#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2du8 s ARG 3002N 0.00 2.65 -0.09 2.12 0.52 -1.26 -2.30 118.95 120.58 2du8 s ARG 3002Ca 0.00 -1.20 -0.02 0.00 -0.52 0.00 0.00 55.73 53.99 2du8 s ARG 3002Cb 0.00 -3.56 -0.03 0.00 0.52 0.00 0.00 34.95 31.88 2du8 s ARG 3002CO 0.00 -0.71 -0.01 0.08 0.02 0.00 0.00 175.30 174.68 2du8 s VAL 3003N 1.43 4.22 -0.11 3.52 1.01 -0.14 0.63 120.40 130.96 2du8 s VAL 3003Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 2du8 s VAL 3003Cb -0.20 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.44 2du8 s VAL 3003CO 0.03 0.59 -0.03 -0.69 0.00 0.00 0.00 175.10 175.00 2du8 s VAL 3004N -0.76 0.75 -0.26 2.92 1.01 -0.36 -1.73 120.40 121.96 2du8 s VAL 3004Ca 0.12 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.78 2du8 s VAL 3004Cb -0.11 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2du8 s VAL 3004CO 0.02 0.24 0.17 -0.69 0.00 0.00 0.00 175.10 174.84 2du8 s VAL 3005N 1.81 5.21 -0.30 2.92 1.01 0.14 -0.19 120.40 131.00 2du8 s VAL 3005Ca 0.04 0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.03 2du8 s VAL 3005Cb -0.13 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2du8 s VAL 3005CO -0.07 0.29 0.25 -0.63 0.00 0.00 0.00 175.10 174.94 2du8 s ILE 3006N 1.51 5.27 0.00 2.22 1.01 0.27 -0.07 121.20 131.41 2du8 s ILE 3006Ca 0.07 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.85 2du8 s ILE 3006Cb -0.15 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.69 2du8 s ILE 3006CO 0.08 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.77 2du8 n GLY 3007N 5.00 3.01 1.44 6.18 0.00 0.15 -1.36 105.19 119.60 2du8 n GLY 3007Ca -0.12 -1.32 -0.07 0.00 0.00 0.00 0.00 46.02 44.51 2du8 n GLY 3007CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2du8 n ALA 3008N 1.21 4.01 -1.35 4.61 0.00 -1.26 -4.12 120.51 123.61 2du8 n ALA 3008Ca 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 53.44 50.07 2du8 n ALA 3008Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2du8 n ALA 3008CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2du8 n GLY 3009N -0.77 0.09 0.26 0.00 0.00 -1.26 -4.44 105.19 99.06 2du8 n GLY 3009Ca 0.27 -1.77 0.01 0.00 0.00 0.00 0.00 46.02 44.53 2du8 n GLY 3009CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2du8 h VAL 3010N -0.05 1.19 0.02 1.61 3.04 -1.96 -2.22 116.25 117.87 2du8 h VAL 3010Ca 0.00 -0.76 -0.03 0.00 -1.01 0.00 0.00 66.70 64.90 2du8 h VAL 3010Cb 0.00 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 2du8 h VAL 3010CO 0.00 0.25 -0.14 0.40 -1.01 0.00 0.00 177.57 177.08 2du8 h ILE 3011N 0.39 1.73 -0.44 3.17 1.08 -1.92 -2.66 117.51 118.86 2du8 h ILE 3011Ca 0.08 -2.36 0.09 0.00 -0.39 0.00 0.00 64.86 62.28 2du8 h ILE 3011Cb 0.34 3.33 -0.10 0.00 -3.07 0.00 0.00 36.82 37.32 2du8 h ILE 3011CO 0.01 0.61 -0.30 1.23 -0.69 0.00 0.00 178.15 179.01 2du8 h GLY 3012N -0.93 -0.14 1.17 5.37 0.00 -1.71 -2.06 103.07 104.76 2du8 h GLY 3012Ca -0.03 0.38 -0.25 0.00 0.00 0.00 0.00 47.33 47.43 2du8 h GLY 3012CO 0.01 -0.21 -0.98 1.41 0.00 0.00 0.00 176.54 176.77 2du8 h LEU 3013N -0.21 0.89 -0.45 3.11 3.38 -1.50 -1.50 115.31 119.03 2du8 h LEU 3013Ca 0.19 -0.73 -0.06 0.00 0.09 0.00 0.00 57.88 57.38 2du8 h LEU 3013Cb 0.52 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2du8 h LEU 3013CO -0.56 1.50 0.05 0.77 0.09 0.00 0.00 178.44 180.29 2du8 h SER 3014N 0.37 0.73 -0.12 -0.43 4.64 -1.53 -0.51 113.55 116.69 2du8 h SER 3014Ca -0.12 -0.27 -0.01 0.00 -0.47 0.00 0.00 61.79 60.92 2du8 h SER 3014Cb 1.64 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 2du8 h SER 3014CO 0.19 0.82 0.05 0.74 -0.87 0.00 0.00 176.83 177.76 2du8 h THR 3015N 0.61 1.16 -0.50 2.95 2.02 -1.35 0.29 112.91 118.09 2du8 h THR 3015Ca 0.13 -0.49 0.09 0.00 0.77 0.00 0.00 66.41 66.91 2du8 h THR 3015Cb 0.41 1.26 -0.08 0.00 -1.74 0.00 0.00 68.15 68.01 2du8 h THR 3015CO 0.01 0.15 0.06 0.00 0.37 0.00 0.00 175.52 176.11 2du8 h ALA 3016N 0.87 0.53 -0.17 6.16 0.00 -1.12 0.18 119.26 125.72 2du8 h ALA 3016Ca 0.04 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2du8 h ALA 3016Cb 0.19 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2du8 h ALA 3016CO -0.00 -0.34 0.04 1.25 0.00 0.00 0.00 179.25 180.19 2du8 h LEU 3017N 0.19 0.26 -1.32 0.00 5.85 -0.81 -2.54 115.31 116.93 2du8 h LEU 3017Ca 0.26 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2du8 h LEU 3017Cb 0.37 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2du8 h LEU 3017CO -0.37 0.42 0.41 0.00 -0.34 0.00 0.00 178.44 178.56 2du8 h ILE 3019N 0.88 1.27 -0.25 0.00 2.04 -0.64 -3.18 117.51 117.64 2du8 h ILE 3019Ca 0.23 -1.68 -0.10 0.00 1.00 0.00 0.00 64.86 64.32 2du8 h ILE 3019Cb -0.06 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2du8 h ILE 3019CO -0.05 0.55 -0.23 -0.74 0.00 0.00 0.00 178.15 177.68 2du8 h HIS 3020N 0.69 0.71 0.00 1.37 2.76 -0.96 -2.43 115.15 117.28 2du8 h HIS 3020Ca 0.03 -0.21 0.00 0.00 -2.20 0.00 0.00 60.37 57.99 2du8 h HIS 3020Cb 1.11 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.92 2du8 h HIS 3020CO 0.07 0.91 0.00 1.05 -1.30 0.00 0.00 177.93 178.66 2du8 h GLU 3021N 0.30 0.00 -0.01 5.26 4.11 -1.42 -2.22 114.58 120.61 2du8 h GLU 3021Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2du8 h GLU 3021Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2du8 h GLU 3021CO 0.06 0.00 -0.77 -2.13 0.07 0.00 0.00 179.01 176.24 2du8 n ARG 3022N -3.08 0.64 0.00 1.06 0.63 -1.04 -4.65 116.66 110.22 2du8 n ARG 3022Ca -0.01 -0.37 0.00 0.00 -0.92 0.00 0.00 57.85 56.55 2du8 n ARG 3022Cb 0.22 -1.46 0.00 0.00 0.45 0.00 0.00 32.46 31.67 2du8 n ARG 3022CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2du8 n TYR 3023N -0.93 0.00 0.40 -0.14 4.01 -0.94 -4.80 117.16 114.75 2du8 n TYR 3023Ca 0.06 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.90 2du8 n TYR 3023Cb 0.37 0.00 0.42 0.00 -0.31 0.00 0.00 39.34 39.82 2du8 n TYR 3023CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 2du8 n HIS 3024N 0.00 0.51 0.00 -0.72 1.44 -0.84 -2.69 115.22 112.92 2du8 n HIS 3024Ca 0.00 0.21 0.03 0.00 -2.01 0.00 0.00 57.72 55.94 2du8 n HIS 3024Cb 0.24 -0.83 -0.11 0.00 0.12 0.00 0.00 29.99 29.40 2du8 n HIS 3024CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2du8 n SER 3025N -1.97 0.41 -0.90 4.39 3.41 -1.26 -4.39 113.62 113.31 2du8 n SER 3025Ca 0.02 0.18 0.08 0.00 -0.26 0.00 0.00 58.87 58.88 2du8 n SER 3025Cb 0.19 0.94 0.22 0.00 -0.26 0.00 0.00 64.21 65.30 2du8 n SER 3025CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2du8 n VAL 3026N -2.64 1.07 -3.62 -3.33 0.24 -1.09 -4.83 118.33 104.13 2du8 n VAL 3026Ca -0.12 -1.03 -0.24 0.00 -2.04 0.00 0.00 64.34 60.91 2du8 n VAL 3026Cb 0.79 0.46 -0.17 0.00 -1.47 0.00 0.00 33.84 33.45 2du8 n VAL 3026CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2du8 s LEU 3027N -1.09 0.27 0.02 1.34 1.43 -1.13 -4.93 118.68 114.60 2du8 s LEU 3027Ca 0.33 -0.41 -0.07 0.00 -1.03 0.00 0.00 54.13 52.94 2du8 s LEU 3027Cb 0.18 -0.19 -0.03 0.00 0.03 0.00 0.00 46.19 46.18 2du8 s LEU 3027CO 0.21 -0.32 1.11 -0.61 0.23 0.00 0.00 176.35 176.98 2du8 h GLN 3028N 8.42 -0.14 -5.02 1.70 -0.00 -1.88 -3.22 115.11 114.97 2du8 h GLN 3028Ca -0.14 0.01 -0.67 0.00 -0.00 0.00 0.00 58.65 57.84 2du8 h GLN 3028Cb 1.14 0.03 -0.17 0.00 0.00 0.00 0.00 27.48 28.48 2du8 h GLN 3028CO 0.25 -0.10 0.37 -1.25 0.00 0.00 0.00 178.83 178.11 2du8 s PRO 3029N -3.57 3.14 -0.63 -2.39 0.05 -1.26 -4.97 135.00 125.37 2du8 s PRO 3029Ca -0.03 -1.19 -0.07 0.00 0.05 0.00 0.00 61.00 59.75 2du8 s PRO 3029Cb 0.01 -4.32 0.16 0.00 0.05 0.00 0.00 34.50 30.41 2du8 s PRO 3029CO 0.13 -1.68 0.49 -1.17 0.05 0.00 0.00 177.00 174.82 2du8 s LEU 3030N 3.21 5.75 -0.47 -3.56 2.96 -1.22 -3.36 118.68 122.00 2du8 s LEU 3030Ca 0.18 -2.56 -0.11 0.00 -0.22 0.00 0.00 54.13 51.43 2du8 s LEU 3030Cb -0.19 -1.98 0.11 0.00 0.50 0.00 0.00 46.19 44.63 2du8 s LEU 3030CO 0.06 -0.51 0.35 -1.81 -1.32 0.00 0.00 176.35 173.12 2du8 s ASP 3031N 1.59 5.79 -0.26 3.68 -0.00 -0.97 -5.03 116.67 121.47 2du8 s ASP 3031Ca 0.14 -1.77 -0.10 0.00 -0.00 0.00 0.00 52.55 50.82 2du8 s ASP 3031Cb -0.19 -2.04 -0.05 0.00 -0.00 0.00 0.00 42.92 40.64 2du8 s ASP 3031CO -0.04 -0.68 0.16 -0.63 -0.00 0.00 0.00 175.17 173.98 2du8 s ILE 3032N 1.43 5.21 0.00 0.77 1.01 -1.26 -0.96 121.20 127.39 2du8 s ILE 3032Ca 0.05 0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.91 2du8 s ILE 3032Cb -0.26 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.74 2du8 s ILE 3032CO 0.01 0.31 -0.26 -0.54 0.00 0.00 0.00 174.94 174.46 2du8 s LYS 3033N 1.38 1.96 -0.22 2.79 1.02 -0.71 -2.94 119.74 123.03 2du8 s LYS 3033Ca 0.07 -0.97 -0.07 0.00 0.02 0.00 0.00 55.97 55.02 2du8 s LYS 3033Cb -0.15 -1.97 -0.04 0.00 -0.52 0.00 0.00 37.83 35.16 2du8 s LYS 3033CO 0.07 0.53 0.07 0.08 -0.92 0.00 0.00 175.35 175.18 2du8 s VAL 3034N -0.66 4.56 -0.14 3.17 1.01 0.10 -0.68 120.40 127.76 2du8 s VAL 3034Ca 0.10 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 2du8 s VAL 3034Cb -0.10 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2du8 s VAL 3034CO -0.00 0.39 -0.05 -0.31 0.00 0.00 0.00 175.10 175.13 2du8 s TYR 3035N 1.03 3.01 0.02 5.22 2.02 0.90 -0.72 117.35 128.83 2du8 s TYR 3035Ca 0.04 -0.27 -0.19 0.00 -0.37 0.00 0.00 57.07 56.28 2du8 s TYR 3035Cb -0.14 -1.92 0.04 0.00 -0.40 0.00 0.00 41.96 39.54 2du8 s TYR 3035CO 0.03 0.01 0.42 0.00 -1.57 0.00 0.00 175.55 174.44 2du8 s ALA 3036N 0.19 -1.05 -0.02 3.71 0.00 -0.67 0.29 121.76 124.21 2du8 s ALA 3036Ca -0.02 0.43 -0.20 0.00 0.00 0.00 0.00 51.96 52.16 2du8 s ALA 3036Cb -0.14 0.25 -0.31 0.00 0.00 0.00 0.00 23.12 22.92 2du8 s ALA 3036CO 0.03 -0.41 0.95 0.22 0.00 0.00 0.00 175.76 176.55 2du8 h ASP 3037N 3.19 0.55 -3.95 0.00 1.82 -1.81 0.38 116.42 116.60 2du8 h ASP 3037Ca -0.30 -0.92 -0.29 0.00 -0.39 0.00 0.00 57.03 55.13 2du8 h ASP 3037Cb 1.19 -0.18 -0.28 0.00 0.68 0.00 0.00 39.33 40.75 2du8 h ASP 3037CO 0.42 1.43 -0.74 0.00 -1.61 0.00 0.00 179.24 178.74 2du8 s ARG 3038N -2.58 0.31 0.38 0.28 1.70 -1.26 -4.67 118.95 113.10 2du8 s ARG 3038Ca -0.13 -0.19 0.03 0.00 -0.47 0.00 0.00 55.73 54.98 2du8 s ARG 3038Cb 0.02 -0.27 0.03 0.00 -0.57 0.00 0.00 34.95 34.16 2du8 s ARG 3038CO 0.85 0.07 0.27 1.19 -1.08 0.00 0.00 175.30 176.60 2du8 n PHE 3039N 2.84 -0.77 -0.06 5.89 3.72 -1.26 -4.62 117.46 123.20 2du8 n PHE 3039Ca -0.14 -1.63 0.06 0.00 -0.05 0.00 0.00 57.45 55.69 2du8 n PHE 3039Cb 0.58 -0.31 0.10 0.00 -0.94 0.00 0.00 39.48 38.91 2du8 n PHE 3039CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2du8 n THR 3040N -1.37 -0.04 0.12 4.37 5.66 -1.26 -0.33 114.28 121.43 2du8 n THR 3040Ca -0.02 0.27 0.05 0.00 -3.05 0.00 0.00 64.05 61.29 2du8 n THR 3040Cb 0.44 -0.44 0.02 0.00 -1.55 0.00 0.00 70.33 68.79 2du8 n THR 3040CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2du8 h PRO 3041N 0.00 0.00 -0.18 1.09 0.13 -1.94 -3.42 132.00 127.68 2du8 h PRO 3041Ca 0.13 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.18 2du8 h PRO 3041Cb 0.39 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.48 2du8 h PRO 3041CO -0.08 0.31 -0.17 1.28 -0.23 0.00 0.00 178.00 179.11 2du8 n LEU 3042N -3.06 3.41 -4.88 1.56 4.77 0.55 -4.87 117.00 114.49 2du8 n LEU 3042Ca -0.01 -3.58 -0.21 0.00 -0.03 0.00 0.00 56.01 52.18 2du8 n LEU 3042Cb 0.70 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2du8 n LEU 3042CO 0.40 1.12 -0.03 0.42 -1.33 0.00 0.00 177.39 177.96 2du8 s THR 3043N -3.12 3.24 0.44 -5.08 -4.23 -1.24 -4.80 115.64 100.85 2du8 s THR 3043Ca 0.40 -1.32 0.10 0.00 -1.18 0.00 0.00 61.69 59.69 2du8 s THR 3043Cb 0.37 -3.13 0.26 0.00 1.34 0.00 0.00 72.50 71.34 2du8 s THR 3043CO -0.00 -0.11 2.08 0.74 -0.54 0.00 0.00 174.62 176.79 2du8 h THR 3044N 1.12 1.08 -0.68 3.99 2.02 -1.95 -2.20 112.91 116.30 2du8 h THR 3044Ca -0.43 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 2du8 h THR 3044Cb 1.26 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 2du8 h THR 3044CO 0.57 0.08 0.43 0.74 0.37 0.00 0.00 175.52 177.71 2du8 h THR 3045N 0.37 1.19 -0.61 3.16 2.02 -1.95 -1.80 112.91 115.29 2du8 h THR 3045Ca 0.10 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2du8 h THR 3045Cb -0.02 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.57 2du8 h THR 3045CO -0.02 0.19 0.39 0.44 0.37 0.00 0.00 175.52 176.89 2du8 h ASP 3046N 0.94 0.71 1.56 4.18 5.19 -1.67 -2.85 116.42 124.48 2du8 h ASP 3046Ca 0.25 -0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.61 2du8 h ASP 3046Cb -0.06 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.27 2du8 h ASP 3046CO -0.05 0.53 -0.12 0.58 -3.12 0.00 0.00 179.24 177.06 2du8 h VAL 3047N 0.83 0.23 -3.83 -1.35 2.07 -1.38 -3.40 116.25 109.40 2du8 h VAL 3047Ca 0.22 -1.13 -0.51 0.00 0.82 0.00 0.00 66.70 66.10 2du8 h VAL 3047Cb -0.07 1.94 0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2du8 h VAL 3047CO -0.05 0.12 0.53 0.00 0.02 0.00 0.00 177.57 178.19 2du8 s ALA 3048N -3.32 3.43 0.24 1.67 0.00 -1.07 -4.94 121.76 117.77 2du8 s ALA 3048Ca 0.04 1.02 0.04 0.00 0.00 0.00 0.00 51.96 53.06 2du8 s ALA 3048Cb 0.07 -3.38 0.26 0.00 0.00 0.00 0.00 23.12 20.07 2du8 s ALA 3048CO 0.65 -0.32 1.57 0.00 0.00 0.00 0.00 175.76 177.66 2du8 h ALA 3049N 3.64 0.86 0.00 0.00 0.00 -1.87 -3.37 119.26 118.53 2du8 h ALA 3049Ca -0.47 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 53.92 2du8 h ALA 3049Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2du8 h ALA 3049CO 0.66 0.70 0.00 0.41 0.00 0.00 0.00 179.25 181.02 2du8 n GLY 3050N 0.19 0.93 3.73 0.00 0.00 -1.26 -4.18 105.19 104.60 2du8 n GLY 3050Ca -0.02 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2du8 n GLY 3050CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2du8 s LEU 3051N 0.00 4.39 -0.42 0.99 2.96 -1.26 0.06 118.68 125.39 2du8 s LEU 3051Ca 0.00 2.47 -0.29 0.00 -0.22 0.00 0.00 54.13 56.09 2du8 s LEU 3051Cb 0.00 -3.60 0.02 0.00 0.50 0.00 0.00 46.19 43.11 2du8 s LEU 3051CO 0.00 -0.66 1.16 0.86 -1.32 0.00 0.00 176.35 176.39 2du8 s TRP 3052N 0.59 2.85 -0.30 5.38 -0.00 0.40 -4.72 118.94 123.14 2du8 s TRP 3052Ca 0.62 0.84 -0.12 0.00 -0.00 0.00 0.00 56.10 57.44 2du8 s TRP 3052Cb -0.39 -4.21 0.18 0.00 -0.00 0.00 0.00 33.47 29.05 2du8 s TRP 3052CO 0.36 -1.25 0.97 -1.14 -0.00 0.00 0.00 176.95 175.89 2du8 s GLN 3053N 4.29 0.26 0.92 5.86 0.74 -1.26 -4.61 119.66 125.86 2du8 s GLN 3053Ca 0.49 0.51 -0.12 0.00 0.05 0.00 0.00 55.36 56.29 2du8 s GLN 3053Cb -0.10 0.29 0.14 0.00 1.10 0.00 0.00 33.01 34.44 2du8 s GLN 3053CO 0.27 -0.24 1.10 -2.14 -0.55 0.00 0.00 175.29 173.73 2du8 s PRO 3054N 2.82 1.10 0.89 1.67 0.02 -1.26 -4.92 135.00 135.33 2du8 s PRO 3054Ca 0.02 0.63 -0.13 0.00 0.02 0.00 0.00 61.00 61.54 2du8 s PRO 3054Cb -0.10 -1.81 0.06 0.00 0.02 0.00 0.00 34.50 32.68 2du8 s PRO 3054CO -0.14 -2.30 0.74 0.66 -0.33 0.00 0.00 177.00 175.63 2du8 n TYR 3055N -3.89 -0.35 0.29 6.54 4.01 -1.26 -4.94 117.16 117.55 2du8 n TYR 3055Ca 0.06 0.32 -0.14 0.00 -0.16 0.00 0.00 57.90 57.98 2du8 n TYR 3055Cb 0.57 -1.91 -0.07 0.00 -0.31 0.00 0.00 39.34 37.62 2du8 n TYR 3055CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2du8 h LEU 3056N -1.41 -0.65-10.23 7.72 7.12 -2.03 -3.46 115.31 112.38 2du8 h LEU 3056Ca -0.44 -0.03 -0.45 0.00 0.13 0.00 0.00 57.88 57.09 2du8 h LEU 3056Cb 1.29 0.17 0.19 0.00 -0.53 0.00 0.00 40.66 41.78 2du8 h LEU 3056CO 0.39 -0.27 0.10 -0.94 -0.13 0.00 0.00 178.44 177.58 2du8 s SER 3057N -4.67 1.77 0.36 1.25 1.04 -1.26 -4.56 113.70 107.63 2du8 s SER 3057Ca -0.14 1.47 -0.26 0.00 0.48 0.00 0.00 55.95 57.50 2du8 s SER 3057Cb 0.02 -2.18 -0.09 0.00 0.10 0.00 0.00 66.02 63.86 2du8 s SER 3057CO 0.45 -3.70 1.11 -0.62 0.98 0.00 0.00 173.24 171.45 2du8 s ASP 3058N -2.87 6.82 0.31 7.02 2.15 -1.26 -4.95 116.67 123.89 2du8 s ASP 3058Ca 0.67 2.22 -0.29 0.00 0.43 0.00 0.00 52.55 55.59 2du8 s ASP 3058Cb -0.22 -2.61 -0.10 0.00 -0.30 0.00 0.00 42.92 39.69 2du8 s ASP 3058CO 0.61 -0.46 1.18 -2.16 -0.17 0.00 0.00 175.17 174.18 2du8 s PRO 3059N -2.11 4.49 0.20 4.34 0.04 -1.26 -4.93 135.00 135.77 2du8 s PRO 3059Ca 0.54 1.96 -0.10 0.00 0.04 0.00 0.00 61.00 63.44 2du8 s PRO 3059Cb -0.28 -3.11 0.23 0.00 0.04 0.00 0.00 34.50 31.39 2du8 s PRO 3059CO 0.36 0.02 1.78 -0.97 0.04 0.00 0.00 177.00 178.23 2du8 h ASN 3060N 3.56 0.40 -3.57 6.66 -0.00 -1.94 -3.37 115.58 117.32 2du8 h ASN 3060Ca -0.48 0.05 -0.67 0.00 -0.00 0.00 0.00 56.30 55.20 2du8 h ASN 3060Cb 1.22 -0.02 -0.26 0.00 -0.00 0.00 0.00 38.32 39.26 2du8 h ASN 3060CO 0.66 0.25 -0.64 0.21 -0.00 0.00 0.00 177.43 177.91 2du8 s ASN 3061N -5.50 4.95 0.55 1.15 2.47 -1.26 -5.01 114.94 112.30 2du8 s ASN 3061Ca -0.13 -0.51 0.37 0.00 0.42 0.00 0.00 52.86 53.01 2du8 s ASN 3061Cb 0.16 -1.86 1.84 0.00 -1.45 0.00 0.00 41.25 39.94 2du8 s ASN 3061CO 0.75 -0.11 2.11 1.55 -3.72 0.00 0.00 177.10 177.68 2du8 h PRO 3062N 8.21 0.00 -0.56 0.43 0.13 -2.00 -2.09 132.00 136.10 2du8 h PRO 3062Ca -0.35 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.77 2du8 h PRO 3062Cb 1.15 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 2du8 h PRO 3062CO 0.60 0.00 0.33 1.96 -0.23 0.00 0.00 178.00 180.65 2du8 h GLN 3063N 0.00 0.76 -0.92 0.86 4.20 -1.94 -2.53 115.11 115.54 2du8 h GLN 3063Ca 0.00 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.67 2du8 h GLN 3063Cb 0.18 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 2du8 h GLN 3063CO 0.00 0.55 0.60 0.93 -0.67 0.00 0.00 178.83 180.24 2du8 h GLU 3064N 0.78 1.16 -0.75 1.46 5.08 -1.79 -0.76 114.58 119.76 2du8 h GLU 3064Ca 0.20 -0.07 0.12 0.00 -1.00 0.00 0.00 59.36 58.62 2du8 h GLU 3064Cb -0.01 -0.26 -0.09 0.00 0.50 0.00 0.00 28.75 28.89 2du8 h GLU 3064CO -0.04 0.77 0.34 0.00 -1.00 0.00 0.00 179.01 179.08 2du8 h ALA 3065N 1.36 1.06 -0.43 3.43 0.00 -1.59 -2.03 119.26 121.05 2du8 h ALA 3065Ca 0.35 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.25 2du8 h ALA 3065Cb -0.06 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2du8 h ALA 3065CO -0.10 -0.13 -0.13 -0.44 0.00 0.00 0.00 179.25 178.45 2du8 h ASP 3066N 0.53 0.86 -0.34 0.00 3.32 -1.21 -2.56 116.42 117.03 2du8 h ASP 3066Ca 0.40 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2du8 h ASP 3066Cb 0.53 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 2du8 h ASP 3066CO -0.34 1.04 0.12 -0.50 -1.72 0.00 0.00 179.24 177.84 2du8 h TRP 3067N 0.68 0.58 -0.20 4.55 6.55 -0.62 0.07 115.95 127.55 2du8 h TRP 3067Ca 0.11 -0.03 -0.08 0.00 0.95 0.00 0.00 58.89 59.84 2du8 h TRP 3067Cb 0.68 -0.18 -0.00 0.00 -0.86 0.00 0.00 29.16 28.79 2du8 h TRP 3067CO 0.05 0.49 -0.18 0.77 -1.05 0.00 0.00 178.44 178.52 2du8 h SER 3068N 0.57 0.50 -0.70 -3.49 0.02 -1.27 -1.45 113.55 107.73 2du8 h SER 3068Ca 0.14 -0.47 0.07 0.00 -0.84 0.00 0.00 61.79 60.69 2du8 h SER 3068Cb 0.18 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 2du8 h SER 3068CO -0.01 0.86 0.39 -0.61 -1.14 0.00 0.00 176.83 176.32 2du8 h GLN 3069N 0.15 0.68 -0.48 3.45 5.75 -1.02 -1.49 115.11 122.16 2du8 h GLN 3069Ca 0.03 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 2du8 h GLN 3069Cb 0.71 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 2du8 h GLN 3069CO 0.05 0.45 0.14 1.96 -2.65 0.00 0.00 178.83 178.78 2du8 h GLN 3070N 0.70 0.75 -0.77 1.69 4.20 -0.83 -1.82 115.11 119.04 2du8 h GLN 3070Ca 0.32 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.86 2du8 h GLN 3070Cb 0.22 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 2du8 h GLN 3070CO -0.20 0.72 0.48 1.15 -0.67 0.00 0.00 178.83 180.31 2du8 h THR 3071N 0.65 1.21 -0.05 -0.54 2.02 -0.74 -1.24 112.91 114.21 2du8 h THR 3071Ca 0.15 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 2du8 h THR 3071Cb 0.29 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2du8 h THR 3071CO -0.00 0.21 -0.19 0.15 0.37 0.00 0.00 175.52 176.06 2du8 h PHE 3072N 1.05 0.29 -0.52 3.16 3.57 -1.00 -2.43 116.94 121.06 2du8 h PHE 3072Ca 0.28 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.71 2du8 h PHE 3072Cb -0.08 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 2du8 h PHE 3072CO 0.00 0.82 0.25 -0.44 -2.23 0.00 0.00 178.31 176.71 2du8 h ASP 3073N -0.32 0.35 -0.68 0.41 3.32 -1.23 0.25 116.42 118.51 2du8 h ASP 3073Ca -0.01 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.12 2du8 h ASP 3073Cb 0.83 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.30 2du8 h ASP 3073CO 0.04 0.24 0.40 0.22 -1.72 0.00 0.00 179.24 178.42 2du8 h TYR 3074N 0.49 0.75 -0.07 4.55 3.20 -1.18 -1.89 116.97 122.82 2du8 h TYR 3074Ca 0.23 0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.90 2du8 h TYR 3074Cb 0.16 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.21 2du8 h TYR 3074CO -0.11 0.39 -0.82 -0.07 -1.64 0.00 0.00 178.16 175.91 2du8 h LEU 3075N 0.77 0.84 -2.40 2.82 3.38 -1.06 -3.09 115.31 116.56 2du8 h LEU 3075Ca 0.29 -0.69 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 2du8 h LEU 3075Cb 0.11 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 2du8 h LEU 3075CO -0.15 1.41 -0.01 0.25 0.09 0.00 0.00 178.44 180.04 2du8 h LEU 3076N 0.34 0.00 -0.09 1.67 5.85 -0.24 -1.24 115.31 121.60 2du8 h LEU 3076Ca -0.08 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2du8 h LEU 3076Cb 1.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.51 2du8 h LEU 3076CO 0.17 0.01 -0.18 -1.54 -0.34 0.00 0.00 178.44 176.55 2du8 n SER 3077N -3.91 0.32 -0.08 1.25 3.41 -0.73 -3.54 113.62 110.34 2du8 n SER 3077Ca -0.03 -0.13 0.01 0.00 -0.26 0.00 0.00 58.87 58.46 2du8 n SER 3077Cb 0.09 -0.13 0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2du8 n SER 3077CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2du8 n HIS 3078N -1.28 0.05 0.22 7.33 8.25 -0.53 -4.72 115.22 124.53 2du8 n HIS 3078Ca 0.10 -0.47 0.06 0.00 -0.26 0.00 0.00 57.72 57.15 2du8 n HIS 3078Cb 0.31 -0.04 0.49 0.00 1.12 0.00 0.00 29.99 31.87 2du8 n HIS 3078CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2du8 h VAL 3079N 0.25 1.03 -0.30 1.59 3.04 -1.43 -3.00 116.25 117.41 2du8 h VAL 3079Ca 0.00 -0.93 0.00 0.00 -1.01 0.00 0.00 66.70 64.76 2du8 h VAL 3079Cb 0.50 1.52 0.00 0.00 -2.01 0.00 0.00 31.29 31.30 2du8 h VAL 3079CO 0.00 0.25 0.00 1.41 -1.01 0.00 0.00 177.57 178.22 2du8 n HIS 3080N -4.00 1.11 -2.52 3.17 8.25 -1.26 -4.78 115.22 115.19 2du8 n HIS 3080Ca -0.02 -0.86 -0.22 0.00 -0.26 0.00 0.00 57.72 56.36 2du8 n HIS 3080Cb 0.33 -0.34 0.05 0.00 1.12 0.00 0.00 29.99 31.14 2du8 n HIS 3080CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2du8 s SER 3081N -1.78 5.07 0.46 0.41 1.04 -1.13 -4.98 113.70 112.78 2du8 s SER 3081Ca 0.44 0.08 0.30 0.00 0.48 0.00 0.00 55.95 57.24 2du8 s SER 3081Cb 0.35 -0.86 1.08 0.00 0.10 0.00 0.00 66.02 66.69 2du8 s SER 3081CO 0.10 -1.33 1.86 1.55 0.98 0.00 0.00 173.24 176.40 2du8 h PRO 3082N -0.16 0.00 -0.39 4.02 0.13 -1.94 -3.10 132.00 130.56 2du8 h PRO 3082Ca -0.42 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.64 2du8 h PRO 3082Cb 1.30 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2du8 h PRO 3082CO 0.53 0.00 -0.03 -0.91 -0.23 0.00 0.00 178.00 177.36 2du8 h ASN 3083N 0.00 0.61 -0.91 1.44 4.21 -1.94 -3.35 115.58 115.64 2du8 h ASN 3083Ca 0.00 -0.14 0.24 0.00 1.21 0.00 0.00 56.30 57.61 2du8 h ASN 3083Cb 0.59 -0.16 -0.17 0.00 -1.12 0.00 0.00 38.32 37.46 2du8 h ASN 3083CO 0.00 0.70 -0.00 0.00 -1.29 0.00 0.00 177.43 176.84 2du8 n ALA 3084N -2.48 0.44 0.17 -0.83 0.00 -1.17 0.17 120.51 116.82 2du8 n ALA 3084Ca 0.02 0.98 -0.14 0.00 0.00 0.00 0.00 53.44 54.29 2du8 n ALA 3084Cb 0.29 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 18.97 2du8 n ALA 3084CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2du8 h GLU 3085N 0.00 -0.40 -0.24 0.00 4.81 -1.79 0.14 114.58 117.10 2du8 h GLU 3085Ca 0.54 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.87 2du8 h GLU 3085Cb 1.10 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2du8 h GLU 3085CO -0.86 -0.27 0.17 -0.91 -0.73 0.00 0.00 179.01 176.42 2du8 h ASN 3086N -0.42 0.00 1.17 1.04 2.35 -0.51 -1.12 115.58 118.10 2du8 h ASN 3086Ca -0.02 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.57 2du8 h ASN 3086Cb 0.35 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 2du8 h ASN 3086CO 0.02 0.00 -0.74 -0.07 -1.65 0.00 0.00 177.43 174.99 2du8 h LEU 3087N 0.00 0.00 -0.49 1.61 4.07 -0.97 -3.41 115.31 116.12 2du8 h LEU 3087Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2du8 h LEU 3087Cb 0.46 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.20 2du8 h LEU 3087CO -0.00 0.74 0.00 0.61 -1.08 0.00 0.00 178.44 178.71 2du8 n GLY 3088N 1.17 0.82 3.48 0.83 0.00 -0.34 -2.00 105.19 109.15 2du8 n GLY 3088Ca 0.01 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 2du8 n GLY 3088CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2du8 s LEU 3089N -0.49 3.30 0.19 0.99 0.20 0.36 -2.25 118.68 120.98 2du8 s LEU 3089Ca 0.00 -0.15 -0.22 0.00 0.69 0.00 0.00 54.13 54.45 2du8 s LEU 3089Cb 0.00 -1.82 0.05 0.00 -0.43 0.00 0.00 46.19 43.99 2du8 s LEU 3089CO 0.00 0.11 0.62 0.72 -0.29 0.00 0.00 176.35 177.51 2du8 s PHE 3090N 0.73 -0.41 0.25 5.38 -0.71 -1.01 -4.50 117.98 117.72 2du8 s PHE 3090Ca -0.00 0.12 -0.09 0.00 -1.04 0.00 0.00 56.93 55.92 2du8 s PHE 3090Cb -0.14 0.58 -0.07 0.00 -1.21 0.00 0.00 43.02 42.18 2du8 s PHE 3090CO 0.02 -0.95 0.56 -0.51 -1.34 0.00 0.00 175.22 173.00 2du8 s LEU 3091N -2.81 4.13 -0.27 -1.99 1.43 -1.26 -1.35 118.68 116.56 2du8 s LEU 3091Ca 0.04 0.90 -0.23 0.00 -1.03 0.00 0.00 54.13 53.81 2du8 s LEU 3091Cb -0.02 -3.68 0.07 0.00 0.03 0.00 0.00 46.19 42.59 2du8 s LEU 3091CO -0.07 -0.11 0.73 -0.51 0.23 0.00 0.00 176.35 176.62 2du8 s ILE 3092N -1.89 0.00 0.26 -0.59 2.07 -1.00 -4.93 121.20 115.12 2du8 s ILE 3092Ca 0.47 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.79 2du8 s ILE 3092Cb -0.11 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.44 2du8 s ILE 3092CO 0.23 0.00 0.11 -0.44 -1.91 0.00 0.00 174.94 172.94 2du8 s SER 3093N 0.61 5.08 0.00 4.50 0.01 -1.26 -0.18 113.70 122.47 2du8 s SER 3093Ca -0.02 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.80 2du8 s SER 3093Cb -0.05 -1.14 0.00 0.00 0.21 0.00 0.00 66.02 65.04 2du8 s SER 3093CO -0.03 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.19 2du8 n GLY 3094N -1.07 -0.10 3.78 3.44 0.00 -0.74 -2.18 105.19 108.31 2du8 n GLY 3094Ca -0.07 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.70 2du8 n GLY 3094CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2du8 s TYR 3095N -2.00 3.27 -0.19 1.61 1.51 0.18 -2.99 117.35 118.75 2du8 s TYR 3095Ca 0.00 0.19 0.00 0.00 -1.01 0.00 0.00 57.07 56.26 2du8 s TYR 3095Cb 0.00 -1.73 0.02 0.00 -0.11 0.00 0.00 41.96 40.14 2du8 s TYR 3095CO 0.00 0.55 -0.18 -0.80 -1.11 0.00 0.00 175.55 174.01 2du8 s ASN 3096N -1.79 3.30 -0.00 2.29 0.01 -0.94 -0.71 114.94 117.11 2du8 s ASN 3096Ca 0.23 -0.61 0.04 0.00 -0.71 0.00 0.00 52.86 51.82 2du8 s ASN 3096Cb -0.12 -1.52 -0.03 0.00 0.41 0.00 0.00 41.25 39.99 2du8 s ASN 3096CO 0.15 -0.00 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.86 2du8 s LEU 3097N 1.31 2.92 0.07 0.60 1.43 0.41 -1.30 118.68 124.12 2du8 s LEU 3097Ca 0.05 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 2du8 s LEU 3097Cb -0.13 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2du8 s LEU 3097CO -0.11 0.29 -0.07 -0.36 0.23 0.00 0.00 176.35 176.33 2du8 s PHE 3098N -0.91 0.78 0.21 0.29 0.08 0.13 -1.25 117.98 117.31 2du8 s PHE 3098Ca 0.15 -0.70 0.02 0.00 0.12 0.00 0.00 56.93 56.52 2du8 s PHE 3098Cb -0.11 -0.46 0.16 0.00 -0.57 0.00 0.00 43.02 42.04 2du8 s PHE 3098CO 0.05 -0.12 1.50 0.45 -0.10 0.00 0.00 175.22 177.00 2du8 h HIS 3099N 3.76 0.38 -4.56 0.36 3.86 -1.82 -1.17 115.15 115.96 2du8 h HIS 3099Ca -0.36 -0.16 -0.24 0.00 -1.16 0.00 0.00 60.37 58.45 2du8 h HIS 3099Cb 1.18 -0.06 -0.15 0.00 1.06 0.00 0.00 27.41 29.44 2du8 h HIS 3099CO 0.62 0.87 -0.59 -1.21 0.86 0.00 0.00 177.93 178.48 2du8 s GLU 3100N -3.65 1.23 0.62 2.45 0.41 -1.26 -3.81 118.70 114.69 2du8 s GLU 3100Ca -0.04 -1.63 -0.18 0.00 -0.41 0.00 0.00 54.97 52.70 2du8 s GLU 3100Cb 0.11 0.28 -0.03 0.00 -1.78 0.00 0.00 34.13 32.71 2du8 s GLU 3100CO 0.81 -0.41 1.14 0.00 -0.49 0.00 0.00 175.26 176.32 2du8 n ALA 3101N -0.29 0.73 -3.19 5.21 0.00 -1.26 -4.69 120.51 117.01 2du8 n ALA 3101Ca 0.02 0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.34 2du8 n ALA 3101Cb 0.66 -2.23 -0.07 0.00 0.00 0.00 0.00 19.45 17.81 2du8 n ALA 3101CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2du8 s ILE 3102N -1.44 0.05 0.70 0.00 1.10 -1.26 -5.15 121.20 115.21 2du8 s ILE 3102Ca 0.79 -0.43 -0.14 0.00 -0.51 0.00 0.00 60.65 60.35 2du8 s ILE 3102Cb -0.40 -0.90 0.02 0.00 0.15 0.00 0.00 42.46 41.33 2du8 s ILE 3102CO 0.44 -0.24 1.12 -2.16 -2.11 0.00 0.00 174.94 172.00 2du8 s PRO 3103N -2.20 2.54 0.58 3.50 0.04 -1.26 -4.99 135.00 133.21 2du8 s PRO 3103Ca -0.07 1.42 -0.18 0.00 0.04 0.00 0.00 61.00 62.21 2du8 s PRO 3103Cb -0.01 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 2du8 s PRO 3103CO -0.00 -1.46 1.14 -0.51 0.04 0.00 0.00 177.00 176.21 2du8 s ASP 3104N -2.62 5.43 0.54 6.66 1.11 -1.26 -5.00 116.67 121.53 2du8 s ASP 3104Ca 0.67 2.19 -0.16 0.00 0.18 0.00 0.00 52.55 55.42 2du8 s ASP 3104Cb -0.21 -2.58 -0.07 0.00 1.07 0.00 0.00 42.92 41.13 2du8 s ASP 3104CO 0.45 -1.42 1.01 -2.16 1.18 0.00 0.00 175.17 174.23 2du8 s PRO 3105N -3.49 3.74 0.39 8.23 0.04 -1.26 -4.95 135.00 137.69 2du8 s PRO 3105Ca 0.72 1.05 0.05 0.00 0.04 0.00 0.00 61.00 62.87 2du8 s PRO 3105Cb -0.25 -2.10 0.77 0.00 0.04 0.00 0.00 34.50 32.97 2du8 s PRO 3105CO 0.32 -0.45 2.04 0.66 0.04 0.00 0.00 177.00 179.61 2du8 h SER 3106N 0.79 0.57 -0.07 6.66 4.64 -1.93 -2.58 113.55 121.63 2du8 h SER 3106Ca -0.47 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2du8 h SER 3106Cb 1.20 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2du8 h SER 3106CO 0.60 0.41 0.00 -2.67 -0.87 0.00 0.00 176.83 174.30 2du8 n TRP 3107N -4.46 0.11 0.02 4.77 4.27 -1.26 -4.39 117.44 116.50 2du8 n TRP 3107Ca 0.04 -0.05 0.20 0.00 -3.89 0.00 0.00 57.50 53.80 2du8 n TRP 3107Cb 0.05 -0.01 0.70 0.00 -1.36 0.00 0.00 31.31 30.69 2du8 n TRP 3107CO 0.00 0.00 0.00 1.57 -2.29 0.00 0.00 177.69 176.97 2du8 h LYS 3108N 0.44 0.00 0.00 -2.67 2.10 -1.85 -1.09 116.57 113.51 2du8 h LYS 3108Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2du8 h LYS 3108Cb 0.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.49 2du8 h LYS 3108CO 0.01 0.00 -1.06 -0.25 -2.00 0.00 0.00 179.45 176.14 2du8 n ASP 3109N -4.30 0.61 -0.11 7.07 8.00 -1.26 -4.07 116.55 122.50 2du8 n ASP 3109Ca 0.09 -0.29 -0.13 0.00 0.71 0.00 0.00 54.79 55.17 2du8 n ASP 3109Cb 0.59 0.87 -0.03 0.00 -0.02 0.00 0.00 41.12 42.52 2du8 n ASP 3109CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2du8 h THR 3110N 0.00 1.29 -4.09 -3.53 2.02 -1.50 -3.46 112.91 103.64 2du8 h THR 3110Ca 0.00 -1.50 -0.50 0.00 0.77 0.00 0.00 66.41 65.19 2du8 h THR 3110Cb 0.71 1.47 0.06 0.00 -1.74 0.00 0.00 68.15 68.65 2du8 h THR 3110CO 0.00 0.49 0.31 0.68 0.37 0.00 0.00 175.52 177.37 2du8 s VAL 3111N -4.39 4.31 0.05 3.16 -7.23 -1.16 -4.98 120.40 110.16 2du8 s VAL 3111Ca -0.12 0.49 -0.26 0.00 -1.81 0.00 0.00 61.98 60.28 2du8 s VAL 3111Cb 0.10 -3.71 -0.05 0.00 0.56 0.00 0.00 36.38 33.27 2du8 s VAL 3111CO 0.86 -0.85 0.79 -0.76 -0.31 0.00 0.00 175.10 174.82 2du8 s LEU 3112N -5.09 4.45 -1.51 1.32 2.01 -0.84 -4.36 118.68 114.66 2du8 s LEU 3112Ca 0.54 1.49 -0.13 0.00 0.01 0.00 0.00 54.13 56.03 2du8 s LEU 3112Cb -0.11 -3.27 0.08 0.00 0.01 0.00 0.00 46.19 42.90 2du8 s LEU 3112CO 0.50 0.01 0.92 0.61 1.01 0.00 0.00 176.35 179.39 2du8 n GLY 3113N 2.37 -0.50 3.71 -3.19 0.00 -1.26 -1.76 105.19 104.57 2du8 n GLY 3113Ca -0.02 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2du8 n GLY 3113CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2du8 n PHE 3114N -4.61 2.49 -3.83 1.61 -0.00 -1.26 -4.61 117.46 107.26 2du8 n PHE 3114Ca 0.03 0.45 -0.07 0.00 -0.00 0.00 0.00 57.45 57.86 2du8 n PHE 3114Cb 0.53 -2.48 0.02 0.00 -0.00 0.00 0.00 39.48 37.55 2du8 n PHE 3114CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 2du8 s ARG 3115N -1.32 1.97 0.21 -4.13 1.04 -0.83 -5.02 118.95 110.86 2du8 s ARG 3115Ca 0.59 -1.26 -0.01 0.00 -1.04 0.00 0.00 55.73 54.01 2du8 s ARG 3115Cb -0.56 0.55 -0.04 0.00 -2.04 0.00 0.00 34.95 32.86 2du8 s ARG 3115CO 0.57 -0.92 0.41 0.15 -0.04 0.00 0.00 175.30 175.47 2du8 s LYS 3116N -2.28 3.54 0.26 3.89 -0.14 -1.26 -1.24 119.74 122.51 2du8 s LYS 3116Ca 0.17 -0.28 -0.30 0.00 -1.36 0.00 0.00 55.97 54.20 2du8 s LYS 3116Cb -0.04 -2.82 -0.10 0.00 -1.68 0.00 0.00 37.83 33.19 2du8 s LYS 3116CO 0.10 0.39 1.34 -0.51 -0.76 0.00 0.00 175.35 175.91 2du8 s LEU 3117N -3.30 4.41 0.57 3.17 1.43 0.63 -4.76 118.68 120.84 2du8 s LEU 3117Ca 0.39 2.58 -0.15 0.00 -1.03 0.00 0.00 54.13 55.92 2du8 s LEU 3117Cb -0.11 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.43 2du8 s LEU 3117CO 0.29 -0.57 1.02 0.42 0.23 0.00 0.00 176.35 177.74 2du8 s THR 3118N -0.38 4.26 0.65 5.49 -4.23 -1.26 -4.85 115.64 115.31 2du8 s THR 3118Ca 0.55 1.01 0.32 0.00 -1.18 0.00 0.00 61.69 62.38 2du8 s THR 3118Cb -0.39 -3.59 0.34 0.00 1.34 0.00 0.00 72.50 70.19 2du8 s THR 3118CO 0.45 -0.69 2.00 1.55 -0.54 0.00 0.00 174.62 177.39 2du8 h PRO 3119N 0.49 0.00 -0.10 3.99 0.13 -2.00 -1.66 132.00 132.85 2du8 h PRO 3119Ca -0.46 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.45 2du8 h PRO 3119Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2du8 h PRO 3119CO 0.60 0.00 -0.81 0.00 -0.23 0.00 0.00 178.00 177.56 2du8 h ARG 3120N 0.00 0.61 -0.20 0.86 3.08 -2.01 -3.10 114.38 113.62 2du8 h ARG 3120Ca 0.04 -0.53 -0.18 0.00 0.07 0.00 0.00 59.98 59.38 2du8 h ARG 3120Cb 0.62 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.79 2du8 h ARG 3120CO -0.00 1.15 -0.59 0.93 -1.07 0.00 0.00 179.97 180.39 2du8 h GLU 3121N 0.40 0.67 0.00 0.04 5.08 -1.69 -3.19 114.58 115.89 2du8 h GLU 3121Ca -0.06 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 2du8 h GLU 3121Cb 1.42 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 2du8 h GLU 3121CO 0.15 1.06 -0.11 -0.07 -1.00 0.00 0.00 179.01 179.05 2du8 h LEU 3122N 0.50 0.00 -1.34 1.33 3.38 -1.53 -2.62 115.31 115.04 2du8 h LEU 3122Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2du8 h LEU 3122Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2du8 h LEU 3122CO 0.12 0.11 -0.29 0.44 0.09 0.00 0.00 178.44 178.90 2du8 h ASP 3123N 0.00 0.00 0.46 -0.43 3.32 -1.52 -2.39 116.42 115.86 2du8 h ASP 3123Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2du8 h ASP 3123Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2du8 h ASP 3123CO 0.01 0.29 0.00 0.24 -1.72 0.00 0.00 179.24 178.07 2du8 h MET 3124N 0.00 0.00 -3.02 3.56 2.86 -1.60 -3.35 114.93 113.37 2du8 h MET 3124Ca -0.00 0.00 -0.62 0.00 -2.06 0.00 0.00 59.70 57.02 2du8 h MET 3124Cb 0.64 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 31.90 2du8 h MET 3124CO 0.04 0.00 -0.69 -0.06 1.06 0.00 0.00 176.91 177.26 2du8 s PHE 3125N -3.75 2.69 0.43 -0.22 0.08 -0.90 -4.99 117.98 111.33 2du8 s PHE 3125Ca -0.01 -2.90 0.16 0.00 0.12 0.00 0.00 56.93 54.29 2du8 s PHE 3125Cb 0.10 -2.25 1.06 0.00 -0.57 0.00 0.00 43.02 41.36 2du8 s PHE 3125CO 0.41 -0.69 1.94 -1.35 -0.10 0.00 0.00 175.22 175.43 2du8 h PRO 3126N 6.05 0.39 -0.00 0.24 0.11 -1.73 -2.70 132.00 134.35 2du8 h PRO 3126Ca 0.07 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2du8 h PRO 3126Cb 0.85 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2du8 h PRO 3126CO 0.60 0.26 -0.01 -0.25 -0.21 0.00 0.00 178.00 178.38 2du8 n ASP 3127N -4.47 0.04 -4.29 -2.05 9.92 -1.26 -4.85 116.55 109.59 2du8 n ASP 3127Ca 0.13 -0.22 -0.20 0.00 -0.53 0.00 0.00 54.79 53.97 2du8 n ASP 3127Cb 0.49 -0.25 -0.11 0.00 -0.64 0.00 0.00 41.12 40.61 2du8 n ASP 3127CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2du8 s TYR 3128N -2.54 1.64 -0.04 1.24 1.51 -1.02 -4.81 117.35 113.34 2du8 s TYR 3128Ca 0.29 -0.51 0.02 0.00 -1.01 0.00 0.00 57.07 55.86 2du8 s TYR 3128Cb 0.20 -0.84 -0.02 0.00 -0.11 0.00 0.00 41.96 41.19 2du8 s TYR 3128CO 0.46 0.25 0.05 0.41 -1.11 0.00 0.00 175.55 175.61 2du8 n GLY 3129N 0.41 0.36 3.14 0.71 0.00 -0.54 -4.93 105.19 104.34 2du8 n GLY 3129Ca -0.14 -0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 2du8 n GLY 3129CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2du8 s TYR 3130N -1.66 0.04 0.00 1.61 5.04 -0.62 -4.95 117.35 116.81 2du8 s TYR 3130Ca -0.00 -0.18 0.00 0.00 -2.44 0.00 0.00 57.07 54.45 2du8 s TYR 3130Cb 0.01 -0.04 0.00 0.00 0.35 0.00 0.00 41.96 42.28 2du8 s TYR 3130CO 0.07 -0.35 0.00 0.41 -1.34 0.00 0.00 175.55 174.34 2du8 n GLY 3131N 1.12 -0.58 3.62 8.97 0.00 -1.26 0.22 105.19 117.28 2du8 n GLY 3131Ca -0.21 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.55 2du8 n GLY 3131CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2du8 s TRP 3132N -2.00 2.53 -0.02 1.61 0.51 -0.42 -0.27 118.94 120.88 2du8 s TRP 3132Ca 0.00 -0.44 0.01 0.00 -2.12 0.00 0.00 56.10 53.55 2du8 s TRP 3132Cb 0.00 -1.45 0.01 0.00 -0.81 0.00 0.00 33.47 31.22 2du8 s TRP 3132CO 0.00 0.50 -0.03 0.12 -0.51 0.00 0.00 176.95 177.03 2du8 s PHE 3133N -2.52 0.46 0.37 -1.98 5.36 -0.37 -2.21 117.98 117.09 2du8 s PHE 3133Ca 0.34 -0.08 -0.14 0.00 -0.96 0.00 0.00 56.93 56.09 2du8 s PHE 3133Cb -0.00 -0.40 0.05 0.00 -0.34 0.00 0.00 43.02 42.34 2du8 s PHE 3133CO 0.19 -0.08 0.74 -2.39 -1.46 0.00 0.00 175.22 172.21 2du8 n HIS 3134N 3.55 -2.27 -4.72 10.12 1.44 -1.16 -1.96 115.22 120.22 2du8 n HIS 3134Ca -0.20 -1.77 -0.33 0.00 -2.01 0.00 0.00 57.72 53.41 2du8 n HIS 3134Cb 0.54 0.87 -0.15 0.00 0.12 0.00 0.00 29.99 31.37 2du8 n HIS 3134CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2du8 s THR 3135N -2.17 2.84 0.00 0.61 2.01 -0.72 -1.79 115.64 116.41 2du8 s THR 3135Ca 0.15 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.43 2du8 s THR 3135Cb -0.05 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.28 2du8 s THR 3135CO 0.12 0.52 0.00 -0.24 -0.69 0.00 0.00 174.62 174.33 2du8 n SER 3136N 3.73 0.83 -4.11 3.53 2.88 0.75 -1.99 113.62 119.25 2du8 n SER 3136Ca -0.18 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.19 2du8 n SER 3136Cb 0.52 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 2du8 n SER 3136CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2du8 s LEU 3137N 0.00 2.24 -0.11 2.46 1.43 -1.26 -2.38 118.68 121.06 2du8 s LEU 3137Ca 0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 2du8 s LEU 3137Cb 0.00 -0.36 0.00 0.00 0.03 0.00 0.00 46.19 45.86 2du8 s LEU 3137CO 0.00 -0.11 -0.23 -0.63 0.23 0.00 0.00 176.35 175.61 2du8 s ILE 3138N -1.20 2.12 -0.45 -0.59 1.01 -0.46 -0.45 121.20 121.19 2du8 s ILE 3138Ca -0.05 -0.99 0.03 0.00 0.00 0.00 0.00 60.65 59.64 2du8 s ILE 3138Cb -0.09 -1.82 0.12 0.00 0.01 0.00 0.00 42.46 40.68 2du8 s ILE 3138CO 0.01 0.55 0.20 -0.22 0.00 0.00 0.00 174.94 175.49 2du8 s LEU 3139N 0.46 3.72 -0.34 2.97 2.96 0.11 -2.41 118.68 126.15 2du8 s LEU 3139Ca -0.16 -2.62 -0.28 0.00 -0.22 0.00 0.00 54.13 50.85 2du8 s LEU 3139Cb -0.17 -1.39 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 2du8 s LEU 3139CO 0.06 -0.28 1.86 -1.61 -1.32 0.00 0.00 176.35 175.06 2du8 s GLU 3140N 0.28 3.24 0.33 1.98 2.02 -0.95 -4.26 118.70 121.34 2du8 s GLU 3140Ca 0.15 1.44 0.11 0.00 0.02 0.00 0.00 54.97 56.69 2du8 s GLU 3140Cb -0.24 -4.24 0.99 0.00 0.10 0.00 0.00 34.13 30.74 2du8 s GLU 3140CO -0.03 -1.97 1.64 0.78 0.02 0.00 0.00 175.26 175.70 2du8 h GLY 3141N 14.12 1.83 0.95 -1.39 0.00 -1.72 -2.19 103.07 114.67 2du8 h GLY 3141Ca -0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2du8 h GLY 3141CO 1.04 -0.50 -0.23 1.70 0.00 0.00 0.00 176.54 178.55 2du8 h LYS 3142N 0.23 -0.59 -0.26 4.80 3.64 -1.78 -1.62 116.57 120.99 2du8 h LYS 3142Ca 0.69 0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.96 2du8 h LYS 3142Cb 1.55 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 33.50 2du8 h LYS 3142CO -0.66 -0.39 -0.42 -0.91 -2.27 0.00 0.00 179.45 174.80 2du8 h ASN 3143N -0.61 0.82 -0.23 4.20 -0.26 -1.69 -3.02 115.58 114.79 2du8 h ASN 3143Ca -0.05 -0.52 0.05 0.00 -0.56 0.00 0.00 56.30 55.22 2du8 h ASN 3143Cb 0.48 -0.23 -0.05 0.00 -1.06 0.00 0.00 38.32 37.46 2du8 h ASN 3143CO 0.07 1.18 -0.10 0.22 -1.06 0.00 0.00 177.43 177.75 2du8 h TYR 3144N 0.48 -0.22 -0.89 1.19 3.20 -0.80 -1.15 116.97 118.77 2du8 h TYR 3144Ca 0.02 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.08 2du8 h TYR 3144Cb 1.01 0.14 -0.10 0.00 1.54 0.00 0.00 36.73 39.32 2du8 h TYR 3144CO 0.08 -0.15 0.47 -0.07 -1.64 0.00 0.00 178.16 176.84 2du8 h LEU 3145N -0.06 0.55 -0.11 2.82 4.07 -1.34 -0.64 115.31 120.60 2du8 h LEU 3145Ca 0.12 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.18 2du8 h LEU 3145Cb 0.24 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 2du8 h LEU 3145CO -0.27 0.20 0.07 -0.61 -1.08 0.00 0.00 178.44 176.75 2du8 h GLN 3146N 0.62 0.14 0.36 1.13 5.75 -1.12 -0.47 115.11 121.51 2du8 h GLN 3146Ca 0.50 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.99 2du8 h GLN 3146Cb 0.76 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.25 2du8 h GLN 3146CO -0.39 0.09 -0.37 2.35 -2.65 0.00 0.00 178.83 177.86 2du8 h TRP 3147N 0.14 -1.01 -0.31 3.99 7.01 -0.69 -2.36 115.95 122.72 2du8 h TRP 3147Ca 0.04 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.12 2du8 h TRP 3147Cb -0.01 0.39 -0.08 0.00 -2.10 0.00 0.00 29.16 27.37 2du8 h TRP 3147CO -0.08 -0.52 -0.21 -0.07 -2.79 0.00 0.00 178.44 174.78 2du8 h LEU 3148N -0.76 -0.69 -0.51 0.65 3.38 -1.02 0.92 115.31 117.28 2du8 h LEU 3148Ca -0.02 0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.18 2du8 h LEU 3148Cb 0.68 0.35 -0.10 0.00 0.09 0.00 0.00 40.66 41.68 2du8 h LEU 3148CO -0.07 -0.24 -0.32 0.74 0.09 0.00 0.00 178.44 178.64 2du8 h THR 3149N -0.18 0.21 0.00 0.22 2.02 -0.98 0.40 112.91 114.60 2du8 h THR 3149Ca 0.16 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.29 2du8 h THR 3149Cb 0.43 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 2du8 h THR 3149CO -0.42 0.00 -0.24 1.05 0.37 0.00 0.00 175.52 176.28 2du8 h GLU 3150N -0.19 0.00 -0.39 6.66 4.11 -0.82 0.28 114.58 124.22 2du8 h GLU 3150Ca 0.21 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.48 2du8 h GLU 3150Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2du8 h GLU 3150CO -0.61 0.24 -0.38 -0.09 0.07 0.00 0.00 179.01 178.24 2du8 h ARG 3151N 0.00 0.94 -0.10 1.06 9.65 0.00 -3.07 114.38 122.86 2du8 h ARG 3151Ca -0.00 -0.49 -0.07 0.00 -1.10 0.00 0.00 59.98 58.31 2du8 h ARG 3151Cb 1.00 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 2du8 h ARG 3151CO 0.03 1.15 -0.23 -0.07 2.80 0.00 0.00 179.97 183.65 2du8 h LEU 3152N 0.77 0.38 -0.58 3.80 4.07 0.51 -3.08 115.31 121.18 2du8 h LEU 3152Ca 0.06 -0.57 0.04 0.00 0.08 0.00 0.00 57.88 57.50 2du8 h LEU 3152Cb 0.97 -0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.56 2du8 h LEU 3152CO 0.09 0.88 0.33 0.74 -1.08 0.00 0.00 178.44 179.40 2du8 h THR 3153N -0.10 1.01 0.00 0.22 2.02 -0.59 -1.35 112.91 114.12 2du8 h THR 3153Ca 0.00 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.96 2du8 h THR 3153Cb 0.82 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2du8 h THR 3153CO 0.05 0.12 0.00 1.05 0.37 0.00 0.00 175.52 177.11 2du8 h GLU 3154N 0.63 0.00 -0.68 6.66 4.11 -1.60 -0.60 114.58 123.11 2du8 h GLU 3154Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.68 2du8 h GLU 3154Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2du8 h GLU 3154CO -0.14 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.48 2du8 n ARG 3155N -2.33 3.36 -0.09 1.06 1.74 -0.54 -4.94 116.66 114.92 2du8 n ARG 3155Ca 0.01 -2.07 0.00 0.00 -0.77 0.00 0.00 57.85 55.03 2du8 n ARG 3155Cb 0.21 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 2du8 n ARG 3155CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2du8 n GLY 3156N 0.60 1.93 3.68 -0.13 0.00 -0.23 -4.99 105.19 106.04 2du8 n GLY 3156Ca 0.18 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 2du8 n GLY 3156CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2du8 n VAL 3157N -2.00 0.34 -4.07 1.61 0.31 -1.04 -4.94 118.33 108.54 2du8 n VAL 3157Ca 0.00 -0.06 -0.34 0.00 -0.01 0.00 0.00 64.34 63.93 2du8 n VAL 3157Cb 0.00 -1.79 -0.07 0.00 -0.91 0.00 0.00 33.84 31.08 2du8 n VAL 3157CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2du8 s LYS 3158N 2.72 3.16 -0.05 5.55 -0.14 -1.15 -4.28 119.74 125.56 2du8 s LYS 3158Ca 0.86 -0.41 0.03 0.00 -1.36 0.00 0.00 55.97 55.09 2du8 s LYS 3158Cb -0.65 -2.93 -0.03 0.00 -1.68 0.00 0.00 37.83 32.54 2du8 s LYS 3158CO 0.44 0.67 -0.11 -0.06 -0.76 0.00 0.00 175.35 175.53 2du8 s PHE 3159N -1.17 2.79 -0.01 3.18 2.99 -1.26 0.02 117.98 124.52 2du8 s PHE 3159Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 56.93 57.07 2du8 s PHE 3159Cb -0.12 -1.65 0.01 0.00 0.00 0.00 0.00 43.02 41.26 2du8 s PHE 3159CO 0.13 0.26 -0.01 -0.06 -0.00 0.00 0.00 175.22 175.54 2du8 s PHE 3160N -0.80 0.20 -0.76 0.36 0.40 0.10 -4.95 117.98 112.53 2du8 s PHE 3160Ca 0.13 0.00 -0.21 0.00 -0.60 0.00 0.00 56.93 56.25 2du8 s PHE 3160Cb -0.11 -0.23 0.10 0.00 0.51 0.00 0.00 43.02 43.29 2du8 s PHE 3160CO 0.02 -0.06 1.01 -1.14 0.70 0.00 0.00 175.22 175.75 2du8 s GLN 3161N 0.46 3.30 0.00 0.44 -0.44 -1.26 -1.66 119.66 120.50 2du8 s GLN 3161Ca -0.04 -1.24 -0.24 0.00 -2.50 0.00 0.00 55.36 51.34 2du8 s GLN 3161Cb -0.07 -4.52 0.05 0.00 -1.64 0.00 0.00 33.01 26.84 2du8 s GLN 3161CO -0.01 -1.78 0.55 -0.98 0.50 0.00 0.00 175.29 173.56 2du8 s ARG 3162N 3.43 0.99 -0.35 1.67 1.70 0.13 -4.95 118.95 121.57 2du8 s ARG 3162Ca 0.26 -0.04 -0.14 0.00 -0.47 0.00 0.00 55.73 55.33 2du8 s ARG 3162Cb -0.13 0.46 -0.01 0.00 -0.57 0.00 0.00 34.95 34.70 2du8 s ARG 3162CO 0.02 -0.33 0.32 0.21 -1.08 0.00 0.00 175.30 174.44 2du8 s LYS 3163N -1.80 3.47 0.06 3.89 2.20 -1.26 -2.75 119.74 123.55 2du8 s LYS 3163Ca -0.09 -0.56 -0.31 0.00 -0.36 0.00 0.00 55.97 54.66 2du8 s LYS 3163Cb -0.01 -3.83 -0.07 0.00 -1.51 0.00 0.00 37.83 32.41 2du8 s LYS 3163CO 0.04 -0.53 1.37 0.08 -0.36 0.00 0.00 175.35 175.95 2du8 s VAL 3164N 1.89 3.56 -0.01 4.02 1.01 -1.26 -4.95 120.40 124.66 2du8 s VAL 3164Ca 0.09 1.06 0.03 0.00 0.00 0.00 0.00 61.98 63.16 2du8 s VAL 3164Cb -0.17 -3.68 -0.25 0.00 0.00 0.00 0.00 36.38 32.28 2du8 s VAL 3164CO 0.11 0.05 0.79 -0.33 0.00 0.00 0.00 175.10 175.72 2du8 h GLU 3165N 7.22 0.14 -2.86 2.72 4.39 -1.97 -3.49 114.58 120.74 2du8 h GLU 3165Ca -0.40 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.05 2du8 h GLU 3165Cb 1.20 0.09 -0.13 0.00 -0.10 0.00 0.00 28.75 29.81 2du8 h GLU 3165CO 0.87 0.92 0.26 -1.54 -1.16 0.00 0.00 179.01 178.35 2du8 s SER 3166N -6.67 -0.54 0.53 1.42 1.04 -1.26 -4.82 113.70 103.40 2du8 s SER 3166Ca -0.08 0.02 0.26 0.00 0.48 0.00 0.00 55.95 56.62 2du8 s SER 3166Cb 0.08 0.56 1.50 0.00 0.10 0.00 0.00 66.02 68.26 2du8 s SER 3166CO 0.83 -0.90 2.13 -0.26 0.98 0.00 0.00 173.24 176.02 2du8 h PHE 3167N 2.03 0.00 -0.02 5.02 0.04 -1.95 -3.02 116.94 119.03 2du8 h PHE 3167Ca -0.32 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.45 2du8 h PHE 3167Cb 1.29 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.44 2du8 h PHE 3167CO 0.24 0.08 0.01 0.93 -0.60 0.00 0.00 178.31 178.97 2du8 h GLU 3168N 0.00 0.04 -0.55 1.51 4.39 -1.95 -2.00 114.58 116.02 2du8 h GLU 3168Ca -0.00 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.77 2du8 h GLU 3168Cb 0.19 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 2du8 h GLU 3168CO 0.01 0.18 0.37 1.49 -1.16 0.00 0.00 179.01 179.89 2du8 h GLU 3169N -0.11 0.39 0.02 2.33 4.81 -1.93 -0.33 114.58 119.76 2du8 h GLU 3169Ca 0.01 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2du8 h GLU 3169Cb 0.15 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2du8 h GLU 3169CO -0.00 0.26 -0.15 0.28 -0.73 0.00 0.00 179.01 178.67 2du8 h VAL 3170N 0.40 1.73 -0.43 0.32 2.07 -1.51 -2.99 116.25 115.84 2du8 h VAL 3170Ca 0.25 -2.33 0.04 0.00 0.82 0.00 0.00 66.70 65.48 2du8 h VAL 3170Cb 0.44 3.31 -0.04 0.00 -1.52 0.00 0.00 31.29 33.48 2du8 h VAL 3170CO -0.06 0.62 0.20 0.00 0.02 0.00 0.00 177.57 178.34 2du8 h ALA 3171N 0.04 0.53 -0.73 1.67 0.00 -1.23 -2.51 119.26 117.03 2du8 h ALA 3171Ca -0.02 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2du8 h ALA 3171Cb 1.09 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 2du8 h ALA 3171CO 0.03 -0.17 0.49 0.00 0.00 0.00 0.00 179.25 179.60 2du8 h ARG 3172N 0.40 0.49 -0.02 0.00 -0.00 -1.15 0.19 114.38 114.29 2du8 h ARG 3172Ca 0.19 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.64 2du8 h ARG 3172Cb 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 29.97 29.98 2du8 h ARG 3172CO -0.15 0.33 0.00 -0.85 0.00 0.00 0.00 179.97 179.30 2du8 n GLU 3173N -4.49 1.09 0.00 0.04 0.28 -0.95 -4.90 120.64 111.71 2du8 n GLU 3173Ca 0.13 -0.13 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2du8 n GLU 3173Cb 0.43 -1.30 0.00 0.00 1.43 0.00 0.00 31.44 32.01 2du8 n GLU 3173CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2du8 n GLY 3174N 0.82 1.98 3.75 -1.84 0.00 0.65 -5.09 105.19 105.46 2du8 n GLY 3174Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2du8 n GLY 3174CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2du8 s ALA 3175N -2.00 3.45 -0.13 4.61 0.00 -1.17 -4.78 121.76 121.74 2du8 s ALA 3175Ca 0.00 0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.83 2du8 s ALA 3175Cb 0.00 -2.79 -0.25 0.00 0.00 0.00 0.00 23.12 20.08 2du8 s ALA 3175CO 0.00 0.09 0.48 -0.44 0.00 0.00 0.00 175.76 175.89 2du8 h ASP 3176N 5.96 0.27 -4.27 0.00 3.32 -0.17 -3.43 116.42 118.10 2du8 h ASP 3176Ca -0.44 -0.80 -0.63 0.00 0.02 0.00 0.00 57.03 55.19 2du8 h ASP 3176Cb 1.20 -0.09 -0.26 0.00 0.22 0.00 0.00 39.33 40.40 2du8 h ASP 3176CO 0.71 1.57 -0.86 -0.69 -1.72 0.00 0.00 179.24 178.26 2du8 s VAL 3177N -2.44 1.86 -0.13 -1.35 1.01 -0.59 -2.92 120.40 115.84 2du8 s VAL 3177Ca -0.22 -1.30 0.02 0.00 0.00 0.00 0.00 61.98 60.48 2du8 s VAL 3177Cb 0.04 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.83 2du8 s VAL 3177CO 0.72 0.25 -0.18 -0.63 0.00 0.00 0.00 175.10 175.27 2du8 s ILE 3178N -0.82 1.75 -0.39 2.22 1.01 0.08 -1.23 121.20 123.82 2du8 s ILE 3178Ca 0.09 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.86 2du8 s ILE 3178Cb -0.09 -1.58 0.05 0.00 0.01 0.00 0.00 42.46 40.85 2du8 s ILE 3178CO 0.02 0.49 0.22 -0.69 0.00 0.00 0.00 174.94 174.98 2du8 s VAL 3179N 0.98 4.38 -0.56 2.92 1.01 0.73 0.17 120.40 130.04 2du8 s VAL 3179Ca -0.05 -1.08 -0.22 0.00 0.00 0.00 0.00 61.98 60.62 2du8 s VAL 3179Cb -0.15 -3.54 0.05 0.00 0.00 0.00 0.00 36.38 32.75 2du8 s VAL 3179CO -0.03 -0.33 0.85 0.21 0.00 0.00 0.00 175.10 175.79 2du8 s ASN 3180N 1.75 6.27 -0.37 3.32 2.47 0.21 -0.57 114.94 128.03 2du8 s ASN 3180Ca 0.02 -0.66 0.11 0.00 0.42 0.00 0.00 52.86 52.75 2du8 s ASN 3180Cb -0.21 -2.39 0.45 0.00 -1.45 0.00 0.00 41.25 37.65 2du8 s ASN 3180CO 0.05 -1.16 1.07 0.00 -3.72 0.00 0.00 177.10 173.33 2du8 n THR 3182N -0.38 0.53 -2.77 0.00 -2.24 -1.24 -4.40 114.28 103.78 2du8 n THR 3182Ca 0.27 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2du8 n THR 3182Cb 0.76 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2du8 n THR 3182CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2du8 n GLY 3183N 1.15 2.72 0.27 3.38 0.00 -1.26 -2.14 105.19 109.31 2du8 n GLY 3183Ca 0.14 -0.28 0.11 0.00 0.00 0.00 0.00 46.02 45.99 2du8 n GLY 3183CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2du8 h VAL 3184N 0.00 0.81 -0.15 1.61 3.04 -1.90 -2.52 116.25 117.14 2du8 h VAL 3184Ca 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 2du8 h VAL 3184Cb 0.00 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 2du8 h VAL 3184CO 0.00 0.04 0.00 0.79 -1.01 0.00 0.00 177.57 177.39 2du8 n TRP 3185N -4.19 0.23 0.57 3.17 8.01 -0.91 -4.19 117.44 120.13 2du8 n TRP 3185Ca -0.03 -0.11 0.06 0.00 -1.31 0.00 0.00 57.50 56.12 2du8 n TRP 3185Cb 0.12 -0.02 0.31 0.00 -2.01 0.00 0.00 31.31 29.71 2du8 n TRP 3185CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2du8 n ALA 3186N -0.04 1.72 0.08 6.99 0.00 -0.95 -2.55 120.51 125.76 2du8 n ALA 3186Ca 0.05 -0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 2du8 n ALA 3186Cb 0.16 -1.21 -0.09 0.00 0.00 0.00 0.00 19.45 18.32 2du8 n ALA 3186CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2du8 h GLY 3187N 2.12 0.11 2.00 0.00 0.00 -1.73 -3.13 103.07 102.44 2du8 h GLY 3187Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2du8 h GLY 3187CO 0.00 0.22 0.00 0.00 0.00 0.00 0.00 176.54 176.76 2du8 h ALA 3188N 0.92 1.00 0.02 3.60 0.00 -1.84 -2.92 119.26 120.03 2du8 h ALA 3188Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.52 2du8 h ALA 3188Cb 1.74 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.47 2du8 h ALA 3188CO 0.15 0.00 -2.12 1.28 0.00 0.00 0.00 179.25 178.56 2du8 n LEU 3189N -2.93 1.07 -3.65 0.00 4.77 -1.21 -4.92 117.00 110.13 2du8 n LEU 3189Ca -0.01 0.15 -0.07 0.00 -0.03 0.00 0.00 56.01 56.05 2du8 n LEU 3189Cb 0.17 -0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 2du8 n LEU 3189CO 0.22 0.57 0.07 -1.58 -1.33 0.00 0.00 177.39 175.34 2du8 s GLN 3190N -2.54 0.37 0.32 3.23 0.74 -1.11 -4.76 119.66 115.90 2du8 s GLN 3190Ca -0.13 1.12 -0.25 0.00 0.05 0.00 0.00 55.36 56.14 2du8 s GLN 3190Cb 0.07 0.44 -0.15 0.00 1.10 0.00 0.00 33.01 34.47 2du8 s GLN 3190CO 0.79 -0.24 0.55 0.54 -0.55 0.00 0.00 175.29 176.37 2du8 n ARG 3191N 5.40 0.42 -3.18 1.67 5.12 -1.16 -4.21 116.66 120.73 2du8 n ARG 3191Ca -0.09 0.15 0.03 0.00 -1.93 0.00 0.00 57.85 56.01 2du8 n ARG 3191Cb 0.49 -1.31 -0.00 0.00 -1.16 0.00 0.00 32.46 30.48 2du8 n ARG 3191CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2du8 s ASP 3192N -0.90 -1.57 0.00 0.55 -1.08 -1.26 -5.00 116.67 107.41 2du8 s ASP 3192Ca 0.62 -0.19 0.20 0.00 -0.52 0.00 0.00 52.55 52.66 2du8 s ASP 3192Cb -0.74 2.00 1.10 0.00 -1.46 0.00 0.00 42.92 43.82 2du8 s ASP 3192CO 0.59 -0.25 1.61 -0.81 0.52 0.00 0.00 175.17 176.83 2du8 n PRO 3193N 5.04 0.45 0.04 4.34 -0.04 -1.26 -2.76 135.00 140.80 2du8 n PRO 3193Ca 0.07 0.05 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 2du8 n PRO 3193Cb 0.55 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.48 2du8 n PRO 3193CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2du8 n LEU 3194N -1.15 0.55 -4.69 1.53 4.77 -1.26 -4.86 117.00 111.88 2du8 n LEU 3194Ca 0.12 0.07 -0.37 0.00 -0.03 0.00 0.00 56.01 55.80 2du8 n LEU 3194Cb 0.12 -0.06 -0.08 0.00 -2.33 0.00 0.00 43.42 41.06 2du8 n LEU 3194CO 0.13 -0.02 -0.06 -0.22 -1.33 0.00 0.00 177.39 175.90 2du8 s LEU 3195N -4.41 4.17 0.03 2.23 2.96 -1.11 -4.14 118.68 118.40 2du8 s LEU 3195Ca 0.00 0.34 -0.21 0.00 -0.22 0.00 0.00 54.13 54.04 2du8 s LEU 3195Cb 0.13 -2.29 0.04 0.00 0.50 0.00 0.00 46.19 44.57 2du8 s LEU 3195CO 0.82 0.04 0.47 0.00 -1.32 0.00 0.00 176.35 176.36 2du8 s GLN 3196N 0.93 0.95 0.24 1.98 -2.07 0.00 -4.94 119.66 116.75 2du8 s GLN 3196Ca 0.13 -0.24 -0.30 0.00 -1.82 0.00 0.00 55.36 53.13 2du8 s GLN 3196Cb -0.13 0.43 -0.10 0.00 -1.09 0.00 0.00 33.01 32.11 2du8 s GLN 3196CO 0.05 -0.32 1.52 -2.14 -1.32 0.00 0.00 175.29 173.07 2du8 s PRO 3197N -2.22 4.21 -0.82 9.60 0.02 -1.26 -1.74 135.00 142.80 2du8 s PRO 3197Ca -0.07 2.39 0.02 0.00 0.02 0.00 0.00 61.00 63.36 2du8 s PRO 3197Cb -0.01 -3.10 0.24 0.00 0.02 0.00 0.00 34.50 31.65 2du8 s PRO 3197CO -0.00 -0.53 0.88 0.41 -0.33 0.00 0.00 177.00 177.43 2du8 n GLY 3198N 2.63 4.58 3.62 0.52 0.00 -0.45 -0.67 105.19 115.42 2du8 n GLY 3198Ca 0.09 -2.68 -0.46 0.00 0.00 0.00 0.00 46.02 42.98 2du8 n GLY 3198CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2du8 n ARG 3199N 1.52 1.60 -4.19 1.61 0.63 -0.55 -2.33 116.66 114.95 2du8 n ARG 3199Ca 0.25 0.57 -0.12 0.00 -0.92 0.00 0.00 57.85 57.64 2du8 n ARG 3199Cb 0.37 -2.08 -0.10 0.00 0.45 0.00 0.00 32.46 31.10 2du8 n ARG 3199CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2du8 s GLY 3200N -0.12 0.93 -0.05 5.14 0.00 0.89 -1.47 107.32 112.65 2du8 s GLY 3200Ca 0.65 -1.44 -0.04 0.00 0.00 0.00 0.00 44.72 43.90 2du8 s GLY 3200CO 0.55 -1.48 0.12 1.62 0.00 0.00 0.00 173.10 173.91 2du8 s GLN 3201N -3.87 0.12 0.11 2.90 0.74 -1.26 -1.15 119.66 117.25 2du8 s GLN 3201Ca 0.16 0.20 0.03 0.00 0.05 0.00 0.00 55.36 55.80 2du8 s GLN 3201Cb 0.06 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 2du8 s GLN 3201CO -0.02 -0.05 -0.08 0.96 -0.55 0.00 0.00 175.29 175.56 2du8 s ILE 3202N 0.31 0.83 -0.14 -2.34 -4.36 0.49 -4.35 121.20 111.63 2du8 s ILE 3202Ca -0.02 -1.94 0.02 0.00 -0.26 0.00 0.00 60.65 58.45 2du8 s ILE 3202Cb -0.03 -1.69 0.01 0.00 1.25 0.00 0.00 42.46 42.00 2du8 s ILE 3202CO -0.01 -0.82 -0.20 -0.32 0.24 0.00 0.00 174.94 173.83 2du8 s MET 3203N -3.72 2.87 -0.15 0.37 -2.45 -0.02 -0.86 119.30 115.33 2du8 s MET 3203Ca 0.12 -0.79 -0.18 0.00 -1.25 0.00 0.00 55.69 53.59 2du8 s MET 3203Cb 0.04 -2.36 -0.04 0.00 1.25 0.00 0.00 34.83 33.72 2du8 s MET 3203CO -0.03 -0.06 0.48 0.15 1.05 0.00 0.00 175.02 176.60 2du8 s LYS 3204N 0.95 4.28 0.15 4.11 -0.14 0.25 -0.43 119.74 128.90 2du8 s LYS 3204Ca -0.05 0.41 0.05 0.00 -1.36 0.00 0.00 55.97 55.03 2du8 s LYS 3204Cb -0.15 -3.48 -0.04 0.00 -1.68 0.00 0.00 37.83 32.47 2du8 s LYS 3204CO -0.04 0.04 -0.12 0.54 -0.76 0.00 0.00 175.35 175.01 2du8 s VAL 3205N 1.00 1.30 -0.64 3.17 0.11 0.59 -0.96 120.40 124.98 2du8 s VAL 3205Ca 0.24 -1.96 -0.12 0.00 -2.93 0.00 0.00 61.98 57.21 2du8 s VAL 3205Cb -0.15 -1.76 0.16 0.00 -1.53 0.00 0.00 36.38 33.11 2du8 s VAL 3205CO 0.10 -0.61 0.56 -0.62 -3.33 0.00 0.00 175.10 171.19 2du8 s ASP 3206N -2.94 6.16 -0.39 3.54 -1.08 -0.12 -0.13 116.67 121.73 2du8 s ASP 3206Ca 0.15 -2.29 0.10 0.00 -0.52 0.00 0.00 52.55 49.99 2du8 s ASP 3206Cb -0.01 -2.12 0.32 0.00 -1.46 0.00 0.00 42.92 39.66 2du8 s ASP 3206CO 0.02 -0.65 0.73 0.00 0.52 0.00 0.00 175.17 175.79 2du8 n ALA 3207N 4.46 1.73 0.55 3.66 0.00 -1.26 -3.90 120.51 125.75 2du8 n ALA 3207Ca 0.01 -3.16 0.06 0.00 0.00 0.00 0.00 53.44 50.34 2du8 n ALA 3207Cb 0.42 -0.94 0.29 0.00 0.00 0.00 0.00 19.45 19.23 2du8 n ALA 3207CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2du8 n PRO 3208N 0.56 0.18 0.00 0.00 -0.04 -1.26 -1.05 135.00 133.40 2du8 n PRO 3208Ca 0.22 0.16 0.14 0.00 -0.04 0.00 0.00 63.50 63.98 2du8 n PRO 3208Cb 0.64 -1.50 0.67 0.00 -0.04 0.00 0.00 33.50 33.26 2du8 n PRO 3208CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2du8 n TRP 3209N -1.25 0.00 -2.66 0.54 2.14 -1.26 -4.75 117.44 110.19 2du8 n TRP 3209Ca 0.06 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.20 2du8 n TRP 3209Cb 0.08 -0.21 -0.03 0.00 -0.81 0.00 0.00 31.31 30.35 2du8 n TRP 3209CO 0.00 0.00 0.00 -1.64 2.07 0.00 0.00 177.69 178.12 2du8 s MET 3210N -2.49 3.59 -0.01 -2.67 -1.94 -0.21 -4.88 119.30 110.69 2du8 s MET 3210Ca 0.29 0.33 0.21 0.00 -1.71 0.00 0.00 55.69 54.81 2du8 s MET 3210Cb 0.20 -3.95 -0.25 0.00 2.01 0.00 0.00 34.83 32.84 2du8 s MET 3210CO 0.47 -1.44 0.78 1.63 -0.01 0.00 0.00 175.02 176.45 2du8 n LYS 3211N 7.84 0.21 -4.55 2.03 4.76 -1.26 -4.74 118.16 122.45 2du8 n LYS 3211Ca 0.09 -0.06 -0.31 0.00 -2.87 0.00 0.00 58.31 55.16 2du8 n LYS 3211Cb 0.49 -1.51 -0.12 0.00 -1.84 0.00 0.00 35.03 32.05 2du8 n LYS 3211CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2du8 s HIS 3212N -3.16 2.66 0.34 2.13 3.76 -1.26 -4.56 115.29 115.19 2du8 s HIS 3212Ca 0.03 -0.19 -0.15 0.00 -0.15 0.00 0.00 55.06 54.60 2du8 s HIS 3212Cb 0.15 -1.49 -0.09 0.00 1.11 0.00 0.00 32.58 32.27 2du8 s HIS 3212CO 0.88 0.31 0.75 -0.59 -0.85 0.00 0.00 174.74 175.24 2du8 s PHE 3213N -0.99 3.38 -0.12 1.40 -0.12 -0.93 -4.49 117.98 116.12 2du8 s PHE 3213Ca 0.16 1.22 -0.04 0.00 -0.05 0.00 0.00 56.93 58.22 2du8 s PHE 3213Cb -0.11 -2.54 0.06 0.00 -0.63 0.00 0.00 43.02 39.80 2du8 s PHE 3213CO 0.07 0.05 0.13 0.42 -0.05 0.00 0.00 175.22 175.84 2du8 s ILE 3214N -2.05 -0.19 -0.14 -4.49 1.01 -0.56 0.48 121.20 115.27 2du8 s ILE 3214Ca 0.54 0.12 -0.00 0.00 0.00 0.00 0.00 60.65 61.31 2du8 s ILE 3214Cb -0.10 -0.43 -0.01 0.00 0.01 0.00 0.00 42.46 41.93 2du8 s ILE 3214CO 0.19 -0.05 -0.13 -0.76 0.00 0.00 0.00 174.94 174.19 2du8 s LEU 3215N 2.22 2.65 0.29 2.97 1.43 0.12 -1.33 118.68 127.03 2du8 s LEU 3215Ca 0.04 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 2du8 s LEU 3215Cb -0.14 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 2du8 s LEU 3215CO -0.07 0.13 0.56 0.42 0.23 0.00 0.00 176.35 177.62 2du8 s THR 3216N 0.55 5.02 0.05 5.49 -4.23 -0.75 -0.44 115.64 121.32 2du8 s THR 3216Ca -0.09 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2du8 s THR 3216Cb -0.16 -3.73 -0.02 0.00 1.34 0.00 0.00 72.50 69.93 2du8 s THR 3216CO 0.04 -0.33 -0.10 -1.00 -0.54 0.00 0.00 174.62 172.69 2du8 s HIS 3217N -2.09 0.82 -0.30 3.99 3.76 -0.38 -4.58 115.29 116.52 2du8 s HIS 3217Ca 0.44 -0.46 -0.08 0.00 -0.15 0.00 0.00 55.06 54.81 2du8 s HIS 3217Cb -0.11 -0.48 0.15 0.00 1.11 0.00 0.00 32.58 33.26 2du8 s HIS 3217CO 0.30 -0.04 0.69 0.34 -0.85 0.00 0.00 174.74 175.18 2du8 s ASP 3218N -1.51 -1.12 0.50 1.40 2.15 -1.26 -4.39 116.67 112.44 2du8 s ASP 3218Ca -0.07 1.21 0.20 0.00 0.43 0.00 0.00 52.55 54.32 2du8 s ASP 3218Cb -0.09 2.15 1.28 0.00 -0.30 0.00 0.00 42.92 45.95 2du8 s ASP 3218CO 0.01 -0.21 2.08 1.55 -0.17 0.00 0.00 175.17 178.43 2du8 h PRO 3219N 7.94 0.00 0.00 4.34 0.13 -2.01 -2.87 132.00 139.54 2du8 h PRO 3219Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2du8 h PRO 3219Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2du8 h PRO 3219CO 0.14 0.10 0.00 0.39 -0.23 0.00 0.00 178.00 178.40 2du8 n GLU 3220N -4.16 0.02 0.00 0.86 -0.58 -1.26 -3.37 120.64 112.14 2du8 n GLU 3220Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2du8 n GLU 3220Cb 0.19 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 2du8 n GLU 3220CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2du8 n ARG 3221N -0.77 0.10 0.00 3.49 0.63 -1.14 -5.18 116.66 113.79 2du8 n ARG 3221Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2du8 n ARG 3221Cb 0.00 -0.01 0.00 0.00 0.45 0.00 0.00 32.46 32.90 2du8 n ARG 3221CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2du8 n GLY 3222N 0.00 2.14 3.69 5.14 0.00 -1.09 -4.71 105.19 110.35 2du8 n GLY 3222Ca 0.00 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 2du8 n GLY 3222CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2du8 n ILE 3223N 1.92 1.53 -2.81 -0.61 0.13 -1.26 -2.27 119.36 115.99 2du8 n ILE 3223Ca 0.00 -0.38 -0.18 0.00 -1.10 0.00 0.00 62.75 61.09 2du8 n ILE 3223Cb 0.00 -1.57 0.00 0.00 -0.84 0.00 0.00 39.64 37.24 2du8 n ILE 3223CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 2du8 n TYR 3224N 1.07 -1.59 0.62 9.51 4.01 -1.26 -4.73 117.16 124.79 2du8 n TYR 3224Ca 0.08 0.23 0.07 0.00 -0.16 0.00 0.00 57.90 58.12 2du8 n TYR 3224Cb 0.34 -3.23 0.02 0.00 -0.31 0.00 0.00 39.34 36.16 2du8 n TYR 3224CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2du8 n ASN 3225N -2.10 1.77 -4.91 7.72 3.02 -0.96 -1.60 115.26 118.20 2du8 n ASN 3225Ca -0.11 -1.39 -0.31 0.00 -0.03 0.00 0.00 54.58 52.75 2du8 n ASN 3225Cb 0.60 0.29 -0.04 0.00 -0.61 0.00 0.00 39.78 40.02 2du8 n ASN 3225CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2du8 s SER 3226N -1.54 6.41 0.40 6.41 0.15 -1.25 -4.61 113.70 119.66 2du8 s SER 3226Ca 0.14 0.38 -0.24 0.00 0.70 0.00 0.00 55.95 56.93 2du8 s SER 3226Cb 0.12 -2.01 -0.12 0.00 -1.71 0.00 0.00 66.02 62.31 2du8 s SER 3226CO 0.29 0.11 0.87 -0.81 1.20 0.00 0.00 173.24 174.91 2du8 n PRO 3227N 0.14 1.10 -3.83 5.44 -0.04 -1.26 -4.18 135.00 132.36 2du8 n PRO 3227Ca -0.04 0.39 -0.12 0.00 -0.04 0.00 0.00 63.50 63.69 2du8 n PRO 3227Cb 0.51 -1.84 -0.10 0.00 -0.04 0.00 0.00 33.50 32.03 2du8 n PRO 3227CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2du8 s TYR 3228N -1.29 -0.06 -0.09 0.54 -0.85 0.01 -1.80 117.35 113.81 2du8 s TYR 3228Ca 0.63 0.08 0.00 0.00 -0.52 0.00 0.00 57.07 57.26 2du8 s TYR 3228Cb -0.60 0.01 0.02 0.00 0.38 0.00 0.00 41.96 41.77 2du8 s TYR 3228CO 0.57 -0.30 -0.09 0.42 -1.52 0.00 0.00 175.55 174.64 2du8 s ILE 3229N -1.18 1.01 -0.24 -3.49 1.01 -0.44 -1.03 121.20 116.84 2du8 s ILE 3229Ca -0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 2du8 s ILE 3229Cb -0.06 -1.00 0.07 0.00 0.01 0.00 0.00 42.46 41.48 2du8 s ILE 3229CO 0.02 0.35 0.04 -0.63 0.00 0.00 0.00 174.94 174.72 2du8 s ILE 3230N 1.37 0.83 0.19 2.92 1.01 0.40 -1.49 121.20 126.43 2du8 s ILE 3230Ca -0.02 -0.97 -0.31 0.00 0.00 0.00 0.00 60.65 59.36 2du8 s ILE 3230Cb -0.14 -1.39 -0.10 0.00 0.01 0.00 0.00 42.46 40.85 2du8 s ILE 3230CO -0.04 -0.34 1.50 -2.84 0.00 0.00 0.00 174.94 173.21 2du8 s PRO 3231N 1.69 4.24 0.00 2.79 0.02 -1.26 -0.72 135.00 141.76 2du8 s PRO 3231Ca 0.02 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.34 2du8 s PRO 3231Cb -0.17 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.20 2du8 s PRO 3231CO -0.13 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 2du8 n GLY 3232N 3.17 3.37 0.22 0.52 0.00 0.26 -4.89 105.19 107.84 2du8 n GLY 3232Ca 0.11 -2.12 -0.18 0.00 0.00 0.00 0.00 46.02 43.84 2du8 n GLY 3232CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2du8 h THR 3233N 0.27 1.28 0.00 2.61 1.03 -1.96 -3.37 112.91 112.76 2du8 h THR 3233Ca 0.00 -1.98 0.00 0.00 -0.01 0.00 0.00 66.41 64.42 2du8 h THR 3233Cb 0.00 2.00 0.00 0.00 -1.07 0.00 0.00 68.15 69.08 2du8 h THR 3233CO 0.00 0.63 -1.15 0.00 -0.01 0.00 0.00 175.52 174.99 2du8 n GLN 3234N -3.94 0.34 -3.92 0.00 1.13 -1.26 -5.07 117.38 104.66 2du8 n GLN 3234Ca -0.08 -0.04 -0.10 0.00 -1.94 0.00 0.00 57.00 54.85 2du8 n GLN 3234Cb 0.75 -1.08 -0.06 0.00 0.11 0.00 0.00 30.24 29.95 2du8 n GLN 3234CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2du8 s THR 3235N -2.25 0.05 -0.14 5.09 -1.32 -1.26 -4.91 115.64 110.89 2du8 s THR 3235Ca -0.01 -1.27 -0.03 0.00 -1.21 0.00 0.00 61.69 59.17 2du8 s THR 3235Cb 0.03 -1.83 -0.03 0.00 -1.51 0.00 0.00 72.50 69.16 2du8 s THR 3235CO 0.17 -0.23 -0.03 -0.69 -2.21 0.00 0.00 174.62 171.63 2du8 s VAL 3236N -3.95 3.98 0.01 5.08 1.01 0.82 0.89 120.40 128.23 2du8 s VAL 3236Ca 0.16 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.60 2du8 s VAL 3236Cb 0.02 -2.73 -0.06 0.00 0.00 0.00 0.00 36.38 33.62 2du8 s VAL 3236CO 0.00 0.51 0.60 -0.89 0.00 0.00 0.00 175.10 175.32 2du8 s THR 3237N 0.12 4.88 -0.16 3.92 2.01 0.10 -0.30 115.64 126.21 2du8 s THR 3237Ca -0.00 1.26 0.01 0.00 0.31 0.00 0.00 61.69 63.27 2du8 s THR 3237Cb -0.13 -3.93 0.02 0.00 0.01 0.00 0.00 72.50 68.46 2du8 s THR 3237CO 0.03 0.44 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.44 2du8 s LEU 3238N -0.32 2.02 0.00 4.42 1.02 0.43 -0.45 118.68 125.81 2du8 s LEU 3238Ca 0.31 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 53.87 2du8 s LEU 3238Cb -0.18 -1.40 -0.00 0.00 0.02 0.00 0.00 46.19 44.63 2du8 s LEU 3238CO 0.18 0.01 0.05 0.61 0.02 0.00 0.00 176.35 177.22 2du8 n GLY 3239N 4.47 3.54 0.00 -3.19 0.00 -0.20 -0.84 105.19 108.97 2du8 n GLY 3239Ca -0.20 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2du8 n GLY 3239CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2du8 n GLY 3240N -0.08 0.00 2.84 -0.02 0.00 -1.26 -0.81 105.19 105.87 2du8 n GLY 3240Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2du8 n GLY 3240CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2du8 s ILE 3241N 0.00 0.41 -0.26 -0.61 1.01 -0.63 -3.94 121.20 117.18 2du8 s ILE 3241Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.63 2du8 s ILE 3241Cb 0.00 -0.49 0.12 0.00 0.01 0.00 0.00 42.46 42.10 2du8 s ILE 3241CO 0.00 0.22 0.27 0.12 0.00 0.00 0.00 174.94 175.54 2du8 s PHE 3242N 1.27 -0.37 -0.28 3.97 2.19 -1.20 -4.20 117.98 119.35 2du8 s PHE 3242Ca -0.06 -0.02 0.02 0.00 0.33 0.00 0.00 56.93 57.21 2du8 s PHE 3242Cb -0.13 -0.42 0.08 0.00 -1.31 0.00 0.00 43.02 41.23 2du8 s PHE 3242CO -0.02 -0.80 -0.02 -0.65 1.83 0.00 0.00 175.22 175.57 2du8 s GLN 3243N 2.35 1.62 0.24 10.12 -0.21 -0.54 -4.90 119.66 128.33 2du8 s GLN 3243Ca 0.09 -1.34 -0.30 0.00 0.02 0.00 0.00 55.36 53.82 2du8 s GLN 3243Cb -0.15 -2.77 -0.11 0.00 1.00 0.00 0.00 33.01 30.99 2du8 s GLN 3243CO -0.25 -0.74 1.54 -0.51 -2.12 0.00 0.00 175.29 173.21 2du8 s LEU 3244N 1.21 4.37 0.00 2.90 1.43 -1.26 -1.47 118.68 125.85 2du8 s LEU 3244Ca 0.00 2.77 0.00 0.00 -1.03 0.00 0.00 54.13 55.87 2du8 s LEU 3244Cb -0.19 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.41 2du8 s LEU 3244CO -0.09 -0.82 0.00 0.61 0.23 0.00 0.00 176.35 176.28 2du8 n GLY 3245N 2.63 3.15 3.65 -3.19 0.00 0.16 -4.96 105.19 106.63 2du8 n GLY 3245Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2du8 n GLY 3245CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2du8 s ASN 3246N -0.11 6.80 -0.08 1.61 3.84 -1.23 -4.85 114.94 120.92 2du8 s ASN 3246Ca 0.00 1.59 0.19 0.00 0.21 0.00 0.00 52.86 54.85 2du8 s ASN 3246Cb 0.00 -2.54 0.68 0.00 -0.55 0.00 0.00 41.25 38.84 2du8 s ASN 3246CO 0.00 -0.90 1.59 0.79 -2.79 0.00 0.00 177.10 175.78 2du8 n TRP 3247N 7.09 1.29 -2.57 0.43 7.02 -1.26 -4.37 117.44 125.07 2du8 n TRP 3247Ca 0.15 -0.58 -0.42 0.00 -1.02 0.00 0.00 57.50 55.63 2du8 n TRP 3247Cb 0.45 -0.17 -0.03 0.00 -2.42 0.00 0.00 31.31 29.15 2du8 n TRP 3247CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2du8 s SER 3248N -0.97 6.33 -1.32 -0.99 0.15 -1.26 -4.93 113.70 110.71 2du8 s SER 3248Ca 0.49 -0.12 -0.12 0.00 0.70 0.00 0.00 55.95 56.90 2du8 s SER 3248Cb 0.30 -2.56 0.13 0.00 -1.71 0.00 0.00 66.02 62.18 2du8 s SER 3248CO 0.26 -1.63 1.90 1.21 1.20 0.00 0.00 173.24 176.18 2du8 n GLU 3249N 8.83 3.36 -3.64 5.44 2.13 -1.26 -4.85 120.64 130.65 2du8 n GLU 3249Ca 0.06 -3.31 -0.11 0.00 0.66 0.00 0.00 57.16 54.46 2du8 n GLU 3249Cb 0.49 -3.08 -0.07 0.00 0.27 0.00 0.00 31.44 29.05 2du8 n GLU 3249CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2du8 s LEU 3250N 1.03 -0.71 0.18 4.31 2.96 -1.26 -5.02 118.68 120.17 2du8 s LEU 3250Ca 0.43 1.41 -0.31 0.00 -0.22 0.00 0.00 54.13 55.44 2du8 s LEU 3250Cb 0.09 2.32 -0.09 0.00 0.50 0.00 0.00 46.19 49.00 2du8 s LEU 3250CO -0.01 -0.24 1.43 0.20 -1.32 0.00 0.00 176.35 176.41 2du8 s ASN 3251N 0.84 6.72 -0.20 3.68 0.01 -1.26 -4.92 114.94 119.81 2du8 s ASN 3251Ca -0.04 2.52 -0.06 0.00 -0.71 0.00 0.00 52.86 54.57 2du8 s ASN 3251Cb -0.05 -2.60 -0.03 0.00 0.41 0.00 0.00 41.25 38.98 2du8 s ASN 3251CO -0.07 -0.69 0.02 0.21 -1.51 0.00 0.00 177.10 175.06 2du8 s ASN 3252N 0.74 5.02 0.23 -1.22 2.47 -1.26 -5.01 114.94 115.91 2du8 s ASN 3252Ca 0.63 -0.15 -0.06 0.00 0.42 0.00 0.00 52.86 53.70 2du8 s ASN 3252Cb -0.40 -1.86 0.33 0.00 -1.45 0.00 0.00 41.25 37.87 2du8 s ASN 3252CO 0.36 0.07 1.81 0.40 -3.72 0.00 0.00 177.10 176.03 2du8 h ILE 3253N 5.30 0.94 -0.36 -5.21 1.08 -1.99 -0.32 117.51 116.97 2du8 h ILE 3253Ca -0.36 -0.27 0.04 0.00 -0.39 0.00 0.00 64.86 63.89 2du8 h ILE 3253Cb 1.18 0.10 -0.04 0.00 -3.07 0.00 0.00 36.82 34.99 2du8 h ILE 3253CO 0.62 0.14 0.12 1.56 -0.69 0.00 0.00 178.15 179.90 2du8 h GLN 3254N 0.77 0.25 -0.17 2.37 7.50 -2.00 -1.12 115.11 122.73 2du8 h GLN 3254Ca 0.36 -0.02 -0.09 0.00 0.50 0.00 0.00 58.65 59.40 2du8 h GLN 3254Cb 0.28 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.74 2du8 h GLN 3254CO -0.22 0.17 -0.31 -0.44 -1.50 0.00 0.00 178.83 176.54 2du8 h ASP 3255N 0.26 0.33 0.13 1.46 3.32 -1.88 -1.85 116.42 118.19 2du8 h ASP 3255Ca 0.17 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2du8 h ASP 3255Cb 0.15 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2du8 h ASP 3255CO -0.18 0.63 -0.14 -0.74 -1.72 0.00 0.00 179.24 177.09 2du8 h HIS 3256N 0.29 -0.36 -0.74 4.55 -0.00 -0.71 -0.31 115.15 117.87 2du8 h HIS 3256Ca 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.38 2du8 h HIS 3256Cb 0.69 0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 28.21 2du8 h HIS 3256CO 0.02 -0.21 0.33 -0.91 -0.00 0.00 0.00 177.93 177.15 2du8 h ASN 3257N -0.30 0.97 -0.29 3.26 2.35 -1.01 0.30 115.58 120.86 2du8 h ASN 3257Ca 0.01 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2du8 h ASN 3257Cb 0.29 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2du8 h ASN 3257CO -0.05 0.84 0.19 0.74 -1.65 0.00 0.00 177.43 177.50 2du8 h THR 3258N 1.05 1.08 0.21 2.81 2.02 -1.09 -0.83 112.91 118.16 2du8 h THR 3258Ca 0.25 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 2du8 h THR 3258Cb 0.14 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 2du8 h THR 3258CO -0.03 0.08 -0.10 0.40 0.37 0.00 0.00 175.52 176.24 2du8 h ILE 3259N 0.38 0.82 -0.32 3.11 1.08 -0.36 -1.65 117.51 120.56 2du8 h ILE 3259Ca 0.10 -0.09 -0.06 0.00 -0.39 0.00 0.00 64.86 64.43 2du8 h ILE 3259Cb -0.03 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 2du8 h ILE 3259CO -0.02 0.02 -0.05 -0.25 -0.69 0.00 0.00 178.15 177.16 2du8 h TRP 3260N -0.32 0.53 0.07 1.37 2.91 -0.88 -1.97 115.95 117.66 2du8 h TRP 3260Ca -0.03 -0.06 -0.10 0.00 1.13 0.00 0.00 58.89 59.82 2du8 h TRP 3260Cb 0.24 -0.15 0.01 0.00 -0.51 0.00 0.00 29.16 28.76 2du8 h TRP 3260CO -0.05 0.56 -0.45 0.93 -1.03 0.00 0.00 178.44 178.39 2du8 h GLU 3261N 0.48 0.19 -0.86 2.65 3.07 -1.10 -2.66 114.58 116.34 2du8 h GLU 3261Ca 0.10 -0.29 0.07 0.00 -0.50 0.00 0.00 59.36 58.73 2du8 h GLU 3261Cb 0.39 0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 28.34 2du8 h GLU 3261CO 0.02 1.11 0.53 0.78 -1.40 0.00 0.00 179.01 180.05 2du8 h GLY 3262N -0.58 1.31 1.39 -3.84 0.00 -1.25 -2.00 103.07 98.10 2du8 h GLY 3262Ca -0.07 -0.38 -0.27 0.00 0.00 0.00 0.00 47.33 46.60 2du8 h GLY 3262CO 0.09 0.25 -1.13 0.00 0.00 0.00 0.00 176.54 175.74 2du8 h ARG 3265N 0.40 1.13 -0.07 0.00 9.65 -1.36 -2.54 114.38 121.59 2du8 h ARG 3265Ca 0.06 -0.07 -0.21 0.00 -1.10 0.00 0.00 59.98 58.66 2du8 h ARG 3265Cb 0.69 -0.26 0.01 0.00 -1.39 0.00 0.00 29.97 29.03 2du8 h ARG 3265CO 0.05 0.75 -0.78 1.25 2.80 0.00 0.00 179.97 184.04 2du8 h LEU 3266N 1.17 0.81 -6.69 3.80 6.46 -1.10 -3.40 115.31 116.34 2du8 h LEU 3266Ca 0.33 -0.69 -0.57 0.00 -0.12 0.00 0.00 57.88 56.83 2du8 h LEU 3266Cb -0.10 -0.24 -0.39 0.00 -0.73 0.00 0.00 40.66 39.19 2du8 h LEU 3266CO -0.08 1.38 -0.82 -0.70 -0.62 0.00 0.00 178.44 177.60 2du8 s GLU 3267N -3.50 0.50 0.56 1.25 2.56 -0.13 -4.96 118.70 114.98 2du8 s GLU 3267Ca -0.11 -1.14 0.27 0.00 0.00 0.00 0.00 54.97 54.00 2du8 s GLU 3267Cb 0.07 -1.36 1.48 0.00 2.00 0.00 0.00 34.13 36.32 2du8 s GLU 3267CO 0.88 -1.14 1.99 -1.35 -0.56 0.00 0.00 175.26 175.08 2du8 h PRO 3268N 7.44 0.00 0.00 4.30 0.11 -1.68 -1.32 132.00 140.84 2du8 h PRO 3268Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2du8 h PRO 3268Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2du8 h PRO 3268CO 0.34 0.00 0.09 1.79 -0.21 0.00 0.00 178.00 180.01 2du8 h THR 3269N 0.00 0.00 0.00 -1.15 1.35 -1.95 -0.14 112.91 111.02 2du8 h THR 3269Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.07 2du8 h THR 3269Cb 0.97 0.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 2du8 h THR 3269CO -0.00 0.00 0.00 -0.11 -0.25 0.00 0.00 175.52 175.16 2du8 n LEU 3270N -2.69 0.34 0.27 3.87 7.94 -0.50 -3.61 117.00 122.62 2du8 n LEU 3270Ca -0.02 0.56 0.18 0.00 -1.11 0.00 0.00 56.01 55.62 2du8 n LEU 3270Cb 0.14 -0.49 0.93 0.00 0.53 0.00 0.00 43.42 44.53 2du8 n LEU 3270CO 0.14 -0.29 1.15 0.50 -1.11 0.00 0.00 177.39 177.78 2du8 h LYS 3271N 0.00 0.00 -0.01 1.96 1.63 -1.23 -2.21 116.57 116.72 2du8 h LYS 3271Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2du8 h LYS 3271Cb 0.41 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 2du8 h LYS 3271CO 0.00 0.00 -0.11 0.09 -3.45 0.00 0.00 179.45 175.98 2du8 n ASN 3272N -3.51 1.22 -4.78 4.20 3.02 -1.24 -5.02 115.26 109.15 2du8 n ASN 3272Ca -0.01 -1.11 -0.41 0.00 -0.03 0.00 0.00 54.58 53.03 2du8 n ASN 3272Cb 0.24 0.34 -0.01 0.00 -0.61 0.00 0.00 39.78 39.74 2du8 n ASN 3272CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2du8 s ALA 3273N -1.00 3.54 0.03 5.41 0.00 -0.83 -4.96 121.76 123.95 2du8 s ALA 3273Ca 0.07 1.48 -0.30 0.00 0.00 0.00 0.00 51.96 53.20 2du8 s ALA 3273Cb 0.06 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 2du8 s ALA 3273CO 0.16 -0.93 1.10 0.50 0.00 0.00 0.00 175.76 176.59 2du8 s ARG 3274N -2.01 4.49 -0.37 0.00 6.06 -1.25 -4.84 118.95 121.03 2du8 s ARG 3274Ca 0.52 1.61 -0.25 0.00 -2.50 0.00 0.00 55.73 55.10 2du8 s ARG 3274Cb -0.44 -3.40 0.01 0.00 0.06 0.00 0.00 34.95 31.18 2du8 s ARG 3274CO 0.60 -0.17 0.91 0.42 -2.50 0.00 0.00 175.30 174.56 2du8 s ILE 3275N 1.05 4.61 -0.16 4.11 1.01 -1.26 -0.94 121.20 129.61 2du8 s ILE 3275Ca 0.56 1.16 -0.19 0.00 0.00 0.00 0.00 60.65 62.18 2du8 s ILE 3275Cb -0.26 -4.31 -0.16 0.00 0.01 0.00 0.00 42.46 37.74 2du8 s ILE 3275CO 0.29 -0.52 0.27 0.40 0.00 0.00 0.00 174.94 175.38 2du8 h ILE 3276N 5.81 0.88 -3.26 2.92 1.08 -1.39 -3.49 117.51 120.06 2du8 h ILE 3276Ca -0.23 -1.86 0.01 0.00 -0.39 0.00 0.00 64.86 62.39 2du8 h ILE 3276Cb 1.08 1.85 -0.06 0.00 -3.07 0.00 0.00 36.82 36.62 2du8 h ILE 3276CO 0.97 0.30 0.10 -0.83 -0.69 0.00 0.00 178.15 178.00 2du8 s GLY 3277N -4.39 0.21 -0.09 5.37 0.00 -1.01 -5.00 107.32 102.41 2du8 s GLY 3277Ca -0.20 -0.57 -0.09 0.00 0.00 0.00 0.00 44.72 43.86 2du8 s GLY 3277CO 0.47 -0.32 0.25 1.85 0.00 0.00 0.00 173.10 175.35 2du8 s GLU 3278N -3.80 0.29 0.01 2.90 2.12 -1.26 0.84 118.70 119.79 2du8 s GLU 3278Ca 0.16 0.34 -0.14 0.00 0.36 0.00 0.00 54.97 55.69 2du8 s GLU 3278Cb -0.04 0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.51 2du8 s GLU 3278CO 0.08 -0.03 0.29 1.03 -0.54 0.00 0.00 175.26 176.09 2du8 s ARG 3279N 0.12 0.70 -0.04 4.30 1.81 -0.04 -5.00 118.95 120.81 2du8 s ARG 3279Ca -0.00 -0.31 0.06 0.00 -1.72 0.00 0.00 55.73 53.75 2du8 s ARG 3279Cb -0.02 0.31 -0.01 0.00 -0.45 0.00 0.00 34.95 34.78 2du8 s ARG 3279CO 0.00 -0.20 -0.22 0.99 -0.68 0.00 0.00 175.30 175.19 2du8 s THR 3280N -1.74 1.80 0.15 0.02 2.01 -1.26 -0.38 115.64 116.25 2du8 s THR 3280Ca -0.11 -0.94 -0.01 0.00 0.31 0.00 0.00 61.69 60.95 2du8 s THR 3280Cb -0.04 -1.52 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 2du8 s THR 3280CO 0.02 0.51 0.08 -0.83 -0.69 0.00 0.00 174.62 173.70 2du8 s GLY 3281N -0.18 1.14 -0.33 4.40 0.00 -0.30 -4.92 107.32 107.13 2du8 s GLY 3281Ca -0.01 -1.55 0.01 0.00 0.00 0.00 0.00 44.72 43.18 2du8 s GLY 3281CO 0.02 -1.38 0.03 -1.36 0.00 0.00 0.00 173.10 170.42 2du8 s PHE 3282N -4.08 3.53 0.16 1.90 0.08 -1.26 -0.08 117.98 118.23 2du8 s PHE 3282Ca 0.29 -2.54 -0.32 0.00 0.12 0.00 0.00 56.93 54.48 2du8 s PHE 3282Cb 0.07 -2.61 -0.12 0.00 -0.57 0.00 0.00 43.02 39.80 2du8 s PHE 3282CO 0.05 -0.91 1.77 0.54 -0.10 0.00 0.00 175.22 176.57 2du8 n ARG 3283N 4.42 2.73 -1.94 0.44 1.74 -0.98 -4.72 116.66 118.35 2du8 n ARG 3283Ca -0.04 0.99 -0.36 0.00 -0.77 0.00 0.00 57.85 57.67 2du8 n ARG 3283Cb 0.42 -2.85 -0.04 0.00 -1.02 0.00 0.00 32.46 28.97 2du8 n ARG 3283CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2du8 n PRO 3284N 4.72 1.98 -2.37 5.56 -0.04 -1.25 -1.34 135.00 142.27 2du8 n PRO 3284Ca 0.17 -2.50 -0.42 0.00 -0.04 0.00 0.00 63.50 60.71 2du8 n PRO 3284Cb 0.35 -3.47 -0.03 0.00 -0.04 0.00 0.00 33.50 30.31 2du8 n PRO 3284CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2du8 s VAL 3285N 7.79 3.93 -0.10 0.52 1.01 -0.71 -0.30 120.40 132.53 2du8 s VAL 3285Ca 0.62 1.36 -0.22 0.00 0.00 0.00 0.00 61.98 63.74 2du8 s VAL 3285Cb 0.05 -3.87 0.05 0.00 0.00 0.00 0.00 36.38 32.61 2du8 s VAL 3285CO 0.11 0.07 0.52 -0.60 0.00 0.00 0.00 175.10 175.20 2du8 s ARG 3286N 1.45 0.78 0.48 2.72 3.52 -1.26 -0.82 118.95 125.82 2du8 s ARG 3286Ca 0.60 0.33 0.21 0.00 -0.13 0.00 0.00 55.73 56.74 2du8 s ARG 3286Cb -0.30 0.37 1.23 0.00 -1.56 0.00 0.00 34.95 34.68 2du8 s ARG 3286CO 0.28 -0.19 1.94 -1.35 -0.81 0.00 0.00 175.30 175.17 2du8 h PRO 3287N 4.16 0.21 -2.94 5.12 0.11 -1.92 -3.42 132.00 133.33 2du8 h PRO 3287Ca -0.28 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.74 2du8 h PRO 3287Cb 1.16 -0.05 -0.17 0.00 0.11 0.00 0.00 31.00 32.06 2du8 h PRO 3287CO 0.30 0.14 -0.08 1.14 -0.21 0.00 0.00 178.00 179.30 2du8 s GLN 3288N -5.22 0.93 0.36 1.05 -2.07 -1.26 -4.71 119.66 108.74 2du8 s GLN 3288Ca -0.07 -0.30 -0.28 0.00 -1.82 0.00 0.00 55.36 52.89 2du8 s GLN 3288Cb 0.21 0.42 -0.11 0.00 -1.09 0.00 0.00 33.01 32.43 2du8 s GLN 3288CO 0.76 -0.32 1.53 0.42 -1.32 0.00 0.00 175.29 176.35 2du8 s ILE 3289N -2.35 2.00 -0.80 3.63 1.01 -1.24 -4.93 121.20 118.51 2du8 s ILE 3289Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.43 2du8 s ILE 3289Cb -0.01 -3.00 0.17 0.00 0.01 0.00 0.00 42.46 39.63 2du8 s ILE 3289CO -0.01 0.00 0.85 -0.60 0.00 0.00 0.00 174.94 175.18 2du8 s ARG 3290N -1.75 3.48 -0.51 2.79 3.52 -0.57 -4.96 118.95 120.95 2du8 s ARG 3290Ca 0.55 -2.02 0.00 0.00 -0.13 0.00 0.00 55.73 54.14 2du8 s ARG 3290Cb -0.47 -4.54 0.13 0.00 -1.56 0.00 0.00 34.95 28.51 2du8 s ARG 3290CO 0.60 -1.48 0.28 -1.17 -0.81 0.00 0.00 175.30 172.72 2du8 s LEU 3291N 1.42 4.90 0.16 -0.88 2.96 -1.25 -2.81 118.68 123.17 2du8 s LEU 3291Ca 0.20 -2.63 -0.20 0.00 -0.22 0.00 0.00 54.13 51.28 2du8 s LEU 3291Cb -0.12 -1.75 0.05 0.00 0.50 0.00 0.00 46.19 44.87 2du8 s LEU 3291CO -0.06 -0.36 0.54 -1.83 -1.32 0.00 0.00 176.35 173.31 2du8 s GLU 3292N 0.26 1.24 0.32 1.98 -1.05 -0.88 -5.00 118.70 115.57 2du8 s GLU 3292Ca 0.14 -0.59 -0.06 0.00 -0.15 0.00 0.00 54.97 54.32 2du8 s GLU 3292Cb -0.22 0.55 -0.05 0.00 -0.44 0.00 0.00 34.13 33.96 2du8 s GLU 3292CO -0.03 -0.53 0.61 0.50 0.95 0.00 0.00 175.26 176.76 2du8 s ARG 3293N -3.78 3.65 -0.21 -4.83 3.52 -1.26 -1.10 118.95 114.94 2du8 s ARG 3293Ca 0.02 0.10 -0.26 0.00 -0.13 0.00 0.00 55.73 55.46 2du8 s ARG 3293Cb -0.00 -2.58 0.07 0.00 -1.56 0.00 0.00 34.95 30.87 2du8 s ARG 3293CO -0.11 0.14 0.70 -2.00 -0.81 0.00 0.00 175.30 173.22 2du8 s GLU 3294N -3.68 0.88 -0.54 5.12 2.12 -0.71 -4.97 118.70 116.92 2du8 s GLU 3294Ca 0.45 0.80 -0.18 0.00 0.36 0.00 0.00 54.97 56.40 2du8 s GLU 3294Cb -0.11 0.43 0.09 0.00 0.26 0.00 0.00 34.13 34.80 2du8 s GLU 3294CO 0.31 -0.16 0.60 -0.65 -0.54 0.00 0.00 175.26 174.82 2du8 s GLN 3295N -0.03 3.05 -0.35 4.30 -1.52 -1.26 -2.50 119.66 121.36 2du8 s GLN 3295Ca -0.03 -1.25 -0.21 0.00 -1.95 0.00 0.00 55.36 51.92 2du8 s GLN 3295Cb -0.04 -4.20 0.00 0.00 -0.22 0.00 0.00 33.01 28.56 2du8 s GLN 3295CO 0.03 -1.33 0.66 -1.17 -0.25 0.00 0.00 175.29 173.23 2du8 s LEU 3296N 2.35 4.22 -0.12 2.90 2.96 -1.20 -4.98 118.68 124.80 2du8 s LEU 3296Ca 0.10 0.24 -0.29 0.00 -0.22 0.00 0.00 54.13 53.95 2du8 s LEU 3296Cb -0.24 -2.83 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2du8 s LEU 3296CO 0.08 -0.60 1.63 -0.13 -1.32 0.00 0.00 176.35 176.01 2du8 s ARG 3297N 2.76 4.03 -0.21 1.98 3.00 -1.26 -2.69 118.95 126.55 2du8 s ARG 3297Ca 0.26 1.98 -0.04 0.00 0.00 0.00 0.00 55.73 57.93 2du8 s ARG 3297Cb -0.14 -4.00 0.09 0.00 0.00 0.00 0.00 34.95 30.90 2du8 s ARG 3297CO 0.15 -1.02 0.17 -0.08 0.00 0.00 0.00 175.30 174.52 2du8 s THR 3298N 4.50 -0.21 0.00 0.02 -1.32 -1.26 -4.96 115.64 112.40 2du8 s THR 3298Ca 0.72 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.94 2du8 s THR 3298Cb -0.30 -0.72 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 2du8 s THR 3298CO 0.29 -0.34 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 2du8 n GLY 3299N 5.29 2.96 0.36 6.08 0.00 -1.26 -3.59 105.19 115.03 2du8 n GLY 3299Ca -0.06 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 2du8 n GLY 3299CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2du8 h PRO 3300N 0.00 -0.41 -4.00 1.61 0.13 -2.03 -3.40 132.00 123.90 2du8 h PRO 3300Ca 0.00 0.03 -0.43 0.00 -0.87 0.00 0.00 66.00 64.73 2du8 h PRO 3300Cb 0.00 0.09 -0.35 0.00 0.13 0.00 0.00 31.00 30.87 2du8 h PRO 3300CO 0.00 -0.27 -0.78 0.45 -0.23 0.00 0.00 178.00 177.17 2du8 s SER 3301N -4.34 1.21 0.48 1.44 0.15 -1.24 -5.14 113.70 106.27 2du8 s SER 3301Ca -0.12 -0.14 -0.22 0.00 0.70 0.00 0.00 55.95 56.17 2du8 s SER 3301Cb 0.06 -0.50 -0.09 0.00 -1.71 0.00 0.00 66.02 63.78 2du8 s SER 3301CO 0.47 -0.08 0.90 -0.46 1.20 0.00 0.00 173.24 175.26 2du8 n ASN 3302N 4.33 0.67 -4.51 5.45 0.23 -1.24 -4.61 115.26 115.58 2du8 n ASN 3302Ca -0.20 0.93 -0.31 0.00 -0.53 0.00 0.00 54.58 54.46 2du8 n ASN 3302Cb 0.51 -1.32 -0.12 0.00 -2.08 0.00 0.00 39.78 36.77 2du8 n ASN 3302CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2du8 s THR 3303N -1.41 3.10 0.45 5.53 -4.23 -1.10 -4.90 115.64 113.08 2du8 s THR 3303Ca 0.67 -1.02 -0.22 0.00 -1.18 0.00 0.00 61.69 59.94 2du8 s THR 3303Cb -0.51 -2.32 -0.08 0.00 1.34 0.00 0.00 72.50 70.93 2du8 s THR 3303CO 0.54 0.37 1.10 -1.61 -0.54 0.00 0.00 174.62 174.48 2du8 s GLU 3304N -1.40 3.85 -0.03 3.99 0.41 -1.15 -3.27 118.70 121.11 2du8 s GLU 3304Ca 0.15 1.59 -0.01 0.00 -0.41 0.00 0.00 54.97 56.29 2du8 s GLU 3304Cb -0.11 -2.35 0.03 0.00 -1.78 0.00 0.00 34.13 29.93 2du8 s GLU 3304CO 0.06 -0.43 0.05 0.08 -0.49 0.00 0.00 175.26 174.53 2du8 s VAL 3305N -1.69 -0.09 -0.26 2.63 1.01 -1.04 -0.74 120.40 120.23 2du8 s VAL 3305Ca 0.63 0.34 -0.07 0.00 0.00 0.00 0.00 61.98 62.89 2du8 s VAL 3305Cb -0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 2du8 s VAL 3305CO 0.29 0.14 0.06 -0.63 0.00 0.00 0.00 175.10 174.96 2du8 s ILE 3306N 1.72 4.13 0.04 2.22 1.01 0.13 -1.74 121.20 128.72 2du8 s ILE 3306Ca -0.01 -0.32 -0.19 0.00 0.00 0.00 0.00 60.65 60.13 2du8 s ILE 3306Cb -0.12 -2.97 -0.06 0.00 0.01 0.00 0.00 42.46 39.31 2du8 s ILE 3306CO -0.03 0.29 0.56 -1.00 0.00 0.00 0.00 174.94 174.76 2du8 s HIS 3307N 1.58 3.76 -0.40 3.97 3.76 -0.26 0.68 115.29 128.38 2du8 s HIS 3307Ca 0.06 1.22 0.04 0.00 -0.15 0.00 0.00 55.06 56.22 2du8 s HIS 3307Cb -0.15 -2.51 0.16 0.00 1.11 0.00 0.00 32.58 31.19 2du8 s HIS 3307CO 0.03 0.53 0.43 1.21 -0.85 0.00 0.00 174.74 176.08 2du8 s ASN 3308N -0.83 0.71 0.20 1.40 2.47 0.13 -2.08 114.94 116.93 2du8 s ASN 3308Ca 0.29 -1.78 -0.22 0.00 0.42 0.00 0.00 52.86 51.57 2du8 s ASN 3308Cb -0.19 0.67 0.05 0.00 -1.45 0.00 0.00 41.25 40.33 2du8 s ASN 3308CO 0.18 -0.21 0.63 -0.72 -3.72 0.00 0.00 177.10 173.25 2du8 s TYR 3309N 1.17 -0.40 0.00 0.43 -0.85 -1.12 -4.24 117.35 112.34 2du8 s TYR 3309Ca 0.21 0.10 0.00 0.00 -0.52 0.00 0.00 57.07 56.86 2du8 s TYR 3309Cb -0.10 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.83 2du8 s TYR 3309CO -0.05 -0.98 0.00 0.41 -1.52 0.00 0.00 175.55 173.41 2du8 n GLY 3310N -0.40 0.53 1.18 5.49 0.00 -1.26 -1.51 105.19 109.22 2du8 n GLY 3310Ca -0.12 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.70 2du8 n GLY 3310CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2du8 n HIS 3311N -0.65 0.99 0.00 1.61 8.25 -1.10 -3.72 115.22 120.59 2du8 n HIS 3311Ca 0.00 -0.42 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 2du8 n HIS 3311Cb 0.28 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2du8 n HIS 3311CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2du8 n GLY 3312N 1.10 2.24 2.62 -1.41 0.00 0.59 -1.60 105.19 108.74 2du8 n GLY 3312Ca 0.19 0.12 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 2du8 n GLY 3312CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2du8 n GLY 3313N 0.00 5.73 0.57 -0.02 0.00 -1.26 -3.94 105.19 106.27 2du8 n GLY 3313Ca 0.00 -2.44 -0.02 0.00 0.00 0.00 0.00 46.02 43.57 2du8 n GLY 3313CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2du8 n TYR 3314N -0.69 0.00 -0.30 1.61 4.11 -0.62 -4.94 117.16 116.32 2du8 n TYR 3314Ca 0.56 -0.12 0.08 0.00 -0.00 0.00 0.00 57.90 58.43 2du8 n TYR 3314Cb 0.46 0.30 0.24 0.00 -0.00 0.00 0.00 39.34 40.34 2du8 n TYR 3314CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.86 177.64 2du8 h GLY 3315N 0.00 1.45 1.30 -7.48 0.00 -1.72 -2.06 103.07 94.56 2du8 h GLY 3315Ca -0.13 -0.26 -0.14 0.00 0.00 0.00 0.00 47.33 46.79 2du8 h GLY 3315CO -0.07 -0.06 -0.36 1.41 0.00 0.00 0.00 176.54 177.47 2du8 h LEU 3316N 0.63 0.82 -2.01 3.11 -0.00 -1.93 0.44 115.31 116.36 2du8 h LEU 3316Ca 0.49 -0.35 -0.01 0.00 -0.00 0.00 0.00 57.88 58.00 2du8 h LEU 3316Cb 0.72 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2du8 h LEU 3316CO -0.38 1.09 -0.06 0.74 -0.00 0.00 0.00 178.44 179.83 2du8 h THR 3317N 0.65 0.26 0.00 0.22 2.02 -1.68 -3.31 112.91 111.07 2du8 h THR 3317Ca 0.06 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2du8 h THR 3317Cb 0.90 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.64 2du8 h THR 3317CO 0.08 0.06 -0.84 0.00 0.37 0.00 0.00 175.52 175.19 2du8 n ILE 3318N -3.33 0.00 -0.33 3.11 3.06 -0.87 -4.51 119.36 116.49 2du8 n ILE 3318Ca -0.01 -0.01 0.26 0.00 -2.50 0.00 0.00 62.75 60.48 2du8 n ILE 3318Cb 0.23 0.45 0.49 0.00 0.54 0.00 0.00 39.64 41.34 2du8 n ILE 3318CO 0.00 0.00 0.00 1.12 -2.50 0.00 0.00 176.55 175.17 2du8 h HIS 3319N 0.00 0.55 -0.20 9.51 2.07 -1.00 -0.43 115.15 125.66 2du8 h HIS 3319Ca 0.00 0.05 -0.03 0.00 -2.85 0.00 0.00 60.37 57.54 2du8 h HIS 3319Cb 0.00 -0.07 -0.01 0.00 2.57 0.00 0.00 27.41 29.90 2du8 h HIS 3319CO 0.00 -0.45 0.02 2.35 -3.07 0.00 0.00 177.93 176.78 2du8 h TRP 3320N 0.02 0.36 -0.27 6.12 2.91 -1.86 -1.11 115.95 122.12 2du8 h TRP 3320Ca 0.76 -0.06 0.07 0.00 1.13 0.00 0.00 58.89 60.79 2du8 h TRP 3320Cb 1.89 -0.10 -0.07 0.00 -0.51 0.00 0.00 29.16 30.37 2du8 h TRP 3320CO -0.17 0.51 -0.22 0.78 -1.03 0.00 0.00 178.44 178.31 2du8 h GLY 3321N 0.11 -0.10 1.06 2.65 0.00 -1.13 -2.22 103.07 103.45 2du8 h GLY 3321Ca 0.06 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.69 2du8 h GLY 3321CO 0.01 -0.19 0.59 0.00 0.00 0.00 0.00 176.54 176.94 2du8 h ALA 3323N 1.46 0.89 -0.37 0.00 0.00 -0.84 0.98 119.26 121.39 2du8 h ALA 3323Ca 0.34 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2du8 h ALA 3323Cb -0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2du8 h ALA 3323CO -0.09 0.63 0.08 -0.07 0.00 0.00 0.00 179.25 179.80 2du8 h LEU 3324N 1.02 0.56 -0.67 0.00 3.38 -0.93 -1.30 115.31 117.36 2du8 h LEU 3324Ca 0.21 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2du8 h LEU 3324Cb 0.39 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2du8 h LEU 3324CO 0.01 0.66 0.39 -0.08 0.09 0.00 0.00 178.44 179.51 2du8 h GLU 3325N 0.44 0.93 -0.64 1.13 4.57 -1.10 -0.65 114.58 119.26 2du8 h GLU 3325Ca 0.11 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2du8 h GLU 3325Cb 0.32 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 2du8 h GLU 3325CO 0.00 0.67 0.23 0.00 -1.18 0.00 0.00 179.01 178.73 2du8 h ALA 3326N 1.20 1.19 -0.34 2.92 0.00 -0.63 -1.58 119.26 122.02 2du8 h ALA 3326Ca 0.24 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2du8 h ALA 3326Cb 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2du8 h ALA 3326CO -0.04 0.57 -0.38 0.00 0.00 0.00 0.00 179.25 179.40 2du8 h ALA 3327N 1.32 0.69 -0.29 0.00 0.00 -0.87 -1.10 119.26 119.00 2du8 h ALA 3327Ca 0.21 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.70 2du8 h ALA 3327Cb 0.23 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2du8 h ALA 3327CO -0.01 0.67 0.13 -0.22 0.00 0.00 0.00 179.25 179.81 2du8 h LYS 3328N 0.66 0.27 -0.16 0.00 3.64 -0.95 -0.45 116.57 119.57 2du8 h LYS 3328Ca 0.06 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2du8 h LYS 3328Cb 0.94 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.69 2du8 h LYS 3328CO 0.09 0.18 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.27 2du8 h LEU 3329N 0.28 0.24 -1.22 5.20 3.38 -1.07 -0.67 115.31 121.45 2du8 h LEU 3329Ca 0.12 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2du8 h LEU 3329Cb 0.06 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2du8 h LEU 3329CO -0.10 0.38 -0.24 0.15 0.09 0.00 0.00 178.44 178.73 2du8 h PHE 3330N 0.25 0.26 0.34 1.13 3.57 -0.56 -2.82 116.94 119.11 2du8 h PHE 3330Ca 0.05 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2du8 h PHE 3330Cb 0.35 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2du8 h PHE 3330CO 0.01 0.47 -0.34 0.78 -2.23 0.00 0.00 178.31 177.00 2du8 h GLY 3331N 0.94 -1.08 -0.44 2.40 0.00 0.45 -2.77 103.07 102.57 2du8 h GLY 3331Ca 0.04 0.49 0.31 0.00 0.00 0.00 0.00 47.33 48.17 2du8 h GLY 3331CO 0.04 -0.34 0.64 3.21 0.00 0.00 0.00 176.54 180.09 2du8 h ARG 3332N -0.68 0.35 -0.25 4.80 2.47 -1.31 0.20 114.38 119.96 2du8 h ARG 3332Ca -0.04 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2du8 h ARG 3332Cb 0.58 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 2du8 h ARG 3332CO -0.04 0.23 0.12 0.82 0.56 0.00 0.00 179.97 181.66 2du8 h ILE 3333N 0.36 1.15 -0.18 2.04 2.04 -1.37 -2.18 117.51 119.37 2du8 h ILE 3333Ca 0.70 -0.42 0.02 0.00 1.00 0.00 0.00 64.86 66.16 2du8 h ILE 3333Cb 1.66 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.69 2du8 h ILE 3333CO -0.48 0.15 0.05 -0.07 0.00 0.00 0.00 178.15 177.79 2du8 h LEU 3334N 0.27 0.05 -0.74 1.44 3.38 -0.34 -0.68 115.31 118.70 2du8 h LEU 3334Ca 0.09 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2du8 h LEU 3334Cb 0.12 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2du8 h LEU 3334CO -0.01 0.05 0.01 1.05 0.09 0.00 0.00 178.44 179.63 2du8 h GLU 3335N 0.13 0.97 -0.44 1.13 4.11 -1.43 0.13 114.58 119.18 2du8 h GLU 3335Ca 0.08 -0.29 -0.07 0.00 0.07 0.00 0.00 59.36 59.15 2du8 h GLU 3335Cb 0.06 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2du8 h GLU 3335CO -0.09 0.95 0.01 0.93 0.07 0.00 0.00 179.01 180.88 2du8 h GLU 3336N 0.90 0.77 0.00 1.06 5.08 -1.25 -1.52 114.58 119.62 2du8 h GLU 3336Ca 0.17 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2du8 h GLU 3336Cb 0.51 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2du8 h GLU 3336CO 0.03 0.83 0.00 1.17 -1.00 0.00 0.00 179.01 180.04 2du8 n LYS 3337N -4.41 0.63 -3.23 2.33 4.81 -0.27 -4.88 118.16 113.13 2du8 n LYS 3337Ca -0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 2du8 n LYS 3337Cb 0.29 -1.05 0.00 0.00 0.02 0.00 0.00 35.03 34.29 2du8 n LYS 3337CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2du8 n LYS 3338N -0.55 -1.49 -0.99 1.64 5.02 -0.57 -4.99 118.16 116.24 2du8 n LYS 3338Ca 0.02 1.37 -0.05 0.00 -2.02 0.00 0.00 58.31 57.63 2du8 n LYS 3338Cb 0.01 -4.81 -0.05 0.00 -0.02 0.00 0.00 35.03 30.16 2du8 n LYS 3338CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2du8 n LEU 3339N -1.80 -0.66 -0.44 -0.35 7.94 0.42 -5.00 117.00 117.12 2du8 n LEU 3339Ca -0.07 -1.87 0.05 0.00 -1.11 0.00 0.00 56.01 53.02 2du8 n LEU 3339Cb 0.55 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.55 2du8 n LEU 3339CO 0.55 1.32 0.42 -1.54 -1.11 0.00 0.00 177.39 177.03