#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pck s LYS 1003N 0.00 4.19 0.22 5.31 2.20 -1.26 -4.96 119.74 125.43 1pck s LYS 1003Ca 0.00 2.03 -0.30 0.00 -0.36 0.00 0.00 55.97 57.34 1pck s LYS 1003Cb 0.00 -3.93 -0.09 0.00 -1.51 0.00 0.00 37.83 32.31 1pck s LYS 1003CO 0.00 -0.82 1.23 0.12 -0.36 0.00 0.00 175.35 175.52 1pck s PHE 1004N 3.92 3.35 -0.07 4.03 2.19 -1.17 -4.72 117.98 125.51 1pck s PHE 1004Ca 0.68 1.40 -0.14 0.00 0.33 0.00 0.00 56.93 59.20 1pck s PHE 1004Cb -0.30 -3.49 -0.05 0.00 -1.31 0.00 0.00 43.02 37.87 1pck s PHE 1004CO 0.25 -1.40 0.35 -1.17 1.83 0.00 0.00 175.22 175.08 1pck s LEU 1005N -0.56 4.38 -0.25 6.12 2.96 -0.81 -0.34 118.68 130.17 1pck s LEU 1005Ca 0.52 0.76 0.00 0.00 -0.22 0.00 0.00 54.13 55.19 1pck s LEU 1005Cb -0.35 -2.47 0.07 0.00 0.50 0.00 0.00 46.19 43.95 1pck s LEU 1005CO 0.40 0.24 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.97 1pck s VAL 1006N -0.47 1.38 -0.31 1.68 1.01 -0.54 -0.84 120.40 122.31 1pck s VAL 1006Ca 0.21 -1.29 -0.14 0.00 0.00 0.00 0.00 61.98 60.76 1pck s VAL 1006Cb -0.15 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1pck s VAL 1006CO 0.09 -0.27 0.30 -0.63 0.00 0.00 0.00 175.10 174.59 1pck s ILE 1007N 1.44 5.23 0.01 2.22 1.01 0.13 -1.29 121.20 129.94 1pck s ILE 1007Ca -0.01 0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.67 1pck s ILE 1007Cb -0.18 -3.70 0.02 0.00 0.01 0.00 0.00 42.46 38.61 1pck s ILE 1007CO -0.10 0.07 0.27 0.00 0.00 0.00 0.00 174.94 175.19 1pck s ALA 1008N 1.91 -0.65 0.00 9.38 0.00 -0.52 -0.68 121.76 131.20 1pck s ALA 1008Ca 0.10 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1pck s ALA 1008Cb -0.16 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.12 1pck s ALA 1008CO 0.11 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1pck n GLY 1009N 1.05 1.09 3.77 0.00 0.00 -1.15 -1.32 105.19 108.63 1pck n GLY 1009Ca -0.21 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 1pck n GLY 1009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pck s PRO 1010N -2.00 4.14 0.16 1.61 0.04 -1.00 -1.32 135.00 136.62 1pck s PRO 1010Ca 0.00 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.86 1pck s PRO 1010Cb 0.00 -2.85 0.04 0.00 0.04 0.00 0.00 34.50 31.74 1pck s PRO 1010CO 0.00 -0.31 1.60 0.00 0.04 0.00 0.00 177.00 178.34 1pck s ALA 1012N -6.01 2.35 -1.33 0.00 0.00 -1.26 -1.51 121.76 114.00 1pck s ALA 1012Ca -0.15 -1.53 -0.17 0.00 0.00 0.00 0.00 51.96 50.11 1pck s ALA 1012Cb 0.13 -0.32 0.06 0.00 0.00 0.00 0.00 23.12 22.98 1pck s ALA 1012CO 0.68 0.44 1.85 -0.89 0.00 0.00 0.00 175.76 177.84 1pck n ILE 1013N 0.57 3.78 0.09 0.00 5.41 -0.59 -4.72 119.36 123.90 1pck n ILE 1013Ca -0.15 -3.80 0.03 0.00 1.00 0.00 0.00 62.75 59.83 1pck n ILE 1013Cb 0.55 -2.40 0.42 0.00 -0.71 0.00 0.00 39.64 37.49 1pck n ILE 1013CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1pck h GLU 1014N 7.28 0.31 -1.80 0.38 5.08 -1.96 -3.41 114.58 120.46 1pck h GLU 1014Ca 0.47 -0.05 0.20 0.00 -1.00 0.00 0.00 59.36 58.97 1pck h GLU 1014Cb 0.82 -0.05 -0.17 0.00 0.50 0.00 0.00 28.75 29.84 1pck h GLU 1014CO 1.55 0.35 0.68 -1.54 -1.00 0.00 0.00 179.01 179.05 1pck s SER 1015N -6.84 -0.23 0.37 1.42 1.04 -1.26 -5.00 113.70 103.20 1pck s SER 1015Ca -0.06 0.00 0.15 0.00 0.48 0.00 0.00 55.95 56.52 1pck s SER 1015Cb 0.16 0.24 0.72 0.00 0.10 0.00 0.00 66.02 67.24 1pck s SER 1015CO 0.73 -0.39 1.79 -0.08 0.98 0.00 0.00 173.24 176.27 1pck h GLU 1016N 2.00 0.00 -0.10 4.02 4.81 -1.96 -2.89 114.58 120.46 1pck h GLU 1016Ca -0.14 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1pck h GLU 1016Cb 1.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 1pck h GLU 1016CO 0.26 0.39 0.06 1.49 -0.73 0.00 0.00 179.01 180.48 1pck h GLU 1017N 0.00 0.14 -0.65 1.92 4.81 -1.99 -1.81 114.58 117.00 1pck h GLU 1017Ca -0.00 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 1pck h GLU 1017Cb 0.75 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.04 1pck h GLU 1017CO 0.05 0.18 0.32 1.25 -0.73 0.00 0.00 179.01 180.08 1pck h LEU 1018N 0.07 0.43 -0.55 1.64 5.85 -1.91 -1.60 115.31 119.24 1pck h LEU 1018Ca 0.04 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.81 1pck h LEU 1018Cb 0.08 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1pck h LEU 1018CO -0.01 0.27 0.36 -0.07 -0.34 0.00 0.00 178.44 178.66 1pck h LEU 1019N 0.58 0.63 -0.91 2.25 4.07 -1.31 -1.88 115.31 118.75 1pck h LEU 1019Ca 0.31 -0.02 -0.08 0.00 0.08 0.00 0.00 57.88 58.17 1pck h LEU 1019Cb 0.27 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 1pck h LEU 1019CO -0.23 0.46 -0.02 -0.07 -1.08 0.00 0.00 178.44 177.50 1pck h LEU 1020N 0.74 0.74 -0.27 1.67 3.38 -0.81 0.43 115.31 121.20 1pck h LEU 1020Ca 0.20 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1pck h LEU 1020Cb -0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1pck h LEU 1020CO -0.04 0.83 0.07 0.50 0.09 0.00 0.00 178.44 179.89 1pck h LYS 1021N 0.72 0.42 -0.27 1.13 3.64 -1.01 0.40 116.57 121.60 1pck h LYS 1021Ca 0.14 -0.10 -0.18 0.00 -1.27 0.00 0.00 60.65 59.24 1pck h LYS 1021Cb 0.47 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1pck h LYS 1021CO 0.02 0.50 -0.55 0.28 -2.27 0.00 0.00 179.45 177.43 1pck h VAL 1022N 0.26 1.28 -0.94 2.00 2.07 -1.18 -3.11 116.25 116.64 1pck h VAL 1022Ca 0.08 -1.75 0.03 0.00 0.82 0.00 0.00 66.70 65.88 1pck h VAL 1022Cb 0.26 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.64 1pck h VAL 1022CO -0.00 0.57 0.62 1.23 0.02 0.00 0.00 177.57 180.00 1pck h GLY 1023N 0.77 1.35 1.00 2.17 0.00 0.06 -0.78 103.07 107.64 1pck h GLY 1023Ca 0.01 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 46.87 1pck h GLY 1023CO 0.12 0.43 0.37 -2.09 0.00 0.00 0.00 176.54 175.37 1pck h GLU 1024N 1.22 0.73 -0.42 4.80 4.81 -0.85 0.68 114.58 125.55 1pck h GLU 1024Ca 0.37 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.46 1pck h GLU 1024Cb -0.04 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 1pck h GLU 1024CO -0.10 0.48 -0.11 1.49 -0.73 0.00 0.00 179.01 180.04 1pck h GLU 1025N 0.75 0.81 -0.49 1.92 4.57 -1.39 -1.61 114.58 119.14 1pck h GLU 1025Ca 0.21 -0.31 -0.05 0.00 -1.18 0.00 0.00 59.36 58.02 1pck h GLU 1025Cb -0.08 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 1pck h GLU 1025CO -0.05 0.93 0.10 0.82 -1.18 0.00 0.00 179.01 179.64 1pck h ILE 1026N 0.63 1.22 -0.48 2.32 2.04 -0.83 -0.88 117.51 121.52 1pck h ILE 1026Ca 0.10 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.12 1pck h ILE 1026Cb 0.64 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1pck h ILE 1026CO 0.04 0.29 0.10 0.50 0.00 0.00 0.00 178.15 179.08 1pck h LYS 1027N 0.72 0.78 -0.45 2.37 1.63 -0.64 -0.23 116.57 120.75 1pck h LYS 1027Ca 0.16 -0.20 0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1pck h LYS 1027Cb 0.29 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.80 1pck h LYS 1027CO 0.00 0.77 0.27 -0.09 -3.45 0.00 0.00 179.45 176.95 1pck h ARG 1028N 0.66 0.53 -0.21 1.90 2.43 -0.74 -2.13 114.38 116.81 1pck h ARG 1028Ca 0.15 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 1pck h ARG 1028Cb 0.35 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1pck h ARG 1028CO 0.00 0.35 -0.24 -0.07 -1.51 0.00 0.00 179.97 178.51 1pck h LEU 1029N 0.55 0.39 -1.71 3.80 3.38 -0.95 -2.44 115.31 118.33 1pck h LEU 1029Ca 0.18 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1pck h LEU 1029Cb 0.00 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1pck h LEU 1029CO -0.08 0.63 -0.17 0.77 0.09 0.00 0.00 178.44 179.69 1pck h SER 1030N 0.35 0.00 1.03 -0.43 4.64 -0.41 0.24 113.55 118.97 1pck h SER 1030Ca 0.06 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.18 1pck h SER 1030Cb 0.61 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.67 1pck h SER 1030CO 0.04 0.17 -0.94 -0.33 -0.87 0.00 0.00 176.83 174.90 1pck h GLU 1031N 0.00 0.00 0.00 4.77 4.39 -0.95 -3.34 114.58 119.45 1pck h GLU 1031Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1pck h GLU 1031Cb 0.43 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1pck h GLU 1031CO 0.02 0.94 -0.16 -0.22 -1.16 0.00 0.00 179.01 178.43 1pck h LYS 1032N 0.00 0.00 -4.15 2.33 3.64 -1.11 -3.39 116.57 113.89 1pck h LYS 1032Ca -0.01 0.00 -0.75 0.00 -1.27 0.00 0.00 60.65 58.62 1pck h LYS 1032Cb 1.71 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 33.36 1pck h LYS 1032CO 0.12 0.62 1.56 1.19 -2.27 0.00 0.00 179.45 180.67 1pck n PHE 1033N -4.65 4.10 0.36 1.91 3.01 0.78 -4.79 117.46 118.19 1pck n PHE 1033Ca -0.09 -3.13 0.11 0.00 1.01 0.00 0.00 57.45 55.35 1pck n PHE 1033Cb 0.34 -2.04 0.49 0.00 -0.01 0.00 0.00 39.48 38.25 1pck n PHE 1033CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1pck n LYS 1034N 4.67 0.17 -0.01 -1.08 5.02 -1.25 -1.94 118.16 123.74 1pck n LYS 1034Ca 0.37 0.45 0.14 0.00 -2.02 0.00 0.00 58.31 57.25 1pck n LYS 1034Cb 0.40 -1.85 0.64 0.00 -0.02 0.00 0.00 35.03 34.19 1pck n LYS 1034CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1pck n GLU 1035N -2.18 1.44 -4.76 1.97 0.00 -1.26 -4.83 120.64 111.02 1pck n GLU 1035Ca 0.02 -0.64 -0.33 0.00 0.00 0.00 0.00 57.16 56.20 1pck n GLU 1035Cb 0.19 -1.47 -0.12 0.00 0.00 0.00 0.00 31.44 30.04 1pck n GLU 1035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1pck s VAL 1036N -1.98 3.37 -0.41 3.84 1.01 -0.82 -3.02 120.40 122.39 1pck s VAL 1036Ca 0.40 -0.62 -0.15 0.00 0.00 0.00 0.00 61.98 61.61 1pck s VAL 1036Cb 0.21 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 34.26 1pck s VAL 1036CO 0.33 0.59 0.31 -0.70 0.00 0.00 0.00 175.10 175.63 1pck s GLU 1037N -0.79 2.97 0.11 2.72 2.12 0.53 -4.95 118.70 121.42 1pck s GLU 1037Ca 0.12 -1.02 -0.18 0.00 0.36 0.00 0.00 54.97 54.25 1pck s GLU 1037Cb -0.11 -3.98 -0.07 0.00 0.26 0.00 0.00 34.13 30.23 1pck s GLU 1037CO 0.01 -0.76 0.58 -0.06 -0.54 0.00 0.00 175.26 174.49 1pck s PHE 1038N 1.69 3.73 -0.09 5.30 0.40 -1.26 -1.47 117.98 126.28 1pck s PHE 1038Ca 0.05 1.23 -0.01 0.00 -0.60 0.00 0.00 56.93 57.60 1pck s PHE 1038Cb -0.19 -2.48 0.03 0.00 0.51 0.00 0.00 43.02 40.89 1pck s PHE 1038CO 0.10 0.51 -0.03 0.08 0.70 0.00 0.00 175.22 176.58 1pck s VAL 1039N -1.27 0.67 -0.09 -0.44 1.01 -0.41 -4.07 120.40 115.81 1pck s VAL 1039Ca 0.33 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1pck s VAL 1039Cb -0.18 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 1pck s VAL 1039CO 0.19 0.31 1.04 0.12 0.00 0.00 0.00 175.10 176.76 1pck s PHE 1040N 1.83 3.48 -0.01 5.22 5.36 0.17 -1.44 117.98 132.59 1pck s PHE 1040Ca 0.05 1.55 0.08 0.00 -0.96 0.00 0.00 56.93 57.64 1pck s PHE 1040Cb -0.12 -3.22 -0.02 0.00 -0.34 0.00 0.00 43.02 39.32 1pck s PHE 1040CO -0.06 -0.38 -0.25 0.21 -1.46 0.00 0.00 175.22 173.28 1pck s LYS 1041N 1.94 2.00 -0.29 10.12 2.36 -0.44 -1.34 119.74 134.09 1pck s LYS 1041Ca 0.50 -0.92 -0.20 0.00 -2.55 0.00 0.00 55.97 52.79 1pck s LYS 1041Cb -0.20 -1.96 0.14 0.00 -1.05 0.00 0.00 37.83 34.76 1pck s LYS 1041CO 0.20 0.53 1.05 0.45 1.55 0.00 0.00 175.35 179.13 1pck s SER 1042N -0.67 -0.43 -0.05 1.43 0.15 -1.19 -3.21 113.70 109.73 1pck s SER 1042Ca 0.10 0.75 -0.23 0.00 0.70 0.00 0.00 55.95 57.27 1pck s SER 1042Cb -0.10 0.98 -0.04 0.00 -1.71 0.00 0.00 66.02 65.15 1pck s SER 1042CO -0.01 -0.12 0.69 -0.44 1.20 0.00 0.00 173.24 174.56 1pck s SER 1043N 0.78 7.01 0.18 5.45 0.01 -0.57 -4.59 113.70 121.96 1pck s SER 1043Ca -0.03 1.21 0.26 0.00 1.31 0.00 0.00 55.95 58.71 1pck s SER 1043Cb -0.04 -2.41 0.89 0.00 0.21 0.00 0.00 66.02 64.66 1pck s SER 1043CO -0.11 -0.08 1.80 2.22 0.41 0.00 0.00 173.24 177.48 1pck n PHE 1044N 3.57 0.77 -3.66 2.43 1.16 -1.26 -1.54 117.46 118.93 1pck n PHE 1044Ca -0.02 0.23 -0.08 0.00 -1.87 0.00 0.00 57.45 55.70 1pck n PHE 1044Cb 0.51 -0.87 -0.08 0.00 -1.61 0.00 0.00 39.48 37.43 1pck n PHE 1044CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1pck s ASP 1045N -4.26 -0.78 -0.89 5.98 2.15 -1.26 -3.85 116.67 113.76 1pck s ASP 1045Ca 0.11 1.27 -0.15 0.00 0.43 0.00 0.00 52.55 54.22 1pck s ASP 1045Cb 0.13 1.15 0.20 0.00 -0.30 0.00 0.00 42.92 44.11 1pck s ASP 1045CO 0.58 -0.22 0.90 -0.54 -0.17 0.00 0.00 175.17 175.71 1pck s LYS 1046N 1.52 3.67 0.00 4.34 -0.14 0.67 -4.87 119.74 124.93 1pck s LYS 1046Ca -0.10 -2.36 0.31 0.00 -1.36 0.00 0.00 55.97 52.46 1pck s LYS 1046Cb -0.06 -4.57 1.66 0.00 -1.68 0.00 0.00 37.83 33.17 1pck s LYS 1046CO -0.17 -1.41 2.10 0.00 -0.76 0.00 0.00 175.35 175.11 1pck n ALA 1047N 4.53 2.64 -1.72 5.17 0.00 -1.26 -3.96 120.51 125.91 1pck n ALA 1047Ca 0.18 -0.21 0.06 0.00 0.00 0.00 0.00 53.44 53.46 1pck n ALA 1047Cb 0.47 -1.46 0.12 0.00 0.00 0.00 0.00 19.45 18.58 1pck n ALA 1047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1pck n ASN 1048N -0.97 1.49 -4.57 0.00 2.04 -1.26 -5.08 115.26 106.91 1pck n ASN 1048Ca 0.20 -3.05 -0.35 0.00 -0.44 0.00 0.00 54.58 50.94 1pck n ASN 1048Cb 0.18 -0.41 0.09 0.00 -2.53 0.00 0.00 39.78 37.11 1pck n ASN 1048CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1pck n ARG 1049N -0.70 0.33 -0.08 -3.83 5.12 -1.25 -4.90 116.66 111.34 1pck n ARG 1049Ca 0.13 0.17 -0.14 0.00 -1.93 0.00 0.00 57.85 56.07 1pck n ARG 1049Cb 0.78 -2.11 -0.05 0.00 -1.16 0.00 0.00 32.46 29.92 1pck n ARG 1049CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1pck h SER 1050N -0.50 0.81 -2.95 0.55 0.02 -1.98 -3.44 113.55 106.06 1pck h SER 1050Ca -0.46 -0.52 -0.66 0.00 -0.84 0.00 0.00 61.79 59.30 1pck h SER 1050Cb 1.33 -0.23 -0.09 0.00 0.14 0.00 0.00 62.40 63.54 1pck h SER 1050CO 0.44 1.17 -0.54 -0.55 -1.14 0.00 0.00 176.83 176.22 1pck s SER 1051N -6.71 5.92 0.51 3.07 0.15 -1.26 -4.98 113.70 110.41 1pck s SER 1051Ca -0.12 0.29 0.33 0.00 0.70 0.00 0.00 55.95 57.16 1pck s SER 1051Cb 0.09 -1.80 1.47 0.00 -1.71 0.00 0.00 66.02 64.06 1pck s SER 1051CO 0.85 0.35 1.98 -0.29 1.20 0.00 0.00 173.24 177.34 1pck h ILE 1052N 3.69 0.00 -0.00 6.45 6.09 -2.02 -2.64 117.51 129.07 1pck h ILE 1052Ca -0.52 -0.35 0.00 0.00 -1.37 0.00 0.00 64.86 62.62 1pck h ILE 1052Cb 1.20 1.28 0.00 0.00 0.47 0.00 0.00 36.82 39.77 1pck h ILE 1052CO 0.59 0.00 -0.28 1.41 -3.07 0.00 0.00 178.15 176.80 1pck n HIS 1053N -2.89 0.00 -2.30 2.19 8.25 -1.26 -4.93 115.22 114.27 1pck n HIS 1053Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.15 1pck n HIS 1053Cb 0.24 -0.25 -0.02 0.00 1.12 0.00 0.00 29.99 31.08 1pck n HIS 1053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1pck s SER 1054N -2.78 6.50 0.36 0.41 0.01 -1.00 -5.01 113.70 112.19 1pck s SER 1054Ca 0.18 1.48 -0.28 0.00 1.31 0.00 0.00 55.95 58.64 1pck s SER 1054Cb 0.19 -2.48 -0.11 0.00 0.21 0.00 0.00 66.02 63.83 1pck s SER 1054CO 0.58 -0.65 1.50 0.12 0.41 0.00 0.00 173.24 175.21 1pck s PHE 1055N -2.75 2.62 -0.04 2.43 5.36 -1.26 -4.94 117.98 119.40 1pck s PHE 1055Ca 0.57 1.10 -0.01 0.00 -0.96 0.00 0.00 56.93 57.63 1pck s PHE 1055Cb -0.10 -4.03 -0.02 0.00 -0.34 0.00 0.00 43.02 38.53 1pck s PHE 1055CO 0.38 -3.09 -0.05 0.54 -1.46 0.00 0.00 175.22 171.54 1pck n ARG 1056N 0.77 0.09 -2.15 10.12 1.74 -1.26 -4.75 116.66 121.23 1pck n ARG 1056Ca 0.02 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1pck n ARG 1056Cb 0.39 -0.81 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 1pck n ARG 1056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pck n GLY 1057N 2.94 -0.66 1.05 -0.13 0.00 -1.26 -0.24 105.19 106.90 1pck n GLY 1057Ca -0.08 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.44 1pck n GLY 1057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1pck n HIS 1058N 4.24 1.07 0.00 1.61 8.25 -1.25 -5.04 115.22 124.10 1pck n HIS 1058Ca 0.00 -0.76 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 1pck n HIS 1058Cb 0.00 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 30.83 1pck n HIS 1058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pck n GLY 1059N 0.00 1.56 0.14 -1.41 0.00 -1.25 -4.43 105.19 99.81 1pck n GLY 1059Ca 0.21 -1.78 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 1pck n GLY 1059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pck h LEU 1060N 0.00 0.34 -0.04 0.99 7.12 -1.98 -1.53 115.31 120.21 1pck h LEU 1060Ca 0.00 -0.08 0.03 0.00 0.13 0.00 0.00 57.88 57.96 1pck h LEU 1060Cb 0.00 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 40.00 1pck h LEU 1060CO 0.00 0.32 -0.17 -0.08 -0.13 0.00 0.00 178.44 178.39 1pck h GLU 1061N 0.34 -0.24 -0.39 1.25 4.81 -1.97 0.74 114.58 119.10 1pck h GLU 1061Ca 0.10 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1pck h GLU 1061Cb 0.05 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1pck h GLU 1061CO -0.02 -0.16 0.24 -0.92 -0.73 0.00 0.00 179.01 177.42 1pck h TYR 1062N -0.25 0.51 -0.42 0.92 3.20 -1.76 -2.08 116.97 117.09 1pck h TYR 1062Ca 0.07 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1pck h TYR 1062Cb 0.35 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1pck h TYR 1062CO -0.24 0.35 0.28 0.78 -1.64 0.00 0.00 178.16 177.69 1pck h GLY 1063N 0.52 0.58 0.99 1.82 0.00 -0.86 -0.46 103.07 105.67 1pck h GLY 1063Ca 0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1pck h GLY 1063CO -0.03 0.21 0.25 -2.08 0.00 0.00 0.00 176.54 174.90 1pck h VAL 1064N 0.56 1.22 -0.55 4.60 2.07 -0.77 -0.16 116.25 123.22 1pck h VAL 1064Ca 0.15 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1pck h VAL 1064Cb -0.07 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 1pck h VAL 1064CO -0.03 0.26 0.36 0.50 0.02 0.00 0.00 177.57 178.68 1pck h LYS 1065N 0.80 0.73 -0.33 1.57 3.64 -1.07 0.15 116.57 122.06 1pck h LYS 1065Ca 0.20 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1pck h LYS 1065Cb 0.16 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1pck h LYS 1065CO -0.02 0.49 0.10 0.00 -2.27 0.00 0.00 179.45 177.74 1pck h ALA 1066N 1.20 0.43 -0.54 5.00 0.00 -0.73 -1.57 119.26 123.05 1pck h ALA 1066Ca 0.20 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1pck h ALA 1066Cb -0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1pck h ALA 1066CO -0.04 0.07 0.16 -0.07 0.00 0.00 0.00 179.25 179.36 1pck h LEU 1067N 0.37 0.76 -1.35 0.00 3.38 -0.76 -1.62 115.31 116.09 1pck h LEU 1067Ca 0.11 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1pck h LEU 1067Cb 0.26 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1pck h LEU 1067CO -0.00 0.73 -0.11 -0.09 0.09 0.00 0.00 178.44 179.05 1pck h ARG 1068N 0.79 0.30 -0.36 1.13 2.43 -0.33 -1.63 114.38 116.70 1pck h ARG 1068Ca 0.18 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.18 1pck h ARG 1068Cb 0.25 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1pck h ARG 1068CO -0.01 0.42 -0.17 -0.22 -1.51 0.00 0.00 179.97 178.48 1pck h LYS 1069N 0.28 0.76 -0.29 0.20 1.63 -0.37 -0.41 116.57 118.37 1pck h LYS 1069Ca 0.06 -0.33 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1pck h LYS 1069Cb 0.37 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 1pck h LYS 1069CO 0.02 0.94 0.19 0.28 -3.45 0.00 0.00 179.45 177.43 1pck h VAL 1070N 0.55 1.07 -0.73 2.00 2.07 -0.90 0.90 116.25 121.21 1pck h VAL 1070Ca 0.08 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 1pck h VAL 1070Cb 0.71 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1pck h VAL 1070CO 0.05 0.07 0.23 0.50 0.02 0.00 0.00 177.57 178.44 1pck h LYS 1071N 0.38 1.14 -0.32 1.57 3.64 -1.20 -0.47 116.57 121.30 1pck h LYS 1071Ca 0.11 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.12 1pck h LYS 1071Cb -0.04 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1pck h LYS 1071CO -0.03 0.97 -0.28 1.49 -2.27 0.00 0.00 179.45 179.33 1pck h GLU 1072N 1.08 0.76 0.04 1.90 4.81 -0.79 0.21 114.58 122.59 1pck h GLU 1072Ca 0.24 -0.38 -0.22 0.00 -0.13 0.00 0.00 59.36 58.86 1pck h GLU 1072Cb 0.30 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1pck h GLU 1072CO -0.01 1.01 -1.00 1.49 -0.73 0.00 0.00 179.01 179.77 1pck h GLU 1073N 0.53 0.15 -0.00 1.92 4.81 -0.75 -3.38 114.58 117.86 1pck h GLU 1073Ca 0.06 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1pck h GLU 1073Cb 0.85 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1pck h GLU 1073CO 0.07 1.03 -0.14 1.19 -0.73 0.00 0.00 179.01 180.43 1pck n PHE 1074N -3.54 0.00 -2.74 0.92 3.72 -0.19 -5.01 117.46 110.61 1pck n PHE 1074Ca -0.04 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.19 1pck n PHE 1074Cb 0.90 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.46 1pck n PHE 1074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pck n GLY 1075N 0.91 -0.27 3.89 1.37 0.00 0.75 -4.98 105.19 106.87 1pck n GLY 1075Ca 0.01 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1pck n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pck s LEU 1076N -5.20 4.38 0.69 0.99 1.02 -1.25 -5.05 118.68 114.26 1pck s LEU 1076Ca 0.19 0.43 -0.15 0.00 0.02 0.00 0.00 54.13 54.62 1pck s LEU 1076Cb -0.08 -2.49 0.02 0.00 0.02 0.00 0.00 46.19 43.65 1pck s LEU 1076CO 0.23 0.30 1.13 -0.54 0.02 0.00 0.00 176.35 177.49 1pck s LYS 1077N -1.66 2.57 0.05 1.70 1.02 -1.26 -4.44 119.74 117.71 1pck s LYS 1077Ca 0.24 1.46 0.06 0.00 0.02 0.00 0.00 55.97 57.76 1pck s LYS 1077Cb -0.13 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 1pck s LYS 1077CO 0.14 -1.45 -0.18 0.42 -0.92 0.00 0.00 175.35 173.37 1pck s ILE 1078N -2.31 1.45 -0.03 2.17 -1.09 -1.26 -0.66 121.20 119.47 1pck s ILE 1078Ca 0.68 -1.15 -0.05 0.00 -2.23 0.00 0.00 60.65 57.89 1pck s ILE 1078Cb -0.22 -1.29 0.01 0.00 -1.58 0.00 0.00 42.46 39.38 1pck s ILE 1078CO 0.44 0.10 0.13 0.28 -1.23 0.00 0.00 174.94 174.66 1pck s THR 1079N -0.85 0.03 0.16 2.92 -1.32 -0.45 0.41 115.64 116.53 1pck s THR 1079Ca 0.05 -0.26 -0.18 0.00 -1.21 0.00 0.00 61.69 60.09 1pck s THR 1079Cb -0.09 -0.28 0.04 0.00 -1.51 0.00 0.00 72.50 70.67 1pck s THR 1079CO 0.02 -0.14 0.49 0.28 -2.21 0.00 0.00 174.62 173.05 1pck s THR 1080N -0.46 0.04 0.08 5.08 -1.32 -1.21 -3.18 115.64 114.68 1pck s THR 1080Ca -0.05 -0.49 0.00 0.00 -1.21 0.00 0.00 61.69 59.94 1pck s THR 1080Cb -0.04 -1.25 -0.04 0.00 -1.51 0.00 0.00 72.50 69.67 1pck s THR 1080CO 0.01 -0.18 0.23 1.51 -2.21 0.00 0.00 174.62 173.98 1pck s ASP 1081N -2.81 6.36 0.20 8.08 -4.77 -1.26 -1.30 116.67 121.16 1pck s ASP 1081Ca 0.04 0.26 0.08 0.00 -3.30 0.00 0.00 52.55 49.63 1pck s ASP 1081Cb 0.00 -1.95 -0.04 0.00 -1.09 0.00 0.00 42.92 39.84 1pck s ASP 1081CO -0.09 0.14 -0.03 0.27 0.70 0.00 0.00 175.17 176.16 1pck s ILE 1082N -1.56 3.50 0.00 2.11 -4.36 -0.86 -4.79 121.20 115.24 1pck s ILE 1082Ca 0.35 -1.60 0.00 0.00 -0.26 0.00 0.00 60.65 59.14 1pck s ILE 1082Cb -0.13 -2.78 0.00 0.00 1.25 0.00 0.00 42.46 40.81 1pck s ILE 1082CO 0.28 -0.17 0.00 1.41 0.24 0.00 0.00 174.94 176.70 1pck n HIS 1083N -0.23 0.00 -4.02 1.37 8.25 -1.26 -4.38 115.22 114.94 1pck n HIS 1083Ca -0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 1pck n HIS 1083Cb 0.56 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.56 1pck n HIS 1083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1pck s GLU 1084N -1.98 0.43 0.32 -0.41 2.02 -1.26 -5.06 118.70 112.76 1pck s GLU 1084Ca 0.00 -0.76 0.09 0.00 0.02 0.00 0.00 54.97 54.32 1pck s GLU 1084Cb 0.00 0.00 0.86 0.00 0.10 0.00 0.00 34.13 35.09 1pck s GLU 1084CO 0.00 -0.03 1.75 0.77 0.02 0.00 0.00 175.26 177.77 1pck h SER 1085N 4.34 0.69 0.17 -0.19 0.02 -1.91 -1.69 113.55 114.98 1pck h SER 1085Ca -0.33 0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1pck h SER 1085Cb 1.20 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 1pck h SER 1085CO 0.45 0.15 -0.02 4.11 -1.14 0.00 0.00 176.83 180.39 1pck h TRP 1086N 0.62 0.00 0.00 3.45 5.08 -1.97 -2.58 115.95 120.56 1pck h TRP 1086Ca 0.62 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.59 1pck h TRP 1086Cb 1.15 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.31 1pck h TRP 1086CO -0.01 0.02 0.00 1.96 -1.28 0.00 0.00 178.44 179.13 1pck h GLN 1087N 0.00 0.00 -0.20 0.12 4.20 -1.73 -3.36 115.11 114.14 1pck h GLN 1087Ca -0.00 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.76 1pck h GLN 1087Cb 0.11 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.84 1pck h GLN 1087CO 0.00 0.00 -0.09 0.00 -0.67 0.00 0.00 178.83 178.07 1pck h ALA 1088N 2.11 0.08 0.57 3.87 0.00 -1.60 -1.61 119.26 122.67 1pck h ALA 1088Ca 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1pck h ALA 1088Cb 0.84 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1pck h ALA 1088CO 0.00 -0.52 -0.30 1.49 0.00 0.00 0.00 179.25 179.92 1pck h GLU 1089N -0.07 -0.77 -0.85 0.00 4.81 -1.79 0.48 114.58 116.39 1pck h GLU 1089Ca 0.11 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1pck h GLU 1089Cb 0.23 0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1pck h GLU 1089CO -0.25 -0.52 0.50 -1.00 -0.73 0.00 0.00 179.01 177.02 1pck h PRO 1090N -0.80 1.16 -0.30 0.92 0.13 -1.76 -2.56 132.00 128.78 1pck h PRO 1090Ca -0.07 -0.11 -0.11 0.00 -0.87 0.00 0.00 66.00 64.83 1pck h PRO 1090Cb 0.63 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.51 1pck h PRO 1090CO 0.11 0.82 -0.28 0.28 -0.23 0.00 0.00 178.00 178.69 1pck h VAL 1091N 1.17 1.28 0.00 1.56 2.07 -1.20 -2.79 116.25 118.34 1pck h VAL 1091Ca 0.30 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1pck h VAL 1091Cb -0.03 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1pck h VAL 1091CO -0.06 0.45 0.00 0.00 0.02 0.00 0.00 177.57 177.98 1pck h ALA 1092N 1.15 1.00 0.00 1.67 0.00 -0.47 -0.31 119.26 122.30 1pck h ALA 1092Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1pck h ALA 1092Cb 0.76 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1pck h ALA 1092CO 0.06 0.00 -0.13 0.93 0.00 0.00 0.00 179.25 180.11 1pck h GLU 1093N 0.00 0.00 0.00 0.00 5.08 -1.44 -3.34 114.58 114.88 1pck h GLU 1093Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pck h GLU 1093Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1pck h GLU 1093CO 0.00 0.13 -0.94 1.55 -1.00 0.00 0.00 179.01 178.75 1pck n VAL 1094N -3.76 0.00 -2.56 3.13 3.14 -0.63 -5.04 118.33 112.61 1pck n VAL 1094Ca -0.02 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.94 1pck n VAL 1094Cb 0.24 -0.81 -0.03 0.00 -1.06 0.00 0.00 33.84 32.18 1pck n VAL 1094CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1pck s ALA 1095N -1.94 3.45 0.08 1.55 0.00 -0.22 -4.56 121.76 120.11 1pck s ALA 1095Ca 0.00 0.52 0.09 0.00 0.00 0.00 0.00 51.96 52.57 1pck s ALA 1095Cb 0.00 -3.48 -0.14 0.00 0.00 0.00 0.00 23.12 19.50 1pck s ALA 1095CO 0.00 -0.68 1.32 -0.44 0.00 0.00 0.00 175.76 175.96 1pck h ASP 1096N 7.28 0.00 -3.27 0.00 3.32 -0.37 -3.43 116.42 119.94 1pck h ASP 1096Ca -0.33 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.22 1pck h ASP 1096Cb 1.16 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.35 1pck h ASP 1096CO 0.87 0.90 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.86 1pck s ILE 1097N -2.79 0.88 -0.20 0.35 1.01 -0.89 -2.16 121.20 117.40 1pck s ILE 1097Ca 0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 1pck s ILE 1097Cb 0.10 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 1pck s ILE 1097CO 0.80 0.33 0.40 -0.63 0.00 0.00 0.00 174.94 175.85 1pck s ILE 1098N 1.44 5.20 -0.09 2.92 1.01 0.56 -3.29 121.20 128.95 1pck s ILE 1098Ca -0.01 0.71 -0.12 0.00 0.00 0.00 0.00 60.65 61.23 1pck s ILE 1098Cb -0.13 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 1pck s ILE 1098CO -0.04 0.25 0.29 -1.58 0.00 0.00 0.00 174.94 173.86 1pck s GLN 1099N 1.30 3.92 -0.26 2.79 0.74 -0.42 -0.79 119.66 126.95 1pck s GLN 1099Ca 0.19 0.14 -0.07 0.00 0.05 0.00 0.00 55.36 55.67 1pck s GLN 1099Cb -0.15 -3.29 -0.02 0.00 1.10 0.00 0.00 33.01 30.65 1pck s GLN 1099CO 0.08 0.54 0.07 0.42 -0.55 0.00 0.00 175.29 175.85 1pck s ILE 1100N -0.47 4.25 0.53 -2.34 -1.09 0.42 -2.04 121.20 120.46 1pck s ILE 1100Ca 0.18 -0.28 -0.21 0.00 -2.23 0.00 0.00 60.65 58.11 1pck s ILE 1100Cb -0.14 -3.03 -0.07 0.00 -1.58 0.00 0.00 42.46 37.64 1pck s ILE 1100CO 0.07 0.28 1.11 -2.65 -1.23 0.00 0.00 174.94 172.52 1pck n PRO 1101N 4.92 1.31 -0.24 2.79 -0.02 -1.26 -1.45 135.00 141.05 1pck n PRO 1101Ca -0.16 0.48 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1pck n PRO 1101Cb 0.51 -2.26 0.14 0.00 -0.02 0.00 0.00 33.50 31.86 1pck n PRO 1101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pck h ALA 1102N 1.13 0.95 0.00 3.55 0.00 -1.89 -0.63 119.26 122.37 1pck h ALA 1102Ca -0.48 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1pck h ALA 1102Cb 1.34 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1pck h ALA 1102CO 0.55 -0.13 -0.12 0.74 0.00 0.00 0.00 179.25 180.29 1pck h PHE 1103N 0.51 0.00 -0.58 0.00 0.04 -1.91 -2.95 116.94 112.05 1pck h PHE 1103Ca 0.36 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.13 1pck h PHE 1103Cb 0.44 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.59 1pck h PHE 1103CO -0.14 0.12 0.00 1.28 -0.60 0.00 0.00 178.31 178.97 1pck n LEU 1104N -3.49 4.49 0.01 1.54 4.77 -0.28 -4.59 117.00 119.44 1pck n LEU 1104Ca -0.01 -2.46 0.05 0.00 -0.03 0.00 0.00 56.01 53.55 1pck n LEU 1104Cb 0.26 -0.54 0.20 0.00 -2.33 0.00 0.00 43.42 41.02 1pck n LEU 1104CO 0.29 0.79 0.65 0.00 -1.33 0.00 0.00 177.39 177.79 1pck n ARG 1106N -1.55 1.17 -2.38 0.00 5.12 -1.26 -4.92 116.66 112.84 1pck n ARG 1106Ca 0.02 -1.04 -0.39 0.00 -1.93 0.00 0.00 57.85 54.51 1pck n ARG 1106Cb 0.10 -1.20 -0.03 0.00 -1.16 0.00 0.00 32.46 30.17 1pck n ARG 1106CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1pck s GLN 1107N -1.21 3.07 0.22 5.56 -1.52 -0.81 -4.89 119.66 120.08 1pck s GLN 1107Ca 0.13 -0.21 -0.13 0.00 -1.95 0.00 0.00 55.36 53.20 1pck s GLN 1107Cb 0.10 -4.54 0.25 0.00 -0.22 0.00 0.00 33.01 28.60 1pck s GLN 1107CO 0.20 -2.43 1.62 1.15 -0.25 0.00 0.00 175.29 175.59 1pck h THR 1108N 6.51 0.33 -0.25 -0.19 2.02 -1.91 -1.94 112.91 117.48 1pck h THR 1108Ca -0.15 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.99 1pck h THR 1108Cb 1.07 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1pck h THR 1108CO 1.29 0.00 -0.04 0.44 0.37 0.00 0.00 175.52 177.58 1pck h ASP 1109N -0.00 0.36 -0.19 4.18 3.32 -1.99 -1.06 116.42 121.04 1pck h ASP 1109Ca 0.32 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.23 1pck h ASP 1109Cb 0.49 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 1pck h ASP 1109CO -0.68 0.46 -0.17 0.25 -1.72 0.00 0.00 179.24 177.37 1pck h LEU 1110N 0.38 0.48 -0.49 1.55 5.85 -1.75 0.05 115.31 121.39 1pck h LEU 1110Ca 0.08 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 1pck h LEU 1110Cb 0.32 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1pck h LEU 1110CO 0.01 0.85 0.28 -0.07 -0.34 0.00 0.00 178.44 179.17 1pck h LEU 1111N 0.13 0.60 -0.74 2.25 3.38 -1.23 -1.72 115.31 117.98 1pck h LEU 1111Ca 0.03 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1pck h LEU 1111Cb 0.70 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1pck h LEU 1111CO 0.04 0.50 0.18 -0.07 0.09 0.00 0.00 178.44 179.19 1pck h LEU 1112N 0.64 1.07 -0.72 1.67 4.07 -1.15 -0.43 115.31 120.47 1pck h LEU 1112Ca 0.17 -0.22 -0.01 0.00 0.08 0.00 0.00 57.88 57.90 1pck h LEU 1112Cb 0.03 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.45 1pck h LEU 1112CO -0.03 1.02 0.43 0.00 -1.08 0.00 0.00 178.44 178.78 1pck h ALA 1113N 1.11 0.92 -0.26 1.53 0.00 -0.62 -2.16 119.26 119.79 1pck h ALA 1113Ca 0.23 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1pck h ALA 1113Cb 0.36 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1pck h ALA 1113CO 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 179.25 179.50 1pck h ALA 1114N 1.22 0.37 -0.97 0.00 0.00 -1.04 -3.27 119.26 115.57 1pck h ALA 1114Ca 0.26 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1pck h ALA 1114Cb -0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1pck h ALA 1114CO -0.05 0.26 0.63 0.00 0.00 0.00 0.00 179.25 180.09 1pck h ALA 1115N 0.72 1.40 0.00 0.00 0.00 -0.81 -2.60 119.26 117.97 1pck h ALA 1115Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pck h ALA 1115Cb 0.67 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1pck h ALA 1115CO 0.04 0.49 0.00 0.36 0.00 0.00 0.00 179.25 180.15 1pck n LYS 1116N -4.46 0.22 0.24 0.00 2.85 -0.83 -3.08 118.16 113.10 1pck n LYS 1116Ca 0.14 0.08 0.14 0.00 -1.05 0.00 0.00 58.31 57.62 1pck n LYS 1116Cb 0.13 -1.50 0.42 0.00 -0.65 0.00 0.00 35.03 33.43 1pck n LYS 1116CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1pck h THR 1117N 0.00 0.08 0.00 0.58 1.35 -1.56 -3.47 112.91 109.89 1pck h THR 1117Ca 0.00 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1pck h THR 1117Cb 0.27 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1pck h THR 1117CO 0.00 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 1pck n GLY 1118N 0.54 1.04 3.91 5.82 0.00 -1.18 -5.05 105.19 110.27 1pck n GLY 1118Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1pck n GLY 1118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pck s ARG 1119N -0.57 2.77 0.59 1.61 1.81 -1.26 -4.93 118.95 118.97 1pck s ARG 1119Ca 0.00 0.07 -0.16 0.00 -1.72 0.00 0.00 55.73 53.92 1pck s ARG 1119Cb 0.00 -2.19 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 1pck s ARG 1119CO 0.00 -0.88 1.06 0.00 -0.68 0.00 0.00 175.30 174.80 1pck s ALA 1120N -3.13 2.73 -0.06 2.13 0.00 -0.92 -4.75 121.76 117.75 1pck s ALA 1120Ca 0.56 0.45 0.02 0.00 0.00 0.00 0.00 51.96 52.99 1pck s ALA 1120Cb -0.11 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1pck s ALA 1120CO 0.47 -0.80 -0.12 0.08 0.00 0.00 0.00 175.76 175.39 1pck s VAL 1121N -2.36 1.11 -0.22 0.00 1.01 -0.46 -0.32 120.40 119.15 1pck s VAL 1121Ca 0.65 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1pck s VAL 1121Cb -0.17 -1.01 0.03 0.00 0.00 0.00 0.00 36.38 35.23 1pck s VAL 1121CO 0.35 0.35 -0.13 0.21 0.00 0.00 0.00 175.10 175.87 1pck s ASN 1122N 0.67 3.83 -0.24 3.32 2.47 0.03 -1.02 114.94 124.01 1pck s ASN 1122Ca -0.14 -0.90 -0.10 0.00 0.42 0.00 0.00 52.86 52.14 1pck s ASN 1122Cb -0.16 -1.56 -0.05 0.00 -1.45 0.00 0.00 41.25 38.04 1pck s ASN 1122CO 0.04 -0.08 0.14 -0.69 -3.72 0.00 0.00 177.10 172.78 1pck s VAL 1123N 1.25 5.12 -0.04 -5.21 1.01 -0.34 -0.43 120.40 121.76 1pck s VAL 1123Ca 0.00 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1pck s VAL 1123Cb -0.16 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1pck s VAL 1123CO -0.08 0.35 1.14 -0.54 0.00 0.00 0.00 175.10 175.97 1pck s LYS 1124N 1.13 4.40 -0.01 2.72 -0.14 -0.53 -0.57 119.74 126.75 1pck s LYS 1124Ca 0.07 1.61 -0.30 0.00 -1.36 0.00 0.00 55.97 55.98 1pck s LYS 1124Cb -0.14 -3.51 -0.06 0.00 -1.68 0.00 0.00 37.83 32.44 1pck s LYS 1124CO 0.05 -0.36 1.50 0.21 -0.76 0.00 0.00 175.35 175.99 1pck s LYS 1125N 1.90 4.24 0.50 1.68 2.20 0.08 -3.97 119.74 126.37 1pck s LYS 1125Ca 0.54 2.07 -0.22 0.00 -0.36 0.00 0.00 55.97 58.01 1pck s LYS 1125Cb -0.24 -3.68 -0.07 0.00 -1.51 0.00 0.00 37.83 32.33 1pck s LYS 1125CO 0.23 -0.68 1.16 0.41 -0.36 0.00 0.00 175.35 176.11 1pck n GLY 1126N 3.82 0.23 0.11 5.54 0.00 -1.24 -4.57 105.19 109.08 1pck n GLY 1126Ca 0.15 0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.31 1pck n GLY 1126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1pck n GLN 1127N -0.50 0.12 0.00 1.61 3.00 -1.26 -1.46 117.38 118.89 1pck n GLN 1127Ca 0.10 0.51 0.10 0.00 -0.01 0.00 0.00 57.00 57.70 1pck n GLN 1127Cb 0.43 -1.82 -0.07 0.00 0.00 0.00 0.00 30.24 28.79 1pck n GLN 1127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1pck n PHE 1128N -2.06 0.00 -3.37 1.08 -1.74 -1.26 -1.43 117.46 108.67 1pck n PHE 1128Ca 0.00 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.51 1pck n PHE 1128Cb 0.10 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.04 1pck n PHE 1128CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1pck s LEU 1129N -2.70 4.47 0.37 5.98 2.96 -0.53 -5.06 118.68 124.17 1pck s LEU 1129Ca 0.12 1.07 -0.17 0.00 -0.22 0.00 0.00 54.13 54.93 1pck s LEU 1129Cb 0.16 -2.74 -0.09 0.00 0.50 0.00 0.00 46.19 44.02 1pck s LEU 1129CO 0.69 0.25 0.82 0.00 -1.32 0.00 0.00 176.35 176.80 1pck s ALA 1130N -0.81 3.21 0.23 5.97 0.00 -1.26 -4.86 121.76 124.24 1pck s ALA 1130Ca 0.26 0.16 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 1pck s ALA 1130Cb -0.18 -2.91 0.39 0.00 0.00 0.00 0.00 23.12 20.42 1pck s ALA 1130CO 0.15 0.22 1.71 -1.35 0.00 0.00 0.00 175.76 176.50 1pck h PRO 1131N 2.03 0.34 0.00 0.00 0.11 -1.97 -1.06 132.00 131.44 1pck h PRO 1131Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1pck h PRO 1131Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1pck h PRO 1131CO 0.64 0.22 0.00 0.11 -0.21 0.00 0.00 178.00 178.76 1pck h TRP 1132N 0.35 0.00 -0.01 0.65 0.09 -1.93 -2.67 115.95 112.42 1pck h TRP 1132Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.35 1pck h TRP 1132Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.80 1pck h TRP 1132CO -0.21 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.07 1pck n ASP 1133N -3.08 0.17 0.04 0.11 8.00 -0.40 -2.91 116.55 118.48 1pck n ASP 1133Ca -0.00 -1.31 0.13 0.00 0.71 0.00 0.00 54.79 54.32 1pck n ASP 1133Cb 0.26 -0.01 0.43 0.00 -0.02 0.00 0.00 41.12 41.77 1pck n ASP 1133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1pck n THR 1134N -0.74 0.21 -0.21 -3.53 -2.24 -1.01 -3.63 114.28 103.13 1pck n THR 1134Ca 0.17 -0.12 -0.05 0.00 -2.27 0.00 0.00 64.05 61.79 1pck n THR 1134Cb 0.11 -0.33 0.06 0.00 -2.10 0.00 0.00 70.33 68.07 1pck n THR 1134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1pck h LYS 1135N 0.00 0.71 0.00 -0.78 3.64 -1.75 -1.36 116.57 117.03 1pck h LYS 1135Ca 0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1pck h LYS 1135Cb 0.60 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1pck h LYS 1135CO 0.00 0.47 -0.35 -0.91 -2.27 0.00 0.00 179.45 176.39 1pck h ASN 1136N 0.73 0.00 -0.33 4.20 2.35 -1.82 -1.10 115.58 119.61 1pck h ASN 1136Ca 0.24 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.95 1pck h ASN 1136Cb 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1pck h ASN 1136CO -0.10 0.35 0.04 0.58 -1.65 0.00 0.00 177.43 176.65 1pck h VAL 1137N 0.00 1.24 -0.67 2.81 2.07 -1.43 -1.23 116.25 119.04 1pck h VAL 1137Ca -0.00 -0.86 -0.07 0.00 0.82 0.00 0.00 66.70 66.59 1pck h VAL 1137Cb 0.71 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1pck h VAL 1137CO 0.05 0.28 0.16 0.58 0.02 0.00 0.00 177.57 178.65 1pck h VAL 1138N 0.38 1.26 -0.55 2.57 2.07 -1.02 -2.43 116.25 118.53 1pck h VAL 1138Ca 0.10 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.69 1pck h VAL 1138Cb 0.37 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1pck h VAL 1138CO 0.01 0.37 0.32 -0.08 0.02 0.00 0.00 177.57 178.20 1pck h GLU 1139N 1.01 0.61 -0.50 1.57 4.81 -0.94 0.04 114.58 121.17 1pck h GLU 1139Ca 0.21 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1pck h GLU 1139Cb 0.38 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1pck h GLU 1139CO 0.00 0.40 0.31 0.87 -0.73 0.00 0.00 179.01 179.86 1pck h LYS 1140N 0.62 0.60 -0.33 1.92 1.57 -0.94 -0.16 116.57 119.86 1pck h LYS 1140Ca 0.23 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1pck h LYS 1140Cb 0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1pck h LYS 1140CO -0.12 0.39 0.16 -0.07 -0.57 0.00 0.00 179.45 179.24 1pck h LEU 1141N 0.61 0.43 -0.90 2.94 3.38 -0.91 -0.73 115.31 120.13 1pck h LEU 1141Ca 0.20 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1pck h LEU 1141Cb 0.00 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1pck h LEU 1141CO -0.08 0.43 0.41 0.11 0.09 0.00 0.00 178.44 179.40 1pck h LYS 1142N 0.39 1.20 -0.84 1.13 1.57 -0.78 -0.69 116.57 118.55 1pck h LYS 1142Ca 0.11 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1pck h LYS 1142Cb 0.12 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 1pck h LYS 1142CO -0.01 0.92 0.56 0.35 -0.57 0.00 0.00 179.45 180.69 1pck h PHE 1143N 1.19 1.05 -0.05 -1.35 3.57 -0.71 -1.66 116.94 118.99 1pck h PHE 1143Ca 0.29 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1pck h PHE 1143Cb 0.10 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.48 1pck h PHE 1143CO 0.01 0.66 0.00 0.41 -2.23 0.00 0.00 178.31 177.16 1pck n GLY 1144N -1.41 -0.65 0.18 2.40 0.00 -0.31 -4.90 105.19 100.50 1pck n GLY 1144Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1pck n GLY 1144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pck n GLY 1145N 0.86 0.61 3.71 -0.02 0.00 -0.62 -3.18 105.19 106.55 1pck n GLY 1145Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1pck n GLY 1145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pck s ALA 1146N -2.10 3.51 -0.14 4.61 0.00 -0.37 -4.87 121.76 122.39 1pck s ALA 1146Ca 0.00 0.99 0.13 0.00 0.00 0.00 0.00 51.96 53.08 1pck s ALA 1146Cb 0.00 -3.51 -0.20 0.00 0.00 0.00 0.00 23.12 19.42 1pck s ALA 1146CO 0.00 -0.58 0.35 1.63 0.00 0.00 0.00 175.76 177.16 1pck n LYS 1147N 4.11 0.88 -3.88 0.00 5.02 -1.26 -4.34 118.16 118.69 1pck n LYS 1147Ca 0.11 -0.10 -0.30 0.00 -2.02 0.00 0.00 58.31 56.00 1pck n LYS 1147Cb 0.44 -1.28 -0.16 0.00 -0.02 0.00 0.00 35.03 34.02 1pck n LYS 1147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1pck s GLU 1148N -2.79 1.31 -0.04 1.97 2.12 -1.26 -5.11 118.70 114.89 1pck s GLU 1148Ca -0.03 -1.01 0.06 0.00 0.36 0.00 0.00 54.97 54.35 1pck s GLU 1148Cb 0.09 -2.48 -0.01 0.00 0.26 0.00 0.00 34.13 31.99 1pck s GLU 1148CO 0.56 -0.71 -0.22 0.42 -0.54 0.00 0.00 175.26 174.77 1pck s ILE 1149N 1.45 1.78 0.08 -3.70 1.01 -1.26 -1.36 121.20 119.21 1pck s ILE 1149Ca -0.01 -0.93 0.08 0.00 0.00 0.00 0.00 60.65 59.79 1pck s ILE 1149Cb -0.18 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1pck s ILE 1149CO -0.10 0.50 -0.21 -0.31 0.00 0.00 0.00 174.94 174.82 1pck s TYR 1150N -0.23 1.84 -0.10 3.97 1.51 -0.19 -2.90 117.35 121.25 1pck s TYR 1150Ca 0.00 -0.40 0.04 0.00 -1.01 0.00 0.00 57.07 55.70 1pck s TYR 1150Cb -0.11 -1.04 0.00 0.00 -0.11 0.00 0.00 41.96 40.70 1pck s TYR 1150CO 0.02 0.17 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.88 1pck s LEU 1151N -1.63 2.06 -0.20 -1.29 1.43 -0.21 -1.19 118.68 117.65 1pck s LEU 1151Ca 0.07 -0.55 -0.04 0.00 -1.03 0.00 0.00 54.13 52.58 1pck s LEU 1151Cb -0.10 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 1pck s LEU 1151CO 0.03 0.15 -0.02 -0.89 0.23 0.00 0.00 176.35 175.85 1pck s THR 1152N 0.39 3.69 -0.17 5.49 2.01 0.27 -0.54 115.64 126.77 1pck s THR 1152Ca -0.18 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.13 1pck s THR 1152Cb -0.18 -2.67 -0.00 0.00 0.01 0.00 0.00 72.50 69.67 1pck s THR 1152CO 0.08 0.43 1.03 -0.70 -0.69 0.00 0.00 174.62 174.77 1pck s GLU 1153N 1.15 4.34 -0.03 4.92 2.56 0.59 -0.74 118.70 131.49 1pck s GLU 1153Ca 0.02 1.38 0.16 0.00 0.00 0.00 0.00 54.97 56.54 1pck s GLU 1153Cb -0.15 -3.59 0.29 0.00 2.00 0.00 0.00 34.13 32.69 1pck s GLU 1153CO 0.00 -0.48 1.12 2.89 -0.56 0.00 0.00 175.26 178.24 1pck n ARG 1154N 5.68 0.26 0.00 4.30 -4.01 -1.26 -1.00 116.66 120.63 1pck n ARG 1154Ca 0.10 -1.89 0.00 0.00 -1.04 0.00 0.00 57.85 55.02 1pck n ARG 1154Cb 0.47 -0.42 0.00 0.00 -3.04 0.00 0.00 32.46 29.47 1pck n ARG 1154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1pck n GLY 1155N 0.05 1.12 3.12 2.89 0.00 -1.26 -3.91 105.19 107.20 1pck n GLY 1155Ca 0.06 -1.81 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 1pck n GLY 1155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pck s THR 1156N -2.92 1.02 0.03 2.61 2.01 0.19 -4.34 115.64 114.24 1pck s THR 1156Ca 0.00 -0.90 -0.35 0.00 0.31 0.00 0.00 61.69 60.75 1pck s THR 1156Cb 0.00 -0.92 -0.14 0.00 0.01 0.00 0.00 72.50 71.45 1pck s THR 1156CO 0.00 0.02 1.66 0.41 -0.69 0.00 0.00 174.62 176.02 1pck n THR 1157N 2.05 0.22 -3.56 -0.82 -1.04 -0.52 -1.27 114.28 109.34 1pck n THR 1157Ca -0.17 -0.04 -0.29 0.00 -2.04 0.00 0.00 64.05 61.51 1pck n THR 1157Cb 0.55 -1.51 -0.12 0.00 -1.82 0.00 0.00 70.33 67.43 1pck n THR 1157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1pck s PHE 1158N 2.11 1.31 0.00 -1.42 5.36 -0.74 -4.83 117.98 119.76 1pck s PHE 1158Ca 0.86 -2.04 0.00 0.00 -0.96 0.00 0.00 56.93 54.78 1pck s PHE 1158Cb -0.76 -1.32 0.00 0.00 -0.34 0.00 0.00 43.02 40.60 1pck s PHE 1158CO 0.46 -0.80 0.00 0.41 -1.46 0.00 0.00 175.22 173.83 1pck n GLY 1159N 3.67 -0.89 3.84 13.12 0.00 -1.26 -4.32 105.19 119.34 1pck n GLY 1159Ca 0.13 -1.18 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 1pck n GLY 1159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pck s TYR 1160N 0.00 3.67 -1.57 1.61 2.02 -1.26 -4.37 117.35 117.44 1pck s TYR 1160Ca 0.00 1.00 -0.14 0.00 -0.37 0.00 0.00 57.07 57.56 1pck s TYR 1160Cb 0.00 -2.31 0.10 0.00 -0.40 0.00 0.00 41.96 39.35 1pck s TYR 1160CO 0.00 0.54 0.90 0.09 -1.57 0.00 0.00 175.55 175.51 1pck n ASN 1161N 1.27 -4.06 -3.62 2.29 3.02 -1.26 -4.96 115.26 107.95 1pck n ASN 1161Ca -0.09 -0.86 -0.16 0.00 -0.03 0.00 0.00 54.58 53.44 1pck n ASN 1161Cb 0.52 -3.53 -0.07 0.00 -0.61 0.00 0.00 39.78 36.08 1pck n ASN 1161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1pck s ASN 1162N -3.39 -0.56 0.04 6.41 3.04 -1.26 -4.25 114.94 114.97 1pck s ASN 1162Ca 0.63 0.77 0.06 0.00 0.04 0.00 0.00 52.86 54.36 1pck s ASN 1162Cb -0.33 0.74 -0.02 0.00 -1.54 0.00 0.00 41.25 40.10 1pck s ASN 1162CO 0.86 -0.44 -0.17 -0.76 -3.04 0.00 0.00 177.10 173.55 1pck s LEU 1163N -0.69 2.17 0.08 3.21 1.43 -1.26 -1.78 118.68 121.83 1pck s LEU 1163Ca -0.08 -0.49 0.08 0.00 -1.03 0.00 0.00 54.13 52.62 1pck s LEU 1163Cb -0.03 -0.77 -0.03 0.00 0.03 0.00 0.00 46.19 45.40 1pck s LEU 1163CO 0.06 0.09 -0.22 0.54 0.23 0.00 0.00 176.35 177.05 1pck s VAL 1164N -0.83 1.77 -0.32 -1.59 0.11 -0.40 -4.85 120.40 114.29 1pck s VAL 1164Ca 0.04 -1.40 -0.11 0.00 -2.93 0.00 0.00 61.98 57.59 1pck s VAL 1164Cb -0.08 -1.57 -0.01 0.00 -1.53 0.00 0.00 36.38 33.19 1pck s VAL 1164CO 0.02 0.10 0.18 -0.69 -3.33 0.00 0.00 175.10 171.37 1pck s VAL 1165N -0.97 4.76 -0.69 2.04 1.01 -1.26 -0.64 120.40 124.65 1pck s VAL 1165Ca 0.08 -0.41 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 1pck s VAL 1165Cb -0.09 -3.45 0.11 0.00 0.00 0.00 0.00 36.38 32.94 1pck s VAL 1165CO 0.03 0.02 0.85 -0.62 0.00 0.00 0.00 175.10 175.38 1pck s ASP 1166N 1.63 6.32 0.00 3.32 -1.08 -1.26 -4.90 116.67 120.70 1pck s ASP 1166Ca 0.05 -1.56 0.03 0.00 -0.52 0.00 0.00 52.55 50.55 1pck s ASP 1166Cb -0.17 -2.34 0.15 0.00 -1.46 0.00 0.00 42.92 39.10 1pck s ASP 1166CO 0.07 -1.13 1.04 0.49 0.52 0.00 0.00 175.17 176.16 1pck n PHE 1167N 6.48 0.00 0.30 -5.34 3.01 -1.26 -1.08 117.46 119.58 1pck n PHE 1167Ca 0.00 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.65 1pck n PHE 1167Cb 0.45 -0.42 0.84 0.00 -0.01 0.00 0.00 39.48 40.34 1pck n PHE 1167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1pck h ARG 1168N 0.00 0.00 0.00 -1.08 3.08 -2.03 -2.63 114.38 111.71 1pck h ARG 1168Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1pck h ARG 1168Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1pck h ARG 1168CO 0.00 0.00 -0.17 0.66 -1.07 0.00 0.00 179.97 179.39 1pck h SER 1169N 0.00 0.00 0.51 7.04 4.64 -1.52 -2.94 113.55 121.27 1pck h SER 1169Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1pck h SER 1169Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1pck h SER 1169CO 0.00 0.17 -0.24 -0.07 -0.87 0.00 0.00 176.83 175.81 1pck h LEU 1170N 0.00 -0.58 -1.15 5.97 4.07 -1.69 -0.61 115.31 121.32 1pck h LEU 1170Ca -0.00 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.89 1pck h LEU 1170Cb 0.31 0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 1pck h LEU 1170CO 0.02 -0.40 -0.37 1.55 -1.08 0.00 0.00 178.44 178.17 1pck h PRO 1171N -0.71 0.00 0.19 1.13 0.13 -1.75 -2.08 132.00 128.91 1pck h PRO 1171Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1pck h PRO 1171Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 1pck h PRO 1171CO 0.11 0.37 -0.09 0.82 -0.23 0.00 0.00 178.00 178.98 1pck h ILE 1172N 0.00 0.92 0.00 -3.56 2.04 -1.37 -3.21 117.51 112.34 1pck h ILE 1172Ca -0.00 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.04 1pck h ILE 1172Cb 0.77 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1pck h ILE 1172CO 0.05 0.17 -0.30 0.24 0.00 0.00 0.00 178.15 178.31 1pck h MET 1173N -0.64 0.00 -0.00 2.37 2.86 -1.11 -2.46 114.93 115.95 1pck h MET 1173Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1pck h MET 1173Cb 0.46 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.12 1pck h MET 1173CO 0.04 0.30 0.08 -0.22 1.06 0.00 0.00 176.91 178.17 1pck h LYS 1174N 0.00 0.00 0.00 1.72 1.63 -1.37 -1.47 116.57 117.08 1pck h LYS 1174Ca -0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1pck h LYS 1174Cb 0.54 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.16 1pck h LYS 1174CO 0.04 0.00 -0.04 1.96 -3.45 0.00 0.00 179.45 177.96 1pck h GLN 1175N 0.00 0.00 0.00 1.90 4.20 -1.50 -3.30 115.11 116.41 1pck h GLN 1175Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1pck h GLN 1175Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1pck h GLN 1175CO -0.00 0.04 0.00 -2.67 -0.67 0.00 0.00 178.83 175.53 1pck n TRP 1176N -4.33 0.00 -3.59 2.96 2.14 -0.59 -5.10 117.44 108.93 1pck n TRP 1176Ca -0.03 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.48 1pck n TRP 1176Cb 0.13 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.61 1pck n TRP 1176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1pck s ALA 1177N -0.02 -1.75 0.40 -1.67 0.00 -0.98 -5.00 121.76 112.74 1pck s ALA 1177Ca 0.00 0.66 -0.25 0.00 0.00 0.00 0.00 51.96 52.37 1pck s ALA 1177Cb 0.00 0.52 -0.08 0.00 0.00 0.00 0.00 23.12 23.56 1pck s ALA 1177CO 0.00 -0.83 1.16 0.15 0.00 0.00 0.00 175.76 176.24 1pck s LYS 1178N -3.21 4.04 -0.12 0.00 1.02 -1.14 -4.02 119.74 116.31 1pck s LYS 1178Ca 0.08 1.80 0.00 0.00 0.02 0.00 0.00 55.97 57.87 1pck s LYS 1178Cb -0.01 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.64 1pck s LYS 1178CO -0.05 -0.32 -0.13 0.08 -0.92 0.00 0.00 175.35 174.01 1pck s VAL 1179N -1.45 3.04 -0.06 3.17 1.01 -1.26 -1.05 120.40 123.81 1pck s VAL 1179Ca 0.58 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.91 1pck s VAL 1179Cb -0.30 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1pck s VAL 1179CO 0.37 0.53 -0.15 -0.63 0.00 0.00 0.00 175.10 175.23 1pck s ILE 1180N 0.20 3.02 -0.24 2.22 -1.09 0.30 -0.19 121.20 125.43 1pck s ILE 1180Ca -0.08 -0.73 -0.07 0.00 -2.23 0.00 0.00 60.65 57.53 1pck s ILE 1180Cb -0.15 -2.19 -0.03 0.00 -1.58 0.00 0.00 42.46 38.51 1pck s ILE 1180CO 0.05 0.58 0.07 -0.47 -1.23 0.00 0.00 174.94 173.95 1pck s TYR 1181N -0.62 3.12 -0.63 3.97 5.04 -0.50 -0.30 117.35 127.43 1pck s TYR 1181Ca 0.09 -0.28 -0.24 0.00 -2.44 0.00 0.00 57.07 54.21 1pck s TYR 1181Cb -0.11 -2.21 0.06 0.00 0.35 0.00 0.00 41.96 40.05 1pck s TYR 1181CO 0.01 -0.23 0.99 0.34 -1.34 0.00 0.00 175.55 175.31 1pck s ASP 1182N 1.34 6.23 0.39 4.32 -1.08 -0.17 -0.21 116.67 127.49 1pck s ASP 1182Ca 0.05 -0.72 0.21 0.00 -0.52 0.00 0.00 52.55 51.57 1pck s ASP 1182Cb -0.15 -2.44 0.66 0.00 -1.46 0.00 0.00 42.92 39.53 1pck s ASP 1182CO 0.04 -1.41 1.71 0.00 0.52 0.00 0.00 175.17 176.04 1pck h ALA 1183N 9.52 0.94 0.03 3.66 0.00 -1.21 -3.19 119.26 129.01 1pck h ALA 1183Ca -0.28 -0.28 -0.37 0.00 0.00 0.00 0.00 54.91 53.98 1pck h ALA 1183Cb 1.07 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1pck h ALA 1183CO 1.16 0.39 -2.24 0.25 0.00 0.00 0.00 179.25 178.81 1pck n THR 1184N -3.37 1.56 0.19 0.00 -2.24 -1.26 -4.38 114.28 104.78 1pck n THR 1184Ca 0.01 -0.69 0.07 0.00 -2.27 0.00 0.00 64.05 61.17 1pck n THR 1184Cb 0.52 -1.24 0.23 0.00 -2.10 0.00 0.00 70.33 67.75 1pck n THR 1184CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1pck h HIS 1185N 0.02 0.00 0.00 4.78 3.86 -1.91 -3.21 115.15 118.70 1pck h HIS 1185Ca -0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 1pck h HIS 1185Cb 2.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.50 1pck h HIS 1185CO 0.03 0.30 0.00 0.43 0.86 0.00 0.00 177.93 179.55 1pck n SER 1186N -3.27 0.69 -0.62 2.45 7.64 -1.20 -2.42 113.62 116.89 1pck n SER 1186Ca 0.02 0.67 0.07 0.00 1.01 0.00 0.00 58.87 60.64 1pck n SER 1186Cb 0.57 -0.82 0.10 0.00 -1.01 0.00 0.00 64.21 63.06 1pck n SER 1186CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1pck n VAL 1187N -2.27 0.38 -2.56 0.44 0.24 -1.21 -4.72 118.33 108.64 1pck n VAL 1187Ca 0.02 -0.69 -0.35 0.00 -2.04 0.00 0.00 64.34 61.28 1pck n VAL 1187Cb 0.23 0.98 -0.04 0.00 -1.47 0.00 0.00 33.84 33.54 1pck n VAL 1187CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pck s GLN 1188N -1.06 3.92 -0.55 7.34 -2.07 -1.02 -2.11 119.66 124.12 1pck s GLN 1188Ca 0.20 1.40 -0.09 0.00 -1.82 0.00 0.00 55.36 55.05 1pck s GLN 1188Cb 0.12 -2.23 0.14 0.00 -1.09 0.00 0.00 33.01 29.96 1pck s GLN 1188CO 0.17 -0.33 0.42 -0.51 -1.32 0.00 0.00 175.29 173.72 1pck s LEU 1189N -3.23 5.78 -0.09 2.60 1.43 -1.26 -4.34 118.68 119.58 1pck s LEU 1189Ca 0.64 -2.17 -0.38 0.00 -1.03 0.00 0.00 54.13 51.19 1pck s LEU 1189Cb -0.18 -2.02 -0.16 0.00 0.03 0.00 0.00 46.19 43.86 1pck s LEU 1189CO 0.22 -0.63 1.52 -2.65 0.23 0.00 0.00 176.35 175.04 1pck n PRO 1190N 4.56 1.12 -1.17 1.29 -0.02 -1.26 -0.62 135.00 138.90 1pck n PRO 1190Ca -0.03 0.41 -0.09 0.00 -2.02 0.00 0.00 63.50 61.78 1pck n PRO 1190Cb 0.41 -2.07 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 1pck n PRO 1190CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pck n GLY 1191N 3.29 0.84 0.22 -1.23 0.00 -1.26 -4.24 105.19 102.80 1pck n GLY 1191Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 1pck n GLY 1191CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1pck h GLY 1192N 0.00 -0.28 0.56 -0.02 0.00 -1.18 -3.50 103.07 98.65 1pck h GLY 1192Ca -0.18 0.20 -0.20 0.00 0.00 0.00 0.00 47.33 47.16 1pck h GLY 1192CO 0.26 -0.17 -0.93 1.41 0.00 0.00 0.00 176.54 177.11 1pck h LEU 1193N -0.31 0.38 -7.76 3.11 -0.00 -1.89 -3.53 115.31 105.31 1pck h LEU 1193Ca 0.04 -0.91 -0.08 0.00 -0.00 0.00 0.00 57.88 56.93 1pck h LEU 1193Cb 0.36 -0.12 -0.13 0.00 -0.00 0.00 0.00 40.66 40.76 1pck h LEU 1193CO -0.13 1.43 -0.26 -0.83 -0.00 0.00 0.00 178.44 178.65 1pck s GLY 1199N -4.58 0.08 -0.43 0.83 0.00 -1.26 -5.23 107.32 96.73 1pck s GLY 1199Ca -0.17 -0.51 0.04 0.00 0.00 0.00 0.00 44.72 44.08 1pck s GLY 1199CO 0.79 -0.66 0.15 1.06 0.00 0.00 0.00 173.10 174.45 1pck s MET 1200N -3.87 1.70 0.59 2.90 1.00 -0.90 -4.88 119.30 115.84 1pck s MET 1200Ca 0.07 -2.22 0.29 0.00 0.00 0.00 0.00 55.69 53.83 1pck s MET 1200Cb 0.03 -3.22 1.64 0.00 0.00 0.00 0.00 34.83 33.28 1pck s MET 1200CO -0.08 -1.03 2.08 -0.09 0.00 0.00 0.00 175.02 175.90 1pck h ARG 1201N 7.07 0.00 0.00 2.03 2.43 -1.88 -1.62 114.38 122.41 1pck h ARG 1201Ca -0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1pck h ARG 1201Cb 0.96 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1pck h ARG 1201CO 0.60 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 180.11 1pck h GLU 1202N 0.00 0.00 -0.02 0.20 9.09 -1.94 -2.46 114.58 119.46 1pck h GLU 1202Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.51 1pck h GLU 1202Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.65 1pck h GLU 1202CO -0.00 0.00 -0.47 1.19 0.05 0.00 0.00 179.01 179.78 1pck n PHE 1203N -2.52 0.00 0.19 2.06 0.99 -0.61 -4.53 117.46 113.04 1pck n PHE 1203Ca -0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.45 57.30 1pck n PHE 1203Cb 0.15 0.00 -0.07 0.00 -1.00 0.00 0.00 39.48 38.56 1pck n PHE 1203CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1pck h ILE 1204N 2.45 0.59 0.10 4.37 2.04 -1.57 -2.58 117.51 122.91 1pck h ILE 1204Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1pck h ILE 1204Cb 0.75 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1pck h ILE 1204CO 0.00 0.00 -0.05 0.15 0.00 0.00 0.00 178.15 178.25 1pck h PHE 1205N -0.47 -0.12 -0.94 1.37 -0.00 -1.80 -2.09 116.94 112.88 1pck h PHE 1205Ca -0.02 -0.00 0.05 0.00 -0.00 0.00 0.00 57.97 57.99 1pck h PHE 1205Cb 0.40 0.04 -0.06 0.00 -0.00 0.00 0.00 35.95 36.33 1pck h PHE 1205CO -0.10 0.07 0.61 -1.00 -0.00 0.00 0.00 178.31 177.88 1pck h PRO 1206N -0.29 1.12 -0.01 6.41 0.13 -1.80 -1.52 132.00 136.02 1pck h PRO 1206Ca -0.01 -0.07 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 1pck h PRO 1206Cb 0.24 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1pck h PRO 1206CO 0.02 0.74 -0.53 -0.07 -0.23 0.00 0.00 178.00 177.93 1pck h LEU 1207N 1.15 0.04 -0.67 1.56 3.38 -1.42 -2.14 115.31 117.22 1pck h LEU 1207Ca 0.39 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.19 1pck h LEU 1207Cb 0.07 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1pck h LEU 1207CO -0.14 0.57 -0.64 -0.29 0.09 0.00 0.00 178.44 178.02 1pck h ILE 1208N 0.03 1.44 -0.63 1.22 2.10 -0.87 -1.30 117.51 119.49 1pck h ILE 1208Ca -0.00 -2.15 -0.09 0.00 1.08 0.00 0.00 64.86 63.70 1pck h ILE 1208Cb 0.95 2.14 -0.02 0.00 -1.09 0.00 0.00 36.82 38.80 1pck h ILE 1208CO 0.07 0.62 0.05 0.03 -1.08 0.00 0.00 178.15 177.84 1pck h ARG 1209N 0.06 1.08 -0.61 2.19 3.08 -0.96 -2.60 114.38 116.63 1pck h ARG 1209Ca -0.01 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.70 1pck h ARG 1209Cb 1.15 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.06 1pck h ARG 1209CO 0.09 1.03 0.30 0.00 -1.07 0.00 0.00 179.97 180.33 1pck h ALA 1210N 1.01 0.79 -0.34 0.04 0.00 -1.04 -2.08 119.26 117.63 1pck h ALA 1210Ca 0.18 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1pck h ALA 1210Cb 0.51 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1pck h ALA 1210CO 0.02 0.34 0.08 0.00 0.00 0.00 0.00 179.25 179.69 1pck h ALA 1211N 1.13 0.38 0.00 0.00 0.00 -0.89 -0.41 119.26 119.47 1pck h ALA 1211Ca 0.21 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1pck h ALA 1211Cb 0.10 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1pck h ALA 1211CO -0.03 -0.32 -0.22 -0.39 0.00 0.00 0.00 179.25 178.29 1pck h VAL 1212N 0.21 0.46 -0.18 0.00 -1.51 -1.37 0.48 116.25 114.34 1pck h VAL 1212Ca 0.16 -1.27 -0.22 0.00 -1.23 0.00 0.00 66.70 64.14 1pck h VAL 1212Cb 0.17 1.92 0.01 0.00 -2.13 0.00 0.00 31.29 31.26 1pck h VAL 1212CO -0.20 0.22 -0.74 0.00 -1.23 0.00 0.00 177.57 175.62 1pck h ALA 1213N 1.78 0.34 -0.11 5.19 0.00 -0.75 -3.17 119.26 122.54 1pck h ALA 1213Ca -0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1pck h ALA 1213Cb 0.91 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1pck h ALA 1213CO 0.03 0.68 -0.05 0.28 0.00 0.00 0.00 179.25 180.19 1pck h VAL 1214N 0.57 1.32 0.00 0.00 2.07 -0.95 -3.47 116.25 115.78 1pck h VAL 1214Ca -0.04 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.42 1pck h VAL 1214Cb 1.36 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 1pck h VAL 1214CO 0.15 0.30 0.00 0.61 0.02 0.00 0.00 177.57 178.66 1pck n GLY 1215N -0.00 3.04 3.39 2.17 0.00 0.15 -4.86 105.19 109.08 1pck n GLY 1215Ca -0.06 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1pck n GLY 1215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pck n ASP 1217N -0.62 2.09 0.00 0.00 8.00 0.73 -4.99 116.55 121.76 1pck n ASP 1217Ca 0.01 -1.56 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1pck n ASP 1217Cb 0.63 0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 1pck n ASP 1217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pck n GLY 1218N 1.35 0.26 3.16 0.44 0.00 -1.12 -1.93 105.19 107.36 1pck n GLY 1218Ca 0.13 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 1pck n GLY 1218CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pck s VAL 1219N -2.00 0.93 -0.12 1.61 -7.23 -0.02 -1.41 120.40 112.17 1pck s VAL 1219Ca 0.00 -1.48 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 1pck s VAL 1219Cb 0.00 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.77 1pck s VAL 1219CO 0.00 -0.45 -0.19 0.12 -0.31 0.00 0.00 175.10 174.26 1pck s PHE 1220N -2.01 2.33 -0.02 2.82 2.19 0.71 -0.69 117.98 123.30 1pck s PHE 1220Ca 0.01 -1.09 0.00 0.00 0.33 0.00 0.00 56.93 56.19 1pck s PHE 1220Cb -0.06 -1.61 0.03 0.00 -1.31 0.00 0.00 43.02 40.07 1pck s PHE 1220CO 0.01 -0.51 0.03 -1.64 1.83 0.00 0.00 175.22 174.94 1pck s MET 1221N 0.77 -0.02 0.04 10.12 -1.94 0.14 -0.69 119.30 127.71 1pck s MET 1221Ca -0.10 0.18 -0.23 0.00 -1.71 0.00 0.00 55.69 53.83 1pck s MET 1221Cb -0.16 -0.26 -0.06 0.00 2.01 0.00 0.00 34.83 36.37 1pck s MET 1221CO 0.01 -0.16 0.68 -1.21 -0.01 0.00 0.00 175.02 174.32 1pck s GLU 1222N 1.05 4.40 0.01 2.03 2.02 -1.26 -2.91 118.70 124.03 1pck s GLU 1222Ca -0.09 0.90 0.00 0.00 0.02 0.00 0.00 54.97 55.80 1pck s GLU 1222Cb -0.13 -3.33 -0.01 0.00 0.10 0.00 0.00 34.13 30.76 1pck s GLU 1222CO -0.03 0.38 -0.01 -0.08 0.02 0.00 0.00 175.26 175.53 1pck s THR 1223N -0.30 0.07 -0.06 3.63 -1.32 -0.44 -1.00 115.64 116.22 1pck s THR 1223Ca 0.34 -0.32 -0.08 0.00 -1.21 0.00 0.00 61.69 60.42 1pck s THR 1223Cb -0.20 -0.12 0.02 0.00 -1.51 0.00 0.00 72.50 70.69 1pck s THR 1223CO 0.20 -0.16 0.21 -2.28 -2.21 0.00 0.00 174.62 170.39 1pck s HIS 1224N -0.49 -0.17 0.27 9.09 5.04 -0.56 -2.39 115.29 126.08 1pck s HIS 1224Ca -0.05 0.39 -0.01 0.00 -1.54 0.00 0.00 55.06 53.86 1pck s HIS 1224Cb -0.03 0.05 0.53 0.00 0.04 0.00 0.00 32.58 33.17 1pck s HIS 1224CO -0.00 -0.19 1.78 -1.35 -2.34 0.00 0.00 174.74 172.64 1pck h PRO 1225N 5.22 0.70 -2.40 2.88 0.11 -1.94 -1.39 132.00 135.17 1pck h PRO 1225Ca -0.27 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.21 1pck h PRO 1225Cb 1.19 -0.16 -0.38 0.00 0.11 0.00 0.00 31.00 31.76 1pck h PRO 1225CO 0.38 0.46 -0.96 -1.21 -0.21 0.00 0.00 178.00 176.46 1pck s GLU 1226N -5.97 0.86 0.32 1.05 2.02 -1.26 -4.41 118.70 111.31 1pck s GLU 1226Ca -0.12 -2.00 0.08 0.00 0.02 0.00 0.00 54.97 52.95 1pck s GLU 1226Cb 0.22 -1.41 0.91 0.00 0.10 0.00 0.00 34.13 33.95 1pck s GLU 1226CO 0.79 -1.36 1.62 -1.35 0.02 0.00 0.00 175.26 174.97 1pck h PRO 1227N 5.84 0.14 -0.13 0.39 0.11 -1.85 0.19 132.00 136.69 1pck h PRO 1227Ca 0.24 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.38 1pck h PRO 1227Cb 0.92 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.99 1pck h PRO 1227CO 0.36 0.09 0.19 1.05 -0.21 0.00 0.00 178.00 179.48 1pck h GLU 1228N 0.15 0.00 -0.12 1.05 4.11 -1.93 0.11 114.58 117.94 1pck h GLU 1228Ca 0.65 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.08 1pck h GLU 1228Cb 1.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.71 1pck h GLU 1228CO -0.73 0.00 0.00 1.63 0.07 0.00 0.00 179.01 179.98 1pck n LYS 1229N -3.57 2.37 -1.89 1.06 5.02 0.67 -4.99 118.16 116.83 1pck n LYS 1229Ca 0.00 -2.01 -0.36 0.00 -2.02 0.00 0.00 58.31 53.92 1pck n LYS 1229Cb 0.30 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 33.88 1pck n LYS 1229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pck s ALA 1230N -1.87 2.46 -2.49 7.82 0.00 0.38 -4.92 121.76 123.14 1pck s ALA 1230Ca 0.31 1.04 0.27 0.00 0.00 0.00 0.00 51.96 53.59 1pck s ALA 1230Cb 0.21 -3.48 0.92 0.00 0.00 0.00 0.00 23.12 20.77 1pck s ALA 1230CO 0.31 -1.34 1.67 1.28 0.00 0.00 0.00 175.76 177.68 1pck n LEU 1231N -1.78 1.63 -3.63 0.00 4.77 -1.26 -4.59 117.00 112.14 1pck n LEU 1231Ca 0.14 -0.54 -0.14 0.00 -0.03 0.00 0.00 56.01 55.44 1pck n LEU 1231Cb 0.49 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 1pck n LEU 1231CO 0.45 0.27 0.41 -0.94 -1.33 0.00 0.00 177.39 176.25 1pck s SER 1232N -2.05 -0.73 -1.49 -1.43 1.04 -1.26 -4.40 113.70 103.39 1pck s SER 1232Ca 0.36 1.37 -0.11 0.00 0.48 0.00 0.00 55.95 58.04 1pck s SER 1232Cb 0.21 1.38 0.07 0.00 0.10 0.00 0.00 66.02 67.78 1pck s SER 1232CO 0.35 -0.27 0.95 0.47 0.98 0.00 0.00 173.24 175.72 1pck n ASP 1233N 2.58 -4.32 0.26 7.02 9.92 -1.26 -4.85 116.55 125.90 1pck n ASP 1233Ca -0.14 -0.77 0.12 0.00 -0.53 0.00 0.00 54.79 53.46 1pck n ASP 1233Cb 0.55 -3.97 0.73 0.00 -0.64 0.00 0.00 41.12 37.79 1pck n ASP 1233CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1pck h ALA 1234N 0.95 1.36 0.00 2.24 0.00 -1.81 -1.40 119.26 120.60 1pck h ALA 1234Ca -0.58 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1pck h ALA 1234Cb 1.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1pck h ALA 1234CO 0.65 0.14 -0.47 0.43 0.00 0.00 0.00 179.25 180.00 1pck n SER 1235N -3.74 0.58 0.00 0.00 7.64 -1.26 -4.06 113.62 112.78 1pck n SER 1235Ca -0.02 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1pck n SER 1235Cb 0.22 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 1pck n SER 1235CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1pck n THR 1236N -1.88 0.00 -1.93 0.44 -2.24 -0.97 -4.16 114.28 103.54 1pck n THR 1236Ca 0.05 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.34 1pck n THR 1236Cb 0.40 0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 69.14 1pck n THR 1236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1pck s GLN 1237N -1.69 4.22 0.09 -0.78 -0.21 -0.57 -4.87 119.66 115.84 1pck s GLN 1237Ca 0.00 2.40 -0.30 0.00 0.02 0.00 0.00 55.36 57.48 1pck s GLN 1237Cb 0.00 -3.07 -0.05 0.00 1.00 0.00 0.00 33.01 30.88 1pck s GLN 1237CO 0.00 -0.48 1.03 -1.17 -2.12 0.00 0.00 175.29 172.55 1pck s LEU 1238N -0.58 4.44 0.25 2.90 2.96 -0.17 -4.73 118.68 123.74 1pck s LEU 1238Ca 0.60 1.85 -0.31 0.00 -0.22 0.00 0.00 54.13 56.05 1pck s LEU 1238Cb -0.44 -3.59 -0.12 0.00 0.50 0.00 0.00 46.19 42.54 1pck s LEU 1238CO 0.46 -0.22 1.57 -2.65 -1.32 0.00 0.00 176.35 174.19 1pck n PRO 1239N 3.19 2.48 -0.28 0.98 -0.02 -1.26 -1.49 135.00 138.59 1pck n PRO 1239Ca 0.04 0.88 0.15 0.00 -2.02 0.00 0.00 63.50 62.55 1pck n PRO 1239Cb 0.49 -2.64 0.41 0.00 -0.02 0.00 0.00 33.50 31.74 1pck n PRO 1239CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1pck h LEU 1240N 5.10 0.60 -1.90 2.45 5.85 -1.46 -0.65 115.31 125.30 1pck h LEU 1240Ca -0.46 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1pck h LEU 1240Cb 1.24 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1pck h LEU 1240CO 0.82 0.26 0.00 0.77 -0.34 0.00 0.00 178.44 179.96 1pck h SER 1241N 0.61 0.00 0.46 1.25 4.64 -1.88 -2.28 113.55 116.35 1pck h SER 1241Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1pck h SER 1241Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1pck h SER 1241CO -0.23 0.00 -0.58 0.00 -0.87 0.00 0.00 176.83 175.15 1pck n GLN 1242N -2.83 0.02 0.09 4.77 6.02 -0.25 -4.45 117.38 120.75 1pck n GLN 1242Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 1pck n GLN 1242Cb 0.17 -1.51 -0.05 0.00 1.02 0.00 0.00 30.24 29.86 1pck n GLN 1242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1pck h LEU 1243N 0.00 -0.47 -0.50 1.08 5.85 -1.44 -2.65 115.31 117.17 1pck h LEU 1243Ca 0.00 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.87 1pck h LEU 1243Cb 0.52 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.66 1pck h LEU 1243CO 0.00 -0.24 0.08 -0.08 -0.34 0.00 0.00 178.44 177.86 1pck h GLU 1244N -0.31 0.21 -0.68 1.25 4.81 -1.78 -1.23 114.58 116.84 1pck h GLU 1244Ca 0.03 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1pck h GLU 1244Cb 0.34 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1pck h GLU 1244CO -0.11 0.14 0.19 0.78 -0.73 0.00 0.00 179.01 179.28 1pck h GLY 1245N 0.21 1.13 0.95 1.92 0.00 -1.82 -1.02 103.07 104.45 1pck h GLY 1245Ca 0.25 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1pck h GLY 1245CO -0.34 0.63 0.06 -2.22 0.00 0.00 0.00 176.54 174.66 1pck h ILE 1246N 1.01 1.25 -0.45 2.60 1.08 -1.06 -1.53 117.51 120.41 1pck h ILE 1246Ca 0.22 -0.90 -0.02 0.00 -0.39 0.00 0.00 64.86 63.77 1pck h ILE 1246Cb 0.31 1.02 -0.02 0.00 -3.07 0.00 0.00 36.82 35.06 1pck h ILE 1246CO -0.00 0.31 0.19 0.40 -0.69 0.00 0.00 178.15 178.36 1pck h ILE 1247N 0.55 1.20 -0.40 -0.67 2.04 -1.04 -1.17 117.51 118.03 1pck h ILE 1247Ca 0.13 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1pck h ILE 1247Cb 0.39 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1pck h ILE 1247CO 0.01 0.22 0.23 -0.08 0.00 0.00 0.00 178.15 178.53 1pck h GLU 1248N 0.58 0.45 -0.35 2.37 4.57 -1.05 -1.57 114.58 119.57 1pck h GLU 1248Ca 0.15 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.32 1pck h GLU 1248Cb 0.17 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1pck h GLU 1248CO -0.01 0.30 0.21 0.00 -1.18 0.00 0.00 179.01 178.32 1pck h ALA 1249N 1.18 0.44 0.00 2.92 0.00 -0.97 -1.49 119.26 121.35 1pck h ALA 1249Ca 0.16 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1pck h ALA 1249Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1pck h ALA 1249CO -0.08 -0.13 -0.42 -0.84 0.00 0.00 0.00 179.25 177.78 1pck h ILE 1250N 0.43 1.19 -0.31 0.00 3.07 -0.97 -1.02 117.51 119.91 1pck h ILE 1250Ca 0.14 -1.48 -0.15 0.00 1.55 0.00 0.00 64.86 64.92 1pck h ILE 1250Cb -0.01 1.82 -0.01 0.00 -0.27 0.00 0.00 36.82 38.36 1pck h ILE 1250CO -0.06 0.41 -0.40 -0.07 -1.05 0.00 0.00 178.15 176.98 1pck h LEU 1251N 0.00 0.80 -0.31 0.16 3.38 -0.96 0.10 115.31 118.49 1pck h LEU 1251Ca -0.00 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.54 1pck h LEU 1251Cb 0.79 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1pck h LEU 1251CO 0.05 1.10 -0.04 -0.33 0.09 0.00 0.00 178.44 179.31 1pck h GLU 1252N 0.61 0.57 -0.50 1.13 5.08 -0.84 -1.08 114.58 119.56 1pck h GLU 1252Ca 0.05 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.08 1pck h GLU 1252Cb 0.95 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1pck h GLU 1252CO 0.09 0.74 -0.20 0.82 -1.00 0.00 0.00 179.01 179.46 1pck h ILE 1253N 0.35 1.27 -0.24 3.13 2.04 -1.12 -2.58 117.51 120.37 1pck h ILE 1253Ca 0.08 -1.36 0.02 0.00 1.00 0.00 0.00 64.86 64.60 1pck h ILE 1253Cb 0.51 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1pck h ILE 1253CO 0.02 0.47 0.11 -0.09 0.00 0.00 0.00 178.15 178.67 1pck h ARG 1254N 0.87 0.24 0.08 2.37 2.43 -0.70 -1.48 114.38 118.18 1pck h ARG 1254Ca 0.12 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1pck h ARG 1254Cb 0.77 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.24 1pck h ARG 1254CO 0.06 0.16 -0.19 1.49 -1.51 0.00 0.00 179.97 179.98 1pck h GLU 1255N 0.24 -0.34 0.00 0.20 4.57 -1.04 0.31 114.58 118.53 1pck h GLU 1255Ca 0.10 0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 58.23 1pck h GLU 1255Cb 0.03 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1pck h GLU 1255CO -0.07 -0.23 -0.34 -0.24 -1.18 0.00 0.00 179.01 176.95 1pck h VAL 1256N -0.35 1.17 0.00 0.32 3.04 -1.37 -3.02 116.25 116.03 1pck h VAL 1256Ca 0.03 -1.19 -0.15 0.00 -1.01 0.00 0.00 66.70 64.39 1pck h VAL 1256Cb 0.39 1.65 -0.02 0.00 -2.01 0.00 0.00 31.29 31.30 1pck h VAL 1256CO -0.13 0.33 -1.13 0.00 -1.01 0.00 0.00 177.57 175.63 1pck h ALA 1257N 1.66 0.65 -1.09 3.17 0.00 -0.98 -3.40 119.26 119.28 1pck h ALA 1257Ca -0.00 -0.72 0.32 0.00 0.00 0.00 0.00 54.91 54.50 1pck h ALA 1257Cb 0.63 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 18.45 1pck h ALA 1257CO 0.04 0.83 0.67 0.66 0.00 0.00 0.00 179.25 181.45 1pck h SER 1258N 0.00 0.45 0.47 0.00 4.64 -0.26 0.13 113.55 118.99 1pck h SER 1258Ca -0.11 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1pck h SER 1258Cb 1.52 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1pck h SER 1258CO 0.05 -0.03 0.00 0.07 -0.87 0.00 0.00 176.83 176.05 1pck h LYS 1259N 0.33 0.00 -0.02 4.77 2.10 -1.77 -2.45 116.57 119.53 1pck h LYS 1259Ca 0.69 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.34 1pck h LYS 1259Cb 1.75 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.08 1pck h LYS 1259CO -0.43 0.00 -0.24 0.66 -2.00 0.00 0.00 179.45 177.44 1pck n TYR 1260N -2.92 0.00 -1.76 0.07 4.02 0.46 -4.94 117.16 112.08 1pck n TYR 1260Ca -0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.46 1pck n TYR 1260Cb 0.17 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.45 1pck n TYR 1260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1pck s TYR 1261N -2.26 2.71 0.43 -0.72 4.12 -0.93 -4.95 117.35 115.75 1pck s TYR 1261Ca 0.24 0.28 -0.23 0.00 0.02 0.00 0.00 57.07 57.39 1pck s TYR 1261Cb 0.19 -4.11 -0.09 0.00 -1.52 0.00 0.00 41.96 36.43 1pck s TYR 1261CO 0.45 -4.32 1.05 -1.21 0.02 0.00 0.00 175.55 171.53 1pck s GLU 1262N 1.64 4.04 -0.11 -0.62 8.01 -1.26 -5.01 118.70 125.40 1pck s GLU 1262Ca 0.76 1.48 -0.28 0.00 0.01 0.00 0.00 54.97 56.94 1pck s GLU 1262Cb -0.48 -2.40 -0.02 0.00 -4.31 0.00 0.00 34.13 26.92 1pck s GLU 1262CO 0.33 -0.24 0.91 0.99 0.01 0.00 0.00 175.26 177.26 1pck s THR 1263N -1.75 4.86 -2.00 3.63 2.01 -1.26 -5.16 115.64 115.97 1pck s THR 1263Ca 0.61 1.85 0.29 0.00 0.31 0.00 0.00 61.69 64.74 1pck s THR 1263Cb -0.21 -4.23 0.81 0.00 0.01 0.00 0.00 72.50 68.89 1pck s THR 1263CO 0.26 0.06 2.05 2.30 -0.69 0.00 0.00 174.62 178.60