#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qez s LEU 5003N 0.00 2.24 0.38 3.14 1.43 -1.26 -5.16 118.68 119.46 1qez s LEU 5003Ca 0.00 -0.58 0.06 0.00 -1.03 0.00 0.00 54.13 52.58 1qez s LEU 5003Cb 0.00 -0.67 -0.07 0.00 0.03 0.00 0.00 46.19 45.48 1qez s LEU 5003CO 0.00 0.01 0.03 -0.94 0.23 0.00 0.00 176.35 175.68 1qez s SER 5004N -1.55 3.37 0.41 2.29 1.04 -1.26 -4.46 113.70 113.53 1qez s SER 5004Ca 0.02 -1.38 0.28 0.00 0.48 0.00 0.00 55.95 55.35 1qez s SER 5004Cb -0.09 -0.28 0.97 0.00 0.10 0.00 0.00 66.02 66.72 1qez s SER 5004CO 0.02 -0.51 1.81 -0.65 0.98 0.00 0.00 173.24 174.89 1qez h PRO 5005N 1.88 0.00 0.00 4.02 0.11 -1.81 -3.42 132.00 132.78 1qez h PRO 5005Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qez h PRO 5005Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1qez h PRO 5005CO 0.77 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.97 1qez n GLY 5006N 0.45 3.56 0.31 -0.55 0.00 -1.26 -0.18 105.19 107.52 1qez n GLY 5006Ca 0.02 -1.55 0.19 0.00 0.00 0.00 0.00 46.02 44.68 1qez n GLY 5006CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qez h LYS 5007N 0.00 0.00 -0.34 1.61 1.57 -1.94 -2.72 116.57 114.75 1qez h LYS 5007Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1qez h LYS 5007Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1qez h LYS 5007CO 0.00 0.02 0.00 0.09 -0.57 0.00 0.00 179.45 178.99 1qez n ASN 5008N -3.25 4.06 -4.76 0.86 4.13 -1.26 -5.01 115.26 110.03 1qez n ASN 5008Ca -0.02 -2.83 -0.39 0.00 1.68 0.00 0.00 54.58 53.02 1qez n ASN 5008Cb 0.16 -0.52 0.03 0.00 -1.54 0.00 0.00 39.78 37.91 1qez n ASN 5008CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1qez s ALA 5009N -2.50 3.02 -2.22 5.41 0.00 -1.03 -1.26 121.76 123.18 1qez s ALA 5009Ca 0.42 1.42 0.20 0.00 0.00 0.00 0.00 51.96 53.99 1qez s ALA 5009Cb 0.32 -3.59 0.54 0.00 0.00 0.00 0.00 23.12 20.39 1qez s ALA 5009CO 0.12 -1.32 1.44 -0.35 0.00 0.00 0.00 175.76 175.65 1qez n PRO 5010N -0.64 2.16 -0.01 0.00 -0.04 -1.26 -4.86 135.00 130.34 1qez n PRO 5010Ca 0.08 -1.77 -0.04 0.00 -0.04 0.00 0.00 63.50 61.73 1qez n PRO 5010Cb 0.43 -1.44 0.19 0.00 -0.04 0.00 0.00 33.50 32.65 1qez n PRO 5010CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1qez h ASP 5011N 3.23 0.55 -3.29 3.54 3.32 -1.56 -3.42 116.42 118.79 1qez h ASP 5011Ca 0.00 -0.18 -0.25 0.00 0.02 0.00 0.00 57.03 56.62 1qez h ASP 5011Cb 0.72 -0.15 -0.33 0.00 0.22 0.00 0.00 39.33 39.80 1qez h ASP 5011CO 0.00 0.76 -0.59 -0.69 -1.72 0.00 0.00 179.24 177.00 1qez s VAL 5012N -4.60 -0.13 0.15 -1.35 1.01 -0.99 -4.30 120.40 110.19 1qez s VAL 5012Ca -0.07 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.19 1qez s VAL 5012Cb 0.14 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.19 1qez s VAL 5012CO 0.80 0.10 -0.12 0.68 0.00 0.00 0.00 175.10 176.55 1qez s VAL 5013N 1.57 1.36 0.13 2.92 -7.23 -0.64 -2.72 120.40 115.79 1qez s VAL 5013Ca -0.05 -1.99 -0.25 0.00 -1.81 0.00 0.00 61.98 57.87 1qez s VAL 5013Cb -0.12 -1.80 -0.07 0.00 0.56 0.00 0.00 36.38 34.95 1qez s VAL 5013CO -0.06 -0.61 0.77 0.20 -0.31 0.00 0.00 175.10 175.09 1qez s ASN 5014N -2.98 7.35 -0.10 4.85 0.01 0.75 -1.23 114.94 123.58 1qez s ASN 5014Ca 0.16 1.60 0.00 0.00 -0.71 0.00 0.00 52.86 53.90 1qez s ASN 5014Cb -0.01 -2.49 0.02 0.00 0.41 0.00 0.00 41.25 39.18 1qez s ASN 5014CO 0.03 0.16 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.00 1qez s VAL 5015N -0.86 1.01 -0.37 1.60 1.01 -0.32 -4.11 120.40 118.37 1qez s VAL 5015Ca 0.37 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.82 1qez s VAL 5015Cb -0.22 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.15 1qez s VAL 5015CO 0.25 0.36 0.68 -0.22 0.00 0.00 0.00 175.10 176.17 1qez s LEU 5016N 1.45 4.25 0.17 3.92 0.20 -0.74 -1.22 118.68 126.70 1qez s LEU 5016Ca -0.00 0.14 -0.30 0.00 0.69 0.00 0.00 54.13 54.66 1qez s LEU 5016Cb -0.13 -2.84 -0.08 0.00 -0.43 0.00 0.00 46.19 42.71 1qez s LEU 5016CO -0.05 -0.65 1.17 -0.69 -0.29 0.00 0.00 176.35 175.83 1qez s VAL 5017N 2.83 3.72 -0.10 1.68 1.01 0.47 -2.78 120.40 127.23 1qez s VAL 5017Ca 0.26 1.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.64 1qez s VAL 5017Cb -0.14 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 1qez s VAL 5017CO 0.16 0.22 -0.11 -0.62 0.00 0.00 0.00 175.10 174.74 1qez n GLU 5018N 2.66 0.23 -4.02 2.72 1.02 0.89 0.92 120.64 125.05 1qez n GLU 5018Ca 0.04 0.08 -0.33 0.00 -0.02 0.00 0.00 57.16 56.93 1qez n GLU 5018Cb 0.45 -1.00 -0.15 0.00 -0.02 0.00 0.00 31.44 30.72 1qez n GLU 5018CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qez s ILE 5019N -2.19 2.49 0.55 -3.67 1.01 -0.38 -4.55 121.20 114.46 1qez s ILE 5019Ca -0.14 -1.25 -0.20 0.00 0.00 0.00 0.00 60.65 59.07 1qez s ILE 5019Cb 0.05 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 1qez s ILE 5019CO 0.20 0.16 1.17 -2.16 0.00 0.00 0.00 174.94 174.30 1qez s PRO 5020N 1.24 3.25 0.47 2.79 0.04 -1.26 -0.88 135.00 140.64 1qez s PRO 5020Ca -0.02 1.72 -0.25 0.00 0.04 0.00 0.00 61.00 62.49 1qez s PRO 5020Cb -0.17 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 1qez s PRO 5020CO -0.06 -0.95 1.43 0.94 0.04 0.00 0.00 177.00 178.40 1qez n GLN 5021N -1.32 2.19 0.00 4.56 7.27 -1.25 -2.15 117.38 126.68 1qez n GLN 5021Ca 0.12 0.78 0.00 0.00 0.07 0.00 0.00 57.00 57.97 1qez n GLN 5021Cb 0.50 -2.63 0.00 0.00 2.41 0.00 0.00 30.24 30.52 1qez n GLN 5021CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1qez n GLY 5022N 0.60 2.49 3.76 1.69 0.00 0.59 -4.73 105.19 109.59 1qez n GLY 5022Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1qez n GLY 5022CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qez s SER 5023N -2.06 5.10 -0.06 1.61 0.15 -0.91 -4.56 113.70 112.97 1qez s SER 5023Ca 0.00 2.23 0.09 0.00 0.70 0.00 0.00 55.95 58.96 1qez s SER 5023Cb 0.00 -2.58 0.13 0.00 -1.71 0.00 0.00 66.02 61.86 1qez s SER 5023CO 0.00 -1.65 1.02 -0.46 1.20 0.00 0.00 173.24 173.35 1qez n ASN 5024N -1.97 1.46 -4.18 5.45 6.94 -1.26 -0.65 115.26 121.06 1qez n ASN 5024Ca 0.12 -2.39 -0.33 0.00 -0.02 0.00 0.00 54.58 51.96 1qez n ASN 5024Cb 0.51 -0.24 -0.16 0.00 -2.36 0.00 0.00 39.78 37.52 1qez n ASN 5024CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1qez s ILE 5025N -1.51 2.28 -0.71 1.53 1.01 -1.26 -1.89 121.20 120.65 1qez s ILE 5025Ca 0.15 -0.88 -0.24 0.00 0.00 0.00 0.00 60.65 59.67 1qez s ILE 5025Cb 0.13 -1.95 0.06 0.00 0.01 0.00 0.00 42.46 40.70 1qez s ILE 5025CO 0.01 0.53 1.10 -0.75 0.00 0.00 0.00 174.94 175.83 1qez s LYS 5026N 1.09 3.18 0.39 2.79 2.20 0.82 -4.92 119.74 125.29 1qez s LYS 5026Ca -0.00 -0.67 -0.11 0.00 -0.36 0.00 0.00 55.97 54.83 1qez s LYS 5026Cb -0.14 -4.28 -0.07 0.00 -1.51 0.00 0.00 37.83 31.83 1qez s LYS 5026CO -0.07 -1.95 0.76 0.71 -0.36 0.00 0.00 175.35 174.44 1qez s TYR 5027N 4.65 3.46 -0.04 4.03 2.02 -1.26 -1.17 117.35 129.04 1qez s TYR 5027Ca 0.28 1.05 -0.02 0.00 -0.37 0.00 0.00 57.07 58.01 1qez s TYR 5027Cb -0.13 -2.44 0.02 0.00 -0.40 0.00 0.00 41.96 39.01 1qez s TYR 5027CO 0.10 -0.07 0.08 -2.00 -1.57 0.00 0.00 175.55 172.09 1qez s GLU 5028N -3.74 0.07 -0.15 -0.62 2.12 0.64 -4.64 118.70 112.38 1qez s GLU 5028Ca 0.51 0.18 -0.22 0.00 0.36 0.00 0.00 54.97 55.81 1qez s GLU 5028Cb -0.10 -0.06 -0.03 0.00 0.26 0.00 0.00 34.13 34.20 1qez s GLU 5028CO 0.30 -0.07 0.65 -0.47 -0.54 0.00 0.00 175.26 175.13 1qez s TYR 5029N 0.47 3.45 -0.47 5.30 5.04 -1.26 0.57 117.35 130.44 1qez s TYR 5029Ca -0.04 1.04 -0.11 0.00 -2.44 0.00 0.00 57.07 55.52 1qez s TYR 5029Cb -0.05 -2.79 0.10 0.00 0.35 0.00 0.00 41.96 39.57 1qez s TYR 5029CO -0.02 -0.07 0.36 0.34 -1.34 0.00 0.00 175.55 174.82 1qez s ASP 5030N 1.02 5.84 0.42 4.32 -1.08 0.52 -4.95 116.67 122.76 1qez s ASP 5030Ca 0.32 -1.68 0.09 0.00 -0.52 0.00 0.00 52.55 50.75 1qez s ASP 5030Cb -0.16 -2.07 0.90 0.00 -1.46 0.00 0.00 42.92 40.14 1qez s ASP 5030CO 0.13 -0.67 2.05 -2.24 0.52 0.00 0.00 175.17 174.95 1qez h ASP 5031N 8.56 0.44 0.00 -0.34 3.04 -1.94 0.89 116.42 127.07 1qez h ASP 5031Ca -0.24 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1qez h ASP 5031Cb 1.09 -0.10 0.00 0.00 -1.04 0.00 0.00 39.33 39.27 1qez h ASP 5031CO 0.87 0.31 0.00 -0.62 -2.04 0.00 0.00 179.24 177.75 1qez n GLU 5032N -4.48 0.00 0.30 4.15 1.02 -1.26 -3.16 120.64 117.21 1qez n GLU 5032Ca 0.04 0.38 0.18 0.00 -0.02 0.00 0.00 57.16 57.74 1qez n GLU 5032Cb 0.12 -1.37 0.89 0.00 -0.02 0.00 0.00 31.44 31.06 1qez n GLU 5032CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1qez h GLU 5033N 0.00 0.00 -1.60 3.49 5.08 -1.99 -3.46 114.58 116.09 1qez h GLU 5033Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1qez h GLU 5033Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1qez h GLU 5033CO 0.00 0.03 -0.22 0.41 -1.00 0.00 0.00 179.01 178.23 1qez n GLY 5034N -0.55 0.11 3.31 -3.84 0.00 0.31 -5.04 105.19 99.49 1qez n GLY 5034Ca -0.01 -0.48 -0.16 0.00 0.00 0.00 0.00 46.02 45.36 1qez n GLY 5034CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qez s VAL 5035N -2.59 0.85 -0.36 1.61 -7.23 -0.98 -4.95 120.40 106.75 1qez s VAL 5035Ca 0.06 -2.01 -0.17 0.00 -1.81 0.00 0.00 61.98 58.04 1qez s VAL 5035Cb -0.03 -2.38 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 1qez s VAL 5035CO 0.07 -0.27 0.48 -0.63 -0.31 0.00 0.00 175.10 174.43 1qez s ILE 5036N -3.54 5.05 0.01 -0.62 -1.09 -1.26 -0.35 121.20 119.39 1qez s ILE 5036Ca 0.30 0.20 -0.01 0.00 -2.23 0.00 0.00 60.65 58.91 1qez s ILE 5036Cb 0.06 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 1qez s ILE 5036CO 0.09 -0.22 0.15 -0.75 -1.23 0.00 0.00 174.94 172.98 1qez s LYS 5037N 2.30 3.28 -0.60 2.79 2.20 0.19 -4.89 119.74 125.01 1qez s LYS 5037Ca 0.17 -0.42 -0.24 0.00 -0.36 0.00 0.00 55.97 55.12 1qez s LYS 5037Cb -0.16 -2.99 0.05 0.00 -1.51 0.00 0.00 37.83 33.22 1qez s LYS 5037CO 0.13 0.65 0.99 0.08 -0.36 0.00 0.00 175.35 176.84 1qez s VAL 5038N -1.31 4.29 -0.00 4.02 1.01 -1.26 -0.26 120.40 126.88 1qez s VAL 5038Ca 0.27 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 62.15 1qez s VAL 5038Cb -0.12 -4.63 -0.17 0.00 0.00 0.00 0.00 36.38 31.46 1qez s VAL 5038CO 0.19 -1.30 1.21 -0.78 0.00 0.00 0.00 175.10 174.42 1qez h ASP 5039N 9.47 -0.25 -4.50 3.32 3.58 -1.47 -3.49 116.42 123.09 1qez h ASP 5039Ca -0.27 -0.24 0.17 0.00 0.42 0.00 0.00 57.03 57.11 1qez h ASP 5039Cb 1.07 0.07 -0.17 0.00 1.72 0.00 0.00 39.33 42.02 1qez h ASP 5039CO 1.14 0.14 0.62 0.00 -2.88 0.00 0.00 179.24 178.27 1qez s ARG 5040N -4.48 0.61 -0.40 0.28 1.70 -1.19 -5.04 118.95 110.44 1qez s ARG 5040Ca -0.14 -0.23 -0.14 0.00 -0.47 0.00 0.00 55.73 54.75 1qez s ARG 5040Cb 0.02 0.28 0.02 0.00 -0.57 0.00 0.00 34.95 34.70 1qez s ARG 5040CO 0.56 -0.27 0.28 0.08 -1.08 0.00 0.00 175.30 174.87 1qez s VAL 5041N -2.83 5.15 -0.10 4.99 1.01 -1.26 -0.13 120.40 127.22 1qez s VAL 5041Ca 0.07 -0.65 -0.25 0.00 0.00 0.00 0.00 61.98 61.15 1qez s VAL 5041Cb -0.01 -3.84 -0.12 0.00 0.00 0.00 0.00 36.38 32.41 1qez s VAL 5041CO -0.07 -0.27 0.75 0.18 0.00 0.00 0.00 175.10 175.69 1qez n LEU 5042N 5.13 0.24 0.14 3.92 4.77 -0.79 -4.80 117.00 125.61 1qez n LEU 5042Ca -0.11 0.70 0.13 0.00 -0.03 0.00 0.00 56.01 56.70 1qez n LEU 5042Cb 0.47 -0.54 0.45 0.00 -2.33 0.00 0.00 43.42 41.47 1qez n LEU 5042CO 0.40 -0.93 0.88 1.88 -1.33 0.00 0.00 177.39 178.29 1qez h TYR 5043N 2.20 0.00 -2.19 -1.77 -1.99 -1.91 -3.44 116.97 107.86 1qez h TYR 5043Ca -0.29 0.00 -0.48 0.00 2.00 0.00 0.00 58.73 59.96 1qez h TYR 5043Cb 0.84 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.54 1qez h TYR 5043CO 0.36 0.00 -0.48 0.95 -0.00 0.00 0.00 178.16 178.99 1qez s THR 5044N -3.26 4.87 -1.43 -2.88 -4.23 -1.26 -4.97 115.64 102.47 1qez s THR 5044Ca 0.07 -1.19 -0.08 0.00 -1.18 0.00 0.00 61.69 59.31 1qez s THR 5044Cb 0.10 -3.64 0.01 0.00 1.34 0.00 0.00 72.50 70.31 1qez s THR 5044CO 0.51 -0.34 2.70 -0.24 -0.54 0.00 0.00 174.62 176.70 1qez n SER 5045N -1.29 8.33 -4.44 3.99 2.88 -1.26 -4.88 113.62 116.94 1qez n SER 5045Ca -0.08 -2.86 -0.25 0.00 -1.33 0.00 0.00 58.87 54.35 1qez n SER 5045Cb 0.57 -1.46 -0.10 0.00 -0.75 0.00 0.00 64.21 62.48 1qez n SER 5045CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1qez s MET 5046N 0.47 1.82 -0.04 -1.46 -1.94 -1.26 -5.17 119.30 111.72 1qez s MET 5046Ca 0.62 -2.06 -0.18 0.00 -1.71 0.00 0.00 55.69 52.36 1qez s MET 5046Cb 0.19 -1.01 0.03 0.00 2.01 0.00 0.00 34.83 36.05 1qez s MET 5046CO -0.08 -0.25 0.39 0.54 -0.01 0.00 0.00 175.02 175.61 1qez s ASN 5047N -3.59 -0.31 -0.08 3.03 4.22 -1.26 -4.60 114.94 112.34 1qez s ASN 5047Ca 0.30 0.32 -0.32 0.00 -2.14 0.00 0.00 52.86 51.02 1qez s ASN 5047Cb 0.07 0.44 -0.10 0.00 1.28 0.00 0.00 41.25 42.94 1qez s ASN 5047CO 0.14 -0.42 1.98 -1.22 -2.04 0.00 0.00 177.10 175.54 1qez n TYR 5048N 1.48 2.29 0.83 1.54 4.02 0.18 -4.81 117.16 122.69 1qez n TYR 5048Ca -0.20 -0.12 -0.00 0.00 -0.01 0.00 0.00 57.90 57.56 1qez n TYR 5048Cb 0.56 -2.71 0.03 0.00 -0.02 0.00 0.00 39.34 37.20 1qez n TYR 5048CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1qez n PRO 5049N 7.32 1.25 -3.62 -0.72 -0.04 -1.26 -0.30 135.00 137.63 1qez n PRO 5049Ca 0.24 -0.26 -0.03 0.00 -0.04 0.00 0.00 63.50 63.41 1qez n PRO 5049Cb 0.35 -1.39 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 1qez n PRO 5049CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1qez s PHE 5050N -0.82 -0.13 -0.00 0.54 -0.12 -1.26 -4.92 117.98 111.26 1qez s PHE 5050Ca 0.05 0.01 -0.27 0.00 -0.05 0.00 0.00 56.93 56.66 1qez s PHE 5050Cb 0.04 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 1qez s PHE 5050CO 0.01 -0.39 0.84 -0.80 -0.05 0.00 0.00 175.22 174.83 1qez s ASN 5051N -2.64 7.22 -0.06 1.98 0.01 -0.33 -3.83 114.94 117.29 1qez s ASN 5051Ca 0.11 1.47 0.02 0.00 -0.71 0.00 0.00 52.86 53.75 1qez s ASN 5051Cb 0.01 -2.50 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 1qez s ASN 5051CO -0.04 -0.14 -0.10 -0.47 -1.51 0.00 0.00 177.10 174.84 1qez s TYR 5052N 0.65 2.84 0.00 2.20 6.14 -0.06 -0.17 117.35 128.94 1qez s TYR 5052Ca 0.44 -0.05 0.00 0.00 0.64 0.00 0.00 57.07 58.10 1qez s TYR 5052Cb -0.20 -1.67 0.00 0.00 0.42 0.00 0.00 41.96 40.51 1qez s TYR 5052CO 0.24 0.27 0.00 0.41 0.64 0.00 0.00 175.55 177.11 1qez n GLY 5053N 2.23 1.27 3.11 8.97 0.00 -1.00 -0.07 105.19 119.69 1qez n GLY 5053Ca -0.18 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 1qez n GLY 5053CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1qez s PHE 5054N -4.20 0.65 -0.41 1.61 -0.12 -1.12 -0.47 117.98 113.92 1qez s PHE 5054Ca 0.00 -0.89 -0.25 0.00 -0.05 0.00 0.00 56.93 55.74 1qez s PHE 5054Cb 0.00 -0.42 0.02 0.00 -0.63 0.00 0.00 43.02 41.99 1qez s PHE 5054CO 0.00 -0.24 0.88 0.42 -0.05 0.00 0.00 175.22 176.22 1qez s ILE 5055N -3.28 4.59 0.56 -4.49 1.01 -0.41 -1.79 121.20 117.40 1qez s ILE 5055Ca 0.05 0.87 -0.20 0.00 0.00 0.00 0.00 60.65 61.37 1qez s ILE 5055Cb 0.03 -4.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1qez s ILE 5055CO -0.06 -0.64 1.28 -2.16 0.00 0.00 0.00 174.94 173.36 1qez s PRO 5056N 3.46 3.08 -0.21 2.79 0.04 -1.26 -3.38 135.00 139.53 1qez s PRO 5056Ca 0.35 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.41 1qez s PRO 5056Cb -0.12 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1qez s PRO 5056CO 0.21 -1.17 0.00 0.41 0.04 0.00 0.00 177.00 176.49 1qez n GLY 5057N 0.66 0.35 3.20 0.56 0.00 -1.26 -2.63 105.19 106.07 1qez n GLY 5057Ca 0.12 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 1qez n GLY 5057CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qez s THR 5058N -2.11 1.09 -0.05 2.61 -4.23 -1.22 -4.60 115.64 107.14 1qez s THR 5058Ca 0.00 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 58.84 1qez s THR 5058Cb 0.00 -1.40 0.03 0.00 1.34 0.00 0.00 72.50 72.48 1qez s THR 5058CO 0.00 -0.49 0.11 -0.22 -0.54 0.00 0.00 174.62 173.48 1qez s LEU 5059N -2.40 0.90 0.42 4.79 2.96 0.31 -3.94 118.68 121.73 1qez s LEU 5059Ca 0.06 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.28 1qez s LEU 5059Cb -0.04 0.25 -0.00 0.00 0.50 0.00 0.00 46.19 46.90 1qez s LEU 5059CO 0.01 -0.13 0.50 -1.61 -1.32 0.00 0.00 176.35 173.80 1qez s GLU 5060N 1.03 2.70 0.66 1.98 0.41 0.25 -4.35 118.70 121.38 1qez s GLU 5060Ca -0.08 -1.37 0.41 0.00 -0.41 0.00 0.00 54.97 53.51 1qez s GLU 5060Cb -0.11 -2.60 2.23 0.00 -1.78 0.00 0.00 34.13 31.87 1qez s GLU 5060CO -0.05 -0.25 2.27 0.93 -0.49 0.00 0.00 175.26 177.67 1qez h GLU 5061N 0.79 0.00 -0.26 1.61 5.08 -2.00 -0.17 114.58 119.62 1qez h GLU 5061Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1qez h GLU 5061Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1qez h GLU 5061CO 0.50 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.11 1qez n ASP 5062N -3.10 1.45 0.00 1.42 5.68 -1.26 -4.89 116.55 115.85 1qez n ASP 5062Ca -0.03 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.29 1qez n ASP 5062Cb 0.14 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1qez n ASP 5062CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qez n GLY 5063N 0.94 0.86 3.67 6.12 0.00 -0.08 -5.01 105.19 111.70 1qez n GLY 5063Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1qez n GLY 5063CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qez s ASP 5064N -2.86 4.76 0.89 1.61 1.01 -1.26 -4.82 116.67 116.01 1qez s ASP 5064Ca 0.00 -0.48 -0.11 0.00 0.71 0.00 0.00 52.55 52.67 1qez s ASP 5064Cb 0.00 -0.99 0.13 0.00 1.01 0.00 0.00 42.92 43.07 1qez s ASP 5064CO 0.00 0.04 1.10 -2.84 0.21 0.00 0.00 175.17 173.68 1qez s PRO 5065N -3.34 1.25 0.03 8.23 0.02 -1.25 -0.58 135.00 139.35 1qez s PRO 5065Ca 0.30 1.08 -0.30 0.00 0.02 0.00 0.00 61.00 62.09 1qez s PRO 5065Cb -0.08 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.61 1qez s PRO 5065CO 0.20 -2.32 1.16 -1.17 -0.33 0.00 0.00 177.00 174.53 1qez s LEU 5066N -6.33 4.35 0.52 -5.54 2.96 -1.26 -4.74 118.68 108.65 1qez s LEU 5066Ca 0.64 1.91 -0.13 0.00 -0.22 0.00 0.00 54.13 56.33 1qez s LEU 5066Cb -0.20 -3.57 -0.06 0.00 0.50 0.00 0.00 46.19 42.86 1qez s LEU 5066CO 0.58 -0.45 0.94 -1.81 -1.32 0.00 0.00 176.35 174.29 1qez s ASP 5067N 1.12 6.45 -0.01 3.68 1.01 -1.26 -1.29 116.67 126.38 1qez s ASP 5067Ca 0.57 1.38 0.00 0.00 0.71 0.00 0.00 52.55 55.21 1qez s ASP 5067Cb -0.27 -2.44 0.01 0.00 1.01 0.00 0.00 42.92 41.23 1qez s ASP 5067CO 0.28 -0.64 -0.01 -0.69 0.21 0.00 0.00 175.17 174.32 1qez s VAL 5068N -2.76 0.08 -0.53 -1.27 1.01 0.38 -1.21 120.40 116.10 1qez s VAL 5068Ca 0.55 -0.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.41 1qez s VAL 5068Cb -0.10 -0.10 0.13 0.00 0.00 0.00 0.00 36.38 36.31 1qez s VAL 5068CO 0.40 0.05 0.44 -0.76 0.00 0.00 0.00 175.10 175.22 1qez s LEU 5069N 0.20 5.92 -0.30 3.92 1.02 0.12 -2.38 118.68 127.19 1qez s LEU 5069Ca -0.02 -1.99 -0.25 0.00 0.02 0.00 0.00 54.13 51.89 1qez s LEU 5069Cb -0.03 -2.08 0.01 0.00 0.02 0.00 0.00 46.19 44.10 1qez s LEU 5069CO -0.01 -0.72 0.88 -0.69 0.02 0.00 0.00 176.35 175.84 1qez s VAL 5070N 1.25 4.72 -0.30 -1.59 1.01 0.76 -1.57 120.40 124.67 1qez s VAL 5070Ca 0.07 1.41 -0.16 0.00 0.00 0.00 0.00 61.98 63.30 1qez s VAL 5070Cb -0.26 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 31.88 1qez s VAL 5070CO -0.00 -0.29 0.41 -0.63 0.00 0.00 0.00 175.10 174.59 1qez s ILE 5071N 3.14 5.13 0.35 2.22 1.01 0.57 -1.19 121.20 132.43 1qez s ILE 5071Ca 0.37 0.42 -0.03 0.00 0.00 0.00 0.00 60.65 61.41 1qez s ILE 5071Cb -0.14 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.54 1qez s ILE 5071CO 0.12 0.01 0.48 0.42 0.00 0.00 0.00 174.94 175.98 1qez s THR 5072N 2.15 0.00 -0.30 2.92 -4.23 -1.26 -4.35 115.64 110.57 1qez s THR 5072Ca 0.16 -1.58 0.07 0.00 -1.18 0.00 0.00 61.69 59.16 1qez s THR 5072Cb -0.16 -2.65 0.46 0.00 1.34 0.00 0.00 72.50 71.49 1qez s THR 5072CO 0.11 0.00 1.30 -0.46 -0.54 0.00 0.00 174.62 175.03 1qez n ASN 5073N -1.41 4.10 -3.50 3.99 0.23 -1.26 -4.96 115.26 112.45 1qez n ASN 5073Ca 0.01 -3.80 -0.11 0.00 -0.53 0.00 0.00 54.58 50.15 1qez n ASN 5073Cb 0.61 -0.47 -0.03 0.00 -2.08 0.00 0.00 39.78 37.82 1qez n ASN 5073CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1qez s TYR 5074N -3.49 -0.43 0.10 -2.53 -0.85 -1.26 -5.17 117.35 103.71 1qez s TYR 5074Ca 0.48 0.18 0.00 0.00 -0.52 0.00 0.00 57.07 57.21 1qez s TYR 5074Cb 0.41 0.49 -0.04 0.00 0.38 0.00 0.00 41.96 43.20 1qez s TYR 5074CO 0.01 -0.83 0.25 1.14 -1.52 0.00 0.00 175.55 174.60 1qez s GLN 5075N -3.77 3.46 0.28 -3.49 -2.07 -1.26 -4.71 119.66 108.09 1qez s GLN 5075Ca 0.02 -0.44 0.09 0.00 -1.82 0.00 0.00 55.36 53.22 1qez s GLN 5075Cb -0.01 -2.99 -0.04 0.00 -1.09 0.00 0.00 33.01 28.88 1qez s GLN 5075CO -0.12 0.56 0.02 -0.51 -1.32 0.00 0.00 175.29 173.92 1qez s LEU 5076N -2.74 3.21 0.12 2.60 1.43 -1.26 -4.97 118.68 117.07 1qez s LEU 5076Ca 0.36 -0.66 -0.27 0.00 -1.03 0.00 0.00 54.13 52.52 1qez s LEU 5076Cb -0.12 -1.72 -0.07 0.00 0.03 0.00 0.00 46.19 44.31 1qez s LEU 5076CO 0.28 -0.04 0.85 -0.31 0.23 0.00 0.00 176.35 177.36 1qez s TYR 5077N -2.34 3.84 0.18 0.29 1.51 -1.26 -4.40 117.35 115.17 1qez s TYR 5077Ca 0.32 1.68 -0.33 0.00 -1.01 0.00 0.00 57.07 57.73 1qez s TYR 5077Cb -0.06 -2.90 -0.14 0.00 -0.11 0.00 0.00 41.96 38.75 1qez s TYR 5077CO 0.20 0.34 1.47 -2.30 -1.11 0.00 0.00 175.55 174.15 1qez n PRO 5078N 2.33 1.97 -0.34 -1.71 -0.02 -1.26 -1.41 135.00 134.55 1qez n PRO 5078Ca -0.02 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1qez n PRO 5078Cb 0.49 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1qez n PRO 5078CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qez n GLY 5079N 2.81 0.70 3.92 -1.23 0.00 0.26 -4.99 105.19 106.66 1qez n GLY 5079Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1qez n GLY 5079CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qez s SER 5080N -2.99 6.40 -0.10 1.61 1.04 -0.50 -4.82 113.70 114.35 1qez s SER 5080Ca 0.00 0.48 -0.02 0.00 0.48 0.00 0.00 55.95 56.89 1qez s SER 5080Cb 0.00 -2.04 -0.03 0.00 0.10 0.00 0.00 66.02 64.05 1qez s SER 5080CO 0.00 -0.07 -0.03 -0.69 0.98 0.00 0.00 173.24 173.43 1qez s VAL 5081N -1.91 4.03 0.04 5.02 1.01 -1.26 -0.39 120.40 126.94 1qez s VAL 5081Ca 0.40 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1qez s VAL 5081Cb -0.11 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 1qez s VAL 5081CO 0.29 0.57 -0.11 -0.51 0.00 0.00 0.00 175.10 175.34 1qez s ILE 5082N -0.53 0.85 -0.25 2.22 2.07 -0.36 -4.94 121.20 120.26 1qez s ILE 5082Ca 0.09 -0.95 -0.16 0.00 -1.41 0.00 0.00 60.65 58.21 1qez s ILE 5082Cb -0.12 -0.81 -0.03 0.00 0.13 0.00 0.00 42.46 41.63 1qez s ILE 5082CO 0.02 -0.12 0.43 -1.61 -1.91 0.00 0.00 174.94 171.75 1qez s GLU 5083N -1.20 4.08 0.39 3.50 2.02 -1.26 -1.17 118.70 125.06 1qez s GLU 5083Ca -0.02 0.18 0.08 0.00 0.02 0.00 0.00 54.97 55.23 1qez s GLU 5083Cb -0.08 -3.62 -0.07 0.00 0.10 0.00 0.00 34.13 30.46 1qez s GLU 5083CO 0.01 -0.24 0.03 0.14 0.02 0.00 0.00 175.26 175.22 1qez s VAL 5084N 1.95 2.21 -0.23 2.63 -7.23 -0.37 -0.76 120.40 118.61 1qez s VAL 5084Ca 0.18 -1.97 -0.01 0.00 -1.81 0.00 0.00 61.98 58.37 1qez s VAL 5084Cb -0.15 -2.90 0.02 0.00 0.56 0.00 0.00 36.38 33.90 1qez s VAL 5084CO 0.09 -0.07 -0.09 -0.13 -0.31 0.00 0.00 175.10 174.59 1qez s ARG 5085N -3.73 2.95 0.23 4.82 0.52 0.94 -1.63 118.95 123.04 1qez s ARG 5085Ca 0.36 -0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 54.37 1qez s ARG 5085Cb 0.06 -2.90 -0.09 0.00 0.52 0.00 0.00 34.95 32.53 1qez s ARG 5085CO 0.19 -0.33 1.34 -2.14 0.02 0.00 0.00 175.30 174.38 1qez s PRO 5086N 1.34 4.36 0.00 3.54 0.02 -1.26 -2.23 135.00 140.77 1qez s PRO 5086Ca 0.02 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.18 1qez s PRO 5086Cb -0.16 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.21 1qez s PRO 5086CO -0.06 -0.28 0.24 0.44 -0.33 0.00 0.00 177.00 177.01 1qez n ILE 5087N 2.31 0.00 -2.26 2.83 -5.35 0.65 -4.85 119.36 112.69 1qez n ILE 5087Ca 0.05 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 1qez n ILE 5087Cb 0.42 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1qez n ILE 5087CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1qez n GLY 5088N 0.46 -1.25 3.18 3.28 0.00 -0.97 -0.29 105.19 109.62 1qez n GLY 5088Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.01 1qez n GLY 5088CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1qez s ILE 5089N -2.73 0.04 -0.16 -0.61 2.07 -0.98 -1.07 121.20 117.76 1qez s ILE 5089Ca 0.00 -0.34 0.01 0.00 -1.41 0.00 0.00 60.65 58.91 1qez s ILE 5089Cb 0.00 -0.49 0.01 0.00 0.13 0.00 0.00 42.46 42.10 1qez s ILE 5089CO 0.00 -0.19 -0.17 -0.22 -1.91 0.00 0.00 174.94 172.45 1qez s LEU 5090N -0.78 2.32 -0.15 8.50 2.96 0.42 -0.12 118.68 131.83 1qez s LEU 5090Ca -0.09 -0.55 -0.11 0.00 -0.22 0.00 0.00 54.13 53.17 1qez s LEU 5090Cb -0.04 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 45.07 1qez s LEU 5090CO 0.02 0.05 0.19 -0.31 -1.32 0.00 0.00 176.35 174.99 1qez s TYR 5091N 1.01 3.50 0.23 5.38 2.02 0.51 -1.01 117.35 128.98 1qez s TYR 5091Ca -0.02 0.50 -0.13 0.00 -0.37 0.00 0.00 57.07 57.05 1qez s TYR 5091Cb -0.15 -2.16 0.00 0.00 -0.40 0.00 0.00 41.96 39.26 1qez s TYR 5091CO -0.04 0.42 0.47 0.00 -1.57 0.00 0.00 175.55 174.83 1qez s MET 5092N -0.08 1.49 -0.03 -0.62 0.23 0.21 0.51 119.30 121.00 1qez s MET 5092Ca 0.13 -1.18 0.01 0.00 -1.03 0.00 0.00 55.69 53.62 1qez s MET 5092Cb -0.12 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.67 1qez s MET 5092CO 0.02 -0.62 -0.05 0.21 -2.03 0.00 0.00 175.02 172.55 1qez s LYS 5093N -3.99 0.76 0.09 3.16 2.20 0.19 -0.54 119.74 121.61 1qez s LYS 5093Ca 0.20 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.68 1qez s LYS 5093Cb -0.00 -0.76 -0.00 0.00 -1.51 0.00 0.00 37.83 35.56 1qez s LYS 5093CO 0.06 -0.03 0.02 -0.40 -0.36 0.00 0.00 175.35 174.64 1qez n ASP 5094N 3.77 1.50 0.28 1.43 5.68 0.24 -0.16 116.55 129.28 1qez n ASP 5094Ca -0.23 -1.43 0.18 0.00 -0.50 0.00 0.00 54.79 52.81 1qez n ASP 5094Cb 0.52 0.15 0.95 0.00 -1.14 0.00 0.00 41.12 41.60 1qez n ASP 5094CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1qez h GLU 5095N 0.00 0.00 0.00 0.11 9.09 -1.83 -1.13 114.58 120.82 1qez h GLU 5095Ca -0.07 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.34 1qez h GLU 5095Cb 0.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 1qez h GLU 5095CO 0.11 0.00 -0.87 0.93 0.05 0.00 0.00 179.01 179.24 1qez h GLU 5096N 0.00 0.00 0.00 1.06 4.39 -1.95 -3.51 114.58 114.57 1qez h GLU 5096Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1qez h GLU 5096Cb 0.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1qez h GLU 5096CO -0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 1qez n GLY 5097N 1.20 0.46 3.82 -3.84 0.00 -0.43 -5.09 105.19 101.30 1qez n GLY 5097Ca 0.01 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 1qez n GLY 5097CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qez s GLU 5098N -1.36 4.11 -0.06 1.61 2.12 -1.26 -0.60 118.70 123.26 1qez s GLU 5098Ca 0.00 1.17 -0.30 0.00 0.36 0.00 0.00 54.97 56.20 1qez s GLU 5098Cb 0.00 -2.16 0.07 0.00 0.26 0.00 0.00 34.13 32.30 1qez s GLU 5098CO 0.00 -0.14 0.66 0.34 -0.54 0.00 0.00 175.26 175.58 1qez s ASP 5099N -2.17 -0.64 -0.01 -1.70 -1.08 0.30 -4.90 116.67 106.47 1qez s ASP 5099Ca 0.63 0.72 0.01 0.00 -0.52 0.00 0.00 52.55 53.39 1qez s ASP 5099Cb -0.11 0.57 0.00 0.00 -1.46 0.00 0.00 42.92 41.92 1qez s ASP 5099CO 0.16 -0.59 -0.03 0.00 0.52 0.00 0.00 175.17 175.23 1qez s ALA 5100N -1.13 0.28 -0.08 3.66 0.00 -1.26 -0.62 121.76 122.61 1qez s ALA 5100Ca -0.11 -0.10 0.01 0.00 0.00 0.00 0.00 51.96 51.77 1qez s ALA 5100Cb -0.00 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.03 1qez s ALA 5100CO 0.09 0.05 -0.11 0.15 0.00 0.00 0.00 175.76 175.95 1qez s LYS 5101N 0.08 1.63 0.39 0.00 1.02 -0.18 -4.55 119.74 118.13 1qez s LYS 5101Ca -0.00 -0.36 -0.26 0.00 0.02 0.00 0.00 55.97 55.37 1qez s LYS 5101Cb -0.03 -1.46 -0.09 0.00 -0.52 0.00 0.00 37.83 35.74 1qez s LYS 5101CO -0.00 -0.07 1.20 0.42 -0.92 0.00 0.00 175.35 175.97 1qez s ILE 5102N 1.01 3.04 -0.15 2.17 -1.09 -0.35 -0.44 121.20 125.39 1qez s ILE 5102Ca -0.08 0.90 -0.01 0.00 -2.23 0.00 0.00 60.65 59.23 1qez s ILE 5102Cb -0.15 -3.52 -0.01 0.00 -1.58 0.00 0.00 42.46 37.20 1qez s ILE 5102CO -0.00 0.11 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.01 1qez s VAL 5103N -1.36 3.09 0.12 2.92 1.01 -0.23 0.13 120.40 126.08 1qez s VAL 5103Ca 0.56 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.85 1qez s VAL 5103Cb -0.33 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 1qez s VAL 5103CO 0.41 0.50 0.15 0.00 0.00 0.00 0.00 175.10 176.16 1qez s ALA 5104N 0.67 0.28 0.26 5.51 0.00 -0.61 -0.25 121.76 127.62 1qez s ALA 5104Ca -0.06 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 50.94 1qez s ALA 5104Cb -0.15 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.60 1qez s ALA 5104CO 0.02 -0.53 -0.14 0.14 0.00 0.00 0.00 175.76 175.26 1qez s VAL 5105N -3.96 2.00 0.61 0.00 -7.23 -0.95 -0.31 120.40 110.56 1qez s VAL 5105Ca 0.15 -2.25 -0.19 0.00 -1.81 0.00 0.00 61.98 57.87 1qez s VAL 5105Cb 0.06 -2.28 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 1qez s VAL 5105CO -0.04 -0.43 1.31 -2.84 -0.31 0.00 0.00 175.10 172.80 1qez s PRO 5106N -3.62 2.79 0.57 4.82 0.02 -1.26 -0.04 135.00 138.28 1qez s PRO 5106Ca 0.27 2.11 -0.20 0.00 0.02 0.00 0.00 61.00 63.20 1qez s PRO 5106Cb -0.01 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 1qez s PRO 5106CO 0.12 -1.43 1.29 -1.59 -0.33 0.00 0.00 177.00 175.06 1qez s LYS 5107N -3.21 3.01 0.27 5.54 -2.85 0.06 -4.51 119.74 118.05 1qez s LYS 5107Ca 0.78 2.07 -0.04 0.00 -1.00 0.00 0.00 55.97 57.78 1qez s LYS 5107Cb -0.38 -2.10 0.54 0.00 -2.06 0.00 0.00 37.83 33.83 1qez s LYS 5107CO 0.42 -1.24 1.61 -0.44 0.10 0.00 0.00 175.35 175.79 1qez h ASP 5108N 1.16 -0.45 0.14 0.03 5.19 -1.91 0.10 116.42 120.68 1qez h ASP 5108Ca -0.51 0.23 -0.05 0.00 -0.62 0.00 0.00 57.03 56.09 1qez h ASP 5108Cb 1.30 0.42 -0.01 0.00 0.18 0.00 0.00 39.33 41.23 1qez h ASP 5108CO 0.56 -0.25 -0.18 0.11 -3.12 0.00 0.00 179.24 176.36 1qez h LYS 5109N 0.06 0.08 -0.11 3.56 1.57 -1.98 -1.30 116.57 118.46 1qez h LYS 5109Ca 0.48 -0.02 -0.23 0.00 -1.87 0.00 0.00 60.65 59.01 1qez h LYS 5109Cb 0.89 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.20 1qez h LYS 5109CO -0.79 0.27 -0.84 1.15 -0.57 0.00 0.00 179.45 178.67 1qez h THR 5110N 0.08 1.29 -1.28 -0.16 2.02 -1.34 -3.42 112.91 110.10 1qez h THR 5110Ca 0.02 -2.07 -0.16 0.00 0.77 0.00 0.00 66.41 64.97 1qez h THR 5110Cb 0.37 2.09 -0.22 0.00 -1.74 0.00 0.00 68.15 68.65 1qez h THR 5110CO 0.03 0.65 -0.52 -0.62 0.37 0.00 0.00 175.52 175.42 1qez s ASP 5111N -7.13 -0.74 0.00 4.18 -1.08 -0.86 -5.01 116.67 106.03 1qez s ASP 5111Ca -0.09 -1.08 0.04 0.00 -0.52 0.00 0.00 52.55 50.90 1qez s ASP 5111Cb 0.08 1.54 0.23 0.00 -1.46 0.00 0.00 42.92 43.31 1qez s ASP 5111CO 0.90 -0.19 0.83 -0.81 0.52 0.00 0.00 175.17 176.42 1qez n PRO 5112N 4.29 0.10 -0.02 4.34 -0.04 -0.51 -2.66 135.00 140.50 1qez n PRO 5112Ca 0.12 0.11 0.12 0.00 -0.04 0.00 0.00 63.50 63.81 1qez n PRO 5112Cb 0.53 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.09 1qez n PRO 5112CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1qez n SER 5113N -1.13 0.81 -0.26 3.54 3.41 -1.26 -3.11 113.62 115.62 1qez n SER 5113Ca 0.03 -1.42 0.04 0.00 -0.26 0.00 0.00 58.87 57.26 1qez n SER 5113Cb 0.02 -0.03 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1qez n SER 5113CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1qez n PHE 5114N -0.31 0.21 0.25 7.33 3.72 -1.09 -4.72 117.46 122.86 1qez n PHE 5114Ca 0.18 -0.64 0.09 0.00 -0.05 0.00 0.00 57.45 57.03 1qez n PHE 5114Cb 0.22 -0.09 0.64 0.00 -0.94 0.00 0.00 39.48 39.30 1qez n PHE 5114CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1qez h SER 5115N 0.68 0.00 1.73 4.37 0.02 -1.74 -2.56 113.55 116.04 1qez h SER 5115Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qez h SER 5115Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 1qez h SER 5115CO 0.02 0.14 -0.10 -0.55 -1.14 0.00 0.00 176.83 175.20 1qez h ASN 5116N 0.00 0.00 -2.10 3.07 -1.07 -1.86 -3.40 115.58 110.22 1qez h ASN 5116Ca -0.00 -0.01 -0.62 0.00 0.07 0.00 0.00 56.30 55.74 1qez h ASN 5116Cb 0.31 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 36.43 1qez h ASN 5116CO 0.02 0.00 0.98 -0.63 0.07 0.00 0.00 177.43 177.88 1qez s ILE 5117N -3.19 4.23 -0.17 6.14 -1.09 -0.97 -4.78 121.20 121.37 1qez s ILE 5117Ca 0.07 -0.70 0.18 0.00 -2.23 0.00 0.00 60.65 57.98 1qez s ILE 5117Cb 0.08 -4.86 -0.27 0.00 -1.58 0.00 0.00 42.46 35.83 1qez s ILE 5117CO 0.66 -1.68 0.46 0.29 -1.23 0.00 0.00 174.94 173.45 1qez n LYS 5118N 7.98 0.66 -3.90 2.79 5.02 -1.26 -4.98 118.16 124.47 1qez n LYS 5118Ca 0.16 -0.14 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 1qez n LYS 5118Cb 0.49 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 1qez n LYS 5118CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1qez s ASP 5119N -3.85 0.10 0.54 4.39 2.15 -1.26 -4.70 116.67 114.03 1qez s ASP 5119Ca -0.04 -0.74 0.33 0.00 0.43 0.00 0.00 52.55 52.53 1qez s ASP 5119Cb 0.12 0.37 1.50 0.00 -0.30 0.00 0.00 42.92 44.62 1qez s ASP 5119CO 0.76 -0.79 1.86 -0.29 -0.17 0.00 0.00 175.17 176.54 1qez h ILE 5120N 2.68 0.50 0.00 4.11 6.09 -0.94 0.23 117.51 130.18 1qez h ILE 5120Ca -0.33 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.16 1qez h ILE 5120Cb 1.21 0.51 0.00 0.00 0.47 0.00 0.00 36.82 39.01 1qez h ILE 5120CO 0.53 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 176.20 1qez n ASN 5121N -4.22 0.00 0.04 2.19 3.02 -1.26 -2.75 115.26 112.29 1qez n ASN 5121Ca 0.20 -0.84 0.12 0.00 -0.03 0.00 0.00 54.58 54.03 1qez n ASN 5121Cb 1.05 -0.04 0.23 0.00 -0.61 0.00 0.00 39.78 40.40 1qez n ASN 5121CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1qez n ASP 5122N -1.04 0.61 -4.76 6.41 8.00 0.81 -4.86 116.55 121.73 1qez n ASP 5122Ca 0.22 0.09 -0.40 0.00 0.71 0.00 0.00 54.79 55.41 1qez n ASP 5122Cb 0.13 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 1qez n ASP 5122CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qez s LEU 5123N -3.88 4.59 0.52 0.64 1.43 -1.11 -4.93 118.68 115.95 1qez s LEU 5123Ca 0.08 1.77 -0.22 0.00 -1.03 0.00 0.00 54.13 54.73 1qez s LEU 5123Cb 0.15 -3.46 -0.06 0.00 0.03 0.00 0.00 46.19 42.85 1qez s LEU 5123CO 0.70 0.14 1.29 -2.65 0.23 0.00 0.00 176.35 176.06 1qez n PRO 5124N 1.82 1.67 -0.34 1.29 -0.02 -1.26 -4.85 135.00 133.31 1qez n PRO 5124Ca -0.03 0.61 0.05 0.00 -2.02 0.00 0.00 63.50 62.11 1qez n PRO 5124Cb 0.48 -2.49 0.20 0.00 -0.02 0.00 0.00 33.50 31.68 1qez n PRO 5124CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1qez h GLN 5125N 1.49 0.94 -0.97 -0.52 5.75 -1.95 -1.36 115.11 118.47 1qez h GLN 5125Ca -0.50 -0.06 0.07 0.00 -0.15 0.00 0.00 58.65 58.01 1qez h GLN 5125Cb 1.31 -0.21 -0.06 0.00 1.07 0.00 0.00 27.48 29.58 1qez h GLN 5125CO 0.57 0.62 0.63 0.00 -2.65 0.00 0.00 178.83 178.00 1qez h ALA 5126N 1.49 1.44 -0.53 3.38 0.00 -1.99 -0.70 119.26 122.36 1qez h ALA 5126Ca 0.45 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.22 1qez h ALA 5126Cb 0.39 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1qez h ALA 5126CO -0.24 0.41 -0.12 1.15 0.00 0.00 0.00 179.25 180.45 1qez h THR 5127N 1.13 1.27 -0.35 0.00 2.02 -1.61 -1.67 112.91 113.70 1qez h THR 5127Ca 0.42 -1.28 -0.04 0.00 0.77 0.00 0.00 66.41 66.28 1qez h THR 5127Cb 0.18 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1qez h THR 5127CO -0.16 0.45 0.05 0.11 0.37 0.00 0.00 175.52 176.34 1qez h LYS 5128N 0.88 0.58 -0.97 6.66 1.57 -1.06 -1.95 116.57 122.28 1qez h LYS 5128Ca 0.13 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1qez h LYS 5128Cb 0.69 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.89 1qez h LYS 5128CO 0.05 0.65 0.63 -0.91 -0.57 0.00 0.00 179.45 179.30 1qez h ASN 5129N 0.41 1.12 -0.18 0.86 2.35 -1.07 -0.49 115.58 118.58 1qez h ASN 5129Ca 0.11 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1qez h ASN 5129Cb 0.36 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1qez h ASN 5129CO 0.01 0.83 0.08 0.50 -1.65 0.00 0.00 177.43 177.20 1qez h LYS 5130N 1.32 0.27 -0.21 0.81 3.64 -1.08 -0.03 116.57 121.28 1qez h LYS 5130Ca 0.35 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 1qez h LYS 5130Cb -0.13 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1qez h LYS 5130CO -0.07 0.32 0.11 0.82 -2.27 0.00 0.00 179.45 178.35 1qez h ILE 5131N 0.16 1.12 -0.09 2.00 2.04 -1.02 -0.33 117.51 121.39 1qez h ILE 5131Ca 0.06 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1qez h ILE 5131Cb 0.14 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1qez h ILE 5131CO -0.01 0.11 0.05 0.58 0.00 0.00 0.00 178.15 178.89 1qez h VAL 5132N 0.22 1.01 -0.89 1.67 2.07 -0.99 -2.30 116.25 117.05 1qez h VAL 5132Ca 0.07 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.60 1qez h VAL 5132Cb 0.08 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 1qez h VAL 5132CO -0.01 0.02 0.58 -0.74 0.02 0.00 0.00 177.57 177.44 1qez h HIS 5133N 0.11 1.06 0.52 1.57 -0.00 -0.85 -2.21 115.15 115.34 1qez h HIS 5133Ca 0.03 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.41 1qez h HIS 5133Cb -0.01 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.05 1qez h HIS 5133CO -0.08 0.59 -0.32 0.35 -0.00 0.00 0.00 177.93 178.48 1qez h PHE 5134N 1.08 -0.84 -0.52 5.26 3.57 -0.53 -2.47 116.94 122.49 1qez h PHE 5134Ca 0.36 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.90 1qez h PHE 5134Cb 0.08 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1qez h PHE 5134CO -0.00 -0.49 0.34 0.74 -2.23 0.00 0.00 178.31 176.67 1qez h PHE 5135N -0.80 0.52 -0.00 0.41 0.04 -1.14 -0.77 116.94 115.20 1qez h PHE 5135Ca -0.06 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1qez h PHE 5135Cb 0.65 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1qez h PHE 5135CO -0.10 0.29 -0.02 0.39 -0.60 0.00 0.00 178.31 178.27 1qez n GLU 5136N -4.47 0.67 0.00 1.51 1.02 -0.86 -4.27 120.64 114.24 1qez n GLU 5136Ca 0.06 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1qez n GLU 5136Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1qez n GLU 5136CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1qez n HIS 5137N -1.10 0.00 0.29 -0.32 8.25 -0.79 -4.76 115.22 116.79 1qez n HIS 5137Ca 0.17 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.81 1qez n HIS 5137Cb 0.22 0.00 0.73 0.00 1.12 0.00 0.00 29.99 32.06 1qez n HIS 5137CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 1qez h TYR 5138N 0.00 0.00 -0.01 4.41 -0.00 -1.35 -3.00 116.97 117.02 1qez h TYR 5138Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1qez h TYR 5138Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1qez h TYR 5138CO 0.00 0.00 -0.42 1.63 -0.00 0.00 0.00 178.16 179.37 1qez n LYS 5139N -3.07 1.84 -0.38 0.10 5.02 -1.26 -4.41 118.16 116.00 1qez n LYS 5139Ca 0.00 -0.58 -0.00 0.00 -2.02 0.00 0.00 58.31 55.71 1qez n LYS 5139Cb 0.28 -1.24 0.05 0.00 -0.02 0.00 0.00 35.03 34.11 1qez n LYS 5139CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1qez n GLU 5140N -0.46 -0.22 0.00 1.97 1.02 -1.14 0.26 120.64 122.07 1qez n GLU 5140Ca 0.05 1.54 0.07 0.00 -0.02 0.00 0.00 57.16 58.80 1qez n GLU 5140Cb 0.30 -2.28 0.35 0.00 -0.02 0.00 0.00 31.44 29.79 1qez n GLU 5140CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1qez n LEU 5141N -5.49 0.00 -4.67 -4.62 4.77 -1.26 -4.62 117.00 101.11 1qez n LEU 5141Ca 0.11 0.23 -0.40 0.00 -0.03 0.00 0.00 56.01 55.92 1qez n LEU 5141Cb 0.41 -0.23 -0.06 0.00 -2.33 0.00 0.00 43.42 41.21 1qez n LEU 5141CO -0.13 -0.13 0.33 -1.61 -1.33 0.00 0.00 177.39 174.52 1qez s GLU 5142N -2.47 4.24 -0.20 3.23 2.02 0.14 -5.00 118.70 120.67 1qez s GLU 5142Ca 0.14 0.59 -0.35 0.00 0.02 0.00 0.00 54.97 55.37 1qez s GLU 5142Cb 0.09 -3.55 -0.12 0.00 0.10 0.00 0.00 34.13 30.65 1qez s GLU 5142CO 0.19 -0.16 1.96 -0.35 0.02 0.00 0.00 175.26 176.93 1qez n PRO 5143N 4.74 1.70 -0.97 0.39 -0.04 -1.26 -2.43 135.00 137.13 1qez n PRO 5143Ca -0.02 0.59 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1qez n PRO 5143Cb 0.50 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 1qez n PRO 5143CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qez n GLY 5144N 4.99 0.67 3.74 0.55 0.00 -1.26 -5.03 105.19 108.85 1qez n GLY 5144Ca 0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.99 1qez n GLY 5144CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qez s LYS 5145N -0.15 2.82 0.03 1.61 0.00 -1.02 -4.82 119.74 118.21 1qez s LYS 5145Ca 0.00 -0.68 -0.28 0.00 0.00 0.00 0.00 55.97 55.01 1qez s LYS 5145Cb 0.00 -2.70 0.10 0.00 0.00 0.00 0.00 37.83 35.23 1qez s LYS 5145CO 0.00 0.58 0.82 1.52 0.00 0.00 0.00 175.35 178.27 1qez s TYR 5146N -1.30 -0.40 -0.06 1.78 -0.85 -1.26 -4.61 117.35 110.64 1qez s TYR 5146Ca 0.26 0.27 -0.05 0.00 -0.52 0.00 0.00 57.07 57.03 1qez s TYR 5146Cb -0.12 0.54 0.02 0.00 0.38 0.00 0.00 41.96 42.78 1qez s TYR 5146CO 0.18 -0.61 0.17 0.08 -1.52 0.00 0.00 175.55 173.85 1qez s VAL 5147N -3.15 -0.01 -0.07 -3.49 1.01 -1.26 -2.72 120.40 110.71 1qez s VAL 5147Ca 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 1qez s VAL 5147Cb -0.01 -0.25 0.03 0.00 0.00 0.00 0.00 36.38 36.15 1qez s VAL 5147CO -0.09 0.01 -0.03 -1.59 0.00 0.00 0.00 175.10 173.40 1qez s LYS 5148N 0.25 0.82 -0.09 2.72 -2.85 0.77 -4.53 119.74 116.83 1qez s LYS 5148Ca -0.01 -0.02 -0.30 0.00 -1.00 0.00 0.00 55.97 54.64 1qez s LYS 5148Cb -0.03 -1.02 -0.02 0.00 -2.06 0.00 0.00 37.83 34.70 1qez s LYS 5148CO -0.01 -0.22 1.07 0.42 0.10 0.00 0.00 175.35 176.71 1qez s ILE 5149N 1.58 4.62 -0.12 3.79 -1.09 -1.26 -0.63 121.20 128.08 1qez s ILE 5149Ca -0.00 1.90 -0.18 0.00 -2.23 0.00 0.00 60.65 60.14 1qez s ILE 5149Cb -0.13 -4.22 -0.16 0.00 -1.58 0.00 0.00 42.46 36.37 1qez s ILE 5149CO -0.04 0.01 0.47 0.28 -1.23 0.00 0.00 174.94 174.43 1qez h SER 5150N 7.20 -0.01 0.00 3.58 0.02 -0.27 -3.48 113.55 120.59 1qez h SER 5150Ca -0.32 -0.59 0.00 0.00 -0.84 0.00 0.00 61.79 60.04 1qez h SER 5150Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1qez h SER 5150CO 0.86 0.79 0.00 0.61 -1.14 0.00 0.00 176.83 177.95 1qez n GLY 5151N 1.65 -1.54 3.80 -3.77 0.00 -1.04 -5.00 105.19 99.28 1qez n GLY 5151Ca -0.06 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 1qez n GLY 5151CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qez s TRP 5152N -2.53 3.07 0.16 1.61 0.52 -1.26 -0.36 118.94 120.14 1qez s TRP 5152Ca 0.00 -0.11 0.06 0.00 0.02 0.00 0.00 56.10 56.08 1qez s TRP 5152Cb 0.00 -1.40 -0.04 0.00 -1.15 0.00 0.00 33.47 30.88 1qez s TRP 5152CO 0.00 0.53 -0.14 0.20 0.02 0.00 0.00 176.95 177.56 1qez s GLY 5153N -3.70 1.24 0.85 0.98 0.00 0.83 -4.93 107.32 102.58 1qez s GLY 5153Ca 0.32 -1.50 -0.13 0.00 0.00 0.00 0.00 44.72 43.42 1qez s GLY 5153CO 0.24 -1.58 1.21 -1.35 0.00 0.00 0.00 173.10 171.62 1qez s SER 5154N -2.97 4.16 0.24 1.64 1.04 -1.26 -2.32 113.70 114.23 1qez s SER 5154Ca 0.17 0.69 -0.06 0.00 0.48 0.00 0.00 55.95 57.22 1qez s SER 5154Cb -0.02 -1.09 0.27 0.00 0.10 0.00 0.00 66.02 65.28 1qez s SER 5154CO 0.04 -2.12 1.90 0.00 0.98 0.00 0.00 173.24 174.05 1qez h ALA 5155N -1.21 1.21 -0.69 5.32 0.00 -1.86 -1.14 119.26 120.89 1qez h ALA 5155Ca -0.46 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.41 1qez h ALA 5155Cb 1.31 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1qez h ALA 5155CO 0.60 0.52 0.46 1.15 0.00 0.00 0.00 179.25 181.98 1qez h THR 5156N 1.21 1.18 0.14 0.00 2.02 -1.92 0.12 112.91 115.65 1qez h THR 5156Ca 0.36 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 67.22 1qez h THR 5156Cb -0.06 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 1qez h THR 5156CO -0.10 0.17 -0.12 -0.08 0.37 0.00 0.00 175.52 175.76 1qez h GLU 5157N 0.94 -0.27 -0.71 6.66 4.81 -1.76 -2.51 114.58 121.74 1qez h GLU 5157Ca 0.25 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.57 1qez h GLU 5157Cb -0.11 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 1qez h GLU 5157CO -0.05 -0.18 0.39 0.00 -0.73 0.00 0.00 179.01 178.44 1qez h ALA 5158N 0.57 0.97 -0.43 2.92 0.00 -0.61 -1.62 119.26 121.06 1qez h ALA 5158Ca 0.00 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1qez h ALA 5158Cb 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1qez h ALA 5158CO -0.02 0.06 0.29 0.87 0.00 0.00 0.00 179.25 180.44 1qez h LYS 5159N 0.71 0.48 -0.06 0.00 6.56 -0.53 -2.01 116.57 121.72 1qez h LYS 5159Ca 0.33 -0.03 -0.03 0.00 -1.06 0.00 0.00 60.65 59.86 1qez h LYS 5159Cb 0.24 -0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 31.79 1qez h LYS 5159CO -0.20 0.32 -0.06 -0.91 -2.06 0.00 0.00 179.45 176.53 1qez h ASN 5160N 0.49 0.15 -0.88 0.86 4.21 -0.88 -2.04 115.58 117.50 1qez h ASN 5160Ca 0.17 -0.50 0.12 0.00 1.21 0.00 0.00 56.30 57.30 1qez h ASN 5160Cb 0.07 -0.04 -0.09 0.00 -1.12 0.00 0.00 38.32 37.14 1qez h ASN 5160CO -0.04 0.63 0.50 -0.09 -1.29 0.00 0.00 177.43 177.14 1qez h ARG 5161N -0.31 0.75 -0.54 0.81 9.65 -1.07 0.28 114.38 123.93 1qez h ARG 5161Ca 0.01 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.75 1qez h ARG 5161Cb 0.59 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.98 1qez h ARG 5161CO 0.02 0.49 -0.04 0.82 2.80 0.00 0.00 179.97 184.06 1qez h ILE 5162N 0.77 1.26 -0.05 1.20 2.04 -1.33 -1.21 117.51 120.19 1qez h ILE 5162Ca 0.45 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1qez h ILE 5162Cb 0.53 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1qez h ILE 5162CO -0.30 0.41 0.03 1.56 0.00 0.00 0.00 178.15 179.85 1qez h GLN 5163N 0.88 0.07 0.17 2.37 1.08 -0.23 -1.21 115.11 118.24 1qez h GLN 5163Ca 0.15 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1qez h GLN 5163Cb 0.57 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1qez h GLN 5163CO 0.03 0.06 -0.08 -0.07 -0.95 0.00 0.00 178.83 177.83 1qez h LEU 5164N 0.06 -0.19 -1.61 1.46 3.38 -1.14 -0.81 115.31 116.45 1qez h LEU 5164Ca 0.02 -0.09 0.22 0.00 0.09 0.00 0.00 57.88 58.13 1qez h LEU 5164Cb 0.01 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 1qez h LEU 5164CO -0.00 -0.03 0.62 0.00 0.09 0.00 0.00 178.44 179.11 1qez h ALA 5165N 0.47 2.36 0.08 1.53 0.00 -1.10 0.48 119.26 123.08 1qez h ALA 5165Ca -0.02 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.70 1qez h ALA 5165Cb 0.27 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.08 1qez h ALA 5165CO 0.04 -0.66 -0.84 0.82 0.00 0.00 0.00 179.25 178.62 1qez h ILE 5166N 0.31 1.42 -0.35 0.00 2.04 -0.84 0.89 117.51 120.97 1qez h ILE 5166Ca 0.47 -2.32 0.03 0.00 1.00 0.00 0.00 64.86 64.04 1qez h ILE 5166Cb 1.34 2.82 -0.03 0.00 -0.74 0.00 0.00 36.82 40.20 1qez h ILE 5166CO -0.15 0.68 0.15 0.11 0.00 0.00 0.00 178.15 178.94 1qez h LYS 5167N -0.09 0.31 -0.93 2.37 1.57 0.42 0.21 116.57 120.43 1qez h LYS 5167Ca -0.13 -0.02 0.25 0.00 -1.87 0.00 0.00 60.65 58.88 1qez h LYS 5167Cb 1.57 -0.07 -0.13 0.00 0.08 0.00 0.00 32.23 33.68 1qez h LYS 5167CO 0.16 0.21 0.42 0.00 -0.57 0.00 0.00 179.45 179.67 1qez h ARG 5168N 0.32 0.35 0.06 3.15 3.08 -1.09 0.41 114.38 120.68 1qez h ARG 5168Ca 0.15 -0.02 -0.18 0.00 0.07 0.00 0.00 59.98 60.00 1qez h ARG 5168Cb 0.09 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1qez h ARG 5168CO -0.13 0.23 -0.92 0.28 -1.07 0.00 0.00 179.97 178.37 1qez h VAL 5169N 0.37 1.28 0.00 2.04 2.07 -1.52 -3.44 116.25 117.04 1qez h VAL 5169Ca 0.61 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1qez h VAL 5169Cb 1.23 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1qez h VAL 5169CO -0.57 0.60 -0.35 -1.20 0.02 0.00 0.00 177.57 176.07 1qez n SER 5170N -4.24 1.06 0.00 0.57 7.64 0.68 -5.12 113.62 114.20 1qez n SER 5170Ca -0.21 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1qez n SER 5170Cb 0.73 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1qez n SER 5170CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64