#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ftk s GLU 1004N 0.00 4.45 -0.08 -3.83 2.02 -1.26 -4.77 118.70 115.22 2ftk s GLU 1004Ca 0.00 0.94 -0.25 0.00 0.02 0.00 0.00 54.97 55.68 2ftk s GLU 1004Cb 0.00 -3.45 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 2ftk s GLU 1004CO 0.00 0.04 0.77 0.15 0.02 0.00 0.00 175.26 176.24 2ftk s LYS 1005N 0.86 4.42 -0.10 1.61 1.02 -1.26 -0.59 119.74 125.70 2ftk s LYS 1005Ca 0.39 0.98 0.00 0.00 0.02 0.00 0.00 55.97 57.37 2ftk s LYS 1005Cb -0.18 -3.48 0.02 0.00 -0.52 0.00 0.00 37.83 33.67 2ftk s LYS 1005CO 0.19 -0.03 -0.10 0.42 -0.92 0.00 0.00 175.35 174.91 2ftk s ILE 1006N 1.11 1.10 -0.22 2.17 1.01 -0.42 -0.27 121.20 125.69 2ftk s ILE 1006Ca 0.40 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 2ftk s ILE 1006Cb -0.18 -1.08 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 2ftk s ILE 1006CO 0.18 0.37 0.21 -0.22 0.00 0.00 0.00 174.94 175.49 2ftk s LEU 1007N 1.37 4.15 -0.26 2.97 2.96 -0.11 -0.88 118.68 128.88 2ftk s LEU 1007Ca -0.01 0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 54.06 2ftk s LEU 1007Cb -0.14 -2.21 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 2ftk s LEU 1007CO -0.05 0.06 0.11 -0.63 -1.32 0.00 0.00 176.35 174.53 2ftk s ILE 1008N 0.93 4.65 -0.25 6.68 -1.09 0.13 -0.12 121.20 132.13 2ftk s ILE 1008Ca 0.11 -0.07 0.01 0.00 -2.23 0.00 0.00 60.65 58.47 2ftk s ILE 1008Cb -0.13 -3.20 0.06 0.00 -1.58 0.00 0.00 42.46 37.61 2ftk s ILE 1008CO 0.04 0.30 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.32 2ftk s VAL 1009N 1.66 1.57 -0.19 2.92 1.01 0.43 -1.08 120.40 126.74 2ftk s VAL 1009Ca 0.07 -1.32 -0.15 0.00 0.00 0.00 0.00 61.98 60.57 2ftk s VAL 1009Cb -0.15 -1.87 0.05 0.00 0.00 0.00 0.00 36.38 34.41 2ftk s VAL 1009CO 0.06 -0.16 0.48 -0.62 0.00 0.00 0.00 175.10 174.87 2ftk s ASP 1010N 1.36 -0.53 0.19 3.32 -1.08 -1.12 -4.40 116.67 114.42 2ftk s ASP 1010Ca -0.04 0.99 -0.07 0.00 -0.52 0.00 0.00 52.55 52.91 2ftk s ASP 1010Cb -0.19 0.97 0.11 0.00 -1.46 0.00 0.00 42.92 42.36 2ftk s ASP 1010CO -0.07 -0.18 1.59 -2.24 0.52 0.00 0.00 175.17 174.79 2ftk h ASP 1011N 5.78 0.88 -2.47 -0.34 2.03 -1.83 -3.40 116.42 117.07 2ftk h ASP 1011Ca -0.29 -0.33 -0.54 0.00 -0.73 0.00 0.00 57.03 55.14 2ftk h ASP 1011Cb 1.18 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 39.44 2ftk h ASP 1011CO 0.21 1.07 1.18 -1.58 -1.03 0.00 0.00 179.24 179.10 2ftk s GLN 1012N -4.62 4.10 0.04 4.15 2.00 -1.26 -4.92 119.66 119.15 2ftk s GLN 1012Ca -0.10 2.37 -0.32 0.00 -2.00 0.00 0.00 55.36 55.31 2ftk s GLN 1012Cb 0.13 -4.09 -0.18 0.00 0.80 0.00 0.00 33.01 29.67 2ftk s GLN 1012CO 0.85 -0.98 1.35 1.03 -0.50 0.00 0.00 175.29 177.04 2ftk h SER 1013N 10.37 -0.90 -1.26 6.67 0.87 -1.99 -3.13 113.55 124.17 2ftk h SER 1013Ca -0.44 0.02 0.38 0.00 -1.23 0.00 0.00 61.79 60.51 2ftk h SER 1013Cb 1.21 0.23 -0.10 0.00 -0.44 0.00 0.00 62.40 63.30 2ftk h SER 1013CO 0.95 -0.56 0.84 1.23 -0.53 0.00 0.00 176.83 178.76 2ftk h GLY 1014N -1.22 0.92 1.41 5.77 0.00 -1.97 0.50 103.07 108.49 2ftk h GLY 1014Ca -0.11 -0.11 -0.14 0.00 0.00 0.00 0.00 47.33 46.97 2ftk h GLY 1014CO 0.18 -0.21 -0.41 -2.22 0.00 0.00 0.00 176.54 173.88 2ftk h ILE 1015N 0.16 1.30 -0.18 2.60 2.04 -1.94 -0.06 117.51 121.43 2ftk h ILE 1015Ca 0.71 -1.59 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 2ftk h ILE 1015Cb 2.28 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 39.88 2ftk h ILE 1015CO -0.27 0.51 -0.01 0.03 0.00 0.00 0.00 178.15 178.40 2ftk h ARG 1016N 0.52 0.32 -0.14 2.37 3.08 0.00 -2.06 114.38 118.47 2ftk h ARG 1016Ca 0.04 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.01 2ftk h ARG 1016Cb 0.93 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 2ftk h ARG 1016CO 0.08 0.55 -0.05 0.82 -1.07 0.00 0.00 179.97 180.30 2ftk h ILE 1017N 0.06 0.81 0.25 2.04 2.04 -1.22 0.83 117.51 122.33 2ftk h ILE 1017Ca 0.05 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 2ftk h ILE 1017Cb 0.42 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 2ftk h ILE 1017CO 0.01 0.00 -0.43 0.25 0.00 0.00 0.00 178.15 177.98 2ftk h LEU 1018N -0.03 -1.25 -1.49 1.44 5.85 -0.92 -0.94 115.31 117.97 2ftk h LEU 1018Ca 0.07 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2ftk h LEU 1018Cb 0.14 0.44 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 2ftk h LEU 1018CO -0.16 -0.51 0.33 -0.07 -0.34 0.00 0.00 178.44 177.68 2ftk h LEU 1019N -0.73 0.58 -0.29 2.25 3.38 -1.31 -2.31 115.31 116.89 2ftk h LEU 1019Ca -0.03 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2ftk h LEU 1019Cb 0.68 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2ftk h LEU 1019CO -0.15 0.43 0.15 -1.13 0.09 0.00 0.00 178.44 177.82 2ftk h ASN 1020N 0.68 0.37 0.20 -0.43 -1.24 -0.40 -0.89 115.58 113.87 2ftk h ASN 1020Ca 0.18 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.09 2ftk h ASN 1020Cb -0.07 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 38.89 2ftk h ASN 1020CO -0.04 0.37 0.00 1.21 -1.29 0.00 0.00 177.43 177.68 2ftk n GLU 1021N -4.81 0.24 -0.10 6.67 2.13 -0.40 -3.05 120.64 121.33 2ftk n GLU 1021Ca -0.02 0.13 -0.17 0.00 0.66 0.00 0.00 57.16 57.76 2ftk n GLU 1021Cb 0.09 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.23 2ftk n GLU 1021CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2ftk n VAL 1022N -1.23 1.49 1.09 6.31 0.31 -0.39 -4.23 118.33 121.69 2ftk n VAL 1022Ca 0.07 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.49 2ftk n VAL 1022Cb 0.10 -2.15 0.53 0.00 -0.91 0.00 0.00 33.84 31.40 2ftk n VAL 1022CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2ftk n PHE 1023N -4.46 0.00 0.01 3.52 3.72 -0.91 -1.71 117.46 117.63 2ftk n PHE 1023Ca -0.27 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.10 2ftk n PHE 1023Cb 0.58 -0.04 -0.10 0.00 -0.94 0.00 0.00 39.48 38.98 2ftk n PHE 1023CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2ftk n ASN 1024N -1.04 0.87 0.13 4.37 5.03 -1.17 -0.87 115.26 122.58 2ftk n ASN 1024Ca 0.13 0.40 0.12 0.00 0.87 0.00 0.00 54.58 56.10 2ftk n ASN 1024Cb 0.07 0.07 0.47 0.00 -1.02 0.00 0.00 39.78 39.38 2ftk n ASN 1024CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2ftk n LYS 1025N -2.95 0.22 -0.50 3.52 5.02 -0.69 -1.55 118.16 121.22 2ftk n LYS 1025Ca -0.12 0.38 0.08 0.00 -2.02 0.00 0.00 58.31 56.63 2ftk n LYS 1025Cb 0.92 -1.87 0.30 0.00 -0.02 0.00 0.00 35.03 34.36 2ftk n LYS 1025CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2ftk n GLU 1026N -2.27 3.44 -3.56 1.97 -0.58 -1.21 -4.97 120.64 113.47 2ftk n GLU 1026Ca 0.03 -2.73 -0.25 0.00 -0.42 0.00 0.00 57.16 53.79 2ftk n GLU 1026Cb 0.28 -1.77 0.06 0.00 -0.57 0.00 0.00 31.44 29.44 2ftk n GLU 1026CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ftk n GLY 1027N 0.65 -0.53 3.91 0.62 0.00 -0.60 -4.99 105.19 104.25 2ftk n GLY 1027Ca 0.22 0.22 -0.24 0.00 0.00 0.00 0.00 46.02 46.22 2ftk n GLY 1027CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ftk s TYR 1028N -3.28 3.37 -0.54 1.61 2.02 -0.05 -3.02 117.35 117.46 2ftk s TYR 1028Ca 0.55 0.03 -0.20 0.00 -0.37 0.00 0.00 57.07 57.08 2ftk s TYR 1028Cb -0.25 -1.58 0.07 0.00 -0.40 0.00 0.00 41.96 39.79 2ftk s TYR 1028CO 0.68 0.50 0.71 -1.14 -1.57 0.00 0.00 175.55 174.73 2ftk s GLN 1029N -3.47 3.13 -0.04 -0.62 0.74 0.24 -4.56 119.66 115.08 2ftk s GLN 1029Ca 0.34 -0.88 -0.17 0.00 0.05 0.00 0.00 55.36 54.69 2ftk s GLN 1029Cb -0.10 -4.13 -0.05 0.00 1.10 0.00 0.00 33.01 29.83 2ftk s GLN 1029CO 0.27 -1.36 0.46 0.95 -0.55 0.00 0.00 175.29 175.06 2ftk s THR 1030N 2.91 5.06 0.11 -0.34 -4.23 -1.26 -1.30 115.64 116.59 2ftk s THR 1030Ca 0.17 0.93 0.07 0.00 -1.18 0.00 0.00 61.69 61.68 2ftk s THR 1030Cb -0.19 -3.78 -0.03 0.00 1.34 0.00 0.00 72.50 69.83 2ftk s THR 1030CO 0.12 0.47 -0.17 -0.36 -0.54 0.00 0.00 174.62 174.14 2ftk s PHE 1031N -0.34 1.51 -0.11 3.99 0.08 -0.06 -4.97 117.98 118.09 2ftk s PHE 1031Ca 0.25 -0.48 -0.10 0.00 0.12 0.00 0.00 56.93 56.72 2ftk s PHE 1031Cb -0.16 -0.81 0.03 0.00 -0.57 0.00 0.00 43.02 41.50 2ftk s PHE 1031CO 0.13 0.16 0.28 1.14 -0.10 0.00 0.00 175.22 176.83 2ftk s GLN 1032N -2.22 0.33 0.03 0.44 -2.07 -1.26 0.17 119.66 115.08 2ftk s GLN 1032Ca 0.06 0.40 0.06 0.00 -1.82 0.00 0.00 55.36 54.05 2ftk s GLN 1032Cb -0.08 0.16 -0.02 0.00 -1.09 0.00 0.00 33.01 31.98 2ftk s GLN 1032CO 0.04 -0.04 -0.17 0.00 -1.32 0.00 0.00 175.29 173.79 2ftk s ALA 1033N 0.15 1.46 -0.75 2.60 0.00 -0.24 -4.95 121.76 120.03 2ftk s ALA 1033Ca -0.00 -0.89 0.22 0.00 0.00 0.00 0.00 51.96 51.29 2ftk s ALA 1033Cb -0.02 -0.29 -0.11 0.00 0.00 0.00 0.00 23.12 22.70 2ftk s ALA 1033CO 0.00 0.32 0.91 0.00 0.00 0.00 0.00 175.76 177.00 2ftk n ALA 1034N 2.09 4.02 -2.89 0.00 0.00 -1.26 -2.77 120.51 119.69 2ftk n ALA 1034Ca -0.17 -0.52 -0.10 0.00 0.00 0.00 0.00 53.44 52.66 2ftk n ALA 1034Cb 0.54 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 2ftk n ALA 1034CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ftk s ASN 1035N -3.46 -0.05 0.03 0.00 2.20 -1.26 -3.81 114.94 108.58 2ftk s ASN 1035Ca 0.05 -0.73 -0.05 0.00 -0.94 0.00 0.00 52.86 51.18 2ftk s ASN 1035Cb 0.15 0.48 -0.01 0.00 -2.00 0.00 0.00 41.25 39.87 2ftk s ASN 1035CO 0.84 -0.94 1.00 0.61 -2.94 0.00 0.00 177.10 175.68 2ftk n GLY 1036N -0.25 -2.77 0.22 0.45 0.00 -1.26 -1.02 105.19 100.57 2ftk n GLY 1036Ca -0.09 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2ftk n GLY 1036CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ftk h LEU 1037N 0.00 -0.10 -1.33 0.99 3.38 -1.98 -0.35 115.31 115.92 2ftk h LEU 1037Ca 0.03 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.18 2ftk h LEU 1037Cb 0.07 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2ftk h LEU 1037CO -0.16 -0.03 0.50 1.56 0.09 0.00 0.00 178.44 180.39 2ftk h GLN 1038N 0.20 0.79 0.56 1.13 4.20 -1.72 -1.79 115.11 118.48 2ftk h GLN 1038Ca 0.30 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.94 2ftk h GLN 1038Cb 0.46 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 28.07 2ftk h GLN 1038CO -0.43 0.53 -0.27 0.00 -0.67 0.00 0.00 178.83 177.99 2ftk h ALA 1039N 1.59 -0.75 -1.03 3.87 0.00 0.44 -2.67 119.26 120.71 2ftk h ALA 1039Ca 0.32 -0.18 0.30 0.00 0.00 0.00 0.00 54.91 55.35 2ftk h ALA 1039Cb 0.22 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2ftk h ALA 1039CO -0.11 -0.72 0.83 -0.07 0.00 0.00 0.00 179.25 179.18 2ftk h LEU 1040N -1.14 0.00 0.10 0.00 3.38 -0.81 0.12 115.31 116.96 2ftk h LEU 1040Ca -0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2ftk h LEU 1040Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2ftk h LEU 1040CO 0.13 0.00 -0.05 0.44 0.09 0.00 0.00 178.44 179.05 2ftk h ASP 1041N 0.00 -0.11 -0.73 -0.43 3.32 -1.30 -2.53 116.42 114.64 2ftk h ASP 1041Ca 0.49 -0.38 0.21 0.00 0.02 0.00 0.00 57.03 57.37 2ftk h ASP 1041Cb 2.15 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 41.70 2ftk h ASP 1041CO -0.01 0.52 0.60 0.40 -1.72 0.00 0.00 179.24 179.04 2ftk h ILE 1042N -0.95 0.46 -0.00 0.35 2.04 -0.51 0.15 117.51 119.05 2ftk h ILE 1042Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2ftk h ILE 1042Cb 0.48 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2ftk h ILE 1042CO 0.02 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.70 2ftk h VAL 1043N 0.00 1.61 0.25 1.67 2.07 -1.00 -2.25 116.25 118.60 2ftk h VAL 1043Ca 0.35 -1.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.00 2ftk h VAL 1043Cb 1.55 2.85 -0.03 0.00 -1.52 0.00 0.00 31.29 34.14 2ftk h VAL 1043CO -0.00 0.49 -0.41 0.74 0.02 0.00 0.00 177.57 178.41 2ftk h THR 1044N -0.72 0.00 0.00 2.57 2.02 -0.34 0.12 112.91 116.56 2ftk h THR 1044Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2ftk h THR 1044Cb 0.83 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2ftk h THR 1044CO 0.01 0.00 0.00 1.17 0.37 0.00 0.00 175.52 177.07 2ftk n LYS 1045N -4.84 0.00 0.33 6.66 4.81 -0.18 -3.94 118.16 121.00 2ftk n LYS 1045Ca -0.08 0.01 0.20 0.00 -0.87 0.00 0.00 58.31 57.57 2ftk n LYS 1045Cb 0.35 -0.91 1.06 0.00 0.02 0.00 0.00 35.03 35.54 2ftk n LYS 1045CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2ftk h GLU 1046N 0.00 0.00 -6.44 1.64 4.39 -1.55 -3.47 114.58 109.15 2ftk h GLU 1046Ca 0.00 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.32 2ftk h GLU 1046Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2ftk h GLU 1046CO 0.00 0.00 -0.88 0.54 -1.16 0.00 0.00 179.01 177.51 2ftk n ARG 1047N -3.09 -1.55 -1.17 2.33 5.12 0.43 -4.90 116.66 113.82 2ftk n ARG 1047Ca -0.02 0.98 -0.30 0.00 -1.93 0.00 0.00 57.85 56.58 2ftk n ARG 1047Cb 0.19 -3.01 0.13 0.00 -1.16 0.00 0.00 32.46 28.61 2ftk n ARG 1047CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2ftk s PRO 1048N -4.33 1.46 -0.15 5.56 0.04 -1.26 -4.96 135.00 131.36 2ftk s PRO 1048Ca 0.04 0.96 -0.14 0.00 0.04 0.00 0.00 61.00 61.90 2ftk s PRO 1048Cb -0.00 -1.82 -0.10 0.00 0.04 0.00 0.00 34.50 32.61 2ftk s PRO 1048CO 0.86 -2.14 0.10 -0.44 0.04 0.00 0.00 177.00 175.43 2ftk h ASP 1049N -1.48 0.00 -4.21 6.66 3.45 -0.98 -3.46 116.42 116.40 2ftk h ASP 1049Ca -0.48 -0.28 -0.69 0.00 0.43 0.00 0.00 57.03 56.00 2ftk h ASP 1049Cb 1.27 0.00 -0.25 0.00 -0.56 0.00 0.00 39.33 39.79 2ftk h ASP 1049CO 0.53 0.94 -0.87 -0.22 -1.57 0.00 0.00 179.24 178.04 2ftk s LEU 1050N -8.20 2.22 -0.06 1.55 2.96 -0.92 -3.51 118.68 112.73 2ftk s LEU 1050Ca -0.16 -0.61 0.02 0.00 -0.22 0.00 0.00 54.13 53.15 2ftk s LEU 1050Cb 0.02 -1.29 0.02 0.00 0.50 0.00 0.00 46.19 45.44 2ftk s LEU 1050CO 0.34 0.24 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.83 2ftk s VAL 1051N -0.86 0.90 -0.42 1.68 1.01 0.31 -0.93 120.40 122.08 2ftk s VAL 1051Ca 0.12 -0.34 -0.14 0.00 0.00 0.00 0.00 61.98 61.63 2ftk s VAL 1051Cb -0.10 -0.85 0.04 0.00 0.00 0.00 0.00 36.38 35.48 2ftk s VAL 1051CO 0.03 0.30 0.30 -0.76 0.00 0.00 0.00 175.10 174.98 2ftk s LEU 1052N 0.74 5.18 0.00 3.92 1.02 0.84 -0.39 118.68 129.98 2ftk s LEU 1052Ca -0.13 -1.09 0.00 0.00 0.02 0.00 0.00 54.13 52.92 2ftk s LEU 1052Cb -0.15 -2.12 0.00 0.00 0.02 0.00 0.00 46.19 43.94 2ftk s LEU 1052CO 0.02 -0.50 0.00 -0.11 0.02 0.00 0.00 176.35 175.78 2ftk n LEU 1053N 5.12 0.00 0.00 1.79 7.94 -0.50 -0.43 117.00 130.92 2ftk n LEU 1053Ca -0.11 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.79 2ftk n LEU 1053Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 2ftk n LEU 1053CO 0.42 -0.05 -0.20 0.23 -1.11 0.00 0.00 177.39 176.68 2ftk n MET 1055N -0.10 0.00 -3.02 1.96 0.00 -1.12 -0.70 117.12 114.13 2ftk n MET 1055Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 57.70 57.26 2ftk n MET 1055Cb 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 33.22 32.60 2ftk n MET 1055CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2ftk s LYS 1056N -1.53 3.43 -0.07 0.03 -0.14 -1.26 -1.19 119.74 119.01 2ftk s LYS 1056Ca 0.00 -1.67 0.04 0.00 -1.36 0.00 0.00 55.97 52.98 2ftk s LYS 1056Cb 0.00 -4.62 -0.00 0.00 -1.68 0.00 0.00 37.83 31.53 2ftk s LYS 1056CO 0.00 -1.65 -0.19 0.42 -0.76 0.00 0.00 175.35 173.16 2ftk s ILE 1057N 2.44 1.65 0.15 2.17 1.01 -1.26 -4.67 121.20 122.70 2ftk s ILE 1057Ca 0.25 -0.81 -0.31 0.00 0.00 0.00 0.00 60.65 59.78 2ftk s ILE 1057Cb -0.11 -1.43 -0.08 0.00 0.01 0.00 0.00 42.46 40.85 2ftk s ILE 1057CO -0.04 0.47 1.35 -2.16 0.00 0.00 0.00 174.94 174.56 2ftk s PRO 1058N 0.21 4.35 0.00 2.79 0.04 -1.26 -3.83 135.00 137.31 2ftk s PRO 1058Ca -0.10 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2ftk s PRO 1058Cb -0.15 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.17 2ftk s PRO 1058CO 0.05 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.15 2ftk n GLY 1059N 2.93 2.17 2.73 0.56 0.00 -1.26 -4.88 105.19 107.45 2ftk n GLY 1059Ca 0.09 -0.69 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 2ftk n GLY 1059CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ftk s MET 1060N 0.00 0.60 0.69 1.61 -2.45 -1.25 -5.10 119.30 113.40 2ftk s MET 1060Ca 0.00 -0.28 -0.11 0.00 -1.25 0.00 0.00 55.69 54.05 2ftk s MET 1060Cb 0.00 -1.84 0.00 0.00 1.25 0.00 0.00 34.83 34.24 2ftk s MET 1060CO 0.00 -0.57 1.08 0.16 1.05 0.00 0.00 175.02 176.74 2ftk s ASP 1061N 1.90 5.56 0.26 1.11 1.47 -1.25 -4.40 116.67 121.33 2ftk s ASP 1061Ca 0.01 1.26 -0.05 0.00 1.18 0.00 0.00 52.55 54.95 2ftk s ASP 1061Cb -0.16 -2.13 0.51 0.00 -0.34 0.00 0.00 42.92 40.80 2ftk s ASP 1061CO -0.07 -1.28 1.62 1.23 0.68 0.00 0.00 175.17 177.35 2ftk h GLY 1062N -0.61 0.95 0.77 2.12 0.00 -1.47 0.31 103.07 105.14 2ftk h GLY 1062Ca -0.45 0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.04 2ftk h GLY 1062CO 0.62 -0.33 0.46 -2.22 0.00 0.00 0.00 176.54 175.07 2ftk h ILE 1063N 0.10 1.04 -0.33 2.60 1.08 -1.94 1.24 117.51 121.30 2ftk h ILE 1063Ca 0.46 -0.30 -0.05 0.00 -0.39 0.00 0.00 64.86 64.58 2ftk h ILE 1063Cb 0.84 0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 34.68 2ftk h ILE 1063CO -0.72 0.16 0.02 -0.08 -0.69 0.00 0.00 178.15 176.84 2ftk h GLU 1064N 0.87 0.58 -0.01 2.37 4.57 -1.36 -0.98 114.58 120.61 2ftk h GLU 1064Ca 0.32 -0.17 -0.17 0.00 -1.18 0.00 0.00 59.36 58.16 2ftk h GLU 1064Cb 0.12 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 2ftk h GLU 1064CO -0.15 0.68 -0.77 0.97 -1.18 0.00 0.00 179.01 178.56 2ftk h ILE 1065N 0.39 1.51 -0.38 2.32 2.10 -0.56 -2.48 117.51 120.42 2ftk h ILE 1065Ca 0.10 -2.53 -0.07 0.00 1.08 0.00 0.00 64.86 63.44 2ftk h ILE 1065Cb 0.41 2.37 -0.02 0.00 -1.09 0.00 0.00 36.82 38.49 2ftk h ILE 1065CO 0.01 0.73 -0.06 0.25 -1.08 0.00 0.00 178.15 178.00 2ftk h LEU 1066N 0.05 0.61 -0.63 2.19 7.12 0.17 0.19 115.31 125.00 2ftk h LEU 1066Ca -0.02 -0.15 -0.09 0.00 0.13 0.00 0.00 57.88 57.76 2ftk h LEU 1066Cb 1.35 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 41.30 2ftk h LEU 1066CO 0.11 0.72 0.06 0.50 -0.13 0.00 0.00 178.44 179.70 2ftk h LYS 1067N 0.59 1.07 -0.07 1.25 3.64 -1.05 -2.77 116.57 119.24 2ftk h LYS 1067Ca 0.11 -0.31 -0.25 0.00 -1.27 0.00 0.00 60.65 58.93 2ftk h LYS 1067Cb 0.47 -0.11 0.02 0.00 -0.41 0.00 0.00 32.23 32.19 2ftk h LYS 1067CO 0.02 1.01 -0.93 0.00 -2.27 0.00 0.00 179.45 177.29 2ftk h ARG 1068N 0.98 0.74 -0.49 1.90 3.08 -0.91 -3.11 114.38 116.58 2ftk h ARG 1068Ca 0.19 -0.71 0.03 0.00 0.07 0.00 0.00 59.98 59.56 2ftk h ARG 1068Cb 0.49 0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 2ftk h ARG 1068CO 0.02 1.29 0.32 0.52 -1.07 0.00 0.00 179.97 181.06 2ftk h MET 1069N 0.46 0.54 -0.71 0.04 2.86 -0.61 -0.74 114.93 116.77 2ftk h MET 1069Ca -0.10 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.47 2ftk h MET 1069Cb 1.57 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 33.08 2ftk h MET 1069CO 0.19 0.35 0.26 0.87 1.06 0.00 0.00 176.91 179.64 2ftk h LYS 1070N 0.55 1.06 -0.93 1.72 1.79 -1.43 -0.95 116.57 118.39 2ftk h LYS 1070Ca 0.20 -0.19 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2ftk h LYS 1070Cb 0.10 -0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.53 2ftk h LYS 1070CO -0.05 0.88 0.54 0.28 -1.08 0.00 0.00 179.45 180.02 2ftk h VAL 1071N 1.04 1.26 0.46 0.50 2.07 -1.09 -2.38 116.25 118.10 2ftk h VAL 1071Ca 0.24 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2ftk h VAL 1071Cb 0.23 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2ftk h VAL 1071CO -0.02 0.28 -0.22 0.40 0.02 0.00 0.00 177.57 178.03 2ftk h ILE 1072N 1.29 0.00 -3.24 4.57 2.04 -1.12 -3.42 117.51 117.63 2ftk h ILE 1072Ca 0.33 -0.34 -0.61 0.00 1.00 0.00 0.00 64.86 65.24 2ftk h ILE 1072Cb -0.03 0.00 -0.40 0.00 -0.74 0.00 0.00 36.82 35.65 2ftk h ILE 1072CO -0.06 0.00 -0.73 -0.62 0.00 0.00 0.00 178.15 176.74 2ftk s ASP 1073N -4.19 4.09 0.55 1.72 2.15 -0.40 -4.99 116.67 115.60 2ftk s ASP 1073Ca -0.09 -2.21 0.33 0.00 0.43 0.00 0.00 52.55 51.01 2ftk s ASP 1073Cb 0.01 -1.16 1.50 0.00 -0.30 0.00 0.00 42.92 42.96 2ftk s ASP 1073CO 0.27 -0.34 1.83 -0.33 -0.17 0.00 0.00 175.17 176.43 2ftk h GLU 1074N 7.38 0.00 -1.11 4.34 5.08 -1.66 0.05 114.58 128.66 2ftk h GLU 1074Ca -0.07 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.88 2ftk h GLU 1074Cb 0.97 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.01 2ftk h GLU 1074CO 0.51 0.00 0.52 0.09 -1.00 0.00 0.00 179.01 179.13 2ftk n ASN 1075N -4.12 4.81 -4.68 1.42 5.03 -1.26 -4.94 115.26 111.51 2ftk n ASN 1075Ca 0.20 -3.22 -0.43 0.00 0.87 0.00 0.00 54.58 52.01 2ftk n ASN 1075Cb 1.07 -0.84 -0.02 0.00 -1.02 0.00 0.00 39.78 38.96 2ftk n ASN 1075CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2ftk s ILE 1076N -2.71 4.45 -0.41 2.41 1.10 0.00 -4.98 121.20 121.05 2ftk s ILE 1076Ca 0.42 1.75 -0.24 0.00 -0.51 0.00 0.00 60.65 62.07 2ftk s ILE 1076Cb 0.35 -4.12 0.02 0.00 0.15 0.00 0.00 42.46 38.85 2ftk s ILE 1076CO 0.05 -0.04 0.85 -0.13 -2.11 0.00 0.00 174.94 173.56 2ftk s ARG 1077N 2.44 3.63 -0.12 3.50 0.52 -1.23 -4.95 118.95 122.74 2ftk s ARG 1077Ca 0.52 0.23 0.03 0.00 -0.52 0.00 0.00 55.73 56.00 2ftk s ARG 1077Cb -0.21 -3.87 0.01 0.00 0.52 0.00 0.00 34.95 31.39 2ftk s ARG 1077CO 0.18 -1.03 -0.22 0.08 0.02 0.00 0.00 175.30 174.33 2ftk s VAL 1078N 3.40 1.96 -0.28 3.52 1.01 -1.26 -0.53 120.40 128.22 2ftk s VAL 1078Ca 0.34 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 2ftk s VAL 1078Cb -0.12 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.56 2ftk s VAL 1078CO 0.21 0.53 0.02 -0.63 0.00 0.00 0.00 175.10 175.23 2ftk s ILE 1079N 0.62 3.44 0.27 2.22 1.01 0.47 -0.85 121.20 128.38 2ftk s ILE 1079Ca -0.12 -0.89 -0.10 0.00 0.00 0.00 0.00 60.65 59.54 2ftk s ILE 1079Cb -0.17 -2.78 -0.07 0.00 0.01 0.00 0.00 42.46 39.45 2ftk s ILE 1079CO 0.03 0.11 0.59 0.27 0.00 0.00 0.00 174.94 175.94 2ftk s ILE 1080N 1.41 4.91 -0.01 2.92 -4.36 -0.95 -1.41 121.20 123.70 2ftk s ILE 1080Ca 0.01 0.47 0.02 0.00 -0.26 0.00 0.00 60.65 60.89 2ftk s ILE 1080Cb -0.17 -3.65 -0.00 0.00 1.25 0.00 0.00 42.46 39.89 2ftk s ILE 1080CO -0.01 -0.17 -0.07 0.00 0.24 0.00 0.00 174.94 174.94 2ftk s MET 1081N -3.05 0.65 0.16 0.37 0.23 0.12 -1.16 119.30 116.63 2ftk s MET 1081Ca 0.48 -0.25 -0.14 0.00 -1.03 0.00 0.00 55.69 54.75 2ftk s MET 1081Cb -0.11 -0.63 0.05 0.00 -1.53 0.00 0.00 34.83 32.61 2ftk s MET 1081CO 0.23 0.13 0.70 -2.37 -2.03 0.00 0.00 175.02 171.68 2ftk n THR 1082N 3.05 0.00 -3.15 3.16 5.66 -0.27 -2.81 114.28 119.92 2ftk n THR 1082Ca -0.15 -0.47 -0.31 0.00 -3.05 0.00 0.00 64.05 60.07 2ftk n THR 1082Cb 0.56 0.58 -0.05 0.00 -1.55 0.00 0.00 70.33 69.88 2ftk n THR 1082CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2ftk s ALA 1083N -1.74 3.42 0.57 1.79 0.00 -1.26 0.55 121.76 125.07 2ftk s ALA 1083Ca 0.15 -0.15 -0.20 0.00 0.00 0.00 0.00 51.96 51.75 2ftk s ALA 1083Cb -0.02 -2.63 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 2ftk s ALA 1083CO 0.05 0.28 1.21 0.98 0.00 0.00 0.00 175.76 178.27 2ftk n TYR 1084N -0.61 1.73 -0.56 0.00 9.36 -1.26 -3.56 117.16 122.27 2ftk n TYR 1084Ca 0.02 0.44 0.00 0.00 3.32 0.00 0.00 57.90 61.68 2ftk n TYR 1084Cb 0.53 -2.27 0.00 0.00 -0.63 0.00 0.00 39.34 36.97 2ftk n TYR 1084CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2ftk n GLY 1085N 0.97 1.18 2.52 2.98 0.00 -1.26 -4.96 105.19 106.62 2ftk n GLY 1085Ca 0.12 -0.34 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 2ftk n GLY 1085CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ftk n GLU 1086N -1.52 2.60 -0.08 1.61 4.07 -1.23 -4.88 120.64 121.20 2ftk n GLU 1086Ca 0.00 -4.01 0.18 0.00 -0.06 0.00 0.00 57.16 53.27 2ftk n GLU 1086Cb 0.11 -1.89 0.61 0.00 -0.06 0.00 0.00 31.44 30.21 2ftk n GLU 1086CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2ftk h LEU 1087N 2.69 0.18 0.12 4.31 4.07 -1.92 -1.30 115.31 123.45 2ftk h LEU 1087Ca 0.15 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 2ftk h LEU 1087Cb 1.08 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.79 2ftk h LEU 1087CO 0.69 0.09 -0.06 0.44 -1.08 0.00 0.00 178.44 178.53 2ftk h ASP 1088N 0.19 -0.13 -0.95 -0.43 3.32 -1.99 -2.06 116.42 114.36 2ftk h ASP 1088Ca 0.31 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.48 2ftk h ASP 1088Cb 0.96 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 40.47 2ftk h ASP 1088CO -0.05 -0.08 0.61 0.24 -1.72 0.00 0.00 179.24 178.23 2ftk h MET 1089N -0.19 0.91 -0.94 3.56 2.86 -1.96 0.14 114.93 119.32 2ftk h MET 1089Ca -0.02 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2ftk h MET 1089Cb 0.12 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 2ftk h MET 1089CO 0.03 0.60 0.62 0.82 1.06 0.00 0.00 176.91 180.04 2ftk h ILE 1090N 0.93 1.24 -0.07 -1.22 2.04 -1.29 0.29 117.51 119.43 2ftk h ILE 1090Ca 0.46 -0.43 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 2ftk h ILE 1090Cb 0.47 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 2ftk h ILE 1090CO -0.22 0.23 -0.15 -0.61 0.00 0.00 0.00 178.15 177.41 2ftk h GLN 1091N 1.27 0.23 -0.62 2.37 5.75 -0.39 -2.80 115.11 120.91 2ftk h GLN 1091Ca 0.35 -0.15 0.05 0.00 -0.15 0.00 0.00 58.65 58.75 2ftk h GLN 1091Cb -0.14 0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.38 2ftk h GLN 1091CO -0.08 0.73 0.35 1.49 -2.65 0.00 0.00 178.83 178.68 2ftk h GLU 1092N -0.25 0.64 0.00 1.69 4.22 -0.42 -1.30 114.58 119.17 2ftk h GLU 1092Ca 0.00 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.36 2ftk h GLU 1092Cb 0.73 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2ftk h GLU 1092CO 0.03 0.42 -0.19 0.66 -2.18 0.00 0.00 179.01 177.75 2ftk h SER 1093N 0.66 0.00 -0.17 1.04 4.64 -0.46 -0.75 113.55 118.50 2ftk h SER 1093Ca 0.27 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.44 2ftk h SER 1093Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2ftk h SER 1093CO -0.16 0.19 -0.48 0.50 -0.87 0.00 0.00 176.83 176.01 2ftk h LYS 1094N 0.00 0.63 0.00 4.77 1.63 -0.98 -0.23 116.57 122.39 2ftk h LYS 1094Ca -0.00 -0.45 -0.08 0.00 -0.85 0.00 0.00 60.65 59.27 2ftk h LYS 1094Cb 0.40 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2ftk h LYS 1094CO 0.02 1.07 -0.38 0.93 -3.45 0.00 0.00 179.45 177.65 2ftk h GLU 1095N 0.31 0.00 0.00 1.90 5.08 -0.80 -2.55 114.58 118.52 2ftk h GLU 1095Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ftk h GLU 1095Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2ftk h GLU 1095CO 0.10 0.38 0.00 1.28 -1.00 0.00 0.00 179.01 179.77 2ftk n LEU 1096N -4.07 0.00 0.00 1.33 4.77 -0.34 -4.90 117.00 113.79 2ftk n LEU 1096Ca -0.02 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 2ftk n LEU 1096Cb 0.41 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2ftk n LEU 1096CO 0.39 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2ftk n GLY 1097N 1.37 1.04 3.70 -0.72 0.00 -0.96 -5.03 105.19 104.59 2ftk n GLY 1097Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2ftk n GLY 1097CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ftk s ALA 1098N -2.00 3.59 0.08 4.61 0.00 -0.12 -4.55 121.76 123.37 2ftk s ALA 1098Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.17 2ftk s ALA 1098Cb 0.00 -2.43 -0.08 0.00 0.00 0.00 0.00 23.12 20.61 2ftk s ALA 1098CO 0.00 -0.06 1.36 -0.07 0.00 0.00 0.00 175.76 176.99 2ftk h LEU 1099N 7.09 -1.14 0.00 0.00 4.07 -1.32 -3.43 115.31 120.58 2ftk h LEU 1099Ca -0.39 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.71 2ftk h LEU 1099Cb 1.16 0.45 0.00 0.00 1.08 0.00 0.00 40.66 43.35 2ftk h LEU 1099CO 0.73 -0.31 0.00 1.07 -1.08 0.00 0.00 178.44 178.85 2ftk n THR 1100N -4.44 0.00 -3.64 0.22 5.66 -1.25 -5.07 114.28 105.76 2ftk n THR 1100Ca -0.04 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.84 2ftk n THR 1100Cb 0.24 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.97 2ftk n THR 1100CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 2ftk s HIS 1101N -3.51 -0.26 -0.05 1.09 -3.43 -1.26 -2.24 115.29 105.63 2ftk s HIS 1101Ca 0.00 0.11 0.01 0.00 -0.80 0.00 0.00 55.06 54.38 2ftk s HIS 1101Cb 0.00 0.26 0.02 0.00 -1.43 0.00 0.00 32.58 31.43 2ftk s HIS 1101CO 0.00 -0.64 -0.06 -0.06 -2.00 0.00 0.00 174.74 171.98 2ftk s PHE 1102N -3.05 0.93 -0.10 0.38 0.08 -0.30 -4.97 117.98 110.94 2ftk s PHE 1102Ca -0.02 -0.30 -0.20 0.00 0.12 0.00 0.00 56.93 56.53 2ftk s PHE 1102Cb 0.00 -0.79 -0.04 0.00 -0.57 0.00 0.00 43.02 41.63 2ftk s PHE 1102CO -0.07 -0.24 0.55 0.00 -0.10 0.00 0.00 175.22 175.37 2ftk s ALA 1103N 0.98 3.43 0.34 5.36 0.00 -1.25 -1.12 121.76 129.51 2ftk s ALA 1103Ca -0.10 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.51 2ftk s ALA 1103Cb -0.14 -2.75 -0.09 0.00 0.00 0.00 0.00 23.12 20.13 2ftk s ALA 1103CO -0.00 -0.04 1.07 0.15 0.00 0.00 0.00 175.76 176.94 2ftk s LYS 1104N 0.70 4.41 -0.45 0.00 1.02 0.19 -2.54 119.74 123.07 2ftk s LYS 1104Ca 0.30 1.65 -0.23 0.00 0.02 0.00 0.00 55.97 57.70 2ftk s LYS 1104Cb -0.16 -2.87 0.03 0.00 -0.52 0.00 0.00 37.83 34.31 2ftk s LYS 1104CO 0.13 0.04 0.77 -1.25 -0.92 0.00 0.00 175.35 174.13 2ftk s PRO 1105N -1.96 3.40 0.72 -1.68 0.04 -1.26 -4.35 135.00 129.90 2ftk s PRO 1105Ca 0.51 -0.13 -0.11 0.00 0.04 0.00 0.00 61.00 61.31 2ftk s PRO 1105Cb -0.27 -3.94 0.02 0.00 0.04 0.00 0.00 34.50 30.35 2ftk s PRO 1105CO 0.34 -1.11 1.09 -0.59 0.04 0.00 0.00 177.00 176.77 2ftk s PHE 1106N 3.25 3.24 -0.24 0.56 -0.12 -1.05 -5.00 117.98 118.62 2ftk s PHE 1106Ca 0.29 1.11 -0.29 0.00 -0.05 0.00 0.00 56.93 57.99 2ftk s PHE 1106Cb -0.12 -3.04 0.00 0.00 -0.63 0.00 0.00 43.02 39.23 2ftk s PHE 1106CO 0.22 -1.26 1.16 -0.51 -0.05 0.00 0.00 175.22 174.78 2ftk s ASP 1107N -4.22 6.94 0.49 1.98 1.01 -1.26 -4.86 116.67 116.74 2ftk s ASP 1107Ca 0.58 1.37 0.15 0.00 0.71 0.00 0.00 52.55 55.36 2ftk s ASP 1107Cb -0.12 -2.54 0.82 0.00 1.01 0.00 0.00 42.92 42.09 2ftk s ASP 1107CO 0.53 -0.82 1.39 -0.29 0.21 0.00 0.00 175.17 176.19 2ftk h ILE 1108N 5.62 0.00 0.00 0.77 6.09 -2.01 -2.44 117.51 125.53 2ftk h ILE 1108Ca -0.23 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 2ftk h ILE 1108Cb 1.08 0.34 0.00 0.00 0.47 0.00 0.00 36.82 38.70 2ftk h ILE 1108CO 1.00 0.00 -0.06 0.44 -3.07 0.00 0.00 178.15 176.46 2ftk h ASP 1109N 0.00 0.00 0.00 2.19 3.32 -2.00 -3.31 116.42 116.61 2ftk h ASP 1109Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ftk h ASP 1109Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2ftk h ASP 1109CO 0.00 0.29 0.10 1.05 -1.72 0.00 0.00 179.24 178.96 2ftk h GLU 1110N -0.52 0.00 -0.16 3.56 4.11 -1.86 -0.69 114.58 119.03 2ftk h GLU 1110Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.28 2ftk h GLU 1110Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2ftk h GLU 1110CO 0.00 0.00 -0.48 0.97 0.07 0.00 0.00 179.01 179.57 2ftk h ILE 1111N 0.00 1.34 0.00 -1.06 -0.00 -1.66 -1.99 117.51 114.13 2ftk h ILE 1111Ca 0.00 -1.75 -0.02 0.00 -0.00 0.00 0.00 64.86 63.09 2ftk h ILE 1111Cb 0.19 2.01 -0.00 0.00 -0.00 0.00 0.00 36.82 39.02 2ftk h ILE 1111CO 0.00 0.54 -0.10 -0.09 -0.00 0.00 0.00 178.15 178.50 2ftk h ARG 1112N 0.26 0.00 0.04 2.19 2.43 -1.22 -2.36 114.38 115.72 2ftk h ARG 1112Ca -0.02 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 2ftk h ARG 1112Cb 1.11 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2ftk h ARG 1112CO 0.10 0.10 -0.43 -0.44 -1.51 0.00 0.00 179.97 177.80 2ftk h ASP 1113N 0.00 0.12 -0.23 -3.80 3.32 -1.33 -2.79 116.42 111.72 2ftk h ASP 1113Ca -0.00 -0.92 0.07 0.00 0.02 0.00 0.00 57.03 56.20 2ftk h ASP 1113Cb 0.31 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2ftk h ASP 1113CO 0.01 1.19 0.25 0.00 -1.72 0.00 0.00 179.24 178.97 2ftk h ALA 1114N -0.05 1.87 0.04 3.45 0.00 -1.10 1.24 119.26 124.71 2ftk h ALA 1114Ca -0.09 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2ftk h ALA 1114Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2ftk h ALA 1114CO 0.01 -0.37 -0.26 -0.39 0.00 0.00 0.00 179.25 178.24 2ftk h VAL 1115N 0.00 1.69 -0.49 0.00 -1.51 -1.50 -2.29 116.25 112.15 2ftk h VAL 1115Ca 0.11 -2.40 0.02 0.00 -1.23 0.00 0.00 66.70 63.20 2ftk h VAL 1115Cb 0.61 3.31 -0.03 0.00 -2.13 0.00 0.00 31.29 33.06 2ftk h VAL 1115CO -0.00 0.63 0.33 0.11 -1.23 0.00 0.00 177.57 177.41 2ftk h LYS 1116N -0.83 0.60 0.00 5.19 1.57 -0.70 -0.05 116.57 122.35 2ftk h LYS 1116Ca -0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2ftk h LYS 1116Cb 1.19 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2ftk h LYS 1116CO 0.04 0.40 0.00 1.17 -0.57 0.00 0.00 179.45 180.48 2ftk n LYS 1117N -4.47 0.00 0.00 3.15 4.81 0.41 -3.30 118.16 118.76 2ftk n LYS 1117Ca 0.05 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 2ftk n LYS 1117Cb 0.10 -1.06 0.00 0.00 0.02 0.00 0.00 35.03 34.09 2ftk n LYS 1117CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2ftk n TYR 1118N -0.84 0.00 -3.88 5.64 4.01 -0.86 -4.44 117.16 116.78 2ftk n TYR 1118Ca 0.00 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.38 2ftk n TYR 1118Cb 0.00 -0.26 -0.12 0.00 -0.31 0.00 0.00 39.34 38.65 2ftk n TYR 1118CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2ftk s LEU 1119N -2.48 3.40 0.00 7.72 2.96 -0.04 -5.05 118.68 125.20 2ftk s LEU 1119Ca 0.00 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.73 2ftk s LEU 1119Cb 0.00 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.80 2ftk s LEU 1119CO 0.00 0.02 0.00 -2.65 -1.32 0.00 0.00 176.35 172.40 2ftk n PRO 1120N 4.57 0.00 0.00 0.98 -0.02 -1.26 -4.80 135.00 134.47 2ftk n PRO 1120Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2ftk n PRO 1120Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2ftk n PRO 1120CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95