14 0.17 0.00 0.82 0.00 0.00 66.70 66.98 1k8c h VAL 282 Cb 0.47 1.96 -0.11 0.00 -1.52 0.00 0.00 31.29 32.09 1k8c h VAL 282 CO -0.29 0.28 0.33 1.56 0.02 0.00 0.00 177.57 179.47 1k8c h GLN 283 N -0.61 0.42 0.00 1.57 4.20 -0.46 -2.17 115.11 118.06 1k8c h GLN 283 Ca -0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1k8c h GLN 283 Cb 0.52 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1k8c h GLN 283 CO 0.01 0.28 0.00 0.09 -0.67 0.00 0.00 178.83 178.54 1k8c n ASN 284 N -5.02 0.59 -0.53 1.46 3.02 0.48 -2.52 115.26 112.74 1k8c n ASN 284 Ca 0.17 0.68 0.07 0.00 -0.03 0.00 0.00 54.58 55.47 1k8c n ASN 284 Cb 0.51 -0.80 0.06 0.00 -0.61 0.00 0.00 39.78 38.94 1k8c n ASN 284 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1k8c n ARG 285 N -2.20 0.86 -3.17 3.52 1.85 -0.82 -4.71 116.66 112.00 1k8c n ARG 285 Ca 0.01 -1.30 -0.21 0.00 -1.00 0.00 0.00 57.85 55.35 1k8c n ARG 285 Cb 0.16 -1.25 -0.05 0.00 -1.05 0.00 0.00 32.46 30.27 1k8c n ARG 285 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1k8c n SER 286 N 0.74 0.27 -0.21 2.89 3.41 -1.05 -4.79 113.62 114.88 1k8c n SER 286 Ca 0.08 -2.86 0.03 0.00 -0.26 0.00 0.00 58.87 55.86 1k8c n SER 286 Cb 0.33 -0.49 0.02 0.00 -0.26 0.00 0.00 64.21 63.80 1k8c n SER 286 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1k8c n PHE 287 N 0.95 0.00 -1.59 7.33 1.16 -1.25 -4.74 117.46 119.33 1k8c n PHE 287 Ca 0.22 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.43 1k8c n PHE 287 Cb 0.59 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.43 1k8c n PHE 287 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 1k8c n ASN 288 N 0.15 8.08 -0.17 5.98 3.02 -1.26 -4.35 115.26 126.71 1k8c n ASN 288 Ca 0.03 -2.85 0.09 0.00 -0.03 0.00 0.00 54.58 51.82 1k8c n ASN 288 Cb 0.15 -1.44 0.15 0.00 -0.61 0.00 0.00 39.78 38.02 1k8c n ASN 288 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1k8c n THR 289 N 2.54 1.91 -3.62 3.41 -2.24 -1.26 -5.03 114.28 109.99 1k8c n THR 289 Ca 0.68 -2.40 -0.05 0.00 -2.27 0.00 0.00 64.05 60.00 1k8c n THR 289 Cb 0.30 -0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 68.27 1k8c n THR 289 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1k8c s PHE 290 N -2.89 -0.16 0.08 4.78 -0.71 -1.26 -5.17 117.98 112.65 1k8c s PHE 290 Ca 0.33 0.25 0.05 0.00 -1.04 0.00 0.00 56.93 56.51 1k8c s PHE 290 Cb 0.29 0.48 -0.04 0.00 -1.21 0.00 0.00 43.02 42.55 1k8c s PHE 290 CO 0.01 -0.15 -0.02 -0.51 -1.34 0.00 0.00 175.22 173.21 1k8c s ASP 291 N -1.19 4.93 0.14 1.98 1.01 -1.26 -5.08 116.67 117.20 1k8c s ASP 291 Ca 0.05 -0.19 -0.18 0.00 0.71 0.00 0.00 52.55 52.95 1k8c s ASP 291 Cb -0.01 -1.16 -0.07 0.00 1.01 0.00 0.00 42.92 42.69 1k8c s ASP 291 CO -0.04 0.19 0.61 -0.76 0.21 0.00 0.00 175.17 175.38 1k8c s LEU 292 N -2.18 4.43 0.49 1.23 1.43 -1.26 -5.07 118.68 117.75 1k8c s LEU 292 Ca 0.24 1.26 -0.02 0.00 -1.03 0.00 0.00 54.13 54.58 1k8c s LEU 292 Cb -0.12 -3.20 -0.01 0.00 0.03 0.00 0.00 46.19 42.89 1k8c s LEU 292 CO 0.16 0.16 0.75 0.42 0.23 0.00 0.00 176.35 178.07 1k8c s THR 293 N -1.33 4.14 0.22 5.49 -4.23 -1.26 -4.89 115.64 113.79 1k8c s THR 293 Ca 0.36 -0.23 -0.09 0.00 -1.18 0.00 0.00 61.69 60.54 1k8c s THR 293 Cb -0.18 -3.57 0.20 0.00 1.34 0.00 0.00 72.50 70.30 1k8c s THR 293 CO 0.20 -0.48 1.68 0.50 -0.54 0.00 0.00 174.62 175.98 1k8c h LYS 294 N 0.23 0.18 -0.60 3.99 3.64 -1.99 0.28 116.57 122.30 1k8c h LYS 294 Ca -0.46 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 58.94 1k8c h LYS 294 Cb 1.24 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1k8c h LYS 294 CO 0.59 0.12 0.40 0.93 -2.27 0.00 0.00 179.45 179.22 1k8c h GLU 295 N 0.18 0.66 -0.11 1.90 3.07 -1.98 0.19 114.58 118.49 1k8c h GLU 295 Ca 0.34 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 59.15 1k8c h GLU 295 Cb 0.56 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1k8c h GLU 295 CO -0.50 0.44 0.01 -0.44 -1.40 0.00 0.00 179.01 177.12 1k8c h ASP 296 N 0.68 0.18 -0.81 1.42 3.32 -0.86 -0.87 116.42 119.47 1k8c h ASP 296 Ca 0.24 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.04 1k8c h ASP 296 Cb 0.12 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 1k8c h ASP 296 CO -0.07 0.41 0.53 -0.26 -1.72 0.00 0.00 179.24 178.13 1k8c h PHE 297 N -0.05 1.00 -0.66 4.55 0.04 -0.29 0.88 116.94 122.40 1k8c h PHE 297 Ca 0.03 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 1k8c h PHE 297 Cb 0.31 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 1k8c h PHE 297 CO 0.02 0.60 0.33 0.93 -0.60 0.00 0.00 178.31 179.59 1k8c h GLU 298 N 1.05 0.94 -0.22 1.51 5.08 -0.46 0.30 114.58 122.78 1k8c h GLU 298 Ca 0.31 -0.13 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 1k8c h GLU 298 Cb -0.05 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1k8c h GLU 298 CO -0.09 0.73 -0.45 0.93 -1.00 0.00 0.00 179.01 179.13 1k8c h GLU 299 N 0.90 0.54 -0.25 2.33 4.39 -0.59 -3.06 114.58 118.84 1k8c h GLU 299 Ca 0.23 -0.29 -0.10 0.00 0.34 0.00 0.00 59.36 59.53 1k8c h GLU 299 Cb 0.09 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1k8c h GLU 299 CO -0.03 0.88 -0.24 0.82 -1.16 0.00 0.00 179.01 179.28 1k8c h ILE 300 N 0.44 1.31 0.00 3.13 2.04 -0.34 -2.87 117.51 121.22 1k8c h ILE 300 Ca 0.03 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.49 1k8c h ILE 300 Cb 0.95 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1k8c h ILE 300 CO 0.08 0.44 0.26 0.00 0.00 0.00 0.00 178.15 178.94 1k8c h ALA 301 N 0.69 1.25 0.00 1.87 0.00 -0.34 0.15 119.26 122.88 1k8c h ALA 301 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1k8c h ALA 301 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1k8c h ALA 301 CO 0.06 -0.25 0.00 0.87 0.00 0.00 0.00 179.25 179.93 1k8c h LYS 302 N 0.00 0.00 0.00 0.00 1.57 -1.42 -3.06 116.57 113.66 1k8c h LYS 302 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1k8c h LYS 302 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1k8c h LYS 302 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.81 1k8c h LEU 303 N 0.00 0.00 -9.08 2.94 3.38 -0.86 -3.45 115.31 108.24 1k8c h LEU 303 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1k8c h LEU 303 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1k8c h LEU 303 CO 0.00 0.00 1.37 -0.62 0.09 0.00 0.00 178.44 179.28 1k8c s ASP 304 N -4.74 5.84 0.00 -0.43 2.15 -0.90 -4.34 116.67 114.26 1k8c s ASP 304 Ca 0.08 2.04 0.00 0.00 0.43 0.00 0.00 52.55 55.10 1k8c s ASP 304 Cb 0.10 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1k8c s ASP 304 CO 0.55 -1.63 0.72 2.30 -0.17 0.00 0.00 175.17 176.94 1k8c n ILE 305 N 7.00 0.53 -3.53 4.11 -5.35 -0.85 -5.01 119.36 116.26 1k8c n ILE 305 Ca 0.26 -0.63 -0.22 0.00 -0.27 0.00 0.00 62.75 61.89 1k8c n ILE 305 Cb 0.44 0.81 0.08 0.00 -1.74 0.00 0.00 39.64 39.23 1k8c n ILE 305 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1k8c n GLY 306 N -0.26 -0.47 3.58 3.28 0.00 0.52 -4.96 105.19 106.88 1k8c n GLY 306 Ca 0.00 0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1k8c n GLY 306 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1k8c s LEU 307 N -6.94 4.23 -0.20 0.99 2.96 -0.39 -4.93 118.68 114.40 1k8c s LEU 307 Ca 0.49 0.19 -0.04 0.00 -0.22 0.00 0.00 54.13 54.56 1k8c s LEU 307 Cb -0.21 -2.67 -0.01 0.00 0.50 0.00 0.00 46.19 43.79 1k8c s LEU 307 CO 0.70 -0.45 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.63 1k8c s ARG 308 N 2.46 3.44 -0.05 1.98 3.52 -1.26 -4.14 118.95 124.90 1k8c s ARG 308 Ca 0.21 -0.61 0.12 0.00 -0.13 0.00 0.00 55.73 55.32 1k8c s ARG 308 Cb -0.15 -2.96 -0.23 0.00 -1.56 0.00 0.00 34.95 30.04 1k8c s ARG 308 CO 0.12 -0.07 0.65 1.19 -0.81 0.00 0.00 175.30 176.38 1k8c n PHE 309 N 4.43 1.02 -3.45 5.12 3.72 -1.26 -4.65 117.46 122.39 1k8c n PHE 309 Ca -0.18 0.36 -0.44 0.00 -0.05 0.00 0.00 57.45 57.14 1k8c n PHE 309 Cb 0.51 -1.19 -0.05 0.00 -0.94 0.00 0.00 39.48 37.82 1k8c n PHE 309 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1k8c s ASN 310 N -6.14 6.24 -0.19 4.37 2.47 -1.26 -5.03 114.94 115.40 1k8c s ASN 310 Ca -0.06 -2.67 -0.00 0.00 0.42 0.00 0.00 52.86 50.56 1k8c s ASN 310 Cb 0.08 -2.10 0.05 0.00 -1.45 0.00 0.00 41.25 37.83 1k8c s ASN 310 CO 0.82 -0.53 -0.06 -0.62 -3.72 0.00 0.00 177.10 172.99 1k8c s ASP 311 N 1.82 3.20 0.32 -4.21 -1.08 -1.26 -4.98 116.67 110.48 1k8c s ASP 311 Ca 0.16 -0.84 0.18 0.00 -0.52 0.00 0.00 52.55 51.54 1k8c s ASP 311 Cb -0.15 -1.03 0.99 0.00 -1.46 0.00 0.00 42.92 41.27 1k8c s ASP 311 CO -0.06 -0.19 1.52 -2.65 0.52 0.00 0.00 175.17 174.30 1k8c n PRO 312 N 4.79 0.12 0.17 4.34 -0.02 -1.26 -0.59 135.00 142.55 1k8c n PRO 312 Ca -0.12 0.61 0.06 0.00 -2.02 0.00 0.00 63.50 62.03 1k8c n PRO 312 Cb 0.47 -2.02 0.54 0.00 -0.02 0.00 0.00 33.50 32.47 1k8c n PRO 312 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 1k8c h TRP 313 N 0.00 0.17 0.00 6.00 2.91 -1.91 -1.65 115.95 121.47 1k8c h TRP 313 Ca 0.00 -0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.92 1k8c h TRP 313 Cb 0.24 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 28.82 1k8c h TRP 313 CO 0.00 0.15 -0.50 -0.44 -1.03 0.00 0.00 178.44 176.63 1k8c h ASP 314 N 0.18 0.00 0.29 2.65 3.32 -1.19 -1.25 116.42 120.42 1k8c h ASP 314 Ca 0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1k8c h ASP 314 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1k8c h ASP 314 CO -0.00 0.50 -0.14 -0.50 -1.72 0.00 0.00 179.24 177.37 1k8c h TRP 315 N 0.00 -0.36 -0.09 4.55 6.55 -1.44 -3.43 115.95 121.73 1k8c h TRP 315 Ca -0.00 -0.01 -0.19 0.00 0.95 0.00 0.00 58.89 59.64 1k8c h TRP 315 Cb 0.94 0.12 -0.20 0.00 -0.86 0.00 0.00 29.16 29.16 1k8c h TRP 315 CO 0.00 -0.02 -0.44 -3.47 -1.05 0.00 0.00 178.44 173.46 1k8c n ASP 316 N -5.05 -0.88 -3.98 -3.49 2.03 -1.15 -5.00 116.55 99.03 1k8c n ASP 316 Ca -0.08 -2.19 -0.27 0.00 0.52 0.00 0.00 54.79 52.78 1k8c n ASP 316 Cb 0.25 0.47 -0.02 0.00 -0.72 0.00 0.00 41.12 41.10 1k8c n ASP 316 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1k8c n ASN 317 N -1.35 -0.74 -4.65 1.67 3.02 -0.47 -4.91 115.26 107.84 1k8c n ASN 317 Ca -0.13 -1.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.00 1k8c n ASN 317 Cb 0.86 -3.04 -0.04 0.00 -0.61 0.00 0.00 39.78 36.95 1k8c n ASN 317 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k8c s ILE 318 N -3.87 4.83 0.00 2.41 1.01 -1.19 -4.93 121.20 119.46 1k8c s ILE 318 Ca 0.10 1.59 0.00 0.00 0.00 0.00 0.00 60.65 62.34 1k8c s ILE 318 Cb -0.05 -4.13 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1k8c s ILE 318 CO 0.89 -0.07 0.76 -0.81 0.00 0.00 0.00 174.94 175.71 1k8c n PRO 319 N 5.93 0.65 -0.30 2.79 -0.04 -1.26 -3.27 135.00 139.50 1k8c n PRO 319 Ca 0.06 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1k8c n PRO 319 Cb 0.48 -1.18 0.09 0.00 -0.04 0.00 0.00 33.50 32.84 1k8c n PRO 319 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1k8c h ILE 320 N 0.52 1.18 -0.56 0.52 1.08 -1.95 -3.08 117.51 115.22 1k8c h ILE 320 Ca 0.00 -0.37 -0.26 0.00 -0.39 0.00 0.00 64.86 63.84 1k8c h ILE 320 Cb 0.65 0.02 -0.16 0.00 -3.07 0.00 0.00 36.82 34.26 1k8c h ILE 320 CO 0.00 0.19 0.17 0.49 -0.69 0.00 0.00 178.15 178.31 1k8c n PHE 321 N -4.54 1.76 -0.23 1.37 3.72 -1.26 -4.71 117.46 113.56 1k8c n PHE 321 Ca 0.09 -1.56 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 1k8c n PHE 321 Cb 0.04 -0.62 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 1k8c n PHE 321 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04