#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jcy n LYS 1003N 0.00 2.13 -2.39 5.31 5.02 -1.26 -4.94 118.16 122.04 1jcy n LYS 1003Ca 0.00 0.77 -0.41 0.00 -2.02 0.00 0.00 58.31 56.66 1jcy n LYS 1003Cb 0.00 -2.56 -0.04 0.00 -0.02 0.00 0.00 35.03 32.41 1jcy n LYS 1003CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1jcy s PHE 1004N 1.94 3.45 -0.17 2.13 2.19 -1.22 -4.75 117.98 121.54 1jcy s PHE 1004Ca 0.84 1.59 -0.09 0.00 0.33 0.00 0.00 56.93 59.60 1jcy s PHE 1004Cb -0.69 -3.39 -0.05 0.00 -1.31 0.00 0.00 43.02 37.58 1jcy s PHE 1004CO 0.43 -0.93 0.13 -1.17 1.83 0.00 0.00 175.22 175.51 1jcy s LEU 1005N -1.29 4.28 -0.28 6.12 2.96 -0.72 -0.08 118.68 129.67 1jcy s LEU 1005Ca 0.47 0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.72 1jcy s LEU 1005Cb -0.34 -2.08 0.08 0.00 0.50 0.00 0.00 46.19 44.35 1jcy s LEU 1005CO 0.43 0.28 0.01 -0.69 -1.32 0.00 0.00 176.35 175.05 1jcy s VAL 1006N -0.21 1.55 -0.28 1.68 1.01 -0.47 -0.69 120.40 122.99 1jcy s VAL 1006Ca 0.11 -1.53 -0.14 0.00 0.00 0.00 0.00 61.98 60.42 1jcy s VAL 1006Cb -0.11 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1jcy s VAL 1006CO 0.00 -0.36 0.33 -0.63 0.00 0.00 0.00 175.10 174.45 1jcy s ILE 1007N 1.33 5.20 0.06 2.22 1.01 0.12 -1.65 121.20 129.49 1jcy s ILE 1007Ca 0.02 0.43 -0.14 0.00 0.00 0.00 0.00 60.65 60.96 1jcy s ILE 1007Cb -0.18 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.63 1jcy s ILE 1007CO -0.11 0.15 0.31 0.00 0.00 0.00 0.00 174.94 175.29 1jcy s ALA 1008N 2.00 -0.70 0.00 9.38 0.00 -0.71 -0.26 121.76 131.48 1jcy s ALA 1008Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1jcy s ALA 1008Cb -0.16 0.38 0.00 0.00 0.00 0.00 0.00 23.12 23.34 1jcy s ALA 1008CO 0.10 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.82 1jcy n GLY 1009N 0.42 1.07 3.77 0.00 0.00 -1.10 -1.35 105.19 107.99 1jcy n GLY 1009Ca -0.18 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 1jcy n GLY 1009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jcy s PRO 1010N -1.94 4.36 0.16 1.61 0.04 -1.06 -1.45 135.00 136.71 1jcy s PRO 1010Ca 0.00 2.18 -0.23 0.00 0.04 0.00 0.00 61.00 62.99 1jcy s PRO 1010Cb 0.00 -3.06 0.04 0.00 0.04 0.00 0.00 34.50 31.52 1jcy s PRO 1010CO 0.00 -0.17 1.60 0.00 0.04 0.00 0.00 177.00 178.47 1jcy s ALA 1012N -6.01 2.46 -1.31 0.00 0.00 -1.26 -1.34 121.76 114.30 1jcy s ALA 1012Ca -0.15 -1.48 -0.18 0.00 0.00 0.00 0.00 51.96 50.15 1jcy s ALA 1012Cb 0.13 -0.42 0.06 0.00 0.00 0.00 0.00 23.12 22.89 1jcy s ALA 1012CO 0.67 0.53 1.81 -0.89 0.00 0.00 0.00 175.76 177.88 1jcy n ILE 1013N 0.76 3.77 0.09 0.00 5.41 -0.61 -4.72 119.36 124.06 1jcy n ILE 1013Ca -0.17 -3.86 0.02 0.00 1.00 0.00 0.00 62.75 59.75 1jcy n ILE 1013Cb 0.54 -2.37 0.39 0.00 -0.71 0.00 0.00 39.64 37.48 1jcy n ILE 1013CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1jcy h GLU 1014N 7.52 0.31 -1.91 0.38 5.08 -1.95 -3.42 114.58 120.59 1jcy h GLU 1014Ca 0.45 -0.06 0.16 0.00 -1.00 0.00 0.00 59.36 58.91 1jcy h GLU 1014Cb 0.85 -0.05 -0.17 0.00 0.50 0.00 0.00 28.75 29.87 1jcy h GLU 1014CO 1.50 0.39 0.62 -1.54 -1.00 0.00 0.00 179.01 178.98 1jcy s SER 1015N -6.84 -0.28 0.44 1.42 1.04 -1.26 -4.99 113.70 103.23 1jcy s SER 1015Ca -0.06 0.04 0.21 0.00 0.48 0.00 0.00 55.95 56.62 1jcy s SER 1015Cb 0.16 0.29 1.03 0.00 0.10 0.00 0.00 66.02 67.60 1jcy s SER 1015CO 0.74 -0.45 1.91 -0.08 0.98 0.00 0.00 173.24 176.34 1jcy h GLU 1016N 2.05 0.00 -0.04 4.02 4.81 -1.96 -2.88 114.58 120.58 1jcy h GLU 1016Ca -0.17 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1jcy h GLU 1016Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 1jcy h GLU 1016CO 0.28 0.25 -0.00 1.49 -0.73 0.00 0.00 179.01 180.29 1jcy h GLU 1017N 0.00 0.07 -0.86 1.92 4.81 -1.99 -2.01 114.58 116.52 1jcy h GLU 1017Ca -0.00 -0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.31 1jcy h GLU 1017Cb 0.58 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.88 1jcy h GLU 1017CO 0.03 0.36 0.49 1.25 -0.73 0.00 0.00 179.01 180.42 1jcy h LEU 1018N -0.24 0.69 -0.64 1.64 5.85 -1.91 -0.89 115.31 119.83 1jcy h LEU 1018Ca 0.01 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1jcy h LEU 1018Cb 0.33 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1jcy h LEU 1018CO 0.00 0.38 0.29 -0.07 -0.34 0.00 0.00 178.44 178.70 1jcy h LEU 1019N 0.80 0.85 -0.91 2.25 4.07 -1.34 -1.78 115.31 119.26 1jcy h LEU 1019Ca 0.43 -0.14 -0.11 0.00 0.08 0.00 0.00 57.88 58.13 1jcy h LEU 1019Cb 0.43 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 1jcy h LEU 1019CO -0.27 0.76 -0.44 -0.07 -1.08 0.00 0.00 178.44 177.34 1jcy h LEU 1020N 0.89 0.24 -0.37 1.67 3.38 -0.58 0.28 115.31 120.82 1jcy h LEU 1020Ca 0.22 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1jcy h LEU 1020Cb 0.15 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jcy h LEU 1020CO -0.02 0.66 -0.11 0.50 0.09 0.00 0.00 178.44 179.55 1jcy h LYS 1021N 0.19 0.73 -0.04 1.13 3.64 -0.90 -1.01 116.57 120.31 1jcy h LYS 1021Ca 0.01 -0.29 -0.21 0.00 -1.27 0.00 0.00 60.65 58.89 1jcy h LYS 1021Cb 0.86 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1jcy h LYS 1021CO 0.07 0.89 -0.80 0.28 -2.27 0.00 0.00 179.45 177.62 1jcy h VAL 1022N 0.53 1.33 -0.71 2.00 2.07 -1.21 -3.20 116.25 117.06 1jcy h VAL 1022Ca 0.09 -2.09 0.06 0.00 0.82 0.00 0.00 66.70 65.59 1jcy h VAL 1022Cb 0.63 2.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.70 1jcy h VAL 1022CO 0.04 0.64 0.47 1.23 0.02 0.00 0.00 177.57 179.96 1jcy h GLY 1023N 0.24 0.92 0.97 2.17 0.00 -0.39 -0.82 103.07 106.16 1jcy h GLY 1023Ca -0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 1jcy h GLY 1023CO 0.16 0.22 0.17 -2.09 0.00 0.00 0.00 176.54 175.00 1jcy h GLU 1024N 0.73 0.41 -0.49 4.80 4.81 -1.18 -0.08 114.58 123.58 1jcy h GLU 1024Ca 0.31 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.41 1jcy h GLU 1024Cb 0.27 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1jcy h GLU 1024CO -0.10 0.33 -0.00 1.49 -0.73 0.00 0.00 179.01 180.00 1jcy h GLU 1025N 0.37 0.86 -0.54 1.92 4.57 -1.39 -1.47 114.58 118.91 1jcy h GLU 1025Ca 0.11 -0.28 -0.04 0.00 -1.18 0.00 0.00 59.36 57.97 1jcy h GLU 1025Cb 0.03 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 1jcy h GLU 1025CO -0.02 0.90 0.15 0.82 -1.18 0.00 0.00 179.01 179.69 1jcy h ILE 1026N 0.72 1.22 -0.49 2.32 2.04 -0.99 -0.68 117.51 121.65 1jcy h ILE 1026Ca 0.14 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.18 1jcy h ILE 1026Cb 0.51 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1jcy h ILE 1026CO 0.03 0.29 0.08 0.50 0.00 0.00 0.00 178.15 179.04 1jcy h LYS 1027N 0.79 0.80 -0.46 2.37 1.63 -0.77 -0.24 116.57 120.70 1jcy h LYS 1027Ca 0.18 -0.21 0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1jcy h LYS 1027Cb 0.26 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.77 1jcy h LYS 1027CO -0.01 0.80 0.29 -0.09 -3.45 0.00 0.00 179.45 177.00 1jcy h ARG 1028N 0.68 0.58 -0.28 1.90 2.43 -0.58 -2.26 114.38 116.85 1jcy h ARG 1028Ca 0.15 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 1jcy h ARG 1028Cb 0.39 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1jcy h ARG 1028CO 0.01 0.38 -0.17 -0.07 -1.51 0.00 0.00 179.97 178.61 1jcy h LEU 1029N 0.60 0.49 -1.65 3.80 3.38 -0.92 -2.24 115.31 118.77 1jcy h LEU 1029Ca 0.17 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1jcy h LEU 1029Cb -0.04 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1jcy h LEU 1029CO -0.05 0.68 -0.20 0.77 0.09 0.00 0.00 178.44 179.73 1jcy h SER 1030N 0.45 0.00 0.57 -0.43 4.64 -0.53 0.61 113.55 118.85 1jcy h SER 1030Ca 0.08 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.19 1jcy h SER 1030Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1jcy h SER 1030CO 0.04 0.20 -0.90 -0.33 -0.87 0.00 0.00 176.83 174.97 1jcy h GLU 1031N 0.00 0.22 0.02 4.77 4.39 -0.87 -3.32 114.58 119.79 1jcy h GLU 1031Ca -0.00 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 1jcy h GLU 1031Cb 0.39 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1jcy h GLU 1031CO 0.03 0.98 -0.01 -0.22 -1.16 0.00 0.00 179.01 178.62 1jcy h LYS 1032N 0.12 -0.03 -3.97 2.33 3.64 -0.80 -3.38 116.57 114.48 1jcy h LYS 1032Ca -0.05 0.00 -0.76 0.00 -1.27 0.00 0.00 60.65 58.58 1jcy h LYS 1032Cb 1.53 0.01 -0.18 0.00 -0.41 0.00 0.00 32.23 33.18 1jcy h LYS 1032CO 0.14 0.47 1.55 1.19 -2.27 0.00 0.00 179.45 180.53 1jcy n PHE 1033N -4.72 3.87 0.35 1.91 3.01 0.20 -4.80 117.46 117.28 1jcy n PHE 1033Ca -0.05 -3.08 0.10 0.00 1.01 0.00 0.00 57.45 55.42 1jcy n PHE 1033Cb 0.25 -1.98 0.43 0.00 -0.01 0.00 0.00 39.48 38.17 1jcy n PHE 1033CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1jcy n LYS 1034N 4.31 0.12 0.00 -1.08 5.02 -1.25 -1.83 118.16 123.45 1jcy n LYS 1034Ca 0.36 0.42 0.14 0.00 -2.02 0.00 0.00 58.31 57.22 1jcy n LYS 1034Cb 0.39 -1.77 0.56 0.00 -0.02 0.00 0.00 35.03 34.19 1jcy n LYS 1034CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1jcy n GLU 1035N -2.01 1.04 -4.20 1.97 0.00 -1.26 -4.84 120.64 111.34 1jcy n GLU 1035Ca 0.02 -0.49 -0.34 0.00 0.00 0.00 0.00 57.16 56.35 1jcy n GLU 1035Cb 0.17 -1.49 -0.08 0.00 0.00 0.00 0.00 31.44 30.04 1jcy n GLU 1035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1jcy s VAL 1036N -2.29 4.53 -0.37 3.84 1.01 -0.76 -3.44 120.40 122.92 1jcy s VAL 1036Ca 0.32 -0.36 -0.12 0.00 0.00 0.00 0.00 61.98 61.82 1jcy s VAL 1036Cb 0.20 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.59 1jcy s VAL 1036CO 0.43 0.45 0.22 -0.70 0.00 0.00 0.00 175.10 175.50 1jcy s GLU 1037N -1.40 2.98 0.14 2.72 2.12 0.88 -4.95 118.70 121.19 1jcy s GLU 1037Ca 0.19 -0.98 -0.14 0.00 0.36 0.00 0.00 54.97 54.40 1jcy s GLU 1037Cb -0.12 -3.75 -0.07 0.00 0.26 0.00 0.00 34.13 30.45 1jcy s GLU 1037CO 0.09 -0.65 0.54 -0.06 -0.54 0.00 0.00 175.26 174.64 1jcy s PHE 1038N 1.60 3.60 -0.07 5.30 0.40 -1.26 -1.37 117.98 126.18 1jcy s PHE 1038Ca 0.03 1.03 -0.01 0.00 -0.60 0.00 0.00 56.93 57.38 1jcy s PHE 1038Cb -0.19 -2.35 0.03 0.00 0.51 0.00 0.00 43.02 41.02 1jcy s PHE 1038CO 0.07 0.43 0.01 0.08 0.70 0.00 0.00 175.22 176.52 1jcy s VAL 1039N -1.46 0.31 -0.10 -0.44 1.01 -0.66 -4.14 120.40 114.92 1jcy s VAL 1039Ca 0.37 0.16 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 1jcy s VAL 1039Cb -0.15 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.74 1jcy s VAL 1039CO 0.19 0.25 1.02 0.12 0.00 0.00 0.00 175.10 176.68 1jcy s PHE 1040N 1.98 3.50 0.03 5.22 5.36 0.36 -1.73 117.98 132.71 1jcy s PHE 1040Ca 0.05 1.58 0.09 0.00 -0.96 0.00 0.00 56.93 57.69 1jcy s PHE 1040Cb -0.12 -3.20 -0.03 0.00 -0.34 0.00 0.00 43.02 39.33 1jcy s PHE 1040CO -0.05 -0.28 -0.26 0.21 -1.46 0.00 0.00 175.22 173.38 1jcy s LYS 1041N 1.97 1.84 -0.29 10.12 2.36 -0.46 -1.48 119.74 133.80 1jcy s LYS 1041Ca 0.49 -1.07 -0.17 0.00 -2.55 0.00 0.00 55.97 52.67 1jcy s LYS 1041Cb -0.19 -1.97 0.18 0.00 -1.05 0.00 0.00 37.83 34.80 1jcy s LYS 1041CO 0.19 0.52 1.14 0.45 1.55 0.00 0.00 175.35 179.20 1jcy s SER 1042N -1.12 -0.27 -0.05 1.43 0.15 -1.21 -3.25 113.70 109.39 1jcy s SER 1042Ca 0.11 0.44 -0.27 0.00 0.70 0.00 0.00 55.95 56.93 1jcy s SER 1042Cb -0.10 1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 65.20 1jcy s SER 1042CO 0.01 -0.07 0.87 -0.44 1.20 0.00 0.00 173.24 174.82 1jcy s SER 1043N 1.04 7.18 0.23 5.45 0.01 -0.45 -4.64 113.70 122.52 1jcy s SER 1043Ca -0.07 1.44 0.25 0.00 1.31 0.00 0.00 55.95 58.88 1jcy s SER 1043Cb -0.03 -2.50 0.86 0.00 0.21 0.00 0.00 66.02 64.56 1jcy s SER 1043CO -0.12 -0.25 1.76 2.22 0.41 0.00 0.00 173.24 177.26 1jcy n PHE 1044N 4.12 0.92 -3.67 2.43 1.16 -1.26 -1.58 117.46 119.58 1jcy n PHE 1044Ca 0.04 0.30 -0.08 0.00 -1.87 0.00 0.00 57.45 55.83 1jcy n PHE 1044Cb 0.51 -0.98 -0.09 0.00 -1.61 0.00 0.00 39.48 37.31 1jcy n PHE 1044CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1jcy s ASP 1045N -4.48 -0.75 -0.92 5.98 2.15 -1.26 -3.92 116.67 113.47 1jcy s ASP 1045Ca 0.09 1.23 -0.15 0.00 0.43 0.00 0.00 52.55 54.15 1jcy s ASP 1045Cb 0.11 1.12 0.20 0.00 -0.30 0.00 0.00 42.92 44.05 1jcy s ASP 1045CO 0.54 -0.22 0.97 -0.54 -0.17 0.00 0.00 175.17 175.75 1jcy s LYS 1046N 1.56 3.72 0.00 4.34 -0.14 0.77 -4.86 119.74 125.13 1jcy s LYS 1046Ca -0.10 -2.36 0.31 0.00 -1.36 0.00 0.00 55.97 52.46 1jcy s LYS 1046Cb -0.07 -4.64 1.77 0.00 -1.68 0.00 0.00 37.83 33.21 1jcy s LYS 1046CO -0.17 -1.46 2.15 0.00 -0.76 0.00 0.00 175.35 175.11 1jcy n ALA 1047N 4.70 2.67 -2.19 5.17 0.00 -1.26 -3.97 120.51 125.64 1jcy n ALA 1047Ca 0.20 -0.22 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1jcy n ALA 1047Cb 0.46 -1.47 0.09 0.00 0.00 0.00 0.00 19.45 18.53 1jcy n ALA 1047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1jcy n ASN 1048N -0.87 1.34 -4.66 0.00 2.04 -1.26 -5.09 115.26 106.76 1jcy n ASN 1048Ca 0.23 -2.71 -0.35 0.00 -0.44 0.00 0.00 54.58 51.31 1jcy n ASN 1048Cb 0.13 -0.39 0.10 0.00 -2.53 0.00 0.00 39.78 37.09 1jcy n ASN 1048CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1jcy n ARG 1049N -0.13 0.53 -0.09 -3.83 5.12 -1.25 -4.92 116.66 112.08 1jcy n ARG 1049Ca 0.11 0.24 -0.12 0.00 -1.93 0.00 0.00 57.85 56.15 1jcy n ARG 1049Cb 0.97 -2.36 -0.04 0.00 -1.16 0.00 0.00 32.46 29.87 1jcy n ARG 1049CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1jcy h SER 1050N -0.30 0.64 -2.94 0.55 0.02 -1.97 -3.44 113.55 106.10 1jcy h SER 1050Ca -0.48 -0.43 -0.66 0.00 -0.84 0.00 0.00 61.79 59.38 1jcy h SER 1050Cb 1.32 -0.18 -0.09 0.00 0.14 0.00 0.00 62.40 63.60 1jcy h SER 1050CO 0.48 0.93 -0.54 -0.55 -1.14 0.00 0.00 176.83 176.01 1jcy s SER 1051N -6.34 5.96 0.59 3.07 0.15 -1.21 -4.98 113.70 110.93 1jcy s SER 1051Ca -0.13 0.29 0.37 0.00 0.70 0.00 0.00 55.95 57.18 1jcy s SER 1051Cb 0.08 -1.81 1.73 0.00 -1.71 0.00 0.00 66.02 64.31 1jcy s SER 1051CO 0.80 0.34 2.11 -0.29 1.20 0.00 0.00 173.24 177.40 1jcy h ILE 1052N 3.57 0.00 -0.01 6.45 6.09 -1.92 -2.42 117.51 129.27 1jcy h ILE 1052Ca -0.51 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 62.65 1jcy h ILE 1052Cb 1.20 1.32 0.00 0.00 0.47 0.00 0.00 36.82 39.81 1jcy h ILE 1052CO 0.61 0.00 -0.14 1.41 -3.07 0.00 0.00 178.15 176.95 1jcy n HIS 1053N -3.06 0.00 -2.20 2.19 8.25 -1.26 -4.93 115.22 114.20 1jcy n HIS 1053Ca -0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 1jcy n HIS 1053Cb 0.22 -0.15 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 1jcy n HIS 1053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1jcy s SER 1054N -2.45 6.35 0.29 0.41 0.01 -0.91 -5.02 113.70 112.38 1jcy s SER 1054Ca 0.28 1.34 -0.30 0.00 1.31 0.00 0.00 55.95 58.59 1jcy s SER 1054Cb 0.20 -2.43 -0.11 0.00 0.21 0.00 0.00 66.02 63.89 1jcy s SER 1054CO 0.48 -0.72 1.48 0.12 0.41 0.00 0.00 173.24 175.01 1jcy s PHE 1055N -2.91 2.87 -0.06 2.43 5.36 -1.26 -4.94 117.98 119.47 1jcy s PHE 1055Ca 0.54 1.02 -0.01 0.00 -0.96 0.00 0.00 56.93 57.52 1jcy s PHE 1055Cb -0.11 -3.91 -0.03 0.00 -0.34 0.00 0.00 43.02 38.63 1jcy s PHE 1055CO 0.45 -2.91 -0.06 0.54 -1.46 0.00 0.00 175.22 171.78 1jcy n ARG 1056N 1.80 0.13 -1.19 10.12 1.74 -1.26 -4.73 116.66 123.26 1jcy n ARG 1056Ca 0.05 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1jcy n ARG 1056Cb 0.39 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 1jcy n ARG 1056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jcy n GLY 1057N 2.91 0.10 1.36 -0.13 0.00 -1.26 -0.16 105.19 108.00 1jcy n GLY 1057Ca -0.11 -1.73 -0.04 0.00 0.00 0.00 0.00 46.02 44.14 1jcy n GLY 1057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1jcy n HIS 1058N 4.42 1.52 0.00 1.61 8.25 -1.25 -5.04 115.22 124.73 1jcy n HIS 1058Ca 0.00 -1.39 0.00 0.00 -0.26 0.00 0.00 57.72 56.07 1jcy n HIS 1058Cb 0.00 -0.54 0.00 0.00 1.12 0.00 0.00 29.99 30.57 1jcy n HIS 1058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jcy n GLY 1059N -0.83 -0.78 0.05 -1.41 0.00 -1.25 -4.28 105.19 96.68 1jcy n GLY 1059Ca 0.35 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1jcy n GLY 1059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jcy h LEU 1060N 0.00 0.04 -0.20 0.99 7.12 -1.98 -1.60 115.31 119.68 1jcy h LEU 1060Ca 0.00 -0.04 0.05 0.00 0.13 0.00 0.00 57.88 58.02 1jcy h LEU 1060Cb 0.00 -0.01 -0.07 0.00 -0.53 0.00 0.00 40.66 40.05 1jcy h LEU 1060CO 0.00 0.07 -0.41 -0.08 -0.13 0.00 0.00 178.44 177.89 1jcy h GLU 1061N 0.01 -0.43 -0.62 1.25 4.81 -1.97 0.21 114.58 117.84 1jcy h GLU 1061Ca 0.01 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1jcy h GLU 1061Cb 0.04 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1jcy h GLU 1061CO -0.00 -0.28 0.40 -0.92 -0.73 0.00 0.00 179.01 177.48 1jcy h TYR 1062N -0.44 0.79 0.10 0.92 3.20 -1.73 -2.31 116.97 117.49 1jcy h TYR 1062Ca 0.09 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1jcy h TYR 1062Cb 0.61 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1jcy h TYR 1062CO -0.51 0.51 -0.05 0.78 -1.64 0.00 0.00 178.16 177.25 1jcy h GLY 1063N 0.84 -0.14 1.10 1.82 0.00 -0.38 -0.72 103.07 105.60 1jcy h GLY 1063Ca 0.23 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.60 1jcy h GLY 1063CO -0.05 -0.05 0.52 -2.08 0.00 0.00 0.00 176.54 174.88 1jcy h VAL 1064N -0.14 1.24 -0.33 4.60 2.07 -0.58 -0.02 116.25 123.09 1jcy h VAL 1064Ca -0.01 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1jcy h VAL 1064Cb 0.11 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 1jcy h VAL 1064CO 0.02 0.26 0.20 0.50 0.02 0.00 0.00 177.57 178.57 1jcy h LYS 1065N 1.20 0.46 -0.36 1.57 3.64 -1.15 0.13 116.57 122.06 1jcy h LYS 1065Ca 0.31 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.62 1jcy h LYS 1065Cb -0.04 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1jcy h LYS 1065CO -0.06 0.36 0.12 0.00 -2.27 0.00 0.00 179.45 177.60 1jcy h ALA 1066N 1.07 0.47 -0.86 5.00 0.00 -0.58 -1.70 119.26 122.66 1jcy h ALA 1066Ca 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1jcy h ALA 1066Cb 0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1jcy h ALA 1066CO -0.02 0.10 0.52 -0.07 0.00 0.00 0.00 179.25 179.77 1jcy h LEU 1067N 0.43 1.03 -1.19 0.00 3.38 -0.77 -1.36 115.31 116.83 1jcy h LEU 1067Ca 0.12 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1jcy h LEU 1067Cb 0.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1jcy h LEU 1067CO -0.01 0.79 -0.17 -0.09 0.09 0.00 0.00 178.44 179.05 1jcy h ARG 1068N 1.18 0.36 -0.58 1.13 2.43 -0.43 -1.53 114.38 116.95 1jcy h ARG 1068Ca 0.31 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.30 1jcy h ARG 1068Cb -0.05 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1jcy h ARG 1068CO -0.06 0.53 0.06 -0.22 -1.51 0.00 0.00 179.97 178.77 1jcy h LYS 1069N 0.33 0.98 -0.19 0.20 1.63 -0.34 0.84 116.57 120.01 1jcy h LYS 1069Ca 0.06 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.57 1jcy h LYS 1069Cb 0.49 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.01 1jcy h LYS 1069CO 0.03 0.95 0.10 0.28 -3.45 0.00 0.00 179.45 177.36 1jcy h VAL 1070N 0.88 1.12 -0.77 2.00 2.07 -0.78 0.21 116.25 120.97 1jcy h VAL 1070Ca 0.17 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1jcy h VAL 1070Cb 0.46 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1jcy h VAL 1070CO 0.02 0.12 0.30 0.50 0.02 0.00 0.00 177.57 178.52 1jcy h LYS 1071N 0.19 1.16 -0.28 1.57 3.64 -1.14 -0.74 116.57 120.98 1jcy h LYS 1071Ca 0.07 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 1jcy h LYS 1071Cb 0.10 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1jcy h LYS 1071CO -0.01 0.95 0.01 1.49 -2.27 0.00 0.00 179.45 179.62 1jcy h GLU 1072N 1.12 0.49 -0.01 1.90 4.81 -0.55 0.32 114.58 122.66 1jcy h GLU 1072Ca 0.26 -0.15 -0.25 0.00 -0.13 0.00 0.00 59.36 59.08 1jcy h GLU 1072Cb 0.23 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.58 1jcy h GLU 1072CO -0.02 0.63 -0.99 1.49 -0.73 0.00 0.00 179.01 179.40 1jcy h GLU 1073N 0.28 0.62 -0.00 1.92 4.81 -0.49 -3.37 114.58 118.35 1jcy h GLU 1073Ca 0.08 -0.65 0.00 0.00 -0.13 0.00 0.00 59.36 58.66 1jcy h GLU 1073Cb 0.41 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1jcy h GLU 1073CO 0.01 1.25 -0.36 1.19 -0.73 0.00 0.00 179.01 180.37 1jcy n PHE 1074N -3.83 0.00 -2.60 0.92 3.72 -0.29 -5.00 117.46 110.38 1jcy n PHE 1074Ca -0.09 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.14 1jcy n PHE 1074Cb 0.86 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.41 1jcy n PHE 1074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1jcy n GLY 1075N 1.10 -0.24 3.88 1.37 0.00 0.11 -4.99 105.19 106.42 1jcy n GLY 1075Ca 0.03 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1jcy n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jcy s LEU 1076N -4.85 4.37 0.67 0.99 1.02 -1.24 -5.04 118.68 114.59 1jcy s LEU 1076Ca 0.13 0.59 -0.15 0.00 0.02 0.00 0.00 54.13 54.72 1jcy s LEU 1076Cb -0.06 -2.67 0.00 0.00 0.02 0.00 0.00 46.19 43.49 1jcy s LEU 1076CO 0.16 0.26 1.12 -0.54 0.02 0.00 0.00 176.35 177.37 1jcy s LYS 1077N -1.71 2.72 0.03 1.70 1.02 -1.26 -4.39 119.74 117.86 1jcy s LYS 1077Ca 0.27 1.43 0.07 0.00 0.02 0.00 0.00 55.97 57.76 1jcy s LYS 1077Cb -0.13 -1.94 -0.02 0.00 -0.52 0.00 0.00 37.83 35.22 1jcy s LYS 1077CO 0.16 -1.32 -0.19 0.42 -0.92 0.00 0.00 175.35 173.50 1jcy s ILE 1078N -2.30 1.53 -0.02 2.17 -1.09 -1.26 -0.49 121.20 119.74 1jcy s ILE 1078Ca 0.68 -1.10 -0.03 0.00 -2.23 0.00 0.00 60.65 57.97 1jcy s ILE 1078Cb -0.21 -1.33 0.00 0.00 -1.58 0.00 0.00 42.46 39.34 1jcy s ILE 1078CO 0.42 0.20 0.07 0.28 -1.23 0.00 0.00 174.94 174.68 1jcy s THR 1079N -0.75 0.03 0.14 2.92 -1.32 -0.55 0.72 115.64 116.83 1jcy s THR 1079Ca 0.06 -0.21 -0.18 0.00 -1.21 0.00 0.00 61.69 60.15 1jcy s THR 1079Cb -0.08 -0.17 0.04 0.00 -1.51 0.00 0.00 72.50 70.78 1jcy s THR 1079CO 0.01 -0.12 0.46 0.28 -2.21 0.00 0.00 174.62 173.05 1jcy s THR 1080N -0.35 0.05 0.07 5.08 -1.32 -1.19 -3.28 115.64 114.70 1jcy s THR 1080Ca -0.04 -0.44 0.01 0.00 -1.21 0.00 0.00 61.69 60.00 1jcy s THR 1080Cb -0.03 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.76 1jcy s THR 1080CO 0.00 -0.22 0.20 1.51 -2.21 0.00 0.00 174.62 173.90 1jcy s ASP 1081N -2.80 6.23 0.22 8.08 -4.77 -1.26 -1.29 116.67 121.08 1jcy s ASP 1081Ca 0.03 0.22 0.08 0.00 -3.30 0.00 0.00 52.55 49.58 1jcy s ASP 1081Cb 0.01 -1.88 -0.04 0.00 -1.09 0.00 0.00 42.92 39.92 1jcy s ASP 1081CO -0.11 0.16 -0.01 0.27 0.70 0.00 0.00 175.17 176.18 1jcy s ILE 1082N -1.51 3.57 0.00 2.11 -4.36 -0.91 -4.78 121.20 115.31 1jcy s ILE 1082Ca 0.34 -1.66 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 1jcy s ILE 1082Cb -0.13 -2.84 0.00 0.00 1.25 0.00 0.00 42.46 40.74 1jcy s ILE 1082CO 0.27 -0.23 0.00 1.41 0.24 0.00 0.00 174.94 176.63 1jcy n HIS 1083N -0.47 0.00 -3.96 1.37 8.25 -1.26 -4.36 115.22 114.78 1jcy n HIS 1083Ca -0.08 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.28 1jcy n HIS 1083Cb 0.57 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.58 1jcy n HIS 1083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1jcy s GLU 1084N -1.63 0.43 0.27 -0.41 2.02 -1.26 -5.07 118.70 113.05 1jcy s GLU 1084Ca 0.00 -0.66 -0.01 0.00 0.02 0.00 0.00 54.97 54.33 1jcy s GLU 1084Cb 0.00 0.16 0.59 0.00 0.10 0.00 0.00 34.13 34.98 1jcy s GLU 1084CO 0.00 -0.09 1.70 0.77 0.02 0.00 0.00 175.26 177.66 1jcy h SER 1085N 4.23 0.21 -0.00 -0.19 0.02 -1.91 -1.89 113.55 114.01 1jcy h SER 1085Ca -0.32 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1jcy h SER 1085Cb 1.19 0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.88 1jcy h SER 1085CO 0.45 0.01 0.05 4.11 -1.14 0.00 0.00 176.83 180.32 1jcy h TRP 1086N 0.37 0.00 0.00 3.45 5.08 -1.97 -2.34 115.95 120.53 1jcy h TRP 1086Ca 0.49 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.45 1jcy h TRP 1086Cb 0.86 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.02 1jcy h TRP 1086CO -0.19 0.00 -0.00 1.96 -1.28 0.00 0.00 178.44 178.93 1jcy h GLN 1087N 0.00 0.00 -0.58 0.12 4.20 -1.77 -3.35 115.11 113.73 1jcy h GLN 1087Ca 0.00 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.76 1jcy h GLN 1087Cb 0.11 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.84 1jcy h GLN 1087CO -0.00 0.00 0.32 0.00 -0.67 0.00 0.00 178.83 178.48 1jcy h ALA 1088N 2.00 0.76 0.71 3.87 0.00 -1.57 -1.73 119.26 123.31 1jcy h ALA 1088Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1jcy h ALA 1088Cb 0.90 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.59 1jcy h ALA 1088CO 0.00 0.00 -0.34 1.49 0.00 0.00 0.00 179.25 180.40 1jcy h GLU 1089N 0.61 -0.92 -0.74 0.00 4.81 -1.78 0.59 114.58 117.15 1jcy h GLU 1089Ca 0.25 0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.53 1jcy h GLU 1089Cb 0.13 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1jcy h GLU 1089CO -0.15 -0.59 0.41 -1.00 -0.73 0.00 0.00 179.01 176.94 1jcy h PRO 1090N -1.06 1.02 -0.50 0.92 0.13 -1.76 -2.65 132.00 128.11 1jcy h PRO 1090Ca -0.10 -0.11 -0.11 0.00 -0.87 0.00 0.00 66.00 64.81 1jcy h PRO 1090Cb 0.76 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 1jcy h PRO 1090CO 0.16 0.75 -0.14 0.28 -0.23 0.00 0.00 178.00 178.82 1jcy h VAL 1091N 1.03 1.27 0.00 1.56 2.07 -1.28 -2.72 116.25 118.18 1jcy h VAL 1091Ca 0.26 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.51 1jcy h VAL 1091Cb 0.02 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1jcy h VAL 1091CO -0.04 0.45 0.02 0.00 0.02 0.00 0.00 177.57 178.01 1jcy h ALA 1092N 0.99 1.02 0.00 1.67 0.00 -0.50 -0.31 119.26 122.12 1jcy h ALA 1092Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1jcy h ALA 1092Cb 0.69 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1jcy h ALA 1092CO 0.05 -0.02 -0.20 0.93 0.00 0.00 0.00 179.25 180.01 1jcy h GLU 1093N 0.00 0.00 0.00 0.00 5.08 -1.45 -3.35 114.58 114.86 1jcy h GLU 1093Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1jcy h GLU 1093Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1jcy h GLU 1093CO 0.00 0.20 -0.99 1.55 -1.00 0.00 0.00 179.01 178.78 1jcy n VAL 1094N -3.67 0.00 -2.42 3.13 3.14 -0.53 -5.04 118.33 112.94 1jcy n VAL 1094Ca -0.01 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.94 1jcy n VAL 1094Cb 0.33 -0.71 -0.03 0.00 -1.06 0.00 0.00 33.84 32.37 1jcy n VAL 1094CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1jcy s ALA 1095N -1.99 3.47 0.07 1.55 0.00 -0.24 -4.58 121.76 120.06 1jcy s ALA 1095Ca 0.00 0.72 0.08 0.00 0.00 0.00 0.00 51.96 52.76 1jcy s ALA 1095Cb 0.00 -3.51 -0.19 0.00 0.00 0.00 0.00 23.12 19.43 1jcy s ALA 1095CO 0.00 -0.69 1.22 -0.44 0.00 0.00 0.00 175.76 175.85 1jcy h ASP 1096N 7.32 0.00 -3.26 0.00 3.32 -0.02 -3.44 116.42 120.34 1jcy h ASP 1096Ca -0.37 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.18 1jcy h ASP 1096Cb 1.18 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.37 1jcy h ASP 1096CO 0.86 0.95 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.91 1jcy s ILE 1097N -2.72 0.92 -0.23 0.35 1.01 -0.82 -2.34 121.20 117.37 1jcy s ILE 1097Ca 0.01 -0.26 -0.15 0.00 0.00 0.00 0.00 60.65 60.24 1jcy s ILE 1097Cb 0.10 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1jcy s ILE 1097CO 0.81 0.34 0.38 -0.63 0.00 0.00 0.00 174.94 175.84 1jcy s ILE 1098N 1.47 5.19 -0.07 2.92 1.01 0.30 -3.16 121.20 128.85 1jcy s ILE 1098Ca -0.00 0.64 -0.14 0.00 0.00 0.00 0.00 60.65 61.14 1jcy s ILE 1098Cb -0.13 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 1jcy s ILE 1098CO -0.05 0.22 0.36 -1.58 0.00 0.00 0.00 174.94 173.89 1jcy s GLN 1099N 1.60 4.02 -0.27 2.79 0.74 -0.41 -0.99 119.66 127.14 1jcy s GLN 1099Ca 0.17 0.27 -0.08 0.00 0.05 0.00 0.00 55.36 55.78 1jcy s GLN 1099Cb -0.15 -3.31 -0.02 0.00 1.10 0.00 0.00 33.01 30.64 1jcy s GLN 1099CO 0.08 0.50 0.09 0.42 -0.55 0.00 0.00 175.29 175.82 1jcy s ILE 1100N -0.39 4.26 0.53 -2.34 -1.09 0.70 -2.15 121.20 120.73 1jcy s ILE 1100Ca 0.21 -0.35 -0.21 0.00 -2.23 0.00 0.00 60.65 58.08 1jcy s ILE 1100Cb -0.15 -3.08 -0.07 0.00 -1.58 0.00 0.00 42.46 37.58 1jcy s ILE 1100CO 0.09 0.23 0.95 -2.65 -1.23 0.00 0.00 174.94 172.33 1jcy n PRO 1101N 4.92 1.06 -0.20 2.79 -0.02 -1.26 -1.29 135.00 141.00 1jcy n PRO 1101Ca -0.15 0.40 -0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1jcy n PRO 1101Cb 0.50 -2.09 0.10 0.00 -0.02 0.00 0.00 33.50 31.99 1jcy n PRO 1101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jcy h ALA 1102N 0.89 0.78 0.00 3.55 0.00 -1.89 -1.10 119.26 121.49 1jcy h ALA 1102Ca -0.47 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1jcy h ALA 1102Cb 1.35 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1jcy h ALA 1102CO 0.53 -0.17 -0.06 0.74 0.00 0.00 0.00 179.25 180.29 1jcy h PHE 1103N 0.43 0.00 -0.59 0.00 0.04 -1.91 -2.97 116.94 111.93 1jcy h PHE 1103Ca 0.30 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.07 1jcy h PHE 1103Cb 0.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 1jcy h PHE 1103CO -0.16 0.06 0.00 1.28 -0.60 0.00 0.00 178.31 178.89 1jcy n LEU 1104N -3.28 3.76 0.01 1.54 4.77 -0.46 -4.61 117.00 118.73 1jcy n LEU 1104Ca -0.01 -2.09 0.02 0.00 -0.03 0.00 0.00 56.01 53.89 1jcy n LEU 1104Cb 0.24 -0.43 0.09 0.00 -2.33 0.00 0.00 43.42 40.99 1jcy n LEU 1104CO 0.27 0.88 0.56 0.00 -1.33 0.00 0.00 177.39 177.77 1jcy n ARG 1106N -1.54 1.68 -2.37 0.00 5.12 -1.26 -4.92 116.66 113.37 1jcy n ARG 1106Ca 0.01 -0.82 -0.39 0.00 -1.93 0.00 0.00 57.85 54.71 1jcy n ARG 1106Cb 0.03 -1.18 -0.03 0.00 -1.16 0.00 0.00 32.46 30.12 1jcy n ARG 1106CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1jcy s GLN 1107N -1.48 3.05 0.22 5.56 -1.52 -0.57 -4.89 119.66 120.03 1jcy s GLN 1107Ca 0.12 -0.17 -0.11 0.00 -1.95 0.00 0.00 55.36 53.24 1jcy s GLN 1107Cb 0.10 -4.53 0.31 0.00 -0.22 0.00 0.00 33.01 28.68 1jcy s GLN 1107CO 0.28 -2.44 1.63 1.15 -0.25 0.00 0.00 175.29 175.67 1jcy h THR 1108N 6.51 0.37 -0.15 -0.19 2.02 -1.91 -1.58 112.91 117.98 1jcy h THR 1108Ca -0.15 -0.02 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 1jcy h THR 1108Cb 1.07 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1jcy h THR 1108CO 1.28 0.01 -0.13 0.44 0.37 0.00 0.00 175.52 177.50 1jcy h ASP 1109N 0.05 0.22 -0.09 4.18 3.32 -1.99 -1.27 116.42 120.84 1jcy h ASP 1109Ca 0.35 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.31 1jcy h ASP 1109Cb 0.56 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 1jcy h ASP 1109CO -0.65 0.38 -0.10 0.25 -1.72 0.00 0.00 179.24 177.40 1jcy h LEU 1110N 0.23 0.24 -0.67 1.55 5.85 -1.68 -0.44 115.31 120.39 1jcy h LEU 1110Ca 0.05 -0.50 0.02 0.00 0.84 0.00 0.00 57.88 58.28 1jcy h LEU 1110Cb 0.37 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1jcy h LEU 1110CO 0.02 0.69 0.43 -0.07 -0.34 0.00 0.00 178.44 179.18 1jcy h LEU 1111N -0.20 0.72 -0.70 2.25 3.38 -1.26 -1.69 115.31 117.81 1jcy h LEU 1111Ca 0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1jcy h LEU 1111Cb 0.63 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1jcy h LEU 1111CO 0.02 0.51 0.15 -0.07 0.09 0.00 0.00 178.44 179.15 1jcy h LEU 1112N 0.86 1.08 -0.82 1.67 4.07 -1.21 -0.77 115.31 120.18 1jcy h LEU 1112Ca 0.26 -0.24 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 1jcy h LEU 1112Cb -0.04 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.37 1jcy h LEU 1112CO -0.08 1.04 0.50 0.00 -1.08 0.00 0.00 178.44 178.82 1jcy h ALA 1113N 1.08 1.05 -0.13 1.53 0.00 -0.53 -2.43 119.26 119.82 1jcy h ALA 1113Ca 0.22 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1jcy h ALA 1113Cb 0.40 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1jcy h ALA 1113CO 0.01 0.51 -0.11 0.00 0.00 0.00 0.00 179.25 179.66 1jcy h ALA 1114N 1.27 0.19 -0.98 0.00 0.00 -1.09 -3.31 119.26 115.35 1jcy h ALA 1114Ca 0.30 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1jcy h ALA 1114Cb -0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 1jcy h ALA 1114CO -0.06 0.03 0.62 0.00 0.00 0.00 0.00 179.25 179.84 1jcy h ALA 1115N 0.62 1.41 0.00 0.00 0.00 -0.90 -2.48 119.26 117.90 1jcy h ALA 1115Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1jcy h ALA 1115Cb 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1jcy h ALA 1115CO 0.03 0.31 0.00 0.36 0.00 0.00 0.00 179.25 179.94 1jcy n LYS 1116N -4.58 0.10 0.16 0.00 2.85 -0.94 -2.90 118.16 112.85 1jcy n LYS 1116Ca 0.16 0.12 0.13 0.00 -1.05 0.00 0.00 58.31 57.67 1jcy n LYS 1116Cb 0.26 -1.50 0.46 0.00 -0.65 0.00 0.00 35.03 33.60 1jcy n LYS 1116CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1jcy h THR 1117N 0.00 0.00 0.00 0.58 1.35 -1.55 -3.46 112.91 109.83 1jcy h THR 1117Ca 0.00 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1jcy h THR 1117Cb 0.32 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 1jcy h THR 1117CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1jcy n GLY 1118N 0.55 1.22 3.91 5.82 0.00 -1.14 -5.04 105.19 110.51 1jcy n GLY 1118Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1jcy n GLY 1118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jcy s ARG 1119N -0.31 3.07 0.57 1.61 1.81 -1.26 -4.92 118.95 119.52 1jcy s ARG 1119Ca 0.00 0.13 -0.18 0.00 -1.72 0.00 0.00 55.73 53.96 1jcy s ARG 1119Cb 0.00 -2.25 -0.04 0.00 -0.45 0.00 0.00 34.95 32.20 1jcy s ARG 1119CO 0.00 -0.64 1.10 0.00 -0.68 0.00 0.00 175.30 175.08 1jcy s ALA 1120N -3.00 2.68 -0.06 2.13 0.00 -0.99 -4.74 121.76 117.77 1jcy s ALA 1120Ca 0.53 0.64 0.02 0.00 0.00 0.00 0.00 51.96 53.16 1jcy s ALA 1120Cb -0.11 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.72 1jcy s ALA 1120CO 0.46 -0.83 -0.13 0.08 0.00 0.00 0.00 175.76 175.35 1jcy s VAL 1121N -2.07 1.16 -0.22 0.00 1.01 -0.31 -0.54 120.40 119.43 1jcy s VAL 1121Ca 0.69 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 62.18 1jcy s VAL 1121Cb -0.20 -1.05 0.03 0.00 0.00 0.00 0.00 36.38 35.15 1jcy s VAL 1121CO 0.31 0.36 -0.14 0.21 0.00 0.00 0.00 175.10 175.84 1jcy s ASN 1122N 0.62 3.76 -0.24 3.32 2.47 -0.16 -0.72 114.94 124.00 1jcy s ASN 1122Ca -0.14 -0.85 -0.09 0.00 0.42 0.00 0.00 52.86 52.20 1jcy s ASN 1122Cb -0.16 -1.55 -0.04 0.00 -1.45 0.00 0.00 41.25 38.05 1jcy s ASN 1122CO 0.04 -0.07 0.11 -0.69 -3.72 0.00 0.00 177.10 172.77 1jcy s VAL 1123N 1.27 4.88 0.05 -5.21 1.01 -0.15 -0.22 120.40 122.03 1jcy s VAL 1123Ca 0.01 0.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.70 1jcy s VAL 1123Cb -0.15 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 1jcy s VAL 1123CO -0.09 0.35 1.18 -0.54 0.00 0.00 0.00 175.10 176.00 1jcy s LYS 1124N 1.22 4.44 -0.01 2.72 -0.14 -0.41 -0.78 119.74 126.78 1jcy s LYS 1124Ca 0.06 1.73 -0.30 0.00 -1.36 0.00 0.00 55.97 56.10 1jcy s LYS 1124Cb -0.14 -3.36 -0.05 0.00 -1.68 0.00 0.00 37.83 32.59 1jcy s LYS 1124CO 0.05 -0.24 1.41 0.21 -0.76 0.00 0.00 175.35 176.02 1jcy s LYS 1125N 1.08 4.27 0.42 1.68 2.20 0.25 -4.06 119.74 125.58 1jcy s LYS 1125Ca 0.58 1.97 -0.25 0.00 -0.36 0.00 0.00 55.97 57.91 1jcy s LYS 1125Cb -0.28 -3.60 -0.10 0.00 -1.51 0.00 0.00 37.83 32.34 1jcy s LYS 1125CO 0.29 -0.59 1.25 0.41 -0.36 0.00 0.00 175.35 176.34 1jcy n GLY 1126N 3.67 0.47 0.11 5.54 0.00 -1.24 -4.57 105.19 109.17 1jcy n GLY 1126Ca 0.13 0.19 0.09 0.00 0.00 0.00 0.00 46.02 46.43 1jcy n GLY 1126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jcy n GLN 1127N 0.06 0.11 0.00 1.61 3.00 -1.26 -1.26 117.38 119.64 1jcy n GLN 1127Ca 0.07 0.52 0.10 0.00 -0.01 0.00 0.00 57.00 57.68 1jcy n GLN 1127Cb 0.39 -1.80 -0.08 0.00 0.00 0.00 0.00 30.24 28.76 1jcy n GLN 1127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1jcy n PHE 1128N -2.03 0.00 -3.32 1.08 -1.74 -1.26 -1.38 117.46 108.81 1jcy n PHE 1128Ca 0.00 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.51 1jcy n PHE 1128Cb 0.09 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.03 1jcy n PHE 1128CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1jcy s LEU 1129N -2.78 4.47 0.40 5.98 2.96 -0.39 -5.06 118.68 124.26 1jcy s LEU 1129Ca 0.12 1.13 -0.16 0.00 -0.22 0.00 0.00 54.13 54.99 1jcy s LEU 1129Cb 0.16 -2.80 -0.09 0.00 0.50 0.00 0.00 46.19 43.96 1jcy s LEU 1129CO 0.74 0.23 0.85 0.00 -1.32 0.00 0.00 176.35 176.85 1jcy s ALA 1130N -0.77 3.20 0.21 5.97 0.00 -1.26 -4.87 121.76 124.24 1jcy s ALA 1130Ca 0.28 0.13 -0.10 0.00 0.00 0.00 0.00 51.96 52.27 1jcy s ALA 1130Cb -0.18 -2.93 0.28 0.00 0.00 0.00 0.00 23.12 20.29 1jcy s ALA 1130CO 0.16 0.12 1.71 -1.35 0.00 0.00 0.00 175.76 176.41 1jcy h PRO 1131N 1.77 0.26 0.00 0.00 0.11 -1.97 -1.60 132.00 130.57 1jcy h PRO 1131Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1jcy h PRO 1131Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1jcy h PRO 1131CO 0.63 0.17 0.00 0.11 -0.21 0.00 0.00 178.00 178.70 1jcy h TRP 1132N 0.27 0.00 -0.01 0.65 0.09 -1.93 -2.59 115.95 112.43 1jcy h TRP 1132Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.29 1jcy h TRP 1132Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.68 1jcy h TRP 1132CO -0.24 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.04 1jcy n ASP 1133N -2.79 0.36 0.03 0.11 8.00 -0.60 -3.04 116.55 118.62 1jcy n ASP 1133Ca -0.00 -1.20 0.13 0.00 0.71 0.00 0.00 54.79 54.43 1jcy n ASP 1133Cb 0.18 -0.01 0.45 0.00 -0.02 0.00 0.00 41.12 41.72 1jcy n ASP 1133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1jcy n THR 1134N -0.68 0.15 -0.24 -3.53 -2.24 -0.97 -3.60 114.28 103.16 1jcy n THR 1134Ca 0.21 -0.08 -0.04 0.00 -2.27 0.00 0.00 64.05 61.87 1jcy n THR 1134Cb 0.16 -0.30 0.07 0.00 -2.10 0.00 0.00 70.33 68.15 1jcy n THR 1134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1jcy h LYS 1135N 0.00 0.83 0.00 -0.78 3.64 -1.75 -1.64 116.57 116.87 1jcy h LYS 1135Ca 0.00 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1jcy h LYS 1135Cb 0.57 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1jcy h LYS 1135CO 0.00 0.55 -0.41 -0.91 -2.27 0.00 0.00 179.45 176.40 1jcy h ASN 1136N 0.85 0.00 -0.35 4.20 2.35 -1.82 -1.50 115.58 119.31 1jcy h ASN 1136Ca 0.27 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.98 1jcy h ASN 1136Cb -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1jcy h ASN 1136CO -0.10 0.41 0.04 0.58 -1.65 0.00 0.00 177.43 176.72 1jcy h VAL 1137N 0.00 1.24 -0.38 2.81 2.07 -1.50 -0.77 116.25 119.72 1jcy h VAL 1137Ca -0.00 -0.87 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 1jcy h VAL 1137Cb 0.79 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1jcy h VAL 1137CO 0.05 0.29 -0.16 0.58 0.02 0.00 0.00 177.57 178.36 1jcy h VAL 1138N 0.42 1.26 -0.46 2.57 2.07 -1.13 -2.47 116.25 118.50 1jcy h VAL 1138Ca 0.11 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 1jcy h VAL 1138Cb 0.38 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1jcy h VAL 1138CO 0.01 0.40 0.25 -0.08 0.02 0.00 0.00 177.57 178.17 1jcy h GLU 1139N 0.62 0.65 -0.39 1.57 4.81 -0.94 -0.42 114.58 120.49 1jcy h GLU 1139Ca 0.10 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1jcy h GLU 1139Cb 0.62 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1jcy h GLU 1139CO 0.04 0.51 0.20 0.87 -0.73 0.00 0.00 179.01 179.91 1jcy h LYS 1140N 0.61 0.40 -0.21 1.92 1.57 -0.90 -0.13 116.57 119.83 1jcy h LYS 1140Ca 0.16 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1jcy h LYS 1140Cb 0.05 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1jcy h LYS 1140CO -0.03 0.26 0.13 -0.07 -0.57 0.00 0.00 179.45 179.18 1jcy h LEU 1141N 0.41 0.26 -1.05 2.94 3.38 -1.08 -0.27 115.31 119.89 1jcy h LEU 1141Ca 0.16 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1jcy h LEU 1141Cb 0.06 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1jcy h LEU 1141CO -0.11 0.23 0.56 0.11 0.09 0.00 0.00 178.44 179.32 1jcy h LYS 1142N 0.26 1.21 -0.86 1.13 1.57 -0.82 -0.34 116.57 118.73 1jcy h LYS 1142Ca 0.08 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1jcy h LYS 1142Cb 0.02 -0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.02 1jcy h LYS 1142CO -0.01 0.83 0.55 0.35 -0.57 0.00 0.00 179.45 180.59 1jcy h PHE 1143N 1.24 1.10 -0.08 -1.35 3.57 -0.57 -1.91 116.94 118.94 1jcy h PHE 1143Ca 0.33 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.84 1jcy h PHE 1143Cb -0.09 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.29 1jcy h PHE 1143CO 0.00 0.71 0.00 0.41 -2.23 0.00 0.00 178.31 177.20 1jcy n GLY 1144N -1.35 -0.55 0.32 2.40 0.00 -0.15 -4.90 105.19 100.96 1jcy n GLY 1144Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1jcy n GLY 1144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcy n GLY 1145N 0.79 0.53 3.72 -0.02 0.00 -0.72 -3.02 105.19 106.47 1jcy n GLY 1145Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1jcy n GLY 1145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcy s ALA 1146N -2.20 3.59 -0.08 4.61 0.00 -0.45 -4.88 121.76 122.36 1jcy s ALA 1146Ca 0.00 1.12 0.13 0.00 0.00 0.00 0.00 51.96 53.21 1jcy s ALA 1146Cb 0.00 -3.54 -0.19 0.00 0.00 0.00 0.00 23.12 19.39 1jcy s ALA 1146CO 0.00 -0.61 0.18 1.63 0.00 0.00 0.00 175.76 176.95 1jcy n LYS 1147N 3.91 1.15 -4.03 0.00 5.02 -1.26 -4.32 118.16 118.63 1jcy n LYS 1147Ca 0.11 -0.07 -0.31 0.00 -2.02 0.00 0.00 58.31 56.02 1jcy n LYS 1147Cb 0.42 -1.34 -0.15 0.00 -0.02 0.00 0.00 35.03 33.94 1jcy n LYS 1147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1jcy s GLU 1148N -2.65 1.90 -0.03 1.97 2.12 -1.26 -5.10 118.70 115.64 1jcy s GLU 1148Ca -0.06 -1.42 0.07 0.00 0.36 0.00 0.00 54.97 53.92 1jcy s GLU 1148Cb 0.06 -2.90 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 1jcy s GLU 1148CO 0.57 -0.68 -0.25 0.42 -0.54 0.00 0.00 175.26 174.78 1jcy s ILE 1149N 1.11 2.01 0.07 -3.70 1.01 -1.26 -1.17 121.20 119.27 1jcy s ILE 1149Ca -0.03 -1.07 0.07 0.00 0.00 0.00 0.00 60.65 59.62 1jcy s ILE 1149Cb -0.19 -1.68 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1jcy s ILE 1149CO -0.07 0.56 -0.18 -0.31 0.00 0.00 0.00 174.94 174.95 1jcy s TYR 1150N -0.42 1.59 -0.11 3.97 1.51 0.10 -2.79 117.35 121.20 1jcy s TYR 1150Ca 0.04 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.74 1jcy s TYR 1150Cb -0.11 -0.91 0.01 0.00 -0.11 0.00 0.00 41.96 40.83 1jcy s TYR 1150CO 0.01 0.11 -0.22 -0.51 -1.11 0.00 0.00 175.55 173.83 1jcy s LEU 1151N -1.52 2.05 -0.19 -1.29 1.43 -0.39 -0.98 118.68 117.80 1jcy s LEU 1151Ca 0.04 -0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 52.54 1jcy s LEU 1151Cb -0.09 -1.37 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 1jcy s LEU 1151CO 0.03 0.12 -0.01 -0.89 0.23 0.00 0.00 176.35 175.82 1jcy s THR 1152N 0.56 3.94 -0.18 5.49 2.01 0.04 -0.93 115.64 126.57 1jcy s THR 1152Ca -0.14 -0.32 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 1jcy s THR 1152Cb -0.17 -2.77 -0.00 0.00 0.01 0.00 0.00 72.50 69.57 1jcy s THR 1152CO 0.04 0.44 1.00 -0.70 -0.69 0.00 0.00 174.62 174.71 1jcy s GLU 1153N 0.86 4.32 -0.05 4.92 2.56 0.66 -0.59 118.70 131.39 1jcy s GLU 1153Ca 0.01 1.32 0.16 0.00 0.00 0.00 0.00 54.97 56.46 1jcy s GLU 1153Cb -0.14 -3.60 0.30 0.00 2.00 0.00 0.00 34.13 32.68 1jcy s GLU 1153CO 0.02 -0.48 1.13 2.89 -0.56 0.00 0.00 175.26 178.26 1jcy n ARG 1154N 5.72 0.38 0.00 4.30 -4.01 -1.26 -0.87 116.66 120.92 1jcy n ARG 1154Ca 0.10 -1.99 0.00 0.00 -1.04 0.00 0.00 57.85 54.92 1jcy n ARG 1154Cb 0.47 -0.55 0.00 0.00 -3.04 0.00 0.00 32.46 29.35 1jcy n ARG 1154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1jcy n GLY 1155N -0.09 0.70 3.16 2.89 0.00 -1.26 -3.90 105.19 106.69 1jcy n GLY 1155Ca 0.07 -1.77 -0.21 0.00 0.00 0.00 0.00 46.02 44.11 1jcy n GLY 1155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jcy s THR 1156N -2.87 1.21 -0.01 2.61 2.01 0.23 -4.35 115.64 114.47 1jcy s THR 1156Ca 0.00 -1.06 -0.35 0.00 0.31 0.00 0.00 61.69 60.59 1jcy s THR 1156Cb 0.00 -1.09 -0.13 0.00 0.01 0.00 0.00 72.50 71.29 1jcy s THR 1156CO 0.00 0.02 1.73 0.41 -0.69 0.00 0.00 174.62 176.08 1jcy n THR 1157N 1.83 0.32 -3.61 -0.82 -1.04 -0.48 -1.33 114.28 109.15 1jcy n THR 1157Ca -0.18 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.05 61.48 1jcy n THR 1157Cb 0.54 -1.63 -0.13 0.00 -1.82 0.00 0.00 70.33 67.30 1jcy n THR 1157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1jcy s PHE 1158N 2.68 1.46 0.00 -1.42 5.36 -0.57 -4.84 117.98 120.66 1jcy s PHE 1158Ca 0.88 -2.09 0.00 0.00 -0.96 0.00 0.00 56.93 54.76 1jcy s PHE 1158Cb -0.74 -1.49 0.00 0.00 -0.34 0.00 0.00 43.02 40.45 1jcy s PHE 1158CO 0.48 -0.80 0.00 0.41 -1.46 0.00 0.00 175.22 173.84 1jcy n GLY 1159N 3.76 -0.91 3.81 13.12 0.00 -1.26 -4.26 105.19 119.45 1jcy n GLY 1159Ca 0.10 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 1jcy n GLY 1159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jcy s TYR 1160N 0.00 3.77 -1.50 1.61 2.02 -1.26 -4.27 117.35 117.71 1jcy s TYR 1160Ca 0.00 1.34 -0.13 0.00 -0.37 0.00 0.00 57.07 57.91 1jcy s TYR 1160Cb 0.00 -2.56 0.09 0.00 -0.40 0.00 0.00 41.96 39.09 1jcy s TYR 1160CO 0.00 0.50 0.80 0.09 -1.57 0.00 0.00 175.55 175.37 1jcy n ASN 1161N 1.34 -4.40 -3.65 2.29 3.02 -1.26 -4.95 115.26 107.65 1jcy n ASN 1161Ca -0.07 -0.69 -0.15 0.00 -0.03 0.00 0.00 54.58 53.65 1jcy n ASN 1161Cb 0.51 -3.56 -0.08 0.00 -0.61 0.00 0.00 39.78 36.04 1jcy n ASN 1161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1jcy s ASN 1162N -3.11 -0.49 0.05 6.41 3.04 -1.26 -4.11 114.94 115.48 1jcy s ASN 1162Ca 0.59 0.66 0.06 0.00 0.04 0.00 0.00 52.86 54.22 1jcy s ASN 1162Cb -0.30 0.67 -0.03 0.00 -1.54 0.00 0.00 41.25 40.06 1jcy s ASN 1162CO 0.73 -0.42 -0.18 -0.76 -3.04 0.00 0.00 177.10 173.44 1jcy s LEU 1163N -0.71 2.20 0.09 3.21 1.43 -1.26 -1.51 118.68 122.13 1jcy s LEU 1163Ca -0.08 -0.53 0.08 0.00 -1.03 0.00 0.00 54.13 52.58 1jcy s LEU 1163Cb -0.03 -0.78 -0.03 0.00 0.03 0.00 0.00 46.19 45.38 1jcy s LEU 1163CO 0.05 0.08 -0.22 0.54 0.23 0.00 0.00 176.35 177.03 1jcy s VAL 1164N -0.91 1.79 -0.30 -1.59 0.11 -0.44 -4.85 120.40 114.21 1jcy s VAL 1164Ca 0.04 -1.49 -0.10 0.00 -2.93 0.00 0.00 61.98 57.50 1jcy s VAL 1164Cb -0.09 -1.60 -0.02 0.00 -1.53 0.00 0.00 36.38 33.14 1jcy s VAL 1164CO 0.02 0.03 0.15 -0.69 -3.33 0.00 0.00 175.10 171.28 1jcy s VAL 1165N -1.06 4.69 -0.75 2.04 1.01 -1.26 -0.60 120.40 124.47 1jcy s VAL 1165Ca 0.08 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 1jcy s VAL 1165Cb -0.10 -3.34 0.14 0.00 0.00 0.00 0.00 36.38 33.08 1jcy s VAL 1165CO 0.04 0.13 0.84 -0.62 0.00 0.00 0.00 175.10 175.48 1jcy s ASP 1166N 1.64 6.46 0.00 3.32 -1.08 -1.26 -4.91 116.67 120.85 1jcy s ASP 1166Ca 0.05 -1.95 0.01 0.00 -0.52 0.00 0.00 52.55 50.15 1jcy s ASP 1166Cb -0.17 -2.30 0.06 0.00 -1.46 0.00 0.00 42.92 39.05 1jcy s ASP 1166CO 0.07 -0.95 0.97 0.49 0.52 0.00 0.00 175.17 176.26 1jcy n PHE 1167N 5.74 0.00 0.29 -5.34 3.01 -1.26 -0.96 117.46 118.94 1jcy n PHE 1167Ca 0.06 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.69 1jcy n PHE 1167Cb 0.45 -0.42 0.82 0.00 -0.01 0.00 0.00 39.48 40.33 1jcy n PHE 1167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jcy h ARG 1168N 0.00 0.00 -0.12 -1.08 3.08 -2.03 -2.67 114.38 111.56 1jcy h ARG 1168Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1jcy h ARG 1168Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1jcy h ARG 1168CO 0.00 0.05 -0.10 0.66 -1.07 0.00 0.00 179.97 179.50 1jcy h SER 1169N 0.00 0.17 0.37 7.04 4.64 -1.47 -2.93 113.55 121.37 1jcy h SER 1169Ca -0.00 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1jcy h SER 1169Cb 0.35 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1jcy h SER 1169CO 0.01 0.30 -0.25 -0.07 -0.87 0.00 0.00 176.83 175.95 1jcy h LEU 1170N 0.18 -0.63 -1.03 5.97 4.07 -1.69 -0.19 115.31 121.99 1jcy h LEU 1170Ca 0.04 0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.96 1jcy h LEU 1170Cb 0.30 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 1jcy h LEU 1170CO 0.02 -0.39 -0.37 1.55 -1.08 0.00 0.00 178.44 178.17 1jcy h PRO 1171N -0.60 0.00 0.25 1.13 0.13 -1.74 -2.16 132.00 129.01 1jcy h PRO 1171Ca -0.04 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1jcy h PRO 1171Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 1jcy h PRO 1171CO 0.03 0.37 -0.12 0.82 -0.23 0.00 0.00 178.00 178.87 1jcy h ILE 1172N 0.00 0.79 0.00 -3.56 2.04 -1.31 -3.14 117.51 112.32 1jcy h ILE 1172Ca -0.00 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1jcy h ILE 1172Cb 0.84 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1jcy h ILE 1172CO 0.05 0.14 -0.16 0.24 0.00 0.00 0.00 178.15 178.42 1jcy h MET 1173N -0.71 0.00 -0.02 2.37 2.86 -1.05 -2.05 114.93 116.33 1jcy h MET 1173Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1jcy h MET 1173Cb 0.49 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1jcy h MET 1173CO 0.06 0.16 0.10 -0.22 1.06 0.00 0.00 176.91 178.06 1jcy h LYS 1174N 0.00 0.00 -0.03 1.72 1.63 -1.34 -1.67 116.57 116.88 1jcy h LYS 1174Ca -0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 1jcy h LYS 1174Cb 0.30 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.92 1jcy h LYS 1174CO 0.02 0.00 -0.05 1.96 -3.45 0.00 0.00 179.45 177.93 1jcy h GLN 1175N 0.00 0.04 0.00 1.90 4.20 -1.42 -3.31 115.11 116.52 1jcy h GLN 1175Ca 0.01 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1jcy h GLN 1175Cb 0.20 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1jcy h GLN 1175CO -0.00 0.10 0.00 -2.67 -0.67 0.00 0.00 178.83 175.59 1jcy n TRP 1176N -4.46 0.00 -3.68 2.96 2.14 -0.66 -5.10 117.44 108.64 1jcy n TRP 1176Ca -0.02 -0.08 -0.05 0.00 2.07 0.00 0.00 57.50 59.42 1jcy n TRP 1176Cb 0.14 -0.01 -0.01 0.00 -0.81 0.00 0.00 31.31 30.62 1jcy n TRP 1176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1jcy s ALA 1177N -0.16 -1.73 0.33 -1.67 0.00 -1.00 -4.98 121.76 112.54 1jcy s ALA 1177Ca 0.00 0.39 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 1jcy s ALA 1177Cb 0.00 0.57 -0.09 0.00 0.00 0.00 0.00 23.12 23.59 1jcy s ALA 1177CO 0.00 -0.95 1.04 0.15 0.00 0.00 0.00 175.76 176.00 1jcy s LYS 1178N -3.20 4.47 -0.12 0.00 1.02 -1.12 -4.08 119.74 116.71 1jcy s LYS 1178Ca 0.10 1.59 -0.02 0.00 0.02 0.00 0.00 55.97 57.67 1jcy s LYS 1178Cb -0.01 -2.90 -0.03 0.00 -0.52 0.00 0.00 37.83 34.38 1jcy s LYS 1178CO -0.01 0.12 -0.07 0.08 -0.92 0.00 0.00 175.35 174.55 1jcy s VAL 1179N -1.42 3.65 -0.05 3.17 1.01 -1.26 -1.26 120.40 124.24 1jcy s VAL 1179Ca 0.50 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 62.07 1jcy s VAL 1179Cb -0.26 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 1jcy s VAL 1179CO 0.32 0.53 -0.22 -0.63 0.00 0.00 0.00 175.10 175.11 1jcy s ILE 1180N 0.02 2.40 -0.25 2.22 -1.09 -0.10 0.05 121.20 124.45 1jcy s ILE 1180Ca -0.01 -0.96 -0.09 0.00 -2.23 0.00 0.00 60.65 57.37 1jcy s ILE 1180Cb -0.14 -1.89 -0.04 0.00 -1.58 0.00 0.00 42.46 38.82 1jcy s ILE 1180CO 0.03 0.58 0.11 -0.47 -1.23 0.00 0.00 174.94 173.96 1jcy s TYR 1181N -0.45 3.16 -0.77 3.97 5.04 -0.43 -0.25 117.35 127.62 1jcy s TYR 1181Ca 0.05 -0.16 -0.23 0.00 -2.44 0.00 0.00 57.07 54.29 1jcy s TYR 1181Cb -0.12 -2.26 0.07 0.00 0.35 0.00 0.00 41.96 40.01 1jcy s TYR 1181CO 0.01 -0.21 1.10 0.34 -1.34 0.00 0.00 175.55 175.46 1jcy s ASP 1182N 1.45 6.30 0.48 4.32 -1.08 -0.05 -0.23 116.67 127.85 1jcy s ASP 1182Ca 0.06 -1.17 0.26 0.00 -0.52 0.00 0.00 52.55 51.18 1jcy s ASP 1182Cb -0.15 -2.45 1.14 0.00 -1.46 0.00 0.00 42.92 40.00 1jcy s ASP 1182CO 0.05 -1.44 1.92 0.00 0.52 0.00 0.00 175.17 176.23 1jcy h ALA 1183N 9.52 1.10 0.02 3.66 0.00 -1.38 -3.11 119.26 129.07 1jcy h ALA 1183Ca -0.14 -0.16 -0.36 0.00 0.00 0.00 0.00 54.91 54.24 1jcy h ALA 1183Cb 1.05 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 1jcy h ALA 1183CO 1.21 0.22 -2.25 0.25 0.00 0.00 0.00 179.25 178.68 1jcy n THR 1184N -3.46 1.51 0.15 0.00 -2.24 -1.26 -4.41 114.28 104.58 1jcy n THR 1184Ca -0.01 -0.73 0.04 0.00 -2.27 0.00 0.00 64.05 61.08 1jcy n THR 1184Cb 0.35 -1.04 0.05 0.00 -2.10 0.00 0.00 70.33 67.60 1jcy n THR 1184CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1jcy h HIS 1185N 0.01 0.00 0.00 4.78 3.86 -1.91 -3.26 115.15 118.64 1jcy h HIS 1185Ca -0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 1jcy h HIS 1185Cb 2.07 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.54 1jcy h HIS 1185CO 0.02 0.44 0.00 0.77 0.86 0.00 0.00 177.93 180.02 1jcy h SER 1186N 0.00 0.00 -0.06 2.45 0.02 -1.65 -2.50 113.55 111.80 1jcy h SER 1186Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jcy h SER 1186Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1jcy h SER 1186CO 0.06 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.08 1jcy n VAL 1187N -2.73 0.09 -2.01 2.27 0.24 -1.23 -4.72 118.33 110.23 1jcy n VAL 1187Ca -0.00 -0.54 -0.33 0.00 -2.04 0.00 0.00 64.34 61.42 1jcy n VAL 1187Cb 0.17 1.28 0.02 0.00 -1.47 0.00 0.00 33.84 33.84 1jcy n VAL 1187CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jcy s GLN 1188N -1.38 3.16 -0.51 7.34 -2.07 -0.94 -2.54 119.66 122.73 1jcy s GLN 1188Ca 0.21 1.36 -0.05 0.00 -1.82 0.00 0.00 55.36 55.06 1jcy s GLN 1188Cb 0.14 -2.00 0.13 0.00 -1.09 0.00 0.00 33.01 30.20 1jcy s GLN 1188CO 0.21 -0.96 0.34 -0.51 -1.32 0.00 0.00 175.29 173.06 1jcy s LEU 1189N -4.43 5.46 -0.19 2.60 1.43 0.30 -4.33 118.68 119.52 1jcy s LEU 1189Ca 0.67 -2.25 -0.41 0.00 -1.03 0.00 0.00 54.13 51.10 1jcy s LEU 1189Cb -0.19 -1.91 -0.18 0.00 0.03 0.00 0.00 46.19 43.94 1jcy s LEU 1189CO 0.35 -0.54 1.46 -2.65 0.23 0.00 0.00 176.35 175.21 1jcy n PRO 1190N 4.35 0.59 -1.31 1.29 -0.02 -1.26 0.80 135.00 139.45 1jcy n PRO 1190Ca -0.00 0.22 -0.12 0.00 -2.02 0.00 0.00 63.50 61.57 1jcy n PRO 1190Cb 0.40 -1.80 -0.05 0.00 -0.02 0.00 0.00 33.50 32.03 1jcy n PRO 1190CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jcy n GLY 1191N 3.16 1.13 0.36 -1.23 0.00 -1.26 -4.29 105.19 103.06 1jcy n GLY 1191Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.39 1jcy n GLY 1191CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jcy h GLY 1192N 0.00 0.64 -3.40 -0.02 0.00 -0.44 -1.86 103.07 97.99 1jcy h GLY 1192Ca -0.24 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1jcy h GLY 1192CO 0.36 0.09 0.00 1.04 0.00 0.00 0.00 176.54 178.03 1jcy n LEU 1193N -4.47 5.43 0.00 3.11 7.99 0.13 -4.76 117.00 124.43 1jcy n LEU 1193Ca 0.11 -2.75 0.00 0.00 -0.01 0.00 0.00 56.01 53.36 1jcy n LEU 1193Cb 0.42 -0.66 0.00 0.00 -0.11 0.00 0.00 43.42 43.06 1jcy n LEU 1193CO 0.34 0.65 0.00 0.61 -1.51 0.00 0.00 177.39 177.48 1jcy n GLY 1194N 0.71 2.16 0.00 -0.72 0.00 -0.70 -3.91 105.19 102.73 1jcy n GLY 1194Ca 0.27 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1jcy n GLY 1194CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jcy n ASP 1195N 5.29 0.00 -3.86 1.61 5.75 -1.26 -4.84 116.55 119.24 1jcy n ASP 1195Ca 0.00 0.29 -0.09 0.00 -0.01 0.00 0.00 54.79 54.97 1jcy n ASP 1195Cb 0.00 -0.42 -0.06 0.00 -1.03 0.00 0.00 41.12 39.60 1jcy n ASP 1195CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1jcy s LYS 1196N -2.85 1.15 0.47 0.11 1.02 -1.25 -3.36 119.74 115.03 1jcy s LYS 1196Ca 0.17 -1.03 -0.13 0.00 0.02 0.00 0.00 55.97 55.01 1jcy s LYS 1196Cb 0.18 0.41 -0.07 0.00 -0.52 0.00 0.00 37.83 37.83 1jcy s LYS 1196CO 0.46 -0.44 0.88 -1.12 -0.92 0.00 0.00 175.35 174.21 1jcy s SER 1197N -2.92 6.52 0.00 2.83 0.01 -1.26 0.23 113.70 119.11 1jcy s SER 1197Ca 0.12 1.32 0.00 0.00 1.31 0.00 0.00 55.95 58.70 1jcy s SER 1197Cb 0.02 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1jcy s SER 1197CO -0.03 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.70 1jcy n GLY 1198N -1.59 2.64 0.00 3.44 0.00 0.24 -4.48 105.19 105.44 1jcy n GLY 1198Ca 0.04 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1jcy n GLY 1198CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcy n GLY 1199N 5.00 2.25 2.93 -0.02 0.00 -1.26 -0.54 105.19 113.55 1jcy n GLY 1199Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1jcy n GLY 1199CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jcy s MET 1200N -2.00 1.50 0.54 1.61 -1.94 -1.05 -4.85 119.30 113.11 1jcy s MET 1200Ca 0.00 -2.00 0.23 0.00 -1.71 0.00 0.00 55.69 52.21 1jcy s MET 1200Cb 0.00 -3.00 1.44 0.00 2.01 0.00 0.00 34.83 35.28 1jcy s MET 1200CO 0.00 -1.02 2.10 -0.09 -0.01 0.00 0.00 175.02 176.00 1jcy h ARG 1201N 7.27 0.00 0.00 2.03 2.43 -1.90 -2.40 114.38 121.81 1jcy h ARG 1201Ca -0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1jcy h ARG 1201Cb 0.97 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 1jcy h ARG 1201CO 0.56 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 180.07 1jcy h GLU 1202N 0.00 0.00 -0.00 0.20 9.09 -1.93 -2.27 114.58 119.66 1jcy h GLU 1202Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.51 1jcy h GLU 1202Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 1jcy h GLU 1202CO -0.00 0.00 -0.78 1.19 0.05 0.00 0.00 179.01 179.47 1jcy n PHE 1203N -2.69 0.00 0.19 2.06 0.99 -0.90 -4.52 117.46 112.60 1jcy n PHE 1203Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.28 1jcy n PHE 1203Cb 0.10 -0.05 -0.07 0.00 -1.00 0.00 0.00 39.48 38.46 1jcy n PHE 1203CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1jcy h ILE 1204N 0.53 0.25 0.32 4.37 2.04 -1.55 -2.53 117.51 120.95 1jcy h ILE 1204Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1jcy h ILE 1204Cb 0.55 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1jcy h ILE 1204CO 0.00 0.00 -0.18 0.15 0.00 0.00 0.00 178.15 178.12 1jcy h PHE 1205N -0.70 -0.47 -0.93 1.37 -0.00 -1.79 -1.86 116.94 112.55 1jcy h PHE 1205Ca -0.01 -0.01 0.06 0.00 -0.00 0.00 0.00 57.97 58.01 1jcy h PHE 1205Cb 0.66 0.16 -0.06 0.00 -0.00 0.00 0.00 35.95 36.71 1jcy h PHE 1205CO -0.24 -0.29 0.60 -1.00 -0.00 0.00 0.00 178.31 177.38 1jcy h PRO 1206N -0.48 1.08 -0.07 6.41 0.13 -1.81 -1.50 132.00 135.76 1jcy h PRO 1206Ca -0.04 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 64.93 1jcy h PRO 1206Cb 0.38 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.26 1jcy h PRO 1206CO 0.05 0.71 -0.38 -0.07 -0.23 0.00 0.00 178.00 178.08 1jcy h LEU 1207N 1.11 0.15 -0.64 1.56 3.38 -1.35 -1.71 115.31 117.81 1jcy h LEU 1207Ca 0.40 -0.06 -0.15 0.00 0.09 0.00 0.00 57.88 58.16 1jcy h LEU 1207Cb 0.12 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jcy h LEU 1207CO -0.16 0.53 -0.60 -0.29 0.09 0.00 0.00 178.44 178.01 1jcy h ILE 1208N 0.13 1.38 -0.60 1.22 2.10 -0.66 -1.18 117.51 119.90 1jcy h ILE 1208Ca 0.01 -1.96 -0.05 0.00 1.08 0.00 0.00 64.86 63.94 1jcy h ILE 1208Cb 0.74 1.97 -0.03 0.00 -1.09 0.00 0.00 36.82 38.42 1jcy h ILE 1208CO 0.06 0.58 0.17 0.03 -1.08 0.00 0.00 178.15 177.91 1jcy h ARG 1209N 0.21 0.95 -0.30 2.19 3.08 -0.89 -2.38 114.38 117.23 1jcy h ARG 1209Ca -0.01 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.85 1jcy h ARG 1209Cb 1.10 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1jcy h ARG 1209CO 0.09 0.85 0.14 0.00 -1.07 0.00 0.00 179.97 179.99 1jcy h ALA 1210N 1.05 0.36 -0.27 0.04 0.00 -0.96 -1.72 119.26 117.75 1jcy h ALA 1210Ca 0.19 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1jcy h ALA 1210Cb 0.32 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1jcy h ALA 1210CO -0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 179.25 178.89 1jcy h ALA 1211N 1.15 0.11 0.00 0.00 0.00 -0.80 -0.05 119.26 119.67 1jcy h ALA 1211Ca 0.12 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1jcy h ALA 1211Cb 0.04 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1jcy h ALA 1211CO -0.09 -0.52 -0.37 -0.39 0.00 0.00 0.00 179.25 177.88 1jcy h VAL 1212N -0.08 0.95 -0.37 0.00 -1.51 -1.33 0.16 116.25 114.08 1jcy h VAL 1212Ca 0.14 -1.43 -0.12 0.00 -1.23 0.00 0.00 66.70 64.06 1jcy h VAL 1212Cb 0.29 1.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.29 1jcy h VAL 1212CO -0.33 0.36 -0.25 0.00 -1.23 0.00 0.00 177.57 176.12 1jcy h ALA 1213N 1.63 0.52 0.00 5.19 0.00 -0.36 -3.06 119.26 123.19 1jcy h ALA 1213Ca -0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1jcy h ALA 1213Cb 0.82 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1jcy h ALA 1213CO 0.05 0.52 -0.00 0.28 0.00 0.00 0.00 179.25 180.10 1jcy h VAL 1214N 0.61 1.31 0.00 0.00 2.07 -0.81 -3.47 116.25 115.96 1jcy h VAL 1214Ca 0.07 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1jcy h VAL 1214Cb 0.82 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1jcy h VAL 1214CO 0.07 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.51 1jcy n GLY 1215N -0.01 3.23 3.37 2.17 0.00 0.55 -4.85 105.19 109.65 1jcy n GLY 1215Ca -0.08 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 1jcy n GLY 1215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcy n ASP 1217N -0.71 2.82 0.00 0.00 8.00 0.11 -4.99 116.55 121.78 1jcy n ASP 1217Ca 0.02 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.61 1jcy n ASP 1217Cb 0.64 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1jcy n ASP 1217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jcy n GLY 1218N 1.35 1.06 3.15 0.44 0.00 -1.12 -1.75 105.19 108.32 1jcy n GLY 1218Ca 0.16 -0.96 -0.17 0.00 0.00 0.00 0.00 46.02 45.05 1jcy n GLY 1218CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jcy s VAL 1219N -2.00 0.97 -0.14 1.61 -7.23 0.13 -1.32 120.40 112.43 1jcy s VAL 1219Ca 0.00 -1.29 0.02 0.00 -1.81 0.00 0.00 61.98 58.90 1jcy s VAL 1219Cb 0.00 -1.00 0.01 0.00 0.56 0.00 0.00 36.38 35.95 1jcy s VAL 1219CO 0.00 -0.29 -0.21 0.12 -0.31 0.00 0.00 175.10 174.41 1jcy s PHE 1220N -1.41 2.68 -0.02 2.82 2.19 0.68 -0.70 117.98 124.22 1jcy s PHE 1220Ca -0.03 -1.26 0.00 0.00 0.33 0.00 0.00 56.93 55.97 1jcy s PHE 1220Cb -0.09 -1.82 0.03 0.00 -1.31 0.00 0.00 43.02 39.83 1jcy s PHE 1220CO 0.02 -0.57 0.02 -1.64 1.83 0.00 0.00 175.22 174.88 1jcy s MET 1221N 0.76 0.04 -0.02 10.12 -1.94 0.64 -1.03 119.30 127.88 1jcy s MET 1221Ca -0.08 0.16 -0.21 0.00 -1.71 0.00 0.00 55.69 53.85 1jcy s MET 1221Cb -0.16 -0.30 -0.05 0.00 2.01 0.00 0.00 34.83 36.33 1jcy s MET 1221CO -0.01 -0.16 0.60 -1.21 -0.01 0.00 0.00 175.02 174.24 1jcy s GLU 1222N 1.06 4.34 0.00 2.03 2.02 -1.26 -2.72 118.70 124.17 1jcy s GLU 1222Ca -0.09 0.74 0.01 0.00 0.02 0.00 0.00 54.97 55.65 1jcy s GLU 1222Cb -0.13 -3.37 -0.01 0.00 0.10 0.00 0.00 34.13 30.73 1jcy s GLU 1222CO -0.03 0.30 -0.04 -0.08 0.02 0.00 0.00 175.26 175.43 1jcy s THR 1223N 0.05 0.30 -0.03 3.63 -1.32 -0.53 -1.03 115.64 116.72 1jcy s THR 1223Ca 0.32 -0.28 -0.02 0.00 -1.21 0.00 0.00 61.69 60.49 1jcy s THR 1223Cb -0.18 -0.28 0.01 0.00 -1.51 0.00 0.00 72.50 70.54 1jcy s THR 1223CO 0.17 0.01 0.07 -2.28 -2.21 0.00 0.00 174.62 170.37 1jcy s HIS 1224N -0.28 -0.07 0.26 9.09 5.04 -0.41 -2.57 115.29 126.36 1jcy s HIS 1224Ca -0.01 0.18 -0.01 0.00 -1.54 0.00 0.00 55.06 53.68 1jcy s HIS 1224Cb -0.03 0.03 0.55 0.00 0.04 0.00 0.00 32.58 33.17 1jcy s HIS 1224CO -0.00 -0.04 1.73 -1.35 -2.34 0.00 0.00 174.74 172.74 1jcy h PRO 1225N 6.04 0.46 -2.62 2.88 0.11 -1.94 -1.93 132.00 135.00 1jcy h PRO 1225Ca -0.24 -0.03 -0.59 0.00 0.11 0.00 0.00 66.00 65.24 1jcy h PRO 1225Cb 1.21 -0.10 -0.39 0.00 0.11 0.00 0.00 31.00 31.82 1jcy h PRO 1225CO 0.47 0.31 -0.85 -1.21 -0.21 0.00 0.00 178.00 176.50 1jcy s GLU 1226N -5.97 1.01 0.28 1.05 2.02 -1.26 -4.34 118.70 111.50 1jcy s GLU 1226Ca -0.12 -1.96 0.02 0.00 0.02 0.00 0.00 54.97 52.93 1jcy s GLU 1226Cb 0.22 -1.75 0.69 0.00 0.10 0.00 0.00 34.13 33.39 1jcy s GLU 1226CO 0.77 -1.28 1.68 -1.35 0.02 0.00 0.00 175.26 175.10 1jcy h PRO 1227N 6.26 0.31 -0.01 0.39 0.11 -1.85 -0.02 132.00 137.19 1jcy h PRO 1227Ca 0.14 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1jcy h PRO 1227Cb 0.92 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 1jcy h PRO 1227CO 0.39 0.20 0.21 1.05 -0.21 0.00 0.00 178.00 179.65 1jcy h GLU 1228N 0.32 0.00 -0.29 1.05 4.11 -1.93 0.55 114.58 118.39 1jcy h GLU 1228Ca 0.54 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.97 1jcy h GLU 1228Cb 1.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1jcy h GLU 1228CO -0.57 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.14 1jcy n LYS 1229N -2.99 2.14 -1.90 1.06 5.02 -0.03 -5.02 118.16 116.44 1jcy n LYS 1229Ca -0.02 -1.92 -0.36 0.00 -2.02 0.00 0.00 58.31 53.99 1jcy n LYS 1229Cb 0.27 -1.34 0.04 0.00 -0.02 0.00 0.00 35.03 33.99 1jcy n LYS 1229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1jcy s ALA 1230N -1.12 2.47 -2.23 7.82 0.00 0.18 -4.92 121.76 123.97 1jcy s ALA 1230Ca 0.26 0.98 0.28 0.00 0.00 0.00 0.00 51.96 53.49 1jcy s ALA 1230Cb 0.15 -3.45 1.01 0.00 0.00 0.00 0.00 23.12 20.82 1jcy s ALA 1230CO 0.21 -1.30 1.72 1.28 0.00 0.00 0.00 175.76 177.67 1jcy n LEU 1231N -1.81 1.26 -3.61 0.00 4.77 -1.26 -4.63 117.00 111.73 1jcy n LEU 1231Ca 0.14 -0.39 -0.15 0.00 -0.03 0.00 0.00 56.01 55.58 1jcy n LEU 1231Cb 0.50 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1jcy n LEU 1231CO 0.45 0.22 0.42 -0.94 -1.33 0.00 0.00 177.39 176.21 1jcy s SER 1232N -2.16 -0.73 -1.41 -1.43 1.04 -1.26 -4.36 113.70 103.39 1jcy s SER 1232Ca 0.34 1.29 -0.02 0.00 0.48 0.00 0.00 55.95 58.04 1jcy s SER 1232Cb 0.20 1.27 0.02 0.00 0.10 0.00 0.00 66.02 67.61 1jcy s SER 1232CO 0.39 -0.32 0.56 0.47 0.98 0.00 0.00 173.24 175.32 1jcy n ASP 1233N 2.32 -1.02 0.22 7.02 8.00 -1.26 -4.86 116.55 126.97 1jcy n ASP 1233Ca -0.15 -0.94 0.09 0.00 0.71 0.00 0.00 54.79 54.50 1jcy n ASP 1233Cb 0.55 -3.37 0.52 0.00 -0.02 0.00 0.00 41.12 38.80 1jcy n ASP 1233CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jcy h ALA 1234N 0.86 1.17 0.00 2.24 0.00 -1.82 -1.56 119.26 120.14 1jcy h ALA 1234Ca -0.62 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1jcy h ALA 1234Cb 1.37 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1jcy h ALA 1234CO 0.62 0.30 -0.29 0.77 0.00 0.00 0.00 179.25 180.65 1jcy h SER 1235N 0.00 0.00 0.00 0.00 0.02 -1.89 -3.38 113.55 108.30 1jcy h SER 1235Ca -0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1jcy h SER 1235Cb 0.61 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1jcy h SER 1235CO 0.03 0.02 -1.01 0.35 -1.14 0.00 0.00 176.83 175.08 1jcy n THR 1236N -2.55 0.00 -2.05 -2.27 -2.24 -1.09 -3.98 114.28 100.09 1jcy n THR 1236Ca 0.04 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 1jcy n THR 1236Cb 0.48 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 69.19 1jcy n THR 1236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1jcy s GLN 1237N -2.10 4.28 0.09 -0.78 -0.21 -0.61 -4.85 119.66 115.48 1jcy s GLN 1237Ca -0.01 2.25 -0.30 0.00 0.02 0.00 0.00 55.36 57.32 1jcy s GLN 1237Cb 0.02 -3.14 -0.05 0.00 1.00 0.00 0.00 33.01 30.84 1jcy s GLN 1237CO 0.14 -0.42 1.03 -1.17 -2.12 0.00 0.00 175.29 172.76 1jcy s LEU 1238N -0.04 4.44 0.25 2.90 2.96 -0.20 -4.73 118.68 124.27 1jcy s LEU 1238Ca 0.61 1.85 -0.31 0.00 -0.22 0.00 0.00 54.13 56.06 1jcy s LEU 1238Cb -0.41 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.58 1jcy s LEU 1238CO 0.40 -0.22 1.62 -2.65 -1.32 0.00 0.00 176.35 174.19 1jcy n PRO 1239N 3.20 2.64 -0.16 0.98 -0.02 -1.26 -1.28 135.00 139.09 1jcy n PRO 1239Ca 0.04 0.94 0.18 0.00 -2.02 0.00 0.00 63.50 62.65 1jcy n PRO 1239Cb 0.49 -2.74 0.54 0.00 -0.02 0.00 0.00 33.50 31.77 1jcy n PRO 1239CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1jcy h LEU 1240N 5.49 0.32 -0.99 2.45 5.85 -1.54 -1.09 115.31 125.80 1jcy h LEU 1240Ca -0.45 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1jcy h LEU 1240Cb 1.22 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1jcy h LEU 1240CO 0.85 0.16 0.00 0.77 -0.34 0.00 0.00 178.44 179.88 1jcy h SER 1241N 0.34 0.00 0.42 1.25 4.64 -1.88 -2.64 113.55 115.68 1jcy h SER 1241Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1jcy h SER 1241Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1jcy h SER 1241CO -0.11 0.00 -0.61 0.00 -0.87 0.00 0.00 176.83 175.24 1jcy n GLN 1242N -2.47 0.02 0.01 4.77 6.02 -0.41 -4.43 117.38 120.88 1jcy n GLN 1242Ca 0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.90 1jcy n GLN 1242Cb 0.23 -1.51 -0.05 0.00 1.02 0.00 0.00 30.24 29.94 1jcy n GLN 1242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1jcy h LEU 1243N 0.00 -0.14 -0.34 1.08 5.85 -1.52 -2.51 115.31 117.73 1jcy h LEU 1243Ca 0.00 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.82 1jcy h LEU 1243Cb 0.51 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 1jcy h LEU 1243CO 0.00 -0.06 -0.11 -0.08 -0.34 0.00 0.00 178.44 177.85 1jcy h GLU 1244N -0.04 -0.04 -0.81 1.25 4.81 -1.79 -1.38 114.58 116.58 1jcy h GLU 1244Ca 0.05 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1jcy h GLU 1244Cb 0.11 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1jcy h GLU 1244CO -0.11 -0.03 0.39 0.78 -0.73 0.00 0.00 179.01 179.32 1jcy h GLY 1245N -0.04 1.24 0.93 1.92 0.00 -1.82 -1.61 103.07 103.70 1jcy h GLY 1245Ca 0.17 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1jcy h GLY 1245CO -0.37 0.58 0.14 -2.22 0.00 0.00 0.00 176.54 174.67 1jcy h ILE 1246N 1.14 1.16 -0.60 2.60 1.08 -0.97 -1.88 117.51 120.04 1jcy h ILE 1246Ca 0.28 -0.46 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 1jcy h ILE 1246Cb 0.11 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 34.76 1jcy h ILE 1246CO -0.04 0.16 0.35 0.40 -0.69 0.00 0.00 178.15 178.34 1jcy h ILE 1247N 0.34 1.18 -0.25 -0.67 2.04 -1.07 -1.19 117.51 117.89 1jcy h ILE 1247Ca 0.10 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.55 1jcy h ILE 1247Cb 0.13 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1jcy h ILE 1247CO -0.01 0.19 0.14 -0.08 0.00 0.00 0.00 178.15 178.39 1jcy h GLU 1248N 0.81 0.28 -0.44 2.37 4.57 -1.18 -1.71 114.58 119.29 1jcy h GLU 1248Ca 0.21 -0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.41 1jcy h GLU 1248Cb -0.00 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 1jcy h GLU 1248CO -0.04 0.18 0.23 0.00 -1.18 0.00 0.00 179.01 178.21 1jcy h ALA 1249N 1.11 0.55 0.00 2.92 0.00 -0.95 -1.23 119.26 121.67 1jcy h ALA 1249Ca 0.10 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1jcy h ALA 1249Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1jcy h ALA 1249CO -0.05 -0.11 -0.39 -0.84 0.00 0.00 0.00 179.25 177.86 1jcy h ILE 1250N 0.47 1.05 -0.26 0.00 3.07 -1.02 -0.59 117.51 120.22 1jcy h ILE 1250Ca 0.19 -1.46 -0.15 0.00 1.55 0.00 0.00 64.86 64.99 1jcy h ILE 1250Cb 0.07 1.84 -0.01 0.00 -0.27 0.00 0.00 36.82 38.45 1jcy h ILE 1250CO -0.12 0.38 -0.45 -0.07 -1.05 0.00 0.00 178.15 176.85 1jcy h LEU 1251N 0.00 0.72 -0.19 0.16 3.38 -0.84 0.16 115.31 118.70 1jcy h LEU 1251Ca -0.00 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 1jcy h LEU 1251Cb 0.81 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1jcy h LEU 1251CO 0.05 1.06 -0.05 -0.33 0.09 0.00 0.00 178.44 179.26 1jcy h GLU 1252N 0.54 0.37 -0.60 1.13 5.08 -0.77 -1.14 114.58 119.18 1jcy h GLU 1252Ca 0.03 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 1jcy h GLU 1252Cb 0.99 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 1jcy h GLU 1252CO 0.09 0.63 -0.02 0.82 -1.00 0.00 0.00 179.01 179.54 1jcy h ILE 1253N 0.09 1.27 -0.23 3.13 2.04 -1.05 -2.59 117.51 120.17 1jcy h ILE 1253Ca 0.05 -1.18 0.02 0.00 1.00 0.00 0.00 64.86 64.75 1jcy h ILE 1253Cb 0.50 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1jcy h ILE 1253CO 0.02 0.43 0.10 -0.09 0.00 0.00 0.00 178.15 178.60 1jcy h ARG 1254N 0.97 0.21 0.04 2.37 2.43 -0.59 -1.22 114.38 118.59 1jcy h ARG 1254Ca 0.17 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1jcy h ARG 1254Cb 0.58 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1jcy h ARG 1254CO 0.03 0.14 -0.13 1.49 -1.51 0.00 0.00 179.97 179.99 1jcy h GLU 1255N 0.21 -0.23 0.00 0.20 4.57 -1.05 0.36 114.58 118.64 1jcy h GLU 1255Ca 0.10 0.02 -0.09 0.00 -1.18 0.00 0.00 59.36 58.20 1jcy h GLU 1255Cb 0.04 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1jcy h GLU 1255CO -0.08 -0.15 -0.43 -0.24 -1.18 0.00 0.00 179.01 176.93 1jcy h VAL 1256N -0.24 1.25 0.00 0.32 3.04 -1.37 -3.04 116.25 116.21 1jcy h VAL 1256Ca 0.03 -1.49 -0.15 0.00 -1.01 0.00 0.00 66.70 64.08 1jcy h VAL 1256Cb 0.27 1.82 -0.02 0.00 -2.01 0.00 0.00 31.29 31.34 1jcy h VAL 1256CO -0.09 0.42 -0.98 0.00 -1.01 0.00 0.00 177.57 175.91 1jcy h ALA 1257N 1.57 0.63 -0.94 3.17 0.00 -0.93 -3.39 119.26 119.37 1jcy h ALA 1257Ca -0.00 -0.72 0.27 0.00 0.00 0.00 0.00 54.91 54.45 1jcy h ALA 1257Cb 0.78 0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.50 1jcy h ALA 1257CO 0.06 0.88 0.40 0.66 0.00 0.00 0.00 179.25 181.25 1jcy h SER 1258N 0.00 0.28 0.33 0.00 4.64 -0.15 0.11 113.55 118.76 1jcy h SER 1258Ca -0.08 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1jcy h SER 1258Cb 1.55 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.83 1jcy h SER 1258CO 0.07 -0.12 0.00 0.07 -0.87 0.00 0.00 176.83 175.98 1jcy h LYS 1259N 0.30 0.00 -0.02 4.77 2.10 -1.76 -2.20 116.57 119.75 1jcy h LYS 1259Ca 0.63 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.28 1jcy h LYS 1259Cb 1.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 1jcy h LYS 1259CO -0.61 0.00 -0.40 0.66 -2.00 0.00 0.00 179.45 177.10 1jcy n TYR 1260N -2.38 0.00 -1.71 0.07 4.02 0.02 -4.95 117.16 112.23 1jcy n TYR 1260Ca -0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1jcy n TYR 1260Cb 0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.41 1jcy n TYR 1260CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1jcy n TYR 1261N 0.18 2.68 -2.48 -0.72 0.53 -0.83 -4.94 117.16 111.57 1jcy n TYR 1261Ca 0.10 0.02 -0.36 0.00 -1.02 0.00 0.00 57.90 56.64 1jcy n TYR 1261Cb 0.48 -2.67 -0.03 0.00 -1.03 0.00 0.00 39.34 36.09 1jcy n TYR 1261CO 0.00 0.00 0.00 -1.21 -1.02 0.00 0.00 176.86 174.63 1jcy s GLU 1262N 1.47 3.96 -0.03 -0.72 8.01 -1.26 -5.02 118.70 125.10 1jcy s GLU 1262Ca 0.77 1.52 -0.24 0.00 0.01 0.00 0.00 54.97 57.03 1jcy s GLU 1262Cb -0.52 -2.37 -0.04 0.00 -4.31 0.00 0.00 34.13 26.89 1jcy s GLU 1262CO 0.34 -0.32 0.74 0.99 0.01 0.00 0.00 175.26 177.01 1jcy s THR 1263N -1.73 4.96 -2.30 3.63 2.01 -1.26 -5.16 115.64 115.78 1jcy s THR 1263Ca 0.62 1.54 0.30 0.00 0.31 0.00 0.00 61.69 64.46 1jcy s THR 1263Cb -0.22 -4.08 0.69 0.00 0.01 0.00 0.00 72.50 68.91 1jcy s THR 1263CO 0.27 0.27 1.94 2.30 -0.69 0.00 0.00 174.62 178.70