#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0p s LEU 9003N 0.00 4.42 0.24 0.99 2.96 -1.26 -3.26 118.68 122.77 1x0p s LEU 9003Ca 0.00 1.54 0.01 0.00 -0.22 0.00 0.00 54.13 55.46 1x0p s LEU 9003Cb 0.00 -3.37 -0.05 0.00 0.50 0.00 0.00 46.19 43.27 1x0p s LEU 9003CO 0.00 -0.09 0.10 -1.00 -1.32 0.00 0.00 176.35 174.04 1x0p s HIS 9004N 0.34 1.46 -0.03 5.38 3.76 -0.06 -1.09 115.29 125.05 1x0p s HIS 9004Ca 0.43 -1.20 0.00 0.00 -0.15 0.00 0.00 55.06 54.14 1x0p s HIS 9004Cb -0.21 -0.84 0.03 0.00 1.11 0.00 0.00 32.58 32.67 1x0p s HIS 9004CO 0.25 -0.38 -0.00 0.50 -0.85 0.00 0.00 174.74 174.26 1x0p s ARG 9005N -4.05 0.34 -0.05 1.40 3.52 -0.39 -1.44 118.95 118.28 1x0p s ARG 9005Ca 0.37 0.08 0.01 0.00 -0.13 0.00 0.00 55.73 56.06 1x0p s ARG 9005Cb 0.08 -0.54 -0.03 0.00 -1.56 0.00 0.00 34.95 32.90 1x0p s ARG 9005CO 0.13 -0.15 -0.06 -1.17 -0.81 0.00 0.00 175.30 173.24 1x0p s LEU 9006N 1.11 3.19 -0.04 -0.88 2.96 0.63 -2.70 118.68 122.94 1x0p s LEU 9006Ca -0.08 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 1x0p s LEU 9006Cb -0.13 -1.74 0.02 0.00 0.50 0.00 0.00 46.19 44.84 1x0p s LEU 9006CO -0.02 0.34 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.69 1x0p s ILE 9007N -0.87 0.42 0.13 6.68 1.01 -0.21 -0.52 121.20 127.83 1x0p s ILE 9007Ca 0.14 -0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.69 1x0p s ILE 9007Cb -0.11 -0.48 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1x0p s ILE 9007CO 0.03 0.21 0.20 -0.72 0.00 0.00 0.00 174.94 174.66 1x0p s TYR 9008N 1.11 0.39 0.15 3.97 -0.85 -0.55 0.37 117.35 121.94 1x0p s TYR 9008Ca -0.08 -0.79 0.06 0.00 -0.52 0.00 0.00 57.07 55.73 1x0p s TYR 9008Cb -0.14 -0.14 -0.04 0.00 0.38 0.00 0.00 41.96 42.02 1x0p s TYR 9008CO -0.01 -0.61 -0.13 -0.48 -1.52 0.00 0.00 175.55 172.80 1x0p s LEU 9009N -2.94 2.48 0.18 -3.49 0.05 0.73 -1.71 118.68 113.97 1x0p s LEU 9009Ca 0.13 -0.92 -0.19 0.00 0.05 0.00 0.00 54.13 53.21 1x0p s LEU 9009Cb 0.05 -0.51 0.04 0.00 -2.05 0.00 0.00 46.19 43.72 1x0p s LEU 9009CO -0.04 -0.21 0.53 -0.94 -0.55 0.00 0.00 176.35 175.13 1x0p s SER 9010N -2.86 -0.33 -0.23 1.48 1.04 -0.73 0.22 113.70 112.28 1x0p s SER 9010Ca 0.14 -0.33 -0.11 0.00 0.48 0.00 0.00 55.95 56.13 1x0p s SER 9010Cb -0.02 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 1x0p s SER 9010CO 0.03 -1.00 0.19 0.00 0.98 0.00 0.00 173.24 173.44 1x0p s ALA 9012N 1.06 3.55 0.22 0.00 0.00 -0.41 0.17 121.76 126.35 1x0p s ALA 9012Ca 0.09 1.26 -0.30 0.00 0.00 0.00 0.00 51.96 53.02 1x0p s ALA 9012Cb -0.14 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 1x0p s ALA 9012CO 0.05 -0.66 1.22 0.99 0.00 0.00 0.00 175.76 177.35 1x0p s THR 9013N -0.58 3.39 0.12 0.00 2.01 -0.35 -4.82 115.64 115.41 1x0p s THR 9013Ca 0.53 1.22 -0.34 0.00 0.31 0.00 0.00 61.69 63.41 1x0p s THR 9013Cb -0.40 -3.78 -0.14 0.00 0.01 0.00 0.00 72.50 68.19 1x0p s THR 9013CO 0.48 0.22 1.61 0.47 -0.69 0.00 0.00 174.62 176.71 1x0p n ASP 9014N 2.11 3.05 0.00 3.53 8.00 -1.26 -1.49 116.55 130.49 1x0p n ASP 9014Ca 0.03 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.60 1x0p n ASP 9014Cb 0.44 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 1x0p n ASP 9014CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 9015N 3.51 0.79 3.53 0.44 0.00 -1.26 -5.04 105.19 107.15 1x0p n GLY 9015Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1x0p n GLY 9015CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x0p n LEU 9016N 0.00 2.29 -4.92 0.99 7.94 -0.56 -4.94 117.00 117.81 1x0p n LEU 9016Ca 0.00 -0.02 -0.26 0.00 -1.11 0.00 0.00 56.01 54.62 1x0p n LEU 9016Cb 0.00 -1.43 0.01 0.00 0.53 0.00 0.00 43.42 42.53 1x0p n LEU 9016CO 0.00 -1.04 0.40 -0.94 -1.11 0.00 0.00 177.39 174.70 1x0p s SER 9017N 9.64 6.08 0.23 1.96 1.04 -1.26 -5.00 113.70 126.39 1x0p s SER 9017Ca 1.06 0.73 -0.08 0.00 0.48 0.00 0.00 55.95 58.14 1x0p s SER 9017Cb -0.51 -2.01 0.20 0.00 0.10 0.00 0.00 66.02 63.80 1x0p s SER 9017CO 0.37 -0.65 1.88 1.88 0.98 0.00 0.00 173.24 177.70 1x0p h TYR 9018N 0.24 1.13 0.00 5.02 -1.99 -2.01 -1.64 116.97 117.73 1x0p h TYR 9018Ca -0.47 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.26 1x0p h TYR 9018Cb 1.22 -0.38 -0.00 0.00 2.00 0.00 0.00 36.73 39.58 1x0p h TYR 9018CO 0.53 0.74 -0.01 -1.00 -0.00 0.00 0.00 178.16 178.42 1x0p h PRO 9019N 1.20 0.00 -0.17 4.88 0.13 -1.99 -1.37 132.00 134.68 1x0p h PRO 9019Ca 0.32 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.41 1x0p h PRO 9019Cb -0.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.05 1x0p h PRO 9019CO -0.06 0.01 -0.03 -0.44 -0.23 0.00 0.00 178.00 177.26 1x0p h ASP 9020N 0.00 0.31 -0.26 1.44 3.32 -1.68 -1.04 116.42 118.50 1x0p h ASP 9020Ca -0.00 -0.35 0.02 0.00 0.02 0.00 0.00 57.03 56.72 1x0p h ASP 9020Cb 0.06 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1x0p h ASP 9020CO 0.00 0.59 0.13 -0.07 -1.72 0.00 0.00 179.24 178.17 1x0p h LEU 9021N 0.03 0.20 -1.69 1.55 3.38 -1.22 0.43 115.31 117.99 1x0p h LEU 9021Ca 0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1x0p h LEU 9021Cb 0.44 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1x0p h LEU 9021CO 0.01 0.15 0.16 0.03 0.09 0.00 0.00 178.44 178.89 1x0p h ARG 9022N 0.28 0.37 0.05 1.13 3.08 -1.31 0.28 114.38 118.26 1x0p h ARG 9022Ca 0.11 -0.03 -0.23 0.00 0.07 0.00 0.00 59.98 59.90 1x0p h ARG 9022Cb 0.03 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.02 1x0p h ARG 9022CO -0.07 0.26 -0.94 0.22 -1.07 0.00 0.00 179.97 178.37 1x0p h ASP 9023N 0.38 0.74 -0.53 7.04 1.82 -0.24 -1.39 116.42 124.24 1x0p h ASP 9023Ca 0.10 -0.79 0.02 0.00 -0.39 0.00 0.00 57.03 55.97 1x0p h ASP 9023Cb -0.01 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 39.74 1x0p h ASP 9023CO -0.02 1.44 0.32 0.40 -1.61 0.00 0.00 179.24 179.77 1x0p h ILE 9024N 0.12 1.06 -0.51 2.25 2.04 0.41 -1.91 117.51 120.97 1x0p h ILE 9024Ca -0.13 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.39 1x0p h ILE 9024Cb 1.63 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1x0p h ILE 9024CO 0.18 0.12 -0.15 0.24 0.00 0.00 0.00 178.15 178.53 1x0p h MET 9025N 0.63 1.00 0.02 2.37 2.86 -1.00 -1.08 114.93 119.73 1x0p h MET 9025Ca 0.21 -0.40 0.03 0.00 -2.06 0.00 0.00 59.70 57.48 1x0p h MET 9025Cb 0.02 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.59 1x0p h MET 9025CO -0.09 1.08 -0.20 0.00 1.06 0.00 0.00 176.91 178.75 1x0p h ALA 9026N 0.89 -0.27 -0.49 6.32 0.00 -0.80 0.30 119.26 125.21 1x0p h ALA 9026Ca 0.12 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1x0p h ALA 9026Cb 0.73 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1x0p h ALA 9026CO 0.06 -0.71 0.02 0.87 0.00 0.00 0.00 179.25 179.49 1x0p h LYS 9027N -0.34 0.86 -0.07 0.00 6.56 -1.37 -3.11 116.57 119.11 1x0p h LYS 9027Ca 0.05 -0.26 0.02 0.00 -1.06 0.00 0.00 60.65 59.40 1x0p h LYS 9027Cb 0.40 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 31.96 1x0p h LYS 9027CO -0.17 0.88 -0.06 0.77 -2.06 0.00 0.00 179.45 178.81 1x0p h SER 9028N 0.72 -0.19 -0.96 0.86 0.02 -0.78 0.14 113.55 113.36 1x0p h SER 9028Ca 0.14 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.23 1x0p h SER 9028Cb 0.48 0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.05 1x0p h SER 9028CO 0.02 -0.08 0.61 -0.33 -1.14 0.00 0.00 176.83 175.91 1x0p h GLU 9029N -0.07 0.95 0.17 3.45 5.08 -0.98 0.16 114.58 123.34 1x0p h GLU 9029Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1x0p h GLU 9029Cb 0.14 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1x0p h GLU 9029CO -0.11 0.63 -0.08 0.28 -1.00 0.00 0.00 179.01 178.73 1x0p h VAL 9030N 0.98 0.58 -0.17 3.13 2.07 -1.40 -3.02 116.25 118.43 1x0p h VAL 9030Ca 0.45 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.88 1x0p h VAL 9030Cb 0.40 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1x0p h VAL 9030CO -0.21 0.16 0.07 0.78 0.02 0.00 0.00 177.57 178.39 1x0p h ASN 9031N -0.97 0.09 -0.45 0.57 2.35 -0.88 -2.08 115.58 114.21 1x0p h ASN 9031Ca -0.02 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1x0p h ASN 9031Cb 0.44 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1x0p h ASN 9031CO 0.04 0.08 0.29 0.78 -1.65 0.00 0.00 177.43 176.96 1x0p h ASN 9032N 0.16 0.54 -0.99 5.81 2.35 -1.12 0.98 115.58 123.30 1x0p h ASN 9032Ca 0.07 -0.04 0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1x0p h ASN 9032Cb 0.03 -0.13 -0.07 0.00 0.05 0.00 0.00 38.32 38.20 1x0p h ASN 9032CO -0.06 0.42 0.64 0.25 -1.65 0.00 0.00 177.43 177.02 1x0p h LEU 9033N 0.61 1.01 -0.87 1.61 7.12 -1.40 0.29 115.31 123.69 1x0p h LEU 9033Ca 0.16 0.01 -0.12 0.00 0.13 0.00 0.00 57.88 58.07 1x0p h LEU 9033Cb -0.03 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 39.88 1x0p h LEU 9033CO -0.03 0.64 -0.49 -0.09 -0.13 0.00 0.00 178.44 178.34 1x0p h ARG 9034N 1.15 0.19 -0.38 1.25 2.43 -0.70 -3.15 114.38 115.16 1x0p h ARG 9034Ca 0.43 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 1x0p h ARG 9034Cb 0.19 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1x0p h ARG 9034CO -0.18 0.64 0.00 -0.25 -1.51 0.00 0.00 179.97 178.67 1x0p n ASP 9035N -3.96 3.14 -1.06 -3.80 8.00 0.28 -4.94 116.55 114.20 1x0p n ASP 9035Ca -0.02 -1.95 -0.11 0.00 0.71 0.00 0.00 54.79 53.42 1x0p n ASP 9035Cb 0.53 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 1x0p n ASP 9035CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 9036N 1.44 0.58 3.85 0.44 0.00 0.72 -4.74 105.19 107.49 1x0p n GLY 9036Ca 0.19 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1x0p n GLY 9036CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0p s ILE 9037N -2.48 5.41 0.30 -0.61 1.01 0.52 -4.60 121.20 120.75 1x0p s ILE 9037Ca 0.00 0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.85 1x0p s ILE 9037Cb 0.00 -3.37 -0.06 0.00 0.01 0.00 0.00 42.46 39.05 1x0p s ILE 9037CO 0.00 0.60 0.08 0.42 0.00 0.00 0.00 174.94 176.03 1x0p s THR 9038N -0.86 0.93 -5.00 2.92 -4.23 -0.85 -4.15 115.64 104.39 1x0p s THR 9038Ca 0.14 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1x0p s THR 9038Cb -0.12 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1x0p s THR 9038CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1x0p n GLY 9039N -0.60 -1.57 3.10 3.99 0.00 -0.72 -0.68 105.19 108.69 1x0p n GLY 9039Ca -0.01 -1.29 -0.17 0.00 0.00 0.00 0.00 46.02 44.54 1x0p n GLY 9039CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 9040N -1.99 0.73 -0.15 1.61 -1.94 -0.96 -3.14 119.30 113.46 1x0p s MET 9040Ca 0.00 -0.70 0.00 0.00 -1.71 0.00 0.00 55.69 53.29 1x0p s MET 9040Cb 0.00 -0.66 0.02 0.00 2.01 0.00 0.00 34.83 36.20 1x0p s MET 9040CO 0.00 0.16 -0.13 -1.17 -0.01 0.00 0.00 175.02 173.86 1x0p s LEU 9041N -1.19 1.63 -0.12 -0.03 2.96 0.96 -1.69 118.68 121.21 1x0p s LEU 9041Ca -0.02 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1x0p s LEU 9041Cb -0.08 -1.14 -0.02 0.00 0.50 0.00 0.00 46.19 45.45 1x0p s LEU 9041CO 0.01 -0.07 -0.08 0.00 -1.32 0.00 0.00 176.35 174.89 1x0p s TYR 9043N -0.05 1.31 -0.29 0.00 5.04 -0.65 -0.69 117.35 122.02 1x0p s TYR 9043Ca -0.00 -0.43 -0.26 0.00 -2.44 0.00 0.00 57.07 53.93 1x0p s TYR 9043Cb -0.13 -0.96 0.19 0.00 0.35 0.00 0.00 41.96 41.41 1x0p s TYR 9043CO 0.03 -0.21 1.41 0.20 -1.34 0.00 0.00 175.55 175.64 1x0p s GLY 9044N 0.49 0.27 -1.46 8.97 0.00 -0.35 -1.88 107.32 113.36 1x0p s GLY 9044Ca -0.10 3.29 -0.10 0.00 0.00 0.00 0.00 44.72 47.82 1x0p s GLY 9044CO 0.02 1.66 0.84 -2.01 0.00 0.00 0.00 173.10 173.61 1x0p n ASN 9045N 1.22 -5.35 -0.60 1.64 5.15 -1.26 -0.76 115.26 115.29 1x0p n ASN 9045Ca -0.07 -0.52 -0.08 0.00 -0.60 0.00 0.00 54.58 53.31 1x0p n ASN 9045Cb 0.58 -4.29 -0.03 0.00 -0.53 0.00 0.00 39.78 35.50 1x0p n ASN 9045CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x0p n GLY 9046N -1.63 0.87 3.30 8.20 0.00 -1.26 -4.98 105.19 109.69 1x0p n GLY 9046Ca -0.02 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 1x0p n GLY 9046CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 9047N -2.40 1.45 0.04 1.61 -1.94 0.06 -1.29 119.30 116.83 1x0p s MET 9047Ca 0.00 -1.09 0.04 0.00 -1.71 0.00 0.00 55.69 52.93 1x0p s MET 9047Cb 0.00 -1.66 -0.04 0.00 2.01 0.00 0.00 34.83 35.14 1x0p s MET 9047CO 0.00 0.42 -0.02 -0.06 -0.01 0.00 0.00 175.02 175.34 1x0p s PHE 9048N -0.91 2.97 -0.17 -0.03 0.40 0.97 -1.21 117.98 120.00 1x0p s PHE 9048Ca 0.09 -0.01 -0.04 0.00 -0.60 0.00 0.00 56.93 56.38 1x0p s PHE 9048Cb -0.09 -1.59 0.08 0.00 0.51 0.00 0.00 43.02 41.92 1x0p s PHE 9048CO 0.03 0.44 0.18 -1.17 0.70 0.00 0.00 175.22 175.41 1x0p s LEU 9049N -1.84 -0.02 0.09 -0.37 2.96 0.13 -1.78 118.68 117.86 1x0p s LEU 9049Ca 0.21 -0.16 0.05 0.00 -0.22 0.00 0.00 54.13 54.01 1x0p s LEU 9049Cb -0.11 0.24 -0.03 0.00 0.50 0.00 0.00 46.19 46.79 1x0p s LEU 9049CO 0.13 -0.31 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.14 1x0p s GLN 9050N 2.28 0.85 -0.02 1.98 0.74 -0.69 0.00 119.66 124.80 1x0p s GLN 9050Ca 0.05 -1.06 0.03 0.00 0.05 0.00 0.00 55.36 54.43 1x0p s GLN 9050Cb -0.15 -0.72 -0.00 0.00 1.10 0.00 0.00 33.01 33.24 1x0p s GLN 9050CO -0.10 0.14 -0.11 -0.08 -0.55 0.00 0.00 175.29 174.59 1x0p s THR 9051N -1.81 0.90 -0.07 -0.34 -1.32 -0.68 -1.48 115.64 110.85 1x0p s THR 9051Ca 0.02 -0.45 0.02 0.00 -1.21 0.00 0.00 61.69 60.07 1x0p s THR 9051Cb -0.07 -0.78 0.01 0.00 -1.51 0.00 0.00 72.50 70.15 1x0p s THR 9051CO 0.02 0.27 -0.12 -0.76 -2.21 0.00 0.00 174.62 171.82 1x0p s LEU 9052N 0.01 1.62 0.01 9.08 1.43 0.32 -2.26 118.68 128.89 1x0p s LEU 9052Ca -0.01 -0.30 0.06 0.00 -1.03 0.00 0.00 54.13 52.86 1x0p s LEU 9052Cb -0.07 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 45.30 1x0p s LEU 9052CO 0.00 0.02 -0.17 -1.61 0.23 0.00 0.00 176.35 174.83 1x0p s GLU 9053N 0.73 2.23 0.00 1.70 2.02 0.14 -0.27 118.70 125.25 1x0p s GLU 9053Ca -0.13 -0.88 0.00 0.00 0.02 0.00 0.00 54.97 53.98 1x0p s GLU 9053Cb -0.16 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.82 1x0p s GLU 9053CO 0.03 0.57 0.00 0.41 0.02 0.00 0.00 175.26 176.29 1x0p n GLY 9054N 1.81 -0.34 3.63 -1.39 0.00 -0.52 -2.01 105.19 106.37 1x0p n GLY 9054Ca -0.16 -1.39 -0.38 0.00 0.00 0.00 0.00 46.02 44.09 1x0p n GLY 9054CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x0p n ASP 9055N 1.39 1.12 -0.18 1.61 2.03 -1.26 -0.88 116.55 120.38 1x0p n ASP 9055Ca 0.00 0.87 -0.09 0.00 0.52 0.00 0.00 54.79 56.09 1x0p n ASP 9055Cb 0.00 -1.41 0.01 0.00 -0.72 0.00 0.00 41.12 39.00 1x0p n ASP 9055CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1x0p h ARG 9056N 0.81 0.83 -0.18 -0.67 2.43 -1.93 -1.06 114.38 114.62 1x0p h ARG 9056Ca -0.48 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 58.41 1x0p h ARG 9056Cb 1.35 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1x0p h ARG 9056CO 0.53 0.79 -0.22 0.37 -1.51 0.00 0.00 179.97 179.93 1x0p h GLN 9057N 0.73 0.47 0.19 0.20 4.15 -1.91 -2.49 115.11 116.45 1x0p h GLN 9057Ca 0.16 -0.26 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 1x0p h GLN 9057Cb 0.33 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1x0p h GLN 9057CO 0.00 0.84 -0.09 0.87 -1.93 0.00 0.00 178.83 178.52 1x0p h LYS 9058N 0.12 -0.25 -0.98 1.69 6.56 -1.92 -1.76 116.57 120.03 1x0p h LYS 9058Ca 0.02 0.02 0.04 0.00 -1.06 0.00 0.00 60.65 59.67 1x0p h LYS 9058Cb 0.78 0.06 -0.06 0.00 -0.57 0.00 0.00 32.23 32.43 1x0p h LYS 9058CO 0.05 -0.08 0.64 0.28 -2.06 0.00 0.00 179.45 178.28 1x0p h VAL 9059N -0.38 1.16 -0.69 0.50 2.07 -1.28 -0.87 116.25 116.77 1x0p h VAL 9059Ca -0.03 -0.42 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 1x0p h VAL 9059Cb 0.29 -0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 29.86 1x0p h VAL 9059CO 0.04 0.22 0.16 0.28 0.02 0.00 0.00 177.57 178.30 1x0p h SER 9060N 1.23 1.03 -0.16 0.57 0.02 -1.31 -1.92 113.55 113.02 1x0p h SER 9060Ca 0.39 -0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 60.97 1x0p h SER 9060Cb 0.01 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1x0p h SER 9060CO -0.13 0.99 -0.46 -0.33 -1.14 0.00 0.00 176.83 175.76 1x0p h GLU 9061N 1.04 0.72 -0.43 3.45 5.08 -0.64 -2.05 114.58 121.75 1x0p h GLU 9061Ca 0.22 -0.41 -0.08 0.00 -1.00 0.00 0.00 59.36 58.08 1x0p h GLU 9061Cb 0.37 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1x0p h GLU 9061CO 0.00 1.03 -0.07 1.15 -1.00 0.00 0.00 179.01 180.13 1x0p h THR 9062N 0.58 1.25 -0.60 1.13 2.02 -1.05 -1.83 112.91 114.40 1x0p h THR 9062Ca 0.03 -1.08 -0.10 0.00 0.77 0.00 0.00 66.41 66.04 1x0p h THR 9062Cb 1.02 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1x0p h THR 9062CO 0.10 0.37 -0.01 0.22 0.37 0.00 0.00 175.52 176.57 1x0p h TYR 9063N 0.69 1.15 -0.52 3.16 3.20 -1.19 -0.69 116.97 122.78 1x0p h TYR 9063Ca 0.13 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 1x0p h TYR 9063Cb 0.52 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 1x0p h TYR 9063CO 0.03 1.02 0.18 0.00 -1.64 0.00 0.00 178.16 177.75 1x0p h ALA 9064N 1.01 1.35 -0.23 1.82 0.00 -0.99 -0.99 119.26 121.23 1x0p h ALA 9064Ca 0.17 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1x0p h ALA 9064Cb 0.56 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x0p h ALA 9064CO 0.03 0.48 -0.22 0.00 0.00 0.00 0.00 179.25 179.54 1x0p h ARG 9065N 0.74 0.56 -0.93 0.00 3.08 -0.91 -3.06 114.38 113.86 1x0p h ARG 9065Ca 0.18 -0.29 0.07 0.00 0.07 0.00 0.00 59.98 60.00 1x0p h ARG 9065Cb 0.19 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 1x0p h ARG 9065CO -0.01 0.87 0.60 0.82 -1.07 0.00 0.00 179.97 181.18 1x0p h ILE 9066N 0.26 1.07 0.00 2.04 2.04 -0.65 -0.56 117.51 121.70 1x0p h ILE 9066Ca 0.04 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1x0p h ILE 9066Cb 0.77 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1x0p h ILE 9066CO 0.05 0.19 -0.02 -0.07 0.00 0.00 0.00 178.15 178.30 1x0p h LEU 9067N 1.06 0.00 -1.26 1.44 4.07 -1.09 -1.33 115.31 118.19 1x0p h LEU 9067Ca 0.40 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.36 1x0p h LEU 9067Cb 0.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1x0p h LEU 9067CO -0.15 0.02 0.00 0.29 -1.08 0.00 0.00 178.44 177.52 1x0p n LYS 9068N -3.34 1.85 -2.74 1.13 5.02 -0.22 -4.83 118.16 115.04 1x0p n LYS 9068Ca -0.02 -1.26 -0.43 0.00 -2.02 0.00 0.00 58.31 54.58 1x0p n LYS 9068Cb 0.14 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 33.67 1x0p n LYS 9068CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1x0p s ASP 9069N -1.80 6.50 0.00 4.39 -1.08 -0.50 -4.90 116.67 119.28 1x0p s ASP 9069Ca 0.35 0.14 0.05 0.00 -0.52 0.00 0.00 52.55 52.56 1x0p s ASP 9069Cb 0.20 -2.49 0.20 0.00 -1.46 0.00 0.00 42.92 39.37 1x0p s ASP 9069CO 0.30 -1.18 1.14 -0.81 0.52 0.00 0.00 175.17 175.14 1x0p n PRO 9070N 7.54 0.00 0.00 4.34 -0.04 -1.26 -2.56 135.00 143.03 1x0p n PRO 9070Ca 0.07 0.41 0.08 0.00 -0.04 0.00 0.00 63.50 64.02 1x0p n PRO 9070Cb 0.49 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.87 1x0p n PRO 9070CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x0p n ARG 9071N -1.49 0.29 -3.98 0.54 1.74 -1.26 -4.72 116.66 107.78 1x0p n ARG 9071Ca 0.01 0.11 -0.09 0.00 -0.77 0.00 0.00 57.85 57.11 1x0p n ARG 9071Cb 0.05 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 29.94 1x0p n ARG 9071CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1x0p s HIS 9072N -2.44 0.32 0.38 -1.55 -3.43 -1.06 -1.21 115.29 106.29 1x0p s HIS 9072Ca 0.17 -0.69 -0.15 0.00 -0.80 0.00 0.00 55.06 53.59 1x0p s HIS 9072Cb 0.11 0.22 0.05 0.00 -1.43 0.00 0.00 32.58 31.53 1x0p s HIS 9072CO 0.23 -1.01 0.77 -3.38 -2.00 0.00 0.00 174.74 169.36 1x0p s HIS 9073N -4.01 0.14 -1.46 0.38 -3.43 0.13 -4.78 115.29 102.26 1x0p s HIS 9073Ca 0.21 -0.78 -0.09 0.00 -0.80 0.00 0.00 55.06 53.60 1x0p s HIS 9073Cb -0.01 0.79 0.04 0.00 -1.43 0.00 0.00 32.58 31.97 1x0p s HIS 9073CO 0.09 -1.53 0.88 0.43 -2.00 0.00 0.00 174.74 172.61 1x0p n SER 9074N -1.34 -5.53 -4.74 7.38 7.64 -1.26 -0.27 113.62 115.52 1x0p n SER 9074Ca -0.08 -0.52 -0.42 0.00 1.01 0.00 0.00 58.87 58.87 1x0p n SER 9074Cb 0.60 -4.42 -0.01 0.00 -1.01 0.00 0.00 64.21 59.38 1x0p n SER 9074CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x0p n ALA 9075N -4.32 1.87 -3.68 -0.43 0.00 -1.26 -4.41 120.51 108.28 1x0p n ALA 9075Ca -0.02 0.36 -0.22 0.00 0.00 0.00 0.00 53.44 53.56 1x0p n ALA 9075Cb 0.56 -2.34 -0.17 0.00 0.00 0.00 0.00 19.45 17.50 1x0p n ALA 9075CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1x0p s GLU 9076N -1.82 0.91 0.04 0.00 2.02 0.13 -4.98 118.70 115.00 1x0p s GLU 9076Ca 0.55 -0.09 -0.30 0.00 0.02 0.00 0.00 54.97 55.15 1x0p s GLU 9076Cb -0.52 -0.99 -0.04 0.00 0.10 0.00 0.00 34.13 32.67 1x0p s GLU 9076CO 0.62 -0.14 1.07 0.42 0.02 0.00 0.00 175.26 177.24 1x0p s ILE 9077N 1.23 4.47 -0.22 -1.63 1.01 -1.26 -0.20 121.20 124.60 1x0p s ILE 9077Ca -0.06 1.80 -0.04 0.00 0.00 0.00 0.00 60.65 62.35 1x0p s ILE 9077Cb -0.14 -4.15 -0.19 0.00 0.01 0.00 0.00 42.46 37.99 1x0p s ILE 9077CO -0.02 0.16 -0.05 0.52 0.00 0.00 0.00 174.94 175.55 1x0p n VAL 9078N 3.78 1.58 -3.51 2.92 0.31 0.16 -4.92 118.33 118.64 1x0p n VAL 9078Ca 0.07 -0.54 -0.10 0.00 -0.01 0.00 0.00 64.34 63.75 1x0p n VAL 9078Cb 0.49 -1.60 -0.03 0.00 -0.91 0.00 0.00 33.84 31.79 1x0p n VAL 9078CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1x0p s GLU 9079N -2.52 0.84 -0.24 5.55 -1.05 -0.69 -4.63 118.70 115.96 1x0p s GLU 9079Ca -0.32 -0.14 -0.05 0.00 -0.15 0.00 0.00 54.97 54.31 1x0p s GLU 9079Cb 0.09 0.39 0.12 0.00 -0.44 0.00 0.00 34.13 34.29 1x0p s GLU 9079CO 0.63 -0.33 0.45 0.12 0.95 0.00 0.00 175.26 177.08 1x0p s PHE 9080N -2.47 -0.96 0.23 4.83 5.36 -1.26 -1.04 117.98 122.67 1x0p s PHE 9080Ca 0.01 1.34 -0.15 0.00 -0.96 0.00 0.00 56.93 57.18 1x0p s PHE 9080Cb -0.01 0.27 0.01 0.00 -0.34 0.00 0.00 43.02 42.95 1x0p s PHE 9080CO -0.05 -0.64 0.50 -1.59 -1.46 0.00 0.00 175.22 171.98 1x0p s LYS 9081N 2.64 1.49 0.35 10.12 -2.85 -1.10 -5.00 119.74 125.39 1x0p s LYS 9081Ca 0.07 -1.09 -0.19 0.00 -1.00 0.00 0.00 55.97 53.75 1x0p s LYS 9081Cb -0.14 0.49 -0.10 0.00 -2.06 0.00 0.00 37.83 36.03 1x0p s LYS 9081CO -0.16 -0.63 0.84 0.00 0.10 0.00 0.00 175.35 175.51 1x0p s ALA 9082N -3.96 3.22 0.05 0.59 0.00 -1.26 -1.26 121.76 119.14 1x0p s ALA 9082Ca 0.16 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.40 1x0p s ALA 9082Cb -0.01 -2.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 1x0p s ALA 9082CO 0.04 0.24 -0.10 0.96 0.00 0.00 0.00 175.76 176.90 1x0p s ILE 9083N -1.94 0.74 0.00 0.00 -4.36 -0.25 -4.87 121.20 110.52 1x0p s ILE 9083Ca 0.55 -1.08 0.11 0.00 -0.26 0.00 0.00 60.65 59.96 1x0p s ILE 9083Cb -0.12 -0.75 -0.11 0.00 1.25 0.00 0.00 42.46 42.73 1x0p s ILE 9083CO 0.17 -0.28 1.30 -0.08 0.24 0.00 0.00 174.94 176.29 1x0p h GLU 9084N 4.57 0.00 -2.90 0.37 4.81 -1.98 -3.41 114.58 116.03 1x0p h GLU 9084Ca -0.37 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.78 1x0p h GLU 9084Cb 1.20 0.00 -0.17 0.00 0.63 0.00 0.00 28.75 30.40 1x0p h GLU 9084CO 0.41 0.77 -0.10 -1.83 -0.73 0.00 0.00 179.01 177.54 1x0p s GLU 9085N -2.80 0.89 0.58 1.92 -1.05 -1.26 -5.05 118.70 111.93 1x0p s GLU 9085Ca 0.02 -0.26 -0.14 0.00 -0.15 0.00 0.00 54.97 54.44 1x0p s GLU 9085Cb 0.09 0.40 -0.05 0.00 -0.44 0.00 0.00 34.13 34.13 1x0p s GLU 9085CO 0.79 -0.30 1.02 1.03 0.95 0.00 0.00 175.26 178.76 1x0p s ARG 9086N -2.12 3.60 -0.15 -4.83 0.52 -1.26 -4.99 118.95 109.72 1x0p s ARG 9086Ca -0.07 0.96 -0.04 0.00 -0.52 0.00 0.00 55.73 56.05 1x0p s ARG 9086Cb -0.02 -2.08 -0.08 0.00 0.52 0.00 0.00 34.95 33.29 1x0p s ARG 9086CO 0.00 -0.56 -0.17 2.41 0.02 0.00 0.00 175.30 177.00 1x0p n THR 9087N -2.16 0.84 -2.88 0.02 -1.04 -1.26 -4.77 114.28 103.02 1x0p n THR 9087Ca 0.07 -0.26 -0.44 0.00 -2.04 0.00 0.00 64.05 61.38 1x0p n THR 9087Cb 0.54 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.66 1x0p n THR 9087CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1x0p n PHE 9088N -3.34 3.83 0.04 -1.42 3.01 -1.26 -4.78 117.46 113.54 1x0p n PHE 9088Ca -0.28 -3.14 -0.22 0.00 1.01 0.00 0.00 57.45 54.82 1x0p n PHE 9088Cb 0.74 -1.79 -0.14 0.00 -0.01 0.00 0.00 39.48 38.28 1x0p n PHE 9088CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1x0p h ILE 9089N 3.87 0.80 -0.34 4.37 2.04 -1.95 -3.27 117.51 123.04 1x0p h ILE 9089Ca 0.28 -2.46 0.08 0.00 1.00 0.00 0.00 64.86 63.76 1x0p h ILE 9089Cb 0.74 2.64 -0.02 0.00 -0.74 0.00 0.00 36.82 39.44 1x0p h ILE 9089CO 1.32 0.87 0.24 0.78 0.00 0.00 0.00 178.15 181.36 1x0p h ASN 9090N 0.09 0.11 -3.98 1.72 2.35 -1.97 -3.43 115.58 110.47 1x0p h ASN 9090Ca -0.37 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 54.82 1x0p h ASN 9090Cb 2.07 -0.02 -0.31 0.00 0.05 0.00 0.00 38.32 40.10 1x0p h ASN 9090CO 0.14 0.07 -0.84 0.26 -1.65 0.00 0.00 177.43 175.41 1x0p s TRP 9091N -5.15 1.66 0.51 1.19 0.51 -1.26 -4.96 118.94 111.44 1x0p s TRP 9091Ca -0.06 -0.45 0.24 0.00 -2.12 0.00 0.00 56.10 53.72 1x0p s TRP 9091Cb 0.19 -1.11 1.49 0.00 -0.81 0.00 0.00 33.47 33.22 1x0p s TRP 9091CO 0.71 -0.14 2.15 0.66 -0.51 0.00 0.00 176.95 179.82 1x0p h SER 9092N 6.15 0.00 -1.11 2.95 4.64 -1.84 -1.93 113.55 122.41 1x0p h SER 9092Ca -0.33 0.00 0.24 0.00 -0.47 0.00 0.00 61.79 61.22 1x0p h SER 9092Cb 1.17 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.95 1x0p h SER 9092CO 0.48 0.06 0.67 -0.32 -0.87 0.00 0.00 176.83 176.85 1x0p s MET 9093N -4.60 0.03 -0.02 4.77 -2.45 -1.26 -3.60 119.30 112.17 1x0p s MET 9093Ca -0.04 0.05 0.06 0.00 -1.25 0.00 0.00 55.69 54.51 1x0p s MET 9093Cb 0.15 0.02 -0.02 0.00 1.25 0.00 0.00 34.83 36.23 1x0p s MET 9093CO 0.60 -0.01 -0.20 0.50 1.05 0.00 0.00 175.02 176.96 1x0p s ARG 9094N 1.50 1.67 -0.13 4.11 3.00 -1.19 -4.83 118.95 123.08 1x0p s ARG 9094Ca -0.04 -0.73 -0.06 0.00 -1.00 0.00 0.00 55.73 53.90 1x0p s ARG 9094Cb -0.01 -1.61 -0.04 0.00 0.00 0.00 0.00 34.95 33.29 1x0p s ARG 9094CO -0.13 0.44 0.07 -1.17 0.00 0.00 0.00 175.30 174.51 1x0p s LEU 9095N -0.47 3.94 -0.19 -0.88 0.20 -1.26 -0.03 118.68 120.00 1x0p s LEU 9095Ca 0.08 0.23 -0.01 0.00 0.69 0.00 0.00 54.13 55.12 1x0p s LEU 9095Cb -0.08 -1.96 0.05 0.00 -0.43 0.00 0.00 46.19 43.77 1x0p s LEU 9095CO -0.01 0.32 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.65 1x0p s VAL 9096N -0.50 1.04 -0.49 1.68 1.01 0.32 -4.96 120.40 118.51 1x0p s VAL 9096Ca 0.10 -0.73 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 1x0p s VAL 9096Cb -0.12 -1.32 0.06 0.00 0.00 0.00 0.00 36.38 35.00 1x0p s VAL 9096CO 0.02 -0.01 0.52 -1.10 0.00 0.00 0.00 175.10 174.53 1x0p s GLN 9097N 1.64 3.06 0.66 2.72 -0.21 -1.26 -1.63 119.66 124.64 1x0p s GLN 9097Ca -0.01 -1.06 0.33 0.00 0.02 0.00 0.00 55.36 54.63 1x0p s GLN 9097Cb -0.16 -4.10 1.79 0.00 1.00 0.00 0.00 33.01 31.53 1x0p s GLN 9097CO -0.07 -1.12 2.01 -0.07 -2.12 0.00 0.00 175.29 173.91 1x0p h LEU 9098N 9.28 0.00 -0.01 2.90 3.38 -1.79 0.76 115.31 129.84 1x0p h LEU 9098Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1x0p h LEU 9098Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1x0p h LEU 9098CO 0.92 0.00 -0.03 0.61 0.09 0.00 0.00 178.44 180.03 1x0p n GLY 9099N -1.19 -1.40 0.51 0.83 0.00 -1.26 -3.31 105.19 99.37 1x0p n GLY 9099Ca -0.02 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.91 1x0p n GLY 9099CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x0p n GLU 9100N -1.41 2.85 -3.14 1.61 1.02 0.26 -5.02 120.64 116.81 1x0p n GLU 9100Ca 0.09 -2.04 -0.18 0.00 -0.02 0.00 0.00 57.16 55.01 1x0p n GLU 9100Cb 0.31 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 1x0p n GLU 9100CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1x0p s MET 9101N -1.29 2.84 0.18 3.49 -1.94 -1.21 -5.05 119.30 116.33 1x0p s MET 9101Ca 0.21 -1.23 -0.31 0.00 -1.71 0.00 0.00 55.69 52.64 1x0p s MET 9101Cb 0.13 -2.73 -0.10 0.00 2.01 0.00 0.00 34.83 34.14 1x0p s MET 9101CO 0.11 -0.21 1.50 0.34 -0.01 0.00 0.00 175.02 176.75 1x0p s ASP 9102N -4.30 6.65 0.00 3.03 2.15 -1.26 -4.95 116.67 117.99 1x0p s ASP 9102Ca 0.53 2.58 0.00 0.00 0.43 0.00 0.00 52.55 56.08 1x0p s ASP 9102Cb -0.09 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 1x0p s ASP 9102CO 0.32 -0.76 0.64 -1.54 -0.17 0.00 0.00 175.17 173.66 1x0p n SER 9103N 3.53 0.00 -0.35 -0.34 3.41 -1.26 -2.03 113.62 116.58 1x0p n SER 9103Ca 0.11 0.64 0.15 0.00 -0.26 0.00 0.00 58.87 59.52 1x0p n SER 9103Cb 0.40 -0.14 0.36 0.00 -0.26 0.00 0.00 64.21 64.57 1x0p n SER 9103CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1x0p h ASP 9104N 0.00 0.72 -0.25 4.04 3.32 -1.98 0.51 116.42 122.78 1x0p h ASP 9104Ca 0.00 0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.21 1x0p h ASP 9104Cb 0.00 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.49 1x0p h ASP 9104CO 0.00 0.20 -0.05 0.74 -1.72 0.00 0.00 179.24 178.41 1x0p h THR 9105N 0.67 0.76 0.08 0.35 2.02 -1.89 -1.72 112.91 113.17 1x0p h THR 9105Ca 0.60 -0.00 -0.25 0.00 0.77 0.00 0.00 66.41 67.53 1x0p h THR 9105Cb 1.06 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1x0p h THR 9105CO -0.41 0.00 -1.12 0.40 0.37 0.00 0.00 175.52 174.76 1x0p h ILE 9106N 0.01 1.54 -0.58 3.11 5.03 -0.77 -3.05 117.51 122.80 1x0p h ILE 9106Ca 0.12 -3.05 0.09 0.00 -0.12 0.00 0.00 64.86 61.89 1x0p h ILE 9106Cb 0.18 2.83 -0.07 0.00 -3.03 0.00 0.00 36.82 36.74 1x0p h ILE 9106CO -0.25 0.89 0.22 -0.09 -0.68 0.00 0.00 178.15 178.24 1x0p h ARG 9107N 0.07 0.40 -0.01 2.37 1.12 -0.67 0.26 114.38 117.92 1x0p h ARG 9107Ca -0.09 -0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.75 1x0p h ARG 9107Cb 1.84 -0.09 -0.00 0.00 -0.01 0.00 0.00 29.97 31.71 1x0p h ARG 9107CO 0.18 0.26 0.00 0.00 -3.11 0.00 0.00 179.97 177.30 1x0p h ARG 9108N 0.41 0.01 -0.43 0.20 3.08 -1.38 -2.19 114.38 114.08 1x0p h ARG 9108Ca 0.29 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.38 1x0p h ARG 9108Cb 0.34 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 1x0p h ARG 9108CO -0.28 0.26 0.19 1.25 -1.07 0.00 0.00 179.97 180.31 1x0p h LEU 9109N -0.24 0.24 0.06 3.04 6.46 -1.29 0.14 115.31 123.72 1x0p h LEU 9109Ca 0.00 0.04 0.01 0.00 -0.12 0.00 0.00 57.88 57.81 1x0p h LEU 9109Cb 0.25 -0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.16 1x0p h LEU 9109CO 0.00 0.18 -0.14 -0.09 -0.62 0.00 0.00 178.44 177.76 1x0p h ARG 9110N 0.38 -0.26 -0.63 1.25 2.43 -0.49 -2.80 114.38 114.25 1x0p h ARG 9110Ca 0.19 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1x0p h ARG 9110Cb 0.14 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1x0p h ARG 9110CO -0.17 -0.17 0.36 -0.07 -1.51 0.00 0.00 179.97 178.41 1x0p h LEU 9111N -0.27 0.78 -1.30 3.80 3.38 -1.03 -2.52 115.31 118.14 1x0p h LEU 9111Ca 0.03 -0.08 0.17 0.00 0.09 0.00 0.00 57.88 58.08 1x0p h LEU 9111Cb 0.30 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 1x0p h LEU 9111CO -0.10 0.64 0.59 0.50 0.09 0.00 0.00 178.44 180.16 1x0p h LYS 9112N 0.86 0.61 -0.17 1.13 3.64 -0.48 -2.71 116.57 119.45 1x0p h LYS 9112Ca 0.22 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1x0p h LYS 9112Cb 0.02 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1x0p h LYS 9112CO -0.04 0.40 0.00 0.66 -2.27 0.00 0.00 179.45 178.20 1x0p n TYR 9113N -4.58 0.51 -3.53 1.91 0.53 -1.11 -5.03 117.16 105.86 1x0p n TYR 9113Ca 0.19 -0.82 -0.11 0.00 -1.02 0.00 0.00 57.90 56.13 1x0p n TYR 9113Cb 0.55 -0.20 -0.03 0.00 -1.03 0.00 0.00 39.34 38.63 1x0p n TYR 9113CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1x0p s SER 9114N -1.99 -0.40 0.00 7.72 1.04 -0.96 -4.78 113.70 114.32 1x0p s SER 9114Ca 0.32 -0.16 0.25 0.00 0.48 0.00 0.00 55.95 56.84 1x0p s SER 9114Cb 0.26 0.54 0.76 0.00 0.10 0.00 0.00 66.02 67.67 1x0p s SER 9114CO 0.07 -0.91 1.57 -0.81 0.98 0.00 0.00 173.24 174.14 1x0p n PRO 9115N -0.30 1.88 -3.31 4.02 -0.04 -1.26 -4.59 135.00 131.39 1x0p n PRO 9115Ca -0.16 -1.30 -0.36 0.00 -0.04 0.00 0.00 63.50 61.64 1x0p n PRO 9115Cb 0.64 -1.45 -0.06 0.00 -0.04 0.00 0.00 33.50 32.59 1x0p n PRO 9115CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x0p s ALA 9116N -1.89 3.55 -0.62 0.55 0.00 -1.26 -4.98 121.76 117.12 1x0p s ALA 9116Ca 0.35 -0.08 0.25 0.00 0.00 0.00 0.00 51.96 52.48 1x0p s ALA 9116Cb 0.20 -2.58 0.57 0.00 0.00 0.00 0.00 23.12 21.31 1x0p s ALA 9116CO 0.31 0.43 1.62 0.00 0.00 0.00 0.00 175.76 178.12 1x0p h ALA 9117N 3.56 0.90 -2.17 0.00 0.00 -1.96 -3.41 119.26 116.19 1x0p h ALA 9117Ca -0.48 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.01 1x0p h ALA 9117Cb 1.19 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 1x0p h ALA 9117CO 0.66 0.00 -0.68 0.95 0.00 0.00 0.00 179.25 180.17 1x0p s THR 9118N -3.15 1.33 -0.25 0.00 -4.23 -1.26 -5.00 115.64 103.08 1x0p s THR 9118Ca 0.08 -2.09 -0.28 0.00 -1.18 0.00 0.00 61.69 58.22 1x0p s THR 9118Cb 0.10 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.65 1x0p s THR 9118CO 0.65 -0.42 2.05 0.12 -0.54 0.00 0.00 174.62 176.48 1x0p s PHE 9119N -3.22 1.41 -0.37 3.99 5.36 -1.26 -4.92 117.98 118.96 1x0p s PHE 9119Ca 0.26 0.54 0.02 0.00 -0.96 0.00 0.00 56.93 56.79 1x0p s PHE 9119Cb 0.04 -4.01 0.15 0.00 -0.34 0.00 0.00 43.02 38.86 1x0p s PHE 9119CO 0.08 -3.71 0.28 -0.65 -1.46 0.00 0.00 175.22 169.77 1x0p s GLN 9120N 6.02 0.65 0.57 10.12 -0.21 -1.26 -4.80 119.66 130.76 1x0p s GLN 9120Ca 0.92 -1.39 0.27 0.00 0.02 0.00 0.00 55.36 55.18 1x0p s GLN 9120Cb -0.29 -1.17 1.57 0.00 1.00 0.00 0.00 33.01 34.12 1x0p s GLN 9120CO 0.35 -1.25 2.09 -1.00 -2.12 0.00 0.00 175.29 173.36 1x0p h PRO 9121N 6.68 0.00 0.00 2.91 0.13 -1.94 -1.12 132.00 138.67 1x0p h PRO 9121Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1x0p h PRO 9121Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1x0p h PRO 9121CO 0.26 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.03 1x0p h ARG 9122N 0.00 0.00 -0.49 0.86 3.08 -1.98 -1.18 114.38 114.67 1x0p h ARG 9122Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1x0p h ARG 9122Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1x0p h ARG 9122CO -0.00 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.77 1x0p n SER 9123N -2.73 3.32 -4.65 7.04 3.41 -0.42 -4.93 113.62 114.65 1x0p n SER 9123Ca 0.00 -1.97 -0.31 0.00 -0.26 0.00 0.00 58.87 56.33 1x0p n SER 9123Cb 0.20 -0.32 -0.09 0.00 -0.26 0.00 0.00 64.21 63.74 1x0p n SER 9123CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1x0p s MET 9124N -1.35 2.54 0.83 4.33 -1.94 -0.45 -4.65 119.30 118.61 1x0p s MET 9124Ca 0.41 -0.80 -0.11 0.00 -1.71 0.00 0.00 55.69 53.48 1x0p s MET 9124Cb 0.22 -2.53 0.13 0.00 2.01 0.00 0.00 34.83 34.67 1x0p s MET 9124CO 0.30 0.56 1.17 0.95 -0.01 0.00 0.00 175.02 178.00 1x0p s THR 9125N -1.19 2.08 0.10 2.05 -4.23 -1.26 -4.85 115.64 108.34 1x0p s THR 9125Ca 0.22 -0.14 -0.20 0.00 -1.18 0.00 0.00 61.69 60.40 1x0p s THR 9125Cb -0.11 -2.94 -0.08 0.00 1.34 0.00 0.00 72.50 70.70 1x0p s THR 9125CO 0.14 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.91 1x0p h ALA 9126N -1.11 0.26 -0.66 3.99 0.00 -1.98 -1.00 119.26 118.77 1x0p h ALA 9126Ca -0.44 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1x0p h ALA 9126Cb 1.28 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1x0p h ALA 9126CO 0.51 -0.19 0.31 1.49 0.00 0.00 0.00 179.25 181.37 1x0p h GLU 9127N 0.21 0.95 -0.25 0.00 4.57 -1.95 -0.37 114.58 117.74 1x0p h GLU 9127Ca 0.07 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1x0p h GLU 9127Cb 0.10 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1x0p h GLU 9127CO -0.01 0.74 0.05 1.96 -1.18 0.00 0.00 179.01 180.57 1x0p h GLN 9128N 0.94 0.42 -0.71 1.92 4.20 -1.80 -1.29 115.11 118.78 1x0p h GLN 9128Ca 0.23 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 1x0p h GLN 9128Cb 0.11 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1x0p h GLN 9128CO -0.03 0.53 0.26 0.00 -0.67 0.00 0.00 178.83 178.93 1x0p h PHE 9130N 1.04 -0.68 -0.51 0.00 3.57 -0.87 -0.41 116.94 119.08 1x0p h PHE 9130Ca 0.24 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1x0p h PHE 9130Cb 0.23 0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1x0p h PHE 9130CO 0.02 -0.40 0.18 0.00 -2.23 0.00 0.00 178.31 175.89 1x0p h ARG 9131N -0.81 0.74 0.17 1.11 3.08 -1.16 0.72 114.38 118.22 1x0p h ARG 9131Ca -0.08 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1x0p h ARG 9131Cb 0.60 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1x0p h ARG 9131CO 0.12 0.62 -0.08 0.35 -1.07 0.00 0.00 179.97 179.91 1x0p h PHE 9132N 0.73 -0.21 -0.43 3.04 3.57 -0.93 -1.64 116.94 121.07 1x0p h PHE 9132Ca 0.17 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 1x0p h PHE 9132Cb 0.17 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1x0p h PHE 9132CO 0.01 -0.05 0.06 -0.07 -2.23 0.00 0.00 178.31 176.04 1x0p h LEU 9133N -0.33 0.62 -0.62 0.59 3.38 -0.78 -2.63 115.31 115.55 1x0p h LEU 9133Ca -0.02 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1x0p h LEU 9133Cb 0.26 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1x0p h LEU 9133CO 0.04 0.65 0.10 0.50 0.09 0.00 0.00 178.44 179.82 1x0p h LYS 9134N 0.64 1.03 -0.57 1.13 3.64 -0.65 -0.39 116.57 121.41 1x0p h LYS 9134Ca 0.14 -0.28 -0.09 0.00 -1.27 0.00 0.00 60.65 59.15 1x0p h LYS 9134Cb 0.31 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1x0p h LYS 9134CO 0.00 0.97 -0.01 0.93 -2.27 0.00 0.00 179.45 179.07 1x0p h GLU 9135N 0.94 0.99 -0.68 1.90 5.08 -1.09 -0.17 114.58 121.56 1x0p h GLU 9135Ca 0.19 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.20 1x0p h GLU 9135Cb 0.44 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1x0p h GLU 9135CO 0.01 0.98 0.25 -0.07 -1.00 0.00 0.00 179.01 179.19 1x0p h LEU 9136N 0.91 0.96 -0.13 1.33 3.38 -1.24 -1.44 115.31 119.09 1x0p h LEU 9136Ca 0.16 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1x0p h LEU 9136Cb 0.54 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1x0p h LEU 9136CO 0.03 0.88 -0.05 0.22 0.09 0.00 0.00 178.44 179.61 1x0p h TYR 9137N 0.98 -0.11 -0.67 1.13 3.20 -0.60 -2.70 116.97 118.20 1x0p h TYR 9137Ca 0.23 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 1x0p h TYR 9137Cb 0.24 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 1x0p h TYR 9137CO 0.02 -0.08 0.30 -0.44 -1.64 0.00 0.00 178.16 176.32 1x0p h ASP 9138N -0.03 0.87 0.52 -2.11 3.45 -0.77 -2.27 116.42 116.08 1x0p h ASP 9138Ca 0.07 -0.10 -0.02 0.00 0.43 0.00 0.00 57.03 57.40 1x0p h ASP 9138Cb 0.13 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.67 1x0p h ASP 9138CO -0.15 0.75 -0.12 0.24 -1.57 0.00 0.00 179.24 178.40 1x0p h MET 9139N 0.95 0.00 -0.03 3.56 2.86 -0.99 -3.51 114.93 117.77 1x0p h MET 9139Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1x0p h MET 9139Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1x0p h MET 9139CO -0.03 0.12 0.00 0.43 1.06 0.00 0.00 176.91 178.49