#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t99 n LYS 1003N 0.00 2.06 -2.56 5.31 4.81 -1.26 -4.95 118.16 121.57 1t99 n LYS 1003Ca 0.00 0.75 -0.41 0.00 -0.87 0.00 0.00 58.31 57.79 1t99 n LYS 1003Cb 0.00 -2.56 -0.04 0.00 0.02 0.00 0.00 35.03 32.45 1t99 n LYS 1003CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1t99 s PHE 1004N 2.97 3.67 -0.16 5.64 2.19 -1.20 -4.77 117.98 126.32 1t99 s PHE 1004Ca 0.89 1.69 -0.15 0.00 0.33 0.00 0.00 56.93 59.69 1t99 s PHE 1004Cb -0.72 -3.21 -0.04 0.00 -1.31 0.00 0.00 43.02 37.73 1t99 s PHE 1004CO 0.48 -0.36 0.34 -1.17 1.83 0.00 0.00 175.22 176.34 1t99 s LEU 1005N -0.74 4.23 -0.20 6.12 2.96 -0.53 -0.78 118.68 129.73 1t99 s LEU 1005Ca 0.47 0.56 0.01 0.00 -0.22 0.00 0.00 54.13 54.95 1t99 s LEU 1005Cb -0.29 -2.45 0.04 0.00 0.50 0.00 0.00 46.19 43.99 1t99 s LEU 1005CO 0.36 0.05 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.62 1t99 s VAL 1006N 0.65 1.85 -0.24 1.68 1.01 -0.44 -0.68 120.40 124.22 1t99 s VAL 1006Ca 0.18 -1.10 -0.08 0.00 0.00 0.00 0.00 61.98 60.99 1t99 s VAL 1006Cb -0.14 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1t99 s VAL 1006CO 0.06 0.23 0.08 -0.63 0.00 0.00 0.00 175.10 174.84 1t99 s ILE 1007N 1.31 4.46 0.07 2.22 1.01 -0.20 -1.19 121.20 128.88 1t99 s ILE 1007Ca -0.01 -0.13 -0.12 0.00 0.00 0.00 0.00 60.65 60.39 1t99 s ILE 1007Cb -0.16 -3.08 0.01 0.00 0.01 0.00 0.00 42.46 39.24 1t99 s ILE 1007CO -0.09 0.34 0.27 0.00 0.00 0.00 0.00 174.94 175.47 1t99 s ALA 1008N 1.48 -0.54 0.00 9.38 0.00 -0.66 -0.68 121.76 130.74 1t99 s ALA 1008Ca 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1t99 s ALA 1008Cb -0.15 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.42 1t99 s ALA 1008CO 0.04 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1t99 n GLY 1009N 0.21 1.01 3.77 0.00 0.00 -1.15 -0.78 105.19 108.25 1t99 n GLY 1009Ca -0.17 -1.21 -0.37 0.00 0.00 0.00 0.00 46.02 44.27 1t99 n GLY 1009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t99 s PRO 1010N -1.99 4.00 0.13 1.61 0.04 -1.06 -1.25 135.00 136.47 1t99 s PRO 1010Ca 0.00 1.68 -0.27 0.00 0.04 0.00 0.00 61.00 62.44 1t99 s PRO 1010Cb 0.00 -2.53 -0.05 0.00 0.04 0.00 0.00 34.50 31.96 1t99 s PRO 1010CO 0.00 -0.32 1.61 0.00 0.04 0.00 0.00 177.00 178.33 1t99 s ALA 1012N -5.99 2.52 -1.24 0.00 0.00 -1.26 -1.55 121.76 114.24 1t99 s ALA 1012Ca -0.16 -1.25 -0.20 0.00 0.00 0.00 0.00 51.96 50.36 1t99 s ALA 1012Cb 0.09 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 1t99 s ALA 1012CO 0.65 0.56 1.86 -0.89 0.00 0.00 0.00 175.76 177.94 1t99 n ILE 1013N 1.47 3.02 0.21 0.00 5.41 -0.80 -4.70 119.36 123.97 1t99 n ILE 1013Ca -0.16 -3.09 0.05 0.00 1.00 0.00 0.00 62.75 60.55 1t99 n ILE 1013Cb 0.52 -2.30 0.49 0.00 -0.71 0.00 0.00 39.64 37.65 1t99 n ILE 1013CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1t99 h GLU 1014N 8.31 0.05 -2.08 0.38 5.08 -1.96 -3.42 114.58 120.93 1t99 h GLU 1014Ca 0.37 -0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.92 1t99 h GLU 1014Cb 0.87 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.00 1t99 h GLU 1014CO 1.42 0.20 0.58 -1.54 -1.00 0.00 0.00 179.01 178.67 1t99 s SER 1015N -6.98 -0.19 0.40 1.42 1.04 -1.26 -5.00 113.70 103.13 1t99 s SER 1015Ca -0.04 -0.23 0.22 0.00 0.48 0.00 0.00 55.95 56.37 1t99 s SER 1015Cb 0.16 0.37 0.48 0.00 0.10 0.00 0.00 66.02 67.14 1t99 s SER 1015CO 0.70 -0.67 1.64 -0.08 0.98 0.00 0.00 173.24 175.81 1t99 h GLU 1016N 2.00 0.00 -0.15 4.02 4.81 -1.97 -3.05 114.58 120.24 1t99 h GLU 1016Ca -0.24 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.90 1t99 h GLU 1016Cb 1.22 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 1t99 h GLU 1016CO 0.27 0.19 -0.26 1.49 -0.73 0.00 0.00 179.01 179.98 1t99 h GLU 1017N 0.00 0.44 -0.55 1.92 4.81 -1.99 -2.30 114.58 116.91 1t99 h GLU 1017Ca -0.00 -0.27 0.06 0.00 -0.13 0.00 0.00 59.36 59.02 1t99 h GLU 1017Cb 1.01 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 1t99 h GLU 1017CO 0.03 0.87 0.25 1.25 -0.73 0.00 0.00 179.01 180.67 1t99 h LEU 1018N 0.05 0.33 -0.50 1.64 5.85 -1.95 -0.96 115.31 119.77 1t99 h LEU 1018Ca 0.01 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1t99 h LEU 1018Cb 0.84 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.82 1t99 h LEU 1018CO 0.06 0.22 0.24 -0.07 -0.34 0.00 0.00 178.44 178.55 1t99 h LEU 1019N 0.47 0.33 -0.92 2.25 4.07 -1.44 -1.64 115.31 118.44 1t99 h LEU 1019Ca 0.25 0.03 -0.11 0.00 0.08 0.00 0.00 57.88 58.14 1t99 h LEU 1019Cb 0.22 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 1t99 h LEU 1019CO -0.21 0.23 -0.48 -0.07 -1.08 0.00 0.00 178.44 176.84 1t99 h LEU 1020N 0.47 0.16 -0.37 1.67 3.38 -0.93 0.79 115.31 120.48 1t99 h LEU 1020Ca 0.22 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1t99 h LEU 1020Cb 0.15 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1t99 h LEU 1020CO -0.17 0.61 -0.13 0.50 0.09 0.00 0.00 178.44 179.34 1t99 h LYS 1021N 0.12 0.74 -0.11 1.13 3.64 -0.71 -0.73 116.57 120.65 1t99 h LYS 1021Ca 0.01 -0.30 -0.22 0.00 -1.27 0.00 0.00 60.65 58.87 1t99 h LYS 1021Cb 0.89 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.69 1t99 h LYS 1021CO 0.07 0.91 -0.77 0.28 -2.27 0.00 0.00 179.45 177.66 1t99 h VAL 1022N 0.53 1.30 -0.65 2.00 2.07 -1.24 -3.15 116.25 117.11 1t99 h VAL 1022Ca 0.09 -2.00 0.06 0.00 0.82 0.00 0.00 66.70 65.67 1t99 h VAL 1022Cb 0.66 2.11 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 1t99 h VAL 1022CO 0.04 0.62 0.43 1.23 0.02 0.00 0.00 177.57 179.92 1t99 h GLY 1023N 0.42 0.81 0.93 2.17 0.00 -0.74 -0.84 103.07 105.82 1t99 h GLY 1023Ca -0.06 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1t99 h GLY 1023CO 0.16 0.19 0.03 -2.09 0.00 0.00 0.00 176.54 174.83 1t99 h GLU 1024N 0.65 0.64 -0.53 4.80 4.81 -1.09 -0.06 114.58 123.79 1t99 h GLU 1024Ca 0.28 -0.19 -0.09 0.00 -0.13 0.00 0.00 59.36 59.23 1t99 h GLU 1024Cb 0.28 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1t99 h GLU 1024CO -0.09 0.72 -0.01 1.49 -0.73 0.00 0.00 179.01 180.39 1t99 h GLU 1025N 0.46 0.91 -0.24 1.92 4.57 -1.32 -1.81 114.58 119.08 1t99 h GLU 1025Ca 0.11 -0.27 -0.10 0.00 -1.18 0.00 0.00 59.36 57.91 1t99 h GLU 1025Cb 0.42 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1t99 h GLU 1025CO 0.01 0.91 -0.29 0.82 -1.18 0.00 0.00 179.01 179.28 1t99 h ILE 1026N 0.84 1.28 -0.41 2.32 2.04 -0.96 -1.04 117.51 121.57 1t99 h ILE 1026Ca 0.15 -1.34 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 1t99 h ILE 1026Cb 0.52 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1t99 h ILE 1026CO 0.03 0.42 0.05 0.50 0.00 0.00 0.00 178.15 179.15 1t99 h LYS 1027N 0.42 0.69 -0.70 2.37 1.63 -0.77 -0.48 116.57 119.72 1t99 h LYS 1027Ca 0.06 -0.19 0.01 0.00 -0.85 0.00 0.00 60.65 59.67 1t99 h LYS 1027Cb 0.72 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.24 1t99 h LYS 1027CO 0.06 0.74 0.46 -0.09 -3.45 0.00 0.00 179.45 177.17 1t99 h ARG 1028N 0.53 0.91 -0.13 1.90 2.43 -0.93 -1.97 114.38 117.12 1t99 h ARG 1028Ca 0.12 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 1t99 h ARG 1028Cb 0.40 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1t99 h ARG 1028CO 0.01 0.60 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.62 1t99 h LEU 1029N 0.94 0.29 -1.35 3.80 3.38 -0.91 -2.35 115.31 119.11 1t99 h LEU 1029Ca 0.26 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 1t99 h LEU 1029Cb -0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1t99 h LEU 1029CO -0.06 0.66 -0.32 0.77 0.09 0.00 0.00 178.44 179.57 1t99 h SER 1030N 0.24 0.00 0.45 -0.43 4.64 -0.54 0.48 113.55 118.40 1t99 h SER 1030Ca 0.02 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.15 1t99 h SER 1030Cb 0.79 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1t99 h SER 1030CO 0.06 0.32 -0.82 -0.33 -0.87 0.00 0.00 176.83 175.20 1t99 h GLU 1031N 0.00 0.27 0.02 4.77 4.39 -0.87 -3.30 114.58 119.86 1t99 h GLU 1031Ca -0.00 -0.26 -0.00 0.00 0.34 0.00 0.00 59.36 59.43 1t99 h GLU 1031Cb 0.58 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1t99 h GLU 1031CO 0.04 0.95 -0.01 -0.22 -1.16 0.00 0.00 179.01 178.61 1t99 h LYS 1032N 0.17 -0.03 -3.87 2.33 3.64 -0.91 -3.38 116.57 114.52 1t99 h LYS 1032Ca -0.04 0.00 -0.76 0.00 -1.27 0.00 0.00 60.65 58.58 1t99 h LYS 1032Cb 1.42 0.01 -0.18 0.00 -0.41 0.00 0.00 32.23 33.06 1t99 h LYS 1032CO 0.13 0.63 1.56 1.19 -2.27 0.00 0.00 179.45 180.69 1t99 n PHE 1033N -4.71 3.72 0.30 1.91 3.01 0.16 -4.80 117.46 117.06 1t99 n PHE 1033Ca -0.07 -3.04 0.18 0.00 1.01 0.00 0.00 57.45 55.53 1t99 n PHE 1033Cb 0.33 -1.94 0.88 0.00 -0.01 0.00 0.00 39.48 38.74 1t99 n PHE 1033CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1t99 h LYS 1034N 6.24 0.00 -0.03 -1.08 1.57 -1.75 -1.43 116.57 120.08 1t99 h LYS 1034Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1t99 h LYS 1034Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1t99 h LYS 1034CO 1.43 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 179.46 1t99 n GLU 1035N -2.91 1.25 -4.67 3.15 0.00 -1.26 -4.82 120.64 111.38 1t99 n GLU 1035Ca -0.01 -0.36 -0.33 0.00 0.00 0.00 0.00 57.16 56.46 1t99 n GLU 1035Cb 0.17 -1.40 -0.12 0.00 0.00 0.00 0.00 31.44 30.09 1t99 n GLU 1035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1t99 s VAL 1036N -1.96 3.40 -0.40 3.84 1.01 -0.54 -3.26 120.40 122.49 1t99 s VAL 1036Ca 0.36 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 1t99 s VAL 1036Cb 0.18 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 34.17 1t99 s VAL 1036CO 0.29 0.51 0.28 -0.70 0.00 0.00 0.00 175.10 175.49 1t99 s GLU 1037N -1.02 2.98 0.17 2.72 2.12 0.04 -4.95 118.70 120.75 1t99 s GLU 1037Ca 0.14 -1.01 -0.14 0.00 0.36 0.00 0.00 54.97 54.32 1t99 s GLU 1037Cb -0.11 -3.94 -0.07 0.00 0.26 0.00 0.00 34.13 30.27 1t99 s GLU 1037CO 0.03 -0.73 0.57 -0.06 -0.54 0.00 0.00 175.26 174.54 1t99 s PHE 1038N 1.67 3.59 -0.06 5.30 0.40 -1.26 -1.33 117.98 126.29 1t99 s PHE 1038Ca 0.05 1.08 -0.00 0.00 -0.60 0.00 0.00 56.93 57.45 1t99 s PHE 1038Cb -0.19 -2.39 0.03 0.00 0.51 0.00 0.00 43.02 40.98 1t99 s PHE 1038CO 0.10 0.40 -0.01 0.08 0.70 0.00 0.00 175.22 176.48 1t99 s VAL 1039N -1.52 0.39 -0.02 -0.44 1.01 -0.34 -4.15 120.40 115.34 1t99 s VAL 1039Ca 0.40 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.16 1t99 s VAL 1039Cb -0.15 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 1t99 s VAL 1039CO 0.19 0.23 0.85 0.12 0.00 0.00 0.00 175.10 176.50 1t99 s PHE 1040N 1.54 3.63 -0.01 5.22 5.36 0.26 -1.65 117.98 132.34 1t99 s PHE 1040Ca -0.02 1.50 0.06 0.00 -0.96 0.00 0.00 56.93 57.51 1t99 s PHE 1040Cb -0.13 -2.96 -0.02 0.00 -0.34 0.00 0.00 43.02 39.57 1t99 s PHE 1040CO -0.03 0.06 -0.19 0.21 -1.46 0.00 0.00 175.22 173.80 1t99 s LYS 1041N 0.82 1.53 -0.29 10.12 2.36 0.04 -1.36 119.74 132.97 1t99 s LYS 1041Ca 0.45 -0.71 -0.25 0.00 -2.55 0.00 0.00 55.97 52.91 1t99 s LYS 1041Cb -0.20 -1.50 0.14 0.00 -1.05 0.00 0.00 37.83 35.22 1t99 s LYS 1041CO 0.24 0.41 1.12 0.45 1.55 0.00 0.00 175.35 179.11 1t99 s SER 1042N -0.53 -0.37 -0.14 1.43 0.15 -1.18 -3.31 113.70 109.75 1t99 s SER 1042Ca 0.07 0.71 -0.21 0.00 0.70 0.00 0.00 55.95 57.22 1t99 s SER 1042Cb -0.08 0.74 -0.03 0.00 -1.71 0.00 0.00 66.02 64.94 1t99 s SER 1042CO -0.00 -0.12 0.60 -0.44 1.20 0.00 0.00 173.24 174.47 1t99 s SER 1043N 0.24 6.75 0.26 5.45 0.01 -0.59 -4.58 113.70 121.25 1t99 s SER 1043Ca 0.03 0.91 0.25 0.00 1.31 0.00 0.00 55.95 58.45 1t99 s SER 1043Cb -0.05 -2.34 0.92 0.00 0.21 0.00 0.00 66.02 64.76 1t99 s SER 1043CO -0.09 -0.15 1.75 2.19 0.41 0.00 0.00 173.24 177.35 1t99 h PHE 1044N 7.09 0.00 -2.03 2.43 -5.15 -1.89 -2.13 116.94 115.27 1t99 h PHE 1044Ca -0.37 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 57.42 1t99 h PHE 1044Cb 1.17 0.00 -0.21 0.00 0.22 0.00 0.00 35.95 37.12 1t99 h PHE 1044CO 0.67 0.00 0.00 0.34 -2.00 0.00 0.00 178.31 177.32 1t99 s ASP 1045N -4.49 -0.94 -0.86 -0.68 2.15 -1.26 -3.86 116.67 106.73 1t99 s ASP 1045Ca 0.06 1.50 -0.17 0.00 0.43 0.00 0.00 52.55 54.37 1t99 s ASP 1045Cb 0.10 1.39 0.17 0.00 -0.30 0.00 0.00 42.92 44.28 1t99 s ASP 1045CO 0.48 -0.24 0.94 -0.54 -0.17 0.00 0.00 175.17 175.65 1t99 s LYS 1046N 1.66 3.56 0.00 4.34 -0.14 -0.15 -4.88 119.74 124.13 1t99 s LYS 1046Ca -0.10 -2.01 0.21 0.00 -1.36 0.00 0.00 55.97 52.71 1t99 s LYS 1046Cb -0.05 -4.66 1.01 0.00 -1.68 0.00 0.00 37.83 32.45 1t99 s LYS 1046CO -0.20 -1.56 1.69 0.00 -0.76 0.00 0.00 175.35 174.53 1t99 n ALA 1047N 5.47 2.06 -2.73 5.17 0.00 -1.26 -4.05 120.51 125.17 1t99 n ALA 1047Ca 0.17 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 1t99 n ALA 1047Cb 0.48 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.60 1t99 n ALA 1047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1t99 n ASN 1048N -1.37 1.49 -4.76 0.00 6.94 -1.26 -5.10 115.26 111.20 1t99 n ASN 1048Ca 0.08 -2.79 -0.33 0.00 -0.02 0.00 0.00 54.58 51.52 1t99 n ASN 1048Cb 0.20 -0.54 0.06 0.00 -2.36 0.00 0.00 39.78 37.14 1t99 n ASN 1048CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1t99 s ARG 1049N -3.04 2.65 0.06 -3.83 1.81 -1.26 -4.95 118.95 110.39 1t99 s ARG 1049Ca 0.30 1.48 -0.28 0.00 -1.72 0.00 0.00 55.73 55.50 1t99 s ARG 1049Cb 0.44 -1.92 -0.17 0.00 -0.45 0.00 0.00 34.95 32.84 1t99 s ARG 1049CO 0.01 -1.38 1.57 0.77 -0.68 0.00 0.00 175.30 175.60 1t99 h SER 1050N -0.03 -0.46 -3.05 0.23 0.02 -1.99 -3.43 113.55 104.84 1t99 h SER 1050Ca -0.47 -0.03 -0.60 0.00 -0.84 0.00 0.00 61.79 59.85 1t99 h SER 1050Cb 1.26 0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.87 1t99 h SER 1050CO 0.53 -0.27 -0.20 -0.55 -1.14 0.00 0.00 176.83 175.20 1t99 s SER 1051N -4.77 6.78 0.58 3.07 0.15 -1.26 -4.96 113.70 113.28 1t99 s SER 1051Ca -0.16 0.94 0.38 0.00 0.70 0.00 0.00 55.95 57.81 1t99 s SER 1051Cb 0.04 -2.24 1.85 0.00 -1.71 0.00 0.00 66.02 63.96 1t99 s SER 1051CO 0.62 0.28 2.14 -0.29 1.20 0.00 0.00 173.24 177.18 1t99 h ILE 1052N 3.46 0.00 -0.00 6.45 6.09 -2.03 -2.36 117.51 129.13 1t99 h ILE 1052Ca -0.51 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 62.75 1t99 h ILE 1052Cb 1.21 1.19 0.00 0.00 0.47 0.00 0.00 36.82 39.69 1t99 h ILE 1052CO 0.63 0.00 -0.29 1.41 -3.07 0.00 0.00 178.15 176.83 1t99 n HIS 1053N -3.00 0.00 -1.57 2.19 8.25 -1.26 -4.94 115.22 114.89 1t99 n HIS 1053Ca -0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.14 1t99 n HIS 1053Cb 0.18 -0.25 0.07 0.00 1.12 0.00 0.00 29.99 31.11 1t99 n HIS 1053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1t99 s SER 1054N -2.78 5.04 0.08 0.41 0.01 -0.89 -4.98 113.70 110.59 1t99 s SER 1054Ca 0.18 1.48 -0.31 0.00 1.31 0.00 0.00 55.95 58.62 1t99 s SER 1054Cb 0.19 -2.31 -0.08 0.00 0.21 0.00 0.00 66.02 64.03 1t99 s SER 1054CO 0.59 -1.65 1.58 0.12 0.41 0.00 0.00 173.24 174.29 1t99 s PHE 1055N -3.09 2.68 -0.24 2.43 5.36 -1.26 -4.93 117.98 118.93 1t99 s PHE 1055Ca 0.59 0.50 -0.10 0.00 -0.96 0.00 0.00 56.93 56.97 1t99 s PHE 1055Cb -0.14 -3.89 -0.11 0.00 -0.34 0.00 0.00 43.02 38.54 1t99 s PHE 1055CO 0.55 -3.46 -0.29 0.54 -1.46 0.00 0.00 175.22 171.09 1t99 n ARG 1056N 5.08 0.52 -2.63 10.12 1.74 -1.26 -4.74 116.66 125.48 1t99 n ARG 1056Ca 0.15 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1t99 n ARG 1056Cb 0.41 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 1t99 n ARG 1056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1t99 n GLY 1057N 1.64 -0.60 0.72 -0.13 0.00 -1.26 -0.98 105.19 104.58 1t99 n GLY 1057Ca -0.46 -1.46 0.08 0.00 0.00 0.00 0.00 46.02 44.17 1t99 n GLY 1057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1t99 n HIS 1058N 8.75 0.70 0.00 1.61 8.25 -1.25 -5.05 115.22 128.22 1t99 n HIS 1058Ca 0.00 -0.77 0.00 0.00 -0.26 0.00 0.00 57.72 56.69 1t99 n HIS 1058Cb 0.00 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 30.90 1t99 n HIS 1058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1t99 n GLY 1059N -0.31 1.34 0.17 -1.41 0.00 -1.25 -4.35 105.19 99.38 1t99 n GLY 1059Ca 0.17 -1.76 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 1t99 n GLY 1059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1t99 h LEU 1060N 0.00 -0.35 -0.04 0.99 7.12 -1.99 -1.57 115.31 119.47 1t99 h LEU 1060Ca 0.00 0.03 0.03 0.00 0.13 0.00 0.00 57.88 58.08 1t99 h LEU 1060Cb 0.00 0.12 -0.06 0.00 -0.53 0.00 0.00 40.66 40.19 1t99 h LEU 1060CO 0.00 -0.20 -0.47 -0.08 -0.13 0.00 0.00 178.44 177.56 1t99 h GLU 1061N -0.29 -0.57 -0.20 1.25 4.81 -1.98 0.04 114.58 117.65 1t99 h GLU 1061Ca 0.01 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1t99 h GLU 1061Cb 0.28 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1t99 h GLU 1061CO -0.04 -0.38 -0.07 -0.92 -0.73 0.00 0.00 179.01 176.88 1t99 h TYR 1062N -0.59 -0.16 -0.28 0.92 3.20 -1.74 -2.01 116.97 116.31 1t99 h TYR 1062Ca 0.04 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.98 1t99 h TYR 1062Cb 0.67 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.00 1t99 h TYR 1062CO -0.48 -0.11 0.02 0.78 -1.64 0.00 0.00 178.16 176.73 1t99 h GLY 1063N -0.03 0.29 1.11 1.82 0.00 -0.85 -0.71 103.07 104.70 1t99 h GLY 1063Ca 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1t99 h GLY 1063CO -0.22 -0.04 0.49 -2.08 0.00 0.00 0.00 176.54 174.69 1t99 h VAL 1064N 0.12 1.24 -0.59 4.60 2.07 -0.84 0.08 116.25 122.93 1t99 h VAL 1064Ca 0.13 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 1t99 h VAL 1064Cb 0.16 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1t99 h VAL 1064CO -0.20 0.26 0.16 0.50 0.02 0.00 0.00 177.57 178.31 1t99 h LYS 1065N 1.19 0.93 0.01 1.57 3.64 -0.66 0.74 116.57 123.99 1t99 h LYS 1065Ca 0.30 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1t99 h LYS 1065Cb -0.01 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1t99 h LYS 1065CO -0.05 0.84 -0.01 0.00 -2.27 0.00 0.00 179.45 177.96 1t99 h ALA 1066N 1.04 -0.02 -0.66 5.00 0.00 -0.66 -0.90 119.26 123.06 1t99 h ALA 1066Ca 0.19 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1t99 h ALA 1066Cb 0.32 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 1t99 h ALA 1066CO -0.00 -0.38 0.31 -0.07 0.00 0.00 0.00 179.25 179.11 1t99 h LEU 1067N -0.29 0.39 -1.19 0.00 3.38 -0.88 0.70 115.31 117.42 1t99 h LEU 1067Ca -0.00 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1t99 h LEU 1067Cb 0.28 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1t99 h LEU 1067CO 0.00 0.23 0.20 -0.09 0.09 0.00 0.00 178.44 178.87 1t99 h ARG 1068N 0.54 0.76 -0.64 1.13 2.43 -0.64 -0.91 114.38 117.05 1t99 h ARG 1068Ca 0.32 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1t99 h ARG 1068Cb 0.34 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1t99 h ARG 1068CO -0.26 0.64 0.35 -0.22 -1.51 0.00 0.00 179.97 178.97 1t99 h LYS 1069N 0.75 0.90 -0.40 0.20 1.63 0.52 -0.53 116.57 119.63 1t99 h LYS 1069Ca 0.18 -0.10 0.01 0.00 -0.85 0.00 0.00 60.65 59.88 1t99 h LYS 1069Cb 0.17 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1t99 h LYS 1069CO -0.02 0.68 0.26 0.28 -3.45 0.00 0.00 179.45 177.20 1t99 h VAL 1070N 0.88 1.08 -0.19 2.00 2.07 -0.11 -0.68 116.25 121.29 1t99 h VAL 1070Ca 0.23 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1t99 h VAL 1070Cb 0.04 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1t99 h VAL 1070CO -0.04 0.10 0.10 0.50 0.02 0.00 0.00 177.57 178.25 1t99 h LYS 1071N 0.52 0.27 -0.05 1.57 3.64 -0.80 -1.33 116.57 120.39 1t99 h LYS 1071Ca 0.15 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1t99 h LYS 1071Cb -0.04 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1t99 h LYS 1071CO -0.05 0.28 0.02 0.93 -2.27 0.00 0.00 179.45 178.37 1t99 h GLU 1072N 0.20 0.07 -0.25 1.90 5.08 -0.94 0.31 114.58 120.95 1t99 h GLU 1072Ca 0.07 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1t99 h GLU 1072Cb 0.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1t99 h GLU 1072CO -0.01 0.18 -0.22 1.49 -1.00 0.00 0.00 179.01 179.45 1t99 h GLU 1073N -0.05 0.46 -0.00 2.33 4.81 -1.09 -3.35 114.58 117.69 1t99 h GLU 1073Ca 0.02 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1t99 h GLU 1073Cb 0.13 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1t99 h GLU 1073CO -0.00 0.66 -0.13 1.19 -0.73 0.00 0.00 179.01 180.00 1t99 n PHE 1074N -4.14 0.00 -1.47 0.92 3.72 -0.51 -5.00 117.46 110.98 1t99 n PHE 1074Ca -0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 1t99 n PHE 1074Cb 0.38 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.89 1t99 n PHE 1074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1t99 n GLY 1075N 0.90 0.91 3.78 1.37 0.00 0.11 -4.98 105.19 107.28 1t99 n GLY 1075Ca 0.01 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.09 1t99 n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t99 s LEU 1076N -2.41 4.58 0.67 0.99 1.02 -1.24 -5.05 118.68 117.23 1t99 s LEU 1076Ca 0.00 1.54 -0.15 0.00 0.02 0.00 0.00 54.13 55.55 1t99 s LEU 1076Cb 0.00 -3.19 0.00 0.00 0.02 0.00 0.00 46.19 43.03 1t99 s LEU 1076CO 0.00 0.22 1.11 -0.54 0.02 0.00 0.00 176.35 177.16 1t99 s LYS 1077N -1.12 2.75 0.09 1.70 1.02 -1.26 -4.45 119.74 118.48 1t99 s LYS 1077Ca 0.34 1.37 0.08 0.00 0.02 0.00 0.00 55.97 57.78 1t99 s LYS 1077Cb -0.22 -1.95 -0.03 0.00 -0.52 0.00 0.00 37.83 35.11 1t99 s LYS 1077CO 0.24 -1.28 -0.21 0.42 -0.92 0.00 0.00 175.35 173.59 1t99 s ILE 1078N -2.39 1.76 -0.09 2.17 -1.09 -1.26 -0.57 121.20 119.73 1t99 s ILE 1078Ca 0.66 -1.50 -0.09 0.00 -2.23 0.00 0.00 60.65 57.50 1t99 s ILE 1078Cb -0.20 -1.58 0.02 0.00 -1.58 0.00 0.00 42.46 39.12 1t99 s ILE 1078CO 0.43 0.01 0.24 0.28 -1.23 0.00 0.00 174.94 174.67 1t99 s THR 1079N -1.08 0.00 0.14 2.92 -1.32 -0.46 -0.34 115.64 115.51 1t99 s THR 1079Ca 0.07 -0.03 -0.16 0.00 -1.21 0.00 0.00 61.69 60.37 1t99 s THR 1079Cb -0.10 -0.35 0.03 0.00 -1.51 0.00 0.00 72.50 70.57 1t99 s THR 1079CO 0.04 -0.02 0.41 0.28 -2.21 0.00 0.00 174.62 173.12 1t99 s THR 1080N 0.05 0.06 0.07 5.08 -1.32 -1.20 -3.11 115.64 115.28 1t99 s THR 1080Ca -0.01 -0.70 0.01 0.00 -1.21 0.00 0.00 61.69 59.78 1t99 s THR 1080Cb -0.02 -1.31 -0.04 0.00 -1.51 0.00 0.00 72.50 69.62 1t99 s THR 1080CO 0.00 -0.28 0.17 1.51 -2.21 0.00 0.00 174.62 173.81 1t99 s ASP 1081N -2.83 6.09 0.27 8.08 -4.77 -1.26 -1.29 116.67 120.96 1t99 s ASP 1081Ca 0.05 0.18 0.09 0.00 -3.30 0.00 0.00 52.55 49.58 1t99 s ASP 1081Cb 0.01 -1.80 -0.04 0.00 -1.09 0.00 0.00 42.92 40.00 1t99 s ASP 1081CO -0.09 0.17 0.01 0.27 0.70 0.00 0.00 175.17 176.23 1t99 s ILE 1082N -1.47 3.43 0.00 2.11 -4.36 -0.99 -4.80 121.20 115.13 1t99 s ILE 1082Ca 0.33 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 58.84 1t99 s ILE 1082Cb -0.13 -2.87 0.00 0.00 1.25 0.00 0.00 42.46 40.71 1t99 s ILE 1082CO 0.26 -0.36 0.00 1.41 0.24 0.00 0.00 174.94 176.49 1t99 n HIS 1083N -0.93 0.00 -3.90 1.37 8.25 -1.26 -4.41 115.22 114.34 1t99 n HIS 1083Ca -0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.30 1t99 n HIS 1083Cb 0.59 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.61 1t99 n HIS 1083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1t99 s GLU 1084N -1.40 0.53 0.26 -0.41 2.02 -1.26 -5.07 118.70 113.37 1t99 s GLU 1084Ca 0.00 -0.59 -0.02 0.00 0.02 0.00 0.00 54.97 54.38 1t99 s GLU 1084Cb 0.00 0.21 0.55 0.00 0.10 0.00 0.00 34.13 35.00 1t99 s GLU 1084CO 0.00 -0.13 1.68 0.77 0.02 0.00 0.00 175.26 177.60 1t99 h SER 1085N 3.97 0.09 -0.04 -0.19 0.02 -1.91 -1.57 113.55 113.93 1t99 h SER 1085Ca -0.32 0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1t99 h SER 1085Cb 1.19 0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.92 1t99 h SER 1085CO 0.45 -0.04 0.08 4.11 -1.14 0.00 0.00 176.83 180.30 1t99 h TRP 1086N 0.30 0.00 0.00 3.45 5.08 -1.97 -2.11 115.95 120.70 1t99 h TRP 1086Ca 0.47 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.43 1t99 h TRP 1086Cb 0.83 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.99 1t99 h TRP 1086CO -0.23 0.00 -0.01 1.96 -1.28 0.00 0.00 178.44 178.87 1t99 h GLN 1087N 0.00 0.00 -0.55 0.12 4.20 -1.71 -3.34 115.11 113.83 1t99 h GLN 1087Ca 0.02 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.79 1t99 h GLN 1087Cb 0.18 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.90 1t99 h GLN 1087CO -0.00 0.01 0.25 0.00 -0.67 0.00 0.00 178.83 178.43 1t99 h ALA 1088N 1.99 0.70 0.59 3.87 0.00 -1.52 -1.86 119.26 123.02 1t99 h ALA 1088Ca -0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1t99 h ALA 1088Cb 0.81 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.57 1t99 h ALA 1088CO 0.00 -0.12 -0.28 1.49 0.00 0.00 0.00 179.25 180.34 1t99 h GLU 1089N 0.48 -0.76 -0.85 0.00 4.81 -1.78 0.30 114.58 116.78 1t99 h GLU 1089Ca 0.25 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.55 1t99 h GLU 1089Cb 0.22 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1t99 h GLU 1089CO -0.21 -0.46 0.56 -1.00 -0.73 0.00 0.00 179.01 177.18 1t99 h PRO 1090N -0.95 1.10 -0.31 0.92 0.13 -1.75 -2.58 132.00 128.55 1t99 h PRO 1090Ca -0.08 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 64.92 1t99 h PRO 1090Cb 0.66 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 1t99 h PRO 1090CO 0.13 0.73 -0.08 0.28 -0.23 0.00 0.00 178.00 178.83 1t99 h VAL 1091N 1.14 1.22 0.00 1.56 2.07 -1.31 -2.33 116.25 118.60 1t99 h VAL 1091Ca 0.32 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1t99 h VAL 1091Cb -0.10 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1t99 h VAL 1091CO -0.08 0.31 0.00 0.00 0.02 0.00 0.00 177.57 177.82 1t99 h ALA 1092N 1.44 1.00 0.00 1.67 0.00 -0.51 -0.84 119.26 122.02 1t99 h ALA 1092Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1t99 h ALA 1092Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1t99 h ALA 1092CO 0.02 0.00 -0.21 0.93 0.00 0.00 0.00 179.25 179.99 1t99 h GLU 1093N 0.00 0.00 0.00 0.00 5.08 -1.39 -3.35 114.58 114.92 1t99 h GLU 1093Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1t99 h GLU 1093Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1t99 h GLU 1093CO 0.00 0.21 -1.06 1.55 -1.00 0.00 0.00 179.01 178.71 1t99 n VAL 1094N -3.66 0.06 -2.56 3.13 3.14 -0.85 -5.03 118.33 112.55 1t99 n VAL 1094Ca -0.01 -0.03 -0.42 0.00 -2.96 0.00 0.00 64.34 60.91 1t99 n VAL 1094Cb 0.34 -0.78 -0.03 0.00 -1.06 0.00 0.00 33.84 32.31 1t99 n VAL 1094CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1t99 s ALA 1095N -2.02 3.39 0.13 1.55 0.00 -0.38 -4.58 121.76 119.85 1t99 s ALA 1095Ca -0.01 0.57 0.08 0.00 0.00 0.00 0.00 51.96 52.60 1t99 s ALA 1095Cb 0.00 -3.45 -0.15 0.00 0.00 0.00 0.00 23.12 19.52 1t99 s ALA 1095CO 0.03 -0.57 1.31 -0.44 0.00 0.00 0.00 175.76 176.10 1t99 h ASP 1096N 7.13 0.00 -3.27 0.00 3.32 -1.01 -3.44 116.42 119.16 1t99 h ASP 1096Ca -0.36 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.20 1t99 h ASP 1096Cb 1.18 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.36 1t99 h ASP 1096CO 0.84 0.95 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.88 1t99 s ILE 1097N -2.80 0.87 -0.22 0.35 1.01 -0.76 -2.21 121.20 117.44 1t99 s ILE 1097Ca 0.01 -0.22 -0.17 0.00 0.00 0.00 0.00 60.65 60.27 1t99 s ILE 1097Cb 0.10 -0.89 -0.03 0.00 0.01 0.00 0.00 42.46 41.65 1t99 s ILE 1097CO 0.81 0.33 0.45 -0.63 0.00 0.00 0.00 174.94 175.90 1t99 s ILE 1098N 1.48 5.15 -0.04 2.92 1.01 0.91 -3.22 121.20 129.40 1t99 s ILE 1098Ca -0.00 0.80 -0.14 0.00 0.00 0.00 0.00 60.65 61.30 1t99 s ILE 1098Cb -0.13 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 1t99 s ILE 1098CO -0.05 0.19 0.38 -1.58 0.00 0.00 0.00 174.94 173.88 1t99 s GLN 1099N 1.67 3.96 -0.23 2.79 0.74 -0.41 -0.86 119.66 127.32 1t99 s GLN 1099Ca 0.20 0.33 -0.05 0.00 0.05 0.00 0.00 55.36 55.89 1t99 s GLN 1099Cb -0.15 -3.26 -0.02 0.00 1.10 0.00 0.00 33.01 30.68 1t99 s GLN 1099CO 0.09 0.59 0.01 0.42 -0.55 0.00 0.00 175.29 175.84 1t99 s ILE 1100N -0.71 3.77 0.57 -2.34 -1.09 0.33 -2.34 121.20 119.40 1t99 s ILE 1100Ca 0.22 -0.36 -0.21 0.00 -2.23 0.00 0.00 60.65 58.08 1t99 s ILE 1100Cb -0.16 -2.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.94 1t99 s ILE 1100CO 0.11 0.38 1.29 -2.65 -1.23 0.00 0.00 174.94 172.85 1t99 n PRO 1101N 4.85 1.47 -0.25 2.79 -0.02 -1.26 -1.54 135.00 141.03 1t99 n PRO 1101Ca -0.17 0.55 0.06 0.00 -2.02 0.00 0.00 63.50 61.91 1t99 n PRO 1101Cb 0.51 -2.51 0.18 0.00 -0.02 0.00 0.00 33.50 31.66 1t99 n PRO 1101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t99 h ALA 1102N 1.13 0.91 0.00 3.55 0.00 -1.89 0.01 119.26 122.97 1t99 h ALA 1102Ca -0.50 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1t99 h ALA 1102Cb 1.32 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.40 1t99 h ALA 1102CO 0.55 -0.38 -0.09 0.74 0.00 0.00 0.00 179.25 180.07 1t99 h PHE 1103N 0.20 0.00 -0.41 0.00 0.04 -1.91 -2.99 116.94 111.88 1t99 h PHE 1103Ca 0.42 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.19 1t99 h PHE 1103Cb 0.74 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.89 1t99 h PHE 1103CO -0.31 0.09 0.00 1.28 -0.60 0.00 0.00 178.31 178.77 1t99 n LEU 1104N -3.50 3.34 0.07 1.54 4.77 -0.05 -4.58 117.00 118.59 1t99 n LEU 1104Ca -0.02 -1.62 0.04 0.00 -0.03 0.00 0.00 56.01 54.37 1t99 n LEU 1104Cb 0.23 -0.27 0.19 0.00 -2.33 0.00 0.00 43.42 41.24 1t99 n LEU 1104CO 0.28 0.75 0.63 0.00 -1.33 0.00 0.00 177.39 177.73 1t99 n GLY 1106N -1.35 -0.42 3.55 0.00 0.00 -1.26 -4.92 105.19 100.80 1t99 n GLY 1106Ca -0.00 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1t99 n GLY 1106CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t99 s GLN 1107N -0.88 3.01 0.25 1.61 -1.52 -0.28 -4.90 119.66 116.94 1t99 s GLN 1107Ca 0.12 0.00 -0.06 0.00 -1.95 0.00 0.00 55.36 53.47 1t99 s GLN 1107Cb 0.09 -4.31 0.45 0.00 -0.22 0.00 0.00 33.01 29.02 1t99 s GLN 1107CO 0.13 -2.37 1.65 1.15 -0.25 0.00 0.00 175.29 175.61 1t99 h THR 1108N 6.36 0.41 -0.36 -0.19 2.02 -1.91 -2.02 112.91 117.21 1t99 h THR 1108Ca -0.25 -0.06 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 1t99 h THR 1108Cb 1.08 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1t99 h THR 1108CO 1.26 0.03 -0.25 0.44 0.37 0.00 0.00 175.52 177.37 1t99 h ASP 1109N 0.16 0.73 -0.43 4.18 3.32 -1.98 -0.14 116.42 122.26 1t99 h ASP 1109Ca 0.42 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 1t99 h ASP 1109Cb 0.73 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1t99 h ASP 1109CO -0.60 0.95 -0.04 0.25 -1.72 0.00 0.00 179.24 178.08 1t99 h LEU 1110N 0.62 0.78 -0.36 1.55 5.85 -1.79 0.47 115.31 122.44 1t99 h LEU 1110Ca 0.08 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 1t99 h LEU 1110Cb 0.75 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1t99 h LEU 1110CO 0.06 0.92 0.20 -0.07 -0.34 0.00 0.00 178.44 179.22 1t99 h LEU 1111N 0.61 0.44 -1.05 2.25 3.38 -1.21 -1.36 115.31 118.37 1t99 h LEU 1111Ca 0.12 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1t99 h LEU 1111Cb 0.55 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1t99 h LEU 1111CO 0.03 0.39 0.05 -0.07 0.09 0.00 0.00 178.44 178.93 1t99 h LEU 1112N 0.46 0.69 -0.68 1.67 4.07 -0.86 -1.13 115.31 119.53 1t99 h LEU 1112Ca 0.13 -0.14 -0.10 0.00 0.08 0.00 0.00 57.88 57.85 1t99 h LEU 1112Cb 0.04 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.58 1t99 h LEU 1112CO -0.02 0.72 -0.10 0.00 -1.08 0.00 0.00 178.44 177.96 1t99 h ALA 1113N 1.36 0.87 -0.16 1.53 0.00 -0.55 -2.49 119.26 119.82 1t99 h ALA 1113Ca 0.15 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1t99 h ALA 1113Cb 0.35 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1t99 h ALA 1113CO 0.01 0.64 -0.15 0.00 0.00 0.00 0.00 179.25 179.75 1t99 h ALA 1114N 1.05 0.23 -0.98 0.00 0.00 -0.93 -3.30 119.26 115.32 1t99 h ALA 1114Ca 0.13 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1t99 h ALA 1114Cb 0.63 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1t99 h ALA 1114CO 0.04 0.12 0.65 0.00 0.00 0.00 0.00 179.25 180.06 1t99 h ALA 1115N 0.62 1.30 0.00 0.00 0.00 -1.12 -2.75 119.26 117.32 1t99 h ALA 1115Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1t99 h ALA 1115Cb 0.68 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1t99 h ALA 1115CO 0.04 0.64 0.00 0.36 0.00 0.00 0.00 179.25 180.29 1t99 n LYS 1116N -4.39 0.09 0.17 0.00 2.85 -0.95 -2.63 118.16 113.30 1t99 n LYS 1116Ca 0.12 0.16 0.14 0.00 -1.05 0.00 0.00 58.31 57.67 1t99 n LYS 1116Cb 0.02 -1.50 0.47 0.00 -0.65 0.00 0.00 35.03 33.37 1t99 n LYS 1116CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1t99 h THR 1117N 0.00 0.00 0.00 0.58 1.35 -1.59 -3.46 112.91 109.79 1t99 h THR 1117Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1t99 h THR 1117Cb 0.27 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 1t99 h THR 1117CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1t99 n GLY 1118N 0.47 1.69 3.89 5.82 0.00 -1.08 -5.04 105.19 110.95 1t99 n GLY 1118Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1t99 n GLY 1118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t99 s ARG 1119N -0.37 2.75 0.54 1.61 1.81 -1.26 -4.92 118.95 119.11 1t99 s ARG 1119Ca 0.00 0.29 -0.18 0.00 -1.72 0.00 0.00 55.73 54.12 1t99 s ARG 1119Cb 0.00 -2.07 -0.06 0.00 -0.45 0.00 0.00 34.95 32.36 1t99 s ARG 1119CO 0.00 -1.03 1.05 0.00 -0.68 0.00 0.00 175.30 174.64 1t99 s ALA 1120N -3.30 2.81 -0.08 2.13 0.00 -0.94 -4.77 121.76 117.60 1t99 s ALA 1120Ca 0.58 0.52 0.02 0.00 0.00 0.00 0.00 51.96 53.08 1t99 s ALA 1120Cb -0.11 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1t99 s ALA 1120CO 0.50 -0.56 -0.14 0.08 0.00 0.00 0.00 175.76 175.64 1t99 s VAL 1121N -2.19 1.29 -0.26 0.00 1.01 -0.34 -0.06 120.40 119.86 1t99 s VAL 1121Ca 0.66 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1t99 s VAL 1121Cb -0.17 -1.18 0.04 0.00 0.00 0.00 0.00 36.38 35.08 1t99 s VAL 1121CO 0.28 0.39 -0.08 0.21 0.00 0.00 0.00 175.10 175.90 1t99 s ASN 1122N 0.80 4.36 -0.25 3.32 2.47 -0.04 -0.87 114.94 124.73 1t99 s ASN 1122Ca -0.12 -1.14 -0.12 0.00 0.42 0.00 0.00 52.86 51.91 1t99 s ASN 1122Cb -0.16 -1.61 -0.05 0.00 -1.45 0.00 0.00 41.25 37.99 1t99 s ASN 1122CO 0.02 -0.17 0.23 -0.69 -3.72 0.00 0.00 177.10 172.77 1t99 s VAL 1123N 1.22 5.30 -0.01 -5.21 1.01 -0.54 -0.51 120.40 121.66 1t99 s VAL 1123Ca -0.04 0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 1t99 s VAL 1123Cb -0.18 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1t99 s VAL 1123CO -0.05 0.28 1.11 -0.54 0.00 0.00 0.00 175.10 175.90 1t99 s LYS 1124N 1.41 4.45 -0.01 2.72 -0.14 -0.59 -0.65 119.74 126.93 1t99 s LYS 1124Ca 0.10 1.59 -0.30 0.00 -1.36 0.00 0.00 55.97 56.00 1t99 s LYS 1124Cb -0.15 -3.46 -0.06 0.00 -1.68 0.00 0.00 37.83 32.49 1t99 s LYS 1124CO 0.07 -0.24 1.58 0.21 -0.76 0.00 0.00 175.35 176.21 1t99 s LYS 1125N 1.44 4.21 0.51 1.68 2.20 0.62 -3.86 119.74 126.54 1t99 s LYS 1125Ca 0.55 2.16 -0.21 0.00 -0.36 0.00 0.00 55.97 58.11 1t99 s LYS 1125Cb -0.24 -3.77 -0.08 0.00 -1.51 0.00 0.00 37.83 32.23 1t99 s LYS 1125CO 0.26 -0.75 0.95 0.41 -0.36 0.00 0.00 175.35 175.86 1t99 n GLY 1126N 3.96 -0.37 0.08 5.54 0.00 -1.23 -4.53 105.19 108.65 1t99 n GLY 1126Ca 0.16 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1t99 n GLY 1126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1t99 n GLN 1127N -0.37 0.09 0.00 1.61 3.00 -1.26 -1.51 117.38 118.94 1t99 n GLN 1127Ca 0.11 0.46 0.09 0.00 -0.01 0.00 0.00 57.00 57.66 1t99 n GLN 1127Cb 0.44 -1.72 -0.05 0.00 0.00 0.00 0.00 30.24 28.90 1t99 n GLN 1127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1t99 n PHE 1128N -1.90 0.00 -3.32 1.08 -1.74 -1.26 -1.52 117.46 108.80 1t99 n PHE 1128Ca 0.01 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.52 1t99 n PHE 1128Cb 0.11 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.05 1t99 n PHE 1128CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1t99 s LEU 1129N -2.56 4.28 0.43 5.98 2.96 -0.57 -5.06 118.68 124.13 1t99 s LEU 1129Ca 0.12 0.81 -0.23 0.00 -0.22 0.00 0.00 54.13 54.60 1t99 s LEU 1129Cb 0.15 -2.68 -0.08 0.00 0.50 0.00 0.00 46.19 44.07 1t99 s LEU 1129CO 0.62 0.01 1.10 0.00 -1.32 0.00 0.00 176.35 176.76 1t99 s ALA 1130N 0.60 3.03 0.39 5.97 0.00 -1.26 -4.85 121.76 125.64 1t99 s ALA 1130Ca 0.26 0.79 0.06 0.00 0.00 0.00 0.00 51.96 53.06 1t99 s ALA 1130Cb -0.15 -3.32 0.79 0.00 0.00 0.00 0.00 23.12 20.44 1t99 s ALA 1130CO 0.10 -0.40 2.03 -1.00 0.00 0.00 0.00 175.76 176.50 1t99 h PRO 1131N 2.28 0.60 0.00 0.00 0.13 -1.97 -1.45 132.00 131.59 1t99 h PRO 1131Ca -0.49 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1t99 h PRO 1131Cb 1.23 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1t99 h PRO 1131CO 0.61 0.42 0.00 0.11 -0.23 0.00 0.00 178.00 178.91 1t99 h TRP 1132N 0.61 0.00 -0.02 1.56 0.09 -1.93 -2.70 115.95 113.57 1t99 h TRP 1132Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.14 1t99 h TRP 1132Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.21 1t99 h TRP 1132CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.28 1t99 n ASP 1133N -3.01 0.56 0.00 0.11 8.00 -0.54 -3.12 116.55 118.54 1t99 n ASP 1133Ca 0.00 -1.25 0.14 0.00 0.71 0.00 0.00 54.79 54.40 1t99 n ASP 1133Cb 0.25 -0.01 0.71 0.00 -0.02 0.00 0.00 41.12 42.05 1t99 n ASP 1133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1t99 n THR 1134N -0.53 0.02 -0.14 -3.53 -2.24 -1.02 -3.54 114.28 103.31 1t99 n THR 1134Ca 0.21 0.01 -0.08 0.00 -2.27 0.00 0.00 64.05 61.92 1t99 n THR 1134Cb 0.19 -0.52 0.01 0.00 -2.10 0.00 0.00 70.33 67.92 1t99 n THR 1134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1t99 h LYS 1135N 0.00 0.57 0.00 -0.78 3.64 -1.76 -2.06 116.57 116.18 1t99 h LYS 1135Ca 0.00 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1t99 h LYS 1135Cb 0.34 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1t99 h LYS 1135CO 0.00 0.38 -0.22 -0.91 -2.27 0.00 0.00 179.45 176.43 1t99 h ASN 1136N 0.59 0.00 -0.54 4.20 2.35 -1.84 -1.27 115.58 119.07 1t99 h ASN 1136Ca 0.16 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.80 1t99 h ASN 1136Cb -0.07 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1t99 h ASN 1136CO -0.03 0.22 -0.09 0.58 -1.65 0.00 0.00 177.43 176.46 1t99 h VAL 1137N 0.00 1.27 -0.33 2.81 2.07 -1.55 -0.41 116.25 120.11 1t99 h VAL 1137Ca -0.00 -1.24 -0.16 0.00 0.82 0.00 0.00 66.70 66.12 1t99 h VAL 1137Cb 0.69 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1t99 h VAL 1137CO 0.03 0.44 -0.42 0.58 0.02 0.00 0.00 177.57 178.21 1t99 h VAL 1138N 0.88 1.28 -0.80 2.57 2.07 -1.04 -2.56 116.25 118.65 1t99 h VAL 1138Ca 0.14 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 66.06 1t99 h VAL 1138Cb 0.65 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.85 1t99 h VAL 1138CO 0.04 0.53 0.50 -0.08 0.02 0.00 0.00 177.57 178.58 1t99 h GLU 1139N 0.68 1.08 -0.75 1.57 4.81 -0.96 -0.67 114.58 120.34 1t99 h GLU 1139Ca 0.05 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1t99 h GLU 1139Cb 1.00 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 1t99 h GLU 1139CO 0.10 0.74 0.42 0.87 -0.73 0.00 0.00 179.01 180.41 1t99 h LYS 1140N 1.09 1.04 -0.51 1.92 1.57 -0.94 -1.21 116.57 119.54 1t99 h LYS 1140Ca 0.29 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 1t99 h LYS 1140Cb -0.07 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.01 1t99 h LYS 1140CO -0.06 0.77 0.12 -0.07 -0.57 0.00 0.00 179.45 179.64 1t99 h LEU 1141N 1.03 0.77 -0.37 2.94 3.38 -0.95 -1.07 115.31 121.04 1t99 h LEU 1141Ca 0.26 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1t99 h LEU 1141Cb 0.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1t99 h LEU 1141CO -0.04 0.81 0.11 0.11 0.09 0.00 0.00 178.44 179.51 1t99 h LYS 1142N 0.70 0.59 -0.91 1.13 1.57 -0.95 -0.61 116.57 118.09 1t99 h LYS 1142Ca 0.16 -0.13 0.15 0.00 -1.87 0.00 0.00 60.65 58.95 1t99 h LYS 1142Cb 0.34 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.49 1t99 h LYS 1142CO 0.00 0.61 0.58 0.35 -0.57 0.00 0.00 179.45 180.42 1t99 h PHE 1143N 0.45 0.86 -0.13 -1.35 3.57 -1.02 0.56 116.94 119.88 1t99 h PHE 1143Ca 0.12 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1t99 h PHE 1143Cb 0.27 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1t99 h PHE 1143CO 0.01 0.31 0.00 0.41 -2.23 0.00 0.00 178.31 176.81 1t99 n GLY 1144N -1.42 -0.21 0.00 2.40 0.00 -0.42 -4.92 105.19 100.62 1t99 n GLY 1144Ca 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1t99 n GLY 1144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t99 n GLY 1145N 0.94 0.33 3.70 -0.02 0.00 0.19 -2.93 105.19 107.40 1t99 n GLY 1145Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1t99 n GLY 1145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t99 s ALA 1146N -2.00 3.57 -0.03 4.61 0.00 -0.31 -4.88 121.76 122.73 1t99 s ALA 1146Ca 0.00 1.02 0.17 0.00 0.00 0.00 0.00 51.96 53.14 1t99 s ALA 1146Cb 0.00 -3.55 -0.26 0.00 0.00 0.00 0.00 23.12 19.31 1t99 s ALA 1146CO 0.00 -0.72 0.35 1.63 0.00 0.00 0.00 175.76 177.02 1t99 n LYS 1147N 4.50 0.57 -3.96 0.00 5.02 -1.26 -4.35 118.16 118.69 1t99 n LYS 1147Ca 0.12 -0.15 -0.31 0.00 -2.02 0.00 0.00 58.31 55.96 1t99 n LYS 1147Cb 0.43 -1.40 -0.15 0.00 -0.02 0.00 0.00 35.03 33.88 1t99 n LYS 1147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1t99 s GLU 1148N -3.13 1.67 -0.02 1.97 2.12 -1.26 -5.11 118.70 114.94 1t99 s GLU 1148Ca -0.06 -1.12 0.06 0.00 0.36 0.00 0.00 54.97 54.21 1t99 s GLU 1148Cb 0.10 -2.66 -0.02 0.00 0.26 0.00 0.00 34.13 31.82 1t99 s GLU 1148CO 0.70 -0.64 -0.21 0.42 -0.54 0.00 0.00 175.26 175.00 1t99 s ILE 1149N 1.32 1.66 0.11 -3.70 1.01 -1.26 -1.20 121.20 119.14 1t99 s ILE 1149Ca -0.04 -0.90 0.07 0.00 0.00 0.00 0.00 60.65 59.78 1t99 s ILE 1149Cb -0.19 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 1t99 s ILE 1149CO -0.07 0.47 -0.17 -0.31 0.00 0.00 0.00 174.94 174.86 1t99 s TYR 1150N -0.48 1.54 -0.10 3.97 1.51 -0.05 -2.75 117.35 120.99 1t99 s TYR 1150Ca 0.08 -0.48 0.03 0.00 -1.01 0.00 0.00 57.07 55.69 1t99 s TYR 1150Cb -0.08 -0.83 0.01 0.00 -0.11 0.00 0.00 41.96 40.95 1t99 s TYR 1150CO -0.01 0.17 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.88 1t99 s LEU 1151N -2.15 1.99 -0.20 -1.29 1.43 -0.04 -1.47 118.68 116.95 1t99 s LEU 1151Ca 0.07 -0.52 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 1t99 s LEU 1151Cb -0.08 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1t99 s LEU 1151CO 0.04 0.11 -0.03 -0.89 0.23 0.00 0.00 176.35 175.81 1t99 s THR 1152N 0.55 3.57 -0.22 5.49 2.01 0.17 -0.67 115.64 126.53 1t99 s THR 1152Ca -0.15 -0.44 -0.29 0.00 0.31 0.00 0.00 61.69 61.12 1t99 s THR 1152Cb -0.17 -2.61 0.00 0.00 0.01 0.00 0.00 72.50 69.73 1t99 s THR 1152CO 0.05 0.43 1.13 -0.70 -0.69 0.00 0.00 174.62 174.84 1t99 s GLU 1153N 1.19 4.21 -0.06 4.92 2.56 -0.05 -0.28 118.70 131.19 1t99 s GLU 1153Ca 0.03 1.42 0.18 0.00 0.00 0.00 0.00 54.97 56.59 1t99 s GLU 1153Cb -0.14 -3.70 0.35 0.00 2.00 0.00 0.00 34.13 32.63 1t99 s GLU 1153CO -0.00 -0.71 1.15 2.89 -0.56 0.00 0.00 175.26 178.03 1t99 n ARG 1154N 6.53 0.49 0.00 4.30 -4.01 -1.26 -1.24 116.66 121.47 1t99 n ARG 1154Ca 0.13 -2.22 0.00 0.00 -1.04 0.00 0.00 57.85 54.72 1t99 n ARG 1154Cb 0.46 -0.59 0.00 0.00 -3.04 0.00 0.00 32.46 29.29 1t99 n ARG 1154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1t99 n GLY 1155N -0.12 0.18 3.07 2.89 0.00 -1.26 -3.93 105.19 106.01 1t99 n GLY 1155Ca 0.09 -1.78 -0.16 0.00 0.00 0.00 0.00 46.02 44.17 1t99 n GLY 1155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t99 s THR 1156N -2.31 0.71 0.01 2.61 2.01 0.15 -4.32 115.64 114.51 1t99 s THR 1156Ca 0.00 -0.86 -0.33 0.00 0.31 0.00 0.00 61.69 60.81 1t99 s THR 1156Cb 0.00 -0.69 -0.12 0.00 0.01 0.00 0.00 72.50 71.70 1t99 s THR 1156CO 0.00 -0.13 1.80 0.41 -0.69 0.00 0.00 174.62 176.01 1t99 n THR 1157N 1.95 0.42 -3.63 -0.82 -1.04 -0.57 -1.19 114.28 109.39 1t99 n THR 1157Ca -0.19 -0.07 -0.29 0.00 -2.04 0.00 0.00 64.05 61.45 1t99 n THR 1157Cb 0.55 -1.84 -0.13 0.00 -1.82 0.00 0.00 70.33 67.09 1t99 n THR 1157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1t99 s PHE 1158N 3.11 1.55 0.00 -1.42 5.36 -0.62 -4.84 117.98 121.11 1t99 s PHE 1158Ca 0.88 -2.11 0.00 0.00 -0.96 0.00 0.00 56.93 54.73 1t99 s PHE 1158Cb -0.65 -1.56 0.00 0.00 -0.34 0.00 0.00 43.02 40.47 1t99 s PHE 1158CO 0.46 -0.80 0.00 0.41 -1.46 0.00 0.00 175.22 173.82 1t99 n GLY 1159N 3.80 -0.63 3.86 13.12 0.00 -1.26 -4.27 105.19 119.80 1t99 n GLY 1159Ca 0.09 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 1t99 n GLY 1159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t99 s TYR 1160N 0.00 3.63 -1.58 1.61 2.02 -1.26 -4.39 117.35 117.38 1t99 s TYR 1160Ca 0.00 0.83 -0.15 0.00 -0.37 0.00 0.00 57.07 57.38 1t99 s TYR 1160Cb 0.00 -2.18 0.10 0.00 -0.40 0.00 0.00 41.96 39.48 1t99 s TYR 1160CO 0.00 0.57 0.94 0.09 -1.57 0.00 0.00 175.55 175.58 1t99 n ASN 1161N 1.22 -4.53 -3.64 2.29 3.02 -1.26 -4.96 115.26 107.39 1t99 n ASN 1161Ca -0.10 -0.83 -0.15 0.00 -0.03 0.00 0.00 54.58 53.47 1t99 n ASN 1161Cb 0.52 -3.63 -0.08 0.00 -0.61 0.00 0.00 39.78 35.99 1t99 n ASN 1161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1t99 s ASN 1162N -3.29 -0.54 0.03 6.41 3.04 -1.26 -4.10 114.94 115.23 1t99 s ASN 1162Ca 0.69 0.82 0.07 0.00 0.04 0.00 0.00 52.86 54.48 1t99 s ASN 1162Cb -0.35 0.81 -0.02 0.00 -1.54 0.00 0.00 41.25 40.15 1t99 s ASN 1162CO 0.85 -0.38 -0.21 -0.76 -3.04 0.00 0.00 177.10 173.56 1t99 s LEU 1163N -0.48 2.14 0.14 3.21 1.43 -1.26 -1.60 118.68 122.27 1t99 s LEU 1163Ca -0.06 -0.49 0.11 0.00 -1.03 0.00 0.00 54.13 52.66 1t99 s LEU 1163Cb -0.03 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 1t99 s LEU 1163CO 0.04 0.19 -0.26 0.54 0.23 0.00 0.00 176.35 177.09 1t99 s VAL 1164N -0.72 2.26 -0.28 -1.59 0.11 -0.34 -4.85 120.40 115.00 1t99 s VAL 1164Ca 0.08 -1.82 -0.08 0.00 -2.93 0.00 0.00 61.98 57.23 1t99 s VAL 1164Cb -0.09 -2.01 -0.01 0.00 -1.53 0.00 0.00 36.38 32.74 1t99 s VAL 1164CO 0.01 0.04 0.10 -0.69 -3.33 0.00 0.00 175.10 171.23 1t99 s VAL 1165N -1.21 4.36 -0.71 2.04 1.01 -1.26 -0.67 120.40 123.95 1t99 s VAL 1165Ca 0.15 -0.36 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 1t99 s VAL 1165Cb -0.09 -3.14 0.14 0.00 0.00 0.00 0.00 36.38 33.29 1t99 s VAL 1165CO 0.07 0.19 0.78 -0.62 0.00 0.00 0.00 175.10 175.52 1t99 s ASP 1166N 1.59 6.43 0.00 3.32 -1.08 -1.26 -4.92 116.67 120.75 1t99 s ASP 1166Ca 0.05 -1.94 0.03 0.00 -0.52 0.00 0.00 52.55 50.17 1t99 s ASP 1166Cb -0.16 -2.28 0.12 0.00 -1.46 0.00 0.00 42.92 39.13 1t99 s ASP 1166CO 0.04 -0.93 1.08 0.49 0.52 0.00 0.00 175.17 176.38 1t99 n PHE 1167N 5.59 0.00 0.30 -5.34 3.01 -1.26 -1.21 117.46 118.55 1t99 n PHE 1167Ca 0.03 0.00 0.18 0.00 1.01 0.00 0.00 57.45 58.67 1t99 n PHE 1167Cb 0.45 -0.49 0.88 0.00 -0.01 0.00 0.00 39.48 40.31 1t99 n PHE 1167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1t99 h ARG 1168N 0.00 0.00 0.00 -1.08 3.08 -2.03 -2.61 114.38 111.73 1t99 h ARG 1168Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1t99 h ARG 1168Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1t99 h ARG 1168CO 0.00 0.03 -0.30 0.66 -1.07 0.00 0.00 179.97 179.28 1t99 h SER 1169N 0.00 0.00 0.60 7.04 4.64 -1.59 -3.02 113.55 121.22 1t99 h SER 1169Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1t99 h SER 1169Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1t99 h SER 1169CO 0.00 0.30 -0.40 -0.07 -0.87 0.00 0.00 176.83 175.79 1t99 h LEU 1170N 0.00 -1.04 -1.60 5.97 4.07 -1.68 -0.68 115.31 120.34 1t99 h LEU 1170Ca -0.00 0.07 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1t99 h LEU 1170Cb 0.56 0.31 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 1t99 h LEU 1170CO 0.04 -0.61 -0.14 1.55 -1.08 0.00 0.00 178.44 178.20 1t99 h PRO 1171N -0.96 0.00 0.06 1.13 0.13 -1.75 -2.22 132.00 128.39 1t99 h PRO 1171Ca -0.07 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1t99 h PRO 1171Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1t99 h PRO 1171CO 0.05 0.14 -0.03 0.82 -0.23 0.00 0.00 178.00 178.75 1t99 h ILE 1172N 0.00 1.25 0.00 -3.56 2.04 -1.36 -3.22 117.51 112.66 1t99 h ILE 1172Ca -0.00 -1.17 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 1t99 h ILE 1172Cb 0.50 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1t99 h ILE 1172CO 0.02 0.29 -0.13 0.24 0.00 0.00 0.00 178.15 178.57 1t99 h MET 1173N -0.62 0.00 0.00 2.37 2.86 -1.08 -2.18 114.93 116.28 1t99 h MET 1173Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1t99 h MET 1173Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1t99 h MET 1173CO 0.01 0.13 0.00 -0.22 1.06 0.00 0.00 176.91 177.89 1t99 h LYS 1174N 0.00 0.00 0.00 1.72 1.63 -1.41 -1.91 116.57 116.60 1t99 h LYS 1174Ca -0.00 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.76 1t99 h LYS 1174Cb 0.46 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.08 1t99 h LYS 1174CO 0.02 0.00 -0.16 1.96 -3.45 0.00 0.00 179.45 177.81 1t99 h GLN 1175N 0.00 0.00 0.00 1.90 4.20 -1.47 -3.31 115.11 116.42 1t99 h GLN 1175Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1t99 h GLN 1175Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1t99 h GLN 1175CO 0.00 0.16 0.00 -2.67 -0.67 0.00 0.00 178.83 175.65 1t99 n TRP 1176N -3.94 0.00 -3.71 2.96 2.14 -0.77 -5.11 117.44 109.01 1t99 n TRP 1176Ca -0.02 -0.04 -0.05 0.00 2.07 0.00 0.00 57.50 59.45 1t99 n TRP 1176Cb 0.25 -0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.73 1t99 n TRP 1176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1t99 s ALA 1177N -0.09 -1.61 0.26 -1.67 0.00 -0.89 -5.00 121.76 112.77 1t99 s ALA 1177Ca 0.00 0.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 1t99 s ALA 1177Cb 0.00 0.66 -0.09 0.00 0.00 0.00 0.00 23.12 23.68 1t99 s ALA 1177CO 0.00 -0.97 1.00 0.15 0.00 0.00 0.00 175.76 175.94 1t99 s LYS 1178N -3.39 4.77 -0.12 0.00 1.02 -1.11 -4.09 119.74 116.81 1t99 s LYS 1178Ca 0.10 1.59 -0.02 0.00 0.02 0.00 0.00 55.97 57.66 1t99 s LYS 1178Cb -0.02 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 34.04 1t99 s LYS 1178CO 0.00 0.40 -0.04 0.08 -0.92 0.00 0.00 175.35 174.87 1t99 s VAL 1179N -1.19 3.87 -0.05 3.17 1.01 -1.26 -0.86 120.40 125.09 1t99 s VAL 1179Ca 0.43 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 62.07 1t99 s VAL 1179Cb -0.28 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1t99 s VAL 1179CO 0.35 0.54 -0.20 -0.63 0.00 0.00 0.00 175.10 175.15 1t99 s ILE 1180N -0.10 2.55 -0.23 2.22 -1.09 0.15 -0.27 121.20 124.43 1t99 s ILE 1180Ca 0.02 -0.91 -0.08 0.00 -2.23 0.00 0.00 60.65 57.45 1t99 s ILE 1180Cb -0.13 -1.96 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 1t99 s ILE 1180CO 0.03 0.58 0.10 -0.47 -1.23 0.00 0.00 174.94 173.94 1t99 s TYR 1181N -0.51 3.18 -0.72 3.97 5.04 -0.22 -0.87 117.35 127.21 1t99 s TYR 1181Ca 0.07 -0.11 -0.22 0.00 -2.44 0.00 0.00 57.07 54.36 1t99 s TYR 1181Cb -0.11 -2.22 0.07 0.00 0.35 0.00 0.00 41.96 40.05 1t99 s TYR 1181CO 0.01 -0.13 1.04 0.34 -1.34 0.00 0.00 175.55 175.48 1t99 s ASP 1182N 1.21 6.26 0.51 4.32 -1.08 -0.37 -0.11 116.67 127.40 1t99 s ASP 1182Ca 0.05 -1.13 0.29 0.00 -0.52 0.00 0.00 52.55 51.25 1t99 s ASP 1182Cb -0.14 -2.44 1.25 0.00 -1.46 0.00 0.00 42.92 40.13 1t99 s ASP 1182CO 0.04 -1.42 1.95 0.00 0.52 0.00 0.00 175.17 176.26 1t99 h ALA 1183N 9.51 1.06 0.00 3.66 0.00 -1.04 -3.21 119.26 129.24 1t99 h ALA 1183Ca -0.20 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1t99 h ALA 1183Cb 1.06 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1t99 h ALA 1183CO 1.19 0.15 -0.43 1.15 0.00 0.00 0.00 179.25 181.30 1t99 h THR 1184N 0.00 1.15 0.00 0.00 2.02 -1.90 -3.39 112.91 110.78 1t99 h THR 1184Ca -0.00 -2.01 0.00 0.00 0.77 0.00 0.00 66.41 65.16 1t99 h THR 1184Cb 0.55 2.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1t99 h THR 1184CO 0.02 0.39 -0.01 0.45 0.37 0.00 0.00 175.52 176.73 1t99 h HIS 1185N -1.00 0.00 0.00 3.16 3.86 -1.91 -3.30 115.15 115.96 1t99 h HIS 1185Ca -0.11 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1t99 h HIS 1185Cb 0.93 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.40 1t99 h HIS 1185CO 0.15 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.71 1t99 h SER 1186N 0.00 0.00 -0.01 2.45 0.02 -1.67 -3.00 113.55 111.34 1t99 h SER 1186Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1t99 h SER 1186Cb 0.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1t99 h SER 1186CO 0.00 0.00 -0.49 1.33 -1.14 0.00 0.00 176.83 176.53 1t99 n VAL 1187N -2.78 0.00 -2.02 2.27 0.24 -1.24 -4.70 118.33 110.10 1t99 n VAL 1187Ca 0.01 -0.26 -0.41 0.00 -2.04 0.00 0.00 64.34 61.65 1t99 n VAL 1187Cb 0.30 1.09 -0.02 0.00 -1.47 0.00 0.00 33.84 33.74 1t99 n VAL 1187CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1t99 s GLN 1188N -2.06 4.28 -0.54 7.34 -0.21 -1.14 -4.64 119.66 122.69 1t99 s GLN 1188Ca 0.09 2.32 -0.20 0.00 0.02 0.00 0.00 55.36 57.59 1t99 s GLN 1188Cb 0.11 -3.06 0.07 0.00 1.00 0.00 0.00 33.01 31.13 1t99 s GLN 1188CO 0.48 -0.33 0.69 -0.51 -2.12 0.00 0.00 175.29 173.50 1t99 s LEU 1189N -1.44 4.98 0.43 2.90 1.43 -1.26 -4.37 118.68 121.34 1t99 s LEU 1189Ca 0.53 -1.02 -0.23 0.00 -1.03 0.00 0.00 54.13 52.38 1t99 s LEU 1189Cb -0.42 -2.43 -0.12 0.00 0.03 0.00 0.00 46.19 43.25 1t99 s LEU 1189CO 0.52 -1.02 0.68 -2.65 0.23 0.00 0.00 176.35 174.12 1t99 n PRO 1190N 6.42 0.77 0.00 1.29 -0.02 -1.26 -4.92 135.00 137.29 1t99 n PRO 1190Ca -0.07 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1t99 n PRO 1190Cb 0.45 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1t99 n PRO 1190CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t99 n GLY 1191N 1.62 1.35 0.00 -1.23 0.00 -1.26 -4.35 105.19 101.32 1t99 n GLY 1191Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1t99 n GLY 1191CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t99 n GLY 1199N 0.00 1.02 2.02 -0.02 0.00 -1.26 -5.01 105.19 101.94 1t99 n GLY 1199Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1t99 n GLY 1199CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1t99 n MET 1200N 0.00 0.00 -0.32 1.61 0.00 -1.26 -4.92 117.12 112.22 1t99 n MET 1200Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 57.70 57.80 1t99 n MET 1200Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 33.22 33.44 1t99 n MET 1200CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1t99 h ARG 1201N 0.00 0.03 0.00 0.03 9.65 -1.89 0.23 114.38 122.43 1t99 h ARG 1201Ca 0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1t99 h ARG 1201Cb 0.00 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 1t99 h ARG 1201CO 0.00 0.02 0.00 1.05 2.80 0.00 0.00 179.97 183.84 1t99 h GLU 1202N 0.03 0.00 -0.00 0.20 4.11 -1.94 -1.96 114.58 115.02 1t99 h GLU 1202Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.95 1t99 h GLU 1202Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1t99 h GLU 1202CO -0.87 0.00 -0.79 1.19 0.07 0.00 0.00 179.01 178.61 1t99 n PHE 1203N -2.40 0.00 0.21 2.06 3.01 0.81 -4.53 117.46 116.62 1t99 n PHE 1203Ca -0.01 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.29 1t99 n PHE 1203Cb 0.07 -0.10 -0.08 0.00 -0.01 0.00 0.00 39.48 39.36 1t99 n PHE 1203CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1t99 h ILE 1204N 0.04 0.20 -0.11 4.37 2.04 -1.37 -2.55 117.51 120.13 1t99 h ILE 1204Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1t99 h ILE 1204Cb 0.50 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1t99 h ILE 1204CO 0.00 0.00 0.05 0.15 0.00 0.00 0.00 178.15 178.35 1t99 h PHE 1205N -0.76 0.16 -0.89 1.37 -0.00 -1.79 -2.17 116.94 112.85 1t99 h PHE 1205Ca -0.02 -0.01 0.07 0.00 -0.00 0.00 0.00 57.97 58.01 1t99 h PHE 1205Cb 0.71 -0.05 -0.07 0.00 -0.00 0.00 0.00 35.95 36.54 1t99 h PHE 1205CO -0.25 0.24 0.55 -1.00 -0.00 0.00 0.00 178.31 177.85 1t99 h PRO 1206N 0.03 0.96 0.00 6.41 0.13 -1.79 -1.66 132.00 136.08 1t99 h PRO 1206Ca 0.04 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 65.03 1t99 h PRO 1206Cb 0.15 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.05 1t99 h PRO 1206CO -0.00 0.63 -0.40 -0.07 -0.23 0.00 0.00 178.00 177.93 1t99 h LEU 1207N 0.98 0.00 -0.43 1.56 3.38 -1.37 -2.50 115.31 116.94 1t99 h LEU 1207Ca 0.39 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.21 1t99 h LEU 1207Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1t99 h LEU 1207CO -0.19 0.40 -0.39 -0.29 0.09 0.00 0.00 178.44 178.06 1t99 h ILE 1208N 0.00 1.27 -0.77 1.22 2.10 -0.70 -1.23 117.51 119.40 1t99 h ILE 1208Ca -0.00 -1.57 -0.00 0.00 1.08 0.00 0.00 64.86 64.37 1t99 h ILE 1208Cb 0.85 1.40 -0.04 0.00 -1.09 0.00 0.00 36.82 37.95 1t99 h ILE 1208CO 0.05 0.52 0.48 0.03 -1.08 0.00 0.00 178.15 178.15 1t99 h ARG 1209N 0.73 1.04 -0.67 2.19 3.08 -0.99 -2.13 114.38 117.64 1t99 h ARG 1209Ca 0.06 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1t99 h ARG 1209Cb 0.98 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 1t99 h ARG 1209CO 0.09 0.72 0.42 0.00 -1.07 0.00 0.00 179.97 180.14 1t99 h ALA 1210N 1.26 0.85 -0.47 0.04 0.00 -1.18 -1.74 119.26 118.02 1t99 h ALA 1210Ca 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1t99 h ALA 1210Cb -0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1t99 h ALA 1210CO -0.05 0.30 0.28 0.00 0.00 0.00 0.00 179.25 179.78 1t99 h ALA 1211N 1.22 0.59 0.00 0.00 0.00 -0.59 -0.57 119.26 119.91 1t99 h ALA 1211Ca 0.24 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1t99 h ALA 1211Cb -0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1t99 h ALA 1211CO -0.05 0.08 -0.55 -0.39 0.00 0.00 0.00 179.25 178.34 1t99 h VAL 1212N 0.62 1.17 -0.16 0.00 -1.51 -1.30 0.11 116.25 115.18 1t99 h VAL 1212Ca 0.17 -2.06 -0.17 0.00 -1.23 0.00 0.00 66.70 63.40 1t99 h VAL 1212Cb -0.01 2.19 -0.00 0.00 -2.13 0.00 0.00 31.29 31.33 1t99 h VAL 1212CO -0.03 0.54 -0.61 0.00 -1.23 0.00 0.00 177.57 176.24 1t99 h ALA 1213N 1.45 0.64 -0.14 5.19 0.00 -0.93 -3.02 119.26 122.43 1t99 h ALA 1213Ca -0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 1t99 h ALA 1213Cb 1.14 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1t99 h ALA 1213CO 0.07 0.70 -0.17 0.28 0.00 0.00 0.00 179.25 180.14 1t99 h VAL 1214N 0.41 1.35 0.00 0.00 2.07 -1.00 -3.48 116.25 115.61 1t99 h VAL 1214Ca -0.00 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1t99 h VAL 1214Cb 1.17 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1t99 h VAL 1214CO 0.11 0.40 0.00 0.61 0.02 0.00 0.00 177.57 178.71 1t99 n GLY 1215N 0.25 3.11 3.43 2.17 0.00 0.02 -4.85 105.19 109.31 1t99 n GLY 1215Ca -0.06 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 1t99 n GLY 1215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t99 n ASP 1217N -1.00 2.03 0.00 0.00 8.00 0.63 -5.00 116.55 121.21 1t99 n ASP 1217Ca 0.01 -1.51 0.00 0.00 0.71 0.00 0.00 54.79 54.01 1t99 n ASP 1217Cb 0.63 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 42.10 1t99 n ASP 1217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1t99 n GLY 1218N 1.40 0.64 3.27 0.44 0.00 -1.15 -1.46 105.19 108.33 1t99 n GLY 1218Ca 0.10 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 1t99 n GLY 1218CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t99 s VAL 1219N -2.00 1.61 -0.14 1.61 -7.23 0.14 -1.06 120.40 113.34 1t99 s VAL 1219Ca 0.00 -1.56 0.03 0.00 -1.81 0.00 0.00 61.98 58.64 1t99 s VAL 1219Cb 0.00 -1.51 0.01 0.00 0.56 0.00 0.00 36.38 35.44 1t99 s VAL 1219CO 0.00 -0.14 -0.21 0.12 -0.31 0.00 0.00 175.10 174.56 1t99 s PHE 1220N -1.34 2.60 -0.02 2.82 2.19 0.85 -1.03 117.98 124.05 1t99 s PHE 1220Ca 0.06 -1.30 0.00 0.00 0.33 0.00 0.00 56.93 56.03 1t99 s PHE 1220Cb -0.09 -1.77 0.02 0.00 -1.31 0.00 0.00 43.02 39.87 1t99 s PHE 1220CO 0.04 -0.59 0.02 -1.64 1.83 0.00 0.00 175.22 174.87 1t99 s MET 1221N 0.81 0.04 0.01 10.12 -1.94 0.14 -0.41 119.30 128.07 1t99 s MET 1221Ca -0.08 0.12 -0.20 0.00 -1.71 0.00 0.00 55.69 53.82 1t99 s MET 1221Cb -0.16 -0.23 -0.06 0.00 2.01 0.00 0.00 34.83 36.39 1t99 s MET 1221CO -0.01 -0.12 0.57 -1.21 -0.01 0.00 0.00 175.02 174.24 1t99 s GLU 1222N 0.79 4.26 0.00 2.03 2.02 -1.26 -2.91 118.70 123.63 1t99 s GLU 1222Ca -0.07 0.69 -0.02 0.00 0.02 0.00 0.00 54.97 55.59 1t99 s GLU 1222Cb -0.10 -3.31 -0.01 0.00 0.10 0.00 0.00 34.13 30.81 1t99 s GLU 1222CO -0.02 0.45 0.04 -0.08 0.02 0.00 0.00 175.26 175.66 1t99 s THR 1223N -0.43 0.06 -0.04 3.63 -1.32 -0.38 -0.34 115.64 116.82 1t99 s THR 1223Ca 0.30 -0.52 -0.08 0.00 -1.21 0.00 0.00 61.69 60.18 1t99 s THR 1223Cb -0.18 -0.23 0.01 0.00 -1.51 0.00 0.00 72.50 70.59 1t99 s THR 1223CO 0.17 -0.28 0.18 -2.28 -2.21 0.00 0.00 174.62 170.20 1t99 s HIS 1224N -0.87 -0.11 0.24 9.09 5.04 -0.41 -2.58 115.29 125.69 1t99 s HIS 1224Ca -0.10 0.24 -0.05 0.00 -1.54 0.00 0.00 55.06 53.61 1t99 s HIS 1224Cb -0.06 0.03 0.45 0.00 0.04 0.00 0.00 32.58 33.04 1t99 s HIS 1224CO -0.00 -0.20 1.70 -1.35 -2.34 0.00 0.00 174.74 172.55 1t99 h PRO 1225N 5.05 0.31 -2.58 2.88 0.11 -1.95 -1.41 132.00 134.41 1t99 h PRO 1225Ca -0.28 -0.02 -0.59 0.00 0.11 0.00 0.00 66.00 65.22 1t99 h PRO 1225Cb 1.19 -0.07 -0.39 0.00 0.11 0.00 0.00 31.00 31.84 1t99 h PRO 1225CO 0.39 0.20 -0.87 -1.21 -0.21 0.00 0.00 178.00 176.31 1t99 s GLU 1226N -6.04 0.84 0.33 1.05 2.02 -1.26 -4.29 118.70 111.35 1t99 s GLU 1226Ca -0.13 -1.75 0.11 0.00 0.02 0.00 0.00 54.97 53.22 1t99 s GLU 1226Cb 0.21 -1.56 0.99 0.00 0.10 0.00 0.00 34.13 33.87 1t99 s GLU 1226CO 0.76 -1.27 1.63 -1.35 0.02 0.00 0.00 175.26 175.05 1t99 h PRO 1227N 6.46 0.19 0.00 0.39 0.11 -1.85 0.72 132.00 138.02 1t99 h PRO 1227Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1t99 h PRO 1227Cb 0.94 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1t99 h PRO 1227CO 0.34 0.12 0.15 1.05 -0.21 0.00 0.00 178.00 179.46 1t99 h GLU 1228N 0.19 0.00 -0.11 1.05 -0.00 -1.93 -0.38 114.58 113.40 1t99 h GLU 1228Ca 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 60.05 1t99 h GLU 1228Cb 1.57 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.32 1t99 h GLU 1228CO -0.69 0.00 0.00 1.63 -0.00 0.00 0.00 179.01 179.95 1t99 n LYS 1229N -2.22 1.81 -1.92 1.06 5.02 0.24 -5.04 118.16 117.13 1t99 n LYS 1229Ca -0.01 -1.44 -0.36 0.00 -2.02 0.00 0.00 58.31 54.48 1t99 n LYS 1229Cb 0.18 -1.12 0.04 0.00 -0.02 0.00 0.00 35.03 34.11 1t99 n LYS 1229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1t99 s ALA 1230N -0.81 2.48 -1.24 7.82 0.00 -0.15 -4.92 121.76 124.94 1t99 s ALA 1230Ca 0.10 1.02 0.27 0.00 0.00 0.00 0.00 51.96 53.35 1t99 s ALA 1230Cb 0.05 -3.47 0.94 0.00 0.00 0.00 0.00 23.12 20.65 1t99 s ALA 1230CO 0.07 -1.29 1.70 1.28 0.00 0.00 0.00 175.76 177.52 1t99 n LEU 1231N -1.75 0.39 -3.64 0.00 4.77 -1.26 -4.59 117.00 110.91 1t99 n LEU 1231Ca 0.14 0.12 -0.15 0.00 -0.03 0.00 0.00 56.01 56.10 1t99 n LEU 1231Cb 0.49 -0.29 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1t99 n LEU 1231CO 0.45 0.08 0.31 -0.94 -1.33 0.00 0.00 177.39 175.97 1t99 s SER 1232N -2.81 -0.61 -1.39 -1.43 1.04 -1.26 -4.49 113.70 102.76 1t99 s SER 1232Ca 0.18 1.02 -0.01 0.00 0.48 0.00 0.00 55.95 57.62 1t99 s SER 1232Cb 0.19 1.01 0.01 0.00 0.10 0.00 0.00 66.02 67.32 1t99 s SER 1232CO 0.57 -0.33 0.10 0.47 0.98 0.00 0.00 173.24 175.03 1t99 n ASP 1233N 2.18 -4.85 -0.33 7.02 9.92 -1.26 -4.81 116.55 124.42 1t99 n ASP 1233Ca -0.16 0.03 0.09 0.00 -0.53 0.00 0.00 54.79 54.22 1t99 n ASP 1233Cb 0.56 -4.06 0.26 0.00 -0.64 0.00 0.00 41.12 37.25 1t99 n ASP 1233CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1t99 h ALA 1234N 1.00 1.47 0.00 2.24 0.00 -1.81 -0.58 119.26 121.58 1t99 h ALA 1234Ca -0.40 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1t99 h ALA 1234Cb 1.29 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1t99 h ALA 1234CO 0.47 -0.00 -0.24 0.77 0.00 0.00 0.00 179.25 180.25 1t99 h SER 1235N 0.76 0.00 -0.00 0.00 0.02 -1.89 -3.30 113.55 109.13 1t99 h SER 1235Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 1t99 h SER 1235Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1t99 h SER 1235CO -0.35 0.24 -0.21 0.35 -1.14 0.00 0.00 176.83 175.72 1t99 n THR 1236N -3.72 0.00 -2.41 -2.27 -2.24 -0.68 -4.38 114.28 98.58 1t99 n THR 1236Ca -0.01 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 60.96 1t99 n THR 1236Cb 0.35 1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 1t99 n THR 1236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1t99 s GLN 1237N -1.30 4.49 0.18 -0.78 -0.21 -0.31 -4.87 119.66 116.86 1t99 s GLN 1237Ca 0.05 1.82 -0.30 0.00 0.02 0.00 0.00 55.36 56.95 1t99 s GLN 1237Cb 0.06 -3.27 -0.08 0.00 1.00 0.00 0.00 33.01 30.71 1t99 s GLN 1237CO 0.22 -0.11 1.18 -1.17 -2.12 0.00 0.00 175.29 173.29 1t99 s LEU 1238N 0.09 4.45 0.28 2.90 2.96 0.54 -4.71 118.68 125.19 1t99 s LEU 1238Ca 0.54 2.20 -0.30 0.00 -0.22 0.00 0.00 54.13 56.35 1t99 s LEU 1238Cb -0.31 -3.61 -0.11 0.00 0.50 0.00 0.00 46.19 42.66 1t99 s LEU 1238CO 0.34 -0.35 1.62 -2.84 -1.32 0.00 0.00 176.35 173.80 1t99 s PRO 1239N -0.22 4.12 0.39 0.98 0.02 -1.26 -1.29 135.00 137.73 1t99 s PRO 1239Ca 0.52 2.59 0.12 0.00 0.02 0.00 0.00 61.00 64.25 1t99 s PRO 1239Cb -0.32 -3.03 0.92 0.00 0.02 0.00 0.00 34.50 32.09 1t99 s PRO 1239CO 0.36 -0.66 1.89 1.25 -0.33 0.00 0.00 177.00 179.51 1t99 h LEU 1240N 5.16 0.54 -0.71 -5.54 5.85 -1.44 -1.07 115.31 118.10 1t99 h LEU 1240Ca -0.46 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1t99 h LEU 1240Cb 1.22 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1t99 h LEU 1240CO 0.82 0.28 0.00 -1.54 -0.34 0.00 0.00 178.44 177.66 1t99 n SER 1241N -4.52 0.55 0.02 1.25 3.41 -1.26 -2.38 113.62 110.69 1t99 n SER 1241Ca 0.16 0.66 0.11 0.00 -0.26 0.00 0.00 58.87 59.54 1t99 n SER 1241Cb 0.49 -0.77 0.11 0.00 -0.26 0.00 0.00 64.21 63.78 1t99 n SER 1241CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t99 n GLN 1242N -2.13 0.16 -0.10 4.33 6.02 -0.41 -4.46 117.38 120.78 1t99 n GLN 1242Ca 0.02 0.01 -0.06 0.00 -0.01 0.00 0.00 57.00 56.96 1t99 n GLN 1242Cb 0.19 -1.56 0.02 0.00 1.02 0.00 0.00 30.24 29.90 1t99 n GLN 1242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1t99 h LEU 1243N 0.00 -0.04 -0.51 1.08 5.85 -1.52 -2.31 115.31 117.85 1t99 h LEU 1243Ca 0.00 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1t99 h LEU 1243Cb 0.63 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 1t99 h LEU 1243CO 0.00 0.01 0.21 -0.08 -0.34 0.00 0.00 178.44 178.25 1t99 h GLU 1244N 0.16 0.40 -0.43 1.25 4.81 -1.79 -0.54 114.58 118.44 1t99 h GLU 1244Ca 0.17 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 1t99 h GLU 1244Cb 0.21 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1t99 h GLU 1244CO -0.25 0.27 -0.15 0.78 -0.73 0.00 0.00 179.01 178.93 1t99 h GLY 1245N 0.41 0.87 0.90 1.92 0.00 -1.79 -0.87 103.07 104.51 1t99 h GLY 1245Ca 0.24 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1t99 h GLY 1245CO -0.22 0.63 0.07 -2.22 0.00 0.00 0.00 176.54 174.80 1t99 h ILE 1246N 0.71 1.22 -0.17 2.60 1.08 -0.87 -1.51 117.51 120.58 1t99 h ILE 1246Ca 0.11 -0.75 -0.01 0.00 -0.39 0.00 0.00 64.86 63.82 1t99 h ILE 1246Cb 0.65 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 35.52 1t99 h ILE 1246CO 0.05 0.25 0.08 0.40 -0.69 0.00 0.00 178.15 178.24 1t99 h ILE 1247N 0.34 1.12 -0.57 -0.67 2.04 -1.00 -1.02 117.51 117.74 1t99 h ILE 1247Ca 0.10 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.68 1t99 h ILE 1247Cb 0.31 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 37.37 1t99 h ILE 1247CO 0.00 0.11 0.26 -0.08 0.00 0.00 0.00 178.15 178.45 1t99 h GLU 1248N 0.15 0.48 -0.64 2.37 4.57 -1.09 -1.41 114.58 119.02 1t99 h GLU 1248Ca 0.06 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 1t99 h GLU 1248Cb 0.11 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 1t99 h GLU 1248CO -0.01 0.32 0.28 0.00 -1.18 0.00 0.00 179.01 178.42 1t99 h ALA 1249N 1.34 0.83 0.00 2.92 0.00 -0.95 -2.00 119.26 121.40 1t99 h ALA 1249Ca 0.27 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1t99 h ALA 1249Cb 0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1t99 h ALA 1249CO -0.21 0.42 -0.47 -0.84 0.00 0.00 0.00 179.25 178.14 1t99 h ILE 1250N 0.89 1.10 -0.24 0.00 3.07 -0.63 -0.89 117.51 120.81 1t99 h ILE 1250Ca 0.22 -1.77 -0.13 0.00 1.55 0.00 0.00 64.86 64.73 1t99 h ILE 1250Cb 0.16 2.02 -0.01 0.00 -0.27 0.00 0.00 36.82 38.72 1t99 h ILE 1250CO -0.02 0.46 -0.37 -0.07 -1.05 0.00 0.00 178.15 177.10 1t99 h LEU 1251N 0.00 0.57 -0.10 0.16 3.38 -1.04 0.85 115.31 119.13 1t99 h LEU 1251Ca -0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1t99 h LEU 1251Cb 0.99 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1t99 h LEU 1251CO 0.06 0.89 -0.02 -0.33 0.09 0.00 0.00 178.44 179.13 1t99 h GLU 1252N 0.45 0.19 -0.40 1.13 5.08 -0.86 -1.59 114.58 118.59 1t99 h GLU 1252Ca 0.04 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1t99 h GLU 1252Cb 0.86 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1t99 h GLU 1252CO 0.07 0.49 -0.07 0.82 -1.00 0.00 0.00 179.01 179.32 1t99 h ILE 1253N -0.12 1.24 -0.21 3.13 2.04 -1.09 -2.62 117.51 119.87 1t99 h ILE 1253Ca 0.03 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.83 1t99 h ILE 1253Cb 0.42 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1t99 h ILE 1253CO 0.01 0.36 0.11 -0.09 0.00 0.00 0.00 178.15 178.54 1t99 h ARG 1254N 0.63 0.30 -0.08 2.37 2.43 -0.76 -0.79 114.38 118.48 1t99 h ARG 1254Ca 0.12 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1t99 h ARG 1254Cb 0.50 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1t99 h ARG 1254CO 0.03 0.28 0.05 1.49 -1.51 0.00 0.00 179.97 180.32 1t99 h GLU 1255N 0.23 0.11 -0.01 0.20 4.57 -1.09 0.24 114.58 118.83 1t99 h GLU 1255Ca 0.07 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.13 1t99 h GLU 1255Cb 0.08 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 1t99 h GLU 1255CO -0.01 0.07 -0.54 -0.24 -1.18 0.00 0.00 179.01 177.12 1t99 h VAL 1256N 0.11 1.38 0.00 0.32 3.04 -1.43 -3.11 116.25 116.56 1t99 h VAL 1256Ca 0.03 -1.84 -0.11 0.00 -1.01 0.00 0.00 66.70 63.77 1t99 h VAL 1256Cb -0.01 1.98 -0.02 0.00 -2.01 0.00 0.00 31.29 31.23 1t99 h VAL 1256CO -0.01 0.53 -0.72 0.00 -1.01 0.00 0.00 177.57 176.36 1t99 h ALA 1257N 1.43 0.68 -1.00 3.17 0.00 -0.90 -3.39 119.26 119.25 1t99 h ALA 1257Ca -0.00 -0.50 0.21 0.00 0.00 0.00 0.00 54.91 54.62 1t99 h ALA 1257Cb 0.96 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.65 1t99 h ALA 1257CO 0.07 0.62 0.60 0.66 0.00 0.00 0.00 179.25 181.20 1t99 h SER 1258N 0.00 0.73 0.25 0.00 4.64 -0.44 -0.48 113.55 118.25 1t99 h SER 1258Ca -0.04 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1t99 h SER 1258Cb 1.39 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 1t99 h SER 1258CO 0.05 0.21 0.00 0.07 -0.87 0.00 0.00 176.83 176.29 1t99 h LYS 1259N 0.69 0.00 -0.02 4.77 2.10 -1.76 -2.30 116.57 120.05 1t99 h LYS 1259Ca 0.60 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.25 1t99 h LYS 1259Cb 1.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.33 1t99 h LYS 1259CO -0.42 0.00 -0.26 0.66 -2.00 0.00 0.00 179.45 177.44 1t99 n TYR 1260N -2.35 0.00 -1.70 0.07 4.02 -0.19 -4.95 117.16 112.06 1t99 n TYR 1260Ca -0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1t99 n TYR 1260Cb 0.10 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.39 1t99 n TYR 1260CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1t99 n TYR 1261N 0.52 2.62 -2.23 -0.72 0.53 -0.87 -4.95 117.16 112.06 1t99 n TYR 1261Ca 0.11 -0.02 -0.34 0.00 -1.02 0.00 0.00 57.90 56.62 1t99 n TYR 1261Cb 0.49 -2.69 0.00 0.00 -1.03 0.00 0.00 39.34 36.12 1t99 n TYR 1261CO 0.00 0.00 0.00 -1.21 -1.02 0.00 0.00 176.86 174.63 1t99 s GLU 1262N 1.96 3.37 -0.29 -0.72 8.01 -1.26 -5.00 118.70 124.77 1t99 s GLU 1262Ca 0.79 1.50 -0.23 0.00 0.01 0.00 0.00 54.97 57.04 1t99 s GLU 1262Cb -0.52 -2.02 -0.00 0.00 -4.31 0.00 0.00 34.13 27.28 1t99 s GLU 1262CO 0.36 -0.81 0.75 0.99 0.01 0.00 0.00 175.26 176.55 1t99 s THR 1263N -1.95 4.85 -2.23 3.63 2.01 -1.26 -5.17 115.64 115.52 1t99 s THR 1263Ca 0.70 1.19 0.30 0.00 0.31 0.00 0.00 61.69 64.19 1t99 s THR 1263Cb -0.21 -4.09 0.74 0.00 0.01 0.00 0.00 72.50 68.95 1t99 s THR 1263CO 0.28 -0.17 2.00 2.30 -0.69 0.00 0.00 174.62 178.35