#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c74 h ASP 5005N 0.00 0.00 -2.42 -3.46 3.32 -1.46 -3.47 116.42 108.93 3c74 h ASP 5005Ca 0.00 -0.03 -0.61 0.00 0.02 0.00 0.00 57.03 56.41 3c74 h ASP 5005Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 3c74 h ASP 5005CO 0.00 0.01 -0.76 0.68 -1.72 0.00 0.00 179.24 177.45 3c74 s VAL 5006N -3.26 2.56 0.12 -1.35 -7.23 -1.21 -5.06 120.40 104.98 3c74 s VAL 5006Ca 0.04 -2.27 0.03 0.00 -1.81 0.00 0.00 61.98 57.98 3c74 s VAL 5006Cb 0.08 -2.32 -0.21 0.00 0.56 0.00 0.00 36.38 34.49 3c74 s VAL 5006CO 0.72 -0.33 1.27 0.15 -0.31 0.00 0.00 175.10 176.60 3c74 h PHE 5007N 2.44 0.17 0.00 2.82 3.57 -1.94 -3.38 116.94 120.62 3c74 h PHE 5007Ca -0.42 -0.12 -0.27 0.00 3.53 0.00 0.00 57.97 60.70 3c74 h PHE 5007Cb 1.25 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 3c74 h PHE 5007CO 0.77 1.05 -1.95 0.72 -2.23 0.00 0.00 178.31 176.68 3c74 n HIS 5008N -3.47 0.00 0.23 0.41 8.25 -1.26 -4.72 115.22 114.66 3c74 n HIS 5008Ca -0.03 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.55 3c74 n HIS 5008Cb 0.93 -0.62 0.43 0.00 1.12 0.00 0.00 29.99 31.84 3c74 n HIS 5008CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3c74 h LEU 5009N -0.29 0.00 -1.10 2.41 3.38 -1.92 -3.44 115.31 114.34 3c74 h LEU 5009Ca -0.40 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.33 3c74 h LEU 5009Cb 1.48 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.32 3c74 h LEU 5009CO -0.16 0.14 -0.44 0.61 0.09 0.00 0.00 178.44 178.69 3c74 n GLY 5010N 0.40 -0.00 3.20 0.83 0.00 -1.26 -4.69 105.19 103.67 3c74 n GLY 5010Ca 0.01 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 3c74 n GLY 5010CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c74 s LEU 5011N -4.91 2.23 0.32 0.99 1.43 -1.26 -4.85 118.68 112.63 3c74 s LEU 5011Ca 0.29 -0.56 0.07 0.00 -1.03 0.00 0.00 54.13 52.90 3c74 s LEU 5011Cb -0.13 -0.69 -0.03 0.00 0.03 0.00 0.00 46.19 45.38 3c74 s LEU 5011CO 0.46 0.02 0.28 0.42 0.23 0.00 0.00 176.35 177.77 3c74 s THR 5012N -1.04 3.70 0.34 5.49 -4.23 -1.26 -1.06 115.64 117.58 3c74 s THR 5012Ca 0.02 -1.36 0.03 0.00 -1.18 0.00 0.00 61.69 59.21 3c74 s THR 5012Cb -0.09 -3.23 0.19 0.00 1.34 0.00 0.00 72.50 70.71 3c74 s THR 5012CO 0.02 -0.20 1.92 0.50 -0.54 0.00 0.00 174.62 176.32 3c74 h LYS 5013N 1.27 0.64 0.00 3.99 3.64 -1.96 -2.42 116.57 121.73 3c74 h LYS 5013Ca -0.45 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 58.80 3c74 h LYS 5013Cb 1.25 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3c74 h LYS 5013CO 0.59 0.56 -0.14 -0.97 -2.27 0.00 0.00 179.45 177.22 3c74 h ASN 5014N 0.63 0.00 -0.39 4.20 -0.00 -1.95 -2.50 115.58 115.56 3c74 h ASN 5014Ca 0.15 0.00 0.08 0.00 -0.00 0.00 0.00 56.30 56.53 3c74 h ASN 5014Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.49 3c74 h ASN 5014CO -0.01 0.14 0.27 0.44 -0.00 0.00 0.00 177.43 178.27 3c74 h ASP 5015N 0.00 0.14 1.62 1.15 3.32 -1.83 -2.70 116.42 118.12 3c74 h ASP 5015Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3c74 h ASP 5015Cb 0.24 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3c74 h ASP 5015CO 0.02 0.09 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.40 3c74 h LEU 5016N 0.16 0.00 -1.58 1.55 4.07 -1.56 -3.48 115.31 114.47 3c74 h LEU 5016Ca 0.18 -0.02 -0.51 0.00 0.08 0.00 0.00 57.88 57.61 3c74 h LEU 5016Cb 0.51 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 42.15 3c74 h LEU 5016CO -0.03 0.01 -0.86 0.00 -1.08 0.00 0.00 178.44 176.48 3c74 n GLN 5017N -2.68 -3.46 -0.98 1.13 1.13 -1.02 -1.81 117.38 109.69 3c74 n GLN 5017Ca 0.04 0.41 0.00 0.00 -1.94 0.00 0.00 57.00 55.51 3c74 n GLN 5017Cb 0.49 -4.79 0.00 0.00 0.11 0.00 0.00 30.24 26.05 3c74 n GLN 5017CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3c74 n GLY 5018N -1.78 0.51 3.76 1.08 0.00 -1.26 -4.72 105.19 102.78 3c74 n GLY 5018Ca -0.16 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 3c74 n GLY 5018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c74 s ALA 5019N -2.00 3.61 0.00 4.61 0.00 -0.75 -4.90 121.76 122.33 3c74 s ALA 5019Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.35 3c74 s ALA 5019Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.56 3c74 s ALA 5019CO 0.00 -0.81 0.41 1.04 0.00 0.00 0.00 175.76 176.40 3c74 n GLN 5020N 1.64 -0.52 -4.70 0.00 6.02 -1.26 -4.29 117.38 114.27 3c74 n GLN 5020Ca 0.04 -0.41 -0.24 0.00 -0.01 0.00 0.00 57.00 56.39 3c74 n GLN 5020Cb 0.40 -0.90 -0.16 0.00 1.02 0.00 0.00 30.24 30.60 3c74 n GLN 5020CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3c74 s LEU 5021N -0.08 1.91 -0.02 1.08 0.20 -1.26 -0.52 118.68 119.99 3c74 s LEU 5021Ca 0.00 -0.29 0.04 0.00 0.69 0.00 0.00 54.13 54.57 3c74 s LEU 5021Cb 0.00 -0.82 -0.01 0.00 -0.43 0.00 0.00 46.19 44.93 3c74 s LEU 5021CO 0.00 0.14 -0.15 0.00 -0.29 0.00 0.00 176.35 176.06 3c74 s ALA 5022N -0.03 1.27 -0.12 5.97 0.00 -0.08 -1.99 121.76 126.78 3c74 s ALA 5022Ca -0.01 -0.61 -0.16 0.00 0.00 0.00 0.00 51.96 51.18 3c74 s ALA 5022Cb -0.09 -0.38 -0.05 0.00 0.00 0.00 0.00 23.12 22.60 3c74 s ALA 5022CO 0.01 0.27 0.41 0.42 0.00 0.00 0.00 175.76 176.87 3c74 s ILE 5023N -0.14 5.20 -0.54 0.00 1.01 0.28 -1.32 121.20 125.69 3c74 s ILE 5023Ca 0.01 0.81 0.04 0.00 0.00 0.00 0.00 60.65 61.51 3c74 s ILE 5023Cb -0.08 -3.75 0.15 0.00 0.01 0.00 0.00 42.46 38.79 3c74 s ILE 5023CO 0.00 0.38 0.33 0.68 0.00 0.00 0.00 174.94 176.33 3c74 s VAL 5024N 0.36 2.18 1.02 2.92 -7.23 0.65 -1.46 120.40 118.83 3c74 s VAL 5024Ca 0.23 -3.33 -0.15 0.00 -1.81 0.00 0.00 61.98 56.92 3c74 s VAL 5024Cb -0.15 -2.49 0.20 0.00 0.56 0.00 0.00 36.38 34.51 3c74 s VAL 5024CO 0.09 -0.92 1.15 -2.16 -0.31 0.00 0.00 175.10 172.95 3c74 s PRO 5025N -0.42 0.26 -0.19 4.82 0.04 -1.23 -3.35 135.00 134.93 3c74 s PRO 5025Ca 0.21 0.11 -0.18 0.00 0.04 0.00 0.00 61.00 61.18 3c74 s PRO 5025Cb -0.17 -1.75 -0.21 0.00 0.04 0.00 0.00 34.50 32.41 3c74 s PRO 5025CO -0.06 -2.76 0.24 0.41 0.04 0.00 0.00 177.00 174.87 3c74 n GLY 5026N -1.91 -0.76 3.65 0.56 0.00 -1.24 -1.76 105.19 103.73 3c74 n GLY 5026Ca 0.09 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3c74 n GLY 5026CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3c74 s ASP 5027N -6.92 6.71 0.45 1.61 3.68 -1.26 -1.47 116.67 119.46 3c74 s ASP 5027Ca -0.28 0.87 0.20 0.00 2.13 0.00 0.00 52.55 55.47 3c74 s ASP 5027Cb 0.06 -2.37 1.17 0.00 -1.45 0.00 0.00 42.92 40.33 3c74 s ASP 5027CO 0.63 -0.36 1.87 -0.65 0.13 0.00 0.00 175.17 176.79 3c74 h PRO 5028N 7.64 0.30 -0.20 4.34 0.11 -1.90 -1.23 132.00 141.07 3c74 h PRO 5028Ca -0.28 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.87 3c74 h PRO 5028Cb 1.13 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3c74 h PRO 5028CO 0.80 0.20 0.21 1.49 -0.21 0.00 0.00 178.00 180.49 3c74 h GLU 5029N 0.31 0.00 0.00 1.05 4.57 -1.97 -2.48 114.58 116.07 3c74 h GLU 5029Ca 0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.63 3c74 h GLU 5029Cb 1.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3c74 h GLU 5029CO -0.14 0.00 -0.73 -0.09 -1.18 0.00 0.00 179.01 176.87 3c74 h ARG 5030N 0.00 0.00 -0.39 1.92 2.43 -1.63 -3.40 114.38 113.31 3c74 h ARG 5030Ca 0.09 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 3c74 h ARG 5030Cb 0.52 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 3c74 h ARG 5030CO -0.00 0.00 0.19 0.28 -1.51 0.00 0.00 179.97 178.93 3c74 h VAL 5031N 0.00 0.98 -0.59 0.20 2.07 -1.54 -2.29 116.25 115.08 3c74 h VAL 5031Ca 0.00 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 3c74 h VAL 5031Cb 0.90 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 3c74 h VAL 5031CO 0.00 0.07 0.17 -0.08 0.02 0.00 0.00 177.57 177.75 3c74 h GLU 5032N 0.39 0.92 -0.80 1.57 4.81 -1.78 -2.51 114.58 117.18 3c74 h GLU 5032Ca 0.16 -0.21 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3c74 h GLU 5032Cb 0.07 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 3c74 h GLU 5032CO -0.12 0.83 0.38 0.87 -0.73 0.00 0.00 179.01 180.25 3c74 h LYS 5033N 0.84 1.15 -0.21 1.92 1.57 -1.72 -0.38 116.57 119.74 3c74 h LYS 5033Ca 0.19 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3c74 h LYS 5033Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3c74 h LYS 5033CO -0.00 0.89 0.03 0.82 -0.57 0.00 0.00 179.45 180.62 3c74 h ILE 5034N 1.14 1.23 0.00 1.86 2.04 -1.34 -3.16 117.51 119.28 3c74 h ILE 5034Ca 0.28 -0.75 -0.07 0.00 1.00 0.00 0.00 64.86 65.32 3c74 h ILE 5034Cb 0.12 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 3c74 h ILE 5034CO -0.03 0.23 -0.33 0.00 0.00 0.00 0.00 178.15 178.02 3c74 h ALA 5035N 0.83 1.16 0.00 1.87 0.00 -1.21 -2.96 119.26 118.96 3c74 h ALA 5035Ca 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3c74 h ALA 5035Cb 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3c74 h ALA 5035CO 0.00 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.67 3c74 n ALA 5036N -2.35 1.55 1.11 0.00 0.00 -0.17 -1.59 120.51 119.06 3c74 n ALA 5036Ca -0.01 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.54 3c74 n ALA 5036Cb 0.43 -1.24 0.35 0.00 0.00 0.00 0.00 19.45 18.99 3c74 n ALA 5036CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3c74 n LEU 5037N -1.68 2.13 0.00 0.00 4.77 -1.12 -4.91 117.00 116.19 3c74 n LEU 5037Ca 0.03 -0.82 -0.26 0.00 -0.03 0.00 0.00 56.01 54.92 3c74 n LEU 5037Cb 0.15 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 3c74 n LEU 5037CO 0.13 0.41 -0.14 0.23 -1.33 0.00 0.00 177.39 176.68 3c74 n MET 5038N 0.63 0.94 -3.58 3.23 2.81 -0.62 -5.12 117.12 115.41 3c74 n MET 5038Ca 0.17 -3.05 -0.32 0.00 -1.81 0.00 0.00 57.70 52.70 3c74 n MET 5038Cb 0.42 0.71 -0.05 0.00 -0.71 0.00 0.00 33.22 33.60 3c74 n MET 5038CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3c74 s ASP 5039N -3.41 6.54 -1.07 7.83 -0.00 0.27 -4.55 116.67 122.28 3c74 s ASP 5039Ca 0.06 0.71 -0.20 0.00 -0.00 0.00 0.00 52.55 53.12 3c74 s ASP 5039Cb -0.00 -2.14 0.01 0.00 -0.00 0.00 0.00 42.92 40.79 3c74 s ASP 5039CO 0.04 0.01 0.71 0.29 -0.00 0.00 0.00 175.17 176.21 3c74 n LYS 5040N 0.01 -0.95 -2.65 8.23 5.02 -1.26 0.39 118.16 126.95 3c74 n LYS 5040Ca -0.01 0.46 -0.42 0.00 -2.02 0.00 0.00 58.31 56.32 3c74 n LYS 5040Cb 0.52 -3.28 -0.03 0.00 -0.02 0.00 0.00 35.03 32.22 3c74 n LYS 5040CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3c74 s PRO 5041N -6.06 4.50 -0.03 1.97 0.05 -1.26 -4.36 135.00 129.82 3c74 s PRO 5041Ca 0.35 1.47 0.01 0.00 0.05 0.00 0.00 61.00 62.88 3c74 s PRO 5041Cb -0.16 -3.47 0.02 0.00 0.05 0.00 0.00 34.50 30.94 3c74 s PRO 5041CO 0.90 -0.16 -0.03 0.54 0.05 0.00 0.00 177.00 178.31 3c74 s VAL 5042N 1.30 0.34 0.23 -0.36 0.11 -0.25 -5.01 120.40 116.76 3c74 s VAL 5042Ca 0.52 -0.07 -0.31 0.00 -2.93 0.00 0.00 61.98 59.20 3c74 s VAL 5042Cb -0.22 -0.37 -0.11 0.00 -1.53 0.00 0.00 36.38 34.16 3c74 s VAL 5042CO 0.26 0.15 1.60 -0.75 -3.33 0.00 0.00 175.10 173.03 3c74 s LYS 5043N 0.62 4.17 -0.07 1.54 2.47 -1.26 -1.09 119.74 126.12 3c74 s LYS 5043Ca -0.07 2.49 -0.08 0.00 -1.56 0.00 0.00 55.97 56.75 3c74 s LYS 5043Cb -0.10 -3.09 -0.03 0.00 -1.46 0.00 0.00 37.83 33.16 3c74 s LYS 5043CO -0.01 -0.63 -0.15 1.28 0.16 0.00 0.00 175.35 176.00 3c74 n LEU 5044N 3.20 0.89 -3.81 5.43 4.77 -0.17 -4.88 117.00 122.44 3c74 n LEU 5044Ca 0.12 0.15 -0.09 0.00 -0.03 0.00 0.00 56.01 56.15 3c74 n LEU 5044Cb 0.37 -0.57 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 3c74 n LEU 5044CO 0.63 -0.41 0.25 0.00 -1.33 0.00 0.00 177.39 176.53 3c74 s ALA 5045N -2.86 -0.79 -0.26 -1.18 0.00 -1.08 -5.00 121.76 110.59 3c74 s ALA 5045Ca -0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 3c74 s ALA 5045Cb 0.02 0.89 0.14 0.00 0.00 0.00 0.00 23.12 24.16 3c74 s ALA 5045CO 0.18 -0.82 0.37 0.45 0.00 0.00 0.00 175.76 175.94 3c74 s SER 5046N -2.91 0.53 -0.03 0.00 0.15 -1.26 -0.52 113.70 109.67 3c74 s SER 5046Ca 0.12 -0.11 0.01 0.00 0.70 0.00 0.00 55.95 56.66 3c74 s SER 5046Cb -0.01 1.00 0.02 0.00 -1.71 0.00 0.00 66.02 65.32 3c74 s SER 5046CO 0.00 -0.33 -0.02 -1.00 1.20 0.00 0.00 173.24 173.09 3c74 s HIS 5047N 2.51 0.42 0.00 3.44 3.76 -0.89 -4.99 115.29 119.54 3c74 s HIS 5047Ca 0.11 -0.06 0.00 0.00 -0.15 0.00 0.00 55.06 54.96 3c74 s HIS 5047Cb -0.14 -0.44 0.00 0.00 1.11 0.00 0.00 32.58 33.10 3c74 s HIS 5047CO -0.22 -0.12 0.00 0.54 -0.85 0.00 0.00 174.74 174.08 3c74 n ARG 5048N 3.94 0.00 -0.67 1.40 5.12 -1.26 -0.88 116.66 124.31 3c74 n ARG 5048Ca -0.25 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 55.75 3c74 n ARG 5048Cb 0.52 0.00 0.34 0.00 -1.16 0.00 0.00 32.46 32.16 3c74 n ARG 5048CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3c74 n GLU 5049N 14.00 3.92 -3.39 5.56 -0.58 -1.26 -4.78 120.64 134.11 3c74 n GLU 5049Ca 0.00 -2.68 -0.45 0.00 -0.42 0.00 0.00 57.16 53.61 3c74 n GLU 5049Cb 0.00 -1.99 -0.03 0.00 -0.57 0.00 0.00 31.44 28.85 3c74 n GLU 5049CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3c74 s PHE 5050N -2.15 3.75 -0.26 -0.32 0.08 -0.06 -3.93 117.98 115.09 3c74 s PHE 5050Ca 0.47 -2.16 -0.13 0.00 0.12 0.00 0.00 56.93 55.23 3c74 s PHE 5050Cb 0.33 -3.72 -0.04 0.00 -0.57 0.00 0.00 43.02 39.01 3c74 s PHE 5050CO 0.19 -0.96 0.27 0.99 -0.10 0.00 0.00 175.22 175.61 3c74 s THR 5051N -0.00 5.26 -0.07 0.64 2.01 -1.26 -2.10 115.64 120.13 3c74 s THR 5051Ca 0.19 0.38 0.03 0.00 0.31 0.00 0.00 61.69 62.59 3c74 s THR 5051Cb -0.11 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 3c74 s THR 5051CO -0.08 0.24 -0.14 -0.94 -0.69 0.00 0.00 174.62 173.01 3c74 s SER 5052N 1.47 4.02 0.07 3.53 1.04 0.32 -2.09 113.70 122.06 3c74 s SER 5052Ca 0.11 -0.22 0.05 0.00 0.48 0.00 0.00 55.95 56.37 3c74 s SER 5052Cb -0.15 -1.00 -0.03 0.00 0.10 0.00 0.00 66.02 64.94 3c74 s SER 5052CO 0.09 0.31 -0.13 0.26 0.98 0.00 0.00 173.24 174.75 3c74 s TRP 5053N -0.52 1.11 -0.09 5.02 0.52 0.30 -1.00 118.94 124.29 3c74 s TRP 5053Ca 0.07 -0.48 0.02 0.00 0.02 0.00 0.00 56.10 55.73 3c74 s TRP 5053Cb -0.12 -0.63 -0.02 0.00 -1.15 0.00 0.00 33.47 31.56 3c74 s TRP 5053CO 0.02 0.03 -0.16 0.50 0.02 0.00 0.00 176.95 177.36 3c74 s ARG 5054N -1.78 2.95 0.37 4.98 3.52 -0.25 -1.09 118.95 127.65 3c74 s ARG 5054Ca -0.03 -0.73 0.05 0.00 -0.13 0.00 0.00 55.73 54.89 3c74 s ARG 5054Cb -0.10 -2.46 -0.03 0.00 -1.56 0.00 0.00 34.95 30.81 3c74 s ARG 5054CO 0.02 0.37 0.20 0.00 -0.81 0.00 0.00 175.30 175.08 3c74 s ALA 5055N -0.09 2.44 -0.05 6.12 0.00 0.40 -1.09 121.76 129.50 3c74 s ALA 5055Ca -0.03 -1.59 0.02 0.00 0.00 0.00 0.00 51.96 50.36 3c74 s ALA 5055Cb -0.14 1.09 0.01 0.00 0.00 0.00 0.00 23.12 24.08 3c74 s ALA 5055CO 0.04 -0.49 -0.10 -2.00 0.00 0.00 0.00 175.76 173.21 3c74 s GLU 5056N -3.60 1.30 -0.19 0.00 2.12 0.16 -0.30 118.70 118.19 3c74 s GLU 5056Ca 0.31 -0.32 -0.01 0.00 0.36 0.00 0.00 54.97 55.32 3c74 s GLU 5056Cb 0.02 -1.14 0.05 0.00 0.26 0.00 0.00 34.13 33.33 3c74 s GLU 5056CO 0.20 0.03 -0.03 -1.17 -0.54 0.00 0.00 175.26 173.76 3c74 s LEU 5057N 0.57 1.77 -1.48 2.70 2.96 0.18 -0.56 118.68 124.82 3c74 s LEU 5057Ca -0.11 -0.86 -0.12 0.00 -0.22 0.00 0.00 54.13 52.82 3c74 s LEU 5057Cb -0.14 -0.89 0.06 0.00 0.50 0.00 0.00 46.19 45.73 3c74 s LEU 5057CO 0.02 -0.24 1.02 0.47 -1.32 0.00 0.00 176.35 176.30 3c74 n ASP 5058N 4.87 -4.98 0.00 3.68 8.00 -1.26 -2.00 116.55 124.86 3c74 n ASP 5058Ca -0.11 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 54.66 3c74 n ASP 5058Cb 0.46 -4.17 0.00 0.00 -0.02 0.00 0.00 41.12 37.40 3c74 n ASP 5058CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c74 n GLY 5059N -1.76 1.33 3.50 0.44 0.00 -1.26 -5.04 105.19 102.39 3c74 n GLY 5059Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3c74 n GLY 5059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c74 s LYS 5060N -0.39 2.67 0.28 1.61 1.02 -0.85 -5.08 119.74 119.00 3c74 s LYS 5060Ca 0.00 -0.65 -0.30 0.00 0.02 0.00 0.00 55.97 55.04 3c74 s LYS 5060Cb 0.00 -2.47 -0.10 0.00 -0.52 0.00 0.00 37.83 34.74 3c74 s LYS 5060CO 0.00 0.59 1.43 0.00 -0.92 0.00 0.00 175.35 176.46 3c74 s ALA 5061N -0.63 3.61 -0.01 5.17 0.00 -1.26 -0.64 121.76 127.99 3c74 s ALA 5061Ca 0.09 1.36 0.01 0.00 0.00 0.00 0.00 51.96 53.43 3c74 s ALA 5061Cb -0.11 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3c74 s ALA 5061CO 0.01 -0.78 -0.04 0.08 0.00 0.00 0.00 175.76 175.04 3c74 s VAL 5062N -0.31 0.31 -0.08 0.00 1.01 0.59 -4.38 120.40 117.54 3c74 s VAL 5062Ca 0.57 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.38 3c74 s VAL 5062Cb -0.42 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 3c74 s VAL 5062CO 0.47 0.10 0.05 -0.63 0.00 0.00 0.00 175.10 175.09 3c74 s ILE 5063N 0.04 4.68 -0.16 2.22 -1.09 -0.84 -0.45 121.20 125.59 3c74 s ILE 5063Ca 0.00 -0.15 0.01 0.00 -2.23 0.00 0.00 60.65 58.28 3c74 s ILE 5063Cb -0.03 -3.01 0.02 0.00 -1.58 0.00 0.00 42.46 37.86 3c74 s ILE 5063CO -0.00 0.57 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.42 3c74 s VAL 5064N -0.97 1.77 -0.04 2.92 1.01 -0.25 -0.56 120.40 124.29 3c74 s VAL 5064Ca 0.15 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.35 3c74 s VAL 5064Cb -0.12 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.67 3c74 s VAL 5064CO 0.04 0.49 0.09 0.00 0.00 0.00 0.00 175.10 175.73 3c74 s SER 5066N 0.90 6.41 -0.08 0.00 1.04 -0.89 -3.57 113.70 117.50 3c74 s SER 5066Ca -0.07 1.36 0.09 0.00 0.48 0.00 0.00 55.95 57.80 3c74 s SER 5066Cb -0.10 -2.43 -0.12 0.00 0.10 0.00 0.00 66.02 63.47 3c74 s SER 5066CO -0.04 -0.67 0.06 0.35 0.98 0.00 0.00 173.24 173.92 3c74 n THR 5067N -2.08 0.56 -2.01 2.02 -2.24 -0.72 -4.37 114.28 105.43 3c74 n THR 5067Ca 0.05 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3c74 n THR 5067Cb 0.54 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 3c74 n THR 5067CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c74 n GLY 5068N 2.35 -2.17 3.75 3.38 0.00 -0.54 -3.85 105.19 108.11 3c74 n GLY 5068Ca -0.14 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 3c74 n GLY 5068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3c74 s ILE 5069N -0.20 5.04 0.00 -0.61 1.01 -1.26 -4.76 121.20 120.43 3c74 s ILE 5069Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 60.65 61.76 3c74 s ILE 5069Cb 0.00 -3.87 0.00 0.00 0.01 0.00 0.00 42.46 38.60 3c74 s ILE 5069CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.94 3c74 n GLY 5070N 2.75 1.40 0.15 6.18 0.00 -1.26 -4.62 105.19 109.80 3c74 n GLY 5070Ca -0.07 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 3c74 n GLY 5070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3c74 h GLY 5071N 0.00 0.47 0.12 -0.02 0.00 -1.86 -2.62 103.07 99.16 3c74 h GLY 5071Ca 0.00 -0.27 0.08 0.00 0.00 0.00 0.00 47.33 47.14 3c74 h GLY 5071CO 0.00 0.25 -0.16 -2.55 0.00 0.00 0.00 176.54 174.09 3c74 h PRO 5072N 0.30 -0.08 -0.49 4.80 0.11 -1.94 0.26 132.00 134.96 3c74 h PRO 5072Ca 0.09 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 3c74 h PRO 5072Cb 0.22 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 3c74 h PRO 5072CO -0.00 -0.05 0.31 1.03 -0.21 0.00 0.00 178.00 179.07 3c74 h SER 5073N -0.08 0.58 -0.81 -2.05 0.87 -1.82 -2.78 113.55 107.46 3c74 h SER 5073Ca 0.19 -0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.76 3c74 h SER 5073Cb 0.37 -0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 3c74 h SER 5073CO -0.44 0.45 0.50 0.74 -0.53 0.00 0.00 176.83 177.55 3c74 h THR 5074N 0.66 1.05 -0.28 2.23 2.02 -0.95 -2.75 112.91 114.88 3c74 h THR 5074Ca 0.18 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.99 3c74 h THR 5074Cb -0.03 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.41 3c74 h THR 5074CO -0.03 0.17 -0.05 0.77 0.37 0.00 0.00 175.52 176.74 3c74 h SER 5075N 0.93 0.42 -0.15 4.18 4.64 -0.25 -1.67 113.55 121.64 3c74 h SER 5075Ca 0.34 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 3c74 h SER 5075Cb 0.13 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3c74 h SER 5075CO -0.16 0.53 -0.03 0.40 -0.87 0.00 0.00 176.83 176.70 3c74 h ILE 5076N 0.43 1.28 -0.41 0.95 2.04 -1.25 -2.40 117.51 118.15 3c74 h ILE 5076Ca 0.09 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 3c74 h ILE 5076Cb 0.36 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3c74 h ILE 5076CO 0.02 0.28 0.14 0.00 0.00 0.00 0.00 178.15 178.59 3c74 h ALA 5077N 0.72 0.54 -0.27 1.87 0.00 -1.28 -2.29 119.26 118.55 3c74 h ALA 5077Ca 0.04 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3c74 h ALA 5077Cb 0.45 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3c74 h ALA 5077CO 0.01 0.17 -0.01 0.28 0.00 0.00 0.00 179.25 179.70 3c74 h VAL 5078N 0.52 1.26 -0.08 0.00 2.07 -1.38 -1.17 116.25 117.47 3c74 h VAL 5078Ca 0.13 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3c74 h VAL 5078Cb 0.23 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3c74 h VAL 5078CO -0.01 0.30 0.04 -0.08 0.02 0.00 0.00 177.57 177.84 3c74 h GLU 5079N 0.26 0.09 0.00 1.57 4.57 -1.42 -0.68 114.58 118.97 3c74 h GLU 5079Ca 0.08 -0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.12 3c74 h GLU 5079Cb 0.44 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 3c74 h GLU 5079CO 0.02 0.06 -0.62 0.93 -1.18 0.00 0.00 179.01 178.22 3c74 h GLU 5080N 0.09 0.00 -0.42 1.92 5.08 -1.42 -1.78 114.58 118.05 3c74 h GLU 5080Ca 0.03 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 3c74 h GLU 5080Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3c74 h GLU 5080CO -0.02 0.62 -0.20 -0.07 -1.00 0.00 0.00 179.01 178.34 3c74 h LEU 5081N 0.00 0.84 -0.74 1.33 3.38 -1.10 -2.92 115.31 116.10 3c74 h LEU 5081Ca -0.01 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.59 3c74 h LEU 5081Cb 1.12 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 3c74 h LEU 5081CO 0.08 1.02 0.14 0.00 0.09 0.00 0.00 178.44 179.77 3c74 h ALA 5082N 1.04 0.96 -0.31 1.53 0.00 -0.76 -1.61 119.26 120.13 3c74 h ALA 5082Ca 0.10 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.77 3c74 h ALA 5082Cb 0.72 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3c74 h ALA 5082CO 0.06 0.66 0.20 1.96 0.00 0.00 0.00 179.25 182.13 3c74 h GLN 5083N 1.03 0.35 0.00 0.00 4.20 -1.30 -2.69 115.11 116.69 3c74 h GLN 5083Ca 0.21 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.90 3c74 h GLN 5083Cb 0.40 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.10 3c74 h GLN 5083CO 0.01 0.23 -0.52 1.28 -0.67 0.00 0.00 178.83 179.16 3c74 n LEU 5084N -4.49 0.67 0.00 1.46 4.77 -0.88 -4.94 117.00 113.58 3c74 n LEU 5084Ca 0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3c74 n LEU 5084Cb 0.11 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3c74 n LEU 5084CO 0.35 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3c74 n GLY 5085N 1.36 0.03 3.72 -0.72 0.00 -0.78 -4.80 105.19 103.99 3c74 n GLY 5085Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3c74 n GLY 5085CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3c74 s ILE 5086N -0.65 4.03 -0.02 -0.61 -1.09 -0.68 -4.46 121.20 117.72 3c74 s ILE 5086Ca 0.00 1.50 0.01 0.00 -2.23 0.00 0.00 60.65 59.92 3c74 s ILE 5086Cb 0.00 -3.96 -0.01 0.00 -1.58 0.00 0.00 42.46 36.91 3c74 s ILE 5086CO 0.00 0.14 0.02 0.54 -1.23 0.00 0.00 174.94 174.41 3c74 n ARG 5087N 3.67 4.07 -4.20 2.79 5.12 0.32 -4.30 116.66 124.15 3c74 n ARG 5087Ca 0.08 -0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.74 3c74 n ARG 5087Cb 0.46 -0.72 -0.17 0.00 -1.16 0.00 0.00 32.46 30.87 3c74 n ARG 5087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3c74 s THR 5088N -1.45 1.09 -0.12 0.55 2.01 -0.91 -0.97 115.64 115.84 3c74 s THR 5088Ca 0.00 -0.38 0.02 0.00 0.31 0.00 0.00 61.69 61.64 3c74 s THR 5088Cb 0.00 -1.06 -0.00 0.00 0.01 0.00 0.00 72.50 71.46 3c74 s THR 5088CO 0.02 0.36 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.75 3c74 s PHE 5089N 1.25 2.66 -0.22 4.92 0.40 0.44 -0.91 117.98 126.53 3c74 s PHE 5089Ca -0.03 -1.05 0.01 0.00 -0.60 0.00 0.00 56.93 55.25 3c74 s PHE 5089Cb -0.14 -1.78 0.03 0.00 0.51 0.00 0.00 43.02 41.64 3c74 s PHE 5089CO -0.03 -0.44 -0.13 -0.51 0.70 0.00 0.00 175.22 174.80 3c74 s LEU 5090N 0.52 2.77 -0.22 -0.37 1.43 -0.44 -1.11 118.68 121.26 3c74 s LEU 5090Ca -0.13 -0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 51.96 3c74 s LEU 5090Cb -0.17 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 3c74 s LEU 5090CO 0.05 -0.08 0.29 -0.60 0.23 0.00 0.00 176.35 176.23 3c74 s ARG 5091N 1.26 4.12 -0.13 1.70 6.06 0.45 -0.25 118.95 132.16 3c74 s ARG 5091Ca 0.00 -0.02 0.03 0.00 -2.50 0.00 0.00 55.73 53.24 3c74 s ARG 5091Cb -0.16 -3.54 0.01 0.00 0.06 0.00 0.00 34.95 31.32 3c74 s ARG 5091CO -0.08 0.00 -0.22 -1.50 -2.50 0.00 0.00 175.30 171.00 3c74 s ILE 5092N 1.21 2.01 0.00 4.11 2.07 -1.21 -0.57 121.20 128.81 3c74 s ILE 5092Ca 0.14 -0.96 0.00 0.00 -1.41 0.00 0.00 60.65 58.42 3c74 s ILE 5092Cb -0.14 -1.77 0.00 0.00 0.13 0.00 0.00 42.46 40.68 3c74 s ILE 5092CO 0.06 0.54 0.00 0.61 -1.91 0.00 0.00 174.94 174.25 3c74 n GLY 5093N 3.98 3.83 3.39 1.50 0.00 -0.87 -3.62 105.19 113.40 3c74 n GLY 5093Ca -0.20 -1.39 -0.23 0.00 0.00 0.00 0.00 46.02 44.21 3c74 n GLY 5093CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3c74 s THR 5094N -2.04 2.10 0.09 2.61 -4.23 -1.26 -2.01 115.64 110.90 3c74 s THR 5094Ca 0.00 -2.16 -0.21 0.00 -1.18 0.00 0.00 61.69 58.14 3c74 s THR 5094Cb 0.00 -2.08 0.05 0.00 1.34 0.00 0.00 72.50 71.81 3c74 s THR 5094CO 0.00 -0.37 0.51 0.28 -0.54 0.00 0.00 174.62 174.50 3c74 s THR 5095N -2.34 0.03 -0.31 3.99 -1.32 -0.79 -4.86 115.64 110.04 3c74 s THR 5095Ca 0.23 -0.26 -0.08 0.00 -1.21 0.00 0.00 61.69 60.36 3c74 s THR 5095Cb -0.05 -1.03 0.01 0.00 -1.51 0.00 0.00 72.50 69.92 3c74 s THR 5095CO 0.10 -0.15 0.11 -0.83 -2.21 0.00 0.00 174.62 171.65 3c74 s GLY 5096N -2.36 1.82 0.34 6.08 0.00 -1.05 -1.39 107.32 110.76 3c74 s GLY 5096Ca -0.02 -1.48 -0.28 0.00 0.00 0.00 0.00 44.72 42.94 3c74 s GLY 5096CO -0.07 0.69 1.21 0.00 0.00 0.00 0.00 173.10 174.93 3c74 s ALA 5097N 1.53 3.38 -0.17 3.20 0.00 0.06 -1.44 121.76 128.31 3c74 s ALA 5097Ca 0.03 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.09 3c74 s ALA 5097Cb -0.17 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.55 3c74 s ALA 5097CO 0.04 -0.49 0.56 0.44 0.00 0.00 0.00 175.76 176.31 3c74 n ILE 5098N 0.70 0.03 -4.19 0.00 -5.35 -0.50 -0.52 119.36 109.54 3c74 n ILE 5098Ca 0.01 -0.52 -0.36 0.00 -0.27 0.00 0.00 62.75 61.62 3c74 n ILE 5098Cb 0.44 1.01 -0.08 0.00 -1.74 0.00 0.00 39.64 39.27 3c74 n ILE 5098CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3c74 s GLN 5099N -0.14 3.22 0.36 6.28 -1.52 -1.24 -4.81 119.66 121.80 3c74 s GLN 5099Ca 0.02 -0.31 0.11 0.00 -1.95 0.00 0.00 55.36 53.22 3c74 s GLN 5099Cb 0.01 -2.96 0.69 0.00 -0.22 0.00 0.00 33.01 30.54 3c74 s GLN 5099CO 0.02 0.69 1.82 -1.35 -0.25 0.00 0.00 175.29 176.22 3c74 h PRO 5100N 5.23 0.08 0.00 2.91 0.11 -1.96 -2.97 132.00 135.40 3c74 h PRO 5100Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 3c74 h PRO 5100Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3c74 h PRO 5100CO 0.57 0.41 0.00 -2.39 -0.21 0.00 0.00 178.00 176.38 3c74 n HIS 5101N -4.12 0.59 -3.11 0.65 1.44 -1.26 -4.71 115.22 104.70 3c74 n HIS 5101Ca -0.02 0.19 -0.40 0.00 -2.01 0.00 0.00 57.72 55.48 3c74 n HIS 5101Cb 0.39 -0.81 -0.06 0.00 0.12 0.00 0.00 29.99 29.64 3c74 n HIS 5101CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3c74 s ILE 5102N -3.11 5.02 0.27 0.61 1.01 -1.12 -5.07 121.20 118.82 3c74 s ILE 5102Ca 0.10 1.22 0.07 0.00 0.00 0.00 0.00 60.65 62.04 3c74 s ILE 5102Cb 0.13 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 3c74 s ILE 5102CO 0.51 0.13 0.29 0.20 0.00 0.00 0.00 174.94 176.06 3c74 s ASN 5103N 1.13 5.74 0.02 3.58 -0.87 -1.26 -4.91 114.94 118.36 3c74 s ASN 5103Ca 0.30 -0.20 -0.30 0.00 -1.57 0.00 0.00 52.86 51.08 3c74 s ASN 5103Cb -0.16 -1.43 -0.07 0.00 -0.02 0.00 0.00 41.25 39.57 3c74 s ASN 5103CO 0.11 -0.14 1.65 -0.69 -2.57 0.00 0.00 177.10 175.45 3c74 s VAL 5104N -2.13 3.29 0.00 1.60 1.01 -1.26 -2.12 120.40 120.79 3c74 s VAL 5104Ca 0.36 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.93 3c74 s VAL 5104Cb -0.08 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3c74 s VAL 5104CO 0.27 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.96 3c74 n GLY 5105N 4.04 2.11 3.76 4.51 0.00 -1.17 -5.05 105.19 113.39 3c74 n GLY 5105Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3c74 n GLY 5105CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3c74 s ASP 5106N -1.62 4.62 -0.09 1.61 1.11 -0.90 -4.79 116.67 116.61 3c74 s ASP 5106Ca 0.00 2.00 0.01 0.00 0.18 0.00 0.00 52.55 54.74 3c74 s ASP 5106Cb 0.00 -2.55 -0.02 0.00 1.07 0.00 0.00 42.92 41.42 3c74 s ASP 5106CO 0.00 -1.96 -0.12 -0.69 1.18 0.00 0.00 175.17 173.58 3c74 s VAL 5107N -2.51 3.24 -0.10 -1.27 1.01 -0.67 -2.13 120.40 117.95 3c74 s VAL 5107Ca 0.66 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 62.04 3c74 s VAL 5107Cb -0.21 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.85 3c74 s VAL 5107CO 0.48 0.56 -0.22 -0.76 0.00 0.00 0.00 175.10 175.16 3c74 s LEU 5108N -0.27 2.18 -0.17 3.92 1.43 0.14 -1.26 118.68 124.65 3c74 s LEU 5108Ca 0.02 -0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 52.55 3c74 s LEU 5108Cb -0.13 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.62 3c74 s LEU 5108CO 0.03 0.16 -0.01 -0.69 0.23 0.00 0.00 176.35 176.07 3c74 s VAL 5109N 0.34 4.04 -0.24 -1.59 1.01 -0.46 -1.09 120.40 122.41 3c74 s VAL 5109Ca -0.18 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.37 3c74 s VAL 5109Cb -0.18 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3c74 s VAL 5109CO 0.08 0.47 0.30 -0.89 0.00 0.00 0.00 175.10 175.06 3c74 s THR 5110N 0.57 5.25 -0.06 3.92 2.01 -0.62 -2.68 115.64 124.03 3c74 s THR 5110Ca -0.01 0.45 -0.20 0.00 0.31 0.00 0.00 61.69 62.24 3c74 s THR 5110Cb -0.14 -3.63 -0.31 0.00 0.01 0.00 0.00 72.50 68.43 3c74 s THR 5110CO 0.02 0.25 0.81 0.71 -0.69 0.00 0.00 174.62 175.72 3c74 h THR 5111N 5.19 1.36 -3.22 -0.82 1.35 -1.74 -3.41 112.91 111.63 3c74 h THR 5111Ca -0.35 -2.52 -0.01 0.00 -0.55 0.00 0.00 66.41 62.98 3c74 h THR 5111Cb 1.17 3.06 -0.10 0.00 -1.73 0.00 0.00 68.15 70.54 3c74 h THR 5111CO 0.65 0.72 0.08 0.00 -0.25 0.00 0.00 175.52 176.73 3c74 s ALA 5112N -2.46 -1.10 0.01 6.62 0.00 -1.26 -0.75 121.76 122.82 3c74 s ALA 5112Ca -0.15 -0.07 0.08 0.00 0.00 0.00 0.00 51.96 51.82 3c74 s ALA 5112Cb 0.02 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 3c74 s ALA 5112CO 0.82 -0.81 -0.24 -1.12 0.00 0.00 0.00 175.76 174.41 3c74 s SER 5113N -2.85 2.87 -0.09 0.00 0.01 -0.54 -2.36 113.70 110.75 3c74 s SER 5113Ca 0.07 -0.49 -0.30 0.00 1.31 0.00 0.00 55.95 56.54 3c74 s SER 5113Cb -0.01 -0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.90 3c74 s SER 5113CO -0.05 0.27 1.25 -0.69 0.41 0.00 0.00 173.24 174.43 3c74 s VAL 5114N -0.66 4.19 -1.25 3.43 1.01 0.51 -4.38 120.40 123.25 3c74 s VAL 5114Ca 0.10 1.50 -0.15 0.00 0.00 0.00 0.00 61.98 63.43 3c74 s VAL 5114Cb -0.09 -3.97 0.14 0.00 0.00 0.00 0.00 36.38 32.46 3c74 s VAL 5114CO 0.00 -0.05 1.57 0.54 0.00 0.00 0.00 175.10 177.16 3c74 n ARG 5115N 5.75 3.32 -1.04 2.72 1.74 -1.26 -1.86 116.66 126.03 3c74 n ARG 5115Ca 0.12 -3.64 -0.23 0.00 -0.77 0.00 0.00 57.85 53.34 3c74 n ARG 5115Cb 0.45 -3.18 0.10 0.00 -1.02 0.00 0.00 32.46 28.82 3c74 n ARG 5115CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3c74 n LEU 5116N 6.38 6.51 -4.63 0.55 4.32 -0.49 -4.92 117.00 124.73 3c74 n LEU 5116Ca 0.41 -3.48 -0.29 0.00 -0.02 0.00 0.00 56.01 52.63 3c74 n LEU 5116Cb 0.43 -0.88 -0.09 0.00 -1.62 0.00 0.00 43.42 41.26 3c74 n LEU 5116CO 0.68 1.13 -0.25 1.51 -1.22 0.00 0.00 177.39 179.25 3c74 s ASP 5117N -0.87 3.49 -0.12 -1.43 -4.77 -1.23 -1.54 116.67 110.20 3c74 s ASP 5117Ca 0.47 -1.57 0.11 0.00 -3.30 0.00 0.00 52.55 48.27 3c74 s ASP 5117Cb 0.38 0.26 -0.16 0.00 -1.09 0.00 0.00 42.92 42.31 3c74 s ASP 5117CO 0.04 -0.76 0.06 0.61 0.70 0.00 0.00 175.17 175.82 3c74 n GLY 5118N -1.03 -0.62 0.25 2.12 0.00 -1.26 -4.72 105.19 99.92 3c74 n GLY 5118Ca -0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 3c74 n GLY 5118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c74 h ALA 5119N 0.66 1.23 -0.41 4.61 0.00 -1.98 -2.68 119.26 120.69 3c74 h ALA 5119Ca -0.32 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.33 3c74 h ALA 5119Cb 1.69 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 3c74 h ALA 5119CO 0.02 0.50 0.28 0.66 0.00 0.00 0.00 179.25 180.70 3c74 h SER 5120N 0.44 0.41 0.56 0.00 4.64 -1.85 -1.62 113.55 116.13 3c74 h SER 5120Ca 0.08 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3c74 h SER 5120Cb 0.52 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3c74 h SER 5120CO 0.03 0.29 0.00 -0.07 -0.87 0.00 0.00 176.83 176.21 3c74 h LEU 5121N 0.48 0.00 0.00 5.97 3.38 -1.59 -2.03 115.31 121.52 3c74 h LEU 5121Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3c74 h LEU 5121Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3c74 h LEU 5121CO -0.04 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.90 3c74 n HIS 5122N -2.92 0.00 0.00 1.13 8.25 -0.61 -3.83 115.22 117.24 3c74 n HIS 5122Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3c74 n HIS 5122Cb 0.20 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.09 3c74 n HIS 5122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3c74 n PHE 5123N -1.21 0.00 -3.58 4.41 3.72 -0.82 -5.10 117.46 114.88 3c74 n PHE 5123Ca 0.14 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.38 3c74 n PHE 5123Cb 0.18 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.65 3c74 n PHE 5123CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3c74 s ALA 5124N -1.85 -1.68 0.83 4.37 0.00 -0.89 -5.00 121.76 117.53 3c74 s ALA 5124Ca 0.00 1.49 -0.11 0.00 0.00 0.00 0.00 51.96 53.34 3c74 s ALA 5124Cb 0.00 -0.42 0.09 0.00 0.00 0.00 0.00 23.12 22.79 3c74 s ALA 5124CO 0.00 -0.35 1.09 -1.25 0.00 0.00 0.00 175.76 175.25 3c74 s PRO 5125N -0.62 1.80 0.54 0.00 0.04 -1.26 -3.92 135.00 131.58 3c74 s PRO 5125Ca -0.07 0.85 0.23 0.00 0.04 0.00 0.00 61.00 62.05 3c74 s PRO 5125Cb -0.02 -1.87 1.40 0.00 0.04 0.00 0.00 34.50 34.05 3c74 s PRO 5125CO 0.06 -1.87 2.06 1.98 0.04 0.00 0.00 177.00 179.27 3c74 h MET 5126N -1.28 0.00 0.00 4.56 4.05 -1.94 -1.03 114.93 119.29 3c74 h MET 5126Ca -0.47 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 58.92 3c74 h MET 5126Cb 1.26 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.06 3c74 h MET 5126CO 0.55 0.00 -0.13 1.05 0.23 0.00 0.00 176.91 178.61 3c74 h GLU 5127N 0.00 0.00 -6.78 0.39 9.09 -2.03 -3.43 114.58 111.82 3c74 h GLU 5127Ca 0.15 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 59.03 3c74 h GLU 5127Cb 0.64 0.00 0.07 0.00 -1.65 0.00 0.00 28.75 27.81 3c74 h GLU 5127CO -0.00 0.13 0.81 0.12 0.05 0.00 0.00 179.01 180.12 3c74 s PHE 5128N -4.64 2.90 0.24 2.06 5.36 -0.39 -4.99 117.98 118.52 3c74 s PHE 5128Ca -0.04 0.95 -0.30 0.00 -0.96 0.00 0.00 56.93 56.58 3c74 s PHE 5128Cb 0.16 -3.92 -0.09 0.00 -0.34 0.00 0.00 43.02 38.83 3c74 s PHE 5128CO 0.67 -3.01 0.95 -1.25 -1.46 0.00 0.00 175.22 171.12 3c74 s PRO 5129N -0.53 4.84 -1.40 10.12 0.04 -1.26 -4.96 135.00 141.86 3c74 s PRO 5129Ca 0.60 1.50 -0.10 0.00 0.04 0.00 0.00 61.00 63.04 3c74 s PRO 5129Cb -0.44 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 30.91 3c74 s PRO 5129CO 0.46 0.50 2.25 0.00 0.04 0.00 0.00 177.00 180.25 3c74 n ALA 5130N 1.45 6.01 -2.77 8.56 0.00 -1.26 -4.71 120.51 127.79 3c74 n ALA 5130Ca -0.02 -4.01 -0.35 0.00 0.00 0.00 0.00 53.44 49.06 3c74 n ALA 5130Cb 0.47 -3.20 -0.05 0.00 0.00 0.00 0.00 19.45 16.67 3c74 n ALA 5130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3c74 s VAL 5131N 1.37 5.33 0.54 0.00 0.11 -1.26 -1.46 120.40 125.02 3c74 s VAL 5131Ca 0.49 0.20 -0.15 0.00 -2.93 0.00 0.00 61.98 59.59 3c74 s VAL 5131Cb 0.14 -3.55 -0.07 0.00 -1.53 0.00 0.00 36.38 31.37 3c74 s VAL 5131CO -0.05 0.42 1.00 0.00 -3.33 0.00 0.00 175.10 173.14 3c74 s ALA 5132N -1.24 3.07 0.30 1.54 0.00 0.07 -4.70 121.76 120.80 3c74 s ALA 5132Ca 0.25 0.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.04 3c74 s ALA 5132Cb -0.13 -3.11 -0.10 0.00 0.00 0.00 0.00 23.12 19.78 3c74 s ALA 5132CO 0.14 -0.35 1.29 0.34 0.00 0.00 0.00 175.76 177.18 3c74 s ASP 5133N -3.33 6.85 0.17 0.00 2.15 0.13 -4.96 116.67 117.67 3c74 s ASP 5133Ca 0.58 2.59 -0.12 0.00 0.43 0.00 0.00 52.55 56.03 3c74 s ASP 5133Cb -0.10 -2.64 0.06 0.00 -0.30 0.00 0.00 42.92 39.94 3c74 s ASP 5133CO 0.37 -0.50 1.71 0.15 -0.17 0.00 0.00 175.17 176.73 3c74 h PHE 5134N 3.89 0.88 -0.45 -5.34 3.57 -1.96 -1.97 116.94 115.56 3c74 h PHE 5134Ca -0.48 -0.08 -0.07 0.00 3.53 0.00 0.00 57.97 60.88 3c74 h PHE 5134Cb 1.22 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 3c74 h PHE 5134CO 0.57 0.73 0.02 0.00 -2.23 0.00 0.00 178.31 177.41 3c74 h ALA 5135N 1.06 0.60 -0.25 2.41 0.00 -1.95 -0.79 119.26 120.34 3c74 h ALA 5135Ca 0.18 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3c74 h ALA 5135Cb 0.25 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3c74 h ALA 5135CO -0.01 0.37 0.14 0.00 0.00 0.00 0.00 179.25 179.75 3c74 h THR 5137N 0.30 1.22 0.34 0.00 2.02 -1.24 -1.43 112.91 114.12 3c74 h THR 5137Ca 0.09 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 3c74 h THR 5137Cb -0.01 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 3c74 h THR 5137CO -0.04 0.26 -0.40 0.74 0.37 0.00 0.00 175.52 176.45 3c74 h THR 5138N 0.53 0.19 -0.99 3.16 2.02 -1.07 -1.63 112.91 115.12 3c74 h THR 5138Ca 0.13 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.51 3c74 h THR 5138Cb 0.28 0.19 -0.10 0.00 -1.74 0.00 0.00 68.15 66.78 3c74 h THR 5138CO -0.00 0.00 0.61 0.00 0.37 0.00 0.00 175.52 176.50 3c74 h ALA 5139N -0.38 1.81 -0.12 6.16 0.00 -1.10 0.11 119.26 125.74 3c74 h ALA 5139Ca -0.02 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3c74 h ALA 5139Cb 0.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3c74 h ALA 5139CO -0.10 -0.16 -0.51 -0.07 0.00 0.00 0.00 179.25 178.41 3c74 h LEU 5140N 0.68 0.34 0.05 0.00 3.38 -1.00 -1.74 115.31 117.02 3c74 h LEU 5140Ca 0.56 -0.17 -0.27 0.00 0.09 0.00 0.00 57.88 58.09 3c74 h LEU 5140Cb 0.97 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.64 3c74 h LEU 5140CO -0.33 0.79 -1.18 0.58 0.09 0.00 0.00 178.44 178.40 3c74 h VAL 5141N 0.25 1.43 -0.39 1.22 2.07 -0.13 -2.79 116.25 117.90 3c74 h VAL 5141Ca 0.01 -2.78 -0.16 0.00 0.82 0.00 0.00 66.70 64.59 3c74 h VAL 5141Cb 0.98 2.77 -0.01 0.00 -1.52 0.00 0.00 31.29 33.52 3c74 h VAL 5141CO 0.08 0.82 -0.36 -0.33 0.02 0.00 0.00 177.57 177.80 3c74 h GLU 5142N 0.15 0.94 -0.47 1.57 4.39 -0.85 -2.32 114.58 117.99 3c74 h GLU 5142Ca -0.13 -0.49 -0.03 0.00 0.34 0.00 0.00 59.36 59.05 3c74 h GLU 5142Cb 1.87 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.51 3c74 h GLU 5142CO 0.20 1.15 0.20 0.00 -1.16 0.00 0.00 179.01 179.39 3c74 h ALA 5143N 0.78 0.61 -0.56 3.43 0.00 -1.40 -1.46 119.26 120.66 3c74 h ALA 5143Ca 0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3c74 h ALA 5143Cb 0.96 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3c74 h ALA 5143CO 0.09 0.21 0.27 0.00 0.00 0.00 0.00 179.25 179.82 3c74 h ALA 5144N 1.04 1.42 -0.41 0.00 0.00 -1.49 -2.43 119.26 117.39 3c74 h ALA 5144Ca 0.16 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 3c74 h ALA 5144Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3c74 h ALA 5144CO -0.01 0.46 -0.27 -0.22 0.00 0.00 0.00 179.25 179.20 3c74 h LYS 5145N 0.79 0.91 0.00 0.00 3.64 -1.01 -1.21 116.57 119.69 3c74 h LYS 5145Ca 0.20 -0.43 -0.10 0.00 -1.27 0.00 0.00 60.65 59.05 3c74 h LYS 5145Cb 0.08 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 3c74 h LYS 5145CO -0.03 1.09 -0.46 0.66 -2.27 0.00 0.00 179.45 178.44 3c74 h SER 5146N 0.73 0.00 1.03 4.20 4.64 -1.11 -3.15 113.55 119.89 3c74 h SER 5146Ca 0.08 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 3c74 h SER 5146Cb 0.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 3c74 h SER 5146CO 0.08 0.46 -1.02 0.40 -0.87 0.00 0.00 176.83 175.88 3c74 h ILE 5147N 0.00 0.29 0.00 0.95 2.04 -1.34 -3.49 117.51 115.97 3c74 h ILE 5147Ca -0.00 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.33 3c74 h ILE 5147Cb 0.90 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 3c74 h ILE 5147CO 0.06 0.17 0.00 0.61 0.00 0.00 0.00 178.15 178.99 3c74 n GLY 5148N 1.26 0.73 3.80 5.37 0.00 -0.48 -5.06 105.19 110.81 3c74 n GLY 5148Ca -0.03 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 3c74 n GLY 5148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c74 s ALA 5149N -2.00 3.48 -0.20 4.61 0.00 -1.06 -5.02 121.76 121.57 3c74 s ALA 5149Ca 0.00 0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 3c74 s ALA 5149Cb 0.00 -2.82 -0.02 0.00 0.00 0.00 0.00 23.12 20.28 3c74 s ALA 5149CO 0.00 0.33 1.39 0.95 0.00 0.00 0.00 175.76 178.43 3c74 s THR 5150N -1.27 4.05 0.05 0.00 -4.23 -1.26 -4.81 115.64 108.17 3c74 s THR 5150Ca 0.36 1.23 0.06 0.00 -1.18 0.00 0.00 61.69 62.16 3c74 s THR 5150Cb -0.20 -3.92 -0.03 0.00 1.34 0.00 0.00 72.50 69.70 3c74 s THR 5150CO 0.23 -0.25 -0.16 -0.89 -0.54 0.00 0.00 174.62 173.00 3c74 s THR 5151N 4.13 1.30 -0.04 3.99 2.01 -1.26 -1.67 115.64 124.08 3c74 s THR 5151Ca 0.61 -1.17 0.03 0.00 0.31 0.00 0.00 61.69 61.47 3c74 s THR 5151Cb -0.22 -1.18 0.00 0.00 0.01 0.00 0.00 72.50 71.11 3c74 s THR 5151CO 0.21 -0.01 -0.14 -1.00 -0.69 0.00 0.00 174.62 172.99 3c74 s HIS 5152N -0.96 1.48 -0.09 4.92 3.76 -0.39 -4.97 115.29 119.04 3c74 s HIS 5152Ca 0.03 -0.44 0.01 0.00 -0.15 0.00 0.00 55.06 54.51 3c74 s HIS 5152Cb -0.09 -1.02 -0.02 0.00 1.11 0.00 0.00 32.58 32.56 3c74 s HIS 5152CO 0.02 -0.17 -0.13 0.08 -0.85 0.00 0.00 174.74 173.69 3c74 s VAL 5153N 0.21 3.15 -5.00 -0.90 1.01 -1.26 -1.35 120.40 116.26 3c74 s VAL 5153Ca -0.06 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3c74 s VAL 5153Cb -0.12 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.98 3c74 s VAL 5153CO 0.02 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.29 3c74 n GLY 5154N 2.88 -0.21 3.82 4.51 0.00 -1.09 -5.01 105.19 110.09 3c74 n GLY 5154Ca -0.18 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 3c74 n GLY 5154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c74 s VAL 5155N -3.39 4.82 0.02 1.61 1.01 -1.26 -1.99 120.40 121.21 3c74 s VAL 5155Ca 0.00 1.11 0.07 0.00 0.00 0.00 0.00 61.98 63.16 3c74 s VAL 5155Cb 0.00 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 3c74 s VAL 5155CO 0.00 0.56 -0.21 -0.89 0.00 0.00 0.00 175.10 174.55 3c74 s THR 5156N -1.11 2.49 -0.33 3.92 2.01 -1.00 -0.71 115.64 120.92 3c74 s THR 5156Ca 0.28 -1.16 -0.16 0.00 0.31 0.00 0.00 61.69 60.96 3c74 s THR 5156Cb -0.19 -1.98 -0.02 0.00 0.01 0.00 0.00 72.50 70.33 3c74 s THR 5156CO 0.18 0.44 0.40 0.00 -0.69 0.00 0.00 174.62 174.95 3c74 s ALA 5157N -0.80 3.51 -0.35 7.40 0.00 -0.19 -0.36 121.76 130.97 3c74 s ALA 5157Ca 0.12 -1.07 -0.10 0.00 0.00 0.00 0.00 51.96 50.91 3c74 s ALA 5157Cb -0.10 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.19 3c74 s ALA 5157CO 0.02 -1.02 0.18 0.45 0.00 0.00 0.00 175.76 175.39 3c74 s SER 5158N 1.72 5.63 0.02 0.00 0.15 -0.77 -1.62 113.70 118.82 3c74 s SER 5158Ca 0.14 -0.88 0.05 0.00 0.70 0.00 0.00 55.95 55.96 3c74 s SER 5158Cb -0.16 -2.00 -0.03 0.00 -1.71 0.00 0.00 66.02 62.12 3c74 s SER 5158CO 0.12 -0.33 -0.10 -0.55 1.20 0.00 0.00 173.24 173.58 3c74 s SER 5159N 1.55 4.38 0.04 5.45 0.15 0.40 -1.39 113.70 124.28 3c74 s SER 5159Ca 0.02 -0.24 0.23 0.00 0.70 0.00 0.00 55.95 56.66 3c74 s SER 5159Cb -0.19 -0.93 0.96 0.00 -1.71 0.00 0.00 66.02 64.16 3c74 s SER 5159CO 0.06 0.27 1.74 0.47 1.20 0.00 0.00 173.24 176.97 3c74 n ASP 5160N 1.48 0.12 -4.20 5.45 9.92 -0.59 -4.28 116.55 124.45 3c74 n ASP 5160Ca -0.15 0.52 -0.19 0.00 -0.53 0.00 0.00 54.79 54.43 3c74 n ASP 5160Cb 0.52 -0.55 -0.12 0.00 -0.64 0.00 0.00 41.12 40.34 3c74 n ASP 5160CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3c74 s THR 5161N -3.03 1.24 0.13 -3.53 -4.23 -1.26 -5.03 115.64 99.93 3c74 s THR 5161Ca 0.11 -1.40 -0.03 0.00 -1.18 0.00 0.00 61.69 59.19 3c74 s THR 5161Cb 0.14 -1.21 -0.18 0.00 1.34 0.00 0.00 72.50 72.59 3c74 s THR 5161CO 0.43 -0.22 1.30 0.15 -0.54 0.00 0.00 174.62 175.75 3c74 h PHE 5162N 4.16 0.56 0.00 3.99 3.57 -1.98 -3.39 116.94 123.85 3c74 h PHE 5162Ca -0.42 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 60.77 3c74 h PHE 5162Cb 1.19 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.87 3c74 h PHE 5162CO 0.63 1.13 0.00 0.66 -2.23 0.00 0.00 178.31 178.50 3c74 n TYR 5163N -3.72 0.00 -0.15 0.41 4.01 -1.26 -4.42 117.16 112.03 3c74 n TYR 5163Ca -0.06 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.57 3c74 n TYR 5163Cb 0.84 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.86 3c74 n TYR 5163CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3c74 h PRO 5164N 0.00 0.97 0.00 -0.72 0.11 -1.86 -0.03 132.00 130.47 3c74 h PRO 5164Ca 0.00 -0.42 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3c74 h PRO 5164Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3c74 h PRO 5164CO 0.00 1.08 0.00 0.41 -0.21 0.00 0.00 178.00 179.28 3c74 n GLY 5165N -0.11 -1.14 0.86 -0.55 0.00 -1.26 -1.04 105.19 101.94 3c74 n GLY 5165Ca -0.00 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.20 3c74 n GLY 5165CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3c74 n GLN 5166N -2.17 3.00 -3.88 1.61 6.02 -1.08 -4.96 117.38 115.92 3c74 n GLN 5166Ca 0.01 -2.58 -0.26 0.00 -0.01 0.00 0.00 57.00 54.17 3c74 n GLN 5166Cb 0.17 -1.66 -0.00 0.00 1.02 0.00 0.00 30.24 29.77 3c74 n GLN 5166CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3c74 n GLU 5167N -0.06 -3.27 -3.31 -1.09 2.13 -0.21 -4.93 120.64 109.90 3c74 n GLU 5167Ca 0.18 0.44 -0.38 0.00 0.66 0.00 0.00 57.16 58.07 3c74 n GLU 5167Cb 0.74 -4.57 -0.06 0.00 0.27 0.00 0.00 31.44 27.83 3c74 n GLU 5167CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3c74 s ARG 5168N -6.39 4.26 -0.01 5.31 0.52 -0.05 -4.97 118.95 117.62 3c74 s ARG 5168Ca 0.06 0.54 0.15 0.00 -0.52 0.00 0.00 55.73 55.96 3c74 s ARG 5168Cb -0.02 -3.37 -0.18 0.00 0.52 0.00 0.00 34.95 31.90 3c74 s ARG 5168CO 0.87 0.32 0.55 0.66 0.02 0.00 0.00 175.30 177.72 3c74 n TYR 5169N 3.05 0.00 -0.88 -0.53 4.01 -1.26 -4.51 117.16 117.04 3c74 n TYR 5169Ca -0.08 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.49 3c74 n TYR 5169Cb 0.52 -0.10 -0.09 0.00 -0.31 0.00 0.00 39.34 39.35 3c74 n TYR 5169CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3c74 n ASP 5170N -1.54 5.15 -4.55 7.72 -0.08 -1.26 -4.08 116.55 117.92 3c74 n ASP 5170Ca 0.01 -2.34 -0.31 0.00 -1.51 0.00 0.00 54.79 50.64 3c74 n ASP 5170Cb 0.28 -1.20 -0.06 0.00 2.34 0.00 0.00 41.12 42.47 3c74 n ASP 5170CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3c74 n THR 5171N 3.06 0.00 -0.26 5.18 -2.24 -1.26 -5.00 114.28 113.76 3c74 n THR 5171Ca 0.44 -2.28 -0.05 0.00 -2.27 0.00 0.00 64.05 59.88 3c74 n THR 5171Cb 0.53 0.45 0.09 0.00 -2.10 0.00 0.00 70.33 69.30 3c74 n THR 5171CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3c74 h TYR 5172N 1.24 1.16 0.00 4.78 3.20 -1.99 -3.21 116.97 122.16 3c74 h TYR 5172Ca -0.40 -0.10 -0.20 0.00 3.14 0.00 0.00 58.73 61.17 3c74 h TYR 5172Cb 1.22 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 3c74 h TYR 5172CO 0.00 0.90 -1.67 -1.13 -1.64 0.00 0.00 178.16 174.62 3c74 n SER 5173N -4.27 0.63 -1.09 -2.11 3.41 -1.26 -4.97 113.62 103.96 3c74 n SER 5173Ca 0.06 0.28 -0.14 0.00 -0.26 0.00 0.00 58.87 58.82 3c74 n SER 5173Cb 0.21 0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 64.57 3c74 n SER 5173CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3c74 n GLY 5174N 1.46 1.28 3.22 5.00 0.00 -1.21 -4.99 105.19 109.95 3c74 n GLY 5174Ca -0.14 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 3c74 n GLY 5174CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3c74 s ARG 5175N -3.30 1.55 -0.11 1.61 3.52 -1.26 -4.92 118.95 116.04 3c74 s ARG 5175Ca 0.00 -0.78 0.01 0.00 -0.13 0.00 0.00 55.73 54.83 3c74 s ARG 5175Cb 0.00 -1.55 0.02 0.00 -1.56 0.00 0.00 34.95 31.86 3c74 s ARG 5175CO 0.00 0.42 -0.14 0.08 -0.81 0.00 0.00 175.30 174.84 3c74 s VAL 5176N -0.56 1.46 0.57 7.11 1.01 -1.26 -4.93 120.40 123.80 3c74 s VAL 5176Ca 0.08 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.25 3c74 s VAL 5176Cb -0.08 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 3c74 s VAL 5176CO -0.00 0.44 1.07 0.55 0.00 0.00 0.00 175.10 177.16 3c74 n VAL 5177N 4.35 3.66 -0.25 2.92 3.14 -1.26 -4.46 118.33 126.42 3c74 n VAL 5177Ca -0.18 -0.50 0.04 0.00 -2.96 0.00 0.00 64.34 60.74 3c74 n VAL 5177Cb 0.51 -1.28 0.09 0.00 -1.06 0.00 0.00 33.84 32.10 3c74 n VAL 5177CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 3c74 n ARG 5178N -0.93 -0.07 -0.25 1.45 0.63 -1.26 -0.99 116.66 115.24 3c74 n ARG 5178Ca 0.13 1.09 0.09 0.00 -0.92 0.00 0.00 57.85 58.24 3c74 n ARG 5178Cb 0.46 -1.63 0.36 0.00 0.45 0.00 0.00 32.46 32.10 3c74 n ARG 5178CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 3c74 h ARG 5179N 0.00 0.73 -0.01 -0.14 2.43 -2.02 -2.79 114.38 112.58 3c74 h ARG 5179Ca 0.33 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 3c74 h ARG 5179Cb 0.50 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 3c74 h ARG 5179CO -0.72 0.48 -0.29 1.19 -1.51 0.00 0.00 179.97 179.12 3c74 n PHE 5180N -4.53 0.00 -1.92 2.20 3.72 -0.16 -4.77 117.46 111.99 3c74 n PHE 5180Ca 0.15 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.12 3c74 n PHE 5180Cb 0.37 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.88 3c74 n PHE 5180CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3c74 s LYS 5181N -1.86 3.64 0.00 -1.08 2.20 -0.86 -1.88 119.74 119.89 3c74 s LYS 5181Ca 0.15 1.85 0.00 0.00 -0.36 0.00 0.00 55.97 57.61 3c74 s LYS 5181Cb 0.13 -4.15 0.00 0.00 -1.51 0.00 0.00 37.83 32.30 3c74 s LYS 5181CO 0.39 -1.50 0.00 0.41 -0.36 0.00 0.00 175.35 174.29 3c74 n GLY 5182N 4.99 0.53 0.15 5.54 0.00 -1.26 -4.96 105.19 110.18 3c74 n GLY 5182Ca 0.22 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 3c74 n GLY 5182CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3c74 h SER 5183N 0.00 0.39 -0.38 1.61 4.64 -1.68 -3.12 113.55 115.02 3c74 h SER 5183Ca 0.00 -0.29 0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3c74 h SER 5183Cb 0.00 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 3c74 h SER 5183CO 0.00 1.05 0.25 -0.03 -0.87 0.00 0.00 176.83 177.23 3c74 h MET 5184N 0.20 0.50 -0.80 4.77 -1.53 -1.92 -1.09 114.93 115.05 3c74 h MET 5184Ca -0.04 -0.03 0.06 0.00 -3.44 0.00 0.00 59.70 56.24 3c74 h MET 5184Cb 1.40 -0.11 -0.05 0.00 -0.55 0.00 0.00 31.60 32.29 3c74 h MET 5184CO 0.13 0.33 0.53 1.49 0.14 0.00 0.00 176.91 179.53 3c74 h GLU 5185N 0.51 0.88 -0.29 0.39 4.81 -1.97 -1.52 114.58 117.40 3c74 h GLU 5185Ca 0.14 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3c74 h GLU 5185Cb -0.05 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 3c74 h GLU 5185CO -0.03 0.59 0.04 0.93 -0.73 0.00 0.00 179.01 179.80 3c74 h GLU 5186N 0.91 0.48 -0.50 1.92 5.08 -1.31 -2.52 114.58 118.64 3c74 h GLU 5186Ca 0.34 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 3c74 h GLU 5186Cb 0.17 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3c74 h GLU 5186CO -0.11 0.60 -0.09 -1.49 -1.00 0.00 0.00 179.01 176.91 3c74 h TRP 5187N 0.30 1.00 -0.43 4.33 -0.00 -0.98 -2.23 115.95 117.94 3c74 h TRP 5187Ca 0.09 -0.19 0.04 0.00 -0.00 0.00 0.00 58.89 58.83 3c74 h TRP 5187Cb 0.36 -0.26 -0.04 0.00 -0.00 0.00 0.00 29.16 29.22 3c74 h TRP 5187CO 0.02 0.95 0.19 1.96 -0.00 0.00 0.00 178.44 181.56 3c74 h GLN 5188N 0.82 0.37 -0.11 0.49 4.20 -1.26 -1.44 115.11 118.17 3c74 h GLN 5188Ca 0.14 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 3c74 h GLN 5188Cb 0.61 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 3c74 h GLN 5188CO 0.04 0.24 -0.28 0.00 -0.67 0.00 0.00 178.83 178.16 3c74 h ALA 5189N 1.26 1.31 0.00 3.87 0.00 -1.32 -2.39 119.26 121.99 3c74 h ALA 5189Ca 0.19 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3c74 h ALA 5189Cb 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3c74 h ALA 5189CO -0.17 0.47 0.00 -1.33 0.00 0.00 0.00 179.25 178.23 3c74 n MET 5190N -4.14 0.90 -0.65 0.00 2.81 -0.84 -4.89 117.12 110.30 3c74 n MET 5190Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 3c74 n MET 5190Cb 0.38 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 3c74 n MET 5190CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3c74 n GLY 5191N 0.92 0.66 3.74 3.03 0.00 -0.90 -5.04 105.19 107.61 3c74 n GLY 5191Ca 0.22 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3c74 n GLY 5191CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c74 s VAL 5192N -2.00 2.67 -0.06 1.61 1.01 -0.60 -4.64 120.40 118.39 3c74 s VAL 5192Ca 0.00 0.56 -0.23 0.00 0.00 0.00 0.00 61.98 62.31 3c74 s VAL 5192Cb 0.00 -3.36 -0.31 0.00 0.00 0.00 0.00 36.38 32.71 3c74 s VAL 5192CO 0.00 0.09 0.88 0.24 0.00 0.00 0.00 175.10 176.31 3c74 h MET 5193N 5.14 0.27 -3.12 2.72 0.00 -1.25 -3.42 114.93 115.28 3c74 h MET 5193Ca -0.46 -0.47 0.02 0.00 0.00 0.00 0.00 59.70 58.79 3c74 h MET 5193Cb 1.22 0.17 -0.08 0.00 0.00 0.00 0.00 31.60 32.91 3c74 h MET 5193CO 0.78 1.22 0.15 0.54 0.00 0.00 0.00 176.91 179.61 3c74 s ASN 5194N -6.91 -0.31 -0.07 1.22 4.22 -1.26 -1.41 114.94 110.42 3c74 s ASN 5194Ca -0.14 -0.48 -0.01 0.00 -2.14 0.00 0.00 52.86 50.09 3c74 s ASN 5194Cb 0.00 0.66 -0.03 0.00 1.28 0.00 0.00 41.25 43.16 3c74 s ASN 5194CO 0.82 -1.19 -0.00 -0.31 -2.04 0.00 0.00 177.10 174.38 3c74 s TYR 5195N -3.88 3.13 0.00 1.54 2.02 -0.52 -1.02 117.35 118.61 3c74 s TYR 5195Ca 0.09 0.16 0.00 0.00 -0.37 0.00 0.00 57.07 56.95 3c74 s TYR 5195Cb -0.03 -1.76 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 3c74 s TYR 5195CO 0.01 0.46 0.00 -0.85 -1.57 0.00 0.00 175.55 173.59 3c74 n GLU 5196N 2.01 0.00 0.00 -0.62 -0.00 -0.64 -2.54 120.64 118.86 3c74 n GLU 5196Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 3c74 n GLU 5196Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 3c74 n GLU 5196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 3c74 n MET 5197N 0.00 1.10 0.00 3.44 2.81 -1.26 -0.45 117.12 122.76 3c74 n MET 5197Ca 0.00 -0.85 0.00 0.00 -1.81 0.00 0.00 57.70 55.04 3c74 n MET 5197Cb 0.00 -0.71 0.00 0.00 -0.71 0.00 0.00 33.22 31.80 3c74 n MET 5197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3c74 n GLU 5198N -0.19 2.99 -0.18 0.03 4.71 -1.26 -3.56 120.64 123.18 3c74 n GLU 5198Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.07 3c74 n GLU 5198Cb 0.37 -0.66 0.01 0.00 -1.01 0.00 0.00 31.44 30.16 3c74 n GLU 5198CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 3c74 h SER 5199N 0.00 0.75 -0.42 1.62 4.64 -1.94 -2.65 113.55 115.54 3c74 h SER 5199Ca 0.00 -0.19 0.08 0.00 -0.47 0.00 0.00 61.79 61.21 3c74 h SER 5199Cb 0.12 -0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 61.95 3c74 h SER 5199CO 0.00 0.74 0.02 0.00 -0.87 0.00 0.00 176.83 176.72 3c74 h ALA 5200N 1.04 0.41 0.45 5.18 0.00 -1.88 0.36 119.26 124.82 3c74 h ALA 5200Ca 0.17 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3c74 h ALA 5200Cb 0.24 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3c74 h ALA 5200CO -0.01 -0.37 -0.30 1.15 0.00 0.00 0.00 179.25 179.72 3c74 h THR 5201N 0.14 0.39 -0.20 0.00 2.02 -1.91 -1.74 112.91 111.61 3c74 h THR 5201Ca 0.21 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.42 3c74 h THR 5201Cb 0.29 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3c74 h THR 5201CO -0.33 0.00 -0.02 0.25 0.37 0.00 0.00 175.52 175.79 3c74 h LEU 5202N -0.72 -0.12 -0.16 2.58 5.85 -1.07 -1.96 115.31 119.71 3c74 h LEU 5202Ca -0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3c74 h LEU 5202Cb 0.60 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.72 3c74 h LEU 5202CO 0.04 -0.03 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.98 3c74 h LEU 5203N 0.04 0.33 0.01 2.25 3.38 -0.32 -2.37 115.31 118.63 3c74 h LEU 5203Ca 0.09 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 3c74 h LEU 5203Cb 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3c74 h LEU 5203CO -0.17 0.64 -0.00 0.74 0.09 0.00 0.00 178.44 179.73 3c74 h THR 5204N 0.02 1.02 0.00 0.22 2.02 -1.31 -1.41 112.91 113.47 3c74 h THR 5204Ca 0.04 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 3c74 h THR 5204Cb 0.50 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 3c74 h THR 5204CO 0.02 0.02 -0.21 0.00 0.37 0.00 0.00 175.52 175.72 3c74 h MET 5205N -0.05 0.00 0.13 6.66 -0.00 -1.36 -2.01 114.93 118.29 3c74 h MET 5205Ca -0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 59.70 59.49 3c74 h MET 5205Cb 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.66 3c74 h MET 5205CO 0.00 0.21 -0.98 0.00 -0.00 0.00 0.00 176.91 176.14 3c74 h ALA 5207N 0.03 1.57 -0.28 0.00 0.00 -1.06 -0.83 119.26 118.68 3c74 h ALA 5207Ca -0.19 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3c74 h ALA 5207Cb 1.66 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.41 3c74 h ALA 5207CO 0.11 0.24 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 3c74 n SER 5208N -4.14 2.75 -0.11 0.00 3.41 -0.77 -4.23 113.62 110.52 3c74 n SER 5208Ca -0.02 -1.89 0.01 0.00 -0.26 0.00 0.00 58.87 56.71 3c74 n SER 5208Cb 0.26 -0.18 0.02 0.00 -0.26 0.00 0.00 64.21 64.05 3c74 n SER 5208CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3c74 n GLN 5209N 1.04 0.91 -1.00 4.33 6.02 -0.96 -5.01 117.38 122.70 3c74 n GLN 5209Ca 0.18 -1.09 -0.00 0.00 -0.01 0.00 0.00 57.00 56.08 3c74 n GLN 5209Cb 0.50 -0.74 -0.00 0.00 1.02 0.00 0.00 30.24 31.02 3c74 n GLN 5209CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3c74 n GLY 5210N -0.29 0.48 3.85 1.08 0.00 -1.03 -5.03 105.19 104.25 3c74 n GLY 5210Ca 0.02 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3c74 n GLY 5210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c74 s LEU 5211N -0.00 4.42 0.05 0.99 1.43 -0.36 -5.04 118.68 120.17 3c74 s LEU 5211Ca 0.00 0.69 -0.24 0.00 -1.03 0.00 0.00 54.13 53.56 3c74 s LEU 5211Cb 0.00 -2.32 -0.06 0.00 0.03 0.00 0.00 46.19 43.85 3c74 s LEU 5211CO 0.00 0.36 0.72 -0.13 0.23 0.00 0.00 176.35 177.53 3c74 s ARG 5212N -0.99 4.45 0.01 1.70 0.52 -0.14 -3.90 118.95 120.59 3c74 s ARG 5212Ca 0.19 0.98 -0.01 0.00 -0.52 0.00 0.00 55.73 56.37 3c74 s ARG 5212Cb -0.14 -3.33 -0.01 0.00 0.52 0.00 0.00 34.95 31.98 3c74 s ARG 5212CO 0.08 0.37 0.01 0.00 0.02 0.00 0.00 175.30 175.78 3c74 s ALA 5213N -0.32 -0.00 0.07 2.13 0.00 -1.26 -0.42 121.76 121.96 3c74 s ALA 5213Ca 0.36 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.03 3c74 s ALA 5213Cb -0.20 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 3c74 s ALA 5213CO 0.22 -0.11 -0.05 0.20 0.00 0.00 0.00 175.76 176.01 3c74 s GLY 5214N -0.93 0.60 -0.05 0.00 0.00 -0.27 -0.70 107.32 105.98 3c74 s GLY 5214Ca -0.10 -1.19 -0.01 0.00 0.00 0.00 0.00 44.72 43.41 3c74 s GLY 5214CO -0.00 -1.29 0.03 -0.29 0.00 0.00 0.00 173.10 171.54 3c74 s MET 5215N -3.48 0.22 0.05 2.90 1.75 -1.26 -0.41 119.30 119.07 3c74 s MET 5215Ca 0.06 0.23 0.03 0.00 -1.25 0.00 0.00 55.69 54.77 3c74 s MET 5215Cb 0.04 -0.66 -0.03 0.00 2.84 0.00 0.00 34.83 37.02 3c74 s MET 5215CO -0.06 -0.29 -0.10 0.54 -0.65 0.00 0.00 175.02 174.47 3c74 s VAL 5216N 1.90 0.72 -0.01 10.11 0.11 0.26 -1.59 120.40 131.89 3c74 s VAL 5216Ca 0.02 -1.15 -0.25 0.00 -2.93 0.00 0.00 61.98 57.68 3c74 s VAL 5216Cb -0.12 -0.75 0.05 0.00 -1.53 0.00 0.00 36.38 34.03 3c74 s VAL 5216CO -0.04 -0.33 0.54 0.00 -3.33 0.00 0.00 175.10 171.95 3c74 s ALA 5217N -1.34 -1.40 -0.07 1.54 0.00 -0.25 -2.04 121.76 118.20 3c74 s ALA 5217Ca -0.07 0.86 -0.07 0.00 0.00 0.00 0.00 51.96 52.68 3c74 s ALA 5217Cb -0.10 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 3c74 s ALA 5217CO 0.01 -0.38 0.20 0.20 0.00 0.00 0.00 175.76 175.79 3c74 s GLY 5218N -1.45 2.22 -0.15 0.00 0.00 -0.85 -0.68 107.32 106.40 3c74 s GLY 5218Ca -0.10 -0.59 -0.28 0.00 0.00 0.00 0.00 44.72 43.74 3c74 s GLY 5218CO 0.05 -0.36 0.96 0.14 0.00 0.00 0.00 173.10 173.90 3c74 s VAL 5219N -1.13 4.79 -0.46 1.40 1.01 -0.91 -1.88 120.40 123.23 3c74 s VAL 5219Ca 0.20 1.92 0.07 0.00 0.00 0.00 0.00 61.98 64.17 3c74 s VAL 5219Cb -0.13 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 3c74 s VAL 5219CO 0.09 -0.02 0.39 2.30 0.00 0.00 0.00 175.10 177.86 3c74 n ILE 5220N 4.74 0.00 -3.54 2.22 -5.35 -0.49 -3.05 119.36 113.90 3c74 n ILE 5220Ca 0.08 -0.37 -0.17 0.00 -0.27 0.00 0.00 62.75 62.03 3c74 n ILE 5220Cb 0.48 1.03 -0.06 0.00 -1.74 0.00 0.00 39.64 39.36 3c74 n ILE 5220CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3c74 s VAL 5221N -1.47 0.00 -0.29 7.28 0.11 -1.23 -4.74 120.40 120.06 3c74 s VAL 5221Ca 0.04 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.08 3c74 s VAL 5221Cb 0.06 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.96 3c74 s VAL 5221CO 0.25 0.00 -0.02 0.21 -3.33 0.00 0.00 175.10 172.21 3c74 s ASN 5222N -1.06 4.80 0.16 3.54 3.84 -1.26 -0.76 114.94 124.19 3c74 s ASN 5222Ca -0.09 -1.32 0.15 0.00 0.21 0.00 0.00 52.86 51.80 3c74 s ASN 5222Cb -0.00 -1.68 0.70 0.00 -0.55 0.00 0.00 41.25 39.71 3c74 s ASN 5222CO 0.08 -0.25 1.45 0.54 -2.79 0.00 0.00 177.10 176.13 3c74 n ARG 5223N 4.58 0.09 0.00 0.43 5.12 0.32 -0.98 116.66 126.22 3c74 n ARG 5223Ca -0.13 0.48 0.13 0.00 -1.93 0.00 0.00 57.85 56.40 3c74 n ARG 5223Cb 0.43 -1.73 0.58 0.00 -1.16 0.00 0.00 32.46 30.59 3c74 n ARG 5223CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3c74 n THR 5224N -1.90 0.15 -0.04 0.55 -2.24 -1.26 -4.10 114.28 105.45 3c74 n THR 5224Ca 0.01 0.04 -0.08 0.00 -2.27 0.00 0.00 64.05 61.75 3c74 n THR 5224Cb 0.09 -0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 67.72 3c74 n THR 5224CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c74 n GLN 5225N -1.48 0.15 -3.94 -0.78 1.13 -0.15 -5.10 117.38 107.21 3c74 n GLN 5225Ca 0.07 0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 55.10 3c74 n GLN 5225Cb 0.30 -0.75 -0.12 0.00 0.11 0.00 0.00 30.24 29.78 3c74 n GLN 5225CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3c74 s GLN 5226N -2.13 0.26 0.05 -1.09 -0.21 -0.90 -5.05 119.66 110.58 3c74 s GLN 5226Ca -0.10 -0.44 -0.15 0.00 0.02 0.00 0.00 55.36 54.68 3c74 s GLN 5226Cb 0.04 0.10 -0.31 0.00 1.00 0.00 0.00 33.01 33.83 3c74 s GLN 5226CO 0.13 -0.05 1.07 0.93 -2.12 0.00 0.00 175.29 175.25 3c74 h GLU 5227N 4.95 0.61 -5.61 2.91 5.08 -1.87 -3.32 114.58 117.33 3c74 h GLU 5227Ca -0.30 -0.86 -0.67 0.00 -1.00 0.00 0.00 59.36 56.53 3c74 h GLU 5227Cb 1.21 0.30 -0.25 0.00 0.50 0.00 0.00 28.75 30.50 3c74 h GLU 5227CO 0.43 1.40 -0.76 0.42 -1.00 0.00 0.00 179.01 179.50 3c74 s ILE 5228N -2.88 3.13 0.00 3.13 1.01 -1.26 -4.99 121.20 119.34 3c74 s ILE 5228Ca -0.09 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 59.90 3c74 s ILE 5228Cb 0.05 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 40.23 3c74 s ILE 5228CO 0.94 0.54 0.00 -2.65 0.00 0.00 0.00 174.94 173.77 3c74 n PRO 5229N 3.16 2.75 0.00 2.79 -0.02 -1.26 -5.06 135.00 137.35 3c74 n PRO 5229Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 3c74 n PRO 5229Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 3c74 n PRO 5229CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3c74 n SER 5239N 0.00 0.00 -0.04 2.55 2.88 -1.26 -5.07 113.62 112.68 3c74 n SER 5239Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 3c74 n SER 5239Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 3c74 n SER 5239CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3c74 h HIS 5240N 0.00 0.92 -0.58 0.66 3.86 -2.00 -3.02 115.15 115.00 3c74 h HIS 5240Ca 0.00 -0.38 -0.02 0.00 -1.16 0.00 0.00 60.37 58.80 3c74 h HIS 5240Cb 0.00 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 3c74 h HIS 5240CO 0.00 1.19 0.26 0.00 0.86 0.00 0.00 177.93 180.24 3c74 h ALA 5241N 0.55 1.38 -0.52 2.45 0.00 -1.95 0.85 119.26 122.01 3c74 h ALA 5241Ca -0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3c74 h ALA 5241Cb 1.22 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3c74 h ALA 5241CO 0.13 0.48 0.16 0.28 0.00 0.00 0.00 179.25 180.30 3c74 h VAL 5242N 0.82 1.23 -0.27 0.00 2.07 -1.99 -0.99 116.25 117.12 3c74 h VAL 5242Ca 0.20 -0.80 -0.14 0.00 0.82 0.00 0.00 66.70 66.79 3c74 h VAL 5242Cb 0.11 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3c74 h VAL 5242CO -0.02 0.29 -0.40 0.50 0.02 0.00 0.00 177.57 177.96 3c74 h LYS 5243N 0.72 0.65 -0.09 1.57 1.63 -1.33 -2.98 116.57 116.74 3c74 h LYS 5243Ca 0.17 -0.33 -0.00 0.00 -0.85 0.00 0.00 60.65 59.63 3c74 h LYS 5243Cb 0.29 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.92 3c74 h LYS 5243CO -0.00 0.94 0.05 0.82 -3.45 0.00 0.00 179.45 177.80 3c74 h ILE 5244N 0.53 1.06 -0.45 2.00 2.04 -0.57 -1.88 117.51 120.25 3c74 h ILE 5244Ca 0.04 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.65 3c74 h ILE 5244Cb 0.93 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3c74 h ILE 5244CO 0.08 0.05 -0.12 1.62 0.00 0.00 0.00 178.15 179.79 3c74 h VAL 5245N 0.08 1.26 -0.17 1.67 3.04 -1.20 0.58 116.25 121.51 3c74 h VAL 5245Ca 0.03 -1.19 -0.16 0.00 -1.01 0.00 0.00 66.70 64.37 3c74 h VAL 5245Cb 0.04 1.04 -0.01 0.00 -2.01 0.00 0.00 31.29 30.35 3c74 h VAL 5245CO -0.01 0.41 -0.56 1.62 -1.01 0.00 0.00 177.57 178.02 3c74 h VAL 5246N 0.73 1.33 -0.50 1.51 3.04 -1.54 -1.83 116.25 118.99 3c74 h VAL 5246Ca 0.12 -1.83 -0.11 0.00 -1.01 0.00 0.00 66.70 63.88 3c74 h VAL 5246Cb 0.61 1.81 -0.02 0.00 -2.01 0.00 0.00 31.29 31.68 3c74 h VAL 5246CO 0.04 0.56 -0.11 -0.08 -1.01 0.00 0.00 177.57 176.98 3c74 h GLU 5247N 0.40 0.93 -0.61 4.17 4.57 -1.02 -2.88 114.58 120.13 3c74 h GLU 5247Ca 0.00 -0.33 -0.07 0.00 -1.18 0.00 0.00 59.36 57.79 3c74 h GLU 5247Cb 1.10 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.60 3c74 h GLU 5247CO 0.10 0.98 0.10 0.00 -1.18 0.00 0.00 179.01 179.02 3c74 h ALA 5248N 1.04 1.04 0.00 2.92 0.00 -0.79 -2.89 119.26 120.58 3c74 h ALA 5248Ca 0.13 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3c74 h ALA 5248Cb 0.64 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3c74 h ALA 5248CO 0.04 0.62 -0.17 0.00 0.00 0.00 0.00 179.25 179.74 3c74 h ALA 5249N 1.18 1.72 -0.38 0.00 0.00 -1.18 -2.43 119.26 118.18 3c74 h ALA 5249Ca 0.19 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3c74 h ALA 5249Cb 0.39 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3c74 h ALA 5249CO 0.01 0.21 -0.07 -0.09 0.00 0.00 0.00 179.25 179.31 3c74 h ARG 5250N 0.00 0.63 0.00 0.00 2.43 -1.30 -2.83 114.38 113.32 3c74 h ARG 5250Ca -0.00 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 3c74 h ARG 5250Cb 0.30 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3c74 h ARG 5250CO 0.02 0.70 -0.16 0.54 -1.51 0.00 0.00 179.97 179.57 3c74 n ARG 5251N -4.21 0.13 -0.13 0.20 1.74 -0.93 -3.64 116.66 109.82 3c74 n ARG 5251Ca 0.01 0.08 0.08 0.00 -0.77 0.00 0.00 57.85 57.26 3c74 n ARG 5251Cb 0.31 -1.63 0.15 0.00 -1.02 0.00 0.00 32.46 30.27 3c74 n ARG 5251CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3c74 n LEU 5252N -1.84 2.87 -0.68 0.55 4.77 -1.08 -5.07 117.00 116.51 3c74 n LEU 5252Ca 0.06 -1.49 0.13 0.00 -0.03 0.00 0.00 56.01 54.68 3c74 n LEU 5252Cb 0.38 -0.17 0.34 0.00 -2.33 0.00 0.00 43.42 41.65 3c74 n LEU 5252CO 0.31 0.63 0.77 -0.11 -1.33 0.00 0.00 177.39 177.65