#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ywk s GLN 999 N 0.00 0.29 -0.11 3.23 -0.44 -1.26 -3.18 119.66 118.19 1ywk s GLN 999 Ca 0.00 0.87 -0.07 0.00 -2.50 0.00 0.00 55.36 53.66 1ywk s GLN 999 Cb 0.00 0.12 0.04 0.00 -1.64 0.00 0.00 33.01 31.54 1ywk s GLN 999 CO 0.00 -0.23 0.27 1.21 0.50 0.00 0.00 175.29 177.04 1ywk s ASN 1000N 2.17 -0.29 -0.24 6.67 3.84 -0.76 -4.99 114.94 121.33 1ywk s ASN 1000Ca -0.03 0.56 -0.01 0.00 0.21 0.00 0.00 52.86 53.59 1ywk s ASN 1000Cb -0.11 0.47 0.07 0.00 -0.55 0.00 0.00 41.25 41.14 1ywk s ASN 1000CO -0.11 -0.15 0.03 -0.32 -2.79 0.00 0.00 177.10 173.75 1ywk s MET 1001N 1.03 1.00 -0.18 0.43 -2.45 -1.25 0.03 119.30 117.91 1ywk s MET 1001Ca -0.07 -0.83 -0.22 0.00 -1.25 0.00 0.00 55.69 53.32 1ywk s MET 1001Cb -0.08 -2.27 -0.02 0.00 1.25 0.00 0.00 34.83 33.71 1ywk s MET 1001CO -0.07 -0.74 0.67 -2.00 1.05 0.00 0.00 175.02 173.93 1ywk s GLU 1002N 1.61 4.25 0.26 4.11 2.12 -0.10 -4.78 118.70 126.18 1ywk s GLU 1002Ca 0.01 0.71 -0.11 0.00 0.36 0.00 0.00 54.97 55.94 1ywk s GLU 1002Cb -0.18 -3.56 -0.08 0.00 0.26 0.00 0.00 34.13 30.58 1ywk s GLU 1002CO -0.12 -0.21 0.60 0.95 -0.54 0.00 0.00 175.26 175.94 1ywk s THR 1003N 1.80 4.86 -0.06 -1.70 -4.23 -1.26 -0.58 115.64 114.48 1ywk s THR 1003Ca 0.31 0.60 -0.01 0.00 -1.18 0.00 0.00 61.69 61.41 1ywk s THR 1003Cb -0.16 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.09 1ywk s THR 1003CO 0.11 -0.11 0.01 -0.13 -0.54 0.00 0.00 174.62 173.97 1ywk s ARG 1004N -2.87 0.44 0.66 3.99 0.52 0.14 -4.87 118.95 116.96 1ywk s ARG 1004Ca 0.49 0.13 -0.14 0.00 -0.52 0.00 0.00 55.73 55.70 1ywk s ARG 1004Cb -0.11 -0.78 -0.00 0.00 0.52 0.00 0.00 34.95 34.57 1ywk s ARG 1004CO 0.20 -0.26 1.07 0.71 0.02 0.00 0.00 175.30 177.05 1ywk s TYR 1005N 1.74 2.88 0.40 -0.53 1.51 -1.26 -1.81 117.35 120.27 1ywk s TYR 1005Ca 0.01 1.50 0.04 0.00 -1.01 0.00 0.00 57.07 57.62 1ywk s TYR 1005Cb -0.13 -3.02 -0.00 0.00 -0.11 0.00 0.00 41.96 38.71 1ywk s TYR 1005CO -0.04 -1.36 0.57 0.95 -1.11 0.00 0.00 175.55 174.56 1ywk s THR 1006N -2.64 3.79 0.12 -0.71 -4.23 -1.26 -4.84 115.64 105.88 1ywk s THR 1006Ca 0.63 -0.82 0.02 0.00 -1.18 0.00 0.00 61.69 60.33 1ywk s THR 1006Cb -0.17 -3.34 -0.01 0.00 1.34 0.00 0.00 72.50 70.33 1ywk s THR 1006CO 0.45 -0.17 0.06 1.41 -0.54 0.00 0.00 174.62 175.82 1ywk n HIS 1007N -1.86 -0.03 -4.35 3.99 -0.00 -1.26 -5.09 115.22 106.62 1ywk n HIS 1007Ca 0.02 -0.85 -0.26 0.00 -0.00 0.00 0.00 57.72 56.62 1ywk n HIS 1007Cb 0.58 0.02 -0.10 0.00 -0.00 0.00 0.00 29.99 30.49 1ywk n HIS 1007CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1ywk s SER 1008N -1.79 3.94 0.62 0.41 1.04 -1.26 -4.99 113.70 111.67 1ywk s SER 1008Ca 0.08 -0.72 0.27 0.00 0.48 0.00 0.00 55.95 56.06 1ywk s SER 1008Cb 0.00 -0.54 1.41 0.00 0.10 0.00 0.00 66.02 66.99 1ywk s SER 1008CO 0.06 0.10 1.81 1.55 0.98 0.00 0.00 173.24 177.74 1ywk h PRO 1009N 2.88 0.00 0.21 4.02 0.13 -1.99 0.13 132.00 137.37 1ywk h PRO 1009Ca -0.46 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.37 1ywk h PRO 1009Cb 1.21 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.37 1ywk h PRO 1009CO 0.53 0.00 -1.39 0.00 -0.23 0.00 0.00 178.00 176.91 1ywk h ALA 1010N 1.26 -0.05 -0.98 -0.56 0.00 -2.00 -2.67 119.26 114.27 1ywk h ALA 1010Ca 0.13 -0.91 0.11 0.00 0.00 0.00 0.00 54.91 54.25 1ywk h ALA 1010Cb 1.13 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 1ywk h ALA 1010CO -0.00 0.70 0.61 -0.44 0.00 0.00 0.00 179.25 180.13 1ywk h ASP 1011N -0.01 0.91 1.12 0.00 3.32 -1.15 -1.75 116.42 118.86 1ywk h ASP 1011Ca -0.26 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.84 1ywk h ASP 1011Cb 2.01 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 41.42 1ywk h ASP 1011CO 0.21 0.51 -0.21 0.00 -1.72 0.00 0.00 179.24 178.02 1ywk n ILE 1012N -4.62 0.35 -0.32 0.35 3.06 -0.99 -4.43 119.36 112.76 1ywk n ILE 1012Ca 0.18 -0.20 0.24 0.00 -2.50 0.00 0.00 62.75 60.47 1ywk n ILE 1012Cb 0.32 -0.36 0.46 0.00 0.54 0.00 0.00 39.64 40.60 1ywk n ILE 1012CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 1ywk h ARG 1013N 0.00 0.13 -0.13 9.51 2.43 -0.94 -0.49 114.38 124.89 1ywk h ARG 1013Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ywk h ARG 1013Cb 0.67 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1ywk h ARG 1013CO 0.00 0.08 -0.01 0.72 -1.51 0.00 0.00 179.97 179.26 1ywk n HIS 1014N -5.23 0.45 -1.65 2.20 8.25 -1.26 -5.04 115.22 112.94 1ywk n HIS 1014Ca 0.31 -0.96 -0.40 0.00 -0.26 0.00 0.00 57.72 56.41 1ywk n HIS 1014Cb 1.03 -0.23 0.03 0.00 1.12 0.00 0.00 29.99 31.93 1ywk n HIS 1014CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ywk n TYR 1015N -1.00 1.44 -2.60 4.41 4.02 -0.20 -5.00 117.16 118.24 1ywk n TYR 1015Ca 0.19 0.50 -0.25 0.00 -0.01 0.00 0.00 57.90 58.33 1ywk n TYR 1015Cb 0.76 -2.26 0.03 0.00 -0.02 0.00 0.00 39.34 37.86 1ywk n TYR 1015CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1ywk s SER 1016N -0.84 5.59 0.34 7.72 1.04 -1.26 -4.84 113.70 121.45 1ywk s SER 1016Ca 0.67 0.49 0.09 0.00 0.48 0.00 0.00 55.95 57.68 1ywk s SER 1016Cb -0.49 -1.53 0.83 0.00 0.10 0.00 0.00 66.02 64.93 1ywk s SER 1016CO 0.54 -0.99 1.81 0.74 0.98 0.00 0.00 173.24 176.32 1ywk h THR 1017N 0.01 0.72 0.72 2.02 2.02 -1.97 0.09 112.91 116.52 1ywk h THR 1017Ca -0.45 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 66.46 1ywk h THR 1017Cb 1.26 -0.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1ywk h THR 1017CO 0.59 0.12 -0.35 -0.08 0.37 0.00 0.00 175.52 176.17 1ywk h GLU 1018N 0.68 -0.93 -0.70 6.66 4.81 -1.99 -2.11 114.58 121.00 1ywk h GLU 1018Ca 0.53 0.06 0.13 0.00 -0.13 0.00 0.00 59.36 59.96 1ywk h GLU 1018Cb 0.94 0.21 -0.13 0.00 0.63 0.00 0.00 28.75 30.40 1ywk h GLU 1018CO -0.30 -0.62 -0.26 1.96 -0.73 0.00 0.00 179.01 179.05 1ywk h GLN 1019N -1.08 -0.07 -0.40 1.92 4.20 -1.68 0.15 115.11 118.16 1ywk h GLN 1019Ca -0.10 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.70 1ywk h GLN 1019Cb 0.74 0.02 -0.09 0.00 0.30 0.00 0.00 27.48 28.45 1ywk h GLN 1019CO 0.16 -0.04 -0.23 -0.07 -0.67 0.00 0.00 178.83 177.98 1ywk h LEU 1020N -0.07 -0.79 -0.61 1.46 3.38 -0.97 -0.02 115.31 117.69 1ywk h LEU 1020Ca 0.30 0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.47 1ywk h LEU 1020Cb 0.55 0.40 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 1ywk h LEU 1020CO -0.75 -0.26 0.37 0.03 0.09 0.00 0.00 178.44 177.93 1ywk h ARG 1021N -0.16 0.71 -0.76 1.13 3.08 -0.12 0.75 114.38 119.01 1ywk h ARG 1021Ca 0.19 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.22 1ywk h ARG 1021Cb 0.46 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 1ywk h ARG 1021CO -0.50 0.47 0.50 -0.44 -1.07 0.00 0.00 179.97 178.94 1ywk h ASP 1022N 0.73 0.84 0.15 7.04 3.32 0.71 -1.32 116.42 127.89 1ywk h ASP 1022Ca 0.24 -0.02 -0.36 0.00 0.02 0.00 0.00 57.03 56.92 1ywk h ASP 1022Cb 0.02 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1ywk h ASP 1022CO -0.10 0.59 -2.00 -0.62 -1.72 0.00 0.00 179.24 175.39 1ywk n GLU 1023N -4.44 0.75 0.00 3.56 -0.58 -0.18 -4.65 120.64 115.11 1ywk n GLU 1023Ca 0.09 0.26 0.06 0.00 -0.42 0.00 0.00 57.16 57.15 1ywk n GLU 1023Cb 0.07 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.24 1ywk n GLU 1023CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1ywk n PHE 1024N -3.44 0.00 -4.55 -0.32 3.01 0.22 -4.91 117.46 107.47 1ywk n PHE 1024Ca -0.31 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 57.81 1ywk n PHE 1024Cb 1.05 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 40.39 1ywk n PHE 1024CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1ywk s LEU 1025N -1.69 3.09 -0.39 4.37 2.96 -0.50 -0.81 118.68 125.71 1ywk s LEU 1025Ca 0.10 -0.16 -0.08 0.00 -0.22 0.00 0.00 54.13 53.76 1ywk s LEU 1025Cb 0.10 -1.72 0.06 0.00 0.50 0.00 0.00 46.19 45.13 1ywk s LEU 1025CO 0.29 0.20 0.21 -0.69 -1.32 0.00 0.00 176.35 175.04 1ywk s VAL 1026N 0.15 4.13 0.19 1.68 1.01 0.91 -4.75 120.40 123.71 1ywk s VAL 1026Ca -0.03 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 60.66 1ywk s VAL 1026Cb -0.14 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 1ywk s VAL 1026CO 0.03 -0.39 1.49 -0.33 0.00 0.00 0.00 175.10 175.91 1ywk h GLU 1027N 8.35 0.50 -4.99 2.72 5.08 -1.94 -1.74 114.58 122.57 1ywk h GLU 1027Ca -0.23 -0.33 -0.67 0.00 -1.00 0.00 0.00 59.36 57.13 1ywk h GLU 1027Cb 1.08 0.05 -0.36 0.00 0.50 0.00 0.00 28.75 30.03 1ywk h GLU 1027CO 0.70 0.95 -0.83 0.15 -1.00 0.00 0.00 179.01 178.97 1ywk s LYS 1028N -3.90 2.72 -0.15 2.33 1.02 -1.26 -4.69 119.74 115.81 1ywk s LYS 1028Ca -0.07 -1.02 0.01 0.00 0.02 0.00 0.00 55.97 54.91 1ywk s LYS 1028Cb 0.11 -2.70 -0.09 0.00 -0.52 0.00 0.00 37.83 34.62 1ywk s LYS 1028CO 0.84 -0.35 -0.14 0.28 -0.92 0.00 0.00 175.35 175.07 1ywk n VAL 1029N 4.56 0.85 -3.84 3.17 0.31 -1.25 -4.85 118.33 117.27 1ywk n VAL 1029Ca -0.18 -0.32 -0.33 0.00 -0.01 0.00 0.00 64.34 63.50 1ywk n VAL 1029Cb 0.47 -1.07 -0.12 0.00 -0.91 0.00 0.00 33.84 32.21 1ywk n VAL 1029CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1ywk s PHE 1030N -2.30 3.33 -0.42 3.52 0.40 -1.26 -1.92 117.98 119.33 1ywk s PHE 1030Ca -0.20 -3.02 -0.13 0.00 -0.60 0.00 0.00 56.93 52.98 1ywk s PHE 1030Cb 0.05 -2.98 0.05 0.00 0.51 0.00 0.00 43.02 40.66 1ywk s PHE 1030CO 0.34 -0.76 0.30 -1.50 0.70 0.00 0.00 175.22 174.30 1ywk s ILE 1031N -0.38 4.85 0.03 0.64 2.07 -1.26 -5.01 121.20 122.13 1ywk s ILE 1031Ca 0.18 -1.01 -0.38 0.00 -1.41 0.00 0.00 60.65 58.03 1ywk s ILE 1031Cb -0.21 -3.83 -0.18 0.00 0.13 0.00 0.00 42.46 38.37 1ywk s ILE 1031CO -0.03 -0.43 1.27 -0.81 -1.91 0.00 0.00 174.94 173.03 1ywk n PRO 1032N 5.08 0.75 -0.15 3.50 -0.04 -1.26 -2.34 135.00 140.54 1ywk n PRO 1032Ca -0.11 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1ywk n PRO 1032Cb 0.45 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 1ywk n PRO 1032CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ywk n GLY 1033N 2.28 1.08 3.24 0.55 0.00 0.17 -4.98 105.19 107.53 1ywk n GLY 1033Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1ywk n GLY 1033CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ywk s ALA 1034N -2.57 0.66 -0.21 4.61 0.00 -0.99 -3.99 121.76 119.27 1ywk s ALA 1034Ca 0.00 -1.35 -0.07 0.00 0.00 0.00 0.00 51.96 50.53 1ywk s ALA 1034Cb 0.00 1.03 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 1ywk s ALA 1034CO 0.00 -0.58 0.06 0.96 0.00 0.00 0.00 175.76 176.20 1ywk s ILE 1035N -4.06 4.60 -0.31 0.00 -4.36 -1.19 -3.13 121.20 112.76 1ywk s ILE 1035Ca 0.26 -0.09 -0.03 0.00 -0.26 0.00 0.00 60.65 60.53 1ywk s ILE 1035Cb 0.06 -3.10 0.04 0.00 1.25 0.00 0.00 42.46 40.71 1ywk s ILE 1035CO 0.05 0.41 0.03 -0.55 0.24 0.00 0.00 174.94 175.12 1ywk s SER 1036N 0.85 4.97 0.19 4.36 0.15 0.34 -1.83 113.70 122.73 1ywk s SER 1036Ca 0.04 -1.17 0.09 0.00 0.70 0.00 0.00 55.95 55.61 1ywk s SER 1036Cb -0.14 -1.76 -0.04 0.00 -1.71 0.00 0.00 66.02 62.37 1ywk s SER 1036CO 0.02 -0.26 -0.19 -0.76 1.20 0.00 0.00 173.24 173.25 1ywk s LEU 1037N 1.32 2.47 -0.04 3.45 1.43 0.10 -0.44 118.68 126.98 1ywk s LEU 1037Ca -0.03 -0.91 0.00 0.00 -1.03 0.00 0.00 54.13 52.16 1ywk s LEU 1037Cb -0.19 -0.88 0.03 0.00 0.03 0.00 0.00 46.19 45.17 1ywk s LEU 1037CO -0.00 -0.03 -0.00 0.28 0.23 0.00 0.00 176.35 176.83 1ywk s THR 1038N -2.19 0.23 -0.35 5.49 -1.32 0.12 -0.92 115.64 116.70 1ywk s THR 1038Ca 0.19 0.09 -0.14 0.00 -1.21 0.00 0.00 61.69 60.62 1ywk s THR 1038Cb -0.05 -0.33 -0.01 0.00 -1.51 0.00 0.00 72.50 70.60 1ywk s THR 1038CO 0.08 0.17 0.29 -0.47 -2.21 0.00 0.00 174.62 172.49 1ywk s TYR 1039N 1.22 3.22 -0.18 9.09 5.04 0.26 -1.53 117.35 134.47 1ywk s TYR 1039Ca -0.07 -0.22 -0.08 0.00 -2.44 0.00 0.00 57.07 54.26 1ywk s TYR 1039Cb -0.13 -2.57 -0.04 0.00 0.35 0.00 0.00 41.96 39.57 1ywk s TYR 1039CO -0.02 -0.43 0.09 -0.08 -1.34 0.00 0.00 175.55 173.77 1ywk s THR 1040N 1.82 5.06 -1.21 4.34 -1.32 -0.11 0.27 115.64 124.50 1ywk s THR 1040Ca 0.08 0.06 0.11 0.00 -1.21 0.00 0.00 61.69 60.73 1ywk s THR 1040Cb -0.17 -3.28 0.15 0.00 -1.51 0.00 0.00 72.50 67.69 1ywk s THR 1040CO 0.11 0.48 1.32 1.41 -2.21 0.00 0.00 174.62 175.73 1ywk n HIS 1041N 3.31 0.00 -2.21 9.09 8.25 -0.75 -2.07 115.22 130.85 1ywk n HIS 1041Ca -0.17 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 56.91 1ywk n HIS 1041Cb 0.52 -0.40 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 1ywk n HIS 1041CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1ywk s ASN 1042N -2.79 5.56 -0.86 0.41 -0.87 -1.26 -3.41 114.94 111.72 1ywk s ASN 1042Ca 0.08 -0.06 0.00 0.00 -1.57 0.00 0.00 52.86 51.31 1ywk s ASN 1042Cb 0.08 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.76 1ywk s ASN 1042CO 0.19 -2.23 0.00 0.47 -2.57 0.00 0.00 177.10 172.97 1ywk n ASP 1043N 11.76 -5.58 -2.53 -1.22 8.00 -1.26 -3.28 116.55 122.45 1ywk n ASP 1043Ca 0.18 0.20 -0.21 0.00 0.71 0.00 0.00 54.79 55.67 1ywk n ASP 1043Cb 0.51 -3.80 -0.00 0.00 -0.02 0.00 0.00 41.12 37.81 1ywk n ASP 1043CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ywk n ARG 1044N -0.62 -2.33 -2.64 -1.24 1.74 -0.88 -4.71 116.66 105.98 1ywk n ARG 1044Ca -0.08 0.98 -0.41 0.00 -0.77 0.00 0.00 57.85 57.57 1ywk n ARG 1044Cb 0.53 -5.69 -0.05 0.00 -1.02 0.00 0.00 32.46 26.24 1ywk n ARG 1044CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1ywk s MET 1045N -5.18 4.70 -0.20 5.56 1.75 -1.08 -4.57 119.30 120.27 1ywk s MET 1045Ca 0.06 1.58 -0.00 0.00 -1.25 0.00 0.00 55.69 56.07 1ywk s MET 1045Cb -0.03 -3.30 0.02 0.00 2.84 0.00 0.00 34.83 34.36 1ywk s MET 1045CO 0.08 0.25 -0.14 0.96 -0.65 0.00 0.00 175.02 175.51 1ywk s ILE 1046N -0.47 2.47 0.29 10.11 -5.25 0.11 -0.93 121.20 127.53 1ywk s ILE 1046Ca 0.46 -0.90 0.03 0.00 -0.99 0.00 0.00 60.65 59.24 1ywk s ILE 1046Cb -0.27 -2.13 -0.06 0.00 2.95 0.00 0.00 42.46 42.96 1ywk s ILE 1046CO 0.33 0.42 0.07 0.72 -1.79 0.00 0.00 174.94 174.69 1ywk s PHE 1047N 1.32 1.74 -5.00 1.37 -0.71 -0.58 -0.23 117.98 115.89 1ywk s PHE 1047Ca 0.03 -1.05 0.00 0.00 -1.04 0.00 0.00 56.93 54.88 1ywk s PHE 1047Cb -0.14 -1.08 0.00 0.00 -1.21 0.00 0.00 43.02 40.59 1ywk s PHE 1047CO -0.09 -0.14 0.00 0.41 -1.34 0.00 0.00 175.22 174.06 1ywk n GLY 1048N -0.56 -0.16 3.11 1.99 0.00 -0.93 0.16 105.19 108.80 1ywk n GLY 1048Ca -0.02 -1.54 -0.28 0.00 0.00 0.00 0.00 46.02 44.18 1ywk n GLY 1048CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ywk s GLY 1049N 0.00 1.04 -0.39 -0.02 0.00 0.42 -1.27 107.32 107.10 1ywk s GLY 1049Ca 0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 44.72 43.97 1ywk s GLY 1049CO 0.00 -0.04 0.20 0.54 0.00 0.00 0.00 173.10 173.80 1ywk s VAL 1050N 0.59 3.84 -0.61 1.40 0.11 0.13 -0.50 120.40 125.36 1ywk s VAL 1050Ca -0.15 -1.50 -0.01 0.00 -2.93 0.00 0.00 61.98 57.39 1ywk s VAL 1050Cb -0.17 -3.37 0.16 0.00 -1.53 0.00 0.00 36.38 31.47 1ywk s VAL 1050CO 0.05 -0.46 0.41 0.28 -3.33 0.00 0.00 175.10 172.05 1ywk s THR 1051N 1.34 3.48 0.42 5.04 -1.32 -1.18 -1.85 115.64 121.57 1ywk s THR 1051Ca 0.03 -3.09 -0.24 0.00 -1.21 0.00 0.00 61.69 57.18 1ywk s THR 1051Cb -0.22 -3.29 -0.08 0.00 -1.51 0.00 0.00 72.50 67.40 1ywk s THR 1051CO 0.00 -0.87 1.12 -2.16 -2.21 0.00 0.00 174.62 170.51 1ywk s PRO 1052N -0.17 4.01 0.00 7.08 0.04 -1.24 -0.66 135.00 144.05 1ywk s PRO 1052Ca 0.17 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.91 1ywk s PRO 1052Cb -0.21 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.78 1ywk s PRO 1052CO -0.03 -0.32 0.00 0.25 0.04 0.00 0.00 177.00 176.95 1ywk n THR 1053N -0.14 0.00 -0.21 1.26 -2.24 -1.26 -4.11 114.28 107.58 1ywk n THR 1053Ca 0.05 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.94 1ywk n THR 1053Cb 0.48 -0.43 0.26 0.00 -2.10 0.00 0.00 70.33 68.55 1ywk n THR 1053CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ywk n THR 1054N -1.43 0.91 -3.62 4.28 -2.24 -1.26 -4.19 114.28 106.73 1ywk n THR 1054Ca 0.00 -0.95 -0.04 0.00 -2.27 0.00 0.00 64.05 60.79 1ywk n THR 1054Cb 0.00 0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 68.75 1ywk n THR 1054CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1ywk s GLU 1055N -1.06 0.58 0.52 -0.78 2.12 -1.26 -5.14 118.70 113.67 1ywk s GLU 1055Ca 0.40 1.11 -0.22 0.00 0.36 0.00 0.00 54.97 56.63 1ywk s GLU 1055Cb 0.21 0.30 -0.07 0.00 0.26 0.00 0.00 34.13 34.84 1ywk s GLU 1055CO 0.28 -0.14 1.15 -0.85 -0.54 0.00 0.00 175.26 175.16 1ywk n GLU 1056N 4.47 1.41 -4.33 4.30 0.28 -1.26 -4.83 120.64 120.68 1ywk n GLU 1056Ca -0.17 0.52 -0.29 0.00 -0.16 0.00 0.00 57.16 57.06 1ywk n GLU 1056Cb 0.56 -2.31 -0.11 0.00 1.43 0.00 0.00 31.44 31.01 1ywk n GLU 1056CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1ywk s LEU 1057N -2.13 2.64 -0.09 -1.84 1.43 0.13 -4.92 118.68 113.89 1ywk s LEU 1057Ca 0.70 -0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 53.11 1ywk s LEU 1057Cb -0.46 -1.46 0.04 0.00 0.03 0.00 0.00 46.19 44.35 1ywk s LEU 1057CO 0.51 0.16 0.22 -0.70 0.23 0.00 0.00 176.35 176.78 1ywk s GLU 1058N -2.27 0.19 -0.45 1.70 2.12 -1.26 0.42 118.70 119.14 1ywk s GLU 1058Ca 0.18 0.47 -0.28 0.00 0.36 0.00 0.00 54.97 55.70 1ywk s GLU 1058Cb -0.10 -0.10 0.01 0.00 0.26 0.00 0.00 34.13 34.20 1ywk s GLU 1058CO 0.10 -0.15 1.47 0.42 -0.54 0.00 0.00 175.26 176.56 1ywk s ILE 1059N 1.09 3.81 -0.40 -3.70 1.01 -1.26 -4.96 121.20 116.79 1ywk s ILE 1059Ca -0.08 0.78 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 1ywk s ILE 1059Cb -0.09 -4.21 0.04 0.00 0.01 0.00 0.00 42.46 38.21 1ywk s ILE 1059CO -0.07 -0.85 0.25 0.27 0.00 0.00 0.00 174.94 174.55 1ywk s ILE 1060N 5.89 4.65 -0.03 2.92 -4.36 -1.26 -4.68 121.20 124.33 1ywk s ILE 1060Ca 0.61 -0.99 -0.01 0.00 -0.26 0.00 0.00 60.65 60.00 1ywk s ILE 1060Cb -0.13 -3.68 0.02 0.00 1.25 0.00 0.00 42.46 39.92 1ywk s ILE 1060CO 0.30 -0.35 0.07 -0.76 0.24 0.00 0.00 174.94 174.45 1ywk s LEU 1061N 1.55 1.19 0.00 0.37 1.02 -1.26 -5.00 118.68 116.55 1ywk s LEU 1061Ca 0.03 0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.31 1ywk s LEU 1061Cb -0.21 0.14 0.00 0.00 0.02 0.00 0.00 46.19 46.14 1ywk s LEU 1061CO 0.06 -0.10 0.00 -0.90 0.02 0.00 0.00 176.35 175.43 1ywk n ASP 1062N 3.84 0.00 -0.36 2.29 5.68 -1.26 0.12 116.55 126.85 1ywk n ASP 1062Ca -0.23 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.07 1ywk n ASP 1062Cb 0.53 0.28 0.14 0.00 -1.14 0.00 0.00 41.12 40.94 1ywk n ASP 1062CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1ywk h LYS 1063N 0.00 1.19 -0.28 0.11 2.10 -1.90 0.18 116.57 117.97 1ywk h LYS 1063Ca 0.00 -0.07 0.07 0.00 -2.00 0.00 0.00 60.65 58.65 1ywk h LYS 1063Cb 0.00 -0.27 -0.01 0.00 -0.90 0.00 0.00 32.23 31.05 1ywk h LYS 1063CO 0.00 0.79 0.20 0.93 -2.00 0.00 0.00 179.45 179.37 1ywk h GLU 1064N 1.23 0.04 -0.15 0.07 3.07 -1.91 -1.95 114.58 114.97 1ywk h GLU 1064Ca 0.40 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.24 1ywk h GLU 1064Cb 0.03 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1ywk h GLU 1064CO -0.13 0.02 -0.04 1.28 -1.40 0.00 0.00 179.01 178.75 1ywk n LEU 1065N -4.46 3.21 -3.94 1.33 4.77 -0.39 -4.98 117.00 112.53 1ywk n LEU 1065Ca 0.04 -3.18 -0.30 0.00 -0.03 0.00 0.00 56.01 52.54 1ywk n LEU 1065Cb 0.33 -0.51 0.01 0.00 -2.33 0.00 0.00 43.42 40.93 1ywk n LEU 1065CO 0.35 0.79 0.03 0.61 -1.33 0.00 0.00 177.39 177.85 1ywk n GLY 1066N -1.00 -0.44 3.38 -0.72 0.00 -0.09 -4.96 105.19 101.36 1ywk n GLY 1066Ca 0.20 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 46.26 1ywk n GLY 1066CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ywk s VAL 1067N -3.41 0.00 0.01 1.61 -7.23 0.44 -5.00 120.40 106.82 1ywk s VAL 1067Ca 0.53 -1.76 0.06 0.00 -1.81 0.00 0.00 61.98 59.00 1ywk s VAL 1067Cb -0.27 -2.47 -0.24 0.00 0.56 0.00 0.00 36.38 33.96 1ywk s VAL 1067CO 0.85 0.00 0.85 0.44 -0.31 0.00 0.00 175.10 176.93 1ywk h ASP 1068N 2.32 0.13 -4.39 4.85 3.45 -1.88 -3.24 116.42 117.65 1ywk h ASP 1068Ca -0.30 -0.20 -0.13 0.00 0.43 0.00 0.00 57.03 56.83 1ywk h ASP 1068Cb 1.24 -0.04 -0.23 0.00 -0.56 0.00 0.00 39.33 39.75 1ywk h ASP 1068CO 0.42 1.17 -0.30 -0.72 -1.57 0.00 0.00 179.24 178.25 1ywk s TYR 1069N -2.63 -0.28 0.06 4.55 -0.85 -1.26 -4.68 117.35 112.26 1ywk s TYR 1069Ca -0.05 0.61 -0.05 0.00 -0.52 0.00 0.00 57.07 57.05 1ywk s TYR 1069Cb 0.08 0.11 0.06 0.00 0.38 0.00 0.00 41.96 42.59 1ywk s TYR 1069CO 0.83 -0.28 0.41 0.34 -1.52 0.00 0.00 175.55 175.33 1ywk n PHE 1070N 2.13 -0.00 -0.94 -3.49 7.35 0.12 -0.46 117.46 122.16 1ywk n PHE 1070Ca -0.17 0.33 0.07 0.00 -0.76 0.00 0.00 57.45 56.92 1ywk n PHE 1070Cb 0.57 -0.59 0.37 0.00 0.35 0.00 0.00 39.48 40.17 1ywk n PHE 1070CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1ywk n LEU 1071N -4.39 5.34 -0.34 -2.13 4.77 -1.26 -4.55 117.00 114.44 1ywk n LEU 1071Ca 0.03 -2.98 0.10 0.00 -0.03 0.00 0.00 56.01 53.12 1ywk n LEU 1071Cb 0.10 -0.66 0.30 0.00 -2.33 0.00 0.00 43.42 40.83 1ywk n LEU 1071CO -0.04 0.65 1.22 -0.08 -1.33 0.00 0.00 177.39 177.82 1ywk h GLU 1072N 3.41 0.84 -0.23 3.23 4.81 -1.05 0.34 114.58 125.93 1ywk h GLU 1072Ca 0.01 -0.05 -0.21 0.00 -0.13 0.00 0.00 59.36 58.98 1ywk h GLU 1072Cb 1.88 -0.19 -0.32 0.00 0.63 0.00 0.00 28.75 30.75 1ywk h GLU 1072CO 0.45 0.56 -0.92 0.54 -0.73 0.00 0.00 179.01 178.90 1ywk n ARG 1073N -4.63 1.33 -4.00 1.92 1.74 -1.26 -3.63 116.66 108.12 1ywk n ARG 1073Ca 0.19 -3.00 -0.08 0.00 -0.77 0.00 0.00 57.85 54.19 1ywk n ARG 1073Cb 0.43 -1.10 -0.10 0.00 -1.02 0.00 0.00 32.46 30.67 1ywk n ARG 1073CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1ywk s ARG 1074N -2.23 0.52 0.25 5.56 0.52 -1.14 -0.30 118.95 122.13 1ywk s ARG 1074Ca 0.35 -0.89 0.09 0.00 -0.52 0.00 0.00 55.73 54.76 1ywk s ARG 1074Cb 0.37 0.19 -0.04 0.00 0.52 0.00 0.00 34.95 35.99 1ywk s ARG 1074CO -0.08 -0.11 -0.01 -1.83 0.02 0.00 0.00 175.30 173.29 1ywk s GLU 1075N -2.79 2.29 -0.08 3.54 -1.05 0.15 -3.04 118.70 117.71 1ywk s GLU 1075Ca -0.04 -1.37 -0.07 0.00 -0.15 0.00 0.00 54.97 53.35 1ywk s GLU 1075Cb -0.00 -2.18 0.03 0.00 -0.44 0.00 0.00 34.13 31.53 1ywk s GLU 1075CO -0.06 0.38 0.21 -1.17 0.95 0.00 0.00 175.26 175.58 1ywk s LEU 1076N -3.53 1.00 0.05 1.83 0.20 0.12 -1.47 118.68 116.89 1ywk s LEU 1076Ca 0.30 0.44 0.04 0.00 0.69 0.00 0.00 54.13 55.61 1ywk s LEU 1076Cb -0.07 0.71 -0.04 0.00 -0.43 0.00 0.00 46.19 46.36 1ywk s LEU 1076CO 0.19 -0.10 -0.04 -0.83 -0.29 0.00 0.00 176.35 175.29 1ywk s GLY 1077N 0.41 1.84 0.00 7.98 0.00 -0.63 -0.67 107.32 116.26 1ywk s GLY 1077Ca -0.02 -1.09 -0.01 0.00 0.00 0.00 0.00 44.72 43.60 1ywk s GLY 1077CO -0.02 -1.02 0.01 0.14 0.00 0.00 0.00 173.10 172.21 1ywk s VAL 1078N -1.17 0.05 -0.10 1.40 1.01 -0.28 -1.70 120.40 119.60 1ywk s VAL 1078Ca 0.21 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 1ywk s VAL 1078Cb -0.11 -0.15 0.05 0.00 0.00 0.00 0.00 36.38 36.17 1ywk s VAL 1078CO 0.13 -0.21 0.21 -0.63 0.00 0.00 0.00 175.10 174.60 1ywk s ILE 1079N -0.63 -0.19 -0.31 2.22 1.01 -0.96 -0.40 121.20 121.94 1ywk s ILE 1079Ca -0.07 0.23 -0.27 0.00 0.00 0.00 0.00 60.65 60.55 1ywk s ILE 1079Cb -0.04 -0.35 0.01 0.00 0.01 0.00 0.00 42.46 42.08 1ywk s ILE 1079CO -0.00 0.10 0.95 0.21 0.00 0.00 0.00 174.94 176.19 1ywk s ASN 1080N 1.76 6.82 0.11 3.58 2.47 -0.35 -1.83 114.94 127.49 1ywk s ASN 1080Ca -0.04 0.88 0.22 0.00 0.42 0.00 0.00 52.86 54.35 1ywk s ASN 1080Cb -0.11 -2.48 -0.12 0.00 -1.45 0.00 0.00 41.25 37.08 1ywk s ASN 1080CO -0.07 -0.76 0.84 -0.38 -3.72 0.00 0.00 177.10 173.00 1ywk n ILE 1081N 5.71 0.36 0.00 -5.21 2.08 0.15 -0.33 119.36 122.13 1ywk n ILE 1081Ca 0.08 -0.51 0.00 0.00 0.56 0.00 0.00 62.75 62.88 1ywk n ILE 1081Cb 0.47 -0.18 0.00 0.00 -0.75 0.00 0.00 39.64 39.19 1ywk n ILE 1081CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ywk n GLY 1082N 1.22 1.81 3.79 7.39 0.00 -1.23 -4.82 105.19 113.35 1ywk n GLY 1082Ca -0.01 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 1ywk n GLY 1082CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ywk s GLY 1083N 0.00 1.59 0.39 -0.02 0.00 0.09 -4.20 107.32 105.16 1ywk s GLY 1083Ca 0.00 -0.45 -0.28 0.00 0.00 0.00 0.00 44.72 44.00 1ywk s GLY 1083CO 0.00 0.08 1.49 2.56 0.00 0.00 0.00 173.10 177.23 1ywk s PRO 1084N -5.25 4.04 0.00 2.90 0.04 -1.26 -3.69 135.00 131.78 1ywk s PRO 1084Ca 0.63 2.57 0.00 0.00 0.04 0.00 0.00 61.00 64.24 1ywk s PRO 1084Cb -0.15 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1ywk s PRO 1084CO 0.54 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.40 1ywk n GLY 1085N 0.46 4.29 3.04 0.56 0.00 0.14 -2.31 105.19 111.36 1ywk n GLY 1085Ca 0.02 -1.12 -0.10 0.00 0.00 0.00 0.00 46.02 44.81 1ywk n GLY 1085CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ywk s PHE 1086N -1.70 0.15 -0.07 1.61 0.08 0.19 -0.33 117.98 117.91 1ywk s PHE 1086Ca 0.00 -0.34 0.03 0.00 0.12 0.00 0.00 56.93 56.74 1ywk s PHE 1086Cb 0.00 -0.12 0.01 0.00 -0.57 0.00 0.00 43.02 42.34 1ywk s PHE 1086CO 0.00 -0.23 -0.15 -1.50 -0.10 0.00 0.00 175.22 173.24 1ywk s ILE 1087N -1.40 1.34 -0.37 0.64 2.07 -0.96 -1.37 121.20 121.16 1ywk s ILE 1087Ca -0.15 -0.60 0.01 0.00 -1.41 0.00 0.00 60.65 58.50 1ywk s ILE 1087Cb -0.09 -1.21 0.10 0.00 0.13 0.00 0.00 42.46 41.40 1ywk s ILE 1087CO 0.00 0.40 0.11 -0.70 -1.91 0.00 0.00 174.94 172.85 1ywk s GLU 1088N 0.62 1.78 -0.45 3.50 2.12 0.65 -0.89 118.70 126.03 1ywk s GLU 1088Ca -0.15 -1.81 -0.15 0.00 0.36 0.00 0.00 54.97 53.23 1ywk s GLU 1088Cb -0.16 -3.37 0.06 0.00 0.26 0.00 0.00 34.13 30.92 1ywk s GLU 1088CO 0.05 -0.97 0.35 -1.50 -0.54 0.00 0.00 175.26 172.64 1ywk s ILE 1089N 1.03 5.14 -1.32 -3.70 1.10 -0.22 -1.03 121.20 122.19 1ywk s ILE 1089Ca 0.08 -0.96 -0.01 0.00 -0.51 0.00 0.00 60.65 59.25 1ywk s ILE 1089Cb -0.21 -4.00 -0.00 0.00 0.15 0.00 0.00 42.46 38.40 1ywk s ILE 1089CO -0.06 -0.48 0.62 0.47 -2.11 0.00 0.00 174.94 173.38 1ywk n ASP 1090N 5.16 -1.20 0.00 4.50 8.00 -0.23 -2.50 116.55 130.28 1ywk n ASP 1090Ca -0.12 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.49 1ywk n ASP 1090Cb 0.45 -3.71 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 1ywk n ASP 1090CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ywk n GLY 1091N -1.71 2.79 3.61 0.44 0.00 -1.26 -5.01 105.19 104.05 1ywk n GLY 1091Ca -0.29 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 1ywk n GLY 1091CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ywk s ALA 1092N 0.00 2.89 -0.28 4.61 0.00 -1.04 -4.95 121.76 122.98 1ywk s ALA 1092Ca 0.00 0.84 -0.09 0.00 0.00 0.00 0.00 51.96 52.71 1ywk s ALA 1092Cb 0.00 -4.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.06 1ywk s ALA 1092CO 0.00 -2.56 0.13 0.21 0.00 0.00 0.00 175.76 173.54 1ywk s LYS 1093N 5.96 3.63 0.48 0.00 2.20 -1.26 -1.06 119.74 129.70 1ywk s LYS 1093Ca 0.97 -0.51 0.04 0.00 -0.36 0.00 0.00 55.97 56.11 1ywk s LYS 1093Cb -0.34 -3.50 -0.02 0.00 -1.51 0.00 0.00 37.83 32.46 1ywk s LYS 1093CO 0.36 -0.26 0.13 -1.21 -0.36 0.00 0.00 175.35 174.01 1ywk s GLU 1094N 1.66 2.18 -0.18 4.03 2.02 -0.07 -4.96 118.70 123.38 1ywk s GLU 1094Ca 0.06 -2.16 -0.09 0.00 0.02 0.00 0.00 54.97 52.81 1ywk s GLU 1094Cb -0.16 -1.77 -0.05 0.00 0.10 0.00 0.00 34.13 32.25 1ywk s GLU 1094CO 0.07 -0.33 0.12 0.95 0.02 0.00 0.00 175.26 176.08 1ywk s THR 1095N -2.77 5.29 -0.36 3.63 -4.23 -1.26 -2.27 115.64 113.67 1ywk s THR 1095Ca 0.24 0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.90 1ywk s THR 1095Cb 0.02 -3.38 0.10 0.00 1.34 0.00 0.00 72.50 70.58 1ywk s THR 1095CO 0.13 0.49 0.09 -0.04 -0.54 0.00 0.00 174.62 174.75 1ywk s MET 1096N 0.01 1.76 0.41 3.99 -1.94 0.55 -4.89 119.30 119.18 1ywk s MET 1096Ca 0.09 -1.79 -0.02 0.00 -1.71 0.00 0.00 55.69 52.26 1ywk s MET 1096Cb -0.11 -3.32 -0.03 0.00 2.01 0.00 0.00 34.83 33.37 1ywk s MET 1096CO -0.00 -0.95 0.65 0.21 -0.01 0.00 0.00 175.02 174.92 1ywk s LYS 1097N 1.01 3.48 0.28 2.03 2.47 -1.26 0.24 119.74 128.00 1ywk s LYS 1097Ca 0.08 -0.14 -0.28 0.00 -1.56 0.00 0.00 55.97 54.07 1ywk s LYS 1097Cb -0.20 -2.54 -0.14 0.00 -1.46 0.00 0.00 37.83 33.48 1ywk s LYS 1097CO -0.06 -0.01 1.02 1.17 0.16 0.00 0.00 175.35 177.62 1ywk n LYS 1098N -1.99 1.35 -0.64 4.03 4.81 -1.26 -0.27 118.16 124.19 1ywk n LYS 1098Ca -0.02 0.47 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1ywk n LYS 1098Cb 0.56 -1.85 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1ywk n LYS 1098CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1ywk n GLN 1099N 0.78 0.00 -2.78 1.64 6.02 0.55 -4.97 117.38 118.62 1ywk n GLN 1099Ca 0.10 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.71 1ywk n GLN 1099Cb 0.32 -2.15 -0.06 0.00 1.02 0.00 0.00 30.24 29.36 1ywk n GLN 1099CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ywk s ASP 1100N -3.35 7.45 0.27 1.08 1.01 0.63 -3.81 116.67 119.95 1ywk s ASP 1100Ca 0.00 1.86 0.03 0.00 0.71 0.00 0.00 52.55 55.15 1ywk s ASP 1100Cb 0.00 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 1ywk s ASP 1100CO 0.00 0.03 0.10 0.61 0.21 0.00 0.00 175.17 176.12 1ywk n GLY 1101N 0.93 3.52 3.64 0.21 0.00 0.17 -1.22 105.19 112.45 1ywk n GLY 1101Ca 0.00 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.90 1ywk n GLY 1101CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ywk s TYR 1102N -2.58 -0.61 -0.30 1.61 6.04 0.46 -1.69 117.35 120.29 1ywk s TYR 1102Ca 0.14 1.38 -0.07 0.00 0.04 0.00 0.00 57.07 58.56 1ywk s TYR 1102Cb 0.01 0.38 0.01 0.00 -1.04 0.00 0.00 41.96 41.31 1ywk s TYR 1102CO 0.10 -0.30 0.08 -0.47 -1.54 0.00 0.00 175.55 173.42 1ywk s TYR 1103N 0.69 3.15 -0.13 4.97 5.04 -0.49 -1.13 117.35 129.45 1ywk s TYR 1103Ca -0.02 -1.00 -0.02 0.00 -2.44 0.00 0.00 57.07 53.59 1ywk s TYR 1103Cb -0.05 -2.25 -0.03 0.00 0.35 0.00 0.00 41.96 39.99 1ywk s TYR 1103CO -0.09 -0.58 -0.06 0.42 -1.34 0.00 0.00 175.55 173.89 1ywk s ILE 1104N 1.49 3.70 0.57 3.14 1.01 0.16 -1.26 121.20 130.00 1ywk s ILE 1104Ca 0.02 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.28 1ywk s ILE 1104Cb -0.17 -2.58 0.07 0.00 0.01 0.00 0.00 42.46 39.78 1ywk s ILE 1104CO 0.02 0.52 0.78 -0.83 0.00 0.00 0.00 174.94 175.44 1ywk s GLY 1105N 0.08 1.81 0.27 6.18 0.00 -1.26 -0.70 107.32 113.70 1ywk s GLY 1105Ca -0.02 -1.74 -0.28 0.00 0.00 0.00 0.00 44.72 42.68 1ywk s GLY 1105CO 0.03 -1.36 0.95 1.17 0.00 0.00 0.00 173.10 173.90 1ywk n LYS 1106N -2.31 1.15 -0.97 2.90 4.81 -1.17 -3.04 118.16 119.53 1ywk n LYS 1106Ca 0.12 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 1ywk n LYS 1106Cb 0.60 -1.73 0.00 0.00 0.02 0.00 0.00 35.03 33.92 1ywk n LYS 1106CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1ywk n GLU 1107N 0.85 -0.16 -2.50 1.64 1.02 0.12 -4.83 120.64 116.77 1ywk n GLU 1107Ca 0.11 0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.87 1ywk n GLU 1107Cb 0.30 -3.07 -0.03 0.00 -0.02 0.00 0.00 31.44 28.63 1ywk n GLU 1107CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1ywk s THR 1108N -2.64 4.36 0.04 2.62 -4.23 -1.17 -4.90 115.64 109.73 1ywk s THR 1108Ca 0.00 1.67 -0.30 0.00 -1.18 0.00 0.00 61.69 61.88 1ywk s THR 1108Cb 0.00 -4.07 -0.17 0.00 1.34 0.00 0.00 72.50 69.59 1ywk s THR 1108CO 0.00 -0.01 1.39 0.11 -0.54 0.00 0.00 174.62 175.56 1ywk h LYS 1109N 7.43 -0.80 -4.31 3.99 1.79 -1.93 -3.40 116.57 119.33 1ywk h LYS 1109Ca -0.33 0.05 -0.52 0.00 -2.18 0.00 0.00 60.65 57.67 1ywk h LYS 1109Cb 1.15 0.18 -0.36 0.00 -1.58 0.00 0.00 32.23 31.63 1ywk h LYS 1109CO 0.88 -0.49 -0.81 -1.01 -1.08 0.00 0.00 179.45 176.94 1ywk s HIS 1110N -5.34 1.49 -0.32 -1.35 3.76 -1.26 -4.80 115.29 107.47 1ywk s HIS 1110Ca -0.16 -0.70 0.00 0.00 -0.15 0.00 0.00 55.06 54.05 1ywk s HIS 1110Cb 0.02 -1.20 0.07 0.00 1.11 0.00 0.00 32.58 32.59 1ywk s HIS 1110CO 0.55 -0.46 0.02 0.08 -0.85 0.00 0.00 174.74 174.07 1ywk s VAL 1111N 1.45 2.70 -0.15 -0.90 1.01 -1.26 -1.07 120.40 122.18 1ywk s VAL 1111Ca 0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 61.98 60.19 1ywk s VAL 1111Cb -0.13 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 1ywk s VAL 1111CO -0.05 -0.28 0.00 -0.13 0.00 0.00 0.00 175.10 174.63 1ywk s ARG 1112N 1.13 3.63 -0.05 2.72 0.52 -0.20 -4.37 118.95 122.33 1ywk s ARG 1112Ca -0.01 -0.44 -0.01 0.00 -0.52 0.00 0.00 55.73 54.75 1ywk s ARG 1112Cb -0.20 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1ywk s ARG 1112CO -0.04 0.34 0.03 -0.06 0.02 0.00 0.00 175.30 175.60 1ywk s PHE 1113N 0.11 3.21 0.04 -0.53 0.08 0.17 -0.25 117.98 120.81 1ywk s PHE 1113Ca 0.01 0.20 -0.17 0.00 0.12 0.00 0.00 56.93 57.09 1ywk s PHE 1113Cb -0.13 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.59 1ywk s PHE 1113CO 0.02 0.51 0.39 -1.54 -0.10 0.00 0.00 175.22 174.50 1ywk s SER 1114N -1.24 -0.25 0.26 1.36 1.04 -0.47 0.21 113.70 114.60 1ywk s SER 1114Ca 0.17 -0.04 0.09 0.00 0.48 0.00 0.00 55.95 56.65 1ywk s SER 1114Cb -0.12 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 1ywk s SER 1114CO 0.07 -0.66 0.05 -0.44 0.98 0.00 0.00 173.24 173.24 1ywk s SER 1115N -2.02 4.82 0.00 7.02 0.01 -1.26 0.55 113.70 122.82 1ywk s SER 1115Ca -0.05 -0.52 0.22 0.00 1.31 0.00 0.00 55.95 56.90 1ywk s SER 1115Cb -0.01 -1.01 0.24 0.00 0.21 0.00 0.00 66.02 65.45 1ywk s SER 1115CO -0.03 -0.00 1.24 -1.84 0.41 0.00 0.00 173.24 173.02 1ywk n GLU 1116N -0.93 2.17 -3.20 12.44 0.28 -0.98 -4.82 120.64 125.60 1ywk n GLU 1116Ca -0.07 -1.93 0.01 0.00 -0.16 0.00 0.00 57.16 55.01 1ywk n GLU 1116Cb 0.58 -1.44 -0.03 0.00 1.43 0.00 0.00 31.44 31.99 1ywk n GLU 1116CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1ywk s ASN 1117N -1.73 -0.99 0.59 -1.84 2.47 -1.26 -5.03 114.94 107.15 1ywk s ASN 1117Ca 0.29 0.57 0.29 0.00 0.42 0.00 0.00 52.86 54.44 1ywk s ASN 1117Cb 0.19 1.88 1.75 0.00 -1.45 0.00 0.00 41.25 43.62 1ywk s ASN 1117CO 0.28 -0.28 2.18 -0.65 -3.72 0.00 0.00 177.10 174.92 1ywk h PRO 1118N 8.05 0.00 -0.10 0.43 0.11 -1.88 -1.81 132.00 136.80 1ywk h PRO 1118Ca -0.18 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.75 1ywk h PRO 1118Cb 1.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1ywk h PRO 1118CO 0.25 0.00 -0.67 0.22 -0.21 0.00 0.00 178.00 177.58 1ywk h ASP 1119N 0.00 0.48 -2.10 -2.05 1.82 -1.95 -3.33 116.42 109.29 1ywk h ASP 1119Ca 0.04 -0.30 -0.58 0.00 -0.39 0.00 0.00 57.03 55.80 1ywk h ASP 1119Cb 0.24 -0.14 -0.41 0.00 0.68 0.00 0.00 39.33 39.70 1ywk h ASP 1119CO -0.00 1.02 -0.85 -3.20 -1.61 0.00 0.00 179.24 174.60 1ywk n ASN 1120N -3.87 2.03 -4.65 2.28 5.15 -0.73 -5.11 115.26 110.36 1ywk n ASN 1120Ca -0.04 -3.09 -0.33 0.00 -0.60 0.00 0.00 54.58 50.52 1ywk n ASN 1120Cb 0.67 -0.65 0.13 0.00 -0.53 0.00 0.00 39.78 39.40 1ywk n ASN 1120CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1ywk n PRO 1121N 1.09 0.08 -2.96 1.20 -0.04 -0.91 -3.92 135.00 129.53 1ywk n PRO 1121Ca 0.26 0.10 -0.40 0.00 -0.04 0.00 0.00 63.50 63.42 1ywk n PRO 1121Cb 0.47 -2.33 -0.05 0.00 -0.04 0.00 0.00 33.50 31.55 1ywk n PRO 1121CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ywk s ALA 1122N -2.19 3.35 -0.53 0.55 0.00 -1.24 -0.74 121.76 120.97 1ywk s ALA 1122Ca 0.71 0.29 -0.10 0.00 0.00 0.00 0.00 51.96 52.86 1ywk s ALA 1122Cb -0.28 -3.02 0.14 0.00 0.00 0.00 0.00 23.12 19.95 1ywk s ALA 1122CO 0.54 0.03 0.41 0.15 0.00 0.00 0.00 175.76 176.89 1ywk s LYS 1123N 0.09 2.64 -0.34 0.00 1.02 -1.26 -3.74 119.74 118.15 1ywk s LYS 1123Ca 0.39 -1.92 -0.24 0.00 0.02 0.00 0.00 55.97 54.23 1ywk s LYS 1123Cb -0.20 -3.99 0.01 0.00 -0.52 0.00 0.00 37.83 33.13 1ywk s LYS 1123CO 0.23 -1.21 0.81 -0.06 -0.92 0.00 0.00 175.35 174.20 1ywk s PHE 1124N 1.10 3.14 -0.29 3.18 0.40 -0.77 0.34 117.98 125.09 1ywk s PHE 1124Ca 0.08 0.70 -0.14 0.00 -0.60 0.00 0.00 56.93 56.98 1ywk s PHE 1124Cb -0.24 -3.37 -0.04 0.00 0.51 0.00 0.00 43.02 39.89 1ywk s PHE 1124CO -0.02 -0.68 0.30 -0.47 0.70 0.00 0.00 175.22 175.06 1ywk s TYR 1125N 3.10 3.23 0.04 0.36 5.04 -0.76 -0.69 117.35 127.67 1ywk s TYR 1125Ca 0.33 0.19 0.07 0.00 -2.44 0.00 0.00 57.07 55.22 1ywk s TYR 1125Cb -0.13 -2.52 -0.03 0.00 0.35 0.00 0.00 41.96 39.62 1ywk s TYR 1125CO 0.15 -0.25 -0.19 0.96 -1.34 0.00 0.00 175.55 174.88 1ywk s ILE 1126N 1.94 2.76 -0.26 3.14 -5.25 -0.39 -2.26 121.20 120.88 1ywk s ILE 1126Ca 0.11 -1.21 -0.01 0.00 -0.99 0.00 0.00 60.65 58.55 1ywk s ILE 1126Cb -0.16 -2.16 0.08 0.00 2.95 0.00 0.00 42.46 43.17 1ywk s ILE 1126CO 0.11 0.33 0.04 -0.55 -1.79 0.00 0.00 174.94 173.07 1ywk s SER 1127N -1.46 3.70 -0.09 4.36 0.15 -0.69 -2.18 113.70 117.49 1ywk s SER 1127Ca 0.15 -1.31 -0.02 0.00 0.70 0.00 0.00 55.95 55.46 1ywk s SER 1127Cb -0.10 -0.92 -0.03 0.00 -1.71 0.00 0.00 66.02 63.26 1ywk s SER 1127CO 0.05 -0.33 0.00 0.00 1.20 0.00 0.00 173.24 174.16 1ywk s VAL 1129N -0.78 0.09 0.32 0.00 1.01 -0.54 -0.71 120.40 119.79 1ywk s VAL 1129Ca 0.12 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 1ywk s VAL 1129Cb -0.12 -0.36 -0.12 0.00 0.00 0.00 0.00 36.38 35.78 1ywk s VAL 1129CO 0.02 -0.39 1.48 -2.65 0.00 0.00 0.00 175.10 173.56 1ywk n PRO 1130N 1.59 2.51 -4.13 2.72 -0.02 -1.26 -0.68 135.00 135.73 1ywk n PRO 1130Ca -0.23 0.89 -0.18 0.00 -2.02 0.00 0.00 63.50 61.96 1ywk n PRO 1130Cb 0.56 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 1ywk n PRO 1130CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ywk s ALA 1131N -0.58 0.54 -0.21 3.55 0.00 0.59 -4.68 121.76 120.96 1ywk s ALA 1131Ca 0.59 -0.06 0.22 0.00 0.00 0.00 0.00 51.96 52.72 1ywk s ALA 1131Cb -0.52 -0.31 -0.21 0.00 0.00 0.00 0.00 23.12 22.08 1ywk s ALA 1131CO 0.56 0.02 0.70 0.72 0.00 0.00 0.00 175.76 177.76 1ywk n HIS 1132N 3.73 0.25 -4.37 0.00 8.25 -1.26 -4.14 115.22 117.68 1ywk n HIS 1132Ca -0.22 0.07 -0.26 0.00 -0.26 0.00 0.00 57.72 57.04 1ywk n HIS 1132Cb 0.53 -0.56 -0.12 0.00 1.12 0.00 0.00 29.99 30.95 1ywk n HIS 1132CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1ywk s HIS 1133N -3.41 2.13 -0.28 4.41 5.65 -1.26 -5.12 115.29 117.40 1ywk s HIS 1133Ca -0.04 -0.39 -0.10 0.00 0.25 0.00 0.00 55.06 54.78 1ywk s HIS 1133Cb 0.13 -1.12 -0.03 0.00 -1.18 0.00 0.00 32.58 30.38 1ywk s HIS 1133CO 0.87 0.35 0.15 0.21 -0.65 0.00 0.00 174.74 175.66 1ywk s LYS 1134N -2.26 3.66 0.23 2.88 2.20 -1.26 -4.49 119.74 120.70 1ywk s LYS 1134Ca 0.14 -0.50 0.08 0.00 -0.36 0.00 0.00 55.97 55.33 1ywk s LYS 1134Cb -0.09 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 1ywk s LYS 1134CO 0.07 -0.27 0.08 0.71 -0.36 0.00 0.00 175.35 175.58 1ywk s TYR 1135N 1.67 2.91 0.55 4.03 1.51 -1.26 -4.98 117.35 121.78 1ywk s TYR 1135Ca 0.06 -0.15 -0.21 0.00 -1.01 0.00 0.00 57.07 55.77 1ywk s TYR 1135Cb -0.16 -1.33 -0.05 0.00 -0.11 0.00 0.00 41.96 40.31 1ywk s TYR 1135CO 0.07 0.56 1.26 -1.25 -1.11 0.00 0.00 175.55 175.08 1ywk s PRO 1136N -3.54 3.20 0.27 -1.71 0.04 -1.26 -4.16 135.00 127.84 1ywk s PRO 1136Ca 0.31 1.97 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 1ywk s PRO 1136Cb -0.08 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 1ywk s PRO 1136CO 0.22 -1.06 1.10 -0.80 0.04 0.00 0.00 177.00 176.50 1ywk s ASN 1137N -1.30 7.27 -0.05 6.66 0.01 -1.26 -4.65 114.94 121.63 1ywk s ASN 1137Ca 0.72 2.24 -0.02 0.00 -0.71 0.00 0.00 52.86 55.10 1ywk s ASN 1137Cb -0.34 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 38.73 1ywk s ASN 1137CO 0.39 -0.15 0.09 0.54 -1.51 0.00 0.00 177.10 176.46 1ywk s VAL 1138N -1.04 -0.10 0.30 1.60 0.11 -0.39 -4.99 120.40 115.90 1ywk s VAL 1138Ca 0.45 0.27 -0.28 0.00 -2.93 0.00 0.00 61.98 59.50 1ywk s VAL 1138Cb -0.32 -0.17 -0.09 0.00 -1.53 0.00 0.00 36.38 34.27 1ywk s VAL 1138CO 0.40 0.11 0.98 -0.75 -3.33 0.00 0.00 175.10 172.51 1ywk s LYS 1139N 1.50 4.63 -0.09 1.54 2.20 -1.26 -1.40 119.74 126.86 1ywk s LYS 1139Ca -0.04 1.47 0.03 0.00 -0.36 0.00 0.00 55.97 57.07 1ywk s LYS 1139Cb -0.12 -2.98 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 1ywk s LYS 1139CO -0.04 0.30 -0.20 0.42 -0.36 0.00 0.00 175.35 175.47 1ywk s ILE 1140N -1.42 1.77 -0.07 5.43 1.01 -0.68 -4.96 121.20 122.29 1ywk s ILE 1140Ca 0.47 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 60.32 1ywk s ILE 1140Cb -0.23 -1.56 -0.00 0.00 0.01 0.00 0.00 42.46 40.68 1ywk s ILE 1140CO 0.29 0.50 -0.21 -0.44 0.00 0.00 0.00 174.94 175.08 1ywk s SER 1141N 0.48 2.71 0.25 3.58 0.01 -1.26 0.46 113.70 119.93 1ywk s SER 1141Ca -0.17 -0.47 0.06 0.00 1.31 0.00 0.00 55.95 56.68 1ywk s SER 1141Cb -0.17 -1.03 0.71 0.00 0.21 0.00 0.00 66.02 65.73 1ywk s SER 1141CO 0.06 0.16 1.18 -0.38 0.41 0.00 0.00 173.24 174.68 1ywk n ILE 1142N 3.36 -0.32 -0.01 1.44 -0.00 -1.25 -1.41 119.36 121.17 1ywk n ILE 1142Ca -0.19 1.62 -0.01 0.00 -0.00 0.00 0.00 62.75 64.17 1ywk n ILE 1142Cb 0.53 -2.44 -0.01 0.00 -0.00 0.00 0.00 39.64 37.72 1ywk n ILE 1142CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 1ywk h ASP 1143N 0.00 -0.12 0.00 4.38 3.32 -1.95 -1.13 116.42 120.92 1ywk h ASP 1143Ca 0.51 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.58 1ywk h ASP 1143Cb 1.17 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1ywk h ASP 1143CO -0.67 -0.03 0.05 -1.84 -1.72 0.00 0.00 179.24 175.03 1ywk n GLU 1144N -2.90 0.00 -4.21 3.56 0.28 -0.50 -4.51 120.64 112.36 1ywk n GLU 1144Ca -0.00 0.08 -0.34 0.00 -0.16 0.00 0.00 57.16 56.73 1ywk n GLU 1144Cb 0.02 -1.55 -0.11 0.00 1.43 0.00 0.00 31.44 31.24 1ywk n GLU 1144CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1ywk s ILE 1145N -1.87 4.36 -0.59 3.84 1.01 -0.43 -5.03 121.20 122.50 1ywk s ILE 1145Ca 0.00 -0.19 -0.19 0.00 0.00 0.00 0.00 60.65 60.27 1ywk s ILE 1145Cb 0.00 -2.93 0.10 0.00 0.01 0.00 0.00 42.46 39.64 1ywk s ILE 1145CO 0.00 0.49 0.71 0.42 0.00 0.00 0.00 174.94 176.55 1ywk s THR 1146N 0.25 4.81 -0.21 2.92 -4.23 -1.26 -5.00 115.64 112.92 1ywk s THR 1146Ca 0.01 -0.94 -0.28 0.00 -1.18 0.00 0.00 61.69 59.30 1ywk s THR 1146Cb -0.13 -4.48 -0.05 0.00 1.34 0.00 0.00 72.50 69.18 1ywk s THR 1146CO 0.02 -1.11 2.13 -2.16 -0.54 0.00 0.00 174.62 172.95 1ywk s PRO 1147N 2.72 3.26 -1.15 3.99 0.04 -1.26 -4.82 135.00 137.79 1ywk s PRO 1147Ca 0.12 1.99 -0.21 0.00 0.04 0.00 0.00 61.00 62.94 1ywk s PRO 1147Cb -0.24 -4.32 0.06 0.00 0.04 0.00 0.00 34.50 30.04 1ywk s PRO 1147CO 0.07 -1.95 1.58 1.41 0.04 0.00 0.00 177.00 178.14 1ywk s MET 1148N 6.05 3.77 0.46 4.56 1.75 -0.61 -4.77 119.30 130.52 1ywk s MET 1148Ca 0.96 -1.52 -0.21 0.00 -1.25 0.00 0.00 55.69 53.67 1ywk s MET 1148Cb -0.32 -5.44 -0.09 0.00 2.84 0.00 0.00 34.83 31.81 1ywk s MET 1148CO 0.35 -2.23 1.01 -1.83 -0.65 0.00 0.00 175.02 171.67 1ywk s GLU 1149N 4.64 3.97 0.04 4.11 -1.05 -1.26 -3.74 118.70 125.41 1ywk s GLU 1149Ca 0.50 1.29 -0.01 0.00 -0.15 0.00 0.00 54.97 56.60 1ywk s GLU 1149Cb 0.02 -2.16 0.00 0.00 -0.44 0.00 0.00 34.13 31.56 1ywk s GLU 1149CO -0.02 -0.28 0.08 0.25 0.95 0.00 0.00 175.26 176.25 1ywk n THR 1150N -0.79 0.00 -0.06 1.83 -2.24 -1.07 -5.00 114.28 106.95 1ywk n THR 1150Ca 0.08 -0.15 0.01 0.00 -2.27 0.00 0.00 64.05 61.72 1ywk n THR 1150Cb 0.53 0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.88 1ywk n THR 1150CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ywk n GLY 1151N -0.06 -2.04 3.09 3.38 0.00 -1.26 -2.53 105.19 105.76 1ywk n GLY 1151Ca -0.01 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 1ywk n GLY 1151CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ywk s ASP 1152N -4.99 -0.24 0.27 1.61 2.15 -1.25 -4.60 116.67 109.62 1ywk s ASP 1152Ca 0.00 0.47 0.14 0.00 0.43 0.00 0.00 52.55 53.59 1ywk s ASP 1152Cb 0.00 0.44 0.77 0.00 -0.30 0.00 0.00 42.92 43.82 1ywk s ASP 1152CO 0.00 -0.11 1.36 -0.81 -0.17 0.00 0.00 175.17 175.45 1ywk n PRO 1153N 3.36 0.09 0.20 4.34 -0.04 -1.26 0.85 135.00 142.54 1ywk n PRO 1153Ca -0.17 0.56 0.09 0.00 -0.04 0.00 0.00 63.50 63.95 1ywk n PRO 1153Cb 0.57 -1.97 0.19 0.00 -0.04 0.00 0.00 33.50 32.25 1ywk n PRO 1153CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1ywk h LEU 1154N 0.00 0.00 -3.08 1.53 5.85 -1.95 -3.06 115.31 114.60 1ywk h LEU 1154Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1ywk h LEU 1154Cb 0.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1ywk h LEU 1154CO 0.00 0.19 -0.15 0.35 -0.34 0.00 0.00 178.44 178.49 1ywk n THR 1155N -3.17 2.11 -4.47 1.05 -2.24 0.25 -4.99 114.28 102.82 1ywk n THR 1155Ca 0.03 -2.55 -0.40 0.00 -2.27 0.00 0.00 64.05 58.86 1ywk n THR 1155Cb 0.57 -0.25 -0.08 0.00 -2.10 0.00 0.00 70.33 68.47 1ywk n THR 1155CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ywk n LEU 1156N -1.19 -0.92 -1.30 3.22 4.77 -0.81 -4.80 117.00 115.97 1ywk n LEU 1156Ca 0.20 -1.24 0.04 0.00 -0.03 0.00 0.00 56.01 54.98 1ywk n LEU 1156Cb 0.74 -1.63 0.05 0.00 -2.33 0.00 0.00 43.42 40.25 1ywk n LEU 1156CO 0.04 0.19 0.12 -0.46 -1.33 0.00 0.00 177.39 175.95 1ywk n ASN 1157N -2.57 1.10 -4.56 -1.43 6.94 -1.14 0.11 115.26 113.71 1ywk n ASN 1157Ca 0.01 -2.34 -0.39 0.00 -0.02 0.00 0.00 54.58 51.84 1ywk n ASN 1157Cb 0.51 -0.34 -0.03 0.00 -2.36 0.00 0.00 39.78 37.56 1ywk n ASN 1157CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 1ywk s GLN 1158N -0.58 2.78 0.06 -3.83 2.00 -1.26 -3.92 119.66 114.91 1ywk s GLN 1158Ca 0.34 0.88 -0.04 0.00 -2.00 0.00 0.00 55.36 54.53 1ywk s GLN 1158Cb 0.37 -4.35 -0.02 0.00 0.80 0.00 0.00 33.01 29.81 1ywk s GLN 1158CO -0.15 -2.54 0.05 -0.98 -0.50 0.00 0.00 175.29 171.18 1ywk s ARG 1159N 6.75 0.66 -0.20 1.67 1.70 -1.05 -0.68 118.95 127.80 1ywk s ARG 1159Ca 0.72 -1.06 -0.02 0.00 -0.47 0.00 0.00 55.73 54.90 1ywk s ARG 1159Cb -0.15 0.25 -0.00 0.00 -0.57 0.00 0.00 34.95 34.47 1ywk s ARG 1159CO 0.24 -0.16 -0.10 0.15 -1.08 0.00 0.00 175.30 174.36 1ywk s LYS 1160N -3.64 3.26 -0.13 3.89 1.02 -0.83 -2.60 119.74 120.71 1ywk s LYS 1160Ca 0.04 -0.69 -0.06 0.00 0.02 0.00 0.00 55.97 55.27 1ywk s LYS 1160Cb 0.05 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1ywk s LYS 1160CO -0.09 -0.16 0.10 0.96 -0.92 0.00 0.00 175.35 175.24 1ywk s ILE 1161N 1.30 5.15 -0.24 2.17 -4.36 -1.25 -1.74 121.20 122.23 1ywk s ILE 1161Ca 0.04 0.08 0.02 0.00 -0.26 0.00 0.00 60.65 60.53 1ywk s ILE 1161Cb -0.14 -3.26 0.05 0.00 1.25 0.00 0.00 42.46 40.36 1ywk s ILE 1161CO -0.05 0.57 -0.12 -0.31 0.24 0.00 0.00 174.94 175.27 1ywk s TYR 1162N -0.63 3.13 -0.42 1.37 1.51 0.26 -1.57 117.35 121.00 1ywk s TYR 1162Ca 0.12 -2.08 -0.29 0.00 -1.01 0.00 0.00 57.07 53.81 1ywk s TYR 1162Cb -0.12 -1.94 0.02 0.00 -0.11 0.00 0.00 41.96 39.80 1ywk s TYR 1162CO 0.02 -0.85 1.29 -0.65 -1.11 0.00 0.00 175.55 174.25 1ywk s GLN 1163N 1.17 3.69 -0.03 -0.62 -1.52 -1.26 -0.92 119.66 120.16 1ywk s GLN 1163Ca -0.05 0.84 -0.03 0.00 -1.95 0.00 0.00 55.36 54.18 1ywk s GLN 1163Cb -0.18 -3.96 -0.01 0.00 -0.22 0.00 0.00 33.01 28.65 1ywk s GLN 1163CO -0.07 -1.43 -0.05 0.66 -0.25 0.00 0.00 175.29 174.15 1ywk n TYR 1164N 8.26 0.06 -3.17 0.91 4.01 -0.88 -4.72 117.16 121.63 1ywk n TYR 1164Ca 0.15 0.02 -0.45 0.00 -0.16 0.00 0.00 57.90 57.45 1ywk n TYR 1164Cb 0.48 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 39.31 1ywk n TYR 1164CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ywk s ILE 1165N -1.31 5.13 0.04 -0.72 -1.09 -1.09 -4.66 121.20 117.49 1ywk s ILE 1165Ca -0.05 -1.73 -0.17 0.00 -2.23 0.00 0.00 60.65 56.47 1ywk s ILE 1165Cb 0.01 -4.53 0.03 0.00 -1.58 0.00 0.00 42.46 36.38 1ywk s ILE 1165CO 0.07 -1.15 0.39 -2.28 -1.23 0.00 0.00 174.94 170.74 1ywk s HIS 1166N 1.64 -0.24 0.48 3.97 2.46 -1.26 -1.79 115.29 120.54 1ywk s HIS 1166Ca 0.18 0.21 0.26 0.00 0.47 0.00 0.00 55.06 56.18 1ywk s HIS 1166Cb -0.15 0.19 1.31 0.00 -0.13 0.00 0.00 32.58 33.80 1ywk s HIS 1166CO -0.03 -0.55 1.85 -1.35 -2.47 0.00 0.00 174.74 172.19 1ywk h PRO 1167N 3.12 0.18 0.00 2.88 0.11 -1.93 0.05 132.00 136.41 1ywk h PRO 1167Ca -0.31 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1ywk h PRO 1167Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ywk h PRO 1167CO 0.43 0.12 0.00 0.09 -0.21 0.00 0.00 178.00 178.44 1ywk n ASN 1168N -4.39 0.66 0.00 -2.05 3.02 -1.26 -3.55 115.26 107.68 1ywk n ASN 1168Ca 0.21 0.70 0.00 0.00 -0.03 0.00 0.00 54.58 55.46 1ywk n ASN 1168Cb 0.91 -0.82 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1ywk n ASN 1168CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1ywk n VAL 1169N -2.26 0.00 -3.60 2.41 3.14 -0.20 -5.12 118.33 112.70 1ywk n VAL 1169Ca 0.01 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.35 1ywk n VAL 1169Cb 0.18 0.22 -0.02 0.00 -1.06 0.00 0.00 33.84 33.16 1ywk n VAL 1169CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ywk s GLU 1171N -2.61 3.55 -0.11 0.00 2.02 -1.26 -3.60 118.70 116.69 1ywk s GLU 1171Ca 0.10 -0.03 -0.30 0.00 0.02 0.00 0.00 54.97 54.76 1ywk s GLU 1171Cb 0.00 -2.54 0.12 0.00 0.10 0.00 0.00 34.13 31.81 1ywk s GLU 1171CO -0.05 0.03 0.99 -1.54 0.02 0.00 0.00 175.26 174.71 1ywk s SER 1172N -3.82 -0.33 0.02 -0.19 1.04 -1.26 -4.90 113.70 104.26 1ywk s SER 1172Ca 0.44 0.21 -0.25 0.00 0.48 0.00 0.00 55.95 56.83 1ywk s SER 1172Cb -0.10 0.31 -0.18 0.00 0.10 0.00 0.00 66.02 66.14 1ywk s SER 1172CO 0.37 -0.42 1.46 0.00 0.98 0.00 0.00 173.24 175.63 1ywk n GLN 1174N -4.95 2.21 -1.79 0.00 10.64 -1.26 -5.07 117.38 117.16 1ywk n GLN 1174Ca -0.08 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 54.71 1ywk n GLN 1174Cb 0.16 -0.18 0.04 0.00 -0.86 0.00 0.00 30.24 29.40 1ywk n GLN 1174CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 1ywk s LEU 1175N 0.00 3.85 -0.12 2.61 2.96 -1.26 -4.34 118.68 122.38 1ywk s LEU 1175Ca 0.00 2.75 -0.05 0.00 -0.22 0.00 0.00 54.13 56.62 1ywk s LEU 1175Cb 0.00 -4.28 0.06 0.00 0.50 0.00 0.00 46.19 42.47 1ywk s LEU 1175CO 0.00 -1.57 0.25 -1.10 -1.32 0.00 0.00 176.35 172.62 1ywk s GLN 1176N -2.91 0.16 0.13 1.98 -1.52 -0.49 -4.80 119.66 112.20 1ywk s GLN 1176Ca 0.72 0.68 0.06 0.00 -1.95 0.00 0.00 55.36 54.87 1ywk s GLN 1176Cb -0.40 -0.07 -0.04 0.00 -0.22 0.00 0.00 33.01 32.28 1ywk s GLN 1176CO 0.47 -0.25 -0.15 -1.64 -0.25 0.00 0.00 175.29 173.47 1ywk s MET 1177N 2.09 1.05 0.06 2.91 -1.94 -0.74 -0.89 119.30 121.85 1ywk s MET 1177Ca -0.02 -1.25 -0.17 0.00 -1.71 0.00 0.00 55.69 52.55 1ywk s MET 1177Cb -0.12 -0.98 0.03 0.00 2.01 0.00 0.00 34.83 35.78 1ywk s MET 1177CO -0.08 0.19 0.39 0.20 -0.01 0.00 0.00 175.02 175.70 1ywk s GLY 1178N -2.44 -0.24 -0.13 -0.03 0.00 -0.25 -2.06 107.32 102.17 1ywk s GLY 1178Ca 0.09 0.16 0.02 0.00 0.00 0.00 0.00 44.72 44.99 1ywk s GLY 1178CO 0.03 -0.09 -0.19 -0.47 0.00 0.00 0.00 173.10 172.38 1ywk s TYR 1179N -2.80 2.43 -0.07 1.90 6.04 -0.10 -1.29 117.35 123.46 1ywk s TYR 1179Ca -0.03 -1.22 0.02 0.00 0.04 0.00 0.00 57.07 55.88 1ywk s TYR 1179Cb -0.00 -1.68 0.01 0.00 -1.04 0.00 0.00 41.96 39.25 1ywk s TYR 1179CO -0.05 -0.58 -0.13 0.99 -1.54 0.00 0.00 175.55 174.24 1ywk s THR 1180N 0.92 1.20 -0.18 4.34 2.01 0.42 0.91 115.64 125.27 1ywk s THR 1180Ca -0.06 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.43 1ywk s THR 1180Cb -0.15 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.28 1ywk s THR 1180CO -0.03 0.37 -0.18 0.27 -0.69 0.00 0.00 174.62 174.36 1ywk s ILE 1181N 0.63 2.23 -0.23 1.82 -4.36 -0.71 -0.20 121.20 120.38 1ywk s ILE 1181Ca -0.15 -0.89 -0.29 0.00 -0.26 0.00 0.00 60.65 59.06 1ywk s ILE 1181Cb -0.16 -1.94 0.00 0.00 1.25 0.00 0.00 42.46 41.62 1ywk s ILE 1181CO 0.04 0.53 1.12 -0.76 0.24 0.00 0.00 174.94 176.10 1ywk s LEU 1182N 1.20 4.08 0.42 0.37 2.01 0.18 -1.97 118.68 124.98 1ywk s LEU 1182Ca 0.02 1.39 -0.25 0.00 0.01 0.00 0.00 54.13 55.31 1ywk s LEU 1182Cb -0.14 -3.54 -0.08 0.00 0.01 0.00 0.00 46.19 42.44 1ywk s LEU 1182CO -0.09 -0.75 1.20 -0.70 1.01 0.00 0.00 176.35 177.02 1ywk s GLU 1183N 3.40 3.91 0.10 1.70 -6.30 0.14 -4.13 118.70 117.52 1ywk s GLU 1183Ca 0.48 1.90 -0.36 0.00 -2.50 0.00 0.00 54.97 54.49 1ywk s GLU 1183Cb -0.16 -2.60 -0.18 0.00 0.00 0.00 0.00 34.13 31.19 1ywk s GLU 1183CO 0.11 -0.46 1.10 -2.30 0.02 0.00 0.00 175.26 173.73 1ywk n PRO 1184N -0.12 0.64 -0.55 4.30 -0.02 -1.26 -2.16 135.00 135.83 1ywk n PRO 1184Ca 0.05 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1ywk n PRO 1184Cb 0.46 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1ywk n PRO 1184CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ywk n GLY 1185N 1.97 0.68 3.08 -1.23 0.00 -1.26 -5.03 105.19 103.39 1ywk n GLY 1185Ca 0.18 -0.41 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 1ywk n GLY 1185CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ywk s SER 1186N -2.37 0.38 0.00 1.61 0.01 -0.92 -4.60 113.70 107.81 1ywk s SER 1186Ca 0.00 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.44 1ywk s SER 1186Cb 0.00 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1ywk s SER 1186CO 0.00 -0.53 0.51 0.00 0.41 0.00 0.00 173.24 173.63 1ywk n ALA 1187N 0.49 2.03 -2.53 1.44 0.00 0.12 -4.29 120.51 117.77 1ywk n ALA 1187Ca -0.17 -0.05 -0.24 0.00 0.00 0.00 0.00 53.44 52.99 1ywk n ALA 1187Cb 0.60 -0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.95 1ywk n ALA 1187CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1ywk s TRP 1188N 0.00 2.66 -0.10 0.00 0.52 -0.89 -0.43 118.94 120.70 1ywk s TRP 1188Ca 0.00 -0.39 0.15 0.00 0.02 0.00 0.00 56.10 55.88 1ywk s TRP 1188Cb 0.00 -1.58 0.23 0.00 -1.15 0.00 0.00 33.47 30.97 1ywk s TRP 1188CO 0.00 0.39 1.11 0.09 0.02 0.00 0.00 176.95 178.57 1ywk n ASN 1189N -1.08 2.08 -3.68 2.95 3.02 -1.10 -4.83 115.26 112.62 1ywk n ASN 1189Ca -0.04 -2.86 -0.10 0.00 -0.03 0.00 0.00 54.58 51.56 1ywk n ASN 1189Cb 0.61 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 1ywk n ASN 1189CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1ywk s THR 1190N -2.40 0.01 -0.91 3.41 -1.32 -1.26 -4.63 115.64 108.53 1ywk s THR 1190Ca 0.26 -0.61 -0.23 0.00 -1.21 0.00 0.00 61.69 59.90 1ywk s THR 1190Cb 0.22 -1.51 -0.23 0.00 -1.51 0.00 0.00 72.50 69.47 1ywk s THR 1190CO 0.02 -0.06 2.47 0.80 -2.21 0.00 0.00 174.62 175.65 1ywk n MET 1200N -0.38 0.19 -4.35 7.08 0.00 -1.26 -4.94 117.12 113.45 1ywk n MET 1200Ca -0.11 -0.08 -0.19 0.00 -0.00 0.00 0.00 57.70 57.33 1ywk n MET 1200Cb 0.62 -1.80 -0.10 0.00 0.00 0.00 0.00 33.22 31.94 1ywk n MET 1200CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1ywk s GLU 1201N 8.29 1.35 -0.06 2.12 2.02 -0.57 -2.75 118.70 129.10 1ywk s GLU 1201Ca 1.26 -1.58 -0.00 0.00 0.02 0.00 0.00 54.97 54.66 1ywk s GLU 1201Cb -0.89 -1.19 0.03 0.00 0.10 0.00 0.00 34.13 32.17 1ywk s GLU 1201CO 0.45 0.21 -0.01 0.00 0.02 0.00 0.00 175.26 175.92 1ywk s ALA 1202N -2.83 0.66 0.05 5.21 0.00 0.19 -0.34 121.76 124.69 1ywk s ALA 1202Ca 0.22 -0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.14 1ywk s ALA 1202Cb -0.02 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1ywk s ALA 1202CO 0.07 -0.28 -0.00 0.71 0.00 0.00 0.00 175.76 176.26 1ywk s TYR 1203N 1.54 3.02 -0.07 0.00 1.51 0.28 -1.85 117.35 121.78 1ywk s TYR 1203Ca -0.02 0.02 -0.01 0.00 -1.01 0.00 0.00 57.07 56.05 1ywk s TYR 1203Cb -0.13 -1.60 0.03 0.00 -0.11 0.00 0.00 41.96 40.15 1ywk s TYR 1203CO -0.03 0.46 0.01 0.54 -1.11 0.00 0.00 175.55 175.42 1ywk s VAL 1204N -1.20 0.33 -0.07 0.71 0.11 -0.91 0.31 120.40 119.68 1ywk s VAL 1204Ca 0.23 0.14 -0.05 0.00 -2.93 0.00 0.00 61.98 59.37 1ywk s VAL 1204Cb -0.12 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.19 1ywk s VAL 1204CO 0.14 0.24 0.16 -0.31 -3.33 0.00 0.00 175.10 172.00 1ywk s TYR 1205N 1.99 3.57 0.29 1.54 1.51 -0.57 -1.31 117.35 124.38 1ywk s TYR 1205Ca 0.05 0.45 -0.10 0.00 -1.01 0.00 0.00 57.07 56.45 1ywk s TYR 1205Cb -0.12 -1.89 0.04 0.00 -0.11 0.00 0.00 41.96 39.88 1ywk s TYR 1205CO -0.05 0.69 0.57 1.97 -1.11 0.00 0.00 175.55 177.62 1ywk n PHE 1206N 1.49 -1.94 -3.57 2.71 1.16 -0.81 -0.20 117.46 116.29 1ywk n PHE 1206Ca -0.16 -1.43 -0.22 0.00 -1.87 0.00 0.00 57.45 53.78 1ywk n PHE 1206Cb 0.54 0.66 0.05 0.00 -1.61 0.00 0.00 39.48 39.12 1ywk n PHE 1206CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1ywk n ASP 1207N -1.43 -3.53 -4.00 5.98 10.43 -1.26 -1.78 116.55 120.96 1ywk n ASP 1207Ca -0.06 -0.83 -0.13 0.00 2.57 0.00 0.00 54.79 56.34 1ywk n ASP 1207Cb 0.44 -4.25 -0.12 0.00 1.84 0.00 0.00 41.12 39.02 1ywk n ASP 1207CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ywk s MET 1208N -5.55 0.41 0.68 -1.24 0.23 -1.26 -4.13 119.30 108.43 1ywk s MET 1208Ca 0.22 -0.49 -0.17 0.00 -1.03 0.00 0.00 55.69 54.22 1ywk s MET 1208Cb -0.06 -0.23 -0.06 0.00 -1.53 0.00 0.00 34.83 32.95 1ywk s MET 1208CO 0.80 0.05 0.45 0.39 -2.03 0.00 0.00 175.02 174.68 1ywk n GLU 1209N 2.08 0.33 -0.01 3.16 -0.58 -1.26 -4.84 120.64 119.52 1ywk n GLU 1209Ca -0.19 0.14 0.13 0.00 -0.42 0.00 0.00 57.16 56.82 1ywk n GLU 1209Cb 0.56 -1.72 0.56 0.00 -0.57 0.00 0.00 31.44 30.27 1ywk n GLU 1209CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1ywk h GLU 1210N -0.21 0.25 0.00 3.49 4.81 -2.01 -2.79 114.58 118.11 1ywk h GLU 1210Ca -0.45 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1ywk h GLU 1210Cb 1.37 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.69 1ywk h GLU 1210CO 0.43 0.16 -0.83 -0.25 -0.73 0.00 0.00 179.01 177.79 1ywk n ASP 1211N -4.46 0.81 -4.79 1.04 8.00 -1.26 -4.85 116.55 111.03 1ywk n ASP 1211Ca 0.07 -0.71 -0.35 0.00 0.71 0.00 0.00 54.79 54.52 1ywk n ASP 1211Cb 0.37 0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 42.16 1ywk n ASP 1211CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ywk s THR 1212N -3.01 3.91 0.01 -3.53 -4.23 -1.06 -5.04 115.64 102.70 1ywk s THR 1212Ca 0.09 1.31 -0.02 0.00 -1.18 0.00 0.00 61.69 61.88 1ywk s THR 1212Cb 0.16 -3.60 -0.01 0.00 1.34 0.00 0.00 72.50 70.39 1ywk s THR 1212CO 0.81 -0.14 0.02 0.00 -0.54 0.00 0.00 174.62 174.77 1ywk s ARG 1213N -2.88 0.36 0.00 3.99 1.70 -1.26 -4.59 118.95 116.26 1ywk s ARG 1213Ca 0.62 -0.53 0.03 0.00 -0.47 0.00 0.00 55.73 55.38 1ywk s ARG 1213Cb -0.17 0.14 -0.03 0.00 -0.57 0.00 0.00 34.95 34.31 1ywk s ARG 1213CO 0.21 -0.07 -0.05 0.96 -1.08 0.00 0.00 175.30 175.28 1ywk s ILE 1214N -1.40 3.77 -0.77 4.99 -5.25 -0.48 -1.20 121.20 120.86 1ywk s ILE 1214Ca -0.15 -0.73 -0.11 0.00 -0.99 0.00 0.00 60.65 58.67 1ywk s ILE 1214Cb -0.09 -2.65 0.20 0.00 2.95 0.00 0.00 42.46 42.87 1ywk s ILE 1214CO -0.00 0.39 0.68 -0.36 -1.79 0.00 0.00 174.94 173.86 1ywk s PHE 1215N -1.02 3.67 -0.39 1.37 0.40 0.23 -0.51 117.98 121.73 1ywk s PHE 1215Ca 0.18 -2.16 -0.29 0.00 -0.60 0.00 0.00 56.93 54.06 1ywk s PHE 1215Cb -0.11 -3.67 0.01 0.00 0.51 0.00 0.00 43.02 39.76 1ywk s PHE 1215CO 0.08 -0.95 1.36 -1.58 0.70 0.00 0.00 175.22 174.82 1ywk s HIS 1216N 0.13 2.51 0.36 0.36 2.46 -0.17 -2.33 115.29 118.62 1ywk s HIS 1216Ca 0.17 0.73 -0.25 0.00 0.47 0.00 0.00 55.06 56.18 1ywk s HIS 1216Cb -0.13 -4.22 -0.09 0.00 -0.13 0.00 0.00 32.58 28.01 1ywk s HIS 1216CO -0.07 -1.85 1.03 -1.64 -2.47 0.00 0.00 174.74 169.74 1ywk s MET 1217N 4.69 4.34 0.31 2.88 -1.94 0.04 -0.82 119.30 128.80 1ywk s MET 1217Ca 0.59 1.50 -0.16 0.00 -1.71 0.00 0.00 55.69 55.90 1ywk s MET 1217Cb -0.14 -2.69 0.03 0.00 2.01 0.00 0.00 34.83 34.04 1ywk s MET 1217CO 0.30 0.02 0.68 0.00 -0.01 0.00 0.00 175.02 176.01 1ywk s MET 1218N -2.25 1.91 0.00 2.03 0.23 0.76 -4.23 119.30 117.75 1ywk s MET 1218Ca 0.54 -1.24 0.00 0.00 -1.03 0.00 0.00 55.69 53.96 1ywk s MET 1218Cb -0.22 0.58 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 1ywk s MET 1218CO 0.28 -0.86 0.00 0.41 -2.03 0.00 0.00 175.02 172.82 1ywk n GLY 1219N -0.48 0.79 3.71 3.16 0.00 -1.26 -0.35 105.19 110.76 1ywk n GLY 1219Ca -0.05 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 1ywk n GLY 1219CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ywk n LYS 1220N 1.07 2.00 0.04 1.61 4.81 -1.24 -1.51 118.16 124.93 1ywk n LYS 1220Ca 0.00 0.71 0.22 0.00 -0.87 0.00 0.00 58.31 58.37 1ywk n LYS 1220Cb 0.00 -2.41 0.67 0.00 0.02 0.00 0.00 35.03 33.31 1ywk n LYS 1220CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1ywk h PRO 1221N 2.17 0.00 0.00 1.64 0.13 -1.92 0.15 132.00 134.16 1ywk h PRO 1221Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1ywk h PRO 1221Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1ywk h PRO 1221CO 0.60 0.00 -0.76 -0.44 -0.23 0.00 0.00 178.00 177.17 1ywk h ASP 1222N 0.00 0.00 -1.91 1.44 3.32 -1.98 -3.38 116.42 113.91 1ywk h ASP 1222Ca 0.25 -0.20 -0.52 0.00 0.02 0.00 0.00 57.03 56.58 1ywk h ASP 1222Cb 1.51 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.65 1ywk h ASP 1222CO -0.00 0.10 -0.91 -0.62 -1.72 0.00 0.00 179.24 176.09 1ywk n GLU 1223N -2.20 2.25 -2.50 3.56 1.02 0.49 -5.10 120.64 118.17 1ywk n GLU 1223Ca 0.02 -4.11 -0.35 0.00 -0.02 0.00 0.00 57.16 52.70 1ywk n GLU 1223Cb 0.46 -1.94 -0.03 0.00 -0.02 0.00 0.00 31.44 29.91 1ywk n GLU 1223CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1ywk s THR 1224N -3.79 3.68 0.26 2.62 -4.23 -1.09 -4.08 115.64 109.01 1ywk s THR 1224Ca 0.43 1.08 -0.01 0.00 -1.18 0.00 0.00 61.69 62.01 1ywk s THR 1224Cb 0.34 -3.45 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 1ywk s THR 1224CO -0.10 -0.19 0.27 -0.54 -0.54 0.00 0.00 174.62 173.51 1ywk s LYS 1225N -3.14 1.49 0.09 3.99 1.02 0.53 -4.96 119.74 118.76 1ywk s LYS 1225Ca 0.67 -1.69 0.00 0.00 0.02 0.00 0.00 55.97 54.98 1ywk s LYS 1225Cb -0.18 0.34 -0.04 0.00 -0.52 0.00 0.00 37.83 37.42 1ywk s LYS 1225CO 0.22 -0.55 -0.04 -3.38 -0.92 0.00 0.00 175.35 170.68 1ywk s HIS 1226N -3.80 0.77 -0.12 3.18 -3.43 -1.26 -0.17 115.29 110.46 1ywk s HIS 1226Ca 0.36 -1.00 0.03 0.00 -0.80 0.00 0.00 55.06 53.64 1ywk s HIS 1226Cb 0.04 -0.48 -0.00 0.00 -1.43 0.00 0.00 32.58 30.71 1ywk s HIS 1226CO 0.17 -0.27 -0.21 -0.51 -2.00 0.00 0.00 174.74 171.92 1ywk s LEU 1227N -3.01 2.22 -0.34 5.38 1.43 -0.00 -4.94 118.68 119.42 1ywk s LEU 1227Ca 0.12 -0.52 -0.22 0.00 -1.03 0.00 0.00 54.13 52.48 1ywk s LEU 1227Cb 0.07 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.83 1ywk s LEU 1227CO -0.06 0.14 0.70 -0.69 0.23 0.00 0.00 176.35 176.68 1ywk s VAL 1228N 0.46 4.84 0.04 -1.59 1.01 -1.26 -1.00 120.40 122.90 1ywk s VAL 1228Ca -0.15 0.83 0.05 0.00 0.00 0.00 0.00 61.98 62.71 1ywk s VAL 1228Cb -0.17 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 1ywk s VAL 1228CO 0.06 -0.30 -0.11 -0.04 0.00 0.00 0.00 175.10 174.71 1ywk s MET 1229N 2.84 2.30 0.60 2.72 1.00 0.33 -4.96 119.30 124.13 1ywk s MET 1229Ca 0.28 -0.88 0.09 0.00 0.00 0.00 0.00 55.69 55.18 1ywk s MET 1229Cb -0.14 -2.36 0.10 0.00 0.00 0.00 0.00 34.83 32.43 1ywk s MET 1229CO 0.14 0.56 0.83 -1.12 0.00 0.00 0.00 175.02 175.43 1ywk s SER 1230N -1.64 4.99 0.36 3.03 0.01 -1.26 -1.38 113.70 117.80 1ywk s SER 1230Ca 0.18 -0.82 -0.28 0.00 1.31 0.00 0.00 55.95 56.33 1ywk s SER 1230Cb -0.11 0.32 -0.10 0.00 0.21 0.00 0.00 66.02 66.34 1ywk s SER 1230CO 0.09 -1.43 1.38 0.21 0.41 0.00 0.00 173.24 173.89 1ywk s ASN 1231N -4.69 6.55 -1.31 2.44 2.47 -1.26 -3.17 114.94 115.96 1ywk s ASN 1231Ca 0.63 2.83 -0.05 0.00 0.42 0.00 0.00 52.86 56.69 1ywk s ASN 1231Cb -0.05 -2.66 0.01 0.00 -1.45 0.00 0.00 41.25 37.10 1ywk s ASN 1231CO 0.40 -0.71 0.63 -0.62 -3.72 0.00 0.00 177.10 173.09 1ywk n GLU 1232N 0.58 -4.82 -4.32 0.43 1.02 0.72 -4.98 120.64 109.27 1ywk n GLU 1232Ca 0.01 0.77 -0.27 0.00 -0.02 0.00 0.00 57.16 57.65 1ywk n GLU 1232Cb 0.41 -5.40 -0.10 0.00 -0.02 0.00 0.00 31.44 26.33 1ywk n GLU 1232CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1ywk s GLN 1233N -5.67 1.90 0.16 3.49 -0.21 -1.15 -3.80 119.66 114.38 1ywk s GLN 1233Ca 0.31 -1.31 0.10 0.00 0.02 0.00 0.00 55.36 54.49 1ywk s GLN 1233Cb -0.14 -2.08 -0.04 0.00 1.00 0.00 0.00 33.01 31.75 1ywk s GLN 1233CO 0.39 0.43 -0.22 0.00 -2.12 0.00 0.00 175.29 173.77 1ywk s ALA 1234N -1.60 2.23 -0.03 6.09 0.00 -0.65 -1.52 121.76 126.27 1ywk s ALA 1234Ca 0.23 -1.50 0.05 0.00 0.00 0.00 0.00 51.96 50.74 1ywk s ALA 1234Cb -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 1ywk s ALA 1234CO 0.13 0.38 -0.18 0.00 0.00 0.00 0.00 175.76 176.09 1ywk s ALA 1235N -1.59 1.59 -0.16 0.00 0.00 0.15 -0.07 121.76 121.68 1ywk s ALA 1235Ca 0.16 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1ywk s ALA 1235Cb -0.08 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 1ywk s ALA 1235CO 0.07 0.33 0.36 0.42 0.00 0.00 0.00 175.76 176.95 1ywk s ILE 1236N -0.17 5.26 -0.32 0.00 1.01 0.01 -0.55 121.20 126.44 1ywk s ILE 1236Ca 0.01 0.69 0.03 0.00 0.00 0.00 0.00 60.65 61.37 1ywk s ILE 1236Cb -0.10 -3.70 0.09 0.00 0.01 0.00 0.00 42.46 38.76 1ywk s ILE 1236CO 0.01 0.35 0.03 -0.55 0.00 0.00 0.00 174.94 174.78 1ywk s SER 1237N 0.62 4.53 0.81 3.58 0.15 0.54 -4.84 113.70 119.08 1ywk s SER 1237Ca 0.19 -1.90 -0.12 0.00 0.70 0.00 0.00 55.95 54.82 1ywk s SER 1237Cb -0.14 -1.45 0.08 0.00 -1.71 0.00 0.00 66.02 62.81 1ywk s SER 1237CO 0.06 -0.35 1.16 -2.16 1.20 0.00 0.00 173.24 173.15 1ywk s PRO 1238N 1.09 1.74 0.25 5.44 0.04 -1.26 -1.51 135.00 140.79 1ywk s PRO 1238Ca 0.07 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 62.56 1ywk s PRO 1238Cb -0.19 -1.80 0.32 0.00 0.04 0.00 0.00 34.50 32.87 1ywk s PRO 1238CO -0.11 -2.10 1.56 0.77 0.04 0.00 0.00 177.00 177.17 1ywk h SER 1239N -1.01 -1.15 0.00 6.66 0.02 -1.95 0.20 113.55 116.32 1ywk h SER 1239Ca -0.45 0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1ywk h SER 1239Cb 1.27 0.67 0.00 0.00 0.14 0.00 0.00 62.40 64.48 1ywk h SER 1239CO 0.47 -0.30 0.00 -2.67 -1.14 0.00 0.00 176.83 173.19 1ywk n TRP 1240N -5.53 0.00 -4.30 3.45 4.27 -1.26 -4.70 117.44 109.37 1ywk n TRP 1240Ca 0.12 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.50 1ywk n TRP 1240Cb 0.44 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.31 1ywk n TRP 1240CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 1ywk s SER 1241N -1.37 4.45 0.62 -0.67 0.15 0.72 -3.73 113.70 113.86 1ywk s SER 1241Ca 0.03 -0.70 -0.16 0.00 0.70 0.00 0.00 55.95 55.83 1ywk s SER 1241Cb 0.02 -0.78 -0.02 0.00 -1.71 0.00 0.00 66.02 63.52 1ywk s SER 1241CO 0.03 -0.02 1.09 -0.63 1.20 0.00 0.00 173.24 174.90 1ywk s ILE 1242N -2.35 3.50 -0.14 6.45 -1.09 -0.57 -4.84 121.20 122.16 1ywk s ILE 1242Ca 0.32 0.72 0.01 0.00 -2.23 0.00 0.00 60.65 59.47 1ywk s ILE 1242Cb -0.06 -3.24 0.00 0.00 -1.58 0.00 0.00 42.46 37.58 1ywk s ILE 1242CO 0.20 -0.41 0.42 1.41 -1.23 0.00 0.00 174.94 175.32 1ywk n HIS 1243N -2.16 0.00 -2.00 3.97 8.25 -1.26 -4.47 115.22 117.55 1ywk n HIS 1243Ca 0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.27 1ywk n HIS 1243Cb 0.52 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.68 1ywk n HIS 1243CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1ywk s SER 1244N -0.37 5.36 -0.06 0.41 1.04 -1.26 -4.90 113.70 113.91 1ywk s SER 1244Ca 0.01 0.99 -0.29 0.00 0.48 0.00 0.00 55.95 57.14 1ywk s SER 1244Cb 0.01 -1.79 0.06 0.00 0.10 0.00 0.00 66.02 64.41 1ywk s SER 1244CO 0.03 -1.35 0.64 -0.83 0.98 0.00 0.00 173.24 172.70 1ywk s GLY 1245N -4.38 -0.53 -0.08 7.32 0.00 -1.26 -0.78 107.32 107.61 1ywk s GLY 1245Ca 0.58 1.23 0.03 0.00 0.00 0.00 0.00 44.72 46.56 1ywk s GLY 1245CO 0.50 0.89 -0.17 0.14 0.00 0.00 0.00 173.10 174.47 1ywk s VAL 1246N -1.13 2.79 0.20 1.40 1.01 -0.98 -2.71 120.40 120.98 1ywk s VAL 1246Ca -0.11 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1ywk s VAL 1246Cb -0.01 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1ywk s VAL 1246CO 0.09 0.56 0.26 -0.83 0.00 0.00 0.00 175.10 175.18 1ywk s GLY 1247N -0.14 1.50 0.41 4.51 0.00 0.43 0.74 107.32 114.76 1ywk s GLY 1247Ca -0.02 -1.20 0.22 0.00 0.00 0.00 0.00 44.72 43.72 1ywk s GLY 1247CO 0.04 -1.22 1.71 -0.84 0.00 0.00 0.00 173.10 172.78 1ywk h THR 1248N 1.55 0.50 -0.36 0.90 2.02 -1.50 -3.45 112.91 112.57 1ywk h THR 1248Ca -0.49 -1.33 0.00 0.00 0.77 0.00 0.00 66.41 65.35 1ywk h THR 1248Cb 1.21 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 1ywk h THR 1248CO 0.64 0.24 0.00 -0.24 0.37 0.00 0.00 175.52 176.52 1ywk n SER 1249N -3.27 0.00 -4.83 4.18 2.88 -1.26 -4.96 113.62 106.35 1ywk n SER 1249Ca 0.01 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.24 1ywk n SER 1249Cb 0.51 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.00 1ywk n SER 1249CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1ywk s ASN 1250N 1.69 5.82 -0.06 -3.46 0.02 -1.26 -4.62 114.94 113.07 1ywk s ASN 1250Ca 0.00 1.61 -0.31 0.00 -1.02 0.00 0.00 52.86 53.13 1ywk s ASN 1250Cb 0.00 -2.50 0.12 0.00 0.02 0.00 0.00 41.25 38.89 1ywk s ASN 1250CO 0.00 -1.14 1.19 -0.72 0.02 0.00 0.00 177.10 176.45 1ywk s TYR 1251N -2.90 -0.11 0.35 2.20 -0.85 -1.26 -4.61 117.35 110.17 1ywk s TYR 1251Ca 0.59 0.00 0.06 0.00 -0.52 0.00 0.00 57.07 57.20 1ywk s TYR 1251Cb -0.13 0.54 -0.07 0.00 0.38 0.00 0.00 41.96 42.68 1ywk s TYR 1251CO 0.48 -0.33 -0.00 -1.12 -1.52 0.00 0.00 175.55 173.06 1ywk s SER 1252N -2.64 3.19 -0.17 -0.18 0.01 -0.73 -0.64 113.70 112.54 1ywk s SER 1252Ca 0.11 -1.32 -0.29 0.00 1.31 0.00 0.00 55.95 55.77 1ywk s SER 1252Cb 0.02 -0.25 0.11 0.00 0.21 0.00 0.00 66.02 66.10 1ywk s SER 1252CO -0.04 -0.45 0.92 0.72 0.41 0.00 0.00 173.24 174.80 1ywk s PHE 1253N -2.93 -0.48 -0.21 2.43 -0.12 0.72 -1.93 117.98 115.45 1ywk s PHE 1253Ca 0.34 0.94 -0.05 0.00 -0.05 0.00 0.00 56.93 58.11 1ywk s PHE 1253Cb 0.08 0.41 -0.02 0.00 -0.63 0.00 0.00 43.02 42.85 1ywk s PHE 1253CO 0.16 -0.38 0.01 0.42 -0.05 0.00 0.00 175.22 175.38 1ywk s ILE 1254N -0.74 4.01 -0.12 -4.49 -1.09 -0.43 -0.43 121.20 117.91 1ywk s ILE 1254Ca -0.03 -0.29 -0.01 0.00 -2.23 0.00 0.00 60.65 58.09 1ywk s ILE 1254Cb -0.02 -2.82 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 1ywk s ILE 1254CO 0.02 0.41 -0.07 -1.66 -1.23 0.00 0.00 174.94 172.41 1ywk s TRP 1255N 1.10 2.94 -0.04 3.97 1.48 -0.41 -2.14 118.94 125.84 1ywk s TRP 1255Ca 0.03 -0.26 0.04 0.00 -1.06 0.00 0.00 56.10 54.85 1ywk s TRP 1255Cb -0.14 -1.84 -0.00 0.00 -1.16 0.00 0.00 33.47 30.33 1ywk s TRP 1255CO 0.02 0.06 -0.16 0.00 -4.06 0.00 0.00 176.95 172.81 1ywk s ALA 1256N -0.08 1.39 0.17 2.67 0.00 -0.77 -1.09 121.76 124.05 1ywk s ALA 1256Ca 0.00 -0.63 -0.07 0.00 0.00 0.00 0.00 51.96 51.26 1ywk s ALA 1256Cb -0.13 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 1ywk s ALA 1256CO 0.03 0.26 0.24 0.00 0.00 0.00 0.00 175.76 176.29 1ywk s MET 1257N -0.00 1.14 -0.01 0.00 0.23 -0.07 -0.64 119.30 119.95 1ywk s MET 1257Ca -0.02 -1.27 -0.30 0.00 -1.03 0.00 0.00 55.69 53.08 1ywk s MET 1257Cb -0.10 0.35 0.11 0.00 -1.53 0.00 0.00 34.83 33.65 1ywk s MET 1257CO 0.01 -0.40 1.06 0.00 -2.03 0.00 0.00 175.02 173.66 1ywk n GLY 1259N -0.31 -1.64 0.00 0.00 0.00 -1.26 -4.28 105.19 97.70 1ywk n GLY 1259Ca -0.06 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1ywk n GLY 1259CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50