#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xew h PHE 1013N 0.00 0.34 -0.50 3.52 3.57 -2.05 -2.76 116.94 119.05 1xew h PHE 1013Ca 0.00 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 1xew h PHE 1013Cb 0.00 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 1xew h PHE 1013CO 0.00 0.29 0.17 0.52 -2.23 0.00 0.00 178.31 177.05 1xew h MET 1014N 0.29 0.74 -0.59 1.11 2.86 -2.04 0.24 114.93 117.55 1xew h MET 1014Ca 0.09 -0.12 -0.10 0.00 -2.06 0.00 0.00 59.70 57.51 1xew h MET 1014Cb 0.06 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1xew h MET 1014CO -0.01 0.64 -0.02 -0.09 1.06 0.00 0.00 176.91 178.48 1xew h ARG 1015N 0.73 1.05 -0.40 1.72 2.43 -1.98 -1.13 114.38 116.80 1xew h ARG 1015Ca 0.17 -0.35 -0.16 0.00 -0.81 0.00 0.00 59.98 58.84 1xew h ARG 1015Cb 0.20 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1xew h ARG 1015CO -0.01 1.04 -0.36 1.15 -1.51 0.00 0.00 179.97 180.28 1xew h THR 1016N 0.95 1.27 -0.46 0.20 2.02 -1.14 -2.61 112.91 113.13 1xew h THR 1016Ca 0.16 -1.54 -0.03 0.00 0.77 0.00 0.00 66.41 65.78 1xew h THR 1016Cb 0.58 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1xew h THR 1016CO 0.03 0.52 0.17 0.15 0.37 0.00 0.00 175.52 176.77 1xew h PHE 1017N 0.79 0.71 -0.46 3.16 3.04 -0.24 -0.96 116.94 122.98 1xew h PHE 1017Ca 0.07 -0.06 -0.07 0.00 3.98 0.00 0.00 57.97 61.89 1xew h PHE 1017Cb 0.96 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.24 1xew h PHE 1017CO 0.06 0.62 -0.02 0.93 -2.02 0.00 0.00 178.31 177.88 1xew h GLU 1018N 0.61 0.76 -0.18 1.11 5.08 -1.23 0.47 114.58 121.19 1xew h GLU 1018Ca 0.15 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1xew h GLU 1018Cb 0.21 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1xew h GLU 1018CO -0.01 0.78 -0.16 0.00 -1.00 0.00 0.00 179.01 178.62 1xew h ALA 1019N 1.27 0.27 -0.27 3.43 0.00 -1.26 0.43 119.26 123.13 1xew h ALA 1019Ca 0.14 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1xew h ALA 1019Cb 0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1xew h ALA 1019CO 0.02 0.16 -0.21 0.82 0.00 0.00 0.00 179.25 180.05 1xew h ILE 1020N 0.10 1.25 -0.47 0.00 2.04 -0.92 -1.90 117.51 117.60 1xew h ILE 1020Ca 0.03 -1.19 -0.11 0.00 1.00 0.00 0.00 64.86 64.60 1xew h ILE 1020Cb 0.69 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1xew h ILE 1020CO 0.04 0.38 -0.13 0.28 0.00 0.00 0.00 178.15 178.72 1xew h SER 1021N 0.44 0.93 -0.52 1.72 0.02 0.07 -0.50 113.55 115.71 1xew h SER 1021Ca 0.07 -0.37 0.02 0.00 -0.84 0.00 0.00 61.79 60.67 1xew h SER 1021Cb 0.61 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 1xew h SER 1021CO 0.04 1.08 0.32 0.03 -1.14 0.00 0.00 176.83 177.17 1xew h ARG 1022N 0.77 0.62 -0.83 3.45 3.08 -0.75 -1.65 114.38 119.06 1xew h ARG 1022Ca 0.12 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1xew h ARG 1022Cb 0.68 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1xew h ARG 1022CO 0.05 0.41 0.44 -0.91 -1.07 0.00 0.00 179.97 178.89 1xew h ASN 1023N 0.64 1.06 0.39 7.04 2.35 -1.04 -1.89 115.58 124.13 1xew h ASN 1023Ca 0.20 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1xew h ASN 1023Cb -0.00 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1xew h ASN 1023CO -0.08 0.87 -0.19 0.15 -1.65 0.00 0.00 177.43 176.53 1xew h PHE 1024N 1.17 -0.49 -0.77 1.19 3.04 -0.65 -0.77 116.94 119.66 1xew h PHE 1024Ca 0.29 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.28 1xew h PHE 1024Cb 0.06 0.16 -0.05 0.00 2.56 0.00 0.00 35.95 38.67 1xew h PHE 1024CO 0.01 -0.22 0.47 0.77 -2.02 0.00 0.00 178.31 177.32 1xew h SER 1025N -0.67 0.75 -0.19 0.41 0.02 -1.25 0.42 113.55 113.04 1xew h SER 1025Ca -0.05 0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.80 1xew h SER 1025Cb 0.48 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1xew h SER 1025CO 0.09 0.50 -0.25 -0.33 -1.14 0.00 0.00 176.83 175.69 1xew h GLU 1026N 0.89 0.66 0.01 3.45 5.08 -1.23 -1.39 114.58 122.05 1xew h GLU 1026Ca 0.33 -0.27 -0.23 0.00 -1.00 0.00 0.00 59.36 58.19 1xew h GLU 1026Cb 0.11 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.35 1xew h GLU 1026CO -0.15 0.85 -0.90 0.82 -1.00 0.00 0.00 179.01 178.63 1xew h ILE 1027N 0.57 1.33 -0.72 3.13 2.04 -0.63 -1.95 117.51 121.30 1xew h ILE 1027Ca 0.08 -2.20 0.06 0.00 1.00 0.00 0.00 64.86 63.80 1xew h ILE 1027Cb 0.73 2.48 -0.06 0.00 -0.74 0.00 0.00 36.82 39.24 1xew h ILE 1027CO 0.06 0.67 0.42 0.15 0.00 0.00 0.00 178.15 179.44 1xew h PHE 1028N 0.21 0.77 -0.64 1.37 3.57 -0.11 0.24 116.94 122.34 1xew h PHE 1028Ca -0.11 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 1xew h PHE 1028Cb 1.57 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 40.04 1xew h PHE 1028CO 0.12 0.38 0.38 0.00 -2.23 0.00 0.00 178.31 176.96 1xew h ALA 1029N 1.36 0.82 -0.12 2.41 0.00 -1.13 0.22 119.26 122.82 1xew h ALA 1029Ca 0.32 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1xew h ALA 1029Cb 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xew h ALA 1029CO -0.17 0.31 -0.41 0.87 0.00 0.00 0.00 179.25 179.85 1xew h LYS 1030N 0.87 0.26 0.00 0.00 1.57 -0.97 -3.05 116.57 115.25 1xew h LYS 1030Ca 0.23 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1xew h LYS 1030Cb -0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1xew h LYS 1030CO -0.04 0.63 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.14 1xew h LEU 1031N 0.22 0.00 -6.47 2.94 3.38 -0.12 -3.40 115.31 111.86 1xew h LEU 1031Ca 0.02 -0.07 -0.59 0.00 0.09 0.00 0.00 57.88 57.33 1xew h LEU 1031Cb 0.82 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.18 1xew h LEU 1031CO 0.06 0.04 -0.92 -0.55 0.09 0.00 0.00 178.44 177.16 1xew s SER 1032N -4.68 1.99 0.08 -0.43 0.15 0.68 -4.82 113.70 106.67 1xew s SER 1032Ca 0.08 -2.93 -0.37 0.00 0.70 0.00 0.00 55.95 53.43 1xew s SER 1032Cb 0.12 -0.52 -0.17 0.00 -1.71 0.00 0.00 66.02 63.73 1xew s SER 1032CO 0.66 -0.19 1.25 -2.65 1.20 0.00 0.00 173.24 173.50 1xew n PRO 1033N 3.04 0.88 -1.02 5.44 -0.02 -1.21 -0.75 135.00 141.36 1xew n PRO 1033Ca 0.25 0.32 -0.01 0.00 -2.02 0.00 0.00 63.50 62.04 1xew n PRO 1033Cb 0.45 -1.90 -0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1xew n PRO 1033CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xew n GLY 1034N 2.23 0.35 3.84 -1.23 0.00 -1.26 -4.44 105.19 104.67 1xew n GLY 1034Ca 0.18 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1xew n GLY 1034CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xew s GLY 1035N -2.07 1.57 0.07 -0.02 0.00 0.07 -3.66 107.32 103.29 1xew s GLY 1035Ca 0.00 -1.52 -0.08 0.00 0.00 0.00 0.00 44.72 43.12 1xew s GLY 1035CO 0.00 -1.51 0.17 -1.35 0.00 0.00 0.00 173.10 170.41 1xew s SER 1036N -3.91 0.13 0.01 1.64 1.04 -0.71 -4.56 113.70 107.35 1xew s SER 1036Ca 0.36 -0.62 -0.29 0.00 0.48 0.00 0.00 55.95 55.89 1xew s SER 1036Cb -0.07 0.31 0.07 0.00 0.10 0.00 0.00 66.02 66.43 1xew s SER 1036CO 0.26 -0.68 0.65 0.00 0.98 0.00 0.00 173.24 174.45 1xew s ALA 1037N -3.55 -1.71 0.01 5.32 0.00 -1.26 -0.09 121.76 120.48 1xew s ALA 1037Ca 0.03 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.07 1xew s ALA 1037Cb 0.04 0.23 -0.01 0.00 0.00 0.00 0.00 23.12 23.38 1xew s ALA 1037CO -0.09 -0.47 -0.02 1.03 0.00 0.00 0.00 175.76 176.20 1xew s ARG 1038N -1.87 0.19 -0.10 0.00 1.81 0.09 -4.26 118.95 114.81 1xew s ARG 1038Ca -0.08 -0.34 -0.21 0.00 -1.72 0.00 0.00 55.73 53.38 1xew s ARG 1038Cb -0.00 0.03 -0.04 0.00 -0.45 0.00 0.00 34.95 34.49 1xew s ARG 1038CO 0.04 -0.02 0.62 -0.51 -0.68 0.00 0.00 175.30 174.75 1xew s LEU 1039N -0.78 4.28 -0.11 2.53 1.43 -1.26 -1.16 118.68 123.61 1xew s LEU 1039Ca -0.08 1.02 0.02 0.00 -1.03 0.00 0.00 54.13 54.06 1xew s LEU 1039Cb -0.05 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.25 1xew s LEU 1039CO -0.00 -0.10 -0.16 -0.63 0.23 0.00 0.00 176.35 175.68 1xew s ILE 1040N 0.88 1.58 0.26 -0.59 1.01 0.04 -4.96 121.20 119.42 1xew s ILE 1040Ca 0.33 -0.70 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 1xew s ILE 1040Cb -0.17 -1.43 -0.10 0.00 0.01 0.00 0.00 42.46 40.78 1xew s ILE 1040CO 0.15 0.46 1.32 -0.76 0.00 0.00 0.00 174.94 176.11 1xew s LEU 1041N 0.88 4.42 0.44 2.97 1.43 -1.26 -1.31 118.68 126.26 1xew s LEU 1041Ca -0.08 2.55 0.24 0.00 -1.03 0.00 0.00 54.13 55.81 1xew s LEU 1041Cb -0.15 -3.63 0.57 0.00 0.03 0.00 0.00 46.19 43.01 1xew s LEU 1041CO -0.00 -0.54 1.69 -0.33 0.23 0.00 0.00 176.35 177.39 1xew h GLU 1042N 4.54 0.00 -2.43 1.70 5.08 -1.38 -3.34 114.58 118.74 1xew h GLU 1042Ca -0.47 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.30 1xew h GLU 1042Cb 1.22 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.08 1xew h GLU 1042CO 0.73 0.07 -0.91 -1.71 -1.00 0.00 0.00 179.01 176.19 1xew n ASN 1043N -3.13 0.31 -0.17 1.42 5.15 -1.26 -4.91 115.26 112.66 1xew n ASN 1043Ca 0.03 -2.59 0.22 0.00 -0.60 0.00 0.00 54.58 51.65 1xew n ASN 1043Cb 0.50 -0.60 0.62 0.00 -0.53 0.00 0.00 39.78 39.77 1xew n ASN 1043CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1xew h PRO 1044N 5.35 0.19 0.45 1.20 0.11 -1.94 -0.83 132.00 136.53 1xew h PRO 1044Ca 0.22 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.30 1xew h PRO 1044Cb 0.87 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1xew h PRO 1044CO 0.45 0.13 -0.22 1.49 -0.21 0.00 0.00 178.00 179.64 1xew h GLU 1045N 0.20 -0.59 -2.51 1.05 4.57 -1.95 -3.36 114.58 112.00 1xew h GLU 1045Ca 0.41 0.04 -0.65 0.00 -1.18 0.00 0.00 59.36 57.98 1xew h GLU 1045Cb 1.31 0.13 -0.39 0.00 -0.16 0.00 0.00 28.75 29.65 1xew h GLU 1045CO -0.08 -0.28 -0.27 -3.47 -1.18 0.00 0.00 179.01 173.72 1xew n ASP 1046N -5.22 4.28 -0.34 1.04 4.64 -0.96 -5.00 116.55 114.99 1xew n ASP 1046Ca -0.10 -3.40 0.18 0.00 -1.38 0.00 0.00 54.79 50.10 1xew n ASP 1046Cb 0.30 -0.83 0.39 0.00 -1.04 0.00 0.00 41.12 39.94 1xew n ASP 1046CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1xew h PRO 1047N 4.68 0.48 0.00 -0.67 0.11 -1.32 -0.93 132.00 134.35 1xew h PRO 1047Ca 0.19 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1xew h PRO 1047Cb 0.67 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.67 1xew h PRO 1047CO 0.93 0.32 0.00 1.19 -0.21 0.00 0.00 178.00 180.23 1xew n PHE 1048N -4.95 0.00 0.97 0.65 3.72 -1.26 -1.82 117.46 114.76 1xew n PHE 1048Ca 0.27 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.79 1xew n PHE 1048Cb 0.78 -0.43 0.09 0.00 -0.94 0.00 0.00 39.48 38.98 1xew n PHE 1048CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1xew n SER 1049N -1.43 2.84 -3.07 4.37 3.41 -0.35 -4.99 113.62 114.41 1xew n SER 1049Ca 0.03 -1.92 -0.17 0.00 -0.26 0.00 0.00 58.87 56.55 1xew n SER 1049Cb 0.11 0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.05 1xew n SER 1049CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xew n GLY 1050N 1.31 3.48 0.00 5.00 0.00 -0.76 -4.96 105.19 109.27 1xew n GLY 1050Ca 0.13 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1xew n GLY 1050CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xew n GLY 1051N 0.12 1.71 2.64 -0.02 0.00 -1.26 -4.81 105.19 103.56 1xew n GLY 1051Ca -0.03 -2.02 -0.23 0.00 0.00 0.00 0.00 46.02 43.74 1xew n GLY 1051CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xew s LEU 1052N 0.00 0.26 0.28 0.99 0.20 -1.26 -0.99 118.68 118.16 1xew s LEU 1052Ca 0.00 -0.27 0.04 0.00 0.69 0.00 0.00 54.13 54.60 1xew s LEU 1052Cb 0.00 -0.20 -0.03 0.00 -0.43 0.00 0.00 46.19 45.53 1xew s LEU 1052CO 0.00 -0.30 0.42 -1.61 -0.29 0.00 0.00 176.35 174.57 1xew s GLU 1053N 2.15 3.40 -0.10 1.98 2.02 -0.42 -4.91 118.70 122.82 1xew s GLU 1053Ca 0.03 -0.70 0.04 0.00 0.02 0.00 0.00 54.97 54.36 1xew s GLU 1053Cb -0.14 -2.83 -0.00 0.00 0.10 0.00 0.00 34.13 31.26 1xew s GLU 1053CO -0.06 0.31 -0.23 0.42 0.02 0.00 0.00 175.26 175.72 1xew s ILE 1054N -2.09 2.15 -0.09 -1.63 1.01 -1.26 -0.78 121.20 118.50 1xew s ILE 1054Ca 0.37 -1.00 0.02 0.00 0.00 0.00 0.00 60.65 60.04 1xew s ILE 1054Cb -0.09 -1.82 0.01 0.00 0.01 0.00 0.00 42.46 40.57 1xew s ILE 1054CO 0.31 0.56 -0.14 -1.61 0.00 0.00 0.00 174.94 174.05 1xew s GLU 1055N 0.27 2.06 0.02 2.79 2.02 -0.31 -2.41 118.70 123.14 1xew s GLU 1055Ca -0.16 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.31 1xew s GLU 1055Cb -0.17 -1.73 -0.02 0.00 0.10 0.00 0.00 34.13 32.31 1xew s GLU 1055CO 0.08 -0.02 -0.03 0.00 0.02 0.00 0.00 175.26 175.31 1xew s ALA 1056N 0.85 0.13 -0.31 5.21 0.00 -0.49 -0.73 121.76 126.42 1xew s ALA 1056Ca -0.10 -0.57 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 1xew s ALA 1056Cb -0.15 0.14 0.11 0.00 0.00 0.00 0.00 23.12 23.22 1xew s ALA 1056CO 0.01 -0.15 0.15 0.21 0.00 0.00 0.00 175.76 175.98 1xew s LYS 1057N -1.41 0.35 0.57 0.00 2.20 0.88 -1.81 119.74 120.52 1xew s LYS 1057Ca -0.15 -0.80 -0.17 0.00 -0.36 0.00 0.00 55.97 54.49 1xew s LYS 1057Cb -0.10 -1.30 -0.05 0.00 -1.51 0.00 0.00 37.83 34.88 1xew s LYS 1057CO -0.01 -1.06 1.06 -2.14 -0.36 0.00 0.00 175.35 172.83 1xew s PRO 1058N 1.77 3.40 0.13 4.03 0.02 -1.26 -1.73 135.00 141.36 1xew s PRO 1058Ca 0.11 1.25 -0.32 0.00 0.02 0.00 0.00 61.00 62.07 1xew s PRO 1058Cb -0.18 -2.04 -0.18 0.00 0.02 0.00 0.00 34.50 32.12 1xew s PRO 1058CO -0.26 -0.75 0.70 0.00 -0.33 0.00 0.00 177.00 176.36 1xew n ALA 1059N -1.81 -3.13 -2.10 -1.55 0.00 -1.24 -0.97 120.51 109.71 1xew n ALA 1059Ca 0.09 0.49 -0.20 0.00 0.00 0.00 0.00 53.44 53.82 1xew n ALA 1059Cb 0.53 -1.65 -0.04 0.00 0.00 0.00 0.00 19.45 18.28 1xew n ALA 1059CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xew n GLY 1060N 1.83 0.41 3.19 0.00 0.00 -1.26 -4.99 105.19 104.38 1xew n GLY 1060Ca 0.19 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 1xew n GLY 1060CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xew s LYS 1061N -4.54 0.90 0.61 1.61 1.02 -0.14 -5.13 119.74 114.06 1xew s LYS 1061Ca 0.00 -1.27 -0.10 0.00 0.02 0.00 0.00 55.97 54.62 1xew s LYS 1061Cb 0.00 -0.49 -0.03 0.00 -0.52 0.00 0.00 37.83 36.78 1xew s LYS 1061CO 0.00 0.06 1.01 -0.51 -0.92 0.00 0.00 175.35 174.99 1xew s ASP 1062N -2.75 6.15 0.32 2.83 -0.00 -1.26 -4.65 116.67 117.31 1xew s ASP 1062Ca 0.10 1.33 -0.29 0.00 -0.00 0.00 0.00 52.55 53.69 1xew s ASP 1062Cb 0.00 -2.39 -0.11 0.00 -0.00 0.00 0.00 42.92 40.43 1xew s ASP 1062CO -0.01 -0.88 1.44 -0.69 -0.00 0.00 0.00 175.17 175.03 1xew s VAL 1063N -3.15 2.39 0.11 -1.27 1.01 -1.26 -4.73 120.40 113.51 1xew s VAL 1063Ca 0.54 0.37 -0.09 0.00 0.00 0.00 0.00 61.98 62.80 1xew s VAL 1063Cb -0.11 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 1xew s VAL 1063CO 0.53 0.07 0.23 -0.54 0.00 0.00 0.00 175.10 175.39 1xew s LYS 1064N -1.28 0.93 0.45 2.72 1.02 -0.75 -4.96 119.74 117.86 1xew s LYS 1064Ca 0.55 -0.98 -0.15 0.00 0.02 0.00 0.00 55.97 55.41 1xew s LYS 1064Cb -0.44 0.36 -0.08 0.00 -0.52 0.00 0.00 37.83 37.15 1xew s LYS 1064CO 0.52 -0.31 0.89 1.03 -0.92 0.00 0.00 175.35 176.56 1xew s ARG 1065N -3.88 3.95 0.16 1.68 0.52 -1.26 -1.40 118.95 118.72 1xew s ARG 1065Ca 0.07 0.81 -0.28 0.00 -0.52 0.00 0.00 55.73 55.81 1xew s ARG 1065Cb 0.04 -2.25 -0.04 0.00 0.52 0.00 0.00 34.95 33.22 1xew s ARG 1065CO -0.09 -0.11 1.46 -0.89 0.02 0.00 0.00 175.30 175.69 1xew n ILE 1066N -1.20 -0.63 0.20 1.52 5.41 -1.01 -0.66 119.36 122.99 1xew n ILE 1066Ca 0.05 2.28 0.18 0.00 1.00 0.00 0.00 62.75 66.26 1xew n ILE 1066Cb 0.54 -2.84 0.81 0.00 -0.71 0.00 0.00 39.64 37.44 1xew n ILE 1066CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1xew h GLU 1067N 0.00 0.00 -0.01 0.38 3.07 -1.93 -0.37 114.58 115.72 1xew h GLU 1067Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1xew h GLU 1067Cb 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1xew h GLU 1067CO -0.89 0.00 -0.08 0.00 -1.40 0.00 0.00 179.01 176.64 1xew n ALA 1068N -2.21 2.72 -1.65 3.43 0.00 0.16 -4.94 120.51 118.03 1xew n ALA 1068Ca 0.03 -0.45 -0.16 0.00 0.00 0.00 0.00 53.44 52.85 1xew n ALA 1068Cb 0.45 -1.13 0.16 0.00 0.00 0.00 0.00 19.45 18.94 1xew n ALA 1068CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1xew n MET 1069N 0.02 -1.15 -2.21 0.00 2.81 -0.15 -4.99 117.12 111.46 1xew n MET 1069Ca 0.17 -1.56 -0.28 0.00 -1.81 0.00 0.00 57.70 54.22 1xew n MET 1069Cb 0.37 -1.07 0.03 0.00 -0.71 0.00 0.00 33.22 31.84 1xew n MET 1069CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1xew s SER 1070N -4.65 5.72 0.18 7.83 1.04 -1.26 -4.80 113.70 117.76 1xew s SER 1070Ca 0.58 0.96 -0.20 0.00 0.48 0.00 0.00 55.95 57.77 1xew s SER 1070Cb -0.02 -1.94 0.12 0.00 0.10 0.00 0.00 66.02 64.28 1xew s SER 1070CO 0.41 -1.06 1.61 1.23 0.98 0.00 0.00 173.24 176.41 1xew h GLY 1071N -0.28 -0.00 1.74 7.32 0.00 -1.97 0.12 103.07 109.99 1xew h GLY 1071Ca -0.45 0.34 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 1xew h GLY 1071CO 0.62 -0.21 -0.07 -1.33 0.00 0.00 0.00 176.54 175.55 1xew h GLY 1072N -0.16 0.35 1.03 4.60 0.00 -1.93 -2.00 103.07 104.96 1xew h GLY 1072Ca 0.22 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 47.21 1xew h GLY 1072CO -0.57 0.19 -0.32 0.83 0.00 0.00 0.00 176.54 176.67 1xew h GLU 1073N 0.31 0.79 -0.22 4.80 5.08 -1.19 -1.75 114.58 122.41 1xew h GLU 1073Ca 0.07 -0.42 0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1xew h GLU 1073Cb 0.32 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1xew h GLU 1073CO 0.01 1.05 0.05 0.87 -1.00 0.00 0.00 179.01 179.99 1xew h LYS 1074N 0.57 0.14 -0.26 2.33 1.57 -0.75 -1.34 116.57 118.82 1xew h LYS 1074Ca 0.05 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1xew h LYS 1074Cb 0.90 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.16 1xew h LYS 1074CO 0.08 0.09 0.14 0.00 -0.57 0.00 0.00 179.45 179.19 1xew h ALA 1075N 1.15 0.33 -0.54 3.86 0.00 -1.26 -0.54 119.26 122.27 1xew h ALA 1075Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xew h ALA 1075Cb 0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1xew h ALA 1075CO -0.12 -0.13 0.35 1.25 0.00 0.00 0.00 179.25 180.60 1xew h LEU 1076N 0.30 0.62 0.03 0.00 5.85 -1.22 -1.57 115.31 119.32 1xew h LEU 1076Ca 0.09 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1xew h LEU 1076Cb 0.08 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1xew h LEU 1076CO -0.01 0.46 -0.01 0.74 -0.34 0.00 0.00 178.44 179.27 1xew h THR 1077N 0.73 1.15 -0.84 1.05 2.02 -1.12 0.12 112.91 116.02 1xew h THR 1077Ca 0.20 -0.54 0.12 0.00 0.77 0.00 0.00 66.41 66.96 1xew h THR 1077Cb -0.08 1.50 -0.08 0.00 -1.74 0.00 0.00 68.15 67.76 1xew h THR 1077CO -0.04 0.14 0.46 0.00 0.37 0.00 0.00 175.52 176.45 1xew h ALA 1078N 0.70 1.22 -0.37 6.16 0.00 -1.09 -1.49 119.26 124.40 1xew h ALA 1078Ca -0.00 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1xew h ALA 1078Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xew h ALA 1078CO 0.01 0.02 -0.02 1.25 0.00 0.00 0.00 179.25 180.51 1xew h LEU 1079N 0.72 0.65 -1.30 0.00 6.46 -1.03 -1.00 115.31 119.83 1xew h LEU 1079Ca 0.43 -0.32 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1xew h LEU 1079Cb 0.48 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.20 1xew h LEU 1079CO -0.29 0.82 0.45 0.00 -0.62 0.00 0.00 178.44 178.79 1xew h ALA 1080N 0.86 1.48 -0.12 1.25 0.00 -0.46 -0.23 119.26 122.05 1xew h ALA 1080Ca 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xew h ALA 1080Cb 0.49 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xew h ALA 1080CO 0.02 0.47 0.06 0.35 0.00 0.00 0.00 179.25 180.15 1xew h PHE 1081N 0.94 0.17 -0.38 0.00 3.57 -0.65 -0.20 116.94 120.39 1xew h PHE 1081Ca 0.25 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 1xew h PHE 1081Cb -0.09 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1xew h PHE 1081CO 0.00 0.21 0.10 0.28 -2.23 0.00 0.00 178.31 176.67 1xew h VAL 1082N 0.08 1.22 -0.92 1.41 2.07 -0.93 -2.32 116.25 116.86 1xew h VAL 1082Ca 0.04 -0.75 0.08 0.00 0.82 0.00 0.00 66.70 66.90 1xew h VAL 1082Cb 0.10 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 1xew h VAL 1082CO -0.01 0.26 0.59 -0.26 0.02 0.00 0.00 177.57 178.18 1xew h PHE 1083N 0.47 1.04 -0.41 1.57 0.05 -0.88 -1.00 116.94 117.77 1xew h PHE 1083Ca 0.12 0.03 -0.05 0.00 3.82 0.00 0.00 57.97 61.89 1xew h PHE 1083Cb 0.29 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 37.88 1xew h PHE 1083CO 0.01 0.50 0.06 0.00 -0.18 0.00 0.00 178.31 178.71 1xew h ALA 1084N 1.52 1.34 -0.12 2.45 0.00 -0.56 -0.22 119.26 123.67 1xew h ALA 1084Ca 0.41 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.95 1xew h ALA 1084Cb 0.31 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1xew h ALA 1084CO -0.17 0.46 -0.65 0.82 0.00 0.00 0.00 179.25 179.71 1xew h ILE 1085N 0.60 1.32 -0.81 0.00 2.04 -0.90 -2.37 117.51 117.39 1xew h ILE 1085Ca 0.13 -1.91 0.00 0.00 1.00 0.00 0.00 64.86 64.08 1xew h ILE 1085Cb 0.29 2.11 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 1xew h ILE 1085CO 0.00 0.59 0.52 1.56 0.00 0.00 0.00 178.15 180.82 1xew h GLN 1086N 0.32 1.07 -0.34 2.37 4.20 -0.97 -1.85 115.11 119.91 1xew h GLN 1086Ca -0.05 -0.08 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 1xew h GLN 1086Cb 1.29 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.82 1xew h GLN 1086CO 0.13 0.73 -0.15 -0.22 -0.67 0.00 0.00 178.83 178.65 1xew h LYS 1087N 1.10 0.61 -0.08 1.46 3.64 -1.04 -1.83 116.57 120.43 1xew h LYS 1087Ca 0.29 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.36 1xew h LYS 1087Cb -0.10 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1xew h LYS 1087CO -0.06 0.74 -0.46 0.35 -2.27 0.00 0.00 179.45 177.75 1xew h PHE 1088N 0.55 0.23 -2.20 1.91 3.57 -0.86 -3.37 116.94 116.77 1xew h PHE 1088Ca 0.09 -0.07 -0.51 0.00 3.53 0.00 0.00 57.97 61.01 1xew h PHE 1088Cb 0.58 -0.05 -0.35 0.00 2.79 0.00 0.00 35.95 38.92 1xew h PHE 1088CO 0.02 0.62 -0.87 0.21 -2.23 0.00 0.00 178.31 176.06 1xew s LYS 1089N -4.03 0.83 0.78 1.11 2.20 -0.75 -5.11 119.74 114.76 1xew s LYS 1089Ca -0.04 -1.71 -0.11 0.00 -0.36 0.00 0.00 55.97 53.75 1xew s LYS 1089Cb 0.13 -1.16 0.06 0.00 -1.51 0.00 0.00 37.83 35.35 1xew s LYS 1089CO 0.77 -1.33 1.10 -1.25 -0.36 0.00 0.00 175.35 174.28 1xew s PRO 1090N 0.49 2.19 0.34 4.03 0.04 -0.71 -4.65 135.00 136.73 1xew s PRO 1090Ca 0.28 1.22 0.08 0.00 0.04 0.00 0.00 61.00 62.63 1xew s PRO 1090Cb -0.04 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1xew s PRO 1090CO -0.12 -1.70 -0.07 0.00 0.04 0.00 0.00 177.00 175.15 1xew s ALA 1091N -2.83 2.85 0.11 8.56 0.00 -1.26 -5.04 121.76 124.15 1xew s ALA 1091Ca 0.62 -2.09 0.21 0.00 0.00 0.00 0.00 51.96 50.70 1xew s ALA 1091Cb -0.18 0.06 0.71 0.00 0.00 0.00 0.00 23.12 23.71 1xew s ALA 1091CO 0.55 0.01 1.74 -1.00 0.00 0.00 0.00 175.76 177.06 1xew h PRO 1092N 2.04 0.00 -3.78 0.00 0.13 -1.98 -3.46 132.00 124.95 1xew h PRO 1092Ca -0.42 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.58 1xew h PRO 1092Cb 1.25 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.19 1xew h PRO 1092CO 0.71 0.32 -0.53 -0.59 -0.23 0.00 0.00 178.00 177.68 1xew s PHE 1093N -3.55 0.19 -0.02 1.56 -0.12 -1.26 -2.92 117.98 111.84 1xew s PHE 1093Ca 0.01 -0.46 0.07 0.00 -0.05 0.00 0.00 56.93 56.49 1xew s PHE 1093Cb 0.10 -0.14 -0.02 0.00 -0.63 0.00 0.00 43.02 42.34 1xew s PHE 1093CO 0.67 -0.35 -0.22 0.71 -0.05 0.00 0.00 175.22 175.98 1xew s TYR 1094N -2.41 2.02 -0.15 3.49 1.51 0.35 -4.97 117.35 117.20 1xew s TYR 1094Ca -0.07 -0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 55.57 1xew s TYR 1094Cb -0.02 -1.31 0.04 0.00 -0.11 0.00 0.00 41.96 40.56 1xew s TYR 1094CO -0.04 -0.06 -0.05 -1.17 -1.11 0.00 0.00 175.55 173.12 1xew s LEU 1095N -0.46 1.44 -0.12 -1.29 2.96 -1.26 -0.10 118.68 119.85 1xew s LEU 1095Ca 0.07 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.46 1xew s LEU 1095Cb -0.09 -0.86 -0.00 0.00 0.50 0.00 0.00 46.19 45.73 1xew s LEU 1095CO -0.00 -0.17 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.29 1xew s PHE 1096N 1.68 2.65 -0.39 5.38 2.99 0.57 -4.98 117.98 125.87 1xew s PHE 1096Ca 0.02 -1.00 -0.03 0.00 0.00 0.00 0.00 56.93 55.92 1xew s PHE 1096Cb -0.14 -1.77 0.10 0.00 0.00 0.00 0.00 43.02 41.20 1xew s PHE 1096CO -0.08 -0.41 0.16 0.34 -0.00 0.00 0.00 175.22 175.24 1xew s ASP 1097N 0.45 5.20 -1.44 1.36 3.68 -1.26 -0.04 116.67 124.62 1xew s ASP 1097Ca -0.14 -1.86 -0.09 0.00 2.13 0.00 0.00 52.55 52.59 1xew s ASP 1097Cb -0.17 -1.81 0.05 0.00 -1.45 0.00 0.00 42.92 39.54 1xew s ASP 1097CO 0.06 -0.48 0.94 -0.62 0.13 0.00 0.00 175.17 175.20 1xew n GLU 1098N 4.61 -5.77 0.11 4.34 -0.58 0.53 -4.88 120.64 119.00 1xew n GLU 1098Ca -0.05 0.65 0.12 0.00 -0.42 0.00 0.00 57.16 57.46 1xew n GLU 1098Cb 0.42 -5.48 0.46 0.00 -0.57 0.00 0.00 31.44 26.27 1xew n GLU 1098CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1xew n ILE 1099N -4.61 0.77 1.02 -3.67 -5.35 -1.26 -3.28 119.36 102.98 1xew n ILE 1099Ca -0.06 0.12 0.11 0.00 -0.27 0.00 0.00 62.75 62.64 1xew n ILE 1099Cb 0.57 -1.01 -0.01 0.00 -1.74 0.00 0.00 39.64 37.46 1xew n ILE 1099CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1xew n ASP 1100N -2.16 1.28 -0.32 7.28 3.85 -1.26 -4.54 116.55 120.68 1xew n ASP 1100Ca 0.03 -1.08 0.05 0.00 -0.71 0.00 0.00 54.79 53.08 1xew n ASP 1100Cb 0.27 0.69 0.20 0.00 -1.35 0.00 0.00 41.12 40.92 1xew n ASP 1100CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1xew h ALA 1101N 3.33 1.30 -0.46 2.12 0.00 -1.95 -1.12 119.26 122.48 1xew h ALA 1101Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xew h ALA 1101Cb 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1xew h ALA 1101CO 0.00 0.13 0.00 0.72 0.00 0.00 0.00 179.25 180.10 1xew n HIS 1102N -4.71 0.60 -1.78 0.00 8.25 -1.26 -4.94 115.22 111.38 1xew n HIS 1102Ca 0.16 -0.30 -0.30 0.00 -0.26 0.00 0.00 57.72 57.02 1xew n HIS 1102Cb 0.31 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.50 1xew n HIS 1102CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xew s LEU 1103N -1.28 2.63 0.16 2.41 1.43 -0.43 -4.08 118.68 119.53 1xew s LEU 1103Ca 0.39 1.05 -0.14 0.00 -1.03 0.00 0.00 54.13 54.39 1xew s LEU 1103Cb 0.21 -3.67 -0.07 0.00 0.03 0.00 0.00 46.19 42.70 1xew s LEU 1103CO 0.29 -1.76 0.56 -1.81 0.23 0.00 0.00 176.35 173.86 1xew s ASP 1104N -4.30 6.82 0.21 2.29 -0.00 -1.26 -4.94 116.67 115.49 1xew s ASP 1104Ca 0.60 1.09 -0.17 0.00 -0.00 0.00 0.00 52.55 54.07 1xew s ASP 1104Cb -0.12 -2.29 0.22 0.00 -0.00 0.00 0.00 42.92 40.72 1xew s ASP 1104CO 0.52 0.08 1.59 -0.78 -0.00 0.00 0.00 175.17 176.57 1xew h ASP 1105N 3.43 -1.01 -0.36 0.27 1.82 -1.96 -0.95 116.42 117.66 1xew h ASP 1105Ca -0.48 0.24 0.10 0.00 -0.39 0.00 0.00 57.03 56.50 1xew h ASP 1105Cb 1.19 0.56 -0.01 0.00 0.68 0.00 0.00 39.33 41.74 1xew h ASP 1105CO 0.66 -0.28 0.38 0.00 -1.61 0.00 0.00 179.24 178.39 1xew h ALA 1106N 1.36 2.05 0.00 -0.78 0.00 -2.01 -2.45 119.26 117.43 1xew h ALA 1106Ca 0.30 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 1xew h ALA 1106Cb 0.56 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1xew h ALA 1106CO -0.76 -0.57 -1.08 -0.91 0.00 0.00 0.00 179.25 175.93 1xew h ASN 1107N 0.00 0.00 -0.44 0.00 -0.26 -1.49 -3.39 115.58 110.00 1xew h ASN 1107Ca 0.17 0.00 0.06 0.00 -0.56 0.00 0.00 56.30 55.97 1xew h ASN 1107Cb 0.93 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.14 1xew h ASN 1107CO -0.00 0.37 0.15 0.58 -1.06 0.00 0.00 177.43 177.47 1xew h VAL 1108N 0.00 0.85 -0.90 2.81 2.07 -1.40 -2.37 116.25 117.31 1xew h VAL 1108Ca -0.08 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.35 1xew h VAL 1108Cb 1.35 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 1xew h VAL 1108CO 0.03 0.06 0.58 0.50 0.02 0.00 0.00 177.57 178.77 1xew h LYS 1109N 0.32 1.11 -0.17 1.57 3.64 -1.75 0.12 116.57 121.41 1xew h LYS 1109Ca 0.21 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 1xew h LYS 1109Cb 0.21 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1xew h LYS 1109CO -0.22 0.74 -0.36 0.00 -2.27 0.00 0.00 179.45 177.34 1xew h ARG 1110N 1.15 0.36 0.02 1.90 -0.00 -1.67 0.16 114.38 116.30 1xew h ARG 1110Ca 0.35 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.98 59.67 1xew h ARG 1110Cb -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 29.97 29.93 1xew h ARG 1110CO -0.11 0.68 -0.01 0.28 0.00 0.00 0.00 179.97 180.81 1xew h VAL 1111N 0.31 1.22 -0.61 2.04 2.07 -0.94 -1.37 116.25 118.98 1xew h VAL 1111Ca 0.03 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 1xew h VAL 1111Cb 0.78 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1xew h VAL 1111CO 0.06 0.19 0.30 0.00 0.02 0.00 0.00 177.57 178.14 1xew h ALA 1112N 0.62 1.39 -0.36 1.67 0.00 -0.57 -1.25 119.26 120.75 1xew h ALA 1112Ca -0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1xew h ALA 1112Cb 0.33 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1xew h ALA 1112CO 0.01 0.48 -0.35 0.22 0.00 0.00 0.00 179.25 179.61 1xew h ASP 1113N 0.85 0.88 -0.68 0.00 3.58 -0.61 -0.27 116.42 120.17 1xew h ASP 1113Ca 0.21 -0.38 -0.06 0.00 0.42 0.00 0.00 57.03 57.22 1xew h ASP 1113Cb 0.07 -0.24 -0.03 0.00 1.72 0.00 0.00 39.33 40.85 1xew h ASP 1113CO -0.03 1.13 0.19 0.25 -2.88 0.00 0.00 179.24 177.91 1xew h LEU 1114N 0.69 1.01 -0.10 2.28 5.85 -0.86 -2.00 115.31 122.20 1xew h LEU 1114Ca 0.07 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 1xew h LEU 1114Cb 0.91 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1xew h LEU 1114CO 0.08 0.96 -0.01 0.40 -0.34 0.00 0.00 178.44 179.53 1xew h ILE 1115N 1.03 1.28 -0.82 4.05 2.04 -1.04 -1.19 117.51 122.86 1xew h ILE 1115Ca 0.22 -0.89 0.16 0.00 1.00 0.00 0.00 64.86 65.35 1xew h ILE 1115Cb 0.32 1.67 -0.10 0.00 -0.74 0.00 0.00 36.82 37.98 1xew h ILE 1115CO -0.00 0.25 0.38 0.50 0.00 0.00 0.00 178.15 179.28 1xew h LYS 1116N -0.13 0.51 0.02 2.37 3.64 -0.96 -0.81 116.57 121.21 1xew h LYS 1116Ca 0.03 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 1xew h LYS 1116Cb 0.40 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1xew h LYS 1116CO 0.01 0.34 -0.96 0.93 -2.27 0.00 0.00 179.45 177.49 1xew h GLU 1117N 0.52 0.12 0.00 1.90 4.39 -1.16 -2.90 114.58 117.45 1xew h GLU 1117Ca 0.46 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1xew h GLU 1117Cb 0.70 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 1xew h GLU 1117CO -0.40 0.99 0.00 0.43 -1.16 0.00 0.00 179.01 178.87 1xew n SER 1118N -3.54 0.54 0.00 1.42 7.64 -0.47 -2.56 113.62 116.65 1xew n SER 1118Ca -0.03 0.57 0.14 0.00 1.01 0.00 0.00 58.87 60.56 1xew n SER 1118Cb 0.87 -0.71 0.79 0.00 -1.01 0.00 0.00 64.21 64.15 1xew n SER 1118CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1xew n SER 1119N -2.03 0.00 0.24 6.43 3.41 -0.36 -1.40 113.62 119.92 1xew n SER 1119Ca 0.05 -0.51 0.15 0.00 -0.26 0.00 0.00 58.87 58.30 1xew n SER 1119Cb 0.35 -0.14 0.44 0.00 -0.26 0.00 0.00 64.21 64.60 1xew n SER 1119CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1xew h LYS 1120N 0.00 0.00 0.00 4.33 6.56 -1.59 -3.34 116.57 122.54 1xew h LYS 1120Ca 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.58 1xew h LYS 1120Cb 0.13 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.79 1xew h LYS 1120CO 0.00 0.00 -1.05 -1.91 -2.06 0.00 0.00 179.45 174.43 1xew n GLU 1121N -3.05 2.54 -4.29 3.15 2.13 -0.80 -5.08 120.64 115.24 1xew n GLU 1121Ca 0.02 -0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.69 1xew n GLU 1121Cb 0.41 -1.02 -0.10 0.00 0.27 0.00 0.00 31.44 31.00 1xew n GLU 1121CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 1xew s SER 1122N -2.76 1.34 0.04 4.31 0.01 -0.49 -5.10 113.70 111.05 1xew s SER 1122Ca -0.00 -1.26 -0.18 0.00 1.31 0.00 0.00 55.95 55.82 1xew s SER 1122Cb 0.00 0.11 -0.06 0.00 0.21 0.00 0.00 66.02 66.28 1xew s SER 1122CO 0.04 -0.62 0.51 -1.58 0.41 0.00 0.00 173.24 172.00 1xew s GLN 1123N -3.95 4.11 -0.05 12.44 0.74 -1.15 -4.15 119.66 127.65 1xew s GLN 1123Ca 0.30 0.61 0.02 0.00 0.05 0.00 0.00 55.36 56.35 1xew s GLN 1123Cb 0.07 -3.24 0.01 0.00 1.10 0.00 0.00 33.01 30.95 1xew s GLN 1123CO 0.09 0.63 -0.10 -0.06 -0.55 0.00 0.00 175.29 175.30 1xew s PHE 1124N -1.01 1.15 -0.17 1.67 0.40 -1.26 -0.49 117.98 118.26 1xew s PHE 1124Ca 0.27 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.25 1xew s PHE 1124Cb -0.18 -0.86 0.03 0.00 0.51 0.00 0.00 43.02 42.52 1xew s PHE 1124CO 0.17 -0.19 -0.14 0.42 0.70 0.00 0.00 175.22 176.18 1xew s ILE 1125N 0.52 1.68 -0.12 0.64 1.01 0.85 -4.95 121.20 120.82 1xew s ILE 1125Ca -0.10 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.75 1xew s ILE 1125Cb -0.13 -1.63 0.02 0.00 0.01 0.00 0.00 42.46 40.73 1xew s ILE 1125CO 0.02 0.36 -0.15 -0.69 0.00 0.00 0.00 174.94 174.49 1xew s VAL 1126N 1.42 1.50 -0.25 2.92 1.01 -1.26 -0.31 120.40 125.43 1xew s VAL 1126Ca 0.03 -0.63 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 1xew s VAL 1126Cb -0.14 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1xew s VAL 1126CO -0.10 0.44 0.47 -0.63 0.00 0.00 0.00 175.10 175.29 1xew s ILE 1127N 1.17 5.11 0.06 2.22 1.01 0.95 -4.97 121.20 126.76 1xew s ILE 1127Ca -0.02 0.81 -0.13 0.00 0.00 0.00 0.00 60.65 61.30 1xew s ILE 1127Cb -0.14 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.55 1xew s ILE 1127CO -0.05 0.13 0.29 0.28 0.00 0.00 0.00 174.94 175.60 1xew s THR 1128N 2.05 0.09 -0.18 2.92 -1.32 -1.26 -0.35 115.64 117.59 1xew s THR 1128Ca 0.20 -0.77 0.16 0.00 -1.21 0.00 0.00 61.69 60.07 1xew s THR 1128Cb -0.16 -1.04 0.44 0.00 -1.51 0.00 0.00 72.50 70.23 1xew s THR 1128CO 0.09 -0.42 1.32 0.18 -2.21 0.00 0.00 174.62 173.58 1xew n LEU 1129N 0.36 3.32 -4.51 9.08 4.77 -1.26 -5.01 117.00 123.75 1xew n LEU 1129Ca -0.18 -3.20 -0.35 0.00 -0.03 0.00 0.00 56.01 52.25 1xew n LEU 1129Cb 0.61 -0.52 -0.12 0.00 -2.33 0.00 0.00 43.42 41.06 1xew n LEU 1129CO 0.21 0.81 -0.29 -0.13 -1.33 0.00 0.00 177.39 176.66 1xew s ARG 1130N -2.93 3.75 0.40 3.23 1.81 -1.26 -4.99 118.95 118.96 1xew s ARG 1130Ca 0.39 -0.45 0.11 0.00 -1.72 0.00 0.00 55.73 54.06 1xew s ARG 1130Cb 0.33 -3.22 0.91 0.00 -0.45 0.00 0.00 34.95 32.53 1xew s ARG 1130CO 0.05 0.02 1.95 -0.44 -0.68 0.00 0.00 175.30 176.20 1xew h ASP 1131N 7.52 0.50 0.14 0.23 3.32 -1.99 -0.10 116.42 126.04 1xew h ASP 1131Ca -0.36 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.58 1xew h ASP 1131Cb 1.18 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1xew h ASP 1131CO 0.62 0.30 -0.44 0.58 -1.72 0.00 0.00 179.24 178.58 1xew h VAL 1132N 0.56 1.32 0.19 -1.35 2.07 -1.97 -1.16 116.25 115.91 1xew h VAL 1132Ca 0.33 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 1xew h VAL 1132Cb 0.52 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1xew h VAL 1132CO -0.11 0.49 -0.09 0.24 0.02 0.00 0.00 177.57 178.12 1xew h MET 1133N 0.30 -0.25 0.20 1.57 2.86 -1.39 -3.24 114.93 114.99 1xew h MET 1133Ca 0.02 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1xew h MET 1133Cb 0.89 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.57 1xew h MET 1133CO 0.07 -0.01 -0.51 0.52 1.06 0.00 0.00 176.91 178.05 1xew h MET 1134N -0.47 -0.76 -1.18 1.72 2.07 -1.27 -2.99 114.93 112.05 1xew h MET 1134Ca -0.03 0.05 0.34 0.00 -2.07 0.00 0.00 59.70 57.99 1xew h MET 1134Cb 0.36 0.17 -0.07 0.00 -1.87 0.00 0.00 31.60 30.19 1xew h MET 1134CO 0.04 -0.50 0.82 0.00 1.07 0.00 0.00 176.91 178.34 1xew h ALA 1135N -0.67 2.87 0.00 6.32 0.00 -1.28 -0.27 119.26 126.23 1xew h ALA 1135Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xew h ALA 1135Cb 0.76 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1xew h ALA 1135CO -0.23 -1.26 -0.32 0.09 0.00 0.00 0.00 179.25 177.54 1xew n ASN 1136N -4.33 0.69 -4.79 0.00 3.02 -1.13 -4.96 115.26 103.76 1xew n ASN 1136Ca 0.27 0.31 -0.34 0.00 -0.03 0.00 0.00 54.58 54.79 1xew n ASN 1136Cb 1.18 -0.28 -0.01 0.00 -0.61 0.00 0.00 39.78 40.07 1xew n ASN 1136CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xew s ALA 1137N -3.12 2.75 0.02 5.41 0.00 -0.11 -4.94 121.76 121.76 1xew s ALA 1137Ca 0.09 0.66 0.14 0.00 0.00 0.00 0.00 51.96 52.86 1xew s ALA 1137Cb 0.14 -3.30 0.22 0.00 0.00 0.00 0.00 23.12 20.17 1xew s ALA 1137CO 0.66 -0.64 1.51 -0.44 0.00 0.00 0.00 175.76 176.84 1xew h ASP 1138N 1.14 0.00 -5.00 0.00 3.45 -1.93 -3.46 116.42 110.63 1xew h ASP 1138Ca -0.49 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 56.84 1xew h ASP 1138Cb 1.24 0.00 -0.20 0.00 -0.56 0.00 0.00 39.33 39.81 1xew h ASP 1138CO 0.58 0.56 -0.36 -0.75 -1.57 0.00 0.00 179.24 177.70 1xew s LYS 1139N -3.14 0.62 -0.03 3.56 2.20 -1.26 -5.15 119.74 116.53 1xew s LYS 1139Ca 0.02 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.35 1xew s LYS 1139Cb 0.09 0.27 -0.00 0.00 -1.51 0.00 0.00 37.83 36.67 1xew s LYS 1139CO 0.74 -0.17 -0.15 0.42 -0.36 0.00 0.00 175.35 175.84 1xew s ILE 1140N -1.52 1.21 -0.03 5.43 1.01 -1.26 -5.06 121.20 120.99 1xew s ILE 1140Ca -0.13 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 59.97 1xew s ILE 1140Cb -0.05 -1.03 -0.01 0.00 0.01 0.00 0.00 42.46 41.37 1xew s ILE 1140CO 0.02 0.35 -0.22 -0.63 0.00 0.00 0.00 174.94 174.47 1xew s ILE 1141N -0.07 1.74 0.04 2.92 -1.09 -1.26 -0.21 121.20 123.27 1xew s ILE 1141Ca -0.00 -0.92 0.06 0.00 -2.23 0.00 0.00 60.65 57.55 1xew s ILE 1141Cb -0.09 -1.46 -0.03 0.00 -1.58 0.00 0.00 42.46 39.30 1xew s ILE 1141CO 0.01 0.49 -0.12 -0.83 -1.23 0.00 0.00 174.94 173.26 1xew s GLY 1142N -0.36 1.70 0.00 6.18 0.00 0.52 -4.91 107.32 110.44 1xew s GLY 1142Ca 0.04 -1.14 0.04 0.00 0.00 0.00 0.00 44.72 43.66 1xew s GLY 1142CO 0.00 -1.04 -0.12 0.14 0.00 0.00 0.00 173.10 172.08 1xew s VAL 1143N -1.03 0.92 0.09 1.40 1.01 -1.26 -1.97 120.40 119.56 1xew s VAL 1143Ca 0.17 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.41 1xew s VAL 1143Cb -0.11 -0.79 0.03 0.00 0.00 0.00 0.00 36.38 35.51 1xew s VAL 1143CO 0.08 0.19 0.37 -0.94 0.00 0.00 0.00 175.10 174.80 1xew s SER 1144N -0.45 -0.19 0.00 3.32 1.04 -0.81 -4.97 113.70 111.64 1xew s SER 1144Ca 0.04 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1xew s SER 1144Cb -0.05 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1xew s SER 1144CO -0.00 -0.75 0.00 0.80 0.98 0.00 0.00 173.24 174.27 1xew n MET 1145N 0.11 1.77 0.00 4.02 1.56 -1.26 0.24 117.12 123.57 1xew n MET 1145Ca -0.17 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.26 1xew n MET 1145Cb 0.62 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.99 1xew n MET 1145CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1xew n GLY 1148N 5.00 0.39 3.39 -5.12 0.00 -1.26 -4.98 105.19 102.62 1xew n GLY 1148Ca 0.00 -1.71 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 1xew n GLY 1148CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xew s VAL 1149N -2.97 3.03 0.29 1.61 1.01 -1.26 -5.12 120.40 116.99 1xew s VAL 1149Ca 0.00 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.11 1xew s VAL 1149Cb 0.00 -2.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.04 1xew s VAL 1149CO 0.00 0.54 0.77 -0.44 0.00 0.00 0.00 175.10 175.97 1xew s SER 1150N 0.14 6.98 0.04 3.32 0.01 -1.26 -4.97 113.70 117.96 1xew s SER 1150Ca -0.07 1.44 0.04 0.00 1.31 0.00 0.00 55.95 58.68 1xew s SER 1150Cb -0.15 -2.43 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 1xew s SER 1150CO 0.05 -0.10 -0.12 -0.75 0.41 0.00 0.00 173.24 172.74 1xew s LYS 1151N -2.44 0.75 0.03 12.44 2.20 0.14 -4.97 119.74 127.89 1xew s LYS 1151Ca 0.49 -0.75 0.04 0.00 -0.36 0.00 0.00 55.97 55.39 1xew s LYS 1151Cb -0.14 -0.69 -0.02 0.00 -1.51 0.00 0.00 37.83 35.47 1xew s LYS 1151CO 0.19 0.16 -0.11 0.08 -0.36 0.00 0.00 175.35 175.31 1xew s VAL 1152N -1.02 0.84 -0.06 4.02 1.01 -1.26 -1.91 120.40 122.02 1xew s VAL 1152Ca -0.02 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 1xew s VAL 1152Cb -0.08 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.54 1xew s VAL 1152CO 0.01 -0.05 0.30 -0.69 0.00 0.00 0.00 175.10 174.66 1xew s VAL 1153N -0.82 0.03 -0.01 2.92 1.01 -0.83 -4.98 120.40 117.73 1xew s VAL 1153Ca -0.01 -0.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.46 1xew s VAL 1153Cb -0.07 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 1xew s VAL 1153CO 0.01 -0.14 0.76 -0.44 0.00 0.00 0.00 175.10 175.28 1xew s SER 1154N -0.61 7.14 0.09 3.32 0.01 -1.26 -0.36 113.70 122.03 1xew s SER 1154Ca -0.07 1.36 0.09 0.00 1.31 0.00 0.00 55.95 58.64 1xew s SER 1154Cb -0.04 -2.46 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1xew s SER 1154CO 0.02 -0.07 -0.23 -0.76 0.41 0.00 0.00 173.24 172.61 1xew s LEU 1155N 0.41 2.25 0.45 2.44 1.43 0.71 -4.92 118.68 121.45 1xew s LEU 1155Ca 0.40 -0.65 -0.10 0.00 -1.03 0.00 0.00 54.13 52.75 1xew s LEU 1155Cb -0.19 -1.03 -0.06 0.00 0.03 0.00 0.00 46.19 44.93 1xew s LEU 1155CO 0.22 0.14 0.81 -0.94 0.23 0.00 0.00 176.35 176.81 1xew s SER 1156N -1.67 6.46 0.22 2.29 1.04 -1.26 -4.09 113.70 116.69 1xew s SER 1156Ca 0.09 1.16 -0.09 0.00 0.48 0.00 0.00 55.95 57.59 1xew s SER 1156Cb -0.10 -2.34 0.33 0.00 0.10 0.00 0.00 66.02 64.01 1xew s SER 1156CO 0.04 -0.49 1.68 0.25 0.98 0.00 0.00 173.24 175.71 1xew h LEU 1157N 0.92 -0.10 -0.52 2.42 5.85 -1.97 0.80 115.31 122.71 1xew h LEU 1157Ca -0.47 0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.40 1xew h LEU 1157Cb 1.19 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.40 1xew h LEU 1157CO 0.63 -0.05 0.33 -0.33 -0.34 0.00 0.00 178.44 178.68 1xew h GLU 1158N 0.20 0.64 0.06 1.25 3.07 -1.99 1.24 114.58 119.06 1xew h GLU 1158Ca 0.34 -0.04 -0.24 0.00 -0.50 0.00 0.00 59.36 58.92 1xew h GLU 1158Cb 0.54 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1xew h GLU 1158CO -0.47 0.42 -1.07 1.57 -1.40 0.00 0.00 179.01 178.06 1xew h LYS 1159N 0.66 0.28 -0.71 2.33 2.10 -1.76 -2.88 116.57 116.59 1xew h LYS 1159Ca 0.20 -0.38 0.08 0.00 -2.00 0.00 0.00 60.65 58.54 1xew h LYS 1159Cb -0.03 0.13 -0.06 0.00 -0.90 0.00 0.00 32.23 31.36 1xew h LYS 1159CO -0.07 1.12 0.38 0.00 -2.00 0.00 0.00 179.45 178.89 1xew h ALA 1160N 0.73 0.98 -0.13 0.07 0.00 0.14 -0.81 119.26 120.23 1xew h ALA 1160Ca -0.09 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1xew h ALA 1160Cb 1.76 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 1xew h ALA 1160CO 0.17 0.02 -0.19 0.52 0.00 0.00 0.00 179.25 179.78 1xew h MET 1161N 0.67 0.21 -0.22 0.00 2.86 0.16 -0.46 114.93 118.15 1xew h MET 1161Ca 0.34 -0.06 -0.18 0.00 -2.06 0.00 0.00 59.70 57.74 1xew h MET 1161Cb 0.29 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 1xew h MET 1161CO -0.23 0.40 -0.59 -0.22 1.06 0.00 0.00 176.91 177.32 1xew h LYS 1162N 0.19 0.71 -0.63 1.72 3.64 -1.13 -2.46 116.57 118.61 1xew h LYS 1162Ca 0.04 -0.48 -0.09 0.00 -1.27 0.00 0.00 60.65 58.85 1xew h LYS 1162Cb 0.45 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 1xew h LYS 1162CO 0.03 1.10 0.04 0.82 -2.27 0.00 0.00 179.45 179.17 1xew h ILE 1163N 0.54 1.27 -0.11 2.00 2.04 -0.75 0.64 117.51 123.13 1xew h ILE 1163Ca -0.00 -1.12 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 1xew h ILE 1163Cb 1.18 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1xew h ILE 1163CO 0.12 0.41 0.06 0.25 0.00 0.00 0.00 178.15 178.99 1xew h LEU 1164N 1.01 0.14 -1.09 1.44 5.85 -0.95 -0.61 115.31 121.10 1xew h LEU 1164Ca 0.18 -0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.88 1xew h LEU 1164Cb 0.52 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.45 1xew h LEU 1164CO 0.03 0.21 0.62 -0.08 -0.34 0.00 0.00 178.44 178.88 1xew h GLU 1165N 0.06 0.99 -0.51 1.25 4.81 -1.36 0.54 114.58 120.36 1xew h GLU 1165Ca 0.04 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1xew h GLU 1165Cb 0.11 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1xew h GLU 1165CO -0.01 0.66 0.13 0.93 -0.73 0.00 0.00 179.01 179.99 1xew h GLU 1166N 1.02 0.82 -0.31 1.92 5.08 0.30 -2.34 114.58 121.07 1xew h GLU 1166Ca 0.44 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.56 1xew h GLU 1166Cb 0.33 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1xew h GLU 1166CO -0.19 0.78 0.02 0.82 -1.00 0.00 0.00 179.01 179.44 1xew h ILE 1167N 0.71 1.25 -0.52 3.13 2.04 0.29 -2.91 117.51 121.50 1xew h ILE 1167Ca 0.16 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.16 1xew h ILE 1167Cb 0.33 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1xew h ILE 1167CO 0.00 0.29 0.35 -0.09 0.00 0.00 0.00 178.15 178.70 1xew h ARG 1168N 0.34 0.60 -0.67 2.37 9.65 0.15 0.12 114.38 126.93 1xew h ARG 1168Ca 0.09 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.91 1xew h ARG 1168Cb 0.40 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.81 1xew h ARG 1168CO 0.01 0.40 0.34 -0.22 2.80 0.00 0.00 179.97 183.29 1xew h LYS 1169N 0.62 0.96 0.02 0.20 3.64 -1.23 1.14 116.57 121.93 1xew h LYS 1169Ca 0.21 -0.13 -0.21 0.00 -1.27 0.00 0.00 60.65 59.24 1xew h LYS 1169Cb 0.06 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1xew h LYS 1169CO -0.05 0.75 -0.96 0.87 -2.27 0.00 0.00 179.45 177.79 1xew h LYS 1170N 0.93 0.21 0.00 1.90 1.79 -1.23 -3.39 116.57 116.79 1xew h LYS 1170Ca 0.23 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1xew h LYS 1170Cb 0.10 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1xew h LYS 1170CO -0.03 1.02 -1.15 0.00 -1.08 0.00 0.00 179.45 178.20 1xew n GLN 1171N -3.62 1.28 0.00 3.15 10.64 0.36 -5.10 117.38 124.09 1xew n GLN 1171Ca -0.04 -0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.06 1xew n GLN 1171Cb 0.86 -1.14 0.00 0.00 -0.86 0.00 0.00 30.24 29.10 1xew n GLN 1171CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1xew n GLY 1172N 1.78 0.46 0.00 2.61 0.00 0.39 -5.03 105.19 105.40 1xew n GLY 1172Ca -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1xew n GLY 1172CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11