#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ddo s LYS 3003N 0.00 4.03 0.01 4.33 0.00 -1.26 -5.05 119.74 121.80 3ddo s LYS 3003Ca 0.00 1.92 0.01 0.00 0.00 0.00 0.00 55.97 57.91 3ddo s LYS 3003Cb 0.00 -2.70 -0.01 0.00 0.00 0.00 0.00 37.83 35.12 3ddo s LYS 3003CO 0.00 -0.36 -0.05 0.45 0.00 0.00 0.00 175.35 175.39 3ddo s SER 3004N -1.02 0.55 0.00 0.03 0.15 -1.26 -4.49 113.70 107.66 3ddo s SER 3004Ca 0.57 -0.18 0.26 0.00 0.70 0.00 0.00 55.95 57.29 3ddo s SER 3004Cb -0.33 -0.03 0.59 0.00 -1.71 0.00 0.00 66.02 64.54 3ddo s SER 3004CO 0.41 -0.01 1.46 0.47 1.20 0.00 0.00 173.24 176.77 3ddo n ASP 3005N 2.65 1.09 -4.22 5.45 8.00 0.35 -4.94 116.55 124.93 3ddo n ASP 3005Ca -0.15 -0.90 -0.13 0.00 0.71 0.00 0.00 54.79 54.33 3ddo n ASP 3005Cb 0.58 0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.80 3ddo n ASP 3005CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3ddo s VAL 3006N -2.58 0.57 0.14 2.53 -7.23 -1.24 -5.04 120.40 107.55 3ddo s VAL 3006Ca 0.21 -1.96 0.05 0.00 -1.81 0.00 0.00 61.98 58.47 3ddo s VAL 3006Cb 0.19 -2.10 -0.18 0.00 0.56 0.00 0.00 36.38 34.84 3ddo s VAL 3006CO 0.56 -0.48 1.32 -0.26 -0.31 0.00 0.00 175.10 175.94 3ddo h PHE 3007N 2.73 0.11 0.00 2.82 -1.00 -1.95 -3.41 116.94 116.24 3ddo h PHE 3007Ca -0.36 -0.07 -0.11 0.00 2.81 0.00 0.00 57.97 60.23 3ddo h PHE 3007Cb 1.20 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.73 3ddo h PHE 3007CO 0.52 0.98 -1.43 0.72 -1.61 0.00 0.00 178.31 177.48 3ddo n HIS 3008N -3.48 0.00 0.24 -0.55 8.25 -1.26 -4.81 115.22 113.60 3ddo n HIS 3008Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.58 3ddo n HIS 3008Cb 0.88 -0.30 0.30 0.00 1.12 0.00 0.00 29.99 32.00 3ddo n HIS 3008CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3ddo h LEU 3009N 0.00 0.00 -0.38 2.41 3.38 -1.92 -3.44 115.31 115.36 3ddo h LEU 3009Ca -0.17 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.61 3ddo h LEU 3009Cb 1.29 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.09 3ddo h LEU 3009CO -0.02 0.00 -0.31 0.61 0.09 0.00 0.00 178.44 178.81 3ddo n GLY 3010N 0.84 0.18 3.25 0.83 0.00 -1.26 -4.69 105.19 104.33 3ddo n GLY 3010Ca 0.03 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 3ddo n GLY 3010CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ddo s LEU 3011N -3.73 2.34 0.32 0.99 1.43 -1.26 -4.84 118.68 113.93 3ddo s LEU 3011Ca 0.21 -0.73 0.09 0.00 -1.03 0.00 0.00 54.13 52.67 3ddo s LEU 3011Cb -0.09 -0.70 -0.04 0.00 0.03 0.00 0.00 46.19 45.39 3ddo s LEU 3011CO 0.27 -0.04 0.10 0.42 0.23 0.00 0.00 176.35 177.32 3ddo s THR 3012N -1.57 3.09 0.28 5.49 -4.23 -1.26 -0.50 115.64 116.94 3ddo s THR 3012Ca 0.06 -1.76 -0.01 0.00 -1.18 0.00 0.00 61.69 58.80 3ddo s THR 3012Cb -0.08 -2.94 0.28 0.00 1.34 0.00 0.00 72.50 71.10 3ddo s THR 3012CO 0.04 -0.23 1.88 0.11 -0.54 0.00 0.00 174.62 175.88 3ddo h LYS 3013N 1.64 1.06 -0.92 3.99 1.57 -1.96 -1.99 116.57 119.96 3ddo h LYS 3013Ca -0.44 -0.06 0.12 0.00 -1.87 0.00 0.00 60.65 58.40 3ddo h LYS 3013Cb 1.25 -0.24 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 3ddo h LYS 3013CO 0.63 0.70 0.59 -0.97 -0.57 0.00 0.00 179.45 179.83 3ddo h ASN 3014N 1.09 0.79 -0.09 0.86 -1.24 -1.95 -0.81 115.58 114.22 3ddo h ASN 3014Ca 0.44 0.03 0.03 0.00 0.71 0.00 0.00 56.30 57.51 3ddo h ASN 3014Cb 0.27 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.19 3ddo h ASN 3014CO -0.19 0.43 0.07 0.44 -1.29 0.00 0.00 177.43 176.89 3ddo h ASP 3015N 0.85 0.01 1.77 1.15 3.32 -1.76 -2.37 116.42 119.39 3ddo h ASP 3015Ca 0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.50 3ddo h ASP 3015Cb 0.53 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 3ddo h ASP 3015CO -0.21 0.01 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.22 3ddo h LEU 3016N 0.01 0.00 -0.80 1.55 4.07 -1.20 -3.48 115.31 115.46 3ddo h LEU 3016Ca 0.04 -0.00 -0.50 0.00 0.08 0.00 0.00 57.88 57.50 3ddo h LEU 3016Cb 0.16 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 41.77 3ddo h LEU 3016CO -0.00 0.00 -0.76 0.00 -1.08 0.00 0.00 178.44 176.60 3ddo n GLN 3017N -2.76 -4.06 -0.49 1.13 6.02 -0.89 -1.20 117.38 115.12 3ddo n GLN 3017Ca 0.05 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 3ddo n GLN 3017Cb 0.49 -5.26 0.00 0.00 1.02 0.00 0.00 30.24 26.49 3ddo n GLN 3017CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ddo n GLY 3018N -1.47 0.75 3.70 1.08 0.00 -1.26 -4.61 105.19 103.38 3ddo n GLY 3018Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 3ddo n GLY 3018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddo n ALA 3019N -0.53 1.47 -0.06 4.61 0.00 -0.34 -4.88 120.51 120.78 3ddo n ALA 3019Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3ddo n ALA 3019Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.16 3ddo n ALA 3019CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3ddo n GLN 3020N 1.03 1.36 -4.69 0.00 6.02 -1.26 -4.27 117.38 115.58 3ddo n GLN 3020Ca 0.06 -0.32 -0.24 0.00 -0.01 0.00 0.00 57.00 56.49 3ddo n GLN 3020Cb 0.35 -0.80 -0.16 0.00 1.02 0.00 0.00 30.24 30.65 3ddo n GLN 3020CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3ddo s LEU 3021N -0.57 1.87 -0.04 1.08 0.20 -1.26 -0.58 118.68 119.37 3ddo s LEU 3021Ca 0.00 -0.30 0.05 0.00 0.69 0.00 0.00 54.13 54.57 3ddo s LEU 3021Cb 0.00 -0.84 -0.01 0.00 -0.43 0.00 0.00 46.19 44.91 3ddo s LEU 3021CO 0.00 0.12 -0.20 0.00 -0.29 0.00 0.00 176.35 175.98 3ddo s ALA 3022N 0.11 1.77 -0.14 5.97 0.00 -0.12 -1.42 121.76 127.92 3ddo s ALA 3022Ca -0.04 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.92 3ddo s ALA 3022Cb -0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 3ddo s ALA 3022CO 0.02 0.35 0.36 0.42 0.00 0.00 0.00 175.76 176.91 3ddo s ILE 3023N -0.14 5.26 -0.47 0.00 1.01 0.36 -0.98 121.20 126.24 3ddo s ILE 3023Ca -0.01 0.69 0.03 0.00 0.00 0.00 0.00 60.65 61.36 3ddo s ILE 3023Cb -0.11 -3.70 0.14 0.00 0.01 0.00 0.00 42.46 38.79 3ddo s ILE 3023CO 0.02 0.37 0.25 0.68 0.00 0.00 0.00 174.94 176.26 3ddo s VAL 3024N 0.48 1.72 0.80 2.92 -7.23 0.65 -1.28 120.40 118.45 3ddo s VAL 3024Ca 0.20 -2.79 -0.12 0.00 -1.81 0.00 0.00 61.98 57.46 3ddo s VAL 3024Cb -0.14 -2.20 0.07 0.00 0.56 0.00 0.00 36.38 34.68 3ddo s VAL 3024CO 0.06 -0.88 1.12 -2.16 -0.31 0.00 0.00 175.10 172.93 3ddo s PRO 3025N 0.14 2.06 -0.07 4.82 0.04 -1.24 -3.45 135.00 137.29 3ddo s PRO 3025Ca 0.18 0.45 -0.24 0.00 0.04 0.00 0.00 61.00 61.43 3ddo s PRO 3025Cb -0.24 -1.93 -0.29 0.00 0.04 0.00 0.00 34.50 32.08 3ddo s PRO 3025CO -0.01 -1.60 0.88 0.78 0.04 0.00 0.00 177.00 177.10 3ddo h GLY 3026N -1.07 0.25 -5.85 0.56 0.00 -1.84 -1.03 103.07 94.10 3ddo h GLY 3026Ca -0.47 -0.61 -0.59 0.00 0.00 0.00 0.00 47.33 45.65 3ddo h GLY 3026CO 0.62 0.54 0.19 -0.35 0.00 0.00 0.00 176.54 177.54 3ddo s ASP 3027N -6.72 6.75 0.53 0.19 -1.08 -1.26 -1.17 116.67 113.90 3ddo s ASP 3027Ca -0.15 0.92 0.27 0.00 -0.52 0.00 0.00 52.55 53.07 3ddo s ASP 3027Cb 0.00 -2.38 1.42 0.00 -1.46 0.00 0.00 42.92 40.50 3ddo s ASP 3027CO 0.79 -0.31 1.95 -0.65 0.52 0.00 0.00 175.17 177.47 3ddo h PRO 3028N 7.46 0.02 0.00 4.34 0.11 -1.89 -1.14 132.00 140.89 3ddo h PRO 3028Ca -0.31 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 3ddo h PRO 3028Cb 1.14 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ddo h PRO 3028CO 0.79 0.01 -0.09 1.49 -0.21 0.00 0.00 178.00 179.99 3ddo h GLU 3029N 0.02 0.00 0.00 1.05 4.81 -1.98 -2.37 114.58 116.11 3ddo h GLU 3029Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 3ddo h GLU 3029Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3ddo h GLU 3029CO -0.01 0.09 -0.26 0.54 -0.73 0.00 0.00 179.01 178.64 3ddo n ARG 3030N -3.39 0.09 0.12 1.92 1.74 -0.43 -4.31 116.66 112.40 3ddo n ARG 3030Ca -0.01 0.05 -0.14 0.00 -0.77 0.00 0.00 57.85 56.98 3ddo n ARG 3030Cb 0.26 -1.58 -0.08 0.00 -1.02 0.00 0.00 32.46 30.04 3ddo n ARG 3030CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3ddo h VAL 3031N 0.00 0.87 -0.87 1.55 2.07 -1.51 -2.10 116.25 116.26 3ddo h VAL 3031Ca 0.00 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.26 3ddo h VAL 3031Cb 0.58 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3ddo h VAL 3031CO 0.00 0.06 0.58 -0.08 0.02 0.00 0.00 177.57 178.15 3ddo h GLU 3032N -0.39 1.12 -0.62 1.57 4.81 -1.76 -1.05 114.58 118.26 3ddo h GLU 3032Ca -0.03 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.08 3ddo h GLU 3032Cb 0.30 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 3ddo h GLU 3032CO 0.04 0.74 0.16 0.87 -0.73 0.00 0.00 179.01 180.10 3ddo h LYS 3033N 1.15 0.98 -0.16 1.92 1.57 -1.71 0.44 116.57 120.76 3ddo h LYS 3033Ca 0.33 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3ddo h LYS 3033Cb -0.10 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.08 3ddo h LYS 3033CO -0.08 0.89 -0.10 0.82 -0.57 0.00 0.00 179.45 180.41 3ddo h ILE 3034N 0.90 1.32 -0.41 1.86 2.04 -1.12 -2.98 117.51 119.12 3ddo h ILE 3034Ca 0.20 -1.17 0.07 0.00 1.00 0.00 0.00 64.86 64.96 3ddo h ILE 3034Cb 0.34 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3ddo h ILE 3034CO -0.00 0.35 0.28 0.00 0.00 0.00 0.00 178.15 178.78 3ddo h ALA 3035N 0.66 2.09 0.00 1.87 0.00 -0.83 -2.14 119.26 120.91 3ddo h ALA 3035Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ddo h ALA 3035Cb 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3ddo h ALA 3035CO 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.10 3ddo h ALA 3036N 1.79 1.00 0.00 0.00 0.00 -0.75 -1.64 119.26 119.66 3ddo h ALA 3036Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3ddo h ALA 3036Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ddo h ALA 3036CO -0.03 0.00 -0.10 1.28 0.00 0.00 0.00 179.25 180.39 3ddo n LEU 3037N -2.66 0.11 -4.90 0.00 4.77 -0.81 -4.89 117.00 108.63 3ddo n LEU 3037Ca 0.00 0.40 -0.26 0.00 -0.03 0.00 0.00 56.01 56.13 3ddo n LEU 3037Cb 0.21 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 3ddo n LEU 3037CO 0.21 0.02 0.05 -0.04 -1.33 0.00 0.00 177.39 176.30 3ddo s MET 3038N -3.00 2.27 0.37 3.23 -1.94 -0.62 -5.12 119.30 114.50 3ddo s MET 3038Ca 0.13 -1.97 -0.16 0.00 -1.71 0.00 0.00 55.69 51.98 3ddo s MET 3038Cb 0.19 -2.12 -0.09 0.00 2.01 0.00 0.00 34.83 34.81 3ddo s MET 3038CO 0.57 -0.58 0.82 -0.51 -0.01 0.00 0.00 175.02 175.31 3ddo s ASP 3039N -4.26 6.78 -1.50 3.03 1.01 -0.32 -4.35 116.67 117.06 3ddo s ASP 3039Ca 0.36 1.40 -0.02 0.00 0.71 0.00 0.00 52.55 55.00 3ddo s ASP 3039Cb -0.02 -2.42 0.02 0.00 1.01 0.00 0.00 42.92 41.50 3ddo s ASP 3039CO 0.22 -0.30 0.25 0.29 0.21 0.00 0.00 175.17 175.84 3ddo n LYS 3040N -0.62 -2.13 -2.27 8.23 5.02 -1.26 -0.49 118.16 124.63 3ddo n LYS 3040Ca 0.05 0.25 -0.39 0.00 -2.02 0.00 0.00 58.31 56.19 3ddo n LYS 3040Cb 0.54 -4.13 -0.02 0.00 -0.02 0.00 0.00 35.03 31.39 3ddo n LYS 3040CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3ddo s PRO 3041N -6.98 4.25 -0.13 1.97 0.04 -1.26 -4.49 135.00 128.40 3ddo s PRO 3041Ca 0.06 1.94 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 3ddo s PRO 3041Cb -0.04 -2.88 0.03 0.00 0.04 0.00 0.00 34.50 31.65 3ddo s PRO 3041CO 0.95 -0.18 0.35 0.54 0.04 0.00 0.00 177.00 178.69 3ddo s VAL 3042N -1.29 -0.00 0.35 -0.36 0.11 -0.01 -5.00 120.40 114.20 3ddo s VAL 3042Ca 0.52 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.29 3ddo s VAL 3042Cb -0.34 -0.49 -0.11 0.00 -1.53 0.00 0.00 36.38 33.91 3ddo s VAL 3042CO 0.43 0.00 1.51 -0.75 -3.33 0.00 0.00 175.10 172.96 3ddo s LYS 3043N 0.19 4.12 0.00 1.54 2.47 -1.26 -0.79 119.74 126.01 3ddo s LYS 3043Ca -0.00 2.56 0.00 0.00 -1.56 0.00 0.00 55.97 56.97 3ddo s LYS 3043Cb -0.02 -2.99 0.00 0.00 -1.46 0.00 0.00 37.83 33.36 3ddo s LYS 3043CO 0.00 -0.55 0.00 1.28 0.16 0.00 0.00 175.35 176.25 3ddo n LEU 3044N 0.95 0.00 -3.85 5.43 4.77 0.39 -4.80 117.00 119.89 3ddo n LEU 3044Ca 0.03 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 3ddo n LEU 3044Cb 0.39 -0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 3ddo n LEU 3044CO 0.63 -0.30 -0.06 0.00 -1.33 0.00 0.00 177.39 176.34 3ddo s ALA 3045N -3.10 -0.26 -0.11 -1.18 0.00 -1.00 -4.98 121.76 111.13 3ddo s ALA 3045Ca 0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 51.96 51.32 3ddo s ALA 3045Cb 0.00 0.56 0.05 0.00 0.00 0.00 0.00 23.12 23.73 3ddo s ALA 3045CO 0.00 -0.54 0.08 0.45 0.00 0.00 0.00 175.76 175.75 3ddo s SER 3046N -2.87 1.71 -0.03 0.00 0.15 -1.26 -0.73 113.70 110.68 3ddo s SER 3046Ca 0.07 -0.25 -0.01 0.00 0.70 0.00 0.00 55.95 56.46 3ddo s SER 3046Cb 0.04 -0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.22 3ddo s SER 3046CO -0.09 -0.30 0.03 -1.00 1.20 0.00 0.00 173.24 173.08 3ddo s HIS 3047N 2.16 0.11 0.00 3.44 3.76 -0.51 -4.99 115.29 119.25 3ddo s HIS 3047Ca 0.04 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 3ddo s HIS 3047Cb -0.14 -0.36 0.00 0.00 1.11 0.00 0.00 32.58 33.19 3ddo s HIS 3047CO -0.06 -0.14 0.00 0.54 -0.85 0.00 0.00 174.74 174.23 3ddo n ARG 3048N 4.57 0.00 -0.08 1.40 5.12 -1.26 -0.95 116.66 125.46 3ddo n ARG 3048Ca -0.19 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 55.75 3ddo n ARG 3048Cb 0.50 0.00 0.05 0.00 -1.16 0.00 0.00 32.46 31.85 3ddo n ARG 3048CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 3ddo n GLU 3049N 14.00 1.35 -3.53 5.56 0.00 -1.26 -4.70 120.64 132.06 3ddo n GLU 3049Ca 0.00 -0.44 -0.42 0.00 0.00 0.00 0.00 57.16 56.31 3ddo n GLU 3049Cb 0.00 -1.21 -0.07 0.00 0.00 0.00 0.00 31.44 30.16 3ddo n GLU 3049CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 3ddo s PHE 3050N -1.72 3.50 -0.18 -1.84 0.08 -0.13 -3.73 117.98 113.97 3ddo s PHE 3050Ca 0.08 -2.09 -0.05 0.00 0.12 0.00 0.00 56.93 54.98 3ddo s PHE 3050Cb 0.05 -3.52 -0.03 0.00 -0.57 0.00 0.00 43.02 38.95 3ddo s PHE 3050CO 0.05 -0.96 0.01 0.99 -0.10 0.00 0.00 175.22 175.21 3ddo s THR 3051N 0.70 4.22 -0.02 0.64 2.01 -1.26 -1.43 115.64 120.49 3ddo s THR 3051Ca 0.12 -0.24 0.06 0.00 0.31 0.00 0.00 61.69 61.94 3ddo s THR 3051Cb -0.21 -2.88 -0.01 0.00 0.01 0.00 0.00 72.50 69.41 3ddo s THR 3051CO -0.03 0.46 -0.19 -0.94 -0.69 0.00 0.00 174.62 173.23 3ddo s SER 3052N 0.53 2.29 0.18 3.53 1.04 0.10 -1.45 113.70 119.92 3ddo s SER 3052Ca -0.00 -0.36 0.08 0.00 0.48 0.00 0.00 55.95 56.14 3ddo s SER 3052Cb -0.14 -0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.59 3ddo s SER 3052CO 0.02 0.22 -0.15 0.26 0.98 0.00 0.00 173.24 174.57 3ddo s TRP 3053N -0.34 1.69 0.12 5.02 0.52 0.11 -0.46 118.94 125.60 3ddo s TRP 3053Ca 0.05 -0.54 0.10 0.00 0.02 0.00 0.00 56.10 55.73 3ddo s TRP 3053Cb -0.09 -0.82 -0.04 0.00 -1.15 0.00 0.00 33.47 31.38 3ddo s TRP 3053CO 0.00 0.32 -0.24 0.50 0.02 0.00 0.00 176.95 177.55 3ddo s ARG 3054N -3.27 1.56 0.00 4.98 3.52 0.03 -0.91 118.95 124.85 3ddo s ARG 3054Ca 0.19 -1.27 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 3ddo s ARG 3054Cb -0.03 -1.97 0.00 0.00 -1.56 0.00 0.00 34.95 31.39 3ddo s ARG 3054CO 0.06 0.47 0.00 0.00 -0.81 0.00 0.00 175.30 175.02 3ddo n ALA 3055N 0.96 0.00 -2.88 6.12 0.00 0.16 -0.83 120.51 124.03 3ddo n ALA 3055Ca -0.17 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.13 3ddo n ALA 3055Cb 0.53 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.83 3ddo n ALA 3055CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3ddo s GLU 3056N -1.33 0.20 -0.10 0.00 2.12 0.35 -0.81 118.70 119.14 3ddo s GLU 3056Ca 0.00 -0.07 0.00 0.00 0.36 0.00 0.00 54.97 55.26 3ddo s GLU 3056Cb 0.00 -0.20 0.02 0.00 0.26 0.00 0.00 34.13 34.21 3ddo s GLU 3056CO 0.00 0.04 -0.07 -0.51 -0.54 0.00 0.00 175.26 174.17 3ddo s LEU 3057N 0.02 1.21 -1.60 2.70 1.43 0.32 -1.17 118.68 121.59 3ddo s LEU 3057Ca 0.00 -0.27 -0.15 0.00 -1.03 0.00 0.00 54.13 52.68 3ddo s LEU 3057Cb -0.02 -0.78 0.11 0.00 0.03 0.00 0.00 46.19 45.53 3ddo s LEU 3057CO -0.00 -0.10 0.86 0.47 0.23 0.00 0.00 176.35 177.81 3ddo n ASP 3058N 4.72 -3.79 0.00 2.29 10.43 -1.26 -0.74 116.55 128.21 3ddo n ASP 3058Ca -0.14 -0.90 0.00 0.00 2.57 0.00 0.00 54.79 56.32 3ddo n ASP 3058Cb 0.50 -3.34 0.00 0.00 1.84 0.00 0.00 41.12 40.12 3ddo n ASP 3058CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3ddo n GLY 3059N -1.57 1.15 3.59 0.44 0.00 -1.26 -5.02 105.19 102.52 3ddo n GLY 3059Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 3ddo n GLY 3059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ddo s LYS 3060N -0.05 3.24 0.39 1.61 1.02 0.09 -5.09 119.74 120.95 3ddo s LYS 3060Ca 0.00 -0.47 -0.27 0.00 0.02 0.00 0.00 55.97 55.25 3ddo s LYS 3060Cb 0.00 -2.82 -0.09 0.00 -0.52 0.00 0.00 37.83 34.39 3ddo s LYS 3060CO 0.00 0.51 1.34 0.00 -0.92 0.00 0.00 175.35 176.27 3ddo s ALA 3061N -0.35 3.35 0.03 5.17 0.00 -1.26 -0.52 121.76 128.17 3ddo s ALA 3061Ca 0.06 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.35 3ddo s ALA 3061Cb -0.12 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.47 3ddo s ALA 3061CO 0.02 -0.84 -0.09 0.08 0.00 0.00 0.00 175.76 174.94 3ddo s VAL 3062N -1.21 0.64 -0.05 0.00 1.01 0.01 -4.18 120.40 116.63 3ddo s VAL 3062Ca 0.55 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 3ddo s VAL 3062Cb -0.40 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 3ddo s VAL 3062CO 0.52 -0.12 0.03 -0.63 0.00 0.00 0.00 175.10 174.91 3ddo s ILE 3063N -0.83 4.48 -0.16 2.22 -1.09 -0.51 -0.67 121.20 124.65 3ddo s ILE 3063Ca -0.03 -0.34 0.01 0.00 -2.23 0.00 0.00 60.65 58.06 3ddo s ILE 3063Cb -0.07 -2.96 0.00 0.00 -1.58 0.00 0.00 42.46 37.86 3ddo s ILE 3063CO 0.00 0.49 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.34 3ddo s VAL 3064N -1.02 2.48 -0.07 2.92 1.01 -0.09 -0.49 120.40 125.14 3ddo s VAL 3064Ca 0.17 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3ddo s VAL 3064Cb -0.12 -2.04 0.04 0.00 0.00 0.00 0.00 36.38 34.27 3ddo s VAL 3064CO 0.07 0.52 0.16 0.00 0.00 0.00 0.00 175.10 175.85 3ddo s SER 3066N 1.48 6.16 -0.01 0.00 1.04 -0.53 -3.69 113.70 118.15 3ddo s SER 3066Ca -0.06 1.74 0.13 0.00 0.48 0.00 0.00 55.95 58.24 3ddo s SER 3066Cb -0.12 -2.53 -0.17 0.00 0.10 0.00 0.00 66.02 63.31 3ddo s SER 3066CO -0.06 -0.90 0.41 0.35 0.98 0.00 0.00 173.24 174.01 3ddo n THR 3067N -1.73 0.00 -2.61 2.02 -2.24 -0.39 -4.36 114.28 104.97 3ddo n THR 3067Ca 0.08 -0.25 0.01 0.00 -2.27 0.00 0.00 64.05 61.62 3ddo n THR 3067Cb 0.53 0.61 -0.00 0.00 -2.10 0.00 0.00 70.33 69.37 3ddo n THR 3067CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ddo n GLY 3068N 1.53 -2.03 3.69 3.38 0.00 -0.32 -3.38 105.19 108.06 3ddo n GLY 3068Ca 0.00 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.22 3ddo n GLY 3068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ddo s ILE 3069N -0.48 5.08 0.00 -0.61 1.01 -1.26 -4.70 121.20 120.25 3ddo s ILE 3069Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 60.65 61.81 3ddo s ILE 3069Cb 0.00 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.55 3ddo s ILE 3069CO 0.00 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.76 3ddo n GLY 3070N 3.48 1.58 0.35 6.18 0.00 -1.26 -4.55 105.19 110.96 3ddo n GLY 3070Ca -0.03 -1.87 -0.01 0.00 0.00 0.00 0.00 46.02 44.11 3ddo n GLY 3070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ddo h GLY 3071N 0.00 1.34 0.92 -0.02 0.00 -1.85 -2.21 103.07 101.25 3ddo h GLY 3071Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 3ddo h GLY 3071CO 0.00 0.39 0.11 -2.55 0.00 0.00 0.00 176.54 174.49 3ddo h PRO 3072N 1.16 0.34 -0.31 4.80 0.11 -1.94 0.21 132.00 136.38 3ddo h PRO 3072Ca 0.37 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.30 3ddo h PRO 3072Cb 0.00 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 3ddo h PRO 3072CO -0.12 0.35 -0.32 0.66 -0.21 0.00 0.00 178.00 178.36 3ddo h SER 3073N 0.25 0.69 -0.69 -2.05 4.64 -1.79 -2.75 113.55 111.84 3ddo h SER 3073Ca 0.08 -0.28 0.04 0.00 -0.47 0.00 0.00 61.79 61.16 3ddo h SER 3073Cb 0.12 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 61.98 3ddo h SER 3073CO -0.01 0.96 0.42 0.74 -0.87 0.00 0.00 176.83 178.08 3ddo h THR 3074N 0.56 1.07 -0.45 2.95 2.02 -1.09 -2.17 112.91 115.81 3ddo h THR 3074Ca 0.06 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 3ddo h THR 3074Cb 0.82 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 3ddo h THR 3074CO 0.07 0.15 0.20 0.77 0.37 0.00 0.00 175.52 177.07 3ddo h SER 3075N 0.82 0.57 -0.06 4.18 4.64 -0.30 -0.45 113.55 122.95 3ddo h SER 3075Ca 0.29 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 3ddo h SER 3075Cb 0.06 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3ddo h SER 3075CO -0.13 0.50 0.00 0.40 -0.87 0.00 0.00 176.83 176.74 3ddo h ILE 3076N 0.63 1.24 -0.36 0.95 2.04 -1.20 -2.26 117.51 118.56 3ddo h ILE 3076Ca 0.16 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 3ddo h ILE 3076Cb 0.10 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 3ddo h ILE 3076CO -0.02 0.20 0.19 0.00 0.00 0.00 0.00 178.15 178.52 3ddo h ALA 3077N 0.73 0.46 -0.27 1.87 0.00 -0.84 -1.71 119.26 119.50 3ddo h ALA 3077Ca 0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3ddo h ALA 3077Cb 0.32 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ddo h ALA 3077CO 0.00 -0.00 0.05 0.28 0.00 0.00 0.00 179.25 179.57 3ddo h VAL 3078N 0.45 1.23 -0.38 0.00 2.07 -1.16 0.49 116.25 118.95 3ddo h VAL 3078Ca 0.12 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.91 3ddo h VAL 3078Cb 0.08 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3ddo h VAL 3078CO -0.02 0.25 0.14 -0.08 0.02 0.00 0.00 177.57 177.88 3ddo h GLU 3079N 0.26 0.29 -0.03 1.57 4.57 -1.29 0.16 114.58 120.11 3ddo h GLU 3079Ca 0.08 -0.02 -0.22 0.00 -1.18 0.00 0.00 59.36 58.03 3ddo h GLU 3079Cb 0.33 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 3ddo h GLU 3079CO 0.00 0.19 -0.88 0.93 -1.18 0.00 0.00 179.01 178.08 3ddo h GLU 3080N 0.30 0.44 -0.89 1.92 5.08 -1.18 -0.85 114.58 119.41 3ddo h GLU 3080Ca 0.17 -0.43 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 3ddo h GLU 3080Cb 0.14 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 3ddo h GLU 3080CO -0.17 1.09 0.47 -0.07 -1.00 0.00 0.00 179.01 179.32 3ddo h LEU 3081N 0.26 1.12 -0.83 1.33 3.38 -0.78 -1.93 115.31 117.86 3ddo h LEU 3081Ca -0.07 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3ddo h LEU 3081Cb 1.50 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 3ddo h LEU 3081CO 0.15 0.91 0.41 0.00 0.09 0.00 0.00 178.44 180.00 3ddo h ALA 3082N 1.26 1.07 -0.70 1.53 0.00 -0.51 -0.99 119.26 120.93 3ddo h ALA 3082Ca 0.31 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3ddo h ALA 3082Cb 0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3ddo h ALA 3082CO -0.05 0.62 0.46 1.96 0.00 0.00 0.00 179.25 182.25 3ddo h GLN 3083N 1.17 0.85 0.00 0.00 4.20 -0.72 -1.36 115.11 119.25 3ddo h GLN 3083Ca 0.29 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.94 3ddo h GLN 3083Cb 0.11 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3ddo h GLN 3083CO -0.04 0.56 0.00 1.28 -0.67 0.00 0.00 178.83 179.96 3ddo n LEU 3084N -4.45 0.00 0.00 1.46 4.77 -0.77 -4.89 117.00 113.12 3ddo n LEU 3084Ca 0.08 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 3ddo n LEU 3084Cb 0.09 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 3ddo n LEU 3084CO 0.35 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3ddo n GLY 3085N 1.05 0.96 3.73 -0.72 0.00 -0.51 -4.79 105.19 104.91 3ddo n GLY 3085Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3ddo n GLY 3085CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ddo s ILE 3086N -2.00 3.60 0.00 -0.61 -1.09 -0.44 -4.50 121.20 116.16 3ddo s ILE 3086Ca 0.00 1.29 0.00 0.00 -2.23 0.00 0.00 60.65 59.71 3ddo s ILE 3086Cb 0.00 -3.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.05 3ddo s ILE 3086CO 0.00 0.18 0.00 0.54 -1.23 0.00 0.00 174.94 174.43 3ddo n ARG 3087N 2.87 3.93 -4.42 2.79 5.12 0.25 -4.20 116.66 123.01 3ddo n ARG 3087Ca 0.06 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.75 3ddo n ARG 3087Cb 0.45 -0.66 -0.16 0.00 -1.16 0.00 0.00 32.46 30.92 3ddo n ARG 3087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3ddo s THR 3088N -1.29 0.88 -0.10 0.55 2.01 -0.75 -0.83 115.64 116.11 3ddo s THR 3088Ca 0.00 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.68 3ddo s THR 3088Cb 0.00 -0.82 0.01 0.00 0.01 0.00 0.00 72.50 71.70 3ddo s THR 3088CO 0.00 0.29 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.72 3ddo s PHE 3089N 0.66 1.91 -0.27 4.92 0.08 0.60 -0.94 117.98 124.94 3ddo s PHE 3089Ca -0.12 -0.89 0.01 0.00 0.12 0.00 0.00 56.93 56.05 3ddo s PHE 3089Cb -0.14 -1.39 0.05 0.00 -0.57 0.00 0.00 43.02 40.97 3ddo s PHE 3089CO 0.02 -0.46 -0.06 -0.51 -0.10 0.00 0.00 175.22 174.11 3ddo s LEU 3090N 0.99 3.59 0.09 -0.37 1.43 -0.15 -1.35 118.68 122.91 3ddo s LEU 3090Ca -0.07 -1.30 -0.27 0.00 -1.03 0.00 0.00 54.13 51.46 3ddo s LEU 3090Cb -0.15 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.39 3ddo s LEU 3090CO -0.01 -0.21 0.84 -0.60 0.23 0.00 0.00 176.35 176.59 3ddo s ARG 3091N 1.18 4.59 -0.10 1.70 3.52 -0.28 -0.26 118.95 129.30 3ddo s ARG 3091Ca -0.07 1.22 0.02 0.00 -0.13 0.00 0.00 55.73 56.77 3ddo s ARG 3091Cb -0.20 -3.35 0.02 0.00 -1.56 0.00 0.00 34.95 29.86 3ddo s ARG 3091CO -0.03 0.32 -0.14 -1.50 -0.81 0.00 0.00 175.30 173.13 3ddo s ILE 3092N -0.26 1.40 0.30 4.11 1.10 -1.22 -1.41 121.20 125.22 3ddo s ILE 3092Ca 0.41 -0.58 0.04 0.00 -0.51 0.00 0.00 60.65 60.00 3ddo s ILE 3092Cb -0.22 -1.29 -0.04 0.00 0.15 0.00 0.00 42.46 41.06 3ddo s ILE 3092CO 0.26 0.42 0.18 -0.83 -2.11 0.00 0.00 174.94 172.87 3ddo s GLY 3093N 1.02 2.06 0.13 1.50 0.00 -0.71 -4.17 107.32 107.14 3ddo s GLY 3093Ca -0.06 -1.80 0.09 0.00 0.00 0.00 0.00 44.72 42.94 3ddo s GLY 3093CO -0.02 -1.54 -0.17 -0.51 0.00 0.00 0.00 173.10 170.87 3ddo s THR 3094N -3.64 2.90 0.14 0.90 -4.23 -1.26 -1.63 115.64 108.82 3ddo s THR 3094Ca 0.37 -1.53 -0.14 0.00 -1.18 0.00 0.00 61.69 59.21 3ddo s THR 3094Cb 0.05 -2.35 0.02 0.00 1.34 0.00 0.00 72.50 71.56 3ddo s THR 3094CO 0.19 0.07 0.37 0.28 -0.54 0.00 0.00 174.62 174.99 3ddo s THR 3095N -1.24 0.07 0.31 3.99 -1.32 0.11 -4.88 115.64 112.68 3ddo s THR 3095Ca 0.19 -0.84 -0.02 0.00 -1.21 0.00 0.00 61.69 59.82 3ddo s THR 3095Cb -0.10 -1.38 0.06 0.00 -1.51 0.00 0.00 72.50 69.58 3ddo s THR 3095CO 0.11 -0.33 0.43 0.61 -2.21 0.00 0.00 174.62 173.23 3ddo n GLY 3096N -0.22 0.21 3.05 6.08 0.00 -1.26 -0.46 105.19 112.59 3ddo n GLY 3096Ca -0.13 -1.91 -0.08 0.00 0.00 0.00 0.00 46.02 43.90 3ddo n GLY 3096CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddo s ALA 3097N -3.19 0.33 -0.28 4.61 0.00 -0.88 -4.53 121.76 117.81 3ddo s ALA 3097Ca 0.27 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 51.32 3ddo s ALA 3097Cb -0.01 0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.36 3ddo s ALA 3097CO 0.18 -0.29 0.67 0.44 0.00 0.00 0.00 175.76 176.77 3ddo n ILE 3098N 0.73 0.20 -3.81 0.00 -5.35 -0.17 -3.58 119.36 107.38 3ddo n ILE 3098Ca -0.18 -0.60 -0.36 0.00 -0.27 0.00 0.00 62.75 61.34 3ddo n ILE 3098Cb 0.59 0.94 -0.07 0.00 -1.74 0.00 0.00 39.64 39.36 3ddo n ILE 3098CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3ddo s GLN 3099N -0.36 3.75 0.51 6.28 -1.52 -1.24 -4.85 119.66 122.23 3ddo s GLN 3099Ca 0.03 -0.14 0.17 0.00 -1.95 0.00 0.00 55.36 53.47 3ddo s GLN 3099Cb 0.02 -3.28 1.24 0.00 -0.22 0.00 0.00 33.01 30.77 3ddo s GLN 3099CO 0.03 0.59 2.10 -1.35 -0.25 0.00 0.00 175.29 176.40 3ddo h PRO 3100N 5.64 0.08 -0.58 2.91 0.11 -1.94 -2.55 132.00 135.68 3ddo h PRO 3100Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3ddo h PRO 3100Cb 1.20 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3ddo h PRO 3100CO 0.65 0.05 0.00 0.72 -0.21 0.00 0.00 178.00 179.21 3ddo n HIS 3101N -4.49 1.50 -3.50 0.65 8.25 -1.26 -4.78 115.22 111.59 3ddo n HIS 3101Ca 0.01 -0.66 -0.40 0.00 -0.26 0.00 0.00 57.72 56.41 3ddo n HIS 3101Cb 0.22 -0.29 -0.10 0.00 1.12 0.00 0.00 29.99 30.93 3ddo n HIS 3101CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3ddo s ILE 3102N -2.09 5.26 0.13 1.59 1.01 -0.96 -5.07 121.20 121.06 3ddo s ILE 3102Ca 0.50 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 61.03 3ddo s ILE 3102Cb 0.34 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 3ddo s ILE 3102CO 0.21 -0.02 0.21 0.20 0.00 0.00 0.00 174.94 175.54 3ddo s ASN 3103N 1.73 6.06 0.19 3.58 0.01 -1.26 -4.86 114.94 120.38 3ddo s ASN 3103Ca 0.08 0.10 -0.33 0.00 -0.71 0.00 0.00 52.86 51.99 3ddo s ASN 3103Cb -0.17 -1.76 -0.14 0.00 0.41 0.00 0.00 41.25 39.59 3ddo s ASN 3103CO 0.11 0.09 1.47 0.52 -1.51 0.00 0.00 177.10 177.78 3ddo n VAL 3104N -0.24 0.46 0.00 1.60 0.31 -1.26 -1.27 118.33 117.92 3ddo n VAL 3104Ca -0.07 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3ddo n VAL 3104Cb 0.53 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 3ddo n VAL 3104CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ddo n GLY 3105N 2.73 2.69 3.77 2.92 0.00 0.59 -5.02 105.19 112.88 3ddo n GLY 3105Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 3ddo n GLY 3105CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ddo s ASP 3106N -1.27 4.37 -0.06 1.61 1.01 -0.39 -4.75 116.67 117.19 3ddo s ASP 3106Ca 0.00 1.62 0.03 0.00 0.71 0.00 0.00 52.55 54.91 3ddo s ASP 3106Cb 0.00 -2.35 -0.03 0.00 1.01 0.00 0.00 42.92 41.55 3ddo s ASP 3106CO 0.00 -2.09 -0.13 -0.69 0.21 0.00 0.00 175.17 172.47 3ddo s VAL 3107N -2.97 3.16 -0.13 -1.27 1.01 -0.03 -1.09 120.40 119.08 3ddo s VAL 3107Ca 0.61 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.92 3ddo s VAL 3107Cb -0.16 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 3ddo s VAL 3107CO 0.56 0.59 -0.16 -0.76 0.00 0.00 0.00 175.10 175.33 3ddo s LEU 3108N -0.66 2.50 -0.18 3.92 1.43 0.38 -0.75 118.68 125.31 3ddo s LEU 3108Ca 0.10 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3ddo s LEU 3108Cb -0.11 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 3ddo s LEU 3108CO 0.01 0.13 -0.07 -0.69 0.23 0.00 0.00 176.35 175.96 3ddo s VAL 3109N 0.54 3.39 -0.25 -1.59 1.01 -0.16 -0.80 120.40 122.53 3ddo s VAL 3109Ca -0.10 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 3ddo s VAL 3109Cb -0.16 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 3ddo s VAL 3109CO 0.04 0.47 0.42 -0.89 0.00 0.00 0.00 175.10 175.14 3ddo s THR 3110N 0.90 5.15 0.06 3.92 2.01 -0.74 -1.80 115.64 125.13 3ddo s THR 3110Ca -0.01 0.70 -0.02 0.00 0.31 0.00 0.00 61.69 62.66 3ddo s THR 3110Cb -0.15 -3.75 -0.27 0.00 0.01 0.00 0.00 72.50 68.35 3ddo s THR 3110CO 0.01 0.15 1.07 0.71 -0.69 0.00 0.00 174.62 175.87 3ddo h THR 3111N 5.32 1.42 -2.22 -0.82 1.35 -1.14 -3.40 112.91 113.42 3ddo h THR 3111Ca -0.32 -3.03 0.14 0.00 -0.55 0.00 0.00 66.41 62.65 3ddo h THR 3111Cb 1.16 2.87 -0.14 0.00 -1.73 0.00 0.00 68.15 70.31 3ddo h THR 3111CO 0.68 0.87 0.52 0.00 -0.25 0.00 0.00 175.52 177.34 3ddo s ALA 3112N -2.65 -1.82 0.06 6.62 0.00 -1.25 -0.69 121.76 122.03 3ddo s ALA 3112Ca -0.05 0.85 0.08 0.00 0.00 0.00 0.00 51.96 52.85 3ddo s ALA 3112Cb 0.07 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 3ddo s ALA 3112CO 0.87 -0.77 -0.23 -1.12 0.00 0.00 0.00 175.76 174.50 3ddo s SER 3113N -2.58 2.78 0.02 0.00 0.01 0.20 -2.01 113.70 112.12 3ddo s SER 3113Ca 0.07 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.44 3ddo s SER 3113Cb -0.01 -0.22 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 3ddo s SER 3113CO -0.06 0.18 1.29 -0.69 0.41 0.00 0.00 173.24 174.37 3ddo s VAL 3114N -0.88 3.89 -1.11 3.43 1.01 0.55 -4.34 120.40 122.96 3ddo s VAL 3114Ca 0.09 1.30 -0.16 0.00 0.00 0.00 0.00 61.98 63.21 3ddo s VAL 3114Cb -0.09 -3.83 0.15 0.00 0.00 0.00 0.00 36.38 32.60 3ddo s VAL 3114CO 0.03 0.04 1.33 -0.13 0.00 0.00 0.00 175.10 176.37 3ddo s ARG 3115N 1.81 3.90 -0.47 2.72 0.52 -1.26 -1.33 118.95 124.83 3ddo s ARG 3115Ca 0.60 -2.24 0.03 0.00 -0.52 0.00 0.00 55.73 53.60 3ddo s ARG 3115Cb -0.30 -5.03 0.58 0.00 0.52 0.00 0.00 34.95 30.72 3ddo s ARG 3115CO 0.27 -1.79 1.85 1.28 0.02 0.00 0.00 175.30 176.92 3ddo n LEU 3116N 6.10 6.50 -4.78 2.53 4.77 -0.21 -4.95 117.00 126.97 3ddo n LEU 3116Ca 0.32 -3.86 -0.33 0.00 -0.03 0.00 0.00 56.01 52.11 3ddo n LEU 3116Cb 0.45 -0.82 -0.07 0.00 -2.33 0.00 0.00 43.42 40.65 3ddo n LEU 3116CO 0.58 1.24 -0.24 1.51 -1.33 0.00 0.00 177.39 179.15 3ddo s ASP 3117N -1.74 4.16 -0.12 -1.43 -4.77 -1.19 -1.77 116.67 109.82 3ddo s ASP 3117Ca 0.57 -1.66 0.08 0.00 -3.30 0.00 0.00 52.55 48.23 3ddo s ASP 3117Cb 0.47 0.58 -0.13 0.00 -1.09 0.00 0.00 42.92 42.76 3ddo s ASP 3117CO 0.06 -0.89 -0.01 0.61 0.70 0.00 0.00 175.17 175.64 3ddo n GLY 3118N -1.30 -0.46 0.19 2.12 0.00 -1.26 -4.70 105.19 99.78 3ddo n GLY 3118Ca -0.20 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.69 3ddo n GLY 3118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddo h ALA 3119N 0.40 1.38 -0.65 4.61 0.00 -1.98 -2.50 119.26 120.53 3ddo h ALA 3119Ca -0.31 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.31 3ddo h ALA 3119Cb 1.64 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.33 3ddo h ALA 3119CO -0.00 0.46 0.43 0.66 0.00 0.00 0.00 179.25 180.80 3ddo h SER 3120N 0.00 0.65 0.43 0.00 4.64 -1.85 0.41 113.55 117.83 3ddo h SER 3120Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3ddo h SER 3120Cb 0.65 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3ddo h SER 3120CO 0.05 0.44 0.00 0.18 -0.87 0.00 0.00 176.83 176.63 3ddo n LEU 3121N -4.46 0.42 -0.08 5.97 4.77 -0.94 -1.12 117.00 121.55 3ddo n LEU 3121Ca 0.08 0.63 0.15 0.00 -0.03 0.00 0.00 56.01 56.84 3ddo n LEU 3121Cb 0.15 -0.61 0.71 0.00 -2.33 0.00 0.00 43.42 41.34 3ddo n LEU 3121CO 0.35 -0.58 0.95 1.41 -1.33 0.00 0.00 177.39 178.19 3ddo n HIS 3122N -2.00 0.00 0.00 -1.77 8.25 0.13 -4.03 115.22 115.80 3ddo n HIS 3122Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3ddo n HIS 3122Cb 0.15 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.09 3ddo n HIS 3122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3ddo n PHE 3123N -0.99 0.00 -3.62 4.41 3.72 -0.28 -5.08 117.46 115.62 3ddo n PHE 3123Ca 0.16 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.40 3ddo n PHE 3123Cb 0.24 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.71 3ddo n PHE 3123CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ddo s ALA 3124N -2.00 -1.41 0.93 4.37 0.00 -0.79 -5.00 121.76 117.86 3ddo s ALA 3124Ca 0.00 1.05 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 3ddo s ALA 3124Cb 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 23.12 23.15 3ddo s ALA 3124CO 0.00 -0.32 1.09 -1.25 0.00 0.00 0.00 175.76 175.28 3ddo s PRO 3125N -1.01 1.00 0.56 0.00 0.04 -1.26 -4.00 135.00 130.32 3ddo s PRO 3125Ca -0.10 0.88 0.24 0.00 0.04 0.00 0.00 61.00 62.06 3ddo s PRO 3125Cb -0.02 -1.77 1.50 0.00 0.04 0.00 0.00 34.50 34.25 3ddo s PRO 3125CO 0.07 -2.44 2.11 1.98 0.04 0.00 0.00 177.00 178.76 3ddo h MET 3126N -1.69 0.00 0.00 4.56 4.05 -1.94 -1.21 114.93 118.70 3ddo h MET 3126Ca -0.50 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 58.91 3ddo h MET 3126Cb 1.29 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.09 3ddo h MET 3126CO 0.53 0.00 -0.04 0.93 0.23 0.00 0.00 176.91 178.56 3ddo h GLU 3127N 0.00 0.00 -6.62 0.39 3.07 -2.03 -3.43 114.58 105.95 3ddo h GLU 3127Ca 0.09 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.44 3ddo h GLU 3127Cb 0.41 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 3ddo h GLU 3127CO -0.00 0.04 0.41 0.12 -1.40 0.00 0.00 179.01 178.18 3ddo s PHE 3128N -4.11 3.73 0.14 4.33 5.36 -0.46 -5.00 117.98 121.98 3ddo s PHE 3128Ca -0.03 1.72 -0.30 0.00 -0.96 0.00 0.00 56.93 57.36 3ddo s PHE 3128Cb 0.12 -3.14 -0.07 0.00 -0.34 0.00 0.00 43.02 39.59 3ddo s PHE 3128CO 0.51 -0.13 1.00 -1.25 -1.46 0.00 0.00 175.22 173.89 3ddo s PRO 3129N -0.24 4.68 -1.41 10.12 0.04 -1.26 -4.94 135.00 141.99 3ddo s PRO 3129Ca 0.48 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.91 3ddo s PRO 3129Cb -0.26 -3.34 0.07 0.00 0.04 0.00 0.00 34.50 31.01 3ddo s PRO 3129CO 0.32 0.20 2.10 0.00 0.04 0.00 0.00 177.00 179.66 3ddo n ALA 3130N 2.55 5.25 -2.79 8.56 0.00 -1.26 -4.74 120.51 128.08 3ddo n ALA 3130Ca 0.02 -3.95 -0.36 0.00 0.00 0.00 0.00 53.44 49.15 3ddo n ALA 3130Cb 0.48 -3.45 -0.08 0.00 0.00 0.00 0.00 19.45 16.40 3ddo n ALA 3130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ddo s VAL 3131N 2.86 4.96 0.56 0.00 0.11 -1.26 -0.63 120.40 127.00 3ddo s VAL 3131Ca 0.47 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.36 3ddo s VAL 3131Cb 0.12 -3.13 -0.05 0.00 -1.53 0.00 0.00 36.38 31.78 3ddo s VAL 3131CO -0.05 0.61 1.03 0.00 -3.33 0.00 0.00 175.10 173.36 3ddo s ALA 3132N -0.94 2.87 0.30 1.54 0.00 0.13 -4.65 121.76 121.01 3ddo s ALA 3132Ca 0.14 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.12 3ddo s ALA 3132Cb -0.12 -3.19 -0.10 0.00 0.00 0.00 0.00 23.12 19.72 3ddo s ALA 3132CO 0.03 -0.58 1.31 0.34 0.00 0.00 0.00 175.76 176.86 3ddo s ASP 3133N -2.91 6.82 0.16 0.00 2.15 0.24 -4.94 116.67 118.19 3ddo s ASP 3133Ca 0.62 2.61 -0.12 0.00 0.43 0.00 0.00 52.55 56.09 3ddo s ASP 3133Cb -0.14 -2.64 0.05 0.00 -0.30 0.00 0.00 42.92 39.90 3ddo s ASP 3133CO 0.35 -0.52 1.66 0.15 -0.17 0.00 0.00 175.17 176.63 3ddo h PHE 3134N 3.95 0.97 -0.75 -5.34 3.57 -1.96 -1.09 116.94 116.29 3ddo h PHE 3134Ca -0.48 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 60.85 3ddo h PHE 3134Cb 1.22 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 3ddo h PHE 3134CO 0.58 0.85 0.29 0.00 -2.23 0.00 0.00 178.31 177.80 3ddo h ALA 3135N 1.00 0.97 -0.23 2.41 0.00 -1.96 0.36 119.26 121.81 3ddo h ALA 3135Ca 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3ddo h ALA 3135Cb 0.39 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3ddo h ALA 3135CO 0.01 0.60 -0.00 0.00 0.00 0.00 0.00 179.25 179.86 3ddo h THR 3137N 0.18 1.22 -0.22 0.00 2.02 -1.06 -1.33 112.91 113.72 3ddo h THR 3137Ca 0.07 -0.54 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 3ddo h THR 3137Cb 0.41 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 3ddo h THR 3137CO 0.01 0.24 0.13 0.74 0.37 0.00 0.00 175.52 177.02 3ddo h THR 3138N 1.02 1.09 -0.92 3.16 2.02 -0.79 -0.82 112.91 117.68 3ddo h THR 3138Ca 0.26 -0.21 0.03 0.00 0.77 0.00 0.00 66.41 67.26 3ddo h THR 3138Cb 0.02 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 3ddo h THR 3138CO -0.04 0.08 0.60 0.00 0.37 0.00 0.00 175.52 176.53 3ddo h ALA 3139N 1.04 1.20 -0.32 6.16 0.00 -0.78 -0.48 119.26 126.08 3ddo h ALA 3139Ca 0.08 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3ddo h ALA 3139Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3ddo h ALA 3139CO -0.02 0.49 -0.16 -0.07 0.00 0.00 0.00 179.25 179.49 3ddo h LEU 3140N 1.18 0.71 -0.58 0.00 3.38 -0.96 -0.62 115.31 118.41 3ddo h LEU 3140Ca 0.36 -0.41 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 3ddo h LEU 3140Cb -0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3ddo h LEU 3140CO -0.11 0.96 0.06 0.58 0.09 0.00 0.00 178.44 180.02 3ddo h VAL 3141N 0.45 1.26 -0.09 1.22 2.07 -0.89 -0.84 116.25 119.43 3ddo h VAL 3141Ca 0.07 -1.04 -0.14 0.00 0.82 0.00 0.00 66.70 66.42 3ddo h VAL 3141Cb 0.70 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3ddo h VAL 3141CO 0.05 0.38 -0.54 -0.33 0.02 0.00 0.00 177.57 177.14 3ddo h GLU 3142N 0.87 0.26 -0.20 1.57 5.08 -1.01 -1.59 114.58 119.56 3ddo h GLU 3142Ca 0.17 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 3ddo h GLU 3142Cb 0.47 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3ddo h GLU 3142CO 0.02 0.74 0.02 0.00 -1.00 0.00 0.00 179.01 178.78 3ddo h ALA 3143N 1.23 0.27 -0.91 3.43 0.00 -0.86 -1.22 119.26 121.20 3ddo h ALA 3143Ca 0.00 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.78 3ddo h ALA 3143Cb 1.02 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 3ddo h ALA 3143CO 0.09 -0.04 0.58 0.00 0.00 0.00 0.00 179.25 179.87 3ddo h ALA 3144N 0.81 1.24 -0.11 0.00 0.00 -1.00 -1.78 119.26 118.43 3ddo h ALA 3144Ca 0.06 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3ddo h ALA 3144Cb 0.35 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ddo h ALA 3144CO 0.01 0.36 -0.36 -0.22 0.00 0.00 0.00 179.25 179.03 3ddo h LYS 3145N 1.07 0.22 0.00 0.00 3.64 -1.15 -1.68 116.57 118.67 3ddo h LYS 3145Ca 0.39 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.63 3ddo h LYS 3145Cb 0.13 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3ddo h LYS 3145CO -0.16 0.56 -0.22 0.66 -2.27 0.00 0.00 179.45 178.03 3ddo h SER 3146N 0.19 0.00 -0.30 4.20 4.64 -0.32 -2.75 113.55 119.22 3ddo h SER 3146Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3ddo h SER 3146Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3ddo h SER 3146CO 0.06 0.22 0.00 2.30 -0.87 0.00 0.00 176.83 178.53 3ddo n ILE 3147N -3.65 0.65 -1.81 0.95 -5.35 -1.09 -5.00 119.36 104.06 3ddo n ILE 3147Ca -0.01 -0.82 -0.08 0.00 -0.27 0.00 0.00 62.75 61.57 3ddo n ILE 3147Cb 0.34 0.78 -0.01 0.00 -1.74 0.00 0.00 39.64 39.01 3ddo n ILE 3147CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ddo n GLY 3148N 0.81 0.38 3.78 3.28 0.00 -0.89 -5.01 105.19 107.54 3ddo n GLY 3148Ca 0.13 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 3ddo n GLY 3148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddo s ALA 3149N -2.34 2.75 -0.47 4.61 0.00 -0.69 -4.98 121.76 120.65 3ddo s ALA 3149Ca 0.00 0.76 -0.27 0.00 0.00 0.00 0.00 51.96 52.45 3ddo s ALA 3149Cb 0.00 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.82 3ddo s ALA 3149CO 0.00 -0.63 1.03 0.99 0.00 0.00 0.00 175.76 177.15 3ddo s THR 3150N -1.83 4.33 -0.06 0.00 2.01 -1.26 -4.75 115.64 114.08 3ddo s THR 3150Ca 0.71 0.97 0.04 0.00 0.31 0.00 0.00 61.69 63.72 3ddo s THR 3150Cb -0.22 -4.52 -0.02 0.00 0.01 0.00 0.00 72.50 67.75 3ddo s THR 3150CO 0.25 -0.93 -0.16 -0.89 -0.69 0.00 0.00 174.62 172.20 3ddo s THR 3151N 4.12 2.92 -0.06 -0.82 2.01 -1.26 -0.85 115.64 121.70 3ddo s THR 3151Ca 0.42 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.70 3ddo s THR 3151Cb -0.09 -2.14 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 3ddo s THR 3151CO 0.29 0.58 -0.21 -1.00 -0.69 0.00 0.00 174.62 173.59 3ddo s HIS 3152N -0.57 2.53 -0.16 4.92 3.76 0.07 -4.96 115.29 120.88 3ddo s HIS 3152Ca 0.08 -0.56 0.01 0.00 -0.15 0.00 0.00 55.06 54.44 3ddo s HIS 3152Cb -0.11 -1.62 0.02 0.00 1.11 0.00 0.00 32.58 31.97 3ddo s HIS 3152CO 0.01 -0.11 -0.16 0.08 -0.85 0.00 0.00 174.74 173.71 3ddo s VAL 3153N -0.28 1.74 -1.70 -0.90 1.01 -1.26 -0.99 120.40 118.02 3ddo s VAL 3153Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3ddo s VAL 3153Cb -0.13 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.64 3ddo s VAL 3153CO 0.03 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.22 3ddo n GLY 3154N 4.68 -0.71 3.85 4.51 0.00 -0.75 -4.94 105.19 111.82 3ddo n GLY 3154Ca -0.18 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 3ddo n GLY 3154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ddo s VAL 3155N -4.00 5.05 0.02 1.61 1.01 -1.26 -0.50 120.40 122.32 3ddo s VAL 3155Ca 0.00 0.72 0.09 0.00 0.00 0.00 0.00 61.98 62.79 3ddo s VAL 3155Cb 0.00 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 3ddo s VAL 3155CO 0.00 0.48 -0.26 -0.89 0.00 0.00 0.00 175.10 174.44 3ddo s THR 3156N -1.19 2.05 -0.19 3.92 2.01 -0.85 -0.63 115.64 120.76 3ddo s THR 3156Ca 0.27 -1.25 -0.17 0.00 0.31 0.00 0.00 61.69 60.85 3ddo s THR 3156Cb -0.16 -1.73 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 3ddo s THR 3156CO 0.15 0.44 0.44 0.00 -0.69 0.00 0.00 174.62 174.95 3ddo s ALA 3157N -0.72 3.54 -0.30 7.40 0.00 0.20 -0.33 121.76 131.57 3ddo s ALA 3157Ca 0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.61 3ddo s ALA 3157Cb -0.10 -2.67 0.05 0.00 0.00 0.00 0.00 23.12 20.40 3ddo s ALA 3157CO 0.01 -0.29 -0.01 0.45 0.00 0.00 0.00 175.76 175.92 3ddo s SER 3158N 1.00 4.82 -0.07 0.00 0.15 -0.44 -1.30 113.70 117.86 3ddo s SER 3158Ca 0.21 -1.32 -0.01 0.00 0.70 0.00 0.00 55.95 55.53 3ddo s SER 3158Cb -0.15 -1.69 -0.03 0.00 -1.71 0.00 0.00 66.02 62.44 3ddo s SER 3158CO 0.09 -0.26 -0.01 -0.55 1.20 0.00 0.00 173.24 173.71 3ddo s SER 3159N 1.24 5.09 0.00 5.45 0.15 0.34 -1.04 113.70 124.92 3ddo s SER 3159Ca -0.05 0.09 0.20 0.00 0.70 0.00 0.00 55.95 56.88 3ddo s SER 3159Cb -0.20 -1.39 0.93 0.00 -1.71 0.00 0.00 66.02 63.66 3ddo s SER 3159CO -0.02 0.36 1.62 0.47 1.20 0.00 0.00 173.24 176.87 3ddo n ASP 3160N 2.06 0.00 -4.19 5.45 9.92 -0.73 -4.32 116.55 124.75 3ddo n ASP 3160Ca -0.18 0.19 -0.15 0.00 -0.53 0.00 0.00 54.79 54.12 3ddo n ASP 3160Cb 0.53 -0.37 -0.11 0.00 -0.64 0.00 0.00 41.12 40.54 3ddo n ASP 3160CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3ddo s THR 3161N -2.73 1.04 0.02 -3.53 -4.23 -1.26 -5.02 115.64 99.93 3ddo s THR 3161Ca 0.15 -1.63 0.10 0.00 -1.18 0.00 0.00 61.69 59.13 3ddo s THR 3161Cb 0.13 -1.37 -0.17 0.00 1.34 0.00 0.00 72.50 72.43 3ddo s THR 3161CO 0.32 -0.50 1.13 0.15 -0.54 0.00 0.00 174.62 175.18 3ddo h PHE 3162N 3.60 0.00 0.00 3.99 3.57 -1.97 -3.39 116.94 122.74 3ddo h PHE 3162Ca -0.38 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.12 3ddo h PHE 3162Cb 1.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.93 3ddo h PHE 3162CO 0.64 0.89 0.00 0.66 -2.23 0.00 0.00 178.31 178.27 3ddo n TYR 3163N -3.23 0.00 0.03 0.41 4.01 -1.26 -4.41 117.16 112.71 3ddo n TYR 3163Ca -0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.69 3ddo n TYR 3163Cb 0.93 0.00 0.28 0.00 -0.31 0.00 0.00 39.34 40.23 3ddo n TYR 3163CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ddo h PRO 3164N 0.00 0.45 0.00 -0.72 0.13 -1.88 -1.25 132.00 128.73 3ddo h PRO 3164Ca 0.00 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 3ddo h PRO 3164Cb 0.00 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.08 3ddo h PRO 3164CO 0.00 0.57 0.00 0.78 -0.23 0.00 0.00 178.00 179.12 3ddo h GLY 3165N 0.90 0.00 -2.67 1.56 0.00 -1.87 0.88 103.07 101.86 3ddo h GLY 3165Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3ddo h GLY 3165CO 0.03 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.51 3ddo n GLN 3166N -2.78 3.98 -3.99 4.80 6.02 -0.70 -4.94 117.38 119.78 3ddo n GLN 3166Ca 0.00 -2.99 -0.27 0.00 -0.01 0.00 0.00 57.00 53.73 3ddo n GLN 3166Cb 0.21 -2.05 -0.02 0.00 1.02 0.00 0.00 30.24 29.41 3ddo n GLN 3166CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3ddo n GLU 3167N 0.20 -3.46 -3.31 -1.09 2.13 0.30 -4.92 120.64 110.50 3ddo n GLU 3167Ca 0.25 0.42 -0.38 0.00 0.66 0.00 0.00 57.16 58.10 3ddo n GLU 3167Cb 1.04 -4.70 -0.06 0.00 0.27 0.00 0.00 31.44 27.99 3ddo n GLU 3167CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3ddo s ARG 3168N -6.60 4.31 0.00 5.31 0.52 -0.56 -4.96 118.95 116.97 3ddo s ARG 3168Ca 0.16 0.50 0.15 0.00 -0.52 0.00 0.00 55.73 56.02 3ddo s ARG 3168Cb -0.09 -3.41 -0.07 0.00 0.52 0.00 0.00 34.95 31.91 3ddo s ARG 3168CO 0.89 0.22 0.74 0.66 0.02 0.00 0.00 175.30 177.83 3ddo n TYR 3169N 3.41 0.00 -1.88 -0.53 4.01 -1.26 -4.42 117.16 116.49 3ddo n TYR 3169Ca -0.07 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.25 3ddo n TYR 3169Cb 0.52 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.54 3ddo n TYR 3169CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3ddo n ASP 3170N -0.62 5.35 -4.01 7.72 3.85 -1.26 -4.18 116.55 123.41 3ddo n ASP 3170Ca 0.05 -2.92 -0.15 0.00 -0.71 0.00 0.00 54.79 51.07 3ddo n ASP 3170Cb 0.28 -1.56 -0.10 0.00 -1.35 0.00 0.00 41.12 38.40 3ddo n ASP 3170CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 3ddo s THR 3171N 1.75 0.08 0.18 2.12 -4.23 -1.26 -5.01 115.64 109.26 3ddo s THR 3171Ca 0.49 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.82 3ddo s THR 3171Cb 0.14 -2.51 0.12 0.00 1.34 0.00 0.00 72.50 71.58 3ddo s THR 3171CO -0.06 0.00 1.64 0.22 -0.54 0.00 0.00 174.62 175.88 3ddo h TYR 3172N 2.45 -0.44 0.00 3.99 3.20 -1.99 -2.88 116.97 121.30 3ddo h TYR 3172Ca -0.34 0.05 -0.19 0.00 3.14 0.00 0.00 58.73 61.39 3ddo h TYR 3172Cb 1.25 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 39.75 3ddo h TYR 3172CO 0.73 -0.26 -1.16 0.66 -1.64 0.00 0.00 178.16 176.49 3ddo h SER 3173N -0.09 0.00 -0.03 -2.11 4.64 -1.97 -3.47 113.55 110.52 3ddo h SER 3173Ca 0.21 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 3ddo h SER 3173Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 3ddo h SER 3173CO -0.50 0.75 -0.01 0.61 -0.87 0.00 0.00 176.83 176.81 3ddo n GLY 3174N 1.38 0.27 3.54 -0.77 0.00 -1.09 -4.99 105.19 103.53 3ddo n GLY 3174Ca -0.06 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 3ddo n GLY 3174CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ddo s ARG 3175N -1.27 1.98 -0.08 1.61 1.70 -1.26 -4.89 118.95 116.74 3ddo s ARG 3175Ca 0.00 -1.11 0.02 0.00 -0.47 0.00 0.00 55.73 54.18 3ddo s ARG 3175Cb 0.00 -2.21 0.01 0.00 -0.57 0.00 0.00 34.95 32.18 3ddo s ARG 3175CO 0.00 0.49 -0.15 0.08 -1.08 0.00 0.00 175.30 174.64 3ddo s VAL 3176N -1.22 1.36 0.62 4.99 1.01 -1.26 -4.91 120.40 120.99 3ddo s VAL 3176Ca 0.20 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 3ddo s VAL 3176Cb -0.11 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 3ddo s VAL 3176CO 0.12 0.41 1.07 0.55 0.00 0.00 0.00 175.10 177.25 3ddo n VAL 3177N 3.85 4.17 -0.31 2.92 3.14 -1.26 -4.56 118.33 126.29 3ddo n VAL 3177Ca -0.21 -0.50 0.10 0.00 -2.96 0.00 0.00 64.34 60.77 3ddo n VAL 3177Cb 0.52 -1.26 0.23 0.00 -1.06 0.00 0.00 33.84 32.27 3ddo n VAL 3177CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 3ddo h ARG 3178N 0.46 0.06 -0.96 1.45 2.43 -2.00 0.72 114.38 116.55 3ddo h ARG 3178Ca -0.49 -0.00 0.20 0.00 -0.81 0.00 0.00 59.98 58.88 3ddo h ARG 3178Cb 1.36 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.81 3ddo h ARG 3178CO 0.51 0.04 0.61 -0.09 -1.51 0.00 0.00 179.97 179.54 3ddo h ARG 3179N 0.06 0.52 -0.01 0.20 2.43 -2.02 -2.38 114.38 113.18 3ddo h ARG 3179Ca 0.52 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 3ddo h ARG 3179Cb 1.00 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 3ddo h ARG 3179CO -0.81 0.35 -0.36 1.19 -1.51 0.00 0.00 179.97 178.82 3ddo n PHE 3180N -4.60 0.00 -2.05 2.20 3.72 0.20 -4.75 117.46 112.17 3ddo n PHE 3180Ca 0.21 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.19 3ddo n PHE 3180Cb 0.67 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.18 3ddo n PHE 3180CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3ddo s LYS 3181N -2.11 4.20 0.00 -1.08 2.20 -0.89 -1.81 119.74 120.25 3ddo s LYS 3181Ca 0.16 2.14 0.00 0.00 -0.36 0.00 0.00 55.97 57.92 3ddo s LYS 3181Cb 0.15 -3.86 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 3ddo s LYS 3181CO 0.46 -0.78 0.00 0.41 -0.36 0.00 0.00 175.35 175.07 3ddo n GLY 3182N 4.01 0.72 0.19 5.54 0.00 -1.26 -4.93 105.19 109.46 3ddo n GLY 3182Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 3ddo n GLY 3182CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ddo h SER 3183N 0.00 0.61 -0.56 1.61 4.64 -1.65 -2.95 113.55 115.25 3ddo h SER 3183Ca 0.00 -0.39 -0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3ddo h SER 3183Cb 0.00 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 3ddo h SER 3183CO 0.00 1.14 0.34 -0.03 -0.87 0.00 0.00 176.83 177.41 3ddo h MET 3184N 0.36 0.76 -0.55 4.77 -1.53 -1.91 -0.51 114.93 116.32 3ddo h MET 3184Ca -0.03 -0.07 -0.04 0.00 -3.44 0.00 0.00 59.70 56.12 3ddo h MET 3184Cb 1.30 -0.16 -0.03 0.00 -0.55 0.00 0.00 31.60 32.16 3ddo h MET 3184CO 0.13 0.54 0.17 1.49 0.14 0.00 0.00 176.91 179.38 3ddo h GLU 3185N 0.76 0.83 -0.09 0.39 4.81 -1.97 0.37 114.58 119.68 3ddo h GLU 3185Ca 0.20 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3ddo h GLU 3185Cb -0.03 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 3ddo h GLU 3185CO -0.04 0.72 0.05 0.93 -0.73 0.00 0.00 179.01 179.94 3ddo h GLU 3186N 0.80 0.12 -0.55 1.92 5.08 -1.20 -1.08 114.58 119.67 3ddo h GLU 3186Ca 0.18 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 3ddo h GLU 3186Cb 0.24 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 3ddo h GLU 3186CO -0.01 0.15 0.09 -1.49 -1.00 0.00 0.00 179.01 176.76 3ddo h TRP 3187N 0.05 0.92 -0.49 4.33 -0.00 -0.66 -1.85 115.95 118.26 3ddo h TRP 3187Ca 0.03 -0.11 0.01 0.00 -0.00 0.00 0.00 58.89 58.82 3ddo h TRP 3187Cb 0.07 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 28.94 3ddo h TRP 3187CO -0.05 0.79 0.32 0.37 -0.00 0.00 0.00 178.44 179.88 3ddo h GLN 3188N 0.83 0.64 0.00 0.49 4.15 -0.76 -1.14 115.11 119.32 3ddo h GLN 3188Ca 0.17 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 3ddo h GLN 3188Cb 0.37 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.91 3ddo h GLN 3188CO 0.01 0.42 -0.15 0.00 -1.93 0.00 0.00 178.83 177.18 3ddo h ALA 3189N 1.18 1.38 -0.22 3.38 0.00 -0.70 -1.74 119.26 122.54 3ddo h ALA 3189Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ddo h ALA 3189Cb -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3ddo h ALA 3189CO -0.04 0.19 0.00 -1.33 0.00 0.00 0.00 179.25 178.07 3ddo n MET 3190N -3.82 1.82 -0.72 0.00 2.81 -0.74 -4.93 117.12 111.55 3ddo n MET 3190Ca -0.02 -1.25 0.00 0.00 -1.81 0.00 0.00 57.70 54.62 3ddo n MET 3190Cb 0.25 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 3ddo n MET 3190CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ddo n GLY 3191N 1.16 0.68 3.75 3.03 0.00 -0.65 -5.02 105.19 108.14 3ddo n GLY 3191Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3ddo n GLY 3191CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ddo s VAL 3192N -2.28 2.39 0.03 1.61 1.01 -0.51 -4.63 120.40 118.03 3ddo s VAL 3192Ca 0.00 0.32 -0.14 0.00 0.00 0.00 0.00 61.98 62.16 3ddo s VAL 3192Cb 0.00 -3.21 -0.35 0.00 0.00 0.00 0.00 36.38 32.82 3ddo s VAL 3192CO 0.00 0.05 1.01 0.24 0.00 0.00 0.00 175.10 176.40 3ddo h MET 3193N 5.09 0.51 -2.26 2.72 0.00 -1.20 -3.41 114.93 116.38 3ddo h MET 3193Ca -0.46 -0.87 0.16 0.00 0.00 0.00 0.00 59.70 58.52 3ddo h MET 3193Cb 1.22 0.33 -0.11 0.00 0.00 0.00 0.00 31.60 33.03 3ddo h MET 3193CO 0.80 1.42 0.51 0.54 0.00 0.00 0.00 176.91 180.17 3ddo s ASN 3194N -7.54 -0.25 -0.04 1.22 4.22 -1.26 -1.00 114.94 110.29 3ddo s ASN 3194Ca -0.09 -0.21 -0.02 0.00 -2.14 0.00 0.00 52.86 50.41 3ddo s ASN 3194Cb 0.04 0.42 -0.04 0.00 1.28 0.00 0.00 41.25 42.96 3ddo s ASN 3194CO 0.94 -0.74 0.07 -0.31 -2.04 0.00 0.00 177.10 175.01 3ddo s TYR 3195N -3.16 3.29 0.00 1.54 2.02 -1.26 -0.63 117.35 119.15 3ddo s TYR 3195Ca 0.09 0.24 0.00 0.00 -0.37 0.00 0.00 57.07 57.03 3ddo s TYR 3195Cb -0.01 -1.77 0.00 0.00 -0.40 0.00 0.00 41.96 39.78 3ddo s TYR 3195CO -0.03 0.55 0.00 -0.85 -1.57 0.00 0.00 175.55 173.65 3ddo n GLU 3196N 1.52 0.00 0.00 -0.62 -0.00 -0.42 -4.51 120.64 116.61 3ddo n GLU 3196Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.01 3ddo n GLU 3196Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 3ddo n GLU 3196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 3ddo n MET 3197N 0.00 -0.21 0.00 3.44 2.81 -1.26 -0.51 117.12 121.39 3ddo n MET 3197Ca 0.00 -0.40 0.00 0.00 -1.81 0.00 0.00 57.70 55.49 3ddo n MET 3197Cb 0.00 -0.78 0.00 0.00 -0.71 0.00 0.00 33.22 31.73 3ddo n MET 3197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3ddo n GLU 3198N -0.04 1.72 0.09 0.03 4.71 -1.26 -3.41 120.64 122.48 3ddo n GLU 3198Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.16 57.10 3ddo n GLU 3198Cb 0.15 -0.84 0.10 0.00 -1.01 0.00 0.00 31.44 29.84 3ddo n GLU 3198CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 3ddo h SER 3199N 0.00 0.21 -0.65 1.62 4.64 -1.94 -1.73 113.55 115.70 3ddo h SER 3199Ca 0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 3ddo h SER 3199Cb 0.00 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 3ddo h SER 3199CO 0.00 0.82 0.42 0.00 -0.87 0.00 0.00 176.83 177.19 3ddo h ALA 3200N 1.18 0.82 0.01 5.18 0.00 -1.86 0.13 119.26 124.71 3ddo h ALA 3200Ca -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3ddo h ALA 3200Cb 1.21 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3ddo h ALA 3200CO 0.10 0.27 -0.00 1.15 0.00 0.00 0.00 179.25 180.76 3ddo h THR 3201N 0.88 1.27 -0.04 0.00 2.02 -1.88 -1.95 112.91 113.21 3ddo h THR 3201Ca 0.24 -0.82 0.03 0.00 0.77 0.00 0.00 66.41 66.62 3ddo h THR 3201Cb -0.07 1.82 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 3ddo h THR 3201CO -0.05 0.21 -0.14 0.25 0.37 0.00 0.00 175.52 176.17 3ddo h LEU 3202N -0.36 -0.40 -0.35 2.58 5.85 -1.12 -1.10 115.31 120.40 3ddo h LEU 3202Ca -0.00 0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.61 3ddo h LEU 3202Cb 0.36 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 3ddo h LEU 3202CO 0.00 -0.19 -0.47 -0.07 -0.34 0.00 0.00 178.44 177.38 3ddo h LEU 3203N -0.21 0.99 -0.30 2.25 3.38 -0.80 -1.78 115.31 118.84 3ddo h LEU 3203Ca 0.06 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 3ddo h LEU 3203Cb 0.29 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3ddo h LEU 3203CO -0.16 1.29 0.01 0.74 0.09 0.00 0.00 178.44 180.41 3ddo h THR 3204N 0.72 1.25 -0.02 0.22 2.02 -1.28 0.01 112.91 115.82 3ddo h THR 3204Ca 0.04 -0.92 -0.10 0.00 0.77 0.00 0.00 66.41 66.20 3ddo h THR 3204Cb 1.07 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 3ddo h THR 3204CO 0.11 0.30 -0.45 0.00 0.37 0.00 0.00 175.52 175.85 3ddo h MET 3205N 0.32 0.05 0.03 6.66 -0.00 -1.13 -2.16 114.93 118.70 3ddo h MET 3205Ca 0.09 -0.03 -0.08 0.00 -0.00 0.00 0.00 59.70 59.68 3ddo h MET 3205Cb 0.42 -0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.03 3ddo h MET 3205CO 0.01 0.49 -0.35 0.00 -0.00 0.00 0.00 176.91 177.07 3ddo h ALA 3207N 0.17 1.38 -0.41 0.00 0.00 -0.91 -1.51 119.26 117.97 3ddo h ALA 3207Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ddo h ALA 3207Cb 1.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3ddo h ALA 3207CO 0.07 0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.24 3ddo n SER 3208N -3.68 3.43 -0.46 0.00 3.41 -0.82 -4.41 113.62 111.09 3ddo n SER 3208Ca -0.03 -1.97 0.03 0.00 -0.26 0.00 0.00 58.87 56.64 3ddo n SER 3208Cb 0.14 -0.27 0.04 0.00 -0.26 0.00 0.00 64.21 63.86 3ddo n SER 3208CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ddo n GLN 3209N 1.42 0.35 -1.85 4.33 6.02 -0.88 -5.01 117.38 121.76 3ddo n GLN 3209Ca 0.19 -1.50 -0.09 0.00 -0.01 0.00 0.00 57.00 55.58 3ddo n GLN 3209Cb 0.58 -0.74 -0.02 0.00 1.02 0.00 0.00 30.24 31.09 3ddo n GLN 3209CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ddo n GLY 3210N -0.34 0.38 3.65 1.08 0.00 -1.09 -5.03 105.19 103.85 3ddo n GLY 3210Ca 0.05 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 3ddo n GLY 3210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ddo s LEU 3211N -2.45 3.33 -0.12 0.99 1.43 -0.62 -5.05 118.68 116.18 3ddo s LEU 3211Ca 0.00 -0.27 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 3ddo s LEU 3211Cb 0.00 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 3ddo s LEU 3211CO 0.00 0.16 0.26 -0.13 0.23 0.00 0.00 176.35 176.87 3ddo s ARG 3212N -2.40 3.99 0.02 1.70 0.52 -0.01 -3.98 118.95 118.79 3ddo s ARG 3212Ca 0.25 0.06 -0.02 0.00 -0.52 0.00 0.00 55.73 55.50 3ddo s ARG 3212Cb -0.11 -3.33 -0.01 0.00 0.52 0.00 0.00 34.95 32.02 3ddo s ARG 3212CO 0.17 0.46 0.02 0.00 0.02 0.00 0.00 175.30 175.97 3ddo s ALA 3213N -0.20 -0.01 0.24 2.13 0.00 -1.26 -0.29 121.76 122.36 3ddo s ALA 3213Ca 0.16 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 3ddo s ALA 3213Cb -0.13 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 3ddo s ALA 3213CO 0.05 -0.18 0.26 0.20 0.00 0.00 0.00 175.76 176.10 3ddo s GLY 3214N -1.45 1.29 -0.11 0.00 0.00 -0.46 -0.59 107.32 106.00 3ddo s GLY 3214Ca -0.16 -1.50 -0.09 0.00 0.00 0.00 0.00 44.72 42.97 3ddo s GLY 3214CO -0.00 -1.17 0.29 -0.29 0.00 0.00 0.00 173.10 171.92 3ddo s MET 3215N -3.97 0.31 0.06 2.90 1.75 -1.26 -1.13 119.30 117.96 3ddo s MET 3215Ca 0.34 0.47 0.05 0.00 -1.25 0.00 0.00 55.69 55.30 3ddo s MET 3215Cb 0.04 0.08 -0.03 0.00 2.84 0.00 0.00 34.83 37.76 3ddo s MET 3215CO 0.13 -0.08 -0.14 0.54 -0.65 0.00 0.00 175.02 174.82 3ddo s VAL 3216N 0.54 1.14 -0.03 10.11 0.11 -0.50 -1.79 120.40 129.97 3ddo s VAL 3216Ca -0.03 -1.22 -0.13 0.00 -2.93 0.00 0.00 61.98 57.67 3ddo s VAL 3216Cb -0.05 -1.07 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 3ddo s VAL 3216CO -0.03 -0.15 0.28 0.00 -3.33 0.00 0.00 175.10 171.87 3ddo s ALA 3217N -1.14 -0.71 -0.06 1.54 0.00 0.02 -1.74 121.76 119.67 3ddo s ALA 3217Ca -0.01 0.37 -0.12 0.00 0.00 0.00 0.00 51.96 52.20 3ddo s ALA 3217Cb -0.09 -0.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.94 3ddo s ALA 3217CO 0.02 -0.23 0.30 0.20 0.00 0.00 0.00 175.76 176.06 3ddo s GLY 3218N -1.03 2.34 -0.32 0.00 0.00 -0.65 -0.47 107.32 107.19 3ddo s GLY 3218Ca -0.11 -0.39 -0.24 0.00 0.00 0.00 0.00 44.72 43.98 3ddo s GLY 3218CO 0.03 0.02 0.82 0.14 0.00 0.00 0.00 173.10 174.11 3ddo s VAL 3219N -0.82 4.75 -0.71 1.40 1.01 -0.25 -0.71 120.40 125.07 3ddo s VAL 3219Ca 0.20 1.18 0.14 0.00 0.00 0.00 0.00 61.98 63.50 3ddo s VAL 3219Cb -0.15 -4.19 -0.14 0.00 0.00 0.00 0.00 36.38 31.90 3ddo s VAL 3219CO 0.09 -0.32 0.61 2.30 0.00 0.00 0.00 175.10 177.78 3ddo n ILE 3220N 5.63 0.00 -3.46 2.22 -5.35 0.39 -0.30 119.36 118.49 3ddo n ILE 3220Ca 0.04 -0.18 -0.11 0.00 -0.27 0.00 0.00 62.75 62.23 3ddo n ILE 3220Cb 0.48 1.01 -0.02 0.00 -1.74 0.00 0.00 39.64 39.37 3ddo n ILE 3220CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3ddo s VAL 3221N -2.28 0.00 -0.23 7.28 0.11 -1.23 -4.87 120.40 119.18 3ddo s VAL 3221Ca 0.06 -0.05 -0.04 0.00 -2.93 0.00 0.00 61.98 59.02 3ddo s VAL 3221Cb 0.11 -1.05 0.09 0.00 -1.53 0.00 0.00 36.38 33.99 3ddo s VAL 3221CO 0.56 0.00 0.16 0.21 -3.33 0.00 0.00 175.10 172.70 3ddo s ASN 3222N -2.71 2.43 0.18 3.54 3.84 -1.26 -2.08 114.94 118.88 3ddo s ASN 3222Ca 0.02 -0.76 -0.13 0.00 0.21 0.00 0.00 52.86 52.20 3ddo s ASN 3222Cb -0.01 -0.04 0.11 0.00 -0.55 0.00 0.00 41.25 40.75 3ddo s ASN 3222CO -0.11 -0.38 1.83 0.03 -2.79 0.00 0.00 177.10 175.68 3ddo h ARG 3223N 8.37 0.71 0.00 0.43 2.47 -1.97 0.68 114.38 125.08 3ddo h ARG 3223Ca -0.17 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.50 3ddo h ARG 3223Cb 1.10 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 29.26 3ddo h ARG 3223CO 0.34 0.47 -0.03 0.00 0.56 0.00 0.00 179.97 181.31 3ddo h THR 3224N 0.73 0.17 0.00 2.04 1.03 -1.89 -1.04 112.91 113.95 3ddo h THR 3224Ca 0.22 -0.26 0.00 0.00 -0.01 0.00 0.00 66.41 66.36 3ddo h THR 3224Cb -0.03 1.21 0.00 0.00 -1.07 0.00 0.00 68.15 68.27 3ddo h THR 3224CO -0.08 0.03 -1.44 0.00 -0.01 0.00 0.00 175.52 174.03 3ddo n GLN 3225N -3.27 0.46 -0.94 0.00 6.02 -0.73 -4.95 117.38 113.96 3ddo n GLN 3225Ca -0.02 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 3ddo n GLN 3225Cb 0.17 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 29.85 3ddo n GLN 3225CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ddo n GLN 3226N -2.13 0.00 0.00 -1.09 10.64 0.16 -5.05 117.38 119.90 3ddo n GLN 3226Ca -0.01 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.16 3ddo n GLN 3226Cb 0.50 -0.25 0.00 0.00 -0.86 0.00 0.00 30.24 29.62 3ddo n GLN 3226CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 3ddo n ASN 3230N 1.52 0.00 0.09 2.61 4.05 -1.26 -5.03 115.26 117.25 3ddo n ASN 3230Ca 0.00 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.01 3ddo n ASN 3230Cb 0.00 0.00 -0.05 0.00 1.23 0.00 0.00 39.78 40.96 3ddo n ASN 3230CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3ddo h ALA 3231N 0.00 0.54 0.12 5.20 0.00 -1.99 -3.18 119.26 119.94 3ddo h ALA 3231Ca 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.18 3ddo h ALA 3231Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3ddo h ALA 3231CO 0.00 0.95 -0.06 1.49 0.00 0.00 0.00 179.25 181.64 3ddo h GLU 3232N 0.00 -0.15 -0.08 0.00 4.57 -2.03 -2.62 114.58 114.26 3ddo h GLU 3232Ca -0.03 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3ddo h GLU 3232Cb 1.59 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 30.21 3ddo h GLU 3232CO 0.09 0.33 0.04 1.79 -1.18 0.00 0.00 179.01 180.08 3ddo h THR 3233N -0.82 1.03 -0.34 0.32 1.35 -1.99 0.69 112.91 113.16 3ddo h THR 3233Ca -0.02 -0.10 -0.02 0.00 -0.55 0.00 0.00 66.41 65.72 3ddo h THR 3233Cb 0.56 0.93 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 3ddo h THR 3233CO 0.03 0.04 0.13 -0.03 -0.25 0.00 0.00 175.52 175.44 3ddo h MET 3234N 0.12 0.50 0.00 4.72 1.85 -1.53 0.60 114.93 121.19 3ddo h MET 3234Ca 0.03 -0.09 -0.10 0.00 -0.61 0.00 0.00 59.70 58.92 3ddo h MET 3234Cb 0.02 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 31.95 3ddo h MET 3234CO -0.00 0.50 -0.49 1.57 -0.40 0.00 0.00 176.91 178.09 3ddo h LYS 3235N 0.39 0.00 -0.07 0.39 2.10 -0.99 -1.99 116.57 116.40 3ddo h LYS 3235Ca 0.11 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.63 3ddo h LYS 3235Cb 0.19 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.53 3ddo h LYS 3235CO -0.01 0.49 -0.49 1.96 -2.00 0.00 0.00 179.45 179.41 3ddo h GLN 3236N 0.00 0.45 -0.53 0.07 1.08 -0.62 -2.01 115.11 113.56 3ddo h GLN 3236Ca -0.00 -0.39 0.04 0.00 -1.45 0.00 0.00 58.65 56.84 3ddo h GLN 3236Cb 1.21 0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 28.69 3ddo h GLN 3236CO 0.06 1.03 0.30 1.15 -0.95 0.00 0.00 178.83 180.42 3ddo h THR 3237N 0.00 1.01 0.02 -0.54 2.02 0.18 -2.53 112.91 113.08 3ddo h THR 3237Ca -0.04 -0.20 0.02 0.00 0.77 0.00 0.00 66.41 66.96 3ddo h THR 3237Cb 1.15 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.88 3ddo h THR 3237CO 0.10 0.11 -0.48 -0.33 0.37 0.00 0.00 175.52 175.29 3ddo h GLU 3238N 0.58 -0.62 -0.77 6.66 5.08 -1.34 -1.51 114.58 122.66 3ddo h GLU 3238Ca 0.22 0.04 0.18 0.00 -1.00 0.00 0.00 59.36 58.81 3ddo h GLU 3238Cb 0.08 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 3ddo h GLU 3238CO -0.13 -0.41 0.53 0.66 -1.00 0.00 0.00 179.01 178.66 3ddo h SER 3239N -0.64 0.27 -0.04 1.42 4.64 -1.08 -0.44 113.55 117.68 3ddo h SER 3239Ca 0.03 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 3ddo h SER 3239Cb 0.70 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3ddo h SER 3239CO -0.33 0.13 -0.15 0.45 -0.87 0.00 0.00 176.83 176.06 3ddo h HIS 3240N 0.28 0.23 -0.74 4.77 3.86 -0.95 -1.34 115.15 121.26 3ddo h HIS 3240Ca 0.38 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.50 3ddo h HIS 3240Cb 1.08 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.48 3ddo h HIS 3240CO -0.00 0.78 0.46 0.00 0.86 0.00 0.00 177.93 180.04 3ddo h ALA 3241N 0.40 1.42 -0.39 2.45 0.00 -0.72 -1.78 119.26 120.64 3ddo h ALA 3241Ca -0.01 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3ddo h ALA 3241Cb 0.80 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3ddo h ALA 3241CO 0.03 0.51 0.05 0.28 0.00 0.00 0.00 179.25 180.13 3ddo h VAL 3242N 1.01 1.24 -0.31 0.00 2.07 -1.06 -0.54 116.25 118.67 3ddo h VAL 3242Ca 0.27 -0.89 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 3ddo h VAL 3242Cb -0.07 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3ddo h VAL 3242CO -0.05 0.30 -0.01 0.07 0.02 0.00 0.00 177.57 177.90 3ddo h LYS 3243N 0.49 0.48 -0.21 1.57 2.10 -0.98 -1.93 116.57 118.09 3ddo h LYS 3243Ca 0.12 -0.10 -0.03 0.00 -2.00 0.00 0.00 60.65 58.64 3ddo h LYS 3243Cb 0.39 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 31.64 3ddo h LYS 3243CO 0.01 0.51 0.02 0.82 -2.00 0.00 0.00 179.45 178.81 3ddo h ILE 3244N 0.46 1.24 -0.29 0.07 2.04 -0.89 -1.24 117.51 118.90 3ddo h ILE 3244Ca 0.10 -0.82 -0.07 0.00 1.00 0.00 0.00 64.86 65.07 3ddo h ILE 3244Cb 0.32 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3ddo h ILE 3244CO 0.01 0.25 -0.13 1.62 0.00 0.00 0.00 178.15 179.91 3ddo h VAL 3245N 0.15 1.23 -0.21 1.67 3.04 -0.73 0.44 116.25 121.84 3ddo h VAL 3245Ca 0.06 -1.02 -0.13 0.00 -1.01 0.00 0.00 66.70 64.60 3ddo h VAL 3245Cb 0.36 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 3ddo h VAL 3245CO 0.01 0.33 -0.37 0.58 -1.01 0.00 0.00 177.57 177.11 3ddo h VAL 3246N 0.46 1.33 -0.69 1.51 2.07 -1.30 -0.79 116.25 118.83 3ddo h VAL 3246Ca 0.08 -1.59 -0.02 0.00 0.82 0.00 0.00 66.70 65.99 3ddo h VAL 3246Cb 0.50 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3ddo h VAL 3246CO 0.03 0.50 0.36 -0.08 0.02 0.00 0.00 177.57 178.39 3ddo h GLU 3247N 0.30 0.96 -0.47 1.57 4.57 -0.98 -1.83 114.58 118.70 3ddo h GLU 3247Ca 0.01 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 3ddo h GLU 3247Cb 0.97 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.35 3ddo h GLU 3247CO 0.08 0.72 -0.02 0.00 -1.18 0.00 0.00 179.01 178.61 3ddo h ALA 3248N 1.43 0.64 -0.91 2.92 0.00 -0.82 -2.80 119.26 119.73 3ddo h ALA 3248Ca 0.24 -0.29 0.12 0.00 0.00 0.00 0.00 54.91 54.99 3ddo h ALA 3248Cb 0.05 -0.17 -0.09 0.00 0.00 0.00 0.00 17.79 17.58 3ddo h ALA 3248CO -0.04 0.46 0.53 0.00 0.00 0.00 0.00 179.25 180.21 3ddo h ALA 3249N 0.91 1.36 -0.76 0.00 0.00 -0.64 -1.23 119.26 118.91 3ddo h ALA 3249Ca 0.13 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.17 3ddo h ALA 3249Cb 0.54 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 3ddo h ALA 3249CO 0.03 0.08 0.50 0.00 0.00 0.00 0.00 179.25 179.85 3ddo h ARG 3250N 0.81 0.73 0.00 0.00 3.08 -1.07 -1.35 114.38 116.58 3ddo h ARG 3250Ca 0.46 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.47 3ddo h ARG 3250Cb 0.53 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3ddo h ARG 3250CO -0.29 0.48 0.00 0.54 -1.07 0.00 0.00 179.97 179.63 3ddo n ARG 3251N -4.49 0.14 -0.03 0.04 1.74 -0.48 -3.75 116.66 109.83 3ddo n ARG 3251Ca 0.12 0.13 0.08 0.00 -0.77 0.00 0.00 57.85 57.41 3ddo n ARG 3251Cb 0.27 -1.67 0.09 0.00 -1.02 0.00 0.00 32.46 30.13 3ddo n ARG 3251CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3ddo n LEU 3252N -1.91 2.51 0.00 0.55 4.77 -0.52 -5.07 117.00 117.33 3ddo n LEU 3252Ca 0.06 -1.12 0.09 0.00 -0.03 0.00 0.00 56.01 55.01 3ddo n LEU 3252Cb 0.38 -0.04 0.54 0.00 -2.33 0.00 0.00 43.42 41.97 3ddo n LEU 3252CO 0.28 0.47 0.74 0.18 -1.33 0.00 0.00 177.39 177.74