#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sj9 n ASP 1005N 0.00 0.00 0.00 6.43 2.03 -1.26 -5.05 116.55 118.70 1sj9 n ASP 1005Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1sj9 n ASP 1005Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1sj9 n ASP 1005CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1sj9 n VAL 1006N 0.00 0.00 0.00 5.18 0.24 -1.26 -5.10 118.33 117.39 1sj9 n VAL 1006Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1sj9 n VAL 1006Cb 0.00 -0.42 0.00 0.00 -1.47 0.00 0.00 33.84 31.95 1sj9 n VAL 1006CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1sj9 n PHE 1007N -0.35 0.00 -0.25 6.34 7.35 -1.26 -5.01 117.46 124.28 1sj9 n PHE 1007Ca 0.00 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.74 1sj9 n PHE 1007Cb 0.00 0.00 0.15 0.00 0.35 0.00 0.00 39.48 39.98 1sj9 n PHE 1007CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1sj9 h HIS 1008N 0.00 0.00 -0.09 -5.13 3.86 -1.98 -3.16 115.15 108.64 1sj9 h HIS 1008Ca 0.00 0.05 -0.11 0.00 -1.16 0.00 0.00 60.37 59.15 1sj9 h HIS 1008Cb 0.00 0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1sj9 h HIS 1008CO 0.00 -0.21 -0.38 -0.07 0.86 0.00 0.00 177.93 178.13 1sj9 h LEU 1009N 0.13 0.49 -1.24 2.43 4.07 -1.92 -3.45 115.31 115.82 1sj9 h LEU 1009Ca 0.40 -0.63 0.00 0.00 0.08 0.00 0.00 57.88 57.73 1sj9 h LEU 1009Cb 0.70 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.29 1sj9 h LEU 1009CO -0.62 1.04 0.00 0.61 -1.08 0.00 0.00 178.44 178.39 1sj9 n GLY 1010N 0.66 0.77 3.39 0.83 0.00 -1.20 -4.71 105.19 104.93 1sj9 n GLY 1010Ca -0.08 -0.54 -0.17 0.00 0.00 0.00 0.00 46.02 45.23 1sj9 n GLY 1010CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sj9 n LEU 1011N -0.62 0.00 -4.06 0.99 4.77 -1.26 -4.45 117.00 112.36 1sj9 n LEU 1011Ca 0.00 -3.02 -0.12 0.00 -0.03 0.00 0.00 56.01 52.85 1sj9 n LEU 1011Cb 0.45 2.31 -0.05 0.00 -2.33 0.00 0.00 43.42 43.80 1sj9 n LEU 1011CO 0.00 -0.63 0.11 0.42 -1.33 0.00 0.00 177.39 175.96 1sj9 s THR 1012N -3.00 0.00 0.17 -5.08 -4.23 -1.26 -4.50 115.64 97.74 1sj9 s THR 1012Ca 0.33 -1.56 -0.14 0.00 -1.18 0.00 0.00 61.69 59.14 1sj9 s THR 1012Cb -0.00 -2.43 0.07 0.00 1.34 0.00 0.00 72.50 71.47 1sj9 s THR 1012CO 0.24 0.00 1.83 0.50 -0.54 0.00 0.00 174.62 176.65 1sj9 h LYS 1013N 2.25 0.72 -0.61 3.99 1.63 -1.97 -2.97 116.57 119.61 1sj9 h LYS 1013Ca -0.28 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.47 1sj9 h LYS 1013Cb 1.25 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1sj9 h LYS 1013CO 0.39 0.49 0.00 -1.71 -3.45 0.00 0.00 179.45 175.17 1sj9 n ASN 1014N -4.70 0.61 -0.00 4.20 4.05 -1.26 -2.44 115.26 115.72 1sj9 n ASN 1014Ca 0.03 -1.44 0.06 0.00 0.45 0.00 0.00 54.58 53.68 1sj9 n ASN 1014Cb 0.03 -0.31 -0.08 0.00 1.23 0.00 0.00 39.78 40.65 1sj9 n ASN 1014CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1sj9 n ASP 1015N 0.04 1.68 0.01 1.20 8.00 -1.12 -4.41 116.55 121.95 1sj9 n ASP 1015Ca 0.00 -0.28 -0.05 0.00 0.71 0.00 0.00 54.79 55.17 1sj9 n ASP 1015Cb 0.15 1.34 -0.11 0.00 -0.02 0.00 0.00 41.12 42.48 1sj9 n ASP 1015CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1sj9 h LEU 1016N 0.00 0.00 -2.44 0.64 3.38 -1.64 -3.47 115.31 111.79 1sj9 h LEU 1016Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 1sj9 h LEU 1016Cb 0.43 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.35 1sj9 h LEU 1016CO 0.00 0.82 -0.72 0.00 0.09 0.00 0.00 178.44 178.63 1sj9 n GLN 1017N -3.01 -2.33 -0.56 1.13 6.02 -1.24 -2.94 117.38 114.45 1sj9 n GLN 1017Ca -0.12 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.60 1sj9 n GLN 1017Cb 0.95 -5.21 0.00 0.00 1.02 0.00 0.00 30.24 27.00 1sj9 n GLN 1017CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sj9 n GLY 1018N -1.25 0.94 3.59 1.08 0.00 -1.26 -4.52 105.19 103.78 1sj9 n GLY 1018Ca -0.08 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.49 1sj9 n GLY 1018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 n ALA 1019N 0.82 -0.17 -0.02 4.61 0.00 -1.15 -4.88 120.51 119.72 1sj9 n ALA 1019Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1sj9 n ALA 1019Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.42 1sj9 n ALA 1019CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sj9 n GLN 1020N 0.77 4.42 -5.28 0.00 -0.00 -1.26 -3.83 117.38 112.20 1sj9 n GLN 1020Ca 0.10 -0.14 -0.31 0.00 -0.00 0.00 0.00 57.00 56.65 1sj9 n GLN 1020Cb 0.32 -0.62 -0.16 0.00 -0.00 0.00 0.00 30.24 29.78 1sj9 n GLN 1020CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1sj9 s LEU 1021N -1.34 2.06 -0.06 2.61 0.20 -1.26 0.13 118.68 121.02 1sj9 s LEU 1021Ca 0.00 -0.48 0.04 0.00 0.69 0.00 0.00 54.13 54.38 1sj9 s LEU 1021Cb 0.00 -1.34 -0.00 0.00 -0.43 0.00 0.00 46.19 44.41 1sj9 s LEU 1021CO 0.00 0.29 -0.18 0.00 -0.29 0.00 0.00 176.35 176.16 1sj9 s ALA 1022N -0.42 1.66 -0.31 5.97 0.00 0.15 -1.48 121.76 127.33 1sj9 s ALA 1022Ca 0.04 -0.73 -0.12 0.00 0.00 0.00 0.00 51.96 51.16 1sj9 s ALA 1022Cb -0.12 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 1sj9 s ALA 1022CO 0.01 0.27 0.21 0.42 0.00 0.00 0.00 175.76 176.67 1sj9 s ILE 1023N 0.17 5.20 -0.44 0.00 1.09 0.47 0.39 121.20 128.08 1sj9 s ILE 1023Ca -0.08 -0.10 0.03 0.00 -1.10 0.00 0.00 60.65 59.40 1sj9 s ILE 1023Cb -0.13 -3.59 0.12 0.00 -1.06 0.00 0.00 42.46 37.79 1sj9 s ILE 1023CO 0.04 0.10 0.17 0.68 -0.10 0.00 0.00 174.94 175.83 1sj9 s VAL 1024N 1.72 2.58 0.63 2.92 -7.23 0.17 -1.44 120.40 119.75 1sj9 s VAL 1024Ca 0.06 -2.76 -0.00 0.00 -1.81 0.00 0.00 61.98 57.47 1sj9 s VAL 1024Cb -0.17 -2.83 0.07 0.00 0.56 0.00 0.00 36.38 34.01 1sj9 s VAL 1024CO 0.10 -0.71 0.88 -2.16 -0.31 0.00 0.00 175.10 172.90 1sj9 s PRO 1025N 0.37 2.20 -0.18 4.82 0.04 -1.19 -3.51 135.00 137.55 1sj9 s PRO 1025Ca 0.14 -0.83 -0.23 0.00 0.04 0.00 0.00 61.00 60.12 1sj9 s PRO 1025Cb -0.22 -2.39 -0.21 0.00 0.04 0.00 0.00 34.50 31.72 1sj9 s PRO 1025CO -0.04 -1.03 0.38 0.78 0.04 0.00 0.00 177.00 177.13 1sj9 h GLY 1026N -0.22 0.00 -4.64 0.56 0.00 -1.86 -1.89 103.07 95.03 1sj9 h GLY 1026Ca -0.40 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.39 1sj9 h GLY 1026CO 0.49 0.00 0.72 -0.35 0.00 0.00 0.00 176.54 177.40 1sj9 s ASP 1027N -6.60 6.90 0.14 0.19 -1.08 -1.26 -2.80 116.67 112.16 1sj9 s ASP 1027Ca -0.25 2.17 0.27 0.00 -0.52 0.00 0.00 52.55 54.22 1sj9 s ASP 1027Cb 0.03 -2.58 0.92 0.00 -1.46 0.00 0.00 42.92 39.83 1sj9 s ASP 1027CO 0.60 -0.63 1.80 -2.65 0.52 0.00 0.00 175.17 174.82 1sj9 n PRO 1028N 4.43 0.18 0.13 4.34 -0.02 -1.26 -2.56 135.00 140.24 1sj9 n PRO 1028Ca 0.11 0.14 0.13 0.00 -2.02 0.00 0.00 63.50 61.86 1sj9 n PRO 1028Cb 0.44 -1.70 0.43 0.00 -0.02 0.00 0.00 33.50 32.64 1sj9 n PRO 1028CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1sj9 h GLU 1029N 0.00 0.00 -0.42 -0.52 4.81 -1.95 -3.21 114.58 113.29 1sj9 h GLU 1029Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1sj9 h GLU 1029Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1sj9 h GLU 1029CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.82 1sj9 n ARG 1030N -2.37 2.96 0.03 1.92 5.12 -1.06 -4.56 116.66 118.70 1sj9 n ARG 1030Ca 0.04 -2.35 -0.20 0.00 -1.93 0.00 0.00 57.85 53.42 1sj9 n ARG 1030Cb 0.37 -1.46 -0.11 0.00 -1.16 0.00 0.00 32.46 30.11 1sj9 n ARG 1030CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1sj9 h VAL 1031N 2.55 1.31 -0.13 1.55 2.07 -1.66 -3.22 116.25 118.72 1sj9 h VAL 1031Ca 0.00 -2.21 -0.07 0.00 0.82 0.00 0.00 66.70 65.24 1sj9 h VAL 1031Cb 0.95 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 1sj9 h VAL 1031CO 0.06 0.68 -0.23 -0.08 0.02 0.00 0.00 177.57 178.01 1sj9 h GLU 1032N 0.28 0.23 -0.27 1.57 4.81 -1.82 -1.07 114.58 118.31 1sj9 h GLU 1032Ca -0.12 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 58.92 1sj9 h GLU 1032Cb 1.62 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.96 1sj9 h GLU 1032CO 0.19 0.45 -0.33 -0.22 -0.73 0.00 0.00 179.01 178.37 1sj9 h LYS 1033N 0.21 0.58 0.05 1.92 1.63 -1.84 0.48 116.57 119.60 1sj9 h LYS 1033Ca 0.04 -0.26 -0.00 0.00 -0.85 0.00 0.00 60.65 59.57 1sj9 h LYS 1033Cb 0.53 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 1sj9 h LYS 1033CO 0.04 0.83 -0.02 0.82 -3.45 0.00 0.00 179.45 177.66 1sj9 h ILE 1034N 0.49 1.29 0.00 2.00 2.04 -1.49 -3.06 117.51 118.78 1sj9 h ILE 1034Ca 0.06 -1.59 0.00 0.00 1.00 0.00 0.00 64.86 64.33 1sj9 h ILE 1034Cb 0.80 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.16 1sj9 h ILE 1034CO 0.07 0.37 0.00 0.00 0.00 0.00 0.00 178.15 178.59 1sj9 h ALA 1035N -0.03 1.00 0.00 1.87 0.00 -1.21 -1.83 119.26 119.06 1sj9 h ALA 1035Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1sj9 h ALA 1035Cb 0.66 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1sj9 h ALA 1035CO 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 179.25 179.11 1sj9 h ALA 1036N 2.06 1.41 -0.26 0.00 0.00 0.08 -2.45 119.26 120.10 1sj9 h ALA 1036Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1sj9 h ALA 1036Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1sj9 h ALA 1036CO 0.00 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.71 1sj9 n LEU 1037N -3.86 2.27 -4.71 0.00 7.99 -0.69 -4.93 117.00 113.07 1sj9 n LEU 1037Ca -0.02 -0.98 -0.25 0.00 -0.01 0.00 0.00 56.01 54.75 1sj9 n LEU 1037Cb 0.24 -0.17 -0.08 0.00 -0.11 0.00 0.00 43.42 43.31 1sj9 n LEU 1037CO 0.32 0.49 -0.20 -0.04 -1.51 0.00 0.00 177.39 176.45 1sj9 s MET 1038N -1.67 2.17 0.27 3.23 -1.94 -0.92 -5.11 119.30 115.33 1sj9 s MET 1038Ca 0.34 -1.87 -0.23 0.00 -1.71 0.00 0.00 55.69 52.22 1sj9 s MET 1038Cb 0.19 -1.93 -0.09 0.00 2.01 0.00 0.00 34.83 35.01 1sj9 s MET 1038CO 0.27 -0.07 0.84 -0.51 -0.01 0.00 0.00 175.02 175.54 1sj9 s ASP 1039N -3.85 7.21 -1.42 3.03 1.01 -0.51 -4.20 116.67 117.93 1sj9 s ASP 1039Ca 0.39 1.64 -0.08 0.00 0.71 0.00 0.00 52.55 55.21 1sj9 s ASP 1039Cb 0.04 -2.50 0.04 0.00 1.01 0.00 0.00 42.92 41.51 1sj9 s ASP 1039CO 0.21 -0.02 0.93 0.29 0.21 0.00 0.00 175.17 176.79 1sj9 n LYS 1040N 0.65 -5.75 -1.70 8.23 5.02 -1.26 -1.72 118.16 121.63 1sj9 n LYS 1040Ca -0.00 0.65 -0.38 0.00 -2.02 0.00 0.00 58.31 56.56 1sj9 n LYS 1040Cb 0.51 -5.47 0.06 0.00 -0.02 0.00 0.00 35.03 30.10 1sj9 n LYS 1040CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1sj9 n PRO 1041N -4.58 1.24 -3.69 1.97 -0.04 -1.26 -4.55 135.00 124.09 1sj9 n PRO 1041Ca -0.09 0.47 -0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1sj9 n PRO 1041Cb 0.59 -2.44 -0.09 0.00 -0.04 0.00 0.00 33.50 31.52 1sj9 n PRO 1041CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1sj9 s VAL 1042N -1.38 -0.01 0.03 0.52 1.01 0.28 -4.96 120.40 115.89 1sj9 s VAL 1042Ca 0.77 0.02 -0.23 0.00 0.00 0.00 0.00 61.98 62.54 1sj9 s VAL 1042Cb -0.41 -0.74 -0.06 0.00 0.00 0.00 0.00 36.38 35.18 1sj9 s VAL 1042CO 0.45 0.01 0.68 -0.75 0.00 0.00 0.00 175.10 175.49 1sj9 s LYS 1043N 0.71 4.41 -0.16 2.72 2.20 -1.26 0.25 119.74 128.61 1sj9 s LYS 1043Ca -0.03 0.92 -0.03 0.00 -0.36 0.00 0.00 55.97 56.46 1sj9 s LYS 1043Cb -0.05 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.84 1sj9 s LYS 1043CO -0.05 0.36 -0.17 1.28 -0.36 0.00 0.00 175.35 176.41 1sj9 n LEU 1044N 2.64 2.19 -3.50 5.43 4.77 -0.88 -4.87 117.00 122.78 1sj9 n LEU 1044Ca -0.05 0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.82 1sj9 n LEU 1044Cb 0.50 -0.51 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1sj9 n LEU 1044CO 0.45 0.57 0.39 0.00 -1.33 0.00 0.00 177.39 177.48 1sj9 s ALA 1045N -2.30 -1.61 0.00 -1.18 0.00 -1.22 -4.92 121.76 110.53 1sj9 s ALA 1045Ca -0.21 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.64 1sj9 s ALA 1045Cb 0.07 0.37 0.00 0.00 0.00 0.00 0.00 23.12 23.56 1sj9 s ALA 1045CO 0.32 -0.53 0.49 0.45 0.00 0.00 0.00 175.76 176.50 1sj9 n SER 1046N 0.39 0.68 -4.62 0.00 2.88 -1.26 -2.94 113.62 108.75 1sj9 n SER 1046Ca -0.18 -1.24 -0.50 0.00 -1.33 0.00 0.00 58.87 55.62 1sj9 n SER 1046Cb 0.60 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.01 1sj9 n SER 1046CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1sj9 n HIS 1047N -0.12 1.80 -2.68 0.66 8.25 -1.25 -4.68 115.22 117.19 1sj9 n HIS 1047Ca 0.00 0.50 0.00 0.00 -0.26 0.00 0.00 57.72 57.96 1sj9 n HIS 1047Cb 0.28 -2.41 0.00 0.00 1.12 0.00 0.00 29.99 28.97 1sj9 n HIS 1047CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1sj9 n ARG 1048N 2.96 0.00 0.02 -0.41 0.63 -1.26 -2.39 116.66 116.21 1sj9 n ARG 1048Ca 0.18 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 57.24 1sj9 n ARG 1048Cb 0.22 0.00 0.32 0.00 0.45 0.00 0.00 32.46 33.46 1sj9 n ARG 1048CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1sj9 n GLU 1049N 14.00 0.07 -2.56 -0.14 4.07 -1.26 -4.67 120.64 130.14 1sj9 n GLU 1049Ca 0.00 0.03 -0.41 0.00 -0.06 0.00 0.00 57.16 56.72 1sj9 n GLU 1049Cb 0.00 -1.55 -0.03 0.00 -0.06 0.00 0.00 31.44 29.80 1sj9 n GLU 1049CO 0.00 0.00 0.00 -0.06 -0.06 0.00 0.00 177.13 177.01 1sj9 s PHE 1050N -3.04 2.47 -0.16 4.31 2.99 -1.01 -4.51 117.98 119.03 1sj9 s PHE 1050Ca 0.11 -0.63 -0.02 0.00 0.00 0.00 0.00 56.93 56.39 1sj9 s PHE 1050Cb 0.17 -4.68 -0.01 0.00 0.00 0.00 0.00 43.02 38.50 1sj9 s PHE 1050CO 0.66 -1.97 -0.10 0.99 -0.00 0.00 0.00 175.22 174.80 1sj9 s THR 1051N 5.16 3.20 -0.01 0.64 2.01 -1.26 -3.89 115.64 121.48 1sj9 s THR 1051Ca 0.43 -0.59 0.01 0.00 0.31 0.00 0.00 61.69 61.85 1sj9 s THR 1051Cb -0.02 -2.38 0.01 0.00 0.01 0.00 0.00 72.50 70.11 1sj9 s THR 1051CO -0.03 0.49 -0.04 -0.94 -0.69 0.00 0.00 174.62 173.41 1sj9 s SER 1052N 0.70 0.58 0.13 3.53 1.04 -1.15 -0.70 113.70 117.83 1sj9 s SER 1052Ca -0.05 -0.08 0.09 0.00 0.48 0.00 0.00 55.95 56.39 1sj9 s SER 1052Cb -0.15 -0.15 -0.04 0.00 0.10 0.00 0.00 66.02 65.77 1sj9 s SER 1052CO 0.02 0.01 -0.16 0.26 0.98 0.00 0.00 173.24 174.35 1sj9 s TRP 1053N 0.27 2.57 -0.15 5.02 0.52 0.21 -2.07 118.94 125.31 1sj9 s TRP 1053Ca -0.03 -0.25 -0.04 0.00 0.02 0.00 0.00 56.10 55.81 1sj9 s TRP 1053Cb -0.06 -1.33 -0.03 0.00 -1.15 0.00 0.00 33.47 30.89 1sj9 s TRP 1053CO -0.00 0.42 -0.01 0.50 0.02 0.00 0.00 176.95 177.88 1sj9 s ARG 1054N -2.32 3.60 0.00 4.98 3.52 0.71 0.28 118.95 129.71 1sj9 s ARG 1054Ca 0.20 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 1sj9 s ARG 1054Cb -0.10 -2.94 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 1sj9 s ARG 1054CO 0.12 0.34 0.00 0.00 -0.81 0.00 0.00 175.30 174.94 1sj9 n ALA 1055N 3.26 0.00 -3.52 6.12 0.00 -0.33 0.98 120.51 127.02 1sj9 n ALA 1055Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 1sj9 n ALA 1055Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1sj9 n ALA 1055CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1sj9 s GLU 1056N 1.78 0.79 -0.27 0.00 2.12 -0.70 -2.54 118.70 119.87 1sj9 s GLU 1056Ca 0.00 -0.11 -0.10 0.00 0.36 0.00 0.00 54.97 55.12 1sj9 s GLU 1056Cb 0.00 0.37 0.11 0.00 0.26 0.00 0.00 34.13 34.87 1sj9 s GLU 1056CO 0.00 -0.31 0.60 -1.17 -0.54 0.00 0.00 175.26 173.84 1sj9 s LEU 1057N -1.93 -0.96 -1.50 2.70 2.96 -0.52 -1.42 118.68 118.00 1sj9 s LEU 1057Ca 0.01 1.42 0.00 0.00 -0.22 0.00 0.00 54.13 55.34 1sj9 s LEU 1057Cb -0.01 2.09 0.00 0.00 0.50 0.00 0.00 46.19 48.77 1sj9 s LEU 1057CO -0.04 -0.22 0.00 0.47 -1.32 0.00 0.00 176.35 175.24 1sj9 n ASP 1058N 5.19 -5.23 0.00 3.68 10.43 -1.26 -1.01 116.55 128.35 1sj9 n ASP 1058Ca -0.13 0.35 0.00 0.00 2.57 0.00 0.00 54.79 57.58 1sj9 n ASP 1058Cb 0.51 -3.97 0.00 0.00 1.84 0.00 0.00 41.12 39.50 1sj9 n ASP 1058CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1sj9 n GLY 1059N -0.54 0.81 2.98 0.44 0.00 -1.26 -5.07 105.19 102.55 1sj9 n GLY 1059Ca -0.14 -0.49 -0.29 0.00 0.00 0.00 0.00 46.02 45.09 1sj9 n GLY 1059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sj9 s LYS 1060N -1.20 1.98 0.09 1.61 1.02 -0.18 -5.09 119.74 117.98 1sj9 s LYS 1060Ca 0.00 -0.58 -0.31 0.00 0.02 0.00 0.00 55.97 55.10 1sj9 s LYS 1060Cb 0.00 -2.09 -0.10 0.00 -0.52 0.00 0.00 37.83 35.12 1sj9 s LYS 1060CO 0.00 -0.32 1.86 0.00 -0.92 0.00 0.00 175.35 175.97 1sj9 s ALA 1061N 1.52 3.71 -0.08 5.17 0.00 -1.26 -1.44 121.76 129.37 1sj9 s ALA 1061Ca 0.03 1.40 0.03 0.00 0.00 0.00 0.00 51.96 53.41 1sj9 s ALA 1061Cb -0.14 -3.78 0.01 0.00 0.00 0.00 0.00 23.12 19.20 1sj9 s ALA 1061CO -0.09 -1.32 -0.16 0.54 0.00 0.00 0.00 175.76 174.72 1sj9 s VAL 1062N 3.24 1.46 0.05 0.00 0.11 -1.05 -3.65 120.40 120.55 1sj9 s VAL 1062Ca 0.83 -0.66 -0.25 0.00 -2.93 0.00 0.00 61.98 58.97 1sj9 s VAL 1062Cb -0.45 -1.30 -0.06 0.00 -1.53 0.00 0.00 36.38 33.04 1sj9 s VAL 1062CO 0.38 0.43 0.75 -0.63 -3.33 0.00 0.00 175.10 172.70 1sj9 s ILE 1063N 0.60 4.71 -0.53 7.04 -1.09 -0.55 -1.19 121.20 130.19 1sj9 s ILE 1063Ca -0.15 1.60 0.02 0.00 -2.23 0.00 0.00 60.65 59.89 1sj9 s ILE 1063Cb -0.16 -4.10 0.14 0.00 -1.58 0.00 0.00 42.46 36.75 1sj9 s ILE 1063CO 0.05 0.38 0.29 -0.69 -1.23 0.00 0.00 174.94 173.75 1sj9 s VAL 1064N -0.18 2.89 0.27 2.92 1.01 0.14 -0.39 120.40 127.06 1sj9 s VAL 1064Ca 0.38 -3.13 0.08 0.00 0.00 0.00 0.00 61.98 59.31 1sj9 s VAL 1064Cb -0.21 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1sj9 s VAL 1064CO 0.23 -0.80 0.12 0.00 0.00 0.00 0.00 175.10 174.65 1sj9 s SER 1066N -3.79 5.49 0.00 0.00 0.01 0.12 -3.16 113.70 112.38 1sj9 s SER 1066Ca 0.33 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.18 1sj9 s SER 1066Cb -0.07 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.12 1sj9 s SER 1066CO 0.23 -0.38 0.00 0.35 0.41 0.00 0.00 173.24 173.85 1sj9 n THR 1067N -1.46 0.00 -1.71 1.44 -2.24 -0.71 -4.64 114.28 104.97 1sj9 n THR 1067Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1sj9 n THR 1067Cb 0.59 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1sj9 n THR 1067CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sj9 n GLY 1068N 2.48 -2.31 3.70 3.38 0.00 -1.12 -3.78 105.19 107.54 1sj9 n GLY 1068Ca 0.00 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 1sj9 n GLY 1068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sj9 s ILE 1069N -0.50 4.89 0.00 -0.61 1.01 -1.26 -4.76 121.20 119.97 1sj9 s ILE 1069Ca 0.00 1.89 0.00 0.00 0.00 0.00 0.00 60.65 62.54 1sj9 s ILE 1069Cb 0.00 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.23 1sj9 s ILE 1069CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1sj9 n GLY 1070N 3.03 1.16 0.11 6.18 0.00 -1.26 -4.73 105.19 109.67 1sj9 n GLY 1070Ca 0.05 -1.78 0.02 0.00 0.00 0.00 0.00 46.02 44.30 1sj9 n GLY 1070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1sj9 h GLY 1071N 0.00 0.00 1.10 -0.02 0.00 -1.90 -2.72 103.07 99.53 1sj9 h GLY 1071Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1sj9 h GLY 1071CO 0.00 0.00 0.34 -2.55 0.00 0.00 0.00 176.54 174.33 1sj9 h PRO 1072N 0.00 1.15 -0.08 4.80 0.11 -1.95 -0.53 132.00 135.49 1sj9 h PRO 1072Ca -0.09 -0.18 -0.22 0.00 0.11 0.00 0.00 66.00 65.61 1sj9 h PRO 1072Cb 1.48 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 32.40 1sj9 h PRO 1072CO 0.05 0.91 -0.85 0.66 -0.21 0.00 0.00 178.00 178.55 1sj9 h SER 1073N 1.13 0.77 -0.90 -2.05 4.64 -1.85 -3.11 113.55 112.16 1sj9 h SER 1073Ca 0.27 -0.54 0.06 0.00 -0.47 0.00 0.00 61.79 61.11 1sj9 h SER 1073Cb 0.16 -0.23 -0.06 0.00 -0.31 0.00 0.00 62.40 61.97 1sj9 h SER 1073CO -0.03 1.33 0.59 0.74 -0.87 0.00 0.00 176.83 178.59 1sj9 h THR 1074N 0.40 1.07 -0.30 2.95 2.02 -1.11 -1.34 112.91 116.60 1sj9 h THR 1074Ca -0.07 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 1sj9 h THR 1074Cb 1.48 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1sj9 h THR 1074CO 0.16 0.19 0.13 0.28 0.37 0.00 0.00 175.52 176.65 1sj9 h SER 1075N 1.03 0.40 -0.11 4.18 0.02 -1.05 -0.68 113.55 117.33 1sj9 h SER 1075Ca 0.39 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.22 1sj9 h SER 1075Cb 0.20 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.58 1sj9 h SER 1075CO -0.15 0.43 -0.46 0.40 -1.14 0.00 0.00 176.83 175.92 1sj9 h ILE 1076N 0.33 0.00 0.00 3.27 1.08 -1.33 0.62 117.51 121.49 1sj9 h ILE 1076Ca 0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.57 1sj9 h ILE 1076Cb 0.15 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.90 1sj9 h ILE 1076CO -0.01 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.45 1sj9 n ALA 1077N -2.93 -0.22 -0.29 1.87 0.00 -0.57 -0.61 120.51 117.75 1sj9 n ALA 1077Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.48 1sj9 n ALA 1077Cb 0.32 0.22 0.22 0.00 0.00 0.00 0.00 19.45 20.20 1sj9 n ALA 1077CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sj9 h VAL 1078N 0.00 0.23 -0.74 0.00 2.07 -1.07 0.52 116.25 117.26 1sj9 h VAL 1078Ca 0.00 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1sj9 h VAL 1078Cb 0.00 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 1sj9 h VAL 1078CO 0.00 0.02 0.27 -0.08 0.02 0.00 0.00 177.57 177.80 1sj9 h GLU 1079N 0.09 1.12 0.33 1.57 4.81 0.40 -2.08 114.58 120.82 1sj9 h GLU 1079Ca 0.49 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1sj9 h GLU 1079Cb 0.93 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.14 1sj9 h GLU 1079CO -0.75 0.93 -0.16 0.93 -0.73 0.00 0.00 179.01 179.23 1sj9 h GLU 1080N 1.08 -0.43 0.09 1.92 4.39 0.87 -2.98 114.58 119.52 1sj9 h GLU 1080Ca 0.24 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.98 1sj9 h GLU 1080Cb 0.25 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 1sj9 h GLU 1080CO -0.02 -0.10 -0.39 -0.07 -1.16 0.00 0.00 179.01 177.28 1sj9 h LEU 1081N -0.83 -1.16 -0.92 1.33 3.38 -0.95 -2.00 115.31 114.16 1sj9 h LEU 1081Ca -0.05 0.12 0.25 0.00 0.09 0.00 0.00 57.88 58.30 1sj9 h LEU 1081Cb 0.52 0.43 -0.16 0.00 0.09 0.00 0.00 40.66 41.54 1sj9 h LEU 1081CO 0.07 -0.41 0.11 0.00 0.09 0.00 0.00 178.44 178.30 1sj9 h ALA 1082N -0.82 1.19 -0.88 1.53 0.00 -1.46 1.87 119.26 120.67 1sj9 h ALA 1082Ca -0.01 0.29 0.11 0.00 0.00 0.00 0.00 54.91 55.30 1sj9 h ALA 1082Cb 0.55 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.74 1sj9 h ALA 1082CO -0.21 -0.54 0.52 0.37 0.00 0.00 0.00 179.25 179.39 1sj9 h GLN 1083N 0.08 0.82 0.00 0.00 4.15 -1.25 -0.38 115.11 118.53 1sj9 h GLN 1083Ca 0.57 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.94 1sj9 h GLN 1083Cb 1.17 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1sj9 h GLN 1083CO -0.80 0.54 0.00 1.28 -1.93 0.00 0.00 178.83 177.92 1sj9 n LEU 1084N -4.71 0.00 0.00 -2.39 4.77 0.63 -4.91 117.00 110.39 1sj9 n LEU 1084Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1sj9 n LEU 1084Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1sj9 n LEU 1084CO 0.27 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1sj9 n GLY 1085N 0.71 3.61 3.56 -0.72 0.00 -0.15 -4.71 105.19 107.49 1sj9 n GLY 1085Ca 0.11 -0.84 -0.55 0.00 0.00 0.00 0.00 46.02 44.74 1sj9 n GLY 1085CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1sj9 n ILE 1086N 0.00 0.01 -0.66 -0.61 2.08 -1.22 -4.72 119.36 114.24 1sj9 n ILE 1086Ca 0.00 -0.00 0.02 0.00 0.56 0.00 0.00 62.75 63.33 1sj9 n ILE 1086Cb 0.00 -0.54 0.02 0.00 -0.75 0.00 0.00 39.64 38.38 1sj9 n ILE 1086CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1sj9 n ARG 1087N 2.25 1.60 -3.57 0.38 5.12 0.35 -3.77 116.66 119.02 1sj9 n ARG 1087Ca 0.19 -1.38 -0.04 0.00 -1.93 0.00 0.00 57.85 54.70 1sj9 n ARG 1087Cb 0.15 -0.91 -0.06 0.00 -1.16 0.00 0.00 32.46 30.48 1sj9 n ARG 1087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1sj9 s THR 1088N -0.97 -0.84 -0.19 0.55 2.01 -0.72 -2.83 115.64 112.64 1sj9 s THR 1088Ca 0.06 0.06 -0.04 0.00 0.31 0.00 0.00 61.69 62.08 1sj9 s THR 1088Cb 0.05 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 1sj9 s THR 1088CO 0.01 0.02 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.55 1sj9 s PHE 1089N 2.77 2.97 -0.42 4.92 0.40 -1.19 0.35 117.98 127.78 1sj9 s PHE 1089Ca 0.00 -0.64 -0.06 0.00 -0.60 0.00 0.00 56.93 55.63 1sj9 s PHE 1089Cb -0.13 -2.04 0.10 0.00 0.51 0.00 0.00 43.02 41.47 1sj9 s PHE 1089CO -0.17 -0.32 0.23 -0.51 0.70 0.00 0.00 175.22 175.15 1sj9 s LEU 1090N 0.99 5.20 -0.13 -0.37 2.01 0.16 -1.13 118.68 125.41 1sj9 s LEU 1090Ca 0.00 -1.80 -0.21 0.00 0.01 0.00 0.00 54.13 52.13 1sj9 s LEU 1090Cb -0.15 -1.90 -0.03 0.00 0.01 0.00 0.00 46.19 44.12 1sj9 s LEU 1090CO 0.01 -0.55 0.61 -0.60 1.01 0.00 0.00 176.35 176.83 1sj9 s ARG 1091N 1.27 4.32 0.17 1.70 6.06 0.15 0.43 118.95 133.06 1sj9 s ARG 1091Ca 0.05 0.66 0.11 0.00 -2.50 0.00 0.00 55.73 54.05 1sj9 s ARG 1091Cb -0.23 -3.50 -0.04 0.00 0.06 0.00 0.00 34.95 31.24 1sj9 s ARG 1091CO -0.02 -0.03 -0.23 -1.50 -2.50 0.00 0.00 175.30 171.02 1sj9 s ILE 1092N 1.20 2.44 0.17 4.11 -1.16 -1.23 -1.86 121.20 124.87 1sj9 s ILE 1092Ca 0.31 -1.91 -0.08 0.00 -0.51 0.00 0.00 60.65 58.46 1sj9 s ILE 1092Cb -0.16 -2.16 0.03 0.00 0.61 0.00 0.00 42.46 40.78 1sj9 s ILE 1092CO 0.13 -0.06 0.43 0.61 -2.81 0.00 0.00 174.94 173.23 1sj9 n GLY 1093N 0.40 1.36 3.62 1.50 0.00 -0.85 -4.17 105.19 107.05 1sj9 n GLY 1093Ca -0.14 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 1sj9 n GLY 1093CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sj9 s THR 1094N -2.49 2.08 0.09 2.61 -4.23 -1.26 0.63 115.64 113.07 1sj9 s THR 1094Ca 0.09 -2.01 -0.26 0.00 -1.18 0.00 0.00 61.69 58.33 1sj9 s THR 1094Cb -0.02 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.97 1sj9 s THR 1094CO 0.05 -0.04 1.14 0.28 -0.54 0.00 0.00 174.62 175.51 1sj9 s THR 1095N -2.68 0.00 -0.27 3.99 -1.32 -0.76 -4.70 115.64 109.90 1sj9 s THR 1095Ca 0.35 -0.42 0.02 0.00 -1.21 0.00 0.00 61.69 60.43 1sj9 s THR 1095Cb 0.08 -2.63 0.06 0.00 -1.51 0.00 0.00 72.50 68.50 1sj9 s THR 1095CO 0.18 0.00 -0.09 -0.83 -2.21 0.00 0.00 174.62 171.67 1sj9 s GLY 1096N -3.38 1.68 0.51 6.08 0.00 -1.24 -0.69 107.32 110.28 1sj9 s GLY 1096Ca 0.21 -1.76 -0.20 0.00 0.00 0.00 0.00 44.72 42.97 1sj9 s GLY 1096CO 0.02 0.62 1.08 0.00 0.00 0.00 0.00 173.10 174.82 1sj9 s ALA 1097N 1.13 2.79 -0.72 3.20 0.00 0.78 -2.60 121.76 126.34 1sj9 s ALA 1097Ca -0.08 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.67 1sj9 s ALA 1097Cb -0.20 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1sj9 s ALA 1097CO -0.04 -0.53 0.55 0.44 0.00 0.00 0.00 175.76 176.17 1sj9 n ILE 1098N -1.13 0.00 -3.68 0.00 -5.35 -0.73 0.27 119.36 108.73 1sj9 n ILE 1098Ca 0.10 -0.41 -0.37 0.00 -0.27 0.00 0.00 62.75 61.81 1sj9 n ILE 1098Cb 0.52 1.09 -0.11 0.00 -1.74 0.00 0.00 39.64 39.40 1sj9 n ILE 1098CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1sj9 s GLN 1099N -1.25 3.95 0.31 6.28 -1.52 -1.26 -4.34 119.66 121.84 1sj9 s GLN 1099Ca 0.06 -0.33 0.08 0.00 -1.95 0.00 0.00 55.36 53.22 1sj9 s GLN 1099Cb 0.07 -3.52 0.82 0.00 -0.22 0.00 0.00 33.01 30.16 1sj9 s GLN 1099CO 0.22 -0.05 1.75 -1.35 -0.25 0.00 0.00 175.29 175.60 1sj9 h PRO 1100N 7.88 0.64 -0.11 2.91 0.11 -1.93 0.34 132.00 141.84 1sj9 h PRO 1100Ca -0.37 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.74 1sj9 h PRO 1100Cb 1.18 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1sj9 h PRO 1100CO 0.61 0.42 0.09 1.12 -0.21 0.00 0.00 178.00 180.03 1sj9 h HIS 1101N 0.66 0.00 -3.38 0.65 2.07 -1.94 -3.39 115.15 109.81 1sj9 h HIS 1101Ca 0.62 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 57.55 1sj9 h HIS 1101Cb 1.09 0.00 -0.08 0.00 2.57 0.00 0.00 27.41 30.98 1sj9 h HIS 1101CO -0.01 0.00 0.16 0.42 -3.07 0.00 0.00 177.93 175.43 1sj9 s ILE 1102N -4.93 5.00 0.56 6.12 1.01 0.12 -5.06 121.20 124.01 1sj9 s ILE 1102Ca -0.05 1.29 0.04 0.00 0.00 0.00 0.00 60.65 61.93 1sj9 s ILE 1102Cb 0.17 -3.99 0.04 0.00 0.01 0.00 0.00 42.46 38.69 1sj9 s ILE 1102CO 0.64 0.12 0.32 0.54 0.00 0.00 0.00 174.94 176.57 1sj9 s ASN 1103N 1.12 4.50 0.27 3.58 4.22 -1.26 -4.78 114.94 122.59 1sj9 s ASN 1103Ca 0.31 -1.40 -0.28 0.00 -2.14 0.00 0.00 52.86 49.36 1sj9 s ASN 1103Cb -0.16 0.59 -0.09 0.00 1.28 0.00 0.00 41.25 42.87 1sj9 s ASN 1103CO 0.12 -1.12 0.93 -0.69 -2.04 0.00 0.00 177.10 174.30 1sj9 s VAL 1104N -2.83 4.15 0.00 3.54 1.01 -1.26 -3.74 120.40 121.26 1sj9 s VAL 1104Ca 0.25 1.96 0.00 0.00 0.00 0.00 0.00 61.98 64.18 1sj9 s VAL 1104Cb -0.02 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1sj9 s VAL 1104CO 0.16 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1sj9 n GLY 1105N 1.10 0.33 3.94 4.51 0.00 -1.14 -5.00 105.19 108.93 1sj9 n GLY 1105Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1sj9 n GLY 1105CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sj9 s ASP 1106N -2.22 4.44 -0.12 1.61 1.01 -1.25 -4.86 116.67 115.28 1sj9 s ASP 1106Ca 0.00 0.30 0.01 0.00 0.71 0.00 0.00 52.55 53.56 1sj9 s ASP 1106Cb 0.00 -0.80 0.02 0.00 1.01 0.00 0.00 42.92 43.16 1sj9 s ASP 1106CO 0.00 -1.84 -0.12 -0.69 0.21 0.00 0.00 175.17 172.72 1sj9 s VAL 1107N -3.35 1.38 -0.19 -1.27 1.01 -0.34 -3.03 120.40 114.61 1sj9 s VAL 1107Ca 0.64 -0.53 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 1sj9 s VAL 1107Cb -0.09 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1sj9 s VAL 1107CO 0.46 0.42 0.00 -0.76 0.00 0.00 0.00 175.10 175.23 1sj9 s LEU 1108N 1.38 3.33 -0.26 3.92 1.43 -0.99 -1.09 118.68 126.40 1sj9 s LEU 1108Ca 0.01 -0.15 -0.09 0.00 -1.03 0.00 0.00 54.13 52.88 1sj9 s LEU 1108Cb -0.13 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1sj9 s LEU 1108CO -0.07 0.10 0.11 -0.69 0.23 0.00 0.00 176.35 176.03 1sj9 s VAL 1109N 0.79 4.65 -0.36 -1.59 1.01 0.07 -1.71 120.40 123.27 1sj9 s VAL 1109Ca 0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.69 1sj9 s VAL 1109Cb -0.14 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.06 1sj9 s VAL 1109CO 0.02 0.32 0.83 -0.89 0.00 0.00 0.00 175.10 175.37 1sj9 s THR 1110N 1.61 4.70 0.04 3.92 2.01 -1.09 -0.98 115.64 125.85 1sj9 s THR 1110Ca 0.06 1.01 -0.16 0.00 0.31 0.00 0.00 61.69 62.91 1sj9 s THR 1110Cb -0.15 -4.24 -0.27 0.00 0.01 0.00 0.00 72.50 67.85 1sj9 s THR 1110CO 0.06 -0.44 1.10 0.71 -0.69 0.00 0.00 174.62 175.36 1sj9 h THR 1111N 5.75 1.32 -1.10 -0.82 1.35 -0.56 -3.41 112.91 115.44 1sj9 h THR 1111Ca -0.24 -2.36 0.19 0.00 -0.55 0.00 0.00 66.41 63.45 1sj9 h THR 1111Cb 1.09 2.66 -0.31 0.00 -1.73 0.00 0.00 68.15 69.86 1sj9 h THR 1111CO 0.93 0.71 0.61 0.00 -0.25 0.00 0.00 175.52 177.52 1sj9 s ALA 1112N -3.04 -2.63 0.25 6.62 0.00 -1.25 -0.25 121.76 121.45 1sj9 s ALA 1112Ca -0.11 2.03 0.07 0.00 0.00 0.00 0.00 51.96 53.95 1sj9 s ALA 1112Cb 0.05 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 1sj9 s ALA 1112CO 0.90 -0.41 0.19 -1.54 0.00 0.00 0.00 175.76 174.91 1sj9 s SER 1113N 1.26 5.51 0.06 0.00 1.04 -1.09 -3.79 113.70 116.70 1sj9 s SER 1113Ca -0.07 -0.25 -0.31 0.00 0.48 0.00 0.00 55.95 55.80 1sj9 s SER 1113Cb -0.03 -1.40 -0.07 0.00 0.10 0.00 0.00 66.02 64.63 1sj9 s SER 1113CO -0.12 -0.03 1.44 -0.69 0.98 0.00 0.00 173.24 174.81 1sj9 s VAL 1114N -2.12 3.44 -1.21 5.02 1.01 0.52 -4.34 120.40 122.73 1sj9 s VAL 1114Ca 0.33 0.93 -0.18 0.00 0.00 0.00 0.00 61.98 63.07 1sj9 s VAL 1114Cb -0.08 -3.60 0.10 0.00 0.00 0.00 0.00 36.38 32.80 1sj9 s VAL 1114CO 0.25 0.03 1.57 -0.13 0.00 0.00 0.00 175.10 176.81 1sj9 s ARG 1115N 1.93 3.93 -0.15 2.72 0.52 -1.26 -1.46 118.95 125.18 1sj9 s ARG 1115Ca 0.66 -2.03 0.15 0.00 -0.52 0.00 0.00 55.73 53.99 1sj9 s ARG 1115Cb -0.35 -5.33 0.69 0.00 0.52 0.00 0.00 34.95 30.48 1sj9 s ARG 1115CO 0.29 -2.08 1.57 1.28 0.02 0.00 0.00 175.30 176.38 1sj9 n LEU 1116N 7.55 4.73 0.00 2.53 4.77 0.22 -4.89 117.00 131.90 1sj9 n LEU 1116Ca 0.41 -2.39 0.00 0.00 -0.03 0.00 0.00 56.01 54.00 1sj9 n LEU 1116Cb 0.46 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1sj9 n LEU 1116CO 0.69 0.67 0.00 -0.90 -1.33 0.00 0.00 177.39 176.52 1sj9 n ASP 1117N 0.81 0.38 0.00 -1.43 5.75 -1.05 -2.33 116.55 118.68 1sj9 n ASP 1117Ca 0.24 -0.44 0.00 0.00 -0.01 0.00 0.00 54.79 54.58 1sj9 n ASP 1117Cb 0.94 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.03 1sj9 n ASP 1117CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sj9 n GLY 1118N 5.00 0.02 0.38 6.12 0.00 -1.26 -4.84 105.19 110.62 1sj9 n GLY 1118Ca 0.00 -0.01 0.20 0.00 0.00 0.00 0.00 46.02 46.21 1sj9 n GLY 1118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 h ALA 1119N 0.00 2.08 0.00 4.61 0.00 -1.99 -0.13 119.26 123.84 1sj9 h ALA 1119Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1sj9 h ALA 1119Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1sj9 h ALA 1119CO 0.00 -0.61 -0.17 0.66 0.00 0.00 0.00 179.25 179.13 1sj9 h SER 1120N 0.00 0.00 0.68 0.00 4.64 -1.88 -1.95 113.55 115.04 1sj9 h SER 1120Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1sj9 h SER 1120Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1sj9 h SER 1120CO -0.00 0.17 0.00 0.18 -0.87 0.00 0.00 176.83 176.31 1sj9 n LEU 1121N -3.80 0.52 -0.02 5.97 4.77 -0.06 -1.33 117.00 123.06 1sj9 n LEU 1121Ca -0.02 0.63 0.15 0.00 -0.03 0.00 0.00 56.01 56.75 1sj9 n LEU 1121Cb 0.27 -0.56 0.86 0.00 -2.33 0.00 0.00 43.42 41.66 1sj9 n LEU 1121CO 0.32 -0.49 1.06 1.41 -1.33 0.00 0.00 177.39 178.37 1sj9 n HIS 1122N -2.08 0.00 -0.03 -1.77 8.25 -0.73 -3.92 115.22 114.95 1sj9 n HIS 1122Ca 0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.44 1sj9 n HIS 1122Cb 0.22 -0.11 -0.02 0.00 1.12 0.00 0.00 29.99 31.20 1sj9 n HIS 1122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1sj9 n PHE 1123N -1.08 0.00 -3.74 4.41 3.01 -0.44 -5.10 117.46 114.52 1sj9 n PHE 1123Ca 0.20 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.52 1sj9 n PHE 1123Cb 0.17 -0.19 -0.09 0.00 -0.01 0.00 0.00 39.48 39.37 1sj9 n PHE 1123CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1sj9 s ALA 1124N -2.10 -0.87 0.34 4.37 0.00 -0.96 -5.00 121.76 117.53 1sj9 s ALA 1124Ca -0.07 0.50 -0.28 0.00 0.00 0.00 0.00 51.96 52.10 1sj9 s ALA 1124Cb 0.02 -0.03 -0.12 0.00 0.00 0.00 0.00 23.12 22.99 1sj9 s ALA 1124CO 0.10 -0.26 1.38 -2.30 0.00 0.00 0.00 175.76 174.69 1sj9 n PRO 1125N 1.48 2.31 -0.43 0.00 -0.02 -1.26 -4.36 135.00 132.72 1sj9 n PRO 1125Ca -0.20 0.81 0.35 0.00 -2.02 0.00 0.00 63.50 62.44 1sj9 n PRO 1125Cb 0.56 -2.46 0.65 0.00 -0.02 0.00 0.00 33.50 32.23 1sj9 n PRO 1125CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1sj9 h MET 1126N 2.99 0.13 -0.52 -0.52 1.85 -1.95 0.24 114.93 117.16 1sj9 h MET 1126Ca -0.47 -0.01 0.10 0.00 -0.61 0.00 0.00 59.70 58.71 1sj9 h MET 1126Cb 1.27 -0.03 -0.10 0.00 0.43 0.00 0.00 31.60 33.17 1sj9 h MET 1126CO 0.65 0.09 -0.18 0.93 -0.40 0.00 0.00 176.91 178.00 1sj9 h GLU 1127N 0.13 -0.06 -6.65 0.39 3.07 -2.04 -3.41 114.58 106.01 1sj9 h GLU 1127Ca 0.76 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 59.04 1sj9 h GLU 1127Cb 2.43 0.01 0.12 0.00 -0.84 0.00 0.00 28.75 30.47 1sj9 h GLU 1127CO -0.32 -0.04 0.30 0.34 -1.40 0.00 0.00 179.01 177.89 1sj9 n PHE 1128N -5.40 1.65 -3.07 4.33 -0.00 0.86 -4.96 117.46 110.85 1sj9 n PHE 1128Ca 0.05 0.59 -0.39 0.00 -0.00 0.00 0.00 57.45 57.70 1sj9 n PHE 1128Cb 0.30 -2.31 -0.06 0.00 -0.00 0.00 0.00 39.48 37.42 1sj9 n PHE 1128CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1sj9 s PRO 1129N -1.87 4.44 0.00 -7.13 0.04 -1.26 -4.93 135.00 124.30 1sj9 s PRO 1129Ca 0.59 1.01 -0.04 0.00 0.04 0.00 0.00 61.00 62.60 1sj9 s PRO 1129Cb -0.59 -3.27 -0.16 0.00 0.04 0.00 0.00 34.50 30.51 1sj9 s PRO 1129CO 0.60 0.54 2.92 0.00 0.04 0.00 0.00 177.00 181.10 1sj9 n ALA 1130N 1.86 5.34 -1.95 8.56 0.00 -1.26 -4.85 120.51 128.21 1sj9 n ALA 1130Ca -0.07 -1.10 -0.41 0.00 0.00 0.00 0.00 53.44 51.86 1sj9 n ALA 1130Cb 0.50 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 1sj9 n ALA 1130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1sj9 s VAL 1131N 0.69 3.25 0.62 0.00 0.11 -1.26 -2.66 120.40 121.14 1sj9 s VAL 1131Ca 0.40 1.08 -0.13 0.00 -2.93 0.00 0.00 61.98 60.41 1sj9 s VAL 1131Cb 0.19 -3.69 -0.03 0.00 -1.53 0.00 0.00 36.38 31.32 1sj9 s VAL 1131CO 0.00 0.19 1.04 0.00 -3.33 0.00 0.00 175.10 173.00 1sj9 s ALA 1132N -0.27 2.89 0.18 1.54 0.00 0.65 -4.72 121.76 122.02 1sj9 s ALA 1132Ca 0.53 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 52.32 1sj9 s ALA 1132Cb -0.36 -3.15 -0.08 0.00 0.00 0.00 0.00 23.12 19.53 1sj9 s ALA 1132CO 0.40 -0.78 1.25 0.34 0.00 0.00 0.00 175.76 176.97 1sj9 s ASP 1133N -3.52 7.00 0.10 0.00 2.15 0.03 -4.93 116.67 117.49 1sj9 s ASP 1133Ca 0.59 2.28 -0.35 0.00 0.43 0.00 0.00 52.55 55.50 1sj9 s ASP 1133Cb -0.13 -2.60 -0.15 0.00 -0.30 0.00 0.00 42.92 39.74 1sj9 s ASP 1133CO 0.46 -0.45 1.55 0.15 -0.17 0.00 0.00 175.17 176.71 1sj9 h PHE 1134N 5.50 -1.52 -0.55 -5.34 3.57 -1.94 -1.65 116.94 115.01 1sj9 h PHE 1134Ca -0.44 0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.19 1sj9 h PHE 1134Cb 1.21 0.64 -0.11 0.00 2.79 0.00 0.00 35.95 40.49 1sj9 h PHE 1134CO 0.63 -0.61 -0.34 0.00 -2.23 0.00 0.00 178.31 175.76 1sj9 h ALA 1135N -0.59 -0.09 -0.28 2.41 0.00 -1.94 0.51 119.26 119.27 1sj9 h ALA 1135Ca -0.01 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1sj9 h ALA 1135Cb 0.77 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1sj9 h ALA 1135CO -0.26 -0.70 0.19 0.00 0.00 0.00 0.00 179.25 178.48 1sj9 h THR 1137N 0.25 1.43 0.04 0.00 2.02 0.01 -2.25 112.91 114.41 1sj9 h THR 1137Ca 0.12 -1.29 0.03 0.00 0.77 0.00 0.00 66.41 66.03 1sj9 h THR 1137Cb 0.15 2.28 -0.05 0.00 -1.74 0.00 0.00 68.15 68.79 1sj9 h THR 1137CO -0.02 0.34 -0.39 0.74 0.37 0.00 0.00 175.52 176.56 1sj9 h THR 1138N -0.50 0.20 -0.97 3.16 2.02 -0.40 0.32 112.91 116.75 1sj9 h THR 1138Ca 0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 1sj9 h THR 1138Cb 0.57 0.20 -0.09 0.00 -1.74 0.00 0.00 68.15 67.09 1sj9 h THR 1138CO 0.00 0.00 0.61 0.00 0.37 0.00 0.00 175.52 176.50 1sj9 h ALA 1139N 0.01 1.74 -0.11 6.16 0.00 -1.35 0.20 119.26 125.91 1sj9 h ALA 1139Ca 0.04 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1sj9 h ALA 1139Cb 0.64 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1sj9 h ALA 1139CO -0.28 -0.04 -0.00 -0.07 0.00 0.00 0.00 179.25 178.87 1sj9 h LEU 1140N 0.77 0.19 -0.43 0.00 3.38 -0.48 -0.93 115.31 117.81 1sj9 h LEU 1140Ca 0.51 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1sj9 h LEU 1140Cb 0.78 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1sj9 h LEU 1140CO -0.28 0.46 0.04 0.58 0.09 0.00 0.00 178.44 179.32 1sj9 h VAL 1141N -0.08 1.25 0.00 1.22 2.07 0.47 -1.59 116.25 119.59 1sj9 h VAL 1141Ca 0.03 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1sj9 h VAL 1141Cb 0.36 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1sj9 h VAL 1141CO 0.01 0.33 0.00 -1.84 0.02 0.00 0.00 177.57 176.08 1sj9 n GLU 1142N -4.45 0.09 0.04 1.57 0.28 0.62 -2.43 120.64 116.36 1sj9 n GLU 1142Ca -0.00 0.21 -0.21 0.00 -0.16 0.00 0.00 57.16 57.00 1sj9 n GLU 1142Cb 0.27 -1.64 -0.14 0.00 1.43 0.00 0.00 31.44 31.35 1sj9 n GLU 1142CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1sj9 h ALA 1143N 2.59 0.03 0.00 -1.84 0.00 -0.64 -2.58 119.26 116.82 1sj9 h ALA 1143Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 1sj9 h ALA 1143Cb 0.43 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1sj9 h ALA 1143CO 0.00 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1sj9 h ALA 1144N 0.03 1.00 0.07 0.00 0.00 -1.11 -2.91 119.26 116.33 1sj9 h ALA 1144Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.37 1sj9 h ALA 1144Cb 1.76 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.52 1sj9 h ALA 1144CO 0.12 0.00 -1.66 1.63 0.00 0.00 0.00 179.25 179.34 1sj9 n LYS 1145N -2.46 0.67 -0.11 0.00 5.02 -1.02 0.65 118.16 120.91 1sj9 n LYS 1145Ca 0.02 0.41 0.18 0.00 -2.02 0.00 0.00 58.31 56.90 1sj9 n LYS 1145Cb 0.25 -1.73 0.58 0.00 -0.02 0.00 0.00 35.03 34.12 1sj9 n LYS 1145CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1sj9 h SER 1146N -0.44 0.23 0.86 4.39 4.64 -1.31 2.01 113.55 123.93 1sj9 h SER 1146Ca -0.39 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1sj9 h SER 1146Cb 1.69 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1sj9 h SER 1146CO -0.06 0.12 -0.44 -0.38 -0.87 0.00 0.00 176.83 175.20 1sj9 n ILE 1147N -4.43 0.25 -2.02 0.95 2.08 -1.11 -4.99 119.36 110.09 1sj9 n ILE 1147Ca 0.13 -0.17 -0.02 0.00 0.56 0.00 0.00 62.75 63.25 1sj9 n ILE 1147Cb 0.59 -0.13 0.00 0.00 -0.75 0.00 0.00 39.64 39.35 1sj9 n ILE 1147CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1sj9 n GLY 1148N 1.40 -0.83 2.92 7.39 0.00 0.68 -5.07 105.19 111.68 1sj9 n GLY 1148Ca 0.05 0.28 -0.22 0.00 0.00 0.00 0.00 46.02 46.13 1sj9 n GLY 1148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 s ALA 1149N -2.04 0.86 -0.30 4.61 0.00 0.21 -4.97 121.76 120.13 1sj9 s ALA 1149Ca 0.06 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 1sj9 s ALA 1149Cb -0.02 -0.49 -0.08 0.00 0.00 0.00 0.00 23.12 22.54 1sj9 s ALA 1149CO 0.28 -0.01 2.24 2.41 0.00 0.00 0.00 175.76 180.68 1sj9 n THR 1150N 4.06 0.24 -4.27 0.00 -1.04 -1.26 -4.61 114.28 107.40 1sj9 n THR 1150Ca -0.23 -0.42 -0.25 0.00 -2.04 0.00 0.00 64.05 61.11 1sj9 n THR 1150Cb 0.51 -2.26 -0.08 0.00 -1.82 0.00 0.00 70.33 66.68 1sj9 n THR 1150CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1sj9 s THR 1151N 8.42 3.45 -0.07 12.58 2.01 -1.26 -1.20 115.64 139.57 1sj9 s THR 1151Ca 1.04 -1.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.27 1sj9 s THR 1151Cb -0.50 -2.79 0.04 0.00 0.01 0.00 0.00 72.50 69.26 1sj9 s THR 1151CO 0.39 -0.25 0.16 -1.00 -0.69 0.00 0.00 174.62 173.22 1sj9 s HIS 1152N -2.04 -0.18 -0.02 4.92 3.76 -0.25 -4.93 115.29 116.55 1sj9 s HIS 1152Ca 0.29 0.52 0.08 0.00 -0.15 0.00 0.00 55.06 55.80 1sj9 s HIS 1152Cb -0.08 -0.08 -0.02 0.00 1.11 0.00 0.00 32.58 33.52 1sj9 s HIS 1152CO 0.18 -0.18 -0.26 0.08 -0.85 0.00 0.00 174.74 173.72 1sj9 s VAL 1153N 1.22 2.05 -0.93 -0.90 1.01 -1.26 -0.75 120.40 120.84 1sj9 s VAL 1153Ca -0.09 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 60.78 1sj9 s VAL 1153Cb -0.11 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1sj9 s VAL 1153CO -0.06 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1sj9 n GLY 1154N 2.42 -0.67 3.79 4.51 0.00 -0.15 -4.95 105.19 110.14 1sj9 n GLY 1154Ca -0.16 -0.35 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 1sj9 n GLY 1154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sj9 s VAL 1155N -4.00 5.09 0.12 1.61 1.01 -1.26 0.26 120.40 123.23 1sj9 s VAL 1155Ca 0.00 0.86 0.09 0.00 0.00 0.00 0.00 61.98 62.93 1sj9 s VAL 1155Cb 0.00 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1sj9 s VAL 1155CO 0.00 0.49 -0.20 -0.89 0.00 0.00 0.00 175.10 174.50 1sj9 s THR 1156N -0.45 2.72 -0.23 3.92 2.01 -1.25 0.28 115.64 122.64 1sj9 s THR 1156Ca 0.24 -1.56 -0.08 0.00 0.31 0.00 0.00 61.69 60.60 1sj9 s THR 1156Cb -0.16 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 1sj9 s THR 1156CO 0.12 0.09 0.09 0.00 -0.69 0.00 0.00 174.62 174.23 1sj9 s ALA 1157N -1.14 3.29 -0.42 7.40 0.00 -0.36 -0.35 121.76 130.18 1sj9 s ALA 1157Ca 0.17 -1.01 -0.12 0.00 0.00 0.00 0.00 51.96 51.00 1sj9 s ALA 1157Cb -0.10 -2.09 0.06 0.00 0.00 0.00 0.00 23.12 20.99 1sj9 s ALA 1157CO 0.09 -0.29 0.29 0.45 0.00 0.00 0.00 175.76 176.30 1sj9 s SER 1158N 1.26 5.85 -0.08 0.00 0.15 -0.54 -1.19 113.70 119.15 1sj9 s SER 1158Ca 0.05 -1.29 -0.03 0.00 0.70 0.00 0.00 55.95 55.38 1sj9 s SER 1158Cb -0.14 -2.07 -0.04 0.00 -1.71 0.00 0.00 66.02 62.06 1sj9 s SER 1158CO 0.04 -0.53 0.06 -0.55 1.20 0.00 0.00 173.24 173.46 1sj9 s SER 1159N 2.10 5.69 0.47 5.45 0.15 0.11 -0.61 113.70 127.06 1sj9 s SER 1159Ca 0.03 0.25 0.26 0.00 0.70 0.00 0.00 55.95 57.20 1sj9 s SER 1159Cb -0.22 -1.70 0.75 0.00 -1.71 0.00 0.00 66.02 63.14 1sj9 s SER 1159CO 0.05 0.37 1.76 0.44 1.20 0.00 0.00 173.24 177.06 1sj9 h ASP 1160N 4.94 0.00 -2.30 5.45 3.45 -1.75 -3.38 116.42 122.82 1sj9 h ASP 1160Ca -0.52 0.00 -0.58 0.00 0.43 0.00 0.00 57.03 56.36 1sj9 h ASP 1160Cb 1.20 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.86 1sj9 h ASP 1160CO 0.57 0.06 -0.68 0.42 -1.57 0.00 0.00 179.24 178.03 1sj9 s THR 1161N -3.40 3.19 -0.26 0.35 -4.23 -1.26 -5.00 115.64 105.03 1sj9 s THR 1161Ca 0.04 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.75 1sj9 s THR 1161Cb 0.07 -2.68 -0.30 0.00 1.34 0.00 0.00 72.50 70.93 1sj9 s THR 1161CO 0.63 -0.35 0.55 0.33 -0.54 0.00 0.00 174.62 175.24 1sj9 n PHE 1162N -0.72 0.00 -0.03 3.99 -0.00 -1.26 -4.23 117.46 115.20 1sj9 n PHE 1162Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.35 1sj9 n PHE 1162Cb 0.59 -0.36 -0.01 0.00 -0.00 0.00 0.00 39.48 39.70 1sj9 n PHE 1162CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1sj9 n TYR 1163N -2.04 0.00 0.02 -5.13 4.02 -1.26 -4.45 117.16 108.33 1sj9 n TYR 1163Ca -0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.75 1sj9 n TYR 1163Cb 0.48 -0.21 -0.09 0.00 -0.02 0.00 0.00 39.34 39.50 1sj9 n TYR 1163CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1sj9 h PRO 1164N -0.42 -0.09 -1.34 -0.72 0.13 -1.86 0.96 132.00 128.66 1sj9 h PRO 1164Ca 0.00 0.01 0.40 0.00 -0.87 0.00 0.00 66.00 65.53 1sj9 h PRO 1164Cb 0.42 0.02 -0.09 0.00 0.13 0.00 0.00 31.00 31.48 1sj9 h PRO 1164CO 0.00 0.39 0.92 0.78 -0.23 0.00 0.00 178.00 179.86 1sj9 h GLY 1165N -0.63 0.66 -3.15 1.56 0.00 -1.87 1.16 103.07 100.79 1sj9 h GLY 1165Ca -0.01 -0.08 -0.43 0.00 0.00 0.00 0.00 47.33 46.81 1sj9 h GLY 1165CO 0.02 -0.15 0.00 -1.06 0.00 0.00 0.00 176.54 175.35 1sj9 n GLN 1166N -4.39 2.56 -3.82 4.80 6.02 -1.21 -4.90 117.38 116.44 1sj9 n GLN 1166Ca 0.32 -3.47 -0.25 0.00 -0.01 0.00 0.00 57.00 53.59 1sj9 n GLN 1166Cb 1.36 -2.09 -0.04 0.00 1.02 0.00 0.00 30.24 30.50 1sj9 n GLN 1166CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1sj9 n GLU 1167N -0.97 -0.77 -3.31 -1.09 2.13 0.40 -4.91 120.64 112.12 1sj9 n GLU 1167Ca 0.46 -0.02 -0.38 0.00 0.66 0.00 0.00 57.16 57.87 1sj9 n GLU 1167Cb 0.98 -1.97 -0.06 0.00 0.27 0.00 0.00 31.44 30.66 1sj9 n GLU 1167CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1sj9 s ARG 1168N -6.24 4.24 0.00 5.31 0.52 0.33 -4.99 118.95 118.12 1sj9 s ARG 1168Ca 0.13 0.55 0.08 0.00 -0.52 0.00 0.00 55.73 55.97 1sj9 s ARG 1168Cb -0.07 -3.35 -0.05 0.00 0.52 0.00 0.00 34.95 32.00 1sj9 s ARG 1168CO 0.66 0.36 0.42 0.66 0.02 0.00 0.00 175.30 177.42 1sj9 n TYR 1169N 2.89 0.00 -1.01 -0.53 4.02 -1.26 -4.49 117.16 116.78 1sj9 n TYR 1169Ca -0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.67 1sj9 n TYR 1169Cb 0.51 0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.67 1sj9 n TYR 1169CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1sj9 n ASP 1170N -0.81 5.38 -4.78 7.72 2.03 -1.26 -4.36 116.55 120.47 1sj9 n ASP 1170Ca 0.02 -2.48 -0.27 0.00 0.52 0.00 0.00 54.79 52.58 1sj9 n ASP 1170Cb 0.14 -1.42 -0.06 0.00 -0.72 0.00 0.00 41.12 39.06 1sj9 n ASP 1170CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1sj9 s THR 1171N 1.05 1.85 0.08 5.18 -4.23 -1.26 -5.02 115.64 113.30 1sj9 s THR 1171Ca 0.67 -1.72 -0.36 0.00 -1.18 0.00 0.00 61.69 59.10 1sj9 s THR 1171Cb 0.31 -2.57 -0.17 0.00 1.34 0.00 0.00 72.50 71.41 1sj9 s THR 1171CO -0.00 0.00 1.57 0.22 -0.54 0.00 0.00 174.62 175.87 1sj9 h TYR 1172N 1.24 -1.34 -0.09 3.99 5.03 -1.99 -2.76 116.97 121.04 1sj9 h TYR 1172Ca -0.41 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 60.81 1sj9 h TYR 1172Cb 1.28 0.52 -0.01 0.00 1.55 0.00 0.00 36.73 40.06 1sj9 h TYR 1172CO 0.93 -0.67 -0.38 0.66 -1.32 0.00 0.00 178.16 177.39 1sj9 h SER 1173N -1.01 0.19 -5.99 -2.11 4.64 -1.97 -3.47 113.55 103.83 1sj9 h SER 1173Ca -0.06 -0.07 -0.42 0.00 -0.47 0.00 0.00 61.79 60.76 1sj9 h SER 1173Cb 0.87 -0.05 0.08 0.00 -0.31 0.00 0.00 62.40 62.99 1sj9 h SER 1173CO -0.04 0.56 -0.72 0.61 -0.87 0.00 0.00 176.83 176.37 1sj9 n GLY 1174N -0.30 -0.50 3.33 -0.77 0.00 -1.04 -4.99 105.19 100.93 1sj9 n GLY 1174Ca -0.01 0.21 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 1sj9 n GLY 1174CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sj9 s ARG 1175N -6.30 0.41 0.04 1.61 3.00 -1.26 -5.00 118.95 111.45 1sj9 s ARG 1175Ca 0.52 0.97 0.04 0.00 -1.00 0.00 0.00 55.73 56.26 1sj9 s ARG 1175Cb -0.24 0.18 -0.04 0.00 0.00 0.00 0.00 34.95 34.85 1sj9 s ARG 1175CO 0.77 -0.20 -0.05 0.08 0.00 0.00 0.00 175.30 175.91 1sj9 s VAL 1176N 1.98 3.76 0.90 7.11 1.01 -1.26 -5.00 120.40 128.90 1sj9 s VAL 1176Ca -0.06 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 60.92 1sj9 s VAL 1176Cb -0.10 -2.70 0.14 0.00 0.00 0.00 0.00 36.38 33.72 1sj9 s VAL 1176CO -0.14 0.28 1.11 0.54 0.00 0.00 0.00 175.10 176.89 1sj9 s VAL 1177N -1.12 2.46 0.17 2.92 0.11 -1.26 -4.66 120.40 119.02 1sj9 s VAL 1177Ca 0.20 0.15 -0.16 0.00 -2.93 0.00 0.00 61.98 59.24 1sj9 s VAL 1177Cb -0.11 -2.36 0.08 0.00 -1.53 0.00 0.00 36.38 32.46 1sj9 s VAL 1177CO 0.12 -0.20 1.69 -0.09 -3.33 0.00 0.00 175.10 173.29 1sj9 h ARG 1178N -1.73 0.09 -0.12 1.54 2.43 -1.99 0.66 114.38 115.26 1sj9 h ARG 1178Ca -0.46 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.74 1sj9 h ARG 1178Cb 1.27 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1sj9 h ARG 1178CO 0.47 0.06 0.19 -0.09 -1.51 0.00 0.00 179.97 179.09 1sj9 h ARG 1179N 0.09 0.00 0.00 0.20 1.12 -2.03 -2.44 114.38 111.32 1sj9 h ARG 1179Ca 0.20 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.07 1sj9 h ARG 1179Cb 0.28 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.24 1sj9 h ARG 1179CO -0.34 0.00 -0.03 1.19 -3.11 0.00 0.00 179.97 177.69 1sj9 n PHE 1180N -3.48 0.00 -3.16 2.20 3.01 -0.41 -4.87 117.46 110.75 1sj9 n PHE 1180Ca 0.00 -0.70 -0.39 0.00 1.01 0.00 0.00 57.45 57.37 1sj9 n PHE 1180Cb 0.29 -0.10 -0.05 0.00 -0.01 0.00 0.00 39.48 39.61 1sj9 n PHE 1180CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1sj9 s LYS 1181N -1.83 4.36 -1.49 -1.08 1.02 0.09 -3.80 119.74 117.01 1sj9 s LYS 1181Ca 0.16 0.79 0.00 0.00 0.02 0.00 0.00 55.97 56.94 1sj9 s LYS 1181Cb 0.14 -3.36 0.00 0.00 -0.52 0.00 0.00 37.83 34.09 1sj9 s LYS 1181CO 0.01 0.31 0.00 0.41 -0.92 0.00 0.00 175.35 175.16 1sj9 n GLY 1182N 2.55 1.33 0.02 -3.33 0.00 -1.26 -4.81 105.19 99.69 1sj9 n GLY 1182Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.09 1sj9 n GLY 1182CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sj9 n SER 1183N -0.94 0.11 0.01 1.61 3.41 -1.25 -3.65 113.62 112.92 1sj9 n SER 1183Ca -0.14 0.51 -0.10 0.00 -0.26 0.00 0.00 58.87 58.89 1sj9 n SER 1183Cb 0.56 -0.54 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 1sj9 n SER 1183CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1sj9 h MET 1184N 0.00 -0.13 -1.00 4.33 2.86 -1.87 -0.56 114.93 118.56 1sj9 h MET 1184Ca 0.00 0.01 0.20 0.00 -2.06 0.00 0.00 59.70 57.85 1sj9 h MET 1184Cb 0.47 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 32.05 1sj9 h MET 1184CO 0.00 0.35 0.61 0.93 1.06 0.00 0.00 176.91 179.86 1sj9 h GLU 1185N -0.92 0.70 0.01 1.72 5.08 -1.98 0.20 114.58 119.40 1sj9 h GLU 1185Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1sj9 h GLU 1185Cb 0.54 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1sj9 h GLU 1185CO 0.02 0.47 -0.04 1.49 -1.00 0.00 0.00 179.01 179.95 1sj9 h GLU 1186N 0.72 -0.06 -0.48 2.33 4.57 -1.61 0.35 114.58 120.41 1sj9 h GLU 1186Ca 0.59 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.87 1sj9 h GLU 1186Cb 0.97 0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 29.48 1sj9 h GLU 1186CO -0.39 -0.04 -0.12 -1.49 -1.18 0.00 0.00 179.01 175.80 1sj9 h TRP 1187N -0.06 -0.25 0.71 0.92 -0.00 -0.17 0.79 115.95 117.89 1sj9 h TRP 1187Ca -0.00 0.04 -0.03 0.00 -0.00 0.00 0.00 58.89 58.90 1sj9 h TRP 1187Cb 0.06 0.18 0.01 0.00 -0.00 0.00 0.00 29.16 29.41 1sj9 h TRP 1187CO -0.30 -0.20 -0.34 1.96 -0.00 0.00 0.00 178.44 179.56 1sj9 h GLN 1188N 0.00 -0.92 -0.82 0.49 4.20 -0.90 0.18 115.11 117.34 1sj9 h GLN 1188Ca 0.23 0.06 0.17 0.00 0.06 0.00 0.00 58.65 59.17 1sj9 h GLN 1188Cb 0.35 0.21 -0.11 0.00 0.30 0.00 0.00 27.48 28.23 1sj9 h GLN 1188CO -0.49 -0.60 0.35 0.00 -0.67 0.00 0.00 178.83 177.42 1sj9 h ALA 1189N -0.77 1.23 0.00 3.87 0.00 -0.11 0.98 119.26 124.45 1sj9 h ALA 1189Ca -0.10 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1sj9 h ALA 1189Cb 0.75 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1sj9 h ALA 1189CO 0.16 -0.24 -0.03 0.52 0.00 0.00 0.00 179.25 179.66 1sj9 h MET 1190N 0.45 0.00 0.00 0.00 2.86 -0.58 -3.46 114.93 114.20 1sj9 h MET 1190Ca 0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.12 1sj9 h MET 1190Cb 0.79 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 1sj9 h MET 1190CO -0.45 0.03 0.00 0.41 1.06 0.00 0.00 176.91 177.95 1sj9 n GLY 1191N -0.64 0.72 3.71 8.32 0.00 0.34 -5.07 105.19 112.57 1sj9 n GLY 1191Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1sj9 n GLY 1191CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1sj9 n VAL 1192N -1.07 0.58 0.04 1.61 0.31 0.51 -4.64 118.33 115.67 1sj9 n VAL 1192Ca 0.00 -0.15 -0.02 0.00 -0.01 0.00 0.00 64.34 64.16 1sj9 n VAL 1192Cb 0.00 -1.80 -0.08 0.00 -0.91 0.00 0.00 33.84 31.05 1sj9 n VAL 1192CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sj9 h MET 1193N 5.36 0.00 0.00 5.55 -0.00 -0.48 -3.39 114.93 121.96 1sj9 h MET 1193Ca -0.45 0.00 -0.10 0.00 -0.00 0.00 0.00 59.70 59.15 1sj9 h MET 1193Cb 1.23 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.81 1sj9 h MET 1193CO 0.84 0.42 -0.01 0.27 -0.00 0.00 0.00 176.91 178.43 1sj9 n ASN 1194N -3.01 -0.78 -4.02 -0.10 6.94 -1.26 -1.78 115.26 111.26 1sj9 n ASN 1194Ca -0.09 -1.85 -0.19 0.00 -0.02 0.00 0.00 54.58 52.43 1sj9 n ASN 1194Cb 0.88 1.39 -0.15 0.00 -2.36 0.00 0.00 39.78 39.54 1sj9 n ASN 1194CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1sj9 s TYR 1195N -4.57 0.81 0.25 -2.53 2.02 -1.07 -1.22 117.35 111.05 1sj9 s TYR 1195Ca 0.12 -0.16 -0.08 0.00 -0.37 0.00 0.00 57.07 56.58 1sj9 s TYR 1195Cb -0.01 -0.53 0.03 0.00 -0.40 0.00 0.00 41.96 41.05 1sj9 s TYR 1195CO 0.09 -0.02 0.48 -0.85 -1.57 0.00 0.00 175.55 173.68 1sj9 n GLU 1196N 2.90 0.70 0.00 -0.62 -0.00 -0.33 -3.64 120.64 119.65 1sj9 n GLU 1196Ca -0.14 -1.51 0.00 0.00 -0.00 0.00 0.00 57.16 55.51 1sj9 n GLU 1196Cb 0.57 1.81 0.00 0.00 -0.00 0.00 0.00 31.44 33.81 1sj9 n GLU 1196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1sj9 n MET 1197N -0.35 -0.12 0.00 3.44 2.81 -1.26 -0.72 117.12 120.92 1sj9 n MET 1197Ca -0.05 -0.46 0.00 0.00 -1.81 0.00 0.00 57.70 55.38 1sj9 n MET 1197Cb 0.39 -0.80 0.00 0.00 -0.71 0.00 0.00 33.22 32.10 1sj9 n MET 1197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1sj9 n GLU 1198N -0.06 2.54 -0.32 0.03 4.71 -1.26 -4.05 120.64 122.23 1sj9 n GLU 1198Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.11 1sj9 n GLU 1198Cb 0.15 -0.85 -0.01 0.00 -1.01 0.00 0.00 31.44 29.72 1sj9 n GLU 1198CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1sj9 n SER 1199N -1.42 -0.65 -0.34 1.62 3.41 -1.26 -1.25 113.62 113.72 1sj9 n SER 1199Ca 0.00 1.41 0.14 0.00 -0.26 0.00 0.00 58.87 60.16 1sj9 n SER 1199Cb 0.26 -0.26 0.35 0.00 -0.26 0.00 0.00 64.21 64.30 1sj9 n SER 1199CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sj9 h ALA 1200N 0.81 1.76 -0.20 7.33 0.00 -1.90 0.15 119.26 127.21 1sj9 h ALA 1200Ca 0.22 0.08 -0.19 0.00 0.00 0.00 0.00 54.91 55.01 1sj9 h ALA 1200Cb 0.42 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1sj9 h ALA 1200CO -0.78 -0.14 -0.64 1.15 0.00 0.00 0.00 179.25 178.85 1sj9 h THR 1201N 0.70 1.30 0.25 0.00 2.02 -1.54 -1.90 112.91 113.74 1sj9 h THR 1201Ca 0.58 -1.87 -0.01 0.00 0.77 0.00 0.00 66.41 65.88 1sj9 h THR 1201Cb 0.99 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1sj9 h THR 1201CO -0.37 0.59 -0.12 0.25 0.37 0.00 0.00 175.52 176.24 1sj9 h LEU 1202N 0.52 -0.28 -1.89 2.58 5.85 -1.18 -0.83 115.31 120.07 1sj9 h LEU 1202Ca -0.01 0.01 0.27 0.00 0.84 0.00 0.00 57.88 58.98 1sj9 h LEU 1202Cb 1.23 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.30 1sj9 h LEU 1202CO 0.13 -0.08 0.75 -0.07 -0.34 0.00 0.00 178.44 178.83 1sj9 h LEU 1203N -0.57 0.00 0.12 2.25 3.38 -0.87 -1.05 115.31 118.57 1sj9 h LEU 1203Ca -0.03 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 1sj9 h LEU 1203Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1sj9 h LEU 1203CO 0.06 0.00 -1.48 0.74 0.09 0.00 0.00 178.44 177.85 1sj9 h THR 1204N 0.00 1.00 0.00 0.22 2.02 -1.36 -2.64 112.91 112.15 1sj9 h THR 1204Ca 0.43 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 65.21 1sj9 h THR 1204Cb 1.93 2.70 0.00 0.00 -1.74 0.00 0.00 68.15 71.04 1sj9 h THR 1204CO -0.00 0.73 -0.06 1.15 0.37 0.00 0.00 175.52 177.70 1sj9 n MET 1205N -3.87 0.16 -0.08 6.66 0.00 -0.32 -2.60 117.12 117.08 1sj9 n MET 1205Ca -0.25 0.12 -0.22 0.00 0.00 0.00 0.00 57.70 57.35 1sj9 n MET 1205Cb 0.93 -1.68 -0.12 0.00 0.00 0.00 0.00 33.22 32.34 1sj9 n MET 1205CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1sj9 h ALA 1207N -0.24 1.21 -0.06 0.00 0.00 -1.54 0.31 119.26 118.94 1sj9 h ALA 1207Ca -0.49 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1sj9 h ALA 1207Cb 1.78 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1sj9 h ALA 1207CO -0.10 0.46 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 1sj9 n SER 1208N -3.83 1.83 -1.48 0.00 3.41 -1.07 -4.20 113.62 108.27 1sj9 n SER 1208Ca -0.01 -1.63 0.03 0.00 -0.26 0.00 0.00 58.87 57.00 1sj9 n SER 1208Cb 0.44 -0.03 0.06 0.00 -0.26 0.00 0.00 64.21 64.42 1sj9 n SER 1208CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sj9 n GLN 1209N 0.43 0.67 -3.67 4.33 6.02 -0.95 -5.02 117.38 119.18 1sj9 n GLN 1209Ca 0.18 -2.53 -0.24 0.00 -0.01 0.00 0.00 57.00 54.40 1sj9 n GLN 1209Cb 0.40 -0.61 0.06 0.00 1.02 0.00 0.00 30.24 31.10 1sj9 n GLN 1209CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sj9 n GLY 1210N -0.01 -0.44 3.01 1.08 0.00 -1.07 -4.94 105.19 102.81 1sj9 n GLY 1210Ca 0.10 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 46.07 1sj9 n GLY 1210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sj9 s LEU 1211N -6.98 1.64 0.78 0.99 1.43 0.11 -5.04 118.68 111.60 1sj9 s LEU 1211Ca 0.37 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.09 1sj9 s LEU 1211Cb -0.17 -0.76 0.06 0.00 0.03 0.00 0.00 46.19 45.35 1sj9 s LEU 1211CO 0.77 0.03 1.08 -0.13 0.23 0.00 0.00 176.35 178.34 1sj9 s ARG 1212N 0.60 2.21 -0.25 1.70 0.52 -1.13 -3.83 118.95 118.78 1sj9 s ARG 1212Ca -0.12 0.83 -0.28 0.00 -0.52 0.00 0.00 55.73 55.63 1sj9 s ARG 1212Cb -0.15 -1.92 0.16 0.00 0.52 0.00 0.00 34.95 33.57 1sj9 s ARG 1212CO 0.03 -1.58 1.22 0.00 0.02 0.00 0.00 175.30 174.99 1sj9 s ALA 1213N -3.06 -2.07 0.03 2.13 0.00 -1.26 -3.15 121.76 114.38 1sj9 s ALA 1213Ca 0.60 1.76 -0.11 0.00 0.00 0.00 0.00 51.96 54.21 1sj9 s ALA 1213Cb -0.15 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.64 1sj9 s ALA 1213CO 0.55 -0.23 0.23 0.20 0.00 0.00 0.00 175.76 176.52 1sj9 s GLY 1214N -0.60 -0.03 -0.03 0.00 0.00 -0.29 -0.79 107.32 105.58 1sj9 s GLY 1214Ca 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 44.72 44.65 1sj9 s GLY 1214CO -0.07 -0.29 0.07 -0.29 0.00 0.00 0.00 173.10 172.52 1sj9 s MET 1215N -2.25 0.02 0.03 2.90 1.75 -1.26 -0.67 119.30 119.82 1sj9 s MET 1215Ca -0.07 0.22 0.05 0.00 -1.25 0.00 0.00 55.69 54.64 1sj9 s MET 1215Cb -0.02 -0.18 -0.02 0.00 2.84 0.00 0.00 34.83 37.45 1sj9 s MET 1215CO -0.02 -0.14 -0.16 0.54 -0.65 0.00 0.00 175.02 174.59 1sj9 s VAL 1216N 0.91 1.27 0.06 10.11 0.11 -0.78 -2.68 120.40 129.40 1sj9 s VAL 1216Ca -0.07 -1.01 0.01 0.00 -2.93 0.00 0.00 61.98 57.99 1sj9 s VAL 1216Cb -0.10 -1.12 -0.03 0.00 -1.53 0.00 0.00 36.38 33.59 1sj9 s VAL 1216CO -0.03 0.10 -0.06 0.00 -3.33 0.00 0.00 175.10 171.77 1sj9 s ALA 1217N -0.77 0.66 -0.23 1.54 0.00 -0.69 -2.01 121.76 120.26 1sj9 s ALA 1217Ca 0.04 -1.00 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 1sj9 s ALA 1217Cb -0.08 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 1sj9 s ALA 1217CO 0.01 -0.15 0.06 0.20 0.00 0.00 0.00 175.76 175.88 1sj9 s GLY 1218N -2.23 1.77 -0.04 0.00 0.00 0.21 -2.35 107.32 104.67 1sj9 s GLY 1218Ca -0.01 -1.07 -0.31 0.00 0.00 0.00 0.00 44.72 43.32 1sj9 s GLY 1218CO -0.03 0.44 1.98 -0.62 0.00 0.00 0.00 173.10 174.88 1sj9 n VAL 1219N 4.69 0.65 -0.03 1.40 0.31 -1.17 -1.83 118.33 122.36 1sj9 n VAL 1219Ca -0.16 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1sj9 n VAL 1219Cb 0.52 -2.19 -0.08 0.00 -0.91 0.00 0.00 33.84 31.17 1sj9 n VAL 1219CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1sj9 n ILE 1220N 5.72 0.35 -3.68 2.52 -5.35 0.13 -2.89 119.36 116.15 1sj9 n ILE 1220Ca 0.23 -0.34 -0.14 0.00 -0.27 0.00 0.00 62.75 62.22 1sj9 n ILE 1220Cb 0.37 -0.24 -0.08 0.00 -1.74 0.00 0.00 39.64 37.96 1sj9 n ILE 1220CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1sj9 s VAL 1221N -2.50 0.04 -0.27 7.28 0.11 -0.90 -5.01 120.40 119.15 1sj9 s VAL 1221Ca -0.04 -0.35 -0.02 0.00 -2.93 0.00 0.00 61.98 58.64 1sj9 s VAL 1221Cb 0.05 -0.78 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 1sj9 s VAL 1221CO 0.43 -0.19 -0.03 0.21 -3.33 0.00 0.00 175.10 172.19 1sj9 s ASN 1222N -1.41 4.56 0.28 3.54 3.04 -1.26 -0.16 114.94 123.53 1sj9 s ASN 1222Ca -0.11 -1.02 0.00 0.00 0.04 0.00 0.00 52.86 51.77 1sj9 s ASN 1222Cb -0.03 -1.69 0.50 0.00 -1.54 0.00 0.00 41.25 38.50 1sj9 s ASN 1222CO 0.05 -0.18 1.87 0.03 -3.04 0.00 0.00 177.10 175.82 1sj9 h ARG 1223N 8.01 1.03 -3.35 0.43 2.47 0.35 -2.87 114.38 120.45 1sj9 h ARG 1223Ca -0.28 -0.06 -0.80 0.00 -1.26 0.00 0.00 59.98 57.58 1sj9 h ARG 1223Cb 1.09 -0.23 -0.27 0.00 -1.65 0.00 0.00 29.97 28.91 1sj9 h ARG 1223CO 0.56 0.68 0.70 2.41 0.56 0.00 0.00 179.97 184.88 1sj9 n THR 1224N -4.55 4.87 -4.39 2.04 -1.04 -1.25 -5.00 114.28 104.97 1sj9 n THR 1224Ca 0.17 -5.54 -0.24 0.00 -2.04 0.00 0.00 64.05 56.40 1sj9 n THR 1224Cb 0.27 -2.36 -0.13 0.00 -1.82 0.00 0.00 70.33 66.28 1sj9 n THR 1224CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1sj9 s GLN 1225N -1.71 1.16 0.00 -2.82 0.74 -1.08 -4.35 119.66 111.61 1sj9 s GLN 1225Ca 0.32 -1.05 0.00 0.00 0.05 0.00 0.00 55.36 54.68 1sj9 s GLN 1225Cb -0.03 -1.34 0.00 0.00 1.10 0.00 0.00 33.01 32.74 1sj9 s GLN 1225CO 0.00 0.32 0.00 0.00 -0.55 0.00 0.00 175.29 175.07 1sj9 n GLN 1226N 1.39 1.21 -2.20 1.67 -0.00 -1.26 -5.08 117.38 113.11 1sj9 n GLN 1226Ca -0.19 0.00 -0.34 0.00 -0.00 0.00 0.00 57.00 56.47 1sj9 n GLN 1226Cb 0.54 -0.72 0.00 0.00 -0.00 0.00 0.00 30.24 30.06 1sj9 n GLN 1226CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1sj9 s GLU 1227N -1.43 3.36 -0.12 2.61 -6.30 -1.26 -4.97 118.70 110.59 1sj9 s GLU 1227Ca 0.00 1.44 -0.29 0.00 -2.50 0.00 0.00 54.97 53.61 1sj9 s GLU 1227Cb 0.00 -2.02 -0.02 0.00 0.00 0.00 0.00 34.13 32.08 1sj9 s GLU 1227CO 0.00 -0.81 1.30 0.96 0.02 0.00 0.00 175.26 176.72 1sj9 s ILE 1228N -2.05 4.17 0.18 -3.70 -5.25 -1.26 -4.96 121.20 108.33 1sj9 s ILE 1228Ca 0.69 1.44 -0.33 0.00 -0.99 0.00 0.00 60.65 61.46 1sj9 s ILE 1228Cb -0.20 -3.93 -0.13 0.00 2.95 0.00 0.00 42.46 41.15 1sj9 s ILE 1228CO 0.30 -0.09 1.66 -0.81 -1.79 0.00 0.00 174.94 174.21 1sj9 n PRO 1229N 6.27 2.48 0.00 0.37 -0.04 -1.26 -4.97 135.00 137.84 1sj9 n PRO 1229Ca 0.14 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.49 1sj9 n PRO 1229Cb 0.45 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1sj9 n PRO 1229CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1sj9 n ASN 1230N 3.83 -1.11 0.00 3.54 3.02 -1.26 -5.00 115.26 118.27 1sj9 n ASN 1230Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1sj9 n ASN 1230Cb 0.32 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 1sj9 n ASN 1230CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sj9 n ALA 1231N -2.51 0.00 -2.74 5.41 0.00 -1.26 -4.44 120.51 114.97 1sj9 n ALA 1231Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1sj9 n ALA 1231Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1sj9 n ALA 1231CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1sj9 s GLU 1232N 0.00 3.49 -1.06 0.00 -1.05 -1.26 -4.94 118.70 113.89 1sj9 s GLU 1232Ca 0.00 -1.25 -0.05 0.00 -0.15 0.00 0.00 54.97 53.52 1sj9 s GLU 1232Cb 0.00 -4.93 0.29 0.00 -0.44 0.00 0.00 34.13 29.04 1sj9 s GLU 1232CO 0.00 -1.99 1.23 0.25 0.95 0.00 0.00 175.26 175.70 1sj9 n THR 1233N 6.18 4.66 0.01 1.83 -2.24 -1.26 -4.58 114.28 118.88 1sj9 n THR 1233Ca 0.22 -5.60 0.00 0.00 -2.27 0.00 0.00 64.05 56.40 1sj9 n THR 1233Cb 0.49 -2.32 0.00 0.00 -2.10 0.00 0.00 70.33 66.40 1sj9 n THR 1233CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1sj9 n MET 1234N 1.96 0.00 -0.31 -0.78 2.81 -1.26 -4.97 117.12 114.56 1sj9 n MET 1234Ca 0.25 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 56.21 1sj9 n MET 1234Cb 0.36 0.00 0.16 0.00 -0.71 0.00 0.00 33.22 33.03 1sj9 n MET 1234CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1sj9 n LYS 1235N -2.78 -0.08 0.12 0.03 0.00 -1.26 0.13 118.16 114.32 1sj9 n LYS 1235Ca 0.00 1.35 0.12 0.00 0.00 0.00 0.00 58.31 59.78 1sj9 n LYS 1235Cb 0.00 -2.06 0.12 0.00 0.00 0.00 0.00 35.03 33.09 1sj9 n LYS 1235CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.40 176.84 1sj9 h GLN 1236N 0.00 0.00 0.64 1.64 -0.00 -1.96 -3.34 115.11 112.10 1sj9 h GLN 1236Ca 0.45 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 59.07 1sj9 h GLN 1236Cb 0.77 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.25 1sj9 h GLN 1236CO -0.88 0.00 -0.31 1.15 -0.00 0.00 0.00 178.83 178.79 1sj9 h THR 1237N 0.00 0.32 0.00 1.86 2.02 0.69 -3.22 112.91 114.57 1sj9 h THR 1237Ca 0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1sj9 h THR 1237Cb 0.92 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1sj9 h THR 1237CO 0.00 0.02 0.00 -0.33 0.37 0.00 0.00 175.52 175.58 1sj9 h GLU 1238N -0.97 0.00 0.00 6.66 5.08 -1.40 -3.20 114.58 120.74 1sj9 h GLU 1238Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1sj9 h GLU 1238Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1sj9 h GLU 1238CO 0.15 0.00 -1.02 -1.13 -1.00 0.00 0.00 179.01 176.00 1sj9 n SER 1239N -2.96 0.78 0.37 1.42 3.41 -1.22 -4.29 113.62 111.12 1sj9 n SER 1239Ca -0.00 0.26 -0.18 0.00 -0.26 0.00 0.00 58.87 58.69 1sj9 n SER 1239Cb 0.22 0.52 -0.09 0.00 -0.26 0.00 0.00 64.21 64.60 1sj9 n SER 1239CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1sj9 h HIS 1240N 0.00 -0.96 0.00 7.33 6.17 -1.57 -2.39 115.15 123.74 1sj9 h HIS 1240Ca 0.00 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.06 1sj9 h HIS 1240Cb 0.96 0.33 0.00 0.00 2.52 0.00 0.00 27.41 31.22 1sj9 h HIS 1240CO 0.00 -0.57 0.00 0.00 0.71 0.00 0.00 177.93 178.07 1sj9 n ALA 1241N -2.56 1.24 -0.08 5.26 0.00 -1.26 -2.13 120.51 120.98 1sj9 n ALA 1241Ca -0.13 0.13 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 1sj9 n ALA 1241Cb 0.40 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.52 1sj9 n ALA 1241CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sj9 h VAL 1242N 0.00 1.30 0.00 0.00 2.07 -1.61 0.16 116.25 118.17 1sj9 h VAL 1242Ca 0.00 -1.64 -0.09 0.00 0.82 0.00 0.00 66.70 65.79 1sj9 h VAL 1242Cb 0.11 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1sj9 h VAL 1242CO 0.00 0.52 -0.74 0.11 0.02 0.00 0.00 177.57 177.49 1sj9 h LYS 1243N 0.49 0.00 0.45 1.57 1.57 -1.39 -2.82 116.57 116.43 1sj9 h LYS 1243Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1sj9 h LYS 1243Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1sj9 h LYS 1243CO 0.10 0.28 -0.21 0.82 -0.57 0.00 0.00 179.45 179.87 1sj9 h ILE 1244N 0.00 0.00 -1.06 1.86 1.08 -1.36 0.77 117.51 118.80 1sj9 h ILE 1244Ca -0.04 -0.36 0.28 0.00 -0.39 0.00 0.00 64.86 64.34 1sj9 h ILE 1244Cb 1.31 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.96 1sj9 h ILE 1244CO 0.04 0.00 0.67 1.62 -0.69 0.00 0.00 178.15 179.79 1sj9 h VAL 1245N -0.96 0.49 0.02 1.67 3.04 -0.77 0.70 116.25 120.43 1sj9 h VAL 1245Ca -0.06 -0.13 -0.23 0.00 -1.01 0.00 0.00 66.70 65.27 1sj9 h VAL 1245Cb 0.46 0.06 0.02 0.00 -2.01 0.00 0.00 31.29 29.82 1sj9 h VAL 1245CO 0.10 0.07 -0.89 0.58 -1.01 0.00 0.00 177.57 176.42 1sj9 h VAL 1246N 0.39 1.34 0.78 1.51 2.07 -1.50 -1.32 116.25 119.53 1sj9 h VAL 1246Ca 0.62 -2.22 -0.04 0.00 0.82 0.00 0.00 66.70 65.88 1sj9 h VAL 1246Cb 1.56 2.54 0.01 0.00 -1.52 0.00 0.00 31.29 33.87 1sj9 h VAL 1246CO -0.34 0.67 -0.38 -0.08 0.02 0.00 0.00 177.57 177.47 1sj9 h GLU 1247N 0.16 -1.01 -1.03 1.57 4.22 0.18 -2.48 114.58 116.17 1sj9 h GLU 1247Ca -0.12 0.07 0.27 0.00 0.08 0.00 0.00 59.36 59.66 1sj9 h GLU 1247Cb 1.58 0.23 -0.08 0.00 0.50 0.00 0.00 28.75 30.98 1sj9 h GLU 1247CO 0.17 -0.67 0.68 0.00 -2.18 0.00 0.00 179.01 177.02 1sj9 h ALA 1248N -1.21 2.34 -0.32 2.92 0.00 0.14 0.73 119.26 123.86 1sj9 h ALA 1248Ca -0.11 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1sj9 h ALA 1248Cb 0.81 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1sj9 h ALA 1248CO 0.18 -0.72 0.19 0.00 0.00 0.00 0.00 179.25 178.90 1sj9 h ALA 1249N 1.59 1.74 0.20 0.00 0.00 -0.83 -3.05 119.26 118.91 1sj9 h ALA 1249Ca 0.57 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 1sj9 h ALA 1249Cb 1.55 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1sj9 h ALA 1249CO -0.24 0.23 -0.10 0.00 0.00 0.00 0.00 179.25 179.14 1sj9 h ARG 1250N 0.43 -0.26 -1.31 0.00 3.08 0.91 -2.99 114.38 114.25 1sj9 h ARG 1250Ca 0.12 0.02 0.39 0.00 0.07 0.00 0.00 59.98 60.57 1sj9 h ARG 1250Cb -0.02 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.03 1sj9 h ARG 1250CO -0.02 -0.17 0.94 0.54 -1.07 0.00 0.00 179.97 180.18 1sj9 n ARG 1251N -2.72 -0.00 -0.04 0.04 1.74 -1.15 -1.05 116.66 113.47 1sj9 n ARG 1251Ca -0.03 0.75 -0.02 0.00 -0.77 0.00 0.00 57.85 57.78 1sj9 n ARG 1251Cb 0.11 -1.70 -0.01 0.00 -1.02 0.00 0.00 32.46 29.83 1sj9 n ARG 1251CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1sj9 h LEU 1252N 0.00 0.00 0.00 0.55 3.38 -1.60 -3.51 115.31 114.12 1sj9 h LEU 1252Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 1sj9 h LEU 1252Cb 2.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.27 1sj9 h LEU 1252CO -0.04 0.39 0.00 0.18 0.09 0.00 0.00 178.44 179.06