#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lrq n LYS 1003N 0.00 2.69 -2.52 5.31 4.81 -1.26 -4.94 118.16 122.25 1lrq n LYS 1003Ca 0.00 0.98 -0.41 0.00 -0.87 0.00 0.00 58.31 58.01 1lrq n LYS 1003Cb 0.00 -2.85 -0.04 0.00 0.02 0.00 0.00 35.03 32.16 1lrq n LYS 1003CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1lrq s PHE 1004N 2.37 3.60 -0.12 5.64 2.19 -1.17 -4.77 117.98 125.71 1lrq s PHE 1004Ca 0.81 1.60 -0.14 0.00 0.33 0.00 0.00 56.93 59.53 1lrq s PHE 1004Cb -0.52 -3.27 -0.05 0.00 -1.31 0.00 0.00 43.02 37.87 1lrq s PHE 1004CO 0.37 -0.60 0.32 -1.17 1.83 0.00 0.00 175.22 175.98 1lrq s LEU 1005N -0.31 4.31 -0.22 6.12 2.96 -0.80 -0.23 118.68 130.50 1lrq s LEU 1005Ca 0.50 0.62 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 1lrq s LEU 1005Cb -0.29 -2.42 0.06 0.00 0.50 0.00 0.00 46.19 44.04 1lrq s LEU 1005CO 0.35 0.17 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.81 1lrq s VAL 1006N 0.02 1.38 -0.26 1.68 1.01 -0.28 -0.94 120.40 123.02 1lrq s VAL 1006Ca 0.19 -1.09 -0.10 0.00 0.00 0.00 0.00 61.98 60.97 1lrq s VAL 1006Cb -0.14 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 1lrq s VAL 1006CO 0.06 -0.09 0.16 -0.63 0.00 0.00 0.00 175.10 174.61 1lrq s ILE 1007N 1.47 5.17 0.04 2.22 1.01 -0.15 -1.38 121.20 129.57 1lrq s ILE 1007Ca -0.05 0.12 -0.17 0.00 0.00 0.00 0.00 60.65 60.55 1lrq s ILE 1007Cb -0.18 -3.44 0.03 0.00 0.01 0.00 0.00 42.46 38.88 1lrq s ILE 1007CO -0.07 0.29 0.39 0.00 0.00 0.00 0.00 174.94 175.55 1lrq s ALA 1008N 1.56 -0.94 0.00 9.38 0.00 -0.56 -0.45 121.76 130.75 1lrq s ALA 1008Ca 0.07 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1lrq s ALA 1008Cb -0.15 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.27 1lrq s ALA 1008CO 0.08 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.83 1lrq n GLY 1009N 0.60 0.73 3.77 0.00 0.00 -1.10 -0.86 105.19 108.34 1lrq n GLY 1009Ca -0.19 -1.18 -0.38 0.00 0.00 0.00 0.00 46.02 44.27 1lrq n GLY 1009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lrq s PRO 1010N -2.00 3.99 0.14 1.61 0.04 -1.00 -0.52 135.00 137.27 1lrq s PRO 1010Ca 0.00 1.85 -0.26 0.00 0.04 0.00 0.00 61.00 62.63 1lrq s PRO 1010Cb 0.00 -2.63 -0.01 0.00 0.04 0.00 0.00 34.50 31.90 1lrq s PRO 1010CO 0.00 -0.37 1.60 0.00 0.04 0.00 0.00 177.00 178.26 1lrq s ALA 1012N -5.96 2.53 -1.26 0.00 0.00 -1.26 -1.49 121.76 114.33 1lrq s ALA 1012Ca -0.15 -1.54 -0.18 0.00 0.00 0.00 0.00 51.96 50.09 1lrq s ALA 1012Cb 0.11 -0.41 0.08 0.00 0.00 0.00 0.00 23.12 22.90 1lrq s ALA 1012CO 0.66 0.49 1.68 0.42 0.00 0.00 0.00 175.76 179.00 1lrq s ILE 1013N -1.42 4.19 0.43 0.00 1.01 -0.52 -4.75 121.20 120.14 1lrq s ILE 1013Ca 0.19 -1.87 0.12 0.00 0.00 0.00 0.00 60.65 59.09 1lrq s ILE 1013Cb -0.09 -5.16 0.19 0.00 0.01 0.00 0.00 42.46 37.41 1lrq s ILE 1013CO 0.09 -1.98 1.98 -0.33 0.00 0.00 0.00 174.94 174.70 1lrq h GLU 1014N 7.77 0.14 -1.43 2.79 5.08 -1.96 -3.42 114.58 123.55 1lrq h GLU 1014Ca 0.41 -0.03 0.21 0.00 -1.00 0.00 0.00 59.36 58.96 1lrq h GLU 1014Cb 0.89 -0.02 -0.21 0.00 0.50 0.00 0.00 28.75 29.90 1lrq h GLU 1014CO 1.43 0.26 0.79 -1.54 -1.00 0.00 0.00 179.01 178.95 1lrq s SER 1015N -6.94 -0.16 0.46 1.42 1.04 -1.26 -5.00 113.70 103.26 1lrq s SER 1015Ca -0.05 0.08 0.16 0.00 0.48 0.00 0.00 55.95 56.62 1lrq s SER 1015Cb 0.16 0.15 1.07 0.00 0.10 0.00 0.00 66.02 67.50 1lrq s SER 1015CO 0.71 -0.22 2.00 -0.08 0.98 0.00 0.00 173.24 176.63 1lrq h GLU 1016N 2.11 0.00 -0.49 4.02 4.81 -1.96 -2.29 114.58 120.78 1lrq h GLU 1016Ca -0.11 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 1lrq h GLU 1016Cb 1.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 1lrq h GLU 1016CO 0.24 0.18 0.16 1.49 -0.73 0.00 0.00 179.01 180.35 1lrq h GLU 1017N 0.00 0.75 -0.53 1.92 4.81 -1.99 -2.06 114.58 117.48 1lrq h GLU 1017Ca -0.00 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1lrq h GLU 1017Cb 0.33 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1lrq h GLU 1017CO 0.02 0.70 0.34 1.25 -0.73 0.00 0.00 179.01 180.60 1lrq h LEU 1018N 0.65 0.62 -0.53 1.64 5.85 -1.81 -2.28 115.31 119.46 1lrq h LEU 1018Ca 0.16 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1lrq h LEU 1018Cb 0.26 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1lrq h LEU 1018CO -0.01 0.47 0.34 -0.07 -0.34 0.00 0.00 178.44 178.84 1lrq h LEU 1019N 0.72 0.59 -1.01 2.25 4.07 -1.23 -2.14 115.31 118.57 1lrq h LEU 1019Ca 0.19 -0.01 -0.08 0.00 0.08 0.00 0.00 57.88 58.06 1lrq h LEU 1019Cb -0.06 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.52 1lrq h LEU 1019CO -0.04 0.42 -0.15 -0.07 -1.08 0.00 0.00 178.44 177.52 1lrq h LEU 1020N 0.70 0.53 -0.22 1.67 3.38 -1.20 0.30 115.31 120.47 1lrq h LEU 1020Ca 0.20 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1lrq h LEU 1020Cb -0.06 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1lrq h LEU 1020CO -0.05 0.71 0.05 0.50 0.09 0.00 0.00 178.44 179.73 1lrq h LYS 1021N 0.49 0.35 -0.37 1.13 3.64 -1.10 -0.26 116.57 120.46 1lrq h LYS 1021Ca 0.09 -0.09 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 1lrq h LYS 1021Cb 0.55 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1lrq h LYS 1021CO 0.04 0.48 -0.41 0.28 -2.27 0.00 0.00 179.45 177.57 1lrq h VAL 1022N 0.17 1.27 -0.77 2.00 2.07 -1.25 -3.06 116.25 116.68 1lrq h VAL 1022Ca 0.07 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 66.02 1lrq h VAL 1022Cb 0.29 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1lrq h VAL 1022CO 0.00 0.53 0.51 1.23 0.02 0.00 0.00 177.57 179.86 1lrq h GLY 1023N 0.77 1.08 0.99 2.17 0.00 -0.23 -1.13 103.07 106.73 1lrq h GLY 1023Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1lrq h GLY 1023CO 0.10 0.38 0.34 -2.09 0.00 0.00 0.00 176.54 175.27 1lrq h GLU 1024N 1.03 0.81 -0.42 4.80 4.81 -0.94 0.39 114.58 125.05 1lrq h GLU 1024Ca 0.29 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.30 1lrq h GLU 1024Cb -0.09 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1lrq h GLU 1024CO -0.07 0.60 -0.26 1.49 -0.73 0.00 0.00 179.01 180.05 1lrq h GLU 1025N 0.80 0.92 -0.58 1.92 4.57 -1.39 -1.54 114.58 119.27 1lrq h GLU 1025Ca 0.21 -0.42 -0.06 0.00 -1.18 0.00 0.00 59.36 57.90 1lrq h GLU 1025Cb 0.01 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 1lrq h GLU 1025CO -0.04 1.08 0.12 0.82 -1.18 0.00 0.00 179.01 179.81 1lrq h ILE 1026N 0.75 1.24 -0.51 2.32 2.04 -0.92 -0.87 117.51 121.56 1lrq h ILE 1026Ca 0.09 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 65.01 1lrq h ILE 1026Cb 0.83 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1lrq h ILE 1026CO 0.07 0.34 0.19 0.50 0.00 0.00 0.00 178.15 179.25 1lrq h LYS 1027N 0.88 0.77 -0.51 2.37 1.63 -0.75 0.07 116.57 121.03 1lrq h LYS 1027Ca 0.19 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1lrq h LYS 1027Cb 0.35 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.84 1lrq h LYS 1027CO 0.00 0.69 0.33 -0.09 -3.45 0.00 0.00 179.45 176.93 1lrq h ARG 1028N 0.68 0.67 -0.18 1.90 2.43 -0.73 -1.98 114.38 117.18 1lrq h ARG 1028Ca 0.17 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 1lrq h ARG 1028Cb 0.22 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1lrq h ARG 1028CO -0.01 0.46 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.56 1lrq h LEU 1029N 0.69 0.34 -1.62 3.80 3.38 -0.93 -2.21 115.31 118.76 1lrq h LEU 1029Ca 0.18 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1lrq h LEU 1029Cb -0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1lrq h LEU 1029CO -0.04 0.62 -0.20 0.77 0.09 0.00 0.00 178.44 179.68 1lrq h SER 1030N 0.30 0.00 0.88 -0.43 4.64 -0.33 0.22 113.55 118.83 1lrq h SER 1030Ca 0.04 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.16 1lrq h SER 1030Cb 0.66 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 1lrq h SER 1030CO 0.05 0.20 -0.97 -0.33 -0.87 0.00 0.00 176.83 174.91 1lrq h GLU 1031N 0.00 0.05 0.00 4.77 4.39 -0.77 -3.35 114.58 119.67 1lrq h GLU 1031Ca -0.00 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1lrq h GLU 1031Cb 0.47 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1lrq h GLU 1031CO 0.03 0.97 -0.07 -0.22 -1.16 0.00 0.00 179.01 178.56 1lrq h LYS 1032N 0.02 0.00 -4.43 2.33 3.64 -1.05 -3.39 116.57 113.68 1lrq h LYS 1032Ca -0.03 0.00 -0.74 0.00 -1.27 0.00 0.00 60.65 58.62 1lrq h LYS 1032Cb 1.69 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 33.35 1lrq h LYS 1032CO 0.13 0.47 1.67 1.19 -2.27 0.00 0.00 179.45 180.64 1lrq n PHE 1033N -4.69 4.30 0.32 1.91 3.01 0.72 -4.79 117.46 118.24 1lrq n PHE 1033Ca -0.06 -3.14 0.16 0.00 1.01 0.00 0.00 57.45 55.42 1lrq n PHE 1033Cb 0.24 -2.16 0.68 0.00 -0.01 0.00 0.00 39.48 38.23 1lrq n PHE 1033CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1lrq h LYS 1034N 6.71 0.00 -0.03 -1.08 1.57 -1.77 -2.19 116.57 119.78 1lrq h LYS 1034Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1lrq h LYS 1034Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1lrq h LYS 1034CO 1.39 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 179.42 1lrq n GLU 1035N -2.73 1.26 -4.58 3.15 0.00 -1.26 -4.81 120.64 111.67 1lrq n GLU 1035Ca 0.01 -0.39 -0.33 0.00 0.00 0.00 0.00 57.16 56.45 1lrq n GLU 1035Cb 0.23 -1.43 -0.11 0.00 0.00 0.00 0.00 31.44 30.13 1lrq n GLU 1035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1lrq s VAL 1036N -1.97 3.56 -0.37 3.84 1.01 -0.82 -3.04 120.40 122.62 1lrq s VAL 1036Ca 0.39 -0.67 -0.13 0.00 0.00 0.00 0.00 61.98 61.57 1lrq s VAL 1036Cb 0.19 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 34.08 1lrq s VAL 1036CO 0.31 0.49 0.24 -0.70 0.00 0.00 0.00 175.10 175.44 1lrq s GLU 1037N -1.11 3.15 0.05 2.72 2.12 0.69 -4.95 118.70 121.37 1lrq s GLU 1037Ca 0.15 -0.88 -0.14 0.00 0.36 0.00 0.00 54.97 54.46 1lrq s GLU 1037Cb -0.11 -3.80 -0.06 0.00 0.26 0.00 0.00 34.13 30.42 1lrq s GLU 1037CO 0.04 -0.60 0.45 -0.06 -0.54 0.00 0.00 175.26 174.55 1lrq s PHE 1038N 1.65 3.67 -0.08 5.30 0.40 -1.26 -1.12 117.98 126.54 1lrq s PHE 1038Ca 0.05 0.97 -0.01 0.00 -0.60 0.00 0.00 56.93 57.34 1lrq s PHE 1038Cb -0.18 -2.28 0.03 0.00 0.51 0.00 0.00 43.02 41.09 1lrq s PHE 1038CO 0.09 0.57 -0.02 0.08 0.70 0.00 0.00 175.22 176.64 1lrq s VAL 1039N -1.24 0.53 -0.03 -0.44 1.01 -0.48 -4.12 120.40 115.63 1lrq s VAL 1039Ca 0.29 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 1lrq s VAL 1039Cb -0.16 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1lrq s VAL 1039CO 0.16 0.28 1.05 0.12 0.00 0.00 0.00 175.10 176.72 1lrq s PHE 1040N 1.86 3.51 0.01 5.22 5.36 0.00 -1.50 117.98 132.44 1lrq s PHE 1040Ca 0.04 1.54 0.08 0.00 -0.96 0.00 0.00 56.93 57.63 1lrq s PHE 1040Cb -0.12 -3.23 -0.02 0.00 -0.34 0.00 0.00 43.02 39.30 1lrq s PHE 1040CO -0.06 -0.45 -0.26 0.21 -1.46 0.00 0.00 175.22 173.21 1lrq s LYS 1041N 1.53 1.99 -0.29 10.12 2.36 -0.04 -1.32 119.74 134.09 1lrq s LYS 1041Ca 0.52 -1.00 -0.23 0.00 -2.55 0.00 0.00 55.97 52.72 1lrq s LYS 1041Cb -0.22 -2.03 0.15 0.00 -1.05 0.00 0.00 37.83 34.69 1lrq s LYS 1041CO 0.24 0.54 1.15 0.45 1.55 0.00 0.00 175.35 179.28 1lrq s SER 1042N -0.89 -0.33 -0.11 1.43 0.15 -1.16 -3.10 113.70 109.68 1lrq s SER 1042Ca 0.11 0.60 -0.20 0.00 0.70 0.00 0.00 55.95 57.16 1lrq s SER 1042Cb -0.10 0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 64.92 1lrq s SER 1042CO 0.00 -0.10 0.55 -0.44 1.20 0.00 0.00 173.24 174.45 1lrq s SER 1043N 0.45 6.76 0.12 5.45 0.01 -0.56 -4.53 113.70 121.41 1lrq s SER 1043Ca 0.01 0.91 0.26 0.00 1.31 0.00 0.00 55.95 58.45 1lrq s SER 1043Cb -0.05 -2.32 0.98 0.00 0.21 0.00 0.00 66.02 64.84 1lrq s SER 1043CO -0.11 -0.05 1.82 2.22 0.41 0.00 0.00 173.24 177.53 1lrq n PHE 1044N 3.79 0.50 -3.66 2.43 1.16 -1.26 -1.43 117.46 118.99 1lrq n PHE 1044Ca -0.05 0.15 -0.09 0.00 -1.87 0.00 0.00 57.45 55.59 1lrq n PHE 1044Cb 0.51 -0.75 -0.08 0.00 -1.61 0.00 0.00 39.48 37.56 1lrq n PHE 1044CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1lrq s ASP 1045N -3.82 -0.79 -0.88 5.98 2.15 -1.26 -3.86 116.67 114.19 1lrq s ASP 1045Ca 0.11 1.33 -0.12 0.00 0.43 0.00 0.00 52.55 54.30 1lrq s ASP 1045Cb 0.15 1.24 0.23 0.00 -0.30 0.00 0.00 42.92 44.24 1lrq s ASP 1045CO 0.54 -0.23 0.83 -0.54 -0.17 0.00 0.00 175.17 175.60 1lrq s LYS 1046N 1.26 3.69 0.00 4.34 -0.14 0.36 -4.88 119.74 124.37 1lrq s LYS 1046Ca -0.07 -2.63 0.32 0.00 -1.36 0.00 0.00 55.97 52.22 1lrq s LYS 1046Cb -0.06 -4.43 1.86 0.00 -1.68 0.00 0.00 37.83 33.53 1lrq s LYS 1046CO -0.13 -1.28 2.21 0.00 -0.76 0.00 0.00 175.35 175.39 1lrq n ALA 1047N 3.67 2.67 -2.13 5.17 0.00 -1.26 -3.91 120.51 124.71 1lrq n ALA 1047Ca 0.16 -0.20 0.03 0.00 0.00 0.00 0.00 53.44 53.43 1lrq n ALA 1047Cb 0.45 -1.51 0.10 0.00 0.00 0.00 0.00 19.45 18.48 1lrq n ALA 1047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1lrq n ASN 1048N -1.03 1.58 -4.66 0.00 2.04 -1.26 -5.09 115.26 106.85 1lrq n ASN 1048Ca 0.23 -2.89 -0.35 0.00 -0.44 0.00 0.00 54.58 51.13 1lrq n ASN 1048Cb 0.13 -0.41 0.10 0.00 -2.53 0.00 0.00 39.78 37.07 1lrq n ASN 1048CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1lrq n ARG 1049N -0.31 0.40 -0.08 -3.83 5.12 -1.25 -4.91 116.66 111.80 1lrq n ARG 1049Ca 0.14 0.20 -0.14 0.00 -1.93 0.00 0.00 57.85 56.12 1lrq n ARG 1049Cb 0.93 -2.34 -0.05 0.00 -1.16 0.00 0.00 32.46 29.83 1lrq n ARG 1049CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1lrq h SER 1050N -0.50 0.72 -2.99 0.55 0.02 -1.98 -3.45 113.55 105.92 1lrq h SER 1050Ca -0.47 -0.51 -0.66 0.00 -0.84 0.00 0.00 61.79 59.31 1lrq h SER 1050Cb 1.32 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 63.56 1lrq h SER 1050CO 0.47 1.09 -0.55 -0.55 -1.14 0.00 0.00 176.83 176.14 1lrq s SER 1051N -6.58 5.87 0.51 3.07 0.15 -1.20 -4.99 113.70 110.53 1lrq s SER 1051Ca -0.12 0.24 0.34 0.00 0.70 0.00 0.00 55.95 57.11 1lrq s SER 1051Cb 0.08 -1.76 1.54 0.00 -1.71 0.00 0.00 66.02 64.18 1lrq s SER 1051CO 0.83 0.31 2.01 -0.29 1.20 0.00 0.00 173.24 177.30 1lrq h ILE 1052N 3.45 0.00 -0.01 6.45 6.09 -1.93 -2.68 117.51 128.88 1lrq h ILE 1052Ca -0.51 -0.31 0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1lrq h ILE 1052Cb 1.19 1.23 0.00 0.00 0.47 0.00 0.00 36.82 39.71 1lrq h ILE 1052CO 0.61 0.00 -0.16 1.41 -3.07 0.00 0.00 178.15 176.95 1lrq n HIS 1053N -2.88 0.00 -2.02 2.19 8.25 -1.26 -4.95 115.22 114.55 1lrq n HIS 1053Ca -0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1lrq n HIS 1053Cb 0.22 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.27 1lrq n HIS 1053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1lrq s SER 1054N -2.29 6.22 0.25 0.41 0.01 -1.01 -5.01 113.70 112.27 1lrq s SER 1054Ca 0.30 1.32 -0.30 0.00 1.31 0.00 0.00 55.95 58.57 1lrq s SER 1054Cb 0.20 -2.42 -0.10 0.00 0.21 0.00 0.00 66.02 63.91 1lrq s SER 1054CO 0.44 -0.82 1.48 0.12 0.41 0.00 0.00 173.24 174.87 1lrq s PHE 1055N -3.10 2.98 -0.10 2.43 5.36 -1.26 -4.93 117.98 119.36 1lrq s PHE 1055Ca 0.54 0.95 -0.03 0.00 -0.96 0.00 0.00 56.93 57.42 1lrq s PHE 1055Cb -0.11 -3.87 -0.05 0.00 -0.34 0.00 0.00 43.02 38.65 1lrq s PHE 1055CO 0.52 -2.88 -0.12 0.54 -1.46 0.00 0.00 175.22 171.82 1lrq n ARG 1056N 2.49 0.23 -2.33 10.12 1.74 -1.26 -4.75 116.66 122.89 1lrq n ARG 1056Ca 0.08 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1lrq n ARG 1056Cb 0.40 -0.98 0.00 0.00 -1.02 0.00 0.00 32.46 30.85 1lrq n ARG 1056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1lrq n GLY 1057N 2.59 -0.79 1.16 -0.13 0.00 -1.26 -0.49 105.19 106.27 1lrq n GLY 1057Ca -0.19 -1.55 0.08 0.00 0.00 0.00 0.00 46.02 44.36 1lrq n GLY 1057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1lrq n HIS 1058N 4.42 1.24 0.00 1.61 8.25 -1.25 -5.04 115.22 124.45 1lrq n HIS 1058Ca 0.00 -0.83 0.00 0.00 -0.26 0.00 0.00 57.72 56.63 1lrq n HIS 1058Cb 0.00 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 30.75 1lrq n HIS 1058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lrq n GLY 1059N -0.18 0.72 0.14 -1.41 0.00 -1.25 -4.39 105.19 98.82 1lrq n GLY 1059Ca 0.23 -1.73 -0.10 0.00 0.00 0.00 0.00 46.02 44.43 1lrq n GLY 1059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lrq h LEU 1060N 0.00 0.35 0.02 0.99 7.12 -1.98 -1.90 115.31 119.90 1lrq h LEU 1060Ca 0.00 -0.08 0.03 0.00 0.13 0.00 0.00 57.88 57.96 1lrq h LEU 1060Cb 0.00 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 40.00 1lrq h LEU 1060CO 0.00 0.33 -0.22 -0.08 -0.13 0.00 0.00 178.44 178.34 1lrq h GLU 1061N 0.34 -0.34 -0.30 1.25 4.81 -1.97 -0.32 114.58 118.06 1lrq h GLU 1061Ca 0.10 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1lrq h GLU 1061Cb 0.05 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1lrq h GLU 1061CO -0.02 -0.23 0.19 -0.92 -0.73 0.00 0.00 179.01 177.31 1lrq h TYR 1062N -0.35 0.39 -0.19 0.92 3.20 -1.76 -2.46 116.97 116.73 1lrq h TYR 1062Ca 0.05 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1lrq h TYR 1062Cb 0.42 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 1lrq h TYR 1062CO -0.25 0.27 0.04 0.78 -1.64 0.00 0.00 178.16 177.35 1lrq h GLY 1063N 0.39 0.20 1.01 1.82 0.00 -1.01 -0.20 103.07 105.29 1lrq h GLY 1063Ca 0.11 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.43 1lrq h GLY 1063CO -0.02 -0.00 0.59 -2.08 0.00 0.00 0.00 176.54 175.03 1lrq h VAL 1064N 0.11 1.24 -0.71 4.60 2.07 -1.01 0.50 116.25 123.05 1lrq h VAL 1064Ca 0.08 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 1lrq h VAL 1064Cb 0.08 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.73 1lrq h VAL 1064CO -0.11 0.23 0.30 0.50 0.02 0.00 0.00 177.57 178.51 1lrq h LYS 1065N 1.24 1.05 -0.48 1.57 3.64 -1.02 0.88 116.57 123.44 1lrq h LYS 1065Ca 0.33 -0.18 -0.12 0.00 -1.27 0.00 0.00 60.65 59.41 1lrq h LYS 1065Cb -0.12 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.51 1lrq h LYS 1065CO -0.07 0.86 -0.17 0.00 -2.27 0.00 0.00 179.45 177.80 1lrq h ALA 1066N 1.14 0.67 -0.45 5.00 0.00 -0.39 -2.11 119.26 123.11 1lrq h ALA 1066Ca 0.24 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1lrq h ALA 1066Cb 0.19 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1lrq h ALA 1066CO -0.02 0.62 -0.15 -0.07 0.00 0.00 0.00 179.25 179.63 1lrq h LEU 1067N 0.81 0.85 -1.16 0.00 3.38 -0.62 -2.55 115.31 116.01 1lrq h LEU 1067Ca 0.12 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1lrq h LEU 1067Cb 0.73 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1lrq h LEU 1067CO 0.06 1.00 -0.08 -0.09 0.09 0.00 0.00 178.44 179.42 1lrq h ARG 1068N 0.76 0.49 -0.67 1.13 2.43 -0.68 -1.63 114.38 116.21 1lrq h ARG 1068Ca 0.12 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 1lrq h ARG 1068Cb 0.66 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1lrq h ARG 1068CO 0.05 0.58 0.15 -0.22 -1.51 0.00 0.00 179.97 179.01 1lrq h LYS 1069N 0.46 1.08 -0.22 0.20 1.63 -1.04 0.11 116.57 118.79 1lrq h LYS 1069Ca 0.09 -0.27 -0.01 0.00 -0.85 0.00 0.00 60.65 59.62 1lrq h LYS 1069Cb 0.42 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 1lrq h LYS 1069CO 0.02 0.97 0.10 0.28 -3.45 0.00 0.00 179.45 177.37 1lrq h VAL 1070N 1.00 1.14 -0.81 2.00 2.07 -1.04 0.15 116.25 120.76 1lrq h VAL 1070Ca 0.21 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1lrq h VAL 1070Cb 0.38 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 1lrq h VAL 1070CO 0.00 0.14 0.37 0.50 0.02 0.00 0.00 177.57 178.60 1lrq h LYS 1071N 0.22 1.18 -0.20 1.57 3.64 -1.04 -0.65 116.57 121.29 1lrq h LYS 1071Ca 0.08 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.19 1lrq h LYS 1071Cb 0.13 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1lrq h LYS 1071CO -0.01 0.93 -0.18 1.49 -2.27 0.00 0.00 179.45 179.41 1lrq h GLU 1072N 1.16 0.48 -0.12 1.90 4.81 -0.55 0.22 114.58 122.47 1lrq h GLU 1072Ca 0.28 -0.24 -0.20 0.00 -0.13 0.00 0.00 59.36 59.06 1lrq h GLU 1072Cb 0.15 0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.55 1lrq h GLU 1072CO -0.03 0.81 -0.70 1.49 -0.73 0.00 0.00 179.01 179.85 1lrq h GLU 1073N 0.15 0.69 0.00 1.92 4.81 -0.64 -3.37 114.58 118.14 1lrq h GLU 1073Ca 0.03 -0.58 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1lrq h GLU 1073Cb 0.72 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.23 1lrq h GLU 1073CO 0.05 1.19 -0.65 1.19 -0.73 0.00 0.00 179.01 180.05 1lrq n PHE 1074N -4.04 0.00 -2.58 0.92 3.72 -0.26 -5.01 117.46 110.21 1lrq n PHE 1074Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.19 1lrq n PHE 1074Cb 0.71 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 39.25 1lrq n PHE 1074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lrq n GLY 1075N 1.32 -0.09 3.90 1.37 0.00 0.78 -4.99 105.19 107.49 1lrq n GLY 1075Ca 0.02 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1lrq n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lrq s LEU 1076N -4.11 4.35 0.66 0.99 1.43 -1.24 -5.04 118.68 115.73 1lrq s LEU 1076Ca 0.13 0.43 -0.15 0.00 -1.03 0.00 0.00 54.13 53.51 1lrq s LEU 1076Cb -0.06 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.36 1lrq s LEU 1076CO 0.16 0.21 1.12 -0.54 0.23 0.00 0.00 176.35 177.53 1lrq s LYS 1077N -2.10 2.75 0.06 1.70 1.02 -1.26 -4.43 119.74 117.49 1lrq s LYS 1077Ca 0.31 1.42 0.08 0.00 0.02 0.00 0.00 55.97 57.80 1lrq s LYS 1077Cb -0.13 -1.94 -0.03 0.00 -0.52 0.00 0.00 37.83 35.21 1lrq s LYS 1077CO 0.21 -1.29 -0.21 0.42 -0.92 0.00 0.00 175.35 173.55 1lrq s ILE 1078N -2.30 1.68 -0.05 2.17 -1.09 -1.26 -0.82 121.20 119.53 1lrq s ILE 1078Ca 0.68 -1.30 -0.06 0.00 -2.23 0.00 0.00 60.65 57.75 1lrq s ILE 1078Cb -0.21 -1.48 0.01 0.00 -1.58 0.00 0.00 42.46 39.20 1lrq s ILE 1078CO 0.42 0.13 0.15 0.28 -1.23 0.00 0.00 174.94 174.69 1lrq s THR 1079N -0.90 0.01 0.15 2.92 -1.32 -0.43 0.22 115.64 116.29 1lrq s THR 1079Ca 0.07 -0.12 -0.17 0.00 -1.21 0.00 0.00 61.69 60.26 1lrq s THR 1079Cb -0.09 -0.25 0.04 0.00 -1.51 0.00 0.00 72.50 70.68 1lrq s THR 1079CO 0.02 -0.06 0.45 0.28 -2.21 0.00 0.00 174.62 173.10 1lrq s THR 1080N -0.16 0.05 0.09 5.08 -1.32 -1.21 -3.00 115.64 115.17 1lrq s THR 1080Ca -0.02 -0.57 0.01 0.00 -1.21 0.00 0.00 61.69 59.89 1lrq s THR 1080Cb -0.02 -1.26 -0.04 0.00 -1.51 0.00 0.00 72.50 69.67 1lrq s THR 1080CO 0.00 -0.23 0.23 1.51 -2.21 0.00 0.00 174.62 173.92 1lrq s ASP 1081N -2.82 6.32 0.18 8.08 -4.77 -1.26 -1.28 116.67 121.13 1lrq s ASP 1081Ca 0.04 0.23 0.08 0.00 -3.30 0.00 0.00 52.55 49.60 1lrq s ASP 1081Cb 0.01 -1.93 -0.04 0.00 -1.09 0.00 0.00 42.92 39.87 1lrq s ASP 1081CO -0.10 0.13 -0.05 0.27 0.70 0.00 0.00 175.17 176.13 1lrq s ILE 1082N -1.58 3.44 0.00 2.11 -4.36 -0.89 -4.81 121.20 115.11 1lrq s ILE 1082Ca 0.35 -1.57 0.00 0.00 -0.26 0.00 0.00 60.65 59.16 1lrq s ILE 1082Cb -0.12 -2.72 0.00 0.00 1.25 0.00 0.00 42.46 40.86 1lrq s ILE 1082CO 0.28 -0.13 0.00 1.41 0.24 0.00 0.00 174.94 176.74 1lrq n HIS 1083N -0.09 0.00 -3.99 1.37 8.25 -1.26 -4.36 115.22 115.13 1lrq n HIS 1083Ca -0.10 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.27 1lrq n HIS 1083Cb 0.56 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.56 1lrq n HIS 1083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1lrq s GLU 1084N -1.84 0.37 0.30 -0.41 2.02 -1.26 -5.07 118.70 112.81 1lrq s GLU 1084Ca 0.00 -0.70 0.05 0.00 0.02 0.00 0.00 54.97 54.35 1lrq s GLU 1084Cb 0.00 0.13 0.78 0.00 0.10 0.00 0.00 34.13 35.14 1lrq s GLU 1084CO 0.00 -0.06 1.69 0.77 0.02 0.00 0.00 175.26 177.68 1lrq h SER 1085N 4.39 0.37 0.24 -0.19 0.02 -1.91 -1.91 113.55 114.55 1lrq h SER 1085Ca -0.32 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1lrq h SER 1085Cb 1.20 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1lrq h SER 1085CO 0.45 -0.01 0.00 4.11 -1.14 0.00 0.00 176.83 180.24 1lrq h TRP 1086N 0.40 0.00 0.00 3.45 5.08 -1.97 -2.67 115.95 120.25 1lrq h TRP 1086Ca 0.59 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.56 1lrq h TRP 1086Cb 1.15 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.31 1lrq h TRP 1086CO -0.12 0.00 -0.04 1.96 -1.28 0.00 0.00 178.44 178.97 1lrq h GLN 1087N 0.00 0.00 -0.26 0.12 4.20 -1.78 -3.36 115.11 114.03 1lrq h GLN 1087Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.74 1lrq h GLN 1087Cb 0.12 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.87 1lrq h GLN 1087CO 0.00 0.00 0.09 0.00 -0.67 0.00 0.00 178.83 178.25 1lrq h ALA 1088N 2.31 0.30 0.80 3.87 0.00 -1.64 -2.14 119.26 122.75 1lrq h ALA 1088Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1lrq h ALA 1088Cb 0.85 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1lrq h ALA 1088CO 0.00 -0.32 -0.47 1.49 0.00 0.00 0.00 179.25 179.95 1lrq h GLU 1089N 0.21 -1.14 -0.88 0.00 4.81 -1.79 0.28 114.58 116.07 1lrq h GLU 1089Ca 0.12 0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1lrq h GLU 1089Cb 0.08 0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1lrq h GLU 1089CO -0.12 -0.76 0.58 -1.00 -0.73 0.00 0.00 179.01 176.98 1lrq h PRO 1090N -1.18 1.15 -0.36 0.92 0.13 -1.77 -2.60 132.00 128.28 1lrq h PRO 1090Ca -0.11 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 64.87 1lrq h PRO 1090Cb 0.94 -0.26 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 1lrq h PRO 1090CO 0.12 0.76 -0.13 0.28 -0.23 0.00 0.00 178.00 178.80 1lrq h VAL 1091N 1.18 1.25 0.00 1.56 2.07 -1.29 -2.60 116.25 118.42 1lrq h VAL 1091Ca 0.32 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.72 1lrq h VAL 1091Cb -0.12 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1lrq h VAL 1091CO -0.07 0.38 0.00 0.00 0.02 0.00 0.00 177.57 177.89 1lrq n ALA 1092N -2.48 1.22 0.24 1.67 0.00 0.08 -1.00 120.51 120.23 1lrq n ALA 1092Ca 0.01 0.17 0.11 0.00 0.00 0.00 0.00 53.44 53.74 1lrq n ALA 1092Cb 0.35 -1.34 0.56 0.00 0.00 0.00 0.00 19.45 19.02 1lrq n ALA 1092CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1lrq h GLU 1093N 0.00 0.00 0.00 0.00 5.08 -1.47 -3.35 114.58 114.84 1lrq h GLU 1093Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lrq h GLU 1093Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1lrq h GLU 1093CO 0.00 0.18 -0.85 1.55 -1.00 0.00 0.00 179.01 178.89 1lrq n VAL 1094N -3.42 0.00 -2.59 3.13 3.14 -0.72 -5.04 118.33 112.83 1lrq n VAL 1094Ca -0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.95 1lrq n VAL 1094Cb 0.37 -0.75 -0.02 0.00 -1.06 0.00 0.00 33.84 32.38 1lrq n VAL 1094CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1lrq s ALA 1095N -1.85 3.48 0.12 1.55 0.00 -0.18 -4.54 121.76 120.35 1lrq s ALA 1095Ca 0.00 0.44 0.07 0.00 0.00 0.00 0.00 51.96 52.47 1lrq s ALA 1095Cb 0.00 -3.49 -0.17 0.00 0.00 0.00 0.00 23.12 19.46 1lrq s ALA 1095CO 0.00 -0.74 1.30 -0.44 0.00 0.00 0.00 175.76 175.88 1lrq h ASP 1096N 7.32 0.00 -3.30 0.00 3.32 -0.56 -3.44 116.42 119.76 1lrq h ASP 1096Ca -0.30 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.26 1lrq h ASP 1096Cb 1.14 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.33 1lrq h ASP 1096CO 0.88 0.97 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.95 1lrq s ILE 1097N -2.77 0.86 -0.22 0.35 1.01 -0.84 -2.14 121.20 117.46 1lrq s ILE 1097Ca 0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 1lrq s ILE 1097Cb 0.10 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 1lrq s ILE 1097CO 0.82 0.32 0.39 -0.63 0.00 0.00 0.00 174.94 175.84 1lrq s ILE 1098N 1.36 5.19 -0.08 2.92 1.01 0.66 -3.33 121.20 128.94 1lrq s ILE 1098Ca -0.03 0.67 -0.15 0.00 0.00 0.00 0.00 60.65 61.15 1lrq s ILE 1098Cb -0.14 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 1lrq s ILE 1098CO -0.03 0.22 0.39 -1.58 0.00 0.00 0.00 174.94 173.93 1lrq s GLN 1099N 1.53 4.10 -0.27 2.79 0.74 -0.41 -0.98 119.66 127.16 1lrq s GLN 1099Ca 0.18 0.32 -0.08 0.00 0.05 0.00 0.00 55.36 55.83 1lrq s GLN 1099Cb -0.15 -3.33 -0.02 0.00 1.10 0.00 0.00 33.01 30.61 1lrq s GLN 1099CO 0.08 0.43 0.09 0.42 -0.55 0.00 0.00 175.29 175.76 1lrq s ILE 1100N -0.19 4.33 0.55 -2.34 -1.09 0.16 -2.10 121.20 120.52 1lrq s ILE 1100Ca 0.22 -0.30 -0.20 0.00 -2.23 0.00 0.00 60.65 58.13 1lrq s ILE 1100Cb -0.15 -3.10 -0.06 0.00 -1.58 0.00 0.00 42.46 37.57 1lrq s ILE 1100CO 0.10 0.24 1.03 -2.65 -1.23 0.00 0.00 174.94 172.42 1lrq n PRO 1101N 4.93 1.13 -0.19 2.79 -0.02 -1.26 -1.49 135.00 140.89 1lrq n PRO 1101Ca -0.15 0.42 -0.01 0.00 -2.02 0.00 0.00 63.50 61.74 1lrq n PRO 1101Cb 0.50 -2.20 0.10 0.00 -0.02 0.00 0.00 33.50 31.88 1lrq n PRO 1101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lrq h ALA 1102N 0.89 0.75 0.00 3.55 0.00 -1.89 -0.96 119.26 121.60 1lrq h ALA 1102Ca -0.48 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1lrq h ALA 1102Cb 1.35 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1lrq h ALA 1102CO 0.53 -0.18 -0.01 0.74 0.00 0.00 0.00 179.25 180.33 1lrq h PHE 1103N 0.41 0.00 -0.58 0.00 0.04 -1.91 -2.91 116.94 111.99 1lrq h PHE 1103Ca 0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.06 1lrq h PHE 1103Cb 0.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.49 1lrq h PHE 1103CO -0.16 0.01 0.00 1.28 -0.60 0.00 0.00 178.31 178.84 1lrq n LEU 1104N -3.12 3.58 0.07 1.54 4.77 -0.40 -4.62 117.00 118.82 1lrq n LEU 1104Ca -0.01 -1.97 0.05 0.00 -0.03 0.00 0.00 56.01 54.06 1lrq n LEU 1104Cb 0.22 -0.39 0.28 0.00 -2.33 0.00 0.00 43.42 41.20 1lrq n LEU 1104CO 0.25 0.89 0.66 0.00 -1.33 0.00 0.00 177.39 177.86 1lrq n ARG 1106N -1.85 0.98 -2.45 0.00 1.74 -1.26 -4.91 116.66 108.92 1lrq n ARG 1106Ca -0.00 -1.35 -0.39 0.00 -0.77 0.00 0.00 57.85 55.34 1lrq n ARG 1106Cb 0.03 -1.24 -0.03 0.00 -1.02 0.00 0.00 32.46 30.20 1lrq n ARG 1106CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1lrq s GLN 1107N -1.02 3.20 0.21 5.56 -1.52 -0.61 -4.90 119.66 120.58 1lrq s GLN 1107Ca 0.16 -0.43 -0.15 0.00 -1.95 0.00 0.00 55.36 52.98 1lrq s GLN 1107Cb 0.11 -4.67 0.23 0.00 -0.22 0.00 0.00 33.01 28.45 1lrq s GLN 1107CO 0.16 -2.35 1.60 1.15 -0.25 0.00 0.00 175.29 175.60 1lrq h THR 1108N 6.50 0.25 -0.50 -0.19 2.02 -1.91 -1.69 112.91 117.39 1lrq h THR 1108Ca -0.09 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1lrq h THR 1108Cb 1.05 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1lrq h THR 1108CO 1.32 0.00 0.22 0.44 0.37 0.00 0.00 175.52 177.87 1lrq h ASP 1109N -0.06 0.63 -0.29 4.18 3.32 -1.99 -0.18 116.42 122.03 1lrq h ASP 1109Ca 0.30 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 1lrq h ASP 1109Cb 0.53 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1lrq h ASP 1109CO -0.71 0.55 -0.11 0.25 -1.72 0.00 0.00 179.24 177.50 1lrq h LEU 1110N 0.70 0.60 -0.50 1.55 5.85 -1.71 0.26 115.31 122.06 1lrq h LEU 1110Ca 0.17 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1lrq h LEU 1110Cb 0.10 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1lrq h LEU 1110CO -0.02 0.85 0.24 -0.07 -0.34 0.00 0.00 178.44 179.10 1lrq h LEU 1111N 0.34 0.66 -0.72 2.25 3.38 -1.07 -2.05 115.31 118.10 1lrq h LEU 1111Ca 0.07 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1lrq h LEU 1111Cb 0.61 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1lrq h LEU 1111CO 0.04 0.61 0.27 -0.07 0.09 0.00 0.00 178.44 179.38 1lrq h LEU 1112N 0.67 1.01 -0.64 1.67 4.07 -0.92 -1.09 115.31 120.09 1lrq h LEU 1112Ca 0.17 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1lrq h LEU 1112Cb 0.12 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.57 1lrq h LEU 1112CO -0.02 0.92 0.40 0.00 -1.08 0.00 0.00 178.44 178.66 1lrq h ALA 1113N 1.13 0.81 -0.33 1.53 0.00 -0.66 -2.29 119.26 119.45 1lrq h ALA 1113Ca 0.24 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 1lrq h ALA 1113Cb 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1lrq h ALA 1113CO -0.02 0.27 -0.19 0.00 0.00 0.00 0.00 179.25 179.31 1lrq h ALA 1114N 1.21 0.47 -0.63 0.00 0.00 -1.17 -3.26 119.26 115.89 1lrq h ALA 1114Ca 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1lrq h ALA 1114Cb -0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1lrq h ALA 1114CO -0.05 0.41 0.36 0.00 0.00 0.00 0.00 179.25 179.98 1lrq h ALA 1115N 0.76 1.45 0.00 0.00 0.00 -0.95 -2.80 119.26 117.72 1lrq h ALA 1115Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1lrq h ALA 1115Cb 0.74 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1lrq h ALA 1115CO 0.06 0.46 0.00 0.36 0.00 0.00 0.00 179.25 180.13 1lrq n LYS 1116N -4.39 0.38 0.21 0.00 2.85 -0.88 -3.00 118.16 113.31 1lrq n LYS 1116Ca 0.06 0.04 0.13 0.00 -1.05 0.00 0.00 58.31 57.50 1lrq n LYS 1116Cb 0.09 -1.50 0.33 0.00 -0.65 0.00 0.00 35.03 33.30 1lrq n LYS 1116CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1lrq h THR 1117N 0.00 0.00 0.00 0.58 1.35 -1.60 -3.47 112.91 109.78 1lrq h THR 1117Ca 0.00 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1lrq h THR 1117Cb 0.23 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1lrq h THR 1117CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1lrq n GLY 1118N 0.86 1.26 3.90 5.82 0.00 -1.16 -5.04 105.19 110.83 1lrq n GLY 1118Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1lrq n GLY 1118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lrq s ARG 1119N -0.35 3.10 0.62 1.61 1.81 -1.26 -4.92 118.95 119.56 1lrq s ARG 1119Ca 0.00 0.25 -0.16 0.00 -1.72 0.00 0.00 55.73 54.11 1lrq s ARG 1119Cb 0.00 -2.20 -0.02 0.00 -0.45 0.00 0.00 34.95 32.28 1lrq s ARG 1119CO 0.00 -0.69 1.09 0.00 -0.68 0.00 0.00 175.30 175.02 1lrq s ALA 1120N -3.07 2.62 -0.07 2.13 0.00 -0.91 -4.76 121.76 117.69 1lrq s ALA 1120Ca 0.54 0.50 0.02 0.00 0.00 0.00 0.00 51.96 53.02 1lrq s ALA 1120Cb -0.11 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.75 1lrq s ALA 1120CO 0.48 -1.01 -0.10 0.08 0.00 0.00 0.00 175.76 175.21 1lrq s VAL 1121N -2.33 1.04 -0.24 0.00 1.01 -0.47 -0.24 120.40 119.16 1lrq s VAL 1121Ca 0.66 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1lrq s VAL 1121Cb -0.19 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.25 1lrq s VAL 1121CO 0.38 0.34 -0.09 0.21 0.00 0.00 0.00 175.10 175.94 1lrq s ASN 1122N 0.89 4.18 -0.27 3.32 2.47 -0.16 -0.68 114.94 124.69 1lrq s ASN 1122Ca -0.11 -0.92 -0.12 0.00 0.42 0.00 0.00 52.86 52.14 1lrq s ASN 1122Cb -0.15 -1.62 -0.05 0.00 -1.45 0.00 0.00 41.25 37.98 1lrq s ASN 1122CO 0.01 -0.12 0.22 -0.69 -3.72 0.00 0.00 177.10 172.80 1lrq s VAL 1123N 1.29 5.29 -0.02 -5.21 1.01 -0.15 -0.67 120.40 121.94 1lrq s VAL 1123Ca -0.01 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1lrq s VAL 1123Cb -0.17 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1lrq s VAL 1123CO -0.06 0.25 1.22 -0.54 0.00 0.00 0.00 175.10 175.97 1lrq s LYS 1124N 1.73 4.36 -0.04 2.72 -0.14 -0.56 -0.47 119.74 127.35 1lrq s LYS 1124Ca 0.08 1.73 -0.30 0.00 -1.36 0.00 0.00 55.97 56.12 1lrq s LYS 1124Cb -0.16 -3.51 -0.06 0.00 -1.68 0.00 0.00 37.83 32.43 1lrq s LYS 1124CO 0.10 -0.42 1.59 0.21 -0.76 0.00 0.00 175.35 176.07 1lrq s LYS 1125N 1.97 4.20 0.38 1.68 2.20 0.36 -3.92 119.74 126.61 1lrq s LYS 1125Ca 0.57 2.14 -0.26 0.00 -0.36 0.00 0.00 55.97 58.06 1lrq s LYS 1125Cb -0.26 -3.85 -0.11 0.00 -1.51 0.00 0.00 37.83 32.09 1lrq s LYS 1125CO 0.24 -0.78 1.17 0.41 -0.36 0.00 0.00 175.35 176.04 1lrq n GLY 1126N 4.00 0.25 0.07 5.54 0.00 -1.23 -4.56 105.19 109.26 1lrq n GLY 1126Ca 0.16 0.23 0.06 0.00 0.00 0.00 0.00 46.02 46.47 1lrq n GLY 1126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1lrq n GLN 1127N 0.30 0.07 0.00 1.61 3.00 -1.26 -1.39 117.38 119.70 1lrq n GLN 1127Ca 0.07 0.50 0.10 0.00 -0.01 0.00 0.00 57.00 57.66 1lrq n GLN 1127Cb 0.37 -1.70 -0.04 0.00 0.00 0.00 0.00 30.24 28.87 1lrq n GLN 1127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1lrq n PHE 1128N -1.85 0.00 -3.34 1.08 -1.74 -1.26 -1.71 117.46 108.64 1lrq n PHE 1128Ca 0.00 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.51 1lrq n PHE 1128Cb 0.06 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.00 1lrq n PHE 1128CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1lrq s LEU 1129N -2.59 4.47 0.37 5.98 2.96 -0.49 -5.07 118.68 124.32 1lrq s LEU 1129Ca 0.14 1.11 -0.14 0.00 -0.22 0.00 0.00 54.13 55.02 1lrq s LEU 1129Cb 0.16 -2.78 -0.08 0.00 0.50 0.00 0.00 46.19 43.99 1lrq s LEU 1129CO 0.64 0.24 0.77 0.00 -1.32 0.00 0.00 176.35 176.68 1lrq s ALA 1130N -0.80 3.30 0.23 5.97 0.00 -1.26 -4.90 121.76 124.30 1lrq s ALA 1130Ca 0.27 -0.02 -0.07 0.00 0.00 0.00 0.00 51.96 52.13 1lrq s ALA 1130Cb -0.18 -2.78 0.37 0.00 0.00 0.00 0.00 23.12 20.53 1lrq s ALA 1130CO 0.16 0.17 1.71 -1.35 0.00 0.00 0.00 175.76 176.45 1lrq h PRO 1131N 1.80 0.32 0.00 0.00 0.11 -1.98 -0.94 132.00 131.30 1lrq h PRO 1131Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1lrq h PRO 1131Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1lrq h PRO 1131CO 0.64 0.21 0.00 0.11 -0.21 0.00 0.00 178.00 178.75 1lrq h TRP 1132N 0.33 0.00 -0.14 0.65 0.09 -1.94 -2.64 115.95 112.30 1lrq h TRP 1132Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.34 1lrq h TRP 1132Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.78 1lrq h TRP 1132CO -0.22 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.06 1lrq n ASP 1133N -2.38 1.19 -0.00 0.11 8.00 -0.36 -3.19 116.55 119.92 1lrq n ASP 1133Ca 0.01 -1.69 0.13 0.00 0.71 0.00 0.00 54.79 53.95 1lrq n ASP 1133Cb 0.19 -0.09 0.40 0.00 -0.02 0.00 0.00 41.12 41.60 1lrq n ASP 1133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1lrq n THR 1134N 0.03 0.00 -0.23 -3.53 -2.24 -1.00 -3.81 114.28 103.51 1lrq n THR 1134Ca 0.14 -0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.87 1lrq n THR 1134Cb 0.24 -0.04 0.05 0.00 -2.10 0.00 0.00 70.33 68.49 1lrq n THR 1134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1lrq h LYS 1135N 0.02 0.81 0.00 -0.78 3.64 -1.76 -1.67 116.57 116.83 1lrq h LYS 1135Ca 0.00 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1lrq h LYS 1135Cb 0.50 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1lrq h LYS 1135CO 0.00 0.54 -0.31 -0.91 -2.27 0.00 0.00 179.45 176.50 1lrq h ASN 1136N 0.84 0.00 -0.33 4.20 2.35 -1.83 -1.63 115.58 119.18 1lrq h ASN 1136Ca 0.24 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.94 1lrq h ASN 1136Cb -0.06 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1lrq h ASN 1136CO -0.07 0.31 -0.02 0.58 -1.65 0.00 0.00 177.43 176.58 1lrq h VAL 1137N 0.00 1.26 -0.47 2.81 2.07 -1.49 -1.37 116.25 119.06 1lrq h VAL 1137Ca -0.00 -1.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.43 1lrq h VAL 1137Cb 0.76 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1lrq h VAL 1137CO 0.04 0.33 -0.07 0.58 0.02 0.00 0.00 177.57 178.46 1lrq h VAL 1138N 0.39 1.26 -0.51 2.57 2.07 -1.10 -2.58 116.25 118.35 1lrq h VAL 1138Ca 0.09 -1.14 -0.00 0.00 0.82 0.00 0.00 66.70 66.47 1lrq h VAL 1138Cb 0.48 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1lrq h VAL 1138CO 0.02 0.40 0.32 -0.08 0.02 0.00 0.00 177.57 178.24 1lrq h GLU 1139N 0.76 0.68 -0.43 1.57 4.81 -1.06 -0.23 114.58 120.68 1lrq h GLU 1139Ca 0.13 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1lrq h GLU 1139Cb 0.56 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1lrq h GLU 1139CO 0.03 0.48 0.24 0.87 -0.73 0.00 0.00 179.01 179.91 1lrq h LYS 1140N 0.68 0.47 -0.46 1.92 1.57 -1.05 -0.25 116.57 119.46 1lrq h LYS 1140Ca 0.18 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 1lrq h LYS 1140Cb -0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1lrq h LYS 1140CO -0.04 0.31 0.18 -0.07 -0.57 0.00 0.00 179.45 179.26 1lrq h LEU 1141N 0.48 0.64 -0.80 2.94 3.38 -1.07 -0.81 115.31 120.08 1lrq h LEU 1141Ca 0.18 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1lrq h LEU 1141Cb 0.04 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1lrq h LEU 1141CO -0.10 0.63 0.41 0.11 0.09 0.00 0.00 178.44 179.59 1lrq h LYS 1142N 0.60 1.13 -0.56 1.13 1.57 -0.79 -0.58 116.57 119.08 1lrq h LYS 1142Ca 0.15 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1lrq h LYS 1142Cb 0.20 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 1lrq h LYS 1142CO -0.01 0.85 0.35 0.35 -0.57 0.00 0.00 179.45 180.43 1lrq h PHE 1143N 1.12 0.71 -0.01 -1.35 3.57 -0.76 -1.77 116.94 118.45 1lrq h PHE 1143Ca 0.28 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1lrq h PHE 1143Cb 0.07 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.57 1lrq h PHE 1143CO 0.01 0.46 0.00 0.41 -2.23 0.00 0.00 178.31 176.96 1lrq n GLY 1144N -1.41 -0.69 0.00 2.40 0.00 -0.33 -4.91 105.19 100.24 1lrq n GLY 1144Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1lrq n GLY 1144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lrq n GLY 1145N 1.01 0.52 3.71 -0.02 0.00 -0.66 -3.18 105.19 106.58 1lrq n GLY 1145Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1lrq n GLY 1145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lrq s ALA 1146N -2.00 3.60 -0.11 4.61 0.00 -0.33 -4.86 121.76 122.67 1lrq s ALA 1146Ca 0.00 1.12 0.12 0.00 0.00 0.00 0.00 51.96 53.20 1lrq s ALA 1146Cb 0.00 -3.55 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 1lrq s ALA 1146CO 0.00 -0.66 0.31 1.63 0.00 0.00 0.00 175.76 177.04 1lrq n LYS 1147N 4.10 0.82 -3.89 0.00 5.02 -1.26 -4.37 118.16 118.58 1lrq n LYS 1147Ca 0.12 -0.09 -0.30 0.00 -2.02 0.00 0.00 58.31 56.01 1lrq n LYS 1147Cb 0.42 -1.26 -0.15 0.00 -0.02 0.00 0.00 35.03 34.02 1lrq n LYS 1147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1lrq s GLU 1148N -2.74 1.31 -0.05 1.97 2.12 -1.26 -5.11 118.70 114.94 1lrq s GLU 1148Ca -0.03 -1.12 0.07 0.00 0.36 0.00 0.00 54.97 54.24 1lrq s GLU 1148Cb 0.08 -2.52 -0.01 0.00 0.26 0.00 0.00 34.13 31.94 1lrq s GLU 1148CO 0.51 -0.75 -0.25 0.42 -0.54 0.00 0.00 175.26 174.64 1lrq s ILE 1149N 1.40 2.04 0.08 -3.70 1.01 -1.26 -1.37 121.20 119.40 1lrq s ILE 1149Ca 0.01 -1.07 0.08 0.00 0.00 0.00 0.00 60.65 59.67 1lrq s ILE 1149Cb -0.18 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1lrq s ILE 1149CO -0.11 0.57 -0.21 -0.31 0.00 0.00 0.00 174.94 174.88 1lrq s TYR 1150N -0.26 1.80 -0.10 3.97 1.51 0.15 -3.01 117.35 121.40 1lrq s TYR 1150Ca -0.01 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.68 1lrq s TYR 1150Cb -0.13 -1.01 0.01 0.00 -0.11 0.00 0.00 41.96 40.71 1lrq s TYR 1150CO 0.03 0.17 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.91 1lrq s LEU 1151N -1.65 1.99 -0.20 -1.29 1.43 -0.62 -0.98 118.68 117.37 1lrq s LEU 1151Ca 0.07 -0.52 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 1lrq s LEU 1151Cb -0.10 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 1lrq s LEU 1151CO 0.03 0.11 -0.02 -0.89 0.23 0.00 0.00 176.35 175.81 1lrq s THR 1152N 0.57 3.70 -0.14 5.49 2.01 0.38 -1.04 115.64 126.61 1lrq s THR 1152Ca -0.14 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.17 1lrq s THR 1152Cb -0.17 -2.67 -0.01 0.00 0.01 0.00 0.00 72.50 69.67 1lrq s THR 1152CO 0.05 0.43 1.03 -0.70 -0.69 0.00 0.00 174.62 174.74 1lrq s GLU 1153N 1.09 4.37 -0.03 4.92 2.56 0.17 -0.49 118.70 131.28 1lrq s GLU 1153Ca 0.02 1.40 0.14 0.00 0.00 0.00 0.00 54.97 56.53 1lrq s GLU 1153Cb -0.15 -3.58 0.25 0.00 2.00 0.00 0.00 34.13 32.66 1lrq s GLU 1153CO 0.01 -0.42 1.11 2.89 -0.56 0.00 0.00 175.26 178.28 1lrq n ARG 1154N 5.43 0.24 0.00 4.30 -4.01 -1.26 -0.93 116.66 120.42 1lrq n ARG 1154Ca 0.10 -1.76 0.00 0.00 -1.04 0.00 0.00 57.85 55.15 1lrq n ARG 1154Cb 0.48 -0.46 0.00 0.00 -3.04 0.00 0.00 32.46 29.44 1lrq n ARG 1154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1lrq n GLY 1155N 0.01 1.53 3.08 2.89 0.00 -1.26 -3.83 105.19 107.61 1lrq n GLY 1155Ca 0.06 -1.87 -0.19 0.00 0.00 0.00 0.00 46.02 44.02 1lrq n GLY 1155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lrq s THR 1156N -2.79 0.88 -0.07 2.61 2.01 0.32 -4.35 115.64 114.25 1lrq s THR 1156Ca 0.00 -0.69 -0.36 0.00 0.31 0.00 0.00 61.69 60.95 1lrq s THR 1156Cb 0.00 -0.78 -0.14 0.00 0.01 0.00 0.00 72.50 71.59 1lrq s THR 1156CO 0.00 0.09 1.72 0.41 -0.69 0.00 0.00 174.62 176.15 1lrq n THR 1157N 2.37 0.33 -3.65 -0.82 -1.04 -0.69 -1.26 114.28 109.52 1lrq n THR 1157Ca -0.16 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.05 61.50 1lrq n THR 1157Cb 0.56 -1.51 -0.13 0.00 -1.82 0.00 0.00 70.33 67.42 1lrq n THR 1157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1lrq s PHE 1158N 2.91 1.58 0.00 -1.42 5.36 -0.82 -4.85 117.98 120.75 1lrq s PHE 1158Ca 0.91 -2.09 0.00 0.00 -0.96 0.00 0.00 56.93 54.78 1lrq s PHE 1158Cb -0.82 -1.59 0.00 0.00 -0.34 0.00 0.00 43.02 40.27 1lrq s PHE 1158CO 0.52 -0.81 0.00 0.41 -1.46 0.00 0.00 175.22 173.88 1lrq n GLY 1159N 3.88 -0.77 3.83 13.12 0.00 -1.26 -4.28 105.19 119.71 1lrq n GLY 1159Ca 0.08 -1.14 -0.38 0.00 0.00 0.00 0.00 46.02 44.58 1lrq n GLY 1159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lrq s TYR 1160N 0.00 3.74 -1.41 1.61 2.02 -1.26 -4.34 117.35 117.72 1lrq s TYR 1160Ca 0.00 1.14 -0.11 0.00 -0.37 0.00 0.00 57.07 57.73 1lrq s TYR 1160Cb 0.00 -2.40 0.08 0.00 -0.40 0.00 0.00 41.96 39.23 1lrq s TYR 1160CO 0.00 0.58 0.63 0.09 -1.57 0.00 0.00 175.55 175.28 1lrq n ASN 1161N 1.56 -4.19 -3.74 2.29 3.02 -1.26 -4.95 115.26 107.99 1lrq n ASN 1161Ca -0.10 -0.51 -0.14 0.00 -0.03 0.00 0.00 54.58 53.80 1lrq n ASN 1161Cb 0.51 -3.43 -0.09 0.00 -0.61 0.00 0.00 39.78 36.17 1lrq n ASN 1161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1lrq s ASN 1162N -2.89 -0.26 0.08 6.41 3.04 -1.26 -4.15 114.94 115.91 1lrq s ASN 1162Ca 0.48 0.25 0.07 0.00 0.04 0.00 0.00 52.86 53.70 1lrq s ASN 1162Cb -0.25 0.41 -0.03 0.00 -1.54 0.00 0.00 41.25 39.85 1lrq s ASN 1162CO 0.59 -0.40 -0.19 -0.76 -3.04 0.00 0.00 177.10 173.29 1lrq s LEU 1163N -1.04 2.25 0.07 3.21 1.43 -1.26 -1.94 118.68 121.41 1lrq s LEU 1163Ca -0.11 -0.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.44 1lrq s LEU 1163Cb -0.04 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 1lrq s LEU 1163CO 0.04 0.06 -0.19 0.54 0.23 0.00 0.00 176.35 177.03 1lrq s VAL 1164N -1.07 1.50 -0.31 -1.59 0.11 -0.39 -4.86 120.40 113.80 1lrq s VAL 1164Ca 0.05 -1.33 -0.09 0.00 -2.93 0.00 0.00 61.98 57.67 1lrq s VAL 1164Cb -0.10 -1.36 -0.00 0.00 -1.53 0.00 0.00 36.38 33.39 1lrq s VAL 1164CO 0.03 -0.02 0.14 -0.69 -3.33 0.00 0.00 175.10 171.23 1lrq s VAL 1165N -1.05 4.46 -0.70 2.04 1.01 -1.26 -0.52 120.40 124.38 1lrq s VAL 1165Ca 0.04 -0.51 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 1lrq s VAL 1165Cb -0.09 -3.29 0.12 0.00 0.00 0.00 0.00 36.38 33.12 1lrq s VAL 1165CO 0.03 0.05 0.82 -0.62 0.00 0.00 0.00 175.10 175.37 1lrq s ASP 1166N 1.58 6.36 0.00 3.32 -1.08 -1.26 -4.91 116.67 120.68 1lrq s ASP 1166Ca 0.04 -1.72 0.02 0.00 -0.52 0.00 0.00 52.55 50.37 1lrq s ASP 1166Cb -0.17 -2.32 0.09 0.00 -1.46 0.00 0.00 42.92 39.06 1lrq s ASP 1166CO 0.05 -1.05 0.97 0.49 0.52 0.00 0.00 175.17 176.16 1lrq n PHE 1167N 6.12 0.00 0.31 -5.34 3.01 -1.26 -1.26 117.46 119.04 1lrq n PHE 1167Ca 0.01 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.63 1lrq n PHE 1167Cb 0.45 -0.40 0.72 0.00 -0.01 0.00 0.00 39.48 40.23 1lrq n PHE 1167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1lrq h ARG 1168N 0.00 0.00 -0.01 -1.08 3.08 -2.03 -2.61 114.38 111.73 1lrq h ARG 1168Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1lrq h ARG 1168Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1lrq h ARG 1168CO 0.00 0.00 -0.33 0.66 -1.07 0.00 0.00 179.97 179.23 1lrq h SER 1169N 0.00 0.01 0.61 7.04 4.64 -1.61 -2.96 113.55 121.28 1lrq h SER 1169Ca 0.00 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1lrq h SER 1169Cb 0.34 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1lrq h SER 1169CO 0.00 0.34 -0.34 -0.07 -0.87 0.00 0.00 176.83 175.89 1lrq h LEU 1170N 0.01 -0.83 -1.28 5.97 4.07 -1.69 0.42 115.31 121.97 1lrq h LEU 1170Ca -0.00 0.04 -0.07 0.00 0.08 0.00 0.00 57.88 57.93 1lrq h LEU 1170Cb 0.59 0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 1lrq h LEU 1170CO 0.04 -0.55 -0.35 1.55 -1.08 0.00 0.00 178.44 178.06 1lrq h PRO 1171N -0.88 0.00 0.15 1.13 0.13 -1.74 -2.08 132.00 128.71 1lrq h PRO 1171Ca -0.08 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1lrq h PRO 1171Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1lrq h PRO 1171CO 0.10 0.35 -0.07 0.82 -0.23 0.00 0.00 178.00 178.96 1lrq h ILE 1172N 0.00 1.00 0.00 -3.56 2.04 -1.33 -3.17 117.51 112.49 1lrq h ILE 1172Ca -0.00 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 1lrq h ILE 1172Cb 0.66 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1lrq h ILE 1172CO 0.04 0.18 -0.19 0.24 0.00 0.00 0.00 178.15 178.42 1lrq h MET 1173N -0.58 0.00 0.00 2.37 2.86 -0.88 -2.42 114.93 116.27 1lrq h MET 1173Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1lrq h MET 1173Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1lrq h MET 1173CO 0.03 0.19 0.00 -0.22 1.06 0.00 0.00 176.91 177.98 1lrq h LYS 1174N 0.00 0.00 0.00 1.72 1.63 -1.34 -1.69 116.57 116.89 1lrq h LYS 1174Ca -0.00 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1lrq h LYS 1174Cb 0.40 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.03 1lrq h LYS 1174CO 0.03 0.00 -0.14 1.96 -3.45 0.00 0.00 179.45 177.84 1lrq h GLN 1175N 0.00 0.00 0.00 1.90 4.20 -1.51 -3.32 115.11 116.37 1lrq h GLN 1175Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1lrq h GLN 1175Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1lrq h GLN 1175CO 0.00 0.14 0.00 -2.67 -0.67 0.00 0.00 178.83 175.63 1lrq n TRP 1176N -3.96 0.00 -3.61 2.96 2.14 -0.67 -5.11 117.44 109.19 1lrq n TRP 1176Ca -0.02 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.48 1lrq n TRP 1176Cb 0.23 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.72 1lrq n TRP 1176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1lrq s ALA 1177N -0.04 -1.67 0.45 -1.67 0.00 -0.98 -5.00 121.76 112.84 1lrq s ALA 1177Ca 0.00 0.51 -0.23 0.00 0.00 0.00 0.00 51.96 52.24 1lrq s ALA 1177Cb 0.00 0.61 -0.08 0.00 0.00 0.00 0.00 23.12 23.65 1lrq s ALA 1177CO 0.00 -0.85 1.14 0.15 0.00 0.00 0.00 175.76 176.20 1lrq s LYS 1178N -3.35 3.82 -0.10 0.00 1.02 -1.16 -4.07 119.74 115.90 1lrq s LYS 1178Ca 0.07 1.71 0.02 0.00 0.02 0.00 0.00 55.97 57.80 1lrq s LYS 1178Cb -0.02 -2.41 -0.02 0.00 -0.52 0.00 0.00 37.83 34.87 1lrq s LYS 1178CO -0.04 -0.48 -0.17 0.08 -0.92 0.00 0.00 175.35 173.82 1lrq s VAL 1179N -1.58 2.78 0.00 3.17 1.01 -1.26 -1.58 120.40 122.94 1lrq s VAL 1179Ca 0.63 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1lrq s VAL 1179Cb -0.27 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 1lrq s VAL 1179CO 0.33 0.55 -0.17 -0.63 0.00 0.00 0.00 175.10 175.18 1lrq s ILE 1180N 0.01 2.82 -0.22 2.22 -1.09 -0.20 0.22 121.20 124.96 1lrq s ILE 1180Ca -0.05 -1.00 -0.05 0.00 -2.23 0.00 0.00 60.65 57.32 1lrq s ILE 1180Cb -0.15 -2.14 -0.02 0.00 -1.58 0.00 0.00 42.46 38.58 1lrq s ILE 1180CO 0.05 0.46 -0.01 -0.47 -1.23 0.00 0.00 174.94 173.74 1lrq s TYR 1181N -0.82 3.01 -0.77 3.97 5.04 -0.61 -0.66 117.35 126.50 1lrq s TYR 1181Ca 0.13 -0.68 -0.23 0.00 -2.44 0.00 0.00 57.07 53.86 1lrq s TYR 1181Cb -0.10 -2.13 0.07 0.00 0.35 0.00 0.00 41.96 40.15 1lrq s TYR 1181CO 0.03 -0.41 1.11 0.34 -1.34 0.00 0.00 175.55 175.27 1lrq s ASP 1182N 1.36 6.30 0.41 4.32 -1.08 -0.10 -0.01 116.67 127.87 1lrq s ASP 1182Ca 0.04 -1.17 0.19 0.00 -0.52 0.00 0.00 52.55 51.10 1lrq s ASP 1182Cb -0.15 -2.46 0.91 0.00 -1.46 0.00 0.00 42.92 39.76 1lrq s ASP 1182CO -0.00 -1.44 1.86 0.00 0.52 0.00 0.00 175.17 176.11 1lrq h ALA 1183N 9.52 1.21 0.02 3.66 0.00 -1.26 -2.85 119.26 129.56 1lrq h ALA 1183Ca -0.14 -0.27 -0.36 0.00 0.00 0.00 0.00 54.91 54.14 1lrq h ALA 1183Cb 1.05 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1lrq h ALA 1183CO 1.21 0.38 -2.19 0.25 0.00 0.00 0.00 179.25 178.90 1lrq n THR 1184N -3.75 1.54 0.10 0.00 -2.24 -1.25 -4.31 114.28 104.36 1lrq n THR 1184Ca -0.01 -0.74 -0.03 0.00 -2.27 0.00 0.00 64.05 61.01 1lrq n THR 1184Cb 0.40 -1.06 0.19 0.00 -2.10 0.00 0.00 70.33 67.76 1lrq n THR 1184CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1lrq h GLY 1185N 2.87 0.20 2.00 3.38 0.00 -1.88 -3.14 103.07 106.51 1lrq h GLY 1185Ca -0.47 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.64 1lrq h GLY 1185CO 0.02 0.20 0.00 1.76 0.00 0.00 0.00 176.54 178.52 1lrq h SER 1186N 0.15 0.00 -0.42 0.19 0.02 -1.60 -2.71 113.55 109.17 1lrq h SER 1186Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1lrq h SER 1186Cb 0.93 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.47 1lrq h SER 1186CO 0.07 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.09 1lrq n VAL 1187N -2.64 0.74 -2.73 2.27 0.24 -1.18 -4.75 118.33 110.27 1lrq n VAL 1187Ca 0.00 -0.87 -0.33 0.00 -2.04 0.00 0.00 64.34 61.11 1lrq n VAL 1187Cb 0.20 0.73 -0.06 0.00 -1.47 0.00 0.00 33.84 33.24 1lrq n VAL 1187CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lrq s GLN 1188N -1.14 4.16 -0.54 7.34 -2.07 -1.03 -1.86 119.66 124.52 1lrq s GLN 1188Ca 0.33 1.10 -0.07 0.00 -1.82 0.00 0.00 55.36 54.91 1lrq s GLN 1188Cb 0.18 -2.17 0.14 0.00 -1.09 0.00 0.00 33.01 30.08 1lrq s GLN 1188CO 0.25 -0.09 0.39 -0.51 -1.32 0.00 0.00 175.29 174.01 1lrq s LEU 1189N -3.35 5.59 -0.13 2.60 1.43 -0.08 -4.28 118.68 120.46 1lrq s LEU 1189Ca 0.62 -2.31 -0.39 0.00 -1.03 0.00 0.00 54.13 51.02 1lrq s LEU 1189Cb -0.09 -1.95 -0.16 0.00 0.03 0.00 0.00 46.19 44.02 1lrq s LEU 1189CO 0.17 -0.55 1.60 -2.65 0.23 0.00 0.00 176.35 175.14 1lrq n PRO 1190N 4.31 1.21 -1.35 1.29 -0.02 -1.26 0.49 135.00 139.68 1lrq n PRO 1190Ca 0.00 0.44 -0.13 0.00 -2.02 0.00 0.00 63.50 61.80 1lrq n PRO 1190Cb 0.41 -2.12 -0.06 0.00 -0.02 0.00 0.00 33.50 31.71 1lrq n PRO 1190CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lrq n GLY 1191N 3.57 1.24 0.32 -1.23 0.00 -1.26 -4.24 105.19 103.59 1lrq n GLY 1191Ca 0.23 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.40 1lrq n GLY 1191CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lrq h GLY 1192N 0.00 0.00 -2.66 -0.02 0.00 -0.74 -2.26 103.07 97.39 1lrq h GLY 1192Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1lrq h GLY 1192CO 0.39 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.97 1lrq n LEU 1193N -4.33 4.43 0.00 3.11 7.99 0.39 -4.76 117.00 123.82 1lrq n LEU 1193Ca 0.03 -2.45 0.00 0.00 -0.01 0.00 0.00 56.01 53.58 1lrq n LEU 1193Cb 0.34 -0.53 0.00 0.00 -0.11 0.00 0.00 43.42 43.12 1lrq n LEU 1193CO 0.34 0.79 0.00 0.61 -1.51 0.00 0.00 177.39 177.62 1lrq n GLY 1194N 0.87 1.89 0.06 -0.72 0.00 -0.85 -4.14 105.19 102.30 1lrq n GLY 1194Ca 0.24 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 46.04 1lrq n GLY 1194CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lrq n ASP 1195N 4.46 0.60 -4.15 1.61 5.75 -1.26 -4.88 116.55 118.67 1lrq n ASP 1195Ca 0.00 0.31 -0.10 0.00 -0.01 0.00 0.00 54.79 54.99 1lrq n ASP 1195Cb 0.00 -0.30 -0.10 0.00 -1.03 0.00 0.00 41.12 39.69 1lrq n ASP 1195CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1lrq s LYS 1196N -3.09 0.90 0.45 0.11 1.02 -1.26 -3.28 119.74 114.59 1lrq s LYS 1196Ca 0.10 -1.42 -0.09 0.00 0.02 0.00 0.00 55.97 54.58 1lrq s LYS 1196Cb 0.14 0.21 -0.05 0.00 -0.52 0.00 0.00 37.83 37.61 1lrq s LYS 1196CO 0.64 -0.23 0.81 -1.12 -0.92 0.00 0.00 175.35 174.52 1lrq s SER 1197N -3.04 6.41 0.00 2.83 0.01 -1.26 -0.46 113.70 118.19 1lrq s SER 1197Ca 0.22 1.11 0.00 0.00 1.31 0.00 0.00 55.95 58.59 1lrq s SER 1197Cb 0.07 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.99 1lrq s SER 1197CO 0.00 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1lrq n GLY 1198N -1.75 3.31 0.00 3.44 0.00 0.18 -4.51 105.19 105.85 1lrq n GLY 1198Ca 0.02 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1lrq n GLY 1198CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lrq n GLY 1199N 5.00 1.28 2.69 -0.02 0.00 -1.26 -0.90 105.19 111.97 1lrq n GLY 1199Ca 0.00 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 1lrq n GLY 1199CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1lrq s MET 1200N -2.00 1.27 0.53 1.61 -1.94 -0.78 -4.88 119.30 113.11 1lrq s MET 1200Ca 0.00 -2.02 0.25 0.00 -1.71 0.00 0.00 55.69 52.20 1lrq s MET 1200Cb 0.00 -2.27 1.40 0.00 2.01 0.00 0.00 34.83 35.97 1lrq s MET 1200CO 0.00 -1.18 2.01 -0.09 -0.01 0.00 0.00 175.02 175.75 1lrq h ARG 1201N 6.64 0.00 0.00 2.03 2.43 -1.87 -1.80 114.38 121.80 1lrq h ARG 1201Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1lrq h ARG 1201Cb 0.92 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1lrq h ARG 1201CO 0.47 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 179.98 1lrq h GLU 1202N 0.00 0.00 -0.02 0.20 4.11 -1.94 -1.75 114.58 115.19 1lrq h GLU 1202Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1lrq h GLU 1202Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1lrq h GLU 1202CO -0.00 0.00 -0.47 1.19 0.07 0.00 0.00 179.01 179.80 1lrq n PHE 1203N -2.87 0.00 0.12 2.06 3.01 -0.68 -4.53 117.46 114.58 1lrq n PHE 1203Ca -0.02 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.31 1lrq n PHE 1203Cb 0.07 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.48 1lrq n PHE 1203CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1lrq h ILE 1204N 2.44 0.48 0.02 4.37 2.04 -1.44 -2.61 117.51 122.81 1lrq h ILE 1204Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1lrq h ILE 1204Cb 0.76 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1lrq h ILE 1204CO 0.00 0.00 -0.01 0.15 0.00 0.00 0.00 178.15 178.29 1lrq h PHE 1205N -0.45 -0.03 -0.62 1.37 -0.00 -1.79 -2.17 116.94 113.25 1lrq h PHE 1205Ca 0.02 -0.00 0.05 0.00 -0.00 0.00 0.00 57.97 58.04 1lrq h PHE 1205Cb 0.46 0.01 -0.05 0.00 -0.00 0.00 0.00 35.95 36.37 1lrq h PHE 1205CO -0.21 0.17 0.34 -1.00 -0.00 0.00 0.00 178.31 177.61 1lrq h PRO 1206N -0.22 0.63 -0.11 6.41 0.13 -1.80 -1.78 132.00 135.26 1lrq h PRO 1206Ca -0.00 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.00 1lrq h PRO 1206Cb 0.20 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.18 1lrq h PRO 1206CO 0.00 0.42 -0.32 -0.07 -0.23 0.00 0.00 178.00 177.80 1lrq h LEU 1207N 0.65 0.22 -0.80 1.56 3.38 -1.45 -2.15 115.31 116.72 1lrq h LEU 1207Ca 0.27 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 1lrq h LEU 1207Cb 0.15 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1lrq h LEU 1207CO -0.17 0.54 -0.57 -0.29 0.09 0.00 0.00 178.44 178.04 1lrq h ILE 1208N 0.19 1.40 -0.52 1.22 2.10 -0.97 -1.31 117.51 119.62 1lrq h ILE 1208Ca 0.03 -1.94 -0.09 0.00 1.08 0.00 0.00 64.86 63.94 1lrq h ILE 1208Cb 0.67 2.02 -0.02 0.00 -1.09 0.00 0.00 36.82 38.40 1lrq h ILE 1208CO 0.05 0.56 -0.03 0.03 -1.08 0.00 0.00 178.15 177.68 1lrq h ARG 1209N 0.06 0.89 -0.47 2.19 3.08 -0.88 -2.49 114.38 116.77 1lrq h ARG 1209Ca -0.00 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 59.75 1lrq h ARG 1209Cb 1.03 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 1lrq h ARG 1209CO 0.08 0.90 0.18 0.00 -1.07 0.00 0.00 179.97 180.07 1lrq h ALA 1210N 1.14 0.61 -0.41 0.04 0.00 -0.91 -2.14 119.26 117.59 1lrq h ALA 1210Ca 0.15 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1lrq h ALA 1210Cb 0.53 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1lrq h ALA 1210CO 0.03 0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.63 1lrq h ALA 1211N 1.03 0.48 0.00 0.00 0.00 -0.87 -0.22 119.26 119.67 1lrq h ALA 1211Ca 0.15 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 1lrq h ALA 1211Cb 0.20 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1lrq h ALA 1211CO -0.01 -0.26 -0.36 -0.39 0.00 0.00 0.00 179.25 178.22 1lrq h VAL 1212N 0.28 0.76 -0.14 0.00 -1.51 -1.38 0.66 116.25 114.91 1lrq h VAL 1212Ca 0.19 -1.60 -0.20 0.00 -1.23 0.00 0.00 66.70 63.86 1lrq h VAL 1212Cb 0.20 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 1lrq h VAL 1212CO -0.21 0.35 -0.71 0.00 -1.23 0.00 0.00 177.57 175.77 1lrq h ALA 1213N 1.64 0.48 -0.15 5.19 0.00 -0.79 -3.13 119.26 122.50 1lrq h ALA 1213Ca -0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.25 1lrq h ALA 1213Cb 1.00 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1lrq h ALA 1213CO 0.05 0.71 -0.17 0.28 0.00 0.00 0.00 179.25 180.12 1lrq h VAL 1214N 0.44 1.35 0.00 0.00 2.07 -0.90 -3.48 116.25 115.74 1lrq h VAL 1214Ca -0.03 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.13 1lrq h VAL 1214Cb 1.31 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1lrq h VAL 1214CO 0.14 0.40 0.00 0.61 0.02 0.00 0.00 177.57 178.74 1lrq n GLY 1215N 0.24 2.86 3.38 2.17 0.00 0.21 -4.86 105.19 109.18 1lrq n GLY 1215Ca -0.06 -1.06 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1lrq n GLY 1215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lrq n ASP 1217N -0.49 1.49 0.00 0.00 8.00 0.13 -4.99 116.55 120.69 1lrq n ASP 1217Ca 0.01 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.33 1lrq n ASP 1217Cb 0.64 0.32 0.00 0.00 -0.02 0.00 0.00 41.12 42.06 1lrq n ASP 1217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lrq n GLY 1218N 1.38 0.16 3.22 0.44 0.00 -1.13 -1.91 105.19 107.35 1lrq n GLY 1218Ca 0.11 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 45.02 1lrq n GLY 1218CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1lrq s VAL 1219N -2.00 1.19 -0.11 1.61 -7.23 -0.11 -1.58 120.40 112.17 1lrq s VAL 1219Ca 0.00 -1.69 0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1lrq s VAL 1219Cb 0.00 -1.47 0.01 0.00 0.56 0.00 0.00 36.38 35.49 1lrq s VAL 1219CO 0.00 -0.46 -0.17 0.12 -0.31 0.00 0.00 175.10 174.27 1lrq s PHE 1220N -2.23 2.13 -0.05 2.82 2.19 0.98 -0.98 117.98 122.84 1lrq s PHE 1220Ca 0.08 -0.98 -0.02 0.00 0.33 0.00 0.00 56.93 56.34 1lrq s PHE 1220Cb -0.04 -1.50 0.04 0.00 -1.31 0.00 0.00 43.02 40.20 1lrq s PHE 1220CO 0.02 -0.47 0.09 -1.64 1.83 0.00 0.00 175.22 175.05 1lrq s MET 1221N 0.81 -0.01 -0.08 10.12 -1.94 0.40 -0.78 119.30 127.82 1lrq s MET 1221Ca -0.10 0.36 -0.22 0.00 -1.71 0.00 0.00 55.69 54.02 1lrq s MET 1221Cb -0.16 -0.33 -0.04 0.00 2.01 0.00 0.00 34.83 36.32 1lrq s MET 1221CO 0.01 -0.25 0.66 -1.21 -0.01 0.00 0.00 175.02 174.21 1lrq s GLU 1222N 1.71 4.42 0.04 2.03 2.02 -1.26 -2.69 118.70 124.97 1lrq s GLU 1222Ca -0.02 0.80 0.03 0.00 0.02 0.00 0.00 54.97 55.80 1lrq s GLU 1222Cb -0.12 -3.44 -0.02 0.00 0.10 0.00 0.00 34.13 30.64 1lrq s GLU 1222CO -0.04 0.08 -0.10 -0.08 0.02 0.00 0.00 175.26 175.14 1lrq s THR 1223N 0.76 0.72 -0.07 3.63 -1.32 0.32 -0.95 115.64 118.74 1lrq s THR 1223Ca 0.35 -1.04 -0.10 0.00 -1.21 0.00 0.00 61.69 59.69 1lrq s THR 1223Cb -0.17 -0.73 0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1lrq s THR 1223CO 0.17 -0.26 0.25 -2.28 -2.21 0.00 0.00 174.62 170.29 1lrq s HIS 1224N -1.18 -0.22 0.29 9.09 5.04 -0.74 -2.36 115.29 125.20 1lrq s HIS 1224Ca -0.06 0.50 0.02 0.00 -1.54 0.00 0.00 55.06 53.99 1lrq s HIS 1224Cb -0.09 0.08 0.59 0.00 0.04 0.00 0.00 32.58 33.20 1lrq s HIS 1224CO 0.01 -0.21 1.82 -1.35 -2.34 0.00 0.00 174.74 172.67 1lrq h PRO 1225N 5.18 0.91 -2.38 2.88 0.11 -1.94 -1.47 132.00 135.29 1lrq h PRO 1225Ca -0.27 -0.05 -0.59 0.00 0.11 0.00 0.00 66.00 65.19 1lrq h PRO 1225Cb 1.19 -0.21 -0.38 0.00 0.11 0.00 0.00 31.00 31.71 1lrq h PRO 1225CO 0.36 0.60 -0.96 0.39 -0.21 0.00 0.00 178.00 178.18 1lrq n GLU 1226N -4.66 0.25 -0.33 1.05 1.02 -1.26 -4.42 120.64 112.30 1lrq n GLU 1226Ca 0.20 -3.22 0.24 0.00 -0.02 0.00 0.00 57.16 54.36 1lrq n GLU 1226Cb 0.40 -1.69 0.48 0.00 -0.02 0.00 0.00 31.44 30.61 1lrq n GLU 1226CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1lrq h PRO 1227N 5.60 0.25 -0.43 3.49 0.11 -1.86 0.53 132.00 139.69 1lrq h PRO 1227Ca 0.26 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.48 1lrq h PRO 1227Cb 0.90 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 1lrq h PRO 1227CO 0.38 0.17 0.36 1.05 -0.21 0.00 0.00 178.00 179.76 1lrq h GLU 1228N 0.26 0.00 -0.31 1.05 4.11 -1.94 -0.68 114.58 117.08 1lrq h GLU 1228Ca 0.74 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.17 1lrq h GLU 1228Cb 1.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1lrq h GLU 1228CO -0.64 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.07 1lrq n LYS 1229N -4.10 2.20 -1.72 1.06 5.02 0.17 -5.00 118.16 115.79 1lrq n LYS 1229Ca 0.08 -2.03 -0.36 0.00 -2.02 0.00 0.00 58.31 53.97 1lrq n LYS 1229Cb 0.56 -1.41 0.07 0.00 -0.02 0.00 0.00 35.03 34.23 1lrq n LYS 1229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lrq s ALA 1230N -1.28 2.35 -1.69 7.82 0.00 -0.26 -4.92 121.76 123.77 1lrq s ALA 1230Ca 0.31 1.12 0.27 0.00 0.00 0.00 0.00 51.96 53.66 1lrq s ALA 1230Cb 0.18 -3.52 0.94 0.00 0.00 0.00 0.00 23.12 20.72 1lrq s ALA 1230CO 0.25 -1.59 1.68 1.28 0.00 0.00 0.00 175.76 177.38 1lrq n LEU 1231N -2.02 0.79 -3.64 0.00 4.77 -1.26 -4.60 117.00 111.04 1lrq n LEU 1231Ca 0.15 -0.14 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 1lrq n LEU 1231Cb 0.49 -0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1lrq n LEU 1231CO 0.47 0.15 0.32 -0.94 -1.33 0.00 0.00 177.39 176.06 1lrq s SER 1232N -2.51 -0.62 -1.51 -1.43 1.04 -1.26 -4.36 113.70 103.05 1lrq s SER 1232Ca 0.26 1.04 -0.13 0.00 0.48 0.00 0.00 55.95 57.60 1lrq s SER 1232Cb 0.19 1.03 0.08 0.00 0.10 0.00 0.00 66.02 67.42 1lrq s SER 1232CO 0.51 -0.33 0.97 0.47 0.98 0.00 0.00 173.24 175.84 1lrq n ASP 1233N 2.20 -4.59 0.27 7.02 8.00 -1.26 -4.84 116.55 123.35 1lrq n ASP 1233Ca -0.16 -0.77 0.12 0.00 0.71 0.00 0.00 54.79 54.69 1lrq n ASP 1233Cb 0.56 -3.94 0.77 0.00 -0.02 0.00 0.00 41.12 38.49 1lrq n ASP 1233CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lrq h ALA 1234N 0.96 1.46 0.00 2.24 0.00 -1.81 -1.93 119.26 120.18 1lrq h ALA 1234Ca -0.58 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1lrq h ALA 1234Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1lrq h ALA 1234CO 0.66 0.10 -0.37 0.43 0.00 0.00 0.00 179.25 180.07 1lrq n SER 1235N -3.85 0.48 0.00 0.00 7.64 -1.26 -4.26 113.62 112.37 1lrq n SER 1235Ca -0.02 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1lrq n SER 1235Cb 0.17 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1lrq n SER 1235CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1lrq n THR 1236N -1.75 0.00 -2.02 0.44 -2.24 -0.96 -3.93 114.28 103.82 1lrq n THR 1236Ca 0.05 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 1lrq n THR 1236Cb 0.38 0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 69.20 1lrq n THR 1236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1lrq s GLN 1237N -1.44 4.27 0.07 -0.78 -0.21 -0.76 -4.79 119.66 116.02 1lrq s GLN 1237Ca 0.00 2.31 -0.30 0.00 0.02 0.00 0.00 55.36 57.39 1lrq s GLN 1237Cb 0.00 -3.08 -0.05 0.00 1.00 0.00 0.00 33.01 30.88 1lrq s GLN 1237CO 0.00 -0.36 1.01 -1.17 -2.12 0.00 0.00 175.29 172.64 1lrq s LEU 1238N -1.01 4.43 0.16 2.90 2.96 -0.12 -4.77 118.68 123.23 1lrq s LEU 1238Ca 0.55 1.79 -0.32 0.00 -0.22 0.00 0.00 54.13 55.93 1lrq s LEU 1238Cb -0.42 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.57 1lrq s LEU 1238CO 0.49 -0.20 1.73 -2.65 -1.32 0.00 0.00 176.35 174.39 1lrq n PRO 1239N 3.33 2.61 -0.30 0.98 -0.02 -1.26 -1.80 135.00 138.54 1lrq n PRO 1239Ca 0.05 0.94 0.24 0.00 -2.02 0.00 0.00 63.50 62.71 1lrq n PRO 1239Cb 0.49 -2.79 0.55 0.00 -0.02 0.00 0.00 33.50 31.74 1lrq n PRO 1239CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1lrq h LEU 1240N 7.20 0.35 -2.34 2.45 5.85 -1.47 0.40 115.31 127.76 1lrq h LEU 1240Ca -0.45 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 1lrq h LEU 1240Cb 1.22 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 1lrq h LEU 1240CO 0.94 0.08 -0.04 0.77 -0.34 0.00 0.00 178.44 179.85 1lrq h SER 1241N 0.32 0.00 0.32 1.25 4.64 -1.87 -2.27 113.55 115.94 1lrq h SER 1241Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1lrq h SER 1241Cb 1.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 1lrq h SER 1241CO -0.22 0.04 -0.41 0.00 -0.87 0.00 0.00 176.83 175.36 1lrq n GLN 1242N -3.65 0.45 -0.05 4.77 6.02 0.13 -4.42 117.38 120.62 1lrq n GLN 1242Ca -0.03 -0.28 -0.10 0.00 -0.01 0.00 0.00 57.00 56.59 1lrq n GLN 1242Cb 0.14 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 1lrq n GLN 1242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1lrq h LEU 1243N 0.68 0.20 -0.14 1.08 5.85 -1.45 -2.47 115.31 119.06 1lrq h LEU 1243Ca 0.00 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.76 1lrq h LEU 1243Cb 0.51 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1lrq h LEU 1243CO 0.00 0.15 -0.14 -0.08 -0.34 0.00 0.00 178.44 178.03 1lrq h GLU 1244N 0.26 -0.15 -0.80 1.25 4.81 -1.78 -1.24 114.58 116.93 1lrq h GLU 1244Ca 0.08 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1lrq h GLU 1244Cb -0.00 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1lrq h GLU 1244CO -0.04 -0.10 0.51 0.78 -0.73 0.00 0.00 179.01 179.43 1lrq h GLY 1245N -0.16 1.16 0.92 1.92 0.00 -1.81 -0.92 103.07 104.18 1lrq h GLY 1245Ca 0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1lrq h GLY 1245CO -0.24 0.33 0.11 -2.22 0.00 0.00 0.00 176.54 174.53 1lrq h ILE 1246N 1.00 1.20 -0.37 2.60 1.08 -1.08 -1.57 117.51 120.36 1lrq h ILE 1246Ca 0.32 -0.62 -0.01 0.00 -0.39 0.00 0.00 64.86 64.15 1lrq h ILE 1246Cb 0.01 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.74 1lrq h ILE 1246CO -0.11 0.21 0.17 0.40 -0.69 0.00 0.00 178.15 178.14 1lrq h ILE 1247N 0.37 1.17 -0.44 -0.67 2.04 -0.95 -0.62 117.51 118.41 1lrq h ILE 1247Ca 0.11 -0.49 0.04 0.00 1.00 0.00 0.00 64.86 65.51 1lrq h ILE 1247Cb 0.22 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1lrq h ILE 1247CO -0.01 0.18 0.21 -0.08 0.00 0.00 0.00 178.15 178.46 1lrq h GLU 1248N 0.46 0.41 -0.34 2.37 4.57 -1.06 -1.32 114.58 119.67 1lrq h GLU 1248Ca 0.13 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1lrq h GLU 1248Cb 0.13 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1lrq h GLU 1248CO -0.02 0.27 0.22 0.00 -1.18 0.00 0.00 179.01 178.30 1lrq h ALA 1249N 1.25 0.43 0.00 2.92 0.00 -0.89 -1.72 119.26 121.25 1lrq h ALA 1249Ca 0.19 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1lrq h ALA 1249Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1lrq h ALA 1249CO -0.15 -0.09 -0.45 -0.84 0.00 0.00 0.00 179.25 177.72 1lrq h ILE 1250N 0.45 1.31 -0.42 0.00 3.07 -0.85 -1.26 117.51 119.81 1lrq h ILE 1250Ca 0.12 -1.54 -0.11 0.00 1.55 0.00 0.00 64.86 64.89 1lrq h ILE 1250Cb -0.03 1.83 -0.02 0.00 -0.27 0.00 0.00 36.82 38.33 1lrq h ILE 1250CO -0.03 0.44 -0.17 -0.07 -1.05 0.00 0.00 178.15 177.27 1lrq h LEU 1251N 0.00 0.81 -0.33 0.16 3.38 -0.93 0.29 115.31 118.70 1lrq h LEU 1251Ca -0.00 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1lrq h LEU 1251Cb 0.79 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1lrq h LEU 1251CO 0.06 0.98 -0.03 -0.33 0.09 0.00 0.00 178.44 179.21 1lrq h GLU 1252N 0.72 0.60 -0.47 1.13 5.08 -0.85 -1.92 114.58 118.86 1lrq h GLU 1252Ca 0.11 -0.21 -0.14 0.00 -1.00 0.00 0.00 59.36 58.12 1lrq h GLU 1252Cb 0.68 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1lrq h GLU 1252CO 0.05 0.75 -0.24 0.82 -1.00 0.00 0.00 179.01 179.39 1lrq h ILE 1253N 0.39 1.27 -0.22 3.13 2.04 -1.13 -2.75 117.51 120.24 1lrq h ILE 1253Ca 0.09 -1.41 0.02 0.00 1.00 0.00 0.00 64.86 64.55 1lrq h ILE 1253Cb 0.50 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1lrq h ILE 1253CO 0.02 0.49 0.09 -0.09 0.00 0.00 0.00 178.15 178.66 1lrq h ARG 1254N 0.84 0.19 -0.07 2.37 2.43 -0.89 -1.12 114.38 118.13 1lrq h ARG 1254Ca 0.10 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1lrq h ARG 1254Cb 0.83 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 1lrq h ARG 1254CO 0.07 0.13 -0.12 1.49 -1.51 0.00 0.00 179.97 180.03 1lrq h GLU 1255N 0.20 -0.16 -0.14 0.20 4.57 -1.26 0.41 114.58 118.41 1lrq h GLU 1255Ca 0.09 0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.18 1lrq h GLU 1255Cb 0.04 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1lrq h GLU 1255CO -0.08 -0.11 -0.35 -0.24 -1.18 0.00 0.00 179.01 177.05 1lrq h VAL 1256N -0.17 1.29 0.00 0.32 3.04 -1.36 -3.11 116.25 116.26 1lrq h VAL 1256Ca 0.07 -1.39 -0.19 0.00 -1.01 0.00 0.00 66.70 64.18 1lrq h VAL 1256Cb 0.26 1.57 -0.03 0.00 -2.01 0.00 0.00 31.29 31.08 1lrq h VAL 1256CO -0.17 0.42 -1.05 0.00 -1.01 0.00 0.00 177.57 175.76 1lrq h ALA 1257N 1.39 0.57 -0.99 3.17 0.00 -0.90 -3.39 119.26 119.11 1lrq h ALA 1257Ca 0.03 -0.86 0.33 0.00 0.00 0.00 0.00 54.91 54.41 1lrq h ALA 1257Cb 0.74 0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.43 1lrq h ALA 1257CO 0.06 1.07 0.52 0.66 0.00 0.00 0.00 179.25 181.55 1lrq h SER 1258N 0.00 0.41 0.35 0.00 4.64 -0.10 0.18 113.55 119.03 1lrq h SER 1258Ca -0.08 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1lrq h SER 1258Cb 1.67 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 1lrq h SER 1258CO 0.09 -0.19 0.00 0.07 -0.87 0.00 0.00 176.83 175.93 1lrq h LYS 1259N 0.26 0.00 -0.02 4.77 2.10 -1.76 -2.26 116.57 119.65 1lrq h LYS 1259Ca 0.73 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.38 1lrq h LYS 1259Cb 1.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.02 1lrq h LYS 1259CO -0.65 0.00 -0.17 0.66 -2.00 0.00 0.00 179.45 177.29 1lrq n TYR 1260N -2.49 0.00 -1.83 0.07 4.02 0.65 -4.96 117.16 112.62 1lrq n TYR 1260Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1lrq n TYR 1260Cb 0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.43 1lrq n TYR 1260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1lrq s TYR 1261N -2.05 2.94 0.49 -0.72 4.12 -0.85 -4.95 117.35 116.33 1lrq s TYR 1261Ca 0.23 0.56 -0.21 0.00 0.02 0.00 0.00 57.07 57.66 1lrq s TYR 1261Cb 0.18 -4.03 -0.08 0.00 -1.52 0.00 0.00 41.96 36.51 1lrq s TYR 1261CO 0.38 -3.78 1.09 -1.21 0.02 0.00 0.00 175.55 172.04 1lrq s GLU 1262N 0.79 3.70 -0.03 -0.62 8.01 -1.26 -5.01 118.70 124.28 1lrq s GLU 1262Ca 0.70 1.53 -0.24 0.00 0.01 0.00 0.00 54.97 56.97 1lrq s GLU 1262Cb -0.47 -2.18 -0.04 0.00 -4.31 0.00 0.00 34.13 27.13 1lrq s GLU 1262CO 0.35 -0.55 0.73 0.99 0.01 0.00 0.00 175.26 176.80 1lrq s THR 1263N -1.80 4.94 -2.30 3.63 2.01 -1.26 -5.17 115.64 115.70 1lrq s THR 1263Ca 0.67 1.53 0.30 0.00 0.31 0.00 0.00 61.69 64.50 1lrq s THR 1263Cb -0.21 -4.08 0.69 0.00 0.01 0.00 0.00 72.50 68.91 1lrq s THR 1263CO 0.26 0.28 1.94 2.30 -0.69 0.00 0.00 174.62 178.70