#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwe s LYS 1004N 0.00 3.23 0.00 1.43 -0.14 -1.26 -4.87 119.74 118.13 3bwe s LYS 1004Ca 0.00 1.11 0.05 0.00 -1.36 0.00 0.00 55.97 55.77 3bwe s LYS 1004Cb 0.00 -2.02 -0.01 0.00 -1.68 0.00 0.00 37.83 34.11 3bwe s LYS 1004CO 0.00 -0.88 -0.14 1.03 -0.76 0.00 0.00 175.35 174.60 3bwe s ARG 1005N -4.38 1.11 0.14 1.68 0.52 -1.26 -1.55 118.95 115.21 3bwe s ARG 1005Ca 0.62 -0.56 0.06 0.00 -0.52 0.00 0.00 55.73 55.32 3bwe s ARG 1005Cb -0.15 -1.08 -0.04 0.00 0.52 0.00 0.00 34.95 34.19 3bwe s ARG 1005CO 0.42 0.29 -0.14 0.00 0.02 0.00 0.00 175.30 175.89 3bwe s ALA 1006N -0.44 1.63 -0.24 2.13 0.00 -0.74 0.17 121.76 124.27 3bwe s ALA 1006Ca 0.05 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3bwe s ALA 1006Cb -0.06 -0.07 0.06 0.00 0.00 0.00 0.00 23.12 23.05 3bwe s ALA 1006CO -0.00 0.08 -0.07 -1.17 0.00 0.00 0.00 175.76 174.60 3bwe s LEU 1007N -2.72 2.84 -0.24 0.00 0.20 -0.08 -1.40 118.68 117.27 3bwe s LEU 1007Ca 0.13 -1.25 -0.11 0.00 0.69 0.00 0.00 54.13 53.59 3bwe s LEU 1007Cb -0.03 -1.29 -0.05 0.00 -0.43 0.00 0.00 46.19 44.39 3bwe s LEU 1007CO 0.04 -0.22 0.19 -0.69 -0.29 0.00 0.00 176.35 175.37 3bwe s VAL 1008N 1.31 5.34 -0.34 1.68 1.01 -0.58 -0.25 120.40 128.57 3bwe s VAL 1008Ca -0.07 0.24 -0.15 0.00 0.00 0.00 0.00 61.98 62.00 3bwe s VAL 1008Cb -0.19 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 3bwe s VAL 1008CO -0.06 0.33 0.34 -0.63 0.00 0.00 0.00 175.10 175.08 3bwe s ILE 1009N 1.11 5.19 -0.46 2.22 1.01 -1.13 -1.34 121.20 127.80 3bwe s ILE 1009Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.61 3bwe s ILE 1009Cb -0.14 -3.80 0.09 0.00 0.01 0.00 0.00 42.46 38.62 3bwe s ILE 1009CO 0.05 -0.08 0.34 -0.22 0.00 0.00 0.00 174.94 175.03 3bwe s LEU 1010N 1.96 5.51 0.31 2.97 2.96 -0.46 -4.46 118.68 127.48 3bwe s LEU 1010Ca 0.11 -1.55 0.07 0.00 -0.22 0.00 0.00 54.13 52.54 3bwe s LEU 1010Cb -0.17 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 3bwe s LEU 1010CO 0.11 -0.63 0.38 0.00 -1.32 0.00 0.00 176.35 174.89 3bwe s ALA 1011N 1.50 4.02 0.20 5.97 0.00 -1.26 -1.28 121.76 130.92 3bwe s ALA 1011Ca 0.04 -1.49 -0.31 0.00 0.00 0.00 0.00 51.96 50.20 3bwe s ALA 1011Cb -0.25 -1.49 -0.10 0.00 0.00 0.00 0.00 23.12 21.28 3bwe s ALA 1011CO 0.03 0.04 1.49 0.21 0.00 0.00 0.00 175.76 177.53 3bwe s LYS 1012N -4.06 4.25 0.00 0.00 2.20 -1.26 -2.61 119.74 118.26 3bwe s LYS 1012Ca 0.41 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 58.32 3bwe s LYS 1012Cb -0.08 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 3bwe s LYS 1012CO 0.29 -0.50 0.00 0.41 -0.36 0.00 0.00 175.35 175.19 3bwe n GLY 1013N 2.95 0.73 3.75 5.54 0.00 -0.90 -2.99 105.19 114.27 3bwe n GLY 1013Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3bwe n GLY 1013CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bwe s ALA 1014N -2.43 2.18 -0.37 4.61 0.00 -1.07 -2.03 121.76 122.64 3bwe s ALA 1014Ca 0.00 0.47 -0.29 0.00 0.00 0.00 0.00 51.96 52.14 3bwe s ALA 1014Cb 0.00 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.80 3bwe s ALA 1014CO 0.00 -1.79 1.24 -2.00 0.00 0.00 0.00 175.76 173.21 3bwe s GLU 1015N -4.51 3.82 0.00 0.00 -6.30 -0.01 0.10 118.70 111.79 3bwe s GLU 1015Ca 0.65 0.97 0.00 0.00 -2.50 0.00 0.00 54.97 54.09 3bwe s GLU 1015Cb -0.20 -3.89 0.00 0.00 0.00 0.00 0.00 34.13 30.03 3bwe s GLU 1015CO 0.51 -1.25 0.00 0.39 0.02 0.00 0.00 175.26 174.93 3bwe n GLU 1016N 7.54 0.00 0.00 4.30 4.71 -1.26 -2.44 120.64 133.49 3bwe n GLU 1016Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 3bwe n GLU 1016Cb 0.48 -0.98 0.00 0.00 -1.01 0.00 0.00 31.44 29.93 3bwe n GLU 1016CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3bwe n GLU 1018N -0.13 0.00 -0.11 3.49 1.02 -1.26 -1.39 120.64 122.26 3bwe n GLU 1018Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 3bwe n GLU 1018Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.34 3bwe n GLU 1018CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3bwe n THR 1019N 0.00 1.25 -0.31 2.62 -2.24 -1.02 -4.41 114.28 110.17 3bwe n THR 1019Ca 0.00 -0.32 -0.03 0.00 -2.27 0.00 0.00 64.05 61.43 3bwe n THR 1019Cb 0.00 -1.81 0.09 0.00 -2.10 0.00 0.00 70.33 66.52 3bwe n THR 1019CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3bwe h VAL 1020N -0.81 1.18 0.35 2.28 2.07 -1.50 -2.35 116.25 117.47 3bwe h VAL 1020Ca -0.58 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 3bwe h VAL 1020Cb 1.51 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3bwe h VAL 1020CO -0.35 0.20 -0.17 0.40 0.02 0.00 0.00 177.57 177.67 3bwe h ILE 1021N 1.11 0.67 -0.91 4.57 2.04 -1.82 -1.61 117.51 121.55 3bwe h ILE 1021Ca 0.32 -0.28 0.01 0.00 1.00 0.00 0.00 64.86 65.91 3bwe h ILE 1021Cb -0.06 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 3bwe h ILE 1021CO -0.09 0.06 0.60 -0.65 0.00 0.00 0.00 178.15 178.07 3bwe h PRO 1022N -0.62 1.20 -0.09 2.37 0.11 -1.75 -2.05 132.00 131.17 3bwe h PRO 1022Ca -0.05 -0.07 0.03 0.00 0.11 0.00 0.00 66.00 66.02 3bwe h PRO 1022Cb 0.45 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 31.26 3bwe h PRO 1022CO 0.08 0.80 -0.11 0.28 -0.21 0.00 0.00 178.00 178.84 3bwe h VAL 1023N 1.24 0.70 0.60 3.15 2.07 -1.30 -3.21 116.25 119.50 3bwe h VAL 1023Ca 0.33 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.83 3bwe h VAL 1023Cb -0.14 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3bwe h VAL 1023CO -0.07 0.00 -0.32 -0.78 0.02 0.00 0.00 177.57 176.42 3bwe h ASP 1024N -0.15 -0.77 0.00 0.57 1.82 -0.91 -1.77 116.42 115.22 3bwe h ASP 1024Ca 0.07 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.74 3bwe h ASP 1024Cb 0.24 0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.46 3bwe h ASP 1024CO -0.17 -0.52 0.00 0.52 -1.61 0.00 0.00 179.24 177.46 3bwe n VAL 1025N -5.46 0.00 0.00 2.25 0.31 -0.80 -0.65 118.33 113.97 3bwe n VAL 1025Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 3bwe n VAL 1025Cb 0.35 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 3bwe n VAL 1025CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3bwe n ARG 1027N 0.40 0.00 0.24 5.55 1.74 -0.67 -0.96 116.66 122.97 3bwe n ARG 1027Ca 0.00 0.00 0.17 0.00 -0.77 0.00 0.00 57.85 57.25 3bwe n ARG 1027Cb 0.00 0.00 0.75 0.00 -1.02 0.00 0.00 32.46 32.19 3bwe n ARG 1027CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3bwe h ARG 1028N 0.00 0.00 -0.25 5.56 3.08 -1.14 0.15 114.38 121.78 3bwe h ARG 1028Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3bwe h ARG 1028Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3bwe h ARG 1028CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3bwe n ALA 1029N -1.97 2.49 -0.87 0.04 0.00 -0.13 -4.88 120.51 115.19 3bwe n ALA 1029Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.85 3bwe n ALA 1029Cb 0.20 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3bwe n ALA 1029CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bwe n GLY 1030N 1.14 0.91 3.69 0.00 0.00 0.53 -5.00 105.19 106.46 3bwe n GLY 1030Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3bwe n GLY 1030CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bwe s ILE 1031N -3.62 4.12 -0.43 -0.61 1.01 -1.25 -4.71 121.20 115.71 3bwe s ILE 1031Ca 0.00 1.47 -0.29 0.00 0.00 0.00 0.00 60.65 61.83 3bwe s ILE 1031Cb 0.00 -3.95 0.01 0.00 0.01 0.00 0.00 42.46 38.54 3bwe s ILE 1031CO 0.00 0.02 1.34 -0.54 0.00 0.00 0.00 174.94 175.76 3bwe s LYS 1032N 2.07 3.61 -0.06 2.79 -0.14 -0.60 -3.98 119.74 123.44 3bwe s LYS 1032Ca 0.58 0.84 -0.01 0.00 -1.36 0.00 0.00 55.97 56.01 3bwe s LYS 1032Cb -0.27 -4.00 -0.04 0.00 -1.68 0.00 0.00 37.83 31.85 3bwe s LYS 1032CO 0.24 -1.52 0.03 0.08 -0.76 0.00 0.00 175.35 173.41 3bwe s VAL 1033N 5.19 4.45 -0.15 3.17 1.01 -1.26 -1.80 120.40 131.01 3bwe s VAL 1033Ca 0.58 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.27 3bwe s VAL 1033Cb -0.12 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.35 3bwe s VAL 1033CO 0.32 0.52 -0.21 -0.89 0.00 0.00 0.00 175.10 174.85 3bwe s THR 1034N -0.99 2.01 -0.50 3.92 2.01 -0.50 -4.95 115.64 116.64 3bwe s THR 1034Ca 0.16 -0.94 -0.17 0.00 0.31 0.00 0.00 61.69 61.06 3bwe s THR 1034Cb -0.12 -1.79 0.08 0.00 0.01 0.00 0.00 72.50 70.68 3bwe s THR 1034CO 0.06 0.54 0.50 -0.69 -0.69 0.00 0.00 174.62 174.34 3bwe s VAL 1035N 0.97 5.10 -0.27 3.82 1.01 -1.26 -1.52 120.40 128.24 3bwe s VAL 1035Ca -0.03 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 60.90 3bwe s VAL 1035Cb -0.15 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 3bwe s VAL 1035CO -0.05 -0.73 0.13 0.00 0.00 0.00 0.00 175.10 174.45 3bwe s ALA 1036N 2.00 3.33 -0.18 5.51 0.00 -0.45 0.81 121.76 132.78 3bwe s ALA 1036Ca 0.08 -1.14 -0.29 0.00 0.00 0.00 0.00 51.96 50.61 3bwe s ALA 1036Cb -0.24 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 3bwe s ALA 1036CO 0.08 -0.55 1.28 0.20 0.00 0.00 0.00 175.76 176.77 3bwe s GLY 1037N 1.68 1.60 0.28 0.00 0.00 -0.26 -1.35 107.32 109.26 3bwe s GLY 1037Ca 0.06 0.43 0.03 0.00 0.00 0.00 0.00 44.72 45.24 3bwe s GLY 1037CO 0.07 2.53 1.76 -2.00 0.00 0.00 0.00 173.10 175.46 3bwe h LEU 1038N 9.92 0.62 -1.63 0.66 5.85 -1.53 -1.29 115.31 127.91 3bwe h LEU 1038Ca -0.27 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.55 3bwe h LEU 1038Cb 1.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.14 3bwe h LEU 1038CO 0.98 0.22 0.00 0.00 -0.34 0.00 0.00 178.44 179.30 3bwe n ALA 1039N -2.39 2.45 0.00 1.25 0.00 -1.26 -4.66 120.51 115.90 3bwe n ALA 1039Ca 0.20 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3bwe n ALA 1039Cb 0.52 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.98 3bwe n ALA 1039CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bwe n GLY 1040N 1.25 0.97 0.02 0.00 0.00 -0.56 -4.84 105.19 102.03 3bwe n GLY 1040Ca 0.16 -1.90 0.11 0.00 0.00 0.00 0.00 46.02 44.40 3bwe n GLY 1040CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bwe n LYS 1041N 0.00 0.06 -1.72 1.61 5.02 -1.26 -3.65 118.16 118.22 3bwe n LYS 1041Ca 0.00 -0.04 -0.33 0.00 -2.02 0.00 0.00 58.31 55.92 3bwe n LYS 1041Cb 0.00 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.56 3bwe n LYS 1041CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3bwe s ASP 1042N -2.97 4.97 0.44 4.39 1.01 -1.26 -4.34 116.67 118.90 3bwe s ASP 1042Ca 0.11 2.07 -0.23 0.00 0.71 0.00 0.00 52.55 55.20 3bwe s ASP 1042Cb 0.17 -2.56 -0.10 0.00 1.01 0.00 0.00 42.92 41.44 3bwe s ASP 1042CO 0.75 -1.73 0.90 -2.65 0.21 0.00 0.00 175.17 172.65 3bwe n PRO 1043N -2.44 1.12 -3.98 8.23 -0.02 -1.26 -4.49 135.00 132.16 3bwe n PRO 1043Ca 0.11 0.41 -0.34 0.00 -2.02 0.00 0.00 63.50 61.65 3bwe n PRO 1043Cb 0.52 -1.93 -0.15 0.00 -0.02 0.00 0.00 33.50 31.92 3bwe n PRO 1043CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3bwe s VAL 1044N -1.35 2.88 -0.42 -1.45 1.01 0.86 -4.95 120.40 116.99 3bwe s VAL 1044Ca 0.65 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 3bwe s VAL 1044Cb -0.55 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.50 3bwe s VAL 1044CO 0.56 0.37 1.14 -1.58 0.00 0.00 0.00 175.10 175.59 3bwe s GLN 1045N 1.38 3.83 1.05 2.72 0.74 -1.26 -1.58 119.66 126.54 3bwe s GLN 1045Ca 0.04 0.78 -0.18 0.00 0.05 0.00 0.00 55.36 56.04 3bwe s GLN 1045Cb -0.15 -3.86 0.25 0.00 1.10 0.00 0.00 33.01 30.35 3bwe s GLN 1045CO -0.06 -1.23 1.27 0.00 -0.55 0.00 0.00 175.29 174.72 3bwe h SER 1047N -2.01 -0.34 -0.91 0.00 4.64 0.65 -0.36 113.55 115.22 3bwe h SER 1047Ca -0.43 0.16 -0.53 0.00 -0.47 0.00 0.00 61.79 60.52 3bwe h SER 1047Cb 1.21 0.29 -0.28 0.00 -0.31 0.00 0.00 62.40 63.30 3bwe h SER 1047CO 0.29 -0.13 0.58 0.54 -0.87 0.00 0.00 176.83 177.24 3bwe n ARG 1048N -5.31 2.39 -1.28 4.77 3.00 -1.26 -4.95 116.66 114.02 3bwe n ARG 1048Ca 0.08 -3.17 -0.10 0.00 -0.01 0.00 0.00 57.85 54.66 3bwe n ARG 1048Cb 0.34 -2.17 -0.04 0.00 0.00 0.00 0.00 32.46 30.58 3bwe n ARG 1048CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 3bwe n ASP 1049N -1.06 -5.25 -4.80 0.55 8.00 -0.14 -5.00 116.55 108.84 3bwe n ASP 1049Ca 0.57 0.24 -0.36 0.00 0.71 0.00 0.00 54.79 55.95 3bwe n ASP 1049Cb 1.26 -3.60 -0.06 0.00 -0.02 0.00 0.00 41.12 38.70 3bwe n ASP 1049CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3bwe s VAL 1050N -1.99 4.37 -0.32 2.53 -7.23 -1.26 -4.68 120.40 111.81 3bwe s VAL 1050Ca 0.00 1.57 -0.11 0.00 -1.81 0.00 0.00 61.98 61.64 3bwe s VAL 1050Cb 0.00 -3.91 -0.01 0.00 0.56 0.00 0.00 36.38 33.02 3bwe s VAL 1050CO 0.00 0.12 0.19 -0.69 -0.31 0.00 0.00 175.10 174.40 3bwe s VAL 1051N -1.64 4.85 -0.06 1.32 1.01 -1.26 -0.91 120.40 123.72 3bwe s VAL 1051Ca 0.49 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 3bwe s VAL 1051Cb -0.17 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 3bwe s VAL 1051CO 0.22 0.03 0.05 -0.63 0.00 0.00 0.00 175.10 174.77 3bwe s ILE 1052N 1.65 4.65 -0.22 2.22 1.01 -0.61 -4.87 121.20 125.03 3bwe s ILE 1052Ca 0.05 -0.25 -0.11 0.00 0.00 0.00 0.00 60.65 60.33 3bwe s ILE 1052Cb -0.17 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 3bwe s ILE 1052CO 0.08 0.50 0.19 0.00 0.00 0.00 0.00 174.94 175.71 3bwe s PRO 1054N 0.84 2.95 0.45 0.00 0.02 -1.26 -4.90 135.00 133.10 3bwe s PRO 1054Ca 0.10 1.45 0.25 0.00 0.02 0.00 0.00 61.00 62.82 3bwe s PRO 1054Cb -0.13 -1.97 0.57 0.00 0.02 0.00 0.00 34.50 33.00 3bwe s PRO 1054CO 0.03 -1.14 1.69 -0.44 -0.33 0.00 0.00 177.00 176.81 3bwe h ASP 1055N 0.33 0.00 -5.66 2.53 5.19 0.04 -3.48 116.42 115.38 3bwe h ASP 1055Ca -0.48 0.00 0.28 0.00 -0.62 0.00 0.00 57.03 56.22 3bwe h ASP 1055Cb 1.25 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.67 3bwe h ASP 1055CO 0.55 0.00 0.75 0.00 -3.12 0.00 0.00 179.24 177.42 3bwe s ALA 1056N -3.30 -2.09 0.39 3.45 0.00 -1.07 -4.97 121.76 114.17 3bwe s ALA 1056Ca 0.06 0.35 -0.15 0.00 0.00 0.00 0.00 51.96 52.22 3bwe s ALA 1056Cb 0.06 0.55 -0.09 0.00 0.00 0.00 0.00 23.12 23.65 3bwe s ALA 1056CO 0.64 -1.07 0.81 -1.54 0.00 0.00 0.00 175.76 174.60 3bwe s SER 1057N -3.17 6.72 0.22 0.00 1.04 -1.26 -1.11 113.70 116.15 3bwe s SER 1057Ca 0.17 1.35 -0.07 0.00 0.48 0.00 0.00 55.95 57.88 3bwe s SER 1057Cb 0.02 -2.41 0.30 0.00 0.10 0.00 0.00 66.02 64.03 3bwe s SER 1057CO -0.01 -0.33 1.81 0.25 0.98 0.00 0.00 173.24 175.94 3bwe h LEU 1058N 1.76 0.61 -1.23 2.42 7.12 -1.58 -1.92 115.31 122.50 3bwe h LEU 1058Ca -0.48 0.03 0.10 0.00 0.13 0.00 0.00 57.88 57.67 3bwe h LEU 1058Cb 1.18 -0.09 -0.06 0.00 -0.53 0.00 0.00 40.66 41.16 3bwe h LEU 1058CO 0.64 0.38 0.57 -0.33 -0.13 0.00 0.00 178.44 179.57 3bwe h GLU 1059N 0.75 0.82 0.03 1.25 4.39 -1.89 -1.40 114.58 118.53 3bwe h GLU 1059Ca 0.34 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 3bwe h GLU 1059Cb 0.24 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3bwe h GLU 1059CO -0.20 0.54 -0.02 -0.44 -1.16 0.00 0.00 179.01 177.73 3bwe h ASP 1060N 0.84 -0.04 -0.47 1.42 5.19 -1.77 -3.26 116.42 118.33 3bwe h ASP 1060Ca 0.41 -0.26 0.14 0.00 -0.62 0.00 0.00 57.03 56.70 3bwe h ASP 1060Cb 0.45 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.95 3bwe h ASP 1060CO -0.18 0.58 0.46 0.00 -3.12 0.00 0.00 179.24 176.98 3bwe h ALA 1061N -0.72 2.23 -0.18 3.45 0.00 -1.37 0.36 119.26 123.03 3bwe h ALA 1061Ca -0.00 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 3bwe h ALA 1061Cb 0.30 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3bwe h ALA 1061CO 0.01 -0.70 0.06 -0.22 0.00 0.00 0.00 179.25 178.40 3bwe h LYS 1062N 0.00 0.14 0.00 0.00 3.64 -1.33 -1.14 116.57 117.88 3bwe h LYS 1062Ca 0.22 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3bwe h LYS 1062Cb 1.13 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3bwe h LYS 1062CO -0.00 0.09 0.00 1.63 -2.27 0.00 0.00 179.45 178.90 3bwe n LYS 1063N -5.06 0.01 -2.47 1.90 5.02 0.12 -4.36 118.16 113.33 3bwe n LYS 1063Ca -0.03 0.25 -0.43 0.00 -2.02 0.00 0.00 58.31 56.08 3bwe n LYS 1063Cb 0.07 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 3bwe n LYS 1063CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3bwe n GLU 1064N -1.55 3.27 -0.66 1.97 4.07 -0.43 -4.95 120.64 122.37 3bwe n GLU 1064Ca 0.04 -3.37 0.09 0.00 -0.06 0.00 0.00 57.16 53.85 3bwe n GLU 1064Cb 0.18 -3.20 -0.02 0.00 -0.06 0.00 0.00 31.44 28.34 3bwe n GLU 1064CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3bwe n GLY 1065N 4.19 -0.91 3.91 8.31 0.00 -1.26 -4.80 105.19 114.63 3bwe n GLY 1065Ca 0.44 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 3bwe n GLY 1065CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3bwe s PRO 1066N -1.46 3.46 0.05 1.61 0.04 -1.26 -4.91 135.00 132.53 3bwe s PRO 1066Ca 0.00 0.21 0.06 0.00 0.04 0.00 0.00 61.00 61.30 3bwe s PRO 1066Cb 0.00 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 3bwe s PRO 1066CO 0.00 -0.30 -0.10 0.71 0.04 0.00 0.00 177.00 177.35 3bwe s TYR 1067N -2.80 2.76 -0.48 0.56 2.02 -1.26 -4.93 117.35 113.20 3bwe s TYR 1067Ca 0.49 -0.13 0.26 0.00 -0.37 0.00 0.00 57.07 57.31 3bwe s TYR 1067Cb -0.10 -1.51 0.87 0.00 -0.40 0.00 0.00 41.96 40.82 3bwe s TYR 1067CO 0.46 0.36 1.76 -0.44 -1.57 0.00 0.00 175.55 176.12 3bwe h ASP 1068N 4.18 0.00 -3.09 2.29 5.19 -0.66 -3.45 116.42 120.88 3bwe h ASP 1068Ca -0.48 0.00 0.05 0.00 -0.62 0.00 0.00 57.03 55.97 3bwe h ASP 1068Cb 1.16 0.00 -0.24 0.00 0.18 0.00 0.00 39.33 40.43 3bwe h ASP 1068CO 0.52 0.00 0.25 0.54 -3.12 0.00 0.00 179.24 177.42 3bwe s VAL 1069N -3.27 0.00 -0.12 -1.35 0.11 -1.10 -3.45 120.40 111.21 3bwe s VAL 1069Ca 0.07 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.12 3bwe s VAL 1069Cb 0.10 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.93 3bwe s VAL 1069CO 0.54 0.00 -0.15 0.54 -3.33 0.00 0.00 175.10 172.70 3bwe s VAL 1070N 1.00 2.88 -0.09 2.04 0.11 -1.07 -0.90 120.40 124.38 3bwe s VAL 1070Ca -0.05 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.29 3bwe s VAL 1070Cb -0.05 -2.19 -0.02 0.00 -1.53 0.00 0.00 36.38 32.59 3bwe s VAL 1070CO -0.12 0.53 -0.12 0.68 -3.33 0.00 0.00 175.10 172.75 3bwe s VAL 1071N 0.33 3.25 -0.44 2.04 -7.23 0.65 -1.71 120.40 117.30 3bwe s VAL 1071Ca -0.12 -0.62 -0.10 0.00 -1.81 0.00 0.00 61.98 59.32 3bwe s VAL 1071Cb -0.16 -2.33 0.09 0.00 0.56 0.00 0.00 36.38 34.53 3bwe s VAL 1071CO 0.06 0.56 0.30 -0.76 -0.31 0.00 0.00 175.10 174.95 3bwe s LEU 1072N -0.29 5.34 0.95 1.32 1.02 0.25 -2.82 118.68 124.45 3bwe s LEU 1072Ca 0.03 -1.56 -0.12 0.00 0.02 0.00 0.00 54.13 52.50 3bwe s LEU 1072Cb -0.13 -2.03 0.16 0.00 0.02 0.00 0.00 46.19 44.22 3bwe s LEU 1072CO 0.03 -0.59 1.09 -2.84 0.02 0.00 0.00 176.35 174.06 3bwe s PRO 1073N 1.45 0.82 0.00 1.29 0.02 -1.26 -2.17 135.00 135.15 3bwe s PRO 1073Ca 0.04 0.78 0.00 0.00 0.02 0.00 0.00 61.00 61.83 3bwe s PRO 1073Cb -0.24 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.52 3bwe s PRO 1073CO 0.02 -2.53 0.00 0.41 -0.33 0.00 0.00 177.00 174.57 3bwe n GLY 1074N -0.88 1.81 0.00 0.52 0.00 -1.22 -4.05 105.19 101.37 3bwe n GLY 1074Ca 0.06 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3bwe n GLY 1074CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bwe n GLY 1075N 5.00 2.69 0.35 -0.02 0.00 -1.26 -0.83 105.19 111.12 3bwe n GLY 1075Ca 0.00 -1.44 -0.16 0.00 0.00 0.00 0.00 46.02 44.42 3bwe n GLY 1075CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3bwe h ASN 1076N 0.00 -0.83 -0.25 1.61 -1.24 -1.95 0.36 115.58 113.27 3bwe h ASN 1076Ca 0.00 0.06 -0.03 0.00 0.71 0.00 0.00 56.30 57.04 3bwe h ASN 1076Cb 0.00 0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 3bwe h ASN 1076CO 0.00 -0.48 0.05 0.25 -1.29 0.00 0.00 177.43 175.96 3bwe h LEU 1077N -0.73 0.39 0.14 0.34 6.46 -1.86 -2.71 115.31 117.34 3bwe h LEU 1077Ca -0.04 -0.25 0.02 0.00 -0.12 0.00 0.00 57.88 57.49 3bwe h LEU 1077Cb 0.63 -0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 40.41 3bwe h LEU 1077CO -0.00 0.54 -0.45 1.23 -0.62 0.00 0.00 178.44 179.14 3bwe h GLY 1078N 0.23 -0.95 1.41 3.75 0.00 -1.19 -0.96 103.07 105.36 3bwe h GLY 1078Ca 0.08 0.54 0.05 0.00 0.00 0.00 0.00 47.33 48.01 3bwe h GLY 1078CO 0.00 -0.28 0.27 0.00 0.00 0.00 0.00 176.54 176.54 3bwe h ALA 1079N -0.30 1.97 -0.36 3.60 0.00 -0.33 -1.61 119.26 122.22 3bwe h ALA 1079Ca 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3bwe h ALA 1079Cb 0.71 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3bwe h ALA 1079CO -0.25 -0.04 0.16 0.37 0.00 0.00 0.00 179.25 179.49 3bwe h GLN 1080N 0.32 0.54 -0.65 0.00 4.15 -0.91 -0.94 115.11 117.61 3bwe h GLN 1080Ca 0.18 -0.09 -0.08 0.00 0.77 0.00 0.00 58.65 59.43 3bwe h GLN 1080Cb 0.29 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 3bwe h GLN 1080CO -0.04 0.50 0.10 -0.91 -1.93 0.00 0.00 178.83 176.55 3bwe h ASN 1081N 0.45 1.04 -0.46 -0.69 2.35 -0.34 -2.63 115.58 115.30 3bwe h ASN 1081Ca 0.12 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.60 3bwe h ASN 1081Cb 0.16 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 3bwe h ASN 1081CO -0.01 1.04 0.26 -0.07 -1.65 0.00 0.00 177.43 177.00 3bwe h LEU 1082N 1.00 0.60 -0.41 1.61 3.38 -1.09 -1.52 115.31 118.87 3bwe h LEU 1082Ca 0.20 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3bwe h LEU 1082Cb 0.45 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3bwe h LEU 1082CO 0.01 0.50 0.00 0.28 0.09 0.00 0.00 178.44 179.32 3bwe h SER 1083N 0.68 0.00 -0.06 -0.43 0.02 -0.83 -3.15 113.55 109.78 3bwe h SER 1083Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3bwe h SER 1083Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3bwe h SER 1083CO -0.03 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.04 3bwe n GLU 1084N -2.58 1.07 -2.92 3.45 1.02 -0.82 -4.81 120.64 115.06 3bwe n GLU 1084Ca 0.04 -1.39 -0.43 0.00 -0.02 0.00 0.00 57.16 55.35 3bwe n GLU 1084Cb 0.38 -1.26 -0.05 0.00 -0.02 0.00 0.00 31.44 30.49 3bwe n GLU 1084CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3bwe s SER 1085N -1.10 6.43 0.40 1.62 0.15 -0.64 -4.90 113.70 115.66 3bwe s SER 1085Ca 0.17 -0.08 0.06 0.00 0.70 0.00 0.00 55.95 56.80 3bwe s SER 1085Cb 0.11 -2.40 0.81 0.00 -1.71 0.00 0.00 66.02 62.83 3bwe s SER 1085CO 0.17 -0.97 2.05 0.00 1.20 0.00 0.00 173.24 175.69 3bwe h ALA 1086N 9.03 1.67 -0.88 5.45 0.00 -1.91 0.46 119.26 133.08 3bwe h ALA 1086Ca -0.25 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.65 3bwe h ALA 1086Cb 1.08 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 3bwe h ALA 1086CO 0.98 0.31 0.58 0.00 0.00 0.00 0.00 179.25 181.12 3bwe h ALA 1087N 1.71 1.12 -0.27 0.00 0.00 -1.97 -1.01 119.26 118.85 3bwe h ALA 1087Ca 0.17 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3bwe h ALA 1087Cb -0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3bwe h ALA 1087CO -0.04 0.49 -0.19 0.28 0.00 0.00 0.00 179.25 179.79 3bwe h VAL 1088N 1.17 1.31 -0.63 0.00 2.07 -1.31 -0.48 116.25 118.37 3bwe h VAL 1088Ca 0.33 -1.33 0.06 0.00 0.82 0.00 0.00 66.70 66.58 3bwe h VAL 1088Cb -0.10 1.58 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 3bwe h VAL 1088CO -0.08 0.42 0.33 0.50 0.02 0.00 0.00 177.57 178.76 3bwe h LYS 1089N 0.32 0.60 0.52 1.57 3.64 -0.76 -0.43 116.57 122.04 3bwe h LYS 1089Ca 0.05 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 3bwe h LYS 1089Cb 0.73 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3bwe h LYS 1089CO 0.05 0.40 -0.35 0.93 -2.27 0.00 0.00 179.45 178.21 3bwe h GLU 1090N 0.62 -0.80 -0.62 1.90 5.08 -0.94 0.35 114.58 120.17 3bwe h GLU 1090Ca 0.29 0.05 0.12 0.00 -1.00 0.00 0.00 59.36 58.83 3bwe h GLU 1090Cb 0.20 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 29.52 3bwe h GLU 1090CO -0.19 -0.53 -0.14 0.82 -1.00 0.00 0.00 179.01 177.97 3bwe h ILE 1091N -0.83 0.40 -0.36 3.13 2.04 -0.87 0.04 117.51 121.06 3bwe h ILE 1091Ca -0.07 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 3bwe h ILE 1091Cb 0.67 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 3bwe h ILE 1091CO 0.05 0.00 -0.02 -0.07 0.00 0.00 0.00 178.15 178.11 3bwe h LEU 1092N 0.01 0.55 0.17 1.44 3.38 -1.00 -1.57 115.31 118.30 3bwe h LEU 1092Ca 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 3bwe h LEU 1092Cb 0.46 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3bwe h LEU 1092CO -0.62 0.63 -0.08 0.11 0.09 0.00 0.00 178.44 178.57 3bwe h LYS 1093N 0.55 -0.22 -0.68 1.13 1.79 0.97 -0.69 116.57 119.41 3bwe h LYS 1093Ca 0.11 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 3bwe h LYS 1093Cb 0.39 0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 3bwe h LYS 1093CO 0.02 -0.07 0.37 0.93 -1.08 0.00 0.00 179.45 179.62 3bwe h GLU 1094N -0.34 0.95 -0.79 3.15 5.08 -1.16 -1.14 114.58 120.34 3bwe h GLU 1094Ca -0.02 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3bwe h GLU 1094Cb 0.26 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3bwe h GLU 1094CO 0.04 0.71 0.50 0.37 -1.00 0.00 0.00 179.01 179.63 3bwe h GLN 1095N 0.94 1.06 -0.27 2.33 5.75 -1.14 0.54 115.11 124.32 3bwe h GLN 1095Ca 0.24 -0.08 -0.13 0.00 -0.15 0.00 0.00 58.65 58.53 3bwe h GLN 1095Cb 0.04 -0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.36 3bwe h GLN 1095CO -0.04 0.73 -0.35 1.49 -2.65 0.00 0.00 178.83 178.01 3bwe h GLU 1096N 1.08 0.72 0.00 1.69 4.81 -0.88 0.45 114.58 122.44 3bwe h GLU 1096Ca 0.29 -0.41 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 3bwe h GLU 1096Cb -0.08 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3bwe h GLU 1096CO -0.06 1.03 -0.26 -0.91 -0.73 0.00 0.00 179.01 178.08 3bwe h ASN 1097N 0.46 0.00 0.12 1.04 -0.26 -0.90 -1.58 115.58 114.47 3bwe h ASN 1097Ca 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 3bwe h ASN 1097Cb 0.93 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.19 3bwe h ASN 1097CO 0.08 0.26 -0.06 -1.14 -1.06 0.00 0.00 177.43 175.51 3bwe n ARG 1098N -3.40 1.15 -3.41 0.81 0.63 0.19 -4.93 116.66 107.70 3bwe n ARG 1098Ca 0.00 -0.49 -0.17 0.00 -0.92 0.00 0.00 57.85 56.28 3bwe n ARG 1098Cb 0.46 -1.49 0.09 0.00 0.45 0.00 0.00 32.46 31.97 3bwe n ARG 1098CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3bwe n LYS 1099N -0.50 -6.56 -4.17 -0.14 5.02 -0.59 -5.02 118.16 106.19 3bwe n LYS 1099Ca 0.18 0.83 -0.24 0.00 -2.02 0.00 0.00 58.31 57.06 3bwe n LYS 1099Cb 0.27 -5.80 -0.06 0.00 -0.02 0.00 0.00 35.03 29.43 3bwe n LYS 1099CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3bwe s GLY 1100N -4.27 1.59 0.09 0.72 0.00 0.15 -5.02 107.32 100.58 3bwe s GLY 1100Ca 0.03 -1.42 -0.31 0.00 0.00 0.00 0.00 44.72 43.03 3bwe s GLY 1100CO 0.71 -1.46 1.44 -2.27 0.00 0.00 0.00 173.10 171.53 3bwe s LEU 1101N -3.47 4.36 -0.15 0.66 2.96 -1.22 -4.56 118.68 117.25 3bwe s LEU 1101Ca 0.31 2.33 0.01 0.00 -0.22 0.00 0.00 54.13 56.56 3bwe s LEU 1101Cb -0.08 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.03 3bwe s LEU 1101CO 0.22 -0.71 -0.18 -0.63 -1.32 0.00 0.00 176.35 173.73 3bwe s ILE 1102N 1.54 2.38 -0.12 6.68 1.01 1.00 -2.59 121.20 131.09 3bwe s ILE 1102Ca 0.66 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 60.47 3bwe s ILE 1102Cb -0.37 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.12 3bwe s ILE 1102CO 0.30 0.53 -0.22 0.00 0.00 0.00 0.00 174.94 175.55 3bwe s ALA 1103N 0.87 2.27 0.02 9.38 0.00 -0.69 -0.78 121.76 132.83 3bwe s ALA 1103Ca -0.05 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.94 3bwe s ALA 1103Cb -0.15 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 3bwe s ALA 1103CO -0.02 0.14 -0.13 0.00 0.00 0.00 0.00 175.76 175.75 3bwe s ALA 1104N 0.56 1.07 0.02 0.00 0.00 0.93 0.85 121.76 125.20 3bwe s ALA 1104Ca -0.13 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3bwe s ALA 1104Cb -0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 3bwe s ALA 1104CO 0.04 0.21 -0.09 -1.50 0.00 0.00 0.00 175.76 174.43 3bwe s ILE 1105N -0.69 0.65 0.00 0.00 2.07 -0.92 -1.75 121.20 120.56 3bwe s ILE 1105Ca 0.02 -0.74 0.00 0.00 -1.41 0.00 0.00 60.65 58.52 3bwe s ILE 1105Cb -0.07 -0.62 0.00 0.00 0.13 0.00 0.00 42.46 41.90 3bwe s ILE 1105CO 0.01 -0.09 0.00 0.00 -1.91 0.00 0.00 174.94 172.95 3bwe n ALA 1107N 4.81 2.67 -0.30 0.00 0.00 -1.26 0.19 120.51 126.62 3bwe n ALA 1107Ca 0.00 -0.26 0.03 0.00 0.00 0.00 0.00 53.44 53.21 3bwe n ALA 1107Cb 0.00 -0.21 0.17 0.00 0.00 0.00 0.00 19.45 19.41 3bwe n ALA 1107CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3bwe h GLY 1108N 1.30 1.30 1.48 0.00 0.00 -1.15 -2.16 103.07 103.84 3bwe h GLY 1108Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3bwe h GLY 1108CO 0.00 0.15 0.15 -1.55 0.00 0.00 0.00 176.54 175.29 3bwe n PRO 1109N -4.72 0.03 0.20 4.80 -0.04 -1.26 -0.59 135.00 133.42 3bwe n PRO 1109Ca 0.14 0.44 0.08 0.00 -0.04 0.00 0.00 63.50 64.12 3bwe n PRO 1109Cb 0.26 -1.75 0.33 0.00 -0.04 0.00 0.00 33.50 32.30 3bwe n PRO 1109CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3bwe h THR 1110N 0.00 0.59 -0.38 0.52 1.35 -1.74 -2.36 112.91 110.89 3bwe h THR 1110Ca 0.00 -1.39 -0.06 0.00 -0.55 0.00 0.00 66.41 64.41 3bwe h THR 1110Cb 0.30 1.95 -0.02 0.00 -1.73 0.00 0.00 68.15 68.65 3bwe h THR 1110CO 0.00 0.27 -0.03 0.00 -0.25 0.00 0.00 175.52 175.52 3bwe h ALA 1111N 1.72 1.24 -0.99 6.62 0.00 -1.05 0.13 119.26 126.94 3bwe h ALA 1111Ca -0.00 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.68 3bwe h ALA 1111Cb 0.93 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 3bwe h ALA 1111CO 0.04 0.50 0.66 -0.07 0.00 0.00 0.00 179.25 180.37 3bwe h LEU 1112N 0.58 1.14 -0.08 0.00 3.38 -1.55 -0.16 115.31 118.63 3bwe h LEU 1112Ca 0.12 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 3bwe h LEU 1112Cb 0.41 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 3bwe h LEU 1112CO 0.02 0.83 -0.14 0.25 0.09 0.00 0.00 178.44 179.49 3bwe h LEU 1113N 1.35 0.27 -2.48 1.67 5.85 -1.23 0.62 115.31 121.35 3bwe h LEU 1113Ca 0.36 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 3bwe h LEU 1113Cb -0.15 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 3bwe h LEU 1113CO -0.08 0.76 -0.02 0.00 -0.34 0.00 0.00 178.44 178.76 3bwe h ALA 1114N 0.52 1.29 -0.30 1.25 0.00 -0.71 -0.73 119.26 120.57 3bwe h ALA 1114Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3bwe h ALA 1114Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3bwe h ALA 1114CO 0.03 0.03 0.00 0.72 0.00 0.00 0.00 179.25 180.03 3bwe n HIS 1115N -3.53 1.03 -3.43 0.00 8.25 -0.10 -4.97 115.22 112.47 3bwe n HIS 1115Ca -0.03 -0.83 -0.23 0.00 -0.26 0.00 0.00 57.72 56.38 3bwe n HIS 1115Cb 0.12 -0.31 -0.02 0.00 1.12 0.00 0.00 29.99 30.90 3bwe n HIS 1115CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3bwe n GLU 1116N -0.29 -2.80 -2.91 -0.41 1.02 -0.28 -4.92 120.64 110.05 3bwe n GLU 1116Ca 0.21 0.34 -0.35 0.00 -0.02 0.00 0.00 57.16 57.34 3bwe n GLU 1116Cb 0.89 -4.99 -0.06 0.00 -0.02 0.00 0.00 31.44 27.26 3bwe n GLU 1116CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3bwe s ILE 1117N -2.84 4.41 -1.73 -3.67 -1.09 0.20 -4.33 121.20 112.15 3bwe s ILE 1117Ca 0.41 1.48 -0.22 0.00 -2.23 0.00 0.00 60.65 60.09 3bwe s ILE 1117Cb -0.22 -3.79 0.22 0.00 -1.58 0.00 0.00 42.46 37.08 3bwe s ILE 1117CO 0.50 -0.04 0.55 0.61 -1.23 0.00 0.00 174.94 175.33 3bwe n GLY 1118N 0.08 -0.40 3.56 6.18 0.00 -1.26 -4.70 105.19 108.65 3bwe n GLY 1118Ca 0.03 0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3bwe n GLY 1118CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3bwe n PHE 1119N -3.89 0.26 -0.73 1.61 3.01 -1.26 -2.00 117.46 114.45 3bwe n PHE 1119Ca 0.11 0.43 0.00 0.00 1.01 0.00 0.00 57.45 59.00 3bwe n PHE 1119Cb 0.44 -2.06 0.00 0.00 -0.01 0.00 0.00 39.48 37.85 3bwe n PHE 1119CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3bwe n GLY 1120N 1.46 1.13 3.89 1.37 0.00 0.11 -5.02 105.19 108.13 3bwe n GLY 1120Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3bwe n GLY 1120CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3bwe s SER 1121N -3.09 6.44 -0.36 1.61 0.01 -0.85 -4.69 113.70 112.77 3bwe s SER 1121Ca 0.00 1.06 -0.18 0.00 1.31 0.00 0.00 55.95 58.13 3bwe s SER 1121Cb 0.00 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.94 3bwe s SER 1121CO 0.00 -0.45 0.52 -0.75 0.41 0.00 0.00 173.24 172.97 3bwe s LYS 1122N -4.12 3.56 -0.06 12.44 2.20 -1.26 -0.88 119.74 131.62 3bwe s LYS 1122Ca 0.50 -0.21 -0.08 0.00 -0.36 0.00 0.00 55.97 55.83 3bwe s LYS 1122Cb -0.10 -3.83 0.02 0.00 -1.51 0.00 0.00 37.83 32.40 3bwe s LYS 1122CO 0.36 -0.69 0.20 0.14 -0.36 0.00 0.00 175.35 175.00 3bwe s VAL 1123N 2.43 0.02 0.13 4.02 -7.23 -0.53 -4.40 120.40 114.83 3bwe s VAL 1123Ca 0.19 -0.16 0.04 0.00 -1.81 0.00 0.00 61.98 60.24 3bwe s VAL 1123Cb -0.15 -0.34 -0.04 0.00 0.56 0.00 0.00 36.38 36.41 3bwe s VAL 1123CO 0.14 -0.09 0.14 0.28 -0.31 0.00 0.00 175.10 175.26 3bwe s THR 1124N -0.25 4.68 0.00 5.32 -1.32 -1.26 -3.58 115.64 119.23 3bwe s THR 1124Ca -0.04 -0.87 0.00 0.00 -1.21 0.00 0.00 61.69 59.58 3bwe s THR 1124Cb -0.03 -3.34 0.00 0.00 -1.51 0.00 0.00 72.50 67.62 3bwe s THR 1124CO 0.01 -0.01 0.00 0.35 -2.21 0.00 0.00 174.62 172.76 3bwe n THR 1125N -0.06 0.00 -2.71 5.08 -2.24 -1.26 -3.87 114.28 109.23 3bwe n THR 1125Ca -0.08 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.31 3bwe n THR 1125Cb 0.53 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.71 3bwe n THR 1125CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3bwe s HIS 1126N -0.69 3.84 0.34 4.78 2.46 0.13 -4.25 115.29 121.90 3bwe s HIS 1126Ca 0.00 1.85 0.12 0.00 0.47 0.00 0.00 55.06 57.50 3bwe s HIS 1126Cb 0.00 -3.02 1.07 0.00 -0.13 0.00 0.00 32.58 30.50 3bwe s HIS 1126CO 0.00 0.22 1.57 -2.30 -2.47 0.00 0.00 174.74 171.75 3bwe n PRO 1127N 1.21 -0.07 0.24 2.88 -0.02 -1.26 0.29 135.00 138.27 3bwe n PRO 1127Ca -0.01 1.43 0.13 0.00 -2.02 0.00 0.00 63.50 63.03 3bwe n PRO 1127Cb 0.47 -2.42 0.35 0.00 -0.02 0.00 0.00 33.50 31.88 3bwe n PRO 1127CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3bwe h LEU 1128N 0.00 0.00 -0.21 2.45 3.38 -1.96 -3.07 115.31 115.89 3bwe h LEU 1128Ca 0.73 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.70 3bwe h LEU 1128Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.53 3bwe h LEU 1128CO -0.84 0.03 -0.20 0.00 0.09 0.00 0.00 178.44 177.52 3bwe n ALA 1129N -2.11 2.92 -0.14 1.53 0.00 0.15 -4.34 120.51 118.52 3bwe n ALA 1129Ca 0.03 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.09 3bwe n ALA 1129Cb 0.46 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 3bwe n ALA 1129CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3bwe h LYS 1130N 0.52 -0.27 -0.15 0.00 3.11 -1.39 -2.62 116.57 115.77 3bwe h LYS 1130Ca 0.00 0.02 0.05 0.00 -2.81 0.00 0.00 60.65 57.91 3bwe h LYS 1130Cb 0.43 0.06 -0.05 0.00 -1.00 0.00 0.00 32.23 31.67 3bwe h LYS 1130CO 0.00 -0.18 -0.19 -0.44 -2.81 0.00 0.00 179.45 175.83 3bwe h ASP 1131N -0.28 -0.59 0.00 4.20 3.45 -1.83 -3.39 116.42 117.97 3bwe h ASP 1131Ca 0.16 0.11 -0.39 0.00 0.43 0.00 0.00 57.03 57.33 3bwe h ASP 1131Cb 0.57 0.28 0.10 0.00 -0.56 0.00 0.00 39.33 39.71 3bwe h ASP 1131CO -0.58 -0.24 1.22 1.17 -1.57 0.00 0.00 179.24 179.24 3bwe n LYS 1132N -5.33 0.00 0.00 3.56 4.81 -0.99 -4.87 118.16 115.34 3bwe n LYS 1132Ca -0.02 -0.81 0.00 0.00 -0.87 0.00 0.00 58.31 56.60 3bwe n LYS 1132Cb 0.25 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.00 3bwe n LYS 1132CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3bwe n ASN 1135N 7.59 0.00 0.00 3.14 2.85 -1.26 -5.06 115.26 122.52 3bwe n ASN 1135Ca 0.31 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.78 3bwe n ASN 1135Cb 0.28 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.30 3bwe n ASN 1135CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3bwe n GLY 1136N 1.67 1.73 2.54 8.20 0.00 -1.26 -4.46 105.19 113.62 3bwe n GLY 1136Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3bwe n GLY 1136CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bwe n GLY 1137N -1.83 1.00 0.00 -0.02 0.00 -1.26 -4.89 105.19 98.18 3bwe n GLY 1137Ca 0.00 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 45.88 3bwe n GLY 1137CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3bwe n HIS 1138N -2.46 0.00 -4.16 1.61 8.25 -1.26 -4.83 115.22 112.37 3bwe n HIS 1138Ca -0.09 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.26 3bwe n HIS 1138Cb 0.44 -0.49 -0.04 0.00 1.12 0.00 0.00 29.99 31.02 3bwe n HIS 1138CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3bwe n TYR 1139N -1.49 -0.47 -4.92 4.41 4.02 -1.26 0.05 117.16 117.51 3bwe n TYR 1139Ca 0.03 -1.61 -0.31 0.00 -0.01 0.00 0.00 57.90 56.00 3bwe n TYR 1139Cb 0.13 0.17 -0.14 0.00 -0.02 0.00 0.00 39.34 39.48 3bwe n TYR 1139CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3bwe s THR 1140N -2.78 2.43 0.16 -0.72 2.01 -0.06 -4.92 115.64 111.76 3bwe s THR 1140Ca 0.23 -1.19 -0.03 0.00 0.31 0.00 0.00 61.69 61.01 3bwe s THR 1140Cb 0.01 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.52 3bwe s THR 1140CO 0.16 0.43 0.37 -0.47 -0.69 0.00 0.00 174.62 174.42 3bwe s TYR 1141N -0.79 3.48 0.05 4.92 5.04 -1.26 -1.46 117.35 127.33 3bwe s TYR 1141Ca 0.12 0.44 -0.00 0.00 -2.44 0.00 0.00 57.07 55.19 3bwe s TYR 1141Cb -0.10 -1.92 -0.03 0.00 0.35 0.00 0.00 41.96 40.25 3bwe s TYR 1141CO 0.02 0.42 -0.04 0.45 -1.34 0.00 0.00 175.55 175.07 3bwe s SER 1142N -2.75 0.57 0.00 4.32 0.15 -1.23 -4.83 113.70 109.93 3bwe s SER 1142Ca 0.39 -0.86 0.00 0.00 0.70 0.00 0.00 55.95 56.18 3bwe s SER 1142Cb -0.12 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.34 3bwe s SER 1142CO 0.27 -0.48 0.76 -0.62 1.20 0.00 0.00 173.24 174.36 3bwe n GLU 1143N 0.51 1.57 -1.98 5.44 1.02 -1.26 -4.29 120.64 121.64 3bwe n GLU 1143Ca -0.16 -1.04 -0.36 0.00 -0.02 0.00 0.00 57.16 55.57 3bwe n GLU 1143Cb 0.59 -0.85 0.04 0.00 -0.02 0.00 0.00 31.44 31.19 3bwe n GLU 1143CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3bwe s ASN 1144N -0.57 5.19 0.35 1.62 0.01 -1.26 -4.88 114.94 115.41 3bwe s ASN 1144Ca 0.00 2.44 0.03 0.00 -0.71 0.00 0.00 52.86 54.62 3bwe s ASN 1144Cb 0.00 -2.60 0.66 0.00 0.41 0.00 0.00 41.25 39.72 3bwe s ASN 1144CO 0.00 -1.60 1.99 0.03 -1.51 0.00 0.00 177.10 176.02 3bwe h ARG 1145N 0.96 0.81 -4.11 -0.60 3.08 -1.95 -3.40 114.38 109.16 3bwe h ARG 1145Ca -0.50 -0.05 -0.48 0.00 0.07 0.00 0.00 59.98 59.02 3bwe h ARG 1145Cb 1.30 -0.18 -0.36 0.00 0.08 0.00 0.00 29.97 30.81 3bwe h ARG 1145CO 0.55 0.54 -0.79 0.08 -1.07 0.00 0.00 179.97 179.28 3bwe s VAL 1146N -5.72 0.79 -0.19 2.04 1.01 -1.26 -2.81 120.40 114.26 3bwe s VAL 1146Ca -0.10 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3bwe s VAL 1146Cb 0.18 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 3bwe s VAL 1146CO 0.77 0.31 -0.01 -0.70 0.00 0.00 0.00 175.10 175.47 3bwe s GLU 1147N 1.45 3.62 -0.52 2.72 2.56 0.02 -4.99 118.70 123.56 3bwe s GLU 1147Ca -0.01 -0.52 0.04 0.00 0.00 0.00 0.00 54.97 54.47 3bwe s GLU 1147Cb -0.13 -3.02 0.14 0.00 2.00 0.00 0.00 34.13 33.11 3bwe s GLU 1147CO -0.04 0.07 0.29 0.21 -0.56 0.00 0.00 175.26 175.24 3bwe s LYS 1148N 0.82 1.78 -0.82 4.30 2.47 -1.26 -1.42 119.74 125.61 3bwe s LYS 1148Ca 0.00 -2.51 -0.06 0.00 -1.56 0.00 0.00 55.97 51.84 3bwe s LYS 1148Cb -0.14 -2.93 0.21 0.00 -1.46 0.00 0.00 37.83 33.51 3bwe s LYS 1148CO 0.02 -1.17 0.71 0.34 0.16 0.00 0.00 175.35 175.41 3bwe s ASP 1149N -0.25 6.08 0.83 1.43 2.15 -0.93 -4.99 116.67 120.99 3bwe s ASP 1149Ca 0.19 -3.21 0.00 0.00 0.43 0.00 0.00 52.55 49.96 3bwe s ASP 1149Cb -0.21 -2.00 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 3bwe s ASP 1149CO -0.03 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 3bwe n GLY 1150N 3.10 1.34 1.38 2.66 0.00 -1.26 -3.34 105.19 109.07 3bwe n GLY 1150Ca 0.16 -0.68 0.09 0.00 0.00 0.00 0.00 46.02 45.58 3bwe n GLY 1150CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3bwe n LEU 1151N 0.00 4.39 -4.24 0.99 4.77 -1.26 -4.84 117.00 116.81 3bwe n LEU 1151Ca 0.00 -2.42 -0.34 0.00 -0.03 0.00 0.00 56.01 53.22 3bwe n LEU 1151Cb 0.00 -0.52 -0.15 0.00 -2.33 0.00 0.00 43.42 40.42 3bwe n LEU 1151CO 0.00 0.80 -0.43 -0.63 -1.33 0.00 0.00 177.39 175.80 3bwe s ILE 1152N -1.78 2.91 -0.15 -0.08 -1.09 -1.21 -0.00 121.20 119.80 3bwe s ILE 1152Ca 0.47 -0.68 0.00 0.00 -2.23 0.00 0.00 60.65 58.21 3bwe s ILE 1152Cb 0.30 -2.31 0.02 0.00 -1.58 0.00 0.00 42.46 38.89 3bwe s ILE 1152CO 0.23 0.44 -0.15 -0.22 -1.23 0.00 0.00 174.94 174.01 3bwe s LEU 1153N 1.41 1.71 0.24 2.97 2.96 0.04 -2.19 118.68 125.81 3bwe s LEU 1153Ca 0.05 -0.49 0.08 0.00 -0.22 0.00 0.00 54.13 53.55 3bwe s LEU 1153Cb -0.14 -1.18 -0.05 0.00 0.50 0.00 0.00 46.19 45.31 3bwe s LEU 1153CO -0.07 -0.05 -0.12 0.42 -1.32 0.00 0.00 176.35 175.22 3bwe s THR 1154N 1.43 1.78 0.16 3.68 -4.23 -0.51 -0.05 115.64 117.91 3bwe s THR 1154Ca 0.04 -2.20 -0.08 0.00 -1.18 0.00 0.00 61.69 58.27 3bwe s THR 1154Cb -0.13 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 3bwe s THR 1154CO -0.10 -0.47 0.24 -0.55 -0.54 0.00 0.00 174.62 173.21 3bwe s SER 1155N -3.38 0.09 -0.06 3.99 0.15 -0.72 -0.80 113.70 112.96 3bwe s SER 1155Ca 0.26 -0.93 0.04 0.00 0.70 0.00 0.00 55.95 56.02 3bwe s SER 1155Cb 0.00 0.41 -0.25 0.00 -1.71 0.00 0.00 66.02 64.48 3bwe s SER 1155CO 0.09 -0.86 0.61 0.03 1.20 0.00 0.00 173.24 174.31 3bwe h ARG 1156N 2.60 0.12 0.00 5.44 3.08 -1.70 0.85 114.38 124.77 3bwe h ARG 1156Ca -0.32 -0.21 0.24 0.00 0.07 0.00 0.00 59.98 59.76 3bwe h ARG 1156Cb 1.22 0.08 -0.05 0.00 0.08 0.00 0.00 29.97 31.31 3bwe h ARG 1156CO 0.50 0.83 0.66 0.41 -1.07 0.00 0.00 179.97 181.31 3bwe n GLY 1157N 1.71 0.40 0.42 0.04 0.00 -1.26 -3.66 105.19 102.84 3bwe n GLY 1157Ca -0.21 -1.02 0.25 0.00 0.00 0.00 0.00 46.02 45.03 3bwe n GLY 1157CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3bwe h PRO 1158N 0.00 0.33 0.00 1.61 0.11 -1.98 1.08 132.00 133.16 3bwe h PRO 1158Ca -0.18 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.91 3bwe h PRO 1158Cb 0.93 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 3bwe h PRO 1158CO 0.25 0.22 -0.01 0.78 -0.21 0.00 0.00 178.00 179.03 3bwe h GLY 1159N 0.34 0.00 -1.89 -0.55 0.00 -2.04 -2.55 103.07 96.39 3bwe h GLY 1159Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.94 3bwe h GLY 1159CO -0.29 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.95 3bwe n THR 1160N -3.11 0.75 0.26 4.70 -2.24 0.37 -4.70 114.28 110.31 3bwe n THR 1160Ca 0.00 -0.87 -0.16 0.00 -2.27 0.00 0.00 64.05 60.74 3bwe n THR 1160Cb 0.30 0.72 -0.08 0.00 -2.10 0.00 0.00 70.33 69.17 3bwe n THR 1160CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3bwe h SER 1161N 3.31 -1.04 -0.76 3.42 0.02 -0.86 0.97 113.55 118.60 3bwe h SER 1161Ca 0.00 0.08 0.10 0.00 -0.84 0.00 0.00 61.79 61.14 3bwe h SER 1161Cb 0.84 0.34 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 3bwe h SER 1161CO 0.00 -0.55 0.50 -0.26 -1.14 0.00 0.00 176.83 175.38 3bwe h PHE 1162N -0.83 0.70 -0.49 3.45 -1.00 -1.84 0.13 116.94 117.05 3bwe h PHE 1162Ca -0.04 0.02 -0.12 0.00 2.81 0.00 0.00 57.97 60.64 3bwe h PHE 1162Cb 0.73 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 40.05 3bwe h PHE 1162CO -0.19 0.32 -0.15 0.93 -1.61 0.00 0.00 178.31 177.61 3bwe h GLU 1163N 0.64 0.95 0.79 1.51 5.08 -1.79 0.12 114.58 121.88 3bwe h GLU 1163Ca 0.36 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3bwe h GLU 1163Cb 0.52 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.72 3bwe h GLU 1163CO -0.13 1.02 -0.40 0.35 -1.00 0.00 0.00 179.01 178.85 3bwe h PHE 1164N 0.84 -1.05 -0.59 4.33 3.57 0.15 -1.59 116.94 122.60 3bwe h PHE 1164Ca 0.12 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 3bwe h PHE 1164Cb 0.70 0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 3bwe h PHE 1164CO 0.04 -0.64 0.25 0.00 -2.23 0.00 0.00 178.31 175.73 3bwe h ALA 1165N -0.90 1.32 -0.18 2.41 0.00 -0.82 -1.89 119.26 119.21 3bwe h ALA 1165Ca -0.11 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 3bwe h ALA 1165Cb 0.85 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3bwe h ALA 1165CO 0.16 0.51 -0.42 -0.07 0.00 0.00 0.00 179.25 179.43 3bwe h LEU 1166N 0.84 0.44 -0.55 0.00 3.38 -0.94 -2.31 115.31 116.17 3bwe h LEU 1166Ca 0.20 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3bwe h LEU 1166Cb 0.15 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3bwe h LEU 1166CO -0.02 0.81 0.14 0.00 0.09 0.00 0.00 178.44 179.46 3bwe h ALA 1167N 1.21 0.72 -0.10 1.53 0.00 -0.61 -1.01 119.26 120.99 3bwe h ALA 1167Ca 0.03 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3bwe h ALA 1167Cb 0.89 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3bwe h ALA 1167CO 0.07 0.42 0.03 0.82 0.00 0.00 0.00 179.25 180.59 3bwe h ILE 1168N 0.77 0.97 -0.19 0.00 2.04 -1.21 -2.02 117.51 117.87 3bwe h ILE 1168Ca 0.17 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 66.05 3bwe h ILE 1168Cb 0.34 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 3bwe h ILE 1168CO 0.00 0.01 -0.10 0.58 0.00 0.00 0.00 178.15 178.64 3bwe h VAL 1169N 0.07 0.68 -0.56 1.67 2.07 -1.10 -0.84 116.25 118.24 3bwe h VAL 1169Ca 0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.63 3bwe h VAL 1169Cb 0.03 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 3bwe h VAL 1169CO -0.05 0.00 0.38 -0.08 0.02 0.00 0.00 177.57 177.83 3bwe h GLU 1170N -0.08 0.49 0.00 1.57 4.81 -1.00 0.49 114.58 120.86 3bwe h GLU 1170Ca 0.11 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.16 3bwe h GLU 1170Cb 0.24 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 3bwe h GLU 1170CO -0.25 0.32 -0.69 0.00 -0.73 0.00 0.00 179.01 177.67 3bwe h ALA 1171N 1.70 0.84 0.04 2.92 0.00 -0.46 -1.24 119.26 123.06 3bwe h ALA 1171Ca 0.25 -0.63 -0.37 0.00 0.00 0.00 0.00 54.91 54.16 3bwe h ALA 1171Cb 0.33 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3bwe h ALA 1171CO -0.07 0.86 -2.24 1.28 0.00 0.00 0.00 179.25 179.09 3bwe n LEU 1172N -3.69 2.22 -0.04 0.00 4.32 -0.45 -4.68 117.00 114.68 3bwe n LEU 1172Ca -0.01 0.05 0.01 0.00 -0.02 0.00 0.00 56.01 56.03 3bwe n LEU 1172Cb 0.68 -0.66 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 3bwe n LEU 1172CO 0.43 0.79 0.25 0.59 -1.22 0.00 0.00 177.39 178.23 3bwe n ASN 1173N -3.23 1.01 0.00 -1.43 5.03 0.16 -4.95 115.26 111.85 3bwe n ASN 1173Ca -0.37 -1.00 0.00 0.00 0.87 0.00 0.00 54.58 54.08 3bwe n ASN 1173Cb 1.04 0.07 0.00 0.00 -1.02 0.00 0.00 39.78 39.87 3bwe n ASN 1173CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3bwe n GLY 1174N 0.13 0.92 0.24 7.41 0.00 -0.47 -4.48 105.19 108.94 3bwe n GLY 1174Ca 0.01 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 43.92 3bwe n GLY 1174CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bwe h LYS 1175N 0.00 0.85 0.17 1.61 1.57 -1.90 -2.25 116.57 116.62 3bwe h LYS 1175Ca 0.00 -0.50 0.01 0.00 -1.87 0.00 0.00 60.65 58.28 3bwe h LYS 1175Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3bwe h LYS 1175CO 0.00 1.14 -0.19 1.49 -0.57 0.00 0.00 179.45 181.33 3bwe h GLU 1176N 0.63 -0.38 -0.28 3.15 4.81 -1.96 0.24 114.58 120.79 3bwe h GLU 1176Ca 0.03 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3bwe h GLU 1176Cb 1.06 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 3bwe h GLU 1176CO 0.11 -0.25 0.16 0.28 -0.73 0.00 0.00 179.01 178.57 3bwe h VAL 1177N -0.39 1.11 -0.28 0.32 2.07 -1.78 -0.89 116.25 116.40 3bwe h VAL 1177Ca 0.01 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.30 3bwe h VAL 1177Cb 0.38 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 3bwe h VAL 1177CO -0.06 0.11 -0.39 0.00 0.02 0.00 0.00 177.57 177.26 3bwe h ALA 1178N 1.04 -0.42 -0.45 1.67 0.00 -0.91 -0.04 119.26 120.16 3bwe h ALA 1178Ca 0.10 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3bwe h ALA 1178Cb 0.04 0.78 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3bwe h ALA 1178CO -0.02 -0.84 0.30 0.00 0.00 0.00 0.00 179.25 178.69 3bwe h ALA 1179N 0.40 1.72 0.00 0.00 0.00 -0.27 -1.06 119.26 120.06 3bwe h ALA 1179Ca 0.12 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3bwe h ALA 1179Cb 0.58 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3bwe h ALA 1179CO -0.48 0.24 -0.43 1.96 0.00 0.00 0.00 179.25 180.54 3bwe h GLN 1180N 0.57 0.00 0.00 0.00 4.20 0.37 -2.59 115.11 117.65 3bwe h GLN 1180Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3bwe h GLN 1180Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3bwe h GLN 1180CO -0.04 0.43 -0.64 0.28 -0.67 0.00 0.00 178.83 178.19 3bwe h VAL 1181N 0.00 0.00 0.02 -0.54 2.07 -0.09 -3.37 116.25 114.34 3bwe h VAL 1181Ca -0.00 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 3bwe h VAL 1181Cb 0.87 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3bwe h VAL 1181CO 0.06 0.00 -0.33 0.50 0.02 0.00 0.00 177.57 177.81 3bwe h LYS 1182N 0.00 0.05 -0.88 1.57 3.64 -0.93 -3.38 116.57 116.64 3bwe h LYS 1182Ca 0.00 -0.09 0.18 0.00 -1.27 0.00 0.00 60.65 59.47 3bwe h LYS 1182Cb 0.84 0.03 -0.17 0.00 -0.41 0.00 0.00 32.23 32.52 3bwe h LYS 1182CO 0.00 1.04 -0.19 0.00 -2.27 0.00 0.00 179.45 178.03 3bwe h ALA 1183N -0.05 0.63 0.00 5.00 0.00 -1.63 0.22 119.26 123.42 3bwe h ALA 1183Ca -0.08 0.34 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3bwe h ALA 1183Cb 1.16 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 3bwe h ALA 1183CO -0.00 -0.41 -0.00 -1.35 0.00 0.00 0.00 179.25 177.49 3bwe h PRO 1184N 0.01 0.00 -0.17 0.00 0.11 -1.78 -3.08 132.00 127.09 3bwe h PRO 1184Ca 0.43 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.47 3bwe h PRO 1184Cb 0.69 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 3bwe h PRO 1184CO -0.90 0.00 -0.22 -0.07 -0.21 0.00 0.00 178.00 176.60 3bwe h LEU 1185N 0.00 0.30 -2.61 2.35 3.38 -0.73 -3.47 115.31 114.52 3bwe h LEU 1185Ca -0.00 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 3bwe h LEU 1185Cb 0.35 -0.08 0.11 0.00 0.09 0.00 0.00 40.66 41.12 3bwe h LEU 1185CO 0.00 0.53 -0.46 0.52 0.09 0.00 0.00 178.44 179.13 3bwe n VAL 1186N -4.17 -6.82 -3.74 1.22 0.31 -1.16 -5.03 118.33 98.94 3bwe n VAL 1186Ca -0.01 -0.76 -0.33 0.00 -0.01 0.00 0.00 64.34 63.23 3bwe n VAL 1186Cb 0.35 -5.54 -0.05 0.00 -0.91 0.00 0.00 33.84 27.69 3bwe n VAL 1186CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3bwe s LEU 1187N -4.35 4.34 0.00 7.52 1.43 -1.26 -5.18 118.68 121.18 3bwe s LEU 1187Ca 0.24 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 53.90 3bwe s LEU 1187Cb -0.03 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.28 3bwe s LEU 1187CO 0.51 0.18 0.34 2.29 0.23 0.00 0.00 176.35 179.90