#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kta h GLU 1008N 0.00 0.95 -0.22 1.97 4.39 -2.06 -0.81 114.58 118.80 3kta h GLU 1008Ca 0.00 -0.08 -0.14 0.00 0.34 0.00 0.00 59.36 59.48 3kta h GLU 1008Cb 0.00 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 3kta h GLU 1008CO 0.00 0.67 -0.44 0.87 -1.16 0.00 0.00 179.01 178.95 3kta h LYS 1009N 0.96 0.54 -0.97 2.33 1.79 -2.05 -2.71 116.57 116.45 3kta h LYS 1009Ca 0.25 -0.29 0.01 0.00 -2.18 0.00 0.00 60.65 58.45 3kta h LYS 1009Cb -0.04 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.57 3kta h LYS 1009CO -0.05 0.87 0.64 -0.22 -1.08 0.00 0.00 179.45 179.62 3kta h LYS 1010N 0.44 1.27 -0.28 3.15 3.64 -1.86 -0.76 116.57 122.17 3kta h LYS 1010Ca 0.03 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 3kta h LYS 1010Cb 0.94 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 3kta h LYS 1010CO 0.08 0.84 -0.04 -0.91 -2.27 0.00 0.00 179.45 177.16 3kta h ASN 1011N 1.31 0.52 -0.59 4.20 2.35 -0.98 -2.97 115.58 119.41 3kta h ASN 1011Ca 0.36 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 3kta h ASN 1011Cb -0.14 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.06 3kta h ASN 1011CO -0.08 0.74 0.23 0.58 -1.65 0.00 0.00 177.43 177.25 3kta h VAL 1012N 0.29 1.23 0.00 2.81 2.07 -1.35 -2.54 116.25 118.76 3kta h VAL 1012Ca 0.07 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.88 3kta h VAL 1012Cb 0.50 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3kta h VAL 1012CO 0.02 0.28 0.00 0.33 0.02 0.00 0.00 177.57 178.22 3kta n PHE 1013N -4.46 0.00 0.00 1.57 7.35 -0.30 -2.09 117.46 119.52 3kta n PHE 1013Ca 0.03 -0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 3kta n PHE 1013Cb 0.17 -0.02 0.00 0.00 0.35 0.00 0.00 39.48 39.98 3kta n PHE 1013CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 3kta n ARG 1015N 0.58 0.00 -0.05 -4.13 0.63 -0.96 0.35 116.66 113.09 3kta n ARG 1015Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 3kta n ARG 1015Cb 0.00 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 32.84 3kta n ARG 1015CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 3kta h THR 1016N 0.00 1.32 -0.42 5.15 2.02 -1.70 -2.61 112.91 116.67 3kta h THR 1016Ca 0.00 -1.10 0.03 0.00 0.77 0.00 0.00 66.41 66.11 3kta h THR 1016Cb 0.00 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 3kta h THR 1016CO 0.00 0.32 0.22 0.15 0.37 0.00 0.00 175.52 176.57 3kta h PHE 1017N -0.09 0.40 -0.28 3.16 3.57 -0.37 -1.43 116.94 121.89 3kta h PHE 1017Ca 0.03 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 3kta h PHE 1017Cb 0.53 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 3kta h PHE 1017CO 0.07 0.21 -0.16 0.93 -2.23 0.00 0.00 178.31 177.13 3kta h GLU 1018N 0.43 0.49 0.09 1.11 4.39 -1.80 0.23 114.58 119.53 3kta h GLU 1018Ca 0.18 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 3kta h GLU 1018Cb 0.08 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3kta h GLU 1018CO -0.12 0.64 -0.04 0.00 -1.16 0.00 0.00 179.01 178.33 3kta h ALA 1019N 1.38 -0.13 -0.63 3.43 0.00 -1.17 -1.77 119.26 120.38 3kta h ALA 1019Ca 0.08 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3kta h ALA 1019Cb 0.54 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3kta h ALA 1019CO 0.03 -0.43 0.13 0.82 0.00 0.00 0.00 179.25 179.80 3kta h ILE 1020N -0.40 1.25 -0.29 0.00 2.04 -1.06 -1.28 117.51 117.76 3kta h ILE 1020Ca -0.01 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 64.90 3kta h ILE 1020Cb 0.33 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3kta h ILE 1020CO 0.02 0.36 0.19 -1.28 0.00 0.00 0.00 178.15 177.44 3kta h SER 1021N 0.95 0.34 -0.43 1.72 0.87 -0.52 0.16 113.55 116.63 3kta h SER 1021Ca 0.20 -0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 3kta h SER 1021Cb 0.37 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 3kta h SER 1021CO 0.00 0.25 -0.04 -0.09 -0.53 0.00 0.00 176.83 176.43 3kta h ARG 1022N 0.39 0.78 -0.50 2.24 2.43 -1.17 -1.95 114.38 116.61 3kta h ARG 1022Ca 0.11 -0.27 0.07 0.00 -0.81 0.00 0.00 59.98 59.08 3kta h ARG 1022Cb -0.04 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 3kta h ARG 1022CO -0.02 0.87 0.18 -0.91 -1.51 0.00 0.00 179.97 178.58 3kta h ASN 1023N 0.62 0.19 -0.33 -3.80 2.35 -0.97 -1.60 115.58 112.03 3kta h ASN 1023Ca 0.12 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 3kta h ASN 1023Cb 0.54 0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.94 3kta h ASN 1023CO 0.03 0.14 0.16 0.15 -1.65 0.00 0.00 177.43 176.25 3kta h PHE 1024N 0.36 0.47 -0.47 1.19 3.57 -0.37 0.48 116.94 122.17 3kta h PHE 1024Ca 0.24 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3kta h PHE 1024Cb 0.25 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3kta h PHE 1024CO -0.16 0.41 0.30 0.77 -2.23 0.00 0.00 178.31 177.41 3kta h SER 1025N 0.39 0.55 -0.33 0.41 0.02 -1.13 0.86 113.55 114.33 3kta h SER 1025Ca 0.11 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 3kta h SER 1025Cb 0.12 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 3kta h SER 1025CO -0.01 0.41 0.08 -0.33 -1.14 0.00 0.00 176.83 175.83 3kta h GLU 1026N 0.63 0.53 -0.47 3.45 5.08 -1.04 -2.29 114.58 120.47 3kta h GLU 1026Ca 0.17 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 3kta h GLU 1026Cb -0.05 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 3kta h GLU 1026CO -0.04 0.59 -0.09 0.82 -1.00 0.00 0.00 179.01 179.29 3kta h ILE 1027N 0.37 1.27 -0.64 3.13 2.04 -0.76 -1.83 117.51 121.10 3kta h ILE 1027Ca 0.10 -1.21 0.04 0.00 1.00 0.00 0.00 64.86 64.79 3kta h ILE 1027Cb 0.30 1.09 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 3kta h ILE 1027CO 0.00 0.42 0.38 0.15 0.00 0.00 0.00 178.15 179.10 3kta h PHE 1028N 0.74 0.71 -0.32 1.37 3.57 -0.76 -0.48 116.94 121.78 3kta h PHE 1028Ca 0.12 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 3kta h PHE 1028Cb 0.64 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3kta h PHE 1028CO 0.05 0.38 -0.08 0.00 -2.23 0.00 0.00 178.31 176.43 3kta h ALA 1029N 1.30 1.28 -0.16 2.41 0.00 -1.20 0.06 119.26 122.94 3kta h ALA 1029Ca 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3kta h ALA 1029Cb 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3kta h ALA 1029CO -0.13 0.48 -0.02 -0.22 0.00 0.00 0.00 179.25 179.36 3kta h LYS 1030N 0.49 0.29 -0.09 0.00 3.64 -0.71 -3.03 116.57 117.16 3kta h LYS 1030Ca 0.10 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 3kta h LYS 1030Cb 0.44 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3kta h LYS 1030CO 0.02 0.55 -0.52 -0.07 -2.27 0.00 0.00 179.45 177.16 3kta h LEU 1031N 0.02 0.27 -7.05 5.20 3.38 -0.83 -3.35 115.31 112.95 3kta h LEU 1031Ca 0.04 -0.14 -0.62 0.00 0.09 0.00 0.00 57.88 57.26 3kta h LEU 1031Cb 0.43 -0.08 -0.41 0.00 0.09 0.00 0.00 40.66 40.69 3kta h LEU 1031CO 0.01 0.74 -0.62 -0.44 0.09 0.00 0.00 178.44 178.23 3kta s SER 1032N -6.89 4.42 0.20 -0.43 0.01 -0.02 -4.90 113.70 106.10 3kta s SER 1032Ca -0.04 -3.65 -0.32 0.00 1.31 0.00 0.00 55.95 53.24 3kta s SER 1032Cb 0.13 -1.51 -0.14 0.00 0.21 0.00 0.00 66.02 64.70 3kta s SER 1032CO 0.79 -0.11 1.33 -2.65 0.41 0.00 0.00 173.24 173.00 3kta n PRO 1033N 2.23 1.67 -0.13 12.44 -0.02 -1.15 -0.60 135.00 149.43 3kta n PRO 1033Ca 0.19 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 3kta n PRO 1033Cb 0.36 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 3kta n PRO 1033CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kta n GLY 1034N 2.25 1.76 3.89 -1.23 0.00 -1.26 -5.00 105.19 105.60 3kta n GLY 1034Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 3kta n GLY 1034CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kta s GLY 1035N -1.93 2.15 0.10 -0.02 0.00 0.23 -2.58 107.32 105.26 3kta s GLY 1035Ca 0.00 -1.81 -0.14 0.00 0.00 0.00 0.00 44.72 42.77 3kta s GLY 1035CO 0.00 -1.73 0.32 -1.35 0.00 0.00 0.00 173.10 170.34 3kta s SER 1036N -4.19 -0.11 0.12 1.64 1.04 -0.25 -4.37 113.70 107.58 3kta s SER 1036Ca 0.47 -0.39 -0.19 0.00 0.48 0.00 0.00 55.95 56.32 3kta s SER 1036Cb -0.03 0.41 0.05 0.00 0.10 0.00 0.00 66.02 66.55 3kta s SER 1036CO 0.28 -0.77 0.47 0.00 0.98 0.00 0.00 173.24 174.19 3kta s ALA 1037N -3.59 -1.17 0.04 5.32 0.00 -1.26 -0.01 121.76 121.10 3kta s ALA 1037Ca 0.02 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.20 3kta s ALA 1037Cb 0.02 0.69 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 3kta s ALA 1037CO -0.10 -0.65 -0.07 1.03 0.00 0.00 0.00 175.76 175.97 3kta s ARG 1038N -3.56 0.52 -0.06 0.00 0.52 0.20 -4.23 118.95 112.34 3kta s ARG 1038Ca 0.01 -0.78 -0.12 0.00 -0.52 0.00 0.00 55.73 54.32 3kta s ARG 1038Cb 0.01 -0.22 -0.05 0.00 0.52 0.00 0.00 34.95 35.21 3kta s ARG 1038CO -0.11 0.03 0.31 -0.51 0.02 0.00 0.00 175.30 175.04 3kta s LEU 1039N -1.68 4.41 -0.07 2.53 1.43 -1.26 -1.26 118.68 122.78 3kta s LEU 1039Ca -0.09 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3kta s LEU 1039Cb -0.09 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.77 3kta s LEU 1039CO -0.00 0.31 -0.06 -0.63 0.23 0.00 0.00 176.35 176.20 3kta s ILE 1040N -0.81 0.76 -0.02 -0.59 1.01 -0.29 -4.98 121.20 116.29 3kta s ILE 1040Ca 0.20 -0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.34 3kta s ILE 1040Cb -0.15 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 3kta s ILE 1040CO 0.09 0.29 1.10 -0.76 0.00 0.00 0.00 174.94 175.66 3kta s LEU 1041N 1.18 4.32 0.47 2.97 1.43 -1.26 -0.15 118.68 127.64 3kta s LEU 1041Ca -0.06 1.77 0.14 0.00 -1.03 0.00 0.00 54.13 54.95 3kta s LEU 1041Cb -0.14 -3.57 1.09 0.00 0.03 0.00 0.00 46.19 43.60 3kta s LEU 1041CO -0.02 -0.43 2.07 -0.33 0.23 0.00 0.00 176.35 177.87 3kta h GLU 1042N 7.03 0.10 -2.66 1.70 5.08 -1.42 -3.32 114.58 121.08 3kta h GLU 1042Ca -0.38 -0.01 -0.60 0.00 -1.00 0.00 0.00 59.36 57.38 3kta h GLU 1042Cb 1.19 -0.02 -0.39 0.00 0.50 0.00 0.00 28.75 30.03 3kta h GLU 1042CO 0.82 0.14 -0.84 1.21 -1.00 0.00 0.00 179.01 179.34 3kta s ASN 1043N -6.98 2.80 0.47 1.42 3.84 -1.26 -4.94 114.94 110.29 3kta s ASN 1043Ca -0.05 -2.79 0.14 0.00 0.21 0.00 0.00 52.86 50.36 3kta s ASN 1043Cb 0.17 -0.71 1.11 0.00 -0.55 0.00 0.00 41.25 41.27 3kta s ASN 1043CO 0.69 -0.23 2.09 -0.65 -2.79 0.00 0.00 177.10 176.21 3kta h PRO 1044N 6.28 0.23 -0.16 0.43 0.11 -1.95 -1.05 132.00 135.89 3kta h PRO 1044Ca 0.12 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 3kta h PRO 1044Cb 0.91 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 3kta h PRO 1044CO 0.41 0.15 -0.06 0.93 -0.21 0.00 0.00 178.00 179.22 3kta h GLU 1045N 0.24 0.33 -2.82 1.05 5.08 -1.95 -3.38 114.58 113.13 3kta h GLU 1045Ca 0.11 -0.13 -0.60 0.00 -1.00 0.00 0.00 59.36 57.73 3kta h GLU 1045Cb 0.14 -0.01 -0.40 0.00 0.50 0.00 0.00 28.75 28.97 3kta h GLU 1045CO -0.02 0.62 -0.78 0.34 -1.00 0.00 0.00 179.01 178.17 3kta s ASP 1046N -5.95 3.30 0.42 1.42 2.15 -1.09 -4.99 116.67 111.93 3kta s ASP 1046Ca -0.14 -2.61 0.08 0.00 0.43 0.00 0.00 52.55 50.31 3kta s ASP 1046Cb 0.06 -0.83 0.89 0.00 -0.30 0.00 0.00 42.92 42.74 3kta s ASP 1046CO 0.74 -0.26 2.06 -0.65 -0.17 0.00 0.00 175.17 176.88 3kta h PRO 1047N 6.64 0.51 0.00 4.34 0.11 -1.39 0.65 132.00 142.86 3kta h PRO 1047Ca 0.04 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.12 3kta h PRO 1047Cb 0.93 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3kta h PRO 1047CO 0.42 0.34 0.00 1.19 -0.21 0.00 0.00 178.00 179.74 3kta n PHE 1048N -4.48 0.00 0.29 0.65 3.72 -1.26 -1.28 117.46 115.11 3kta n PHE 1048Ca 0.04 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.55 3kta n PHE 1048Cb 0.09 -0.30 0.23 0.00 -0.94 0.00 0.00 39.48 38.55 3kta n PHE 1048CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3kta n SER 1049N -1.30 3.47 -3.06 4.37 7.64 0.22 -5.01 113.62 119.94 3kta n SER 1049Ca 0.05 -1.99 -0.12 0.00 1.01 0.00 0.00 58.87 57.81 3kta n SER 1049Cb 0.09 -0.26 -0.01 0.00 -1.01 0.00 0.00 64.21 63.02 3kta n SER 1049CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3kta s GLY 1050N -1.46 1.06 0.08 0.23 0.00 -0.40 -4.92 107.32 101.91 3kta s GLY 1050Ca 0.39 -1.22 0.01 0.00 0.00 0.00 0.00 44.72 43.90 3kta s GLY 1050CO 0.32 -0.72 0.11 0.61 0.00 0.00 0.00 173.10 173.42 3kta n GLY 1051N -0.56 1.30 2.96 0.20 0.00 -1.26 -4.83 105.19 102.99 3kta n GLY 1051Ca -0.03 -2.05 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 3kta n GLY 1051CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kta s LEU 1052N 0.00 1.82 0.20 0.99 0.20 -1.26 -1.06 118.68 119.58 3kta s LEU 1052Ca 0.08 -0.66 0.04 0.00 0.69 0.00 0.00 54.13 54.27 3kta s LEU 1052Cb -0.01 -1.08 -0.03 0.00 -0.43 0.00 0.00 46.19 44.64 3kta s LEU 1052CO 0.05 -0.13 0.32 -1.61 -0.29 0.00 0.00 176.35 174.69 3kta s GLU 1053N 1.52 3.41 -0.12 1.98 0.41 0.79 -4.91 118.70 121.77 3kta s GLU 1053Ca 0.01 -0.71 -0.00 0.00 -0.41 0.00 0.00 54.97 53.86 3kta s GLU 1053Cb -0.15 -2.90 -0.02 0.00 -1.78 0.00 0.00 34.13 29.28 3kta s GLU 1053CO -0.09 0.46 -0.12 0.42 -0.49 0.00 0.00 175.26 175.44 3kta s ILE 1054N -1.89 3.12 -0.18 -1.63 1.01 -1.26 -1.14 121.20 119.23 3kta s ILE 1054Ca 0.34 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.36 3kta s ILE 1054Cb -0.10 -2.31 0.03 0.00 0.01 0.00 0.00 42.46 40.10 3kta s ILE 1054CO 0.29 0.53 -0.13 -0.70 0.00 0.00 0.00 174.94 174.92 3kta s GLU 1055N 0.24 2.29 0.03 2.79 2.12 -0.39 -4.93 118.70 120.85 3kta s GLU 1055Ca -0.08 -0.75 0.08 0.00 0.36 0.00 0.00 54.97 54.58 3kta s GLU 1055Cb -0.15 -2.34 -0.03 0.00 0.26 0.00 0.00 34.13 31.87 3kta s GLU 1055CO 0.05 -0.33 -0.25 0.00 -0.54 0.00 0.00 175.26 174.20 3kta s ALA 1056N 1.40 2.08 -0.55 6.30 0.00 -1.26 -0.63 121.76 129.10 3kta s ALA 1056Ca 0.02 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.85 3kta s ALA 1056Cb -0.15 -0.45 0.14 0.00 0.00 0.00 0.00 23.12 22.67 3kta s ALA 1056CO -0.10 0.49 0.33 0.15 0.00 0.00 0.00 175.76 176.63 3kta s LYS 1057N -1.09 1.94 0.44 0.00 1.02 0.99 -0.82 119.74 122.21 3kta s LYS 1057Ca 0.10 -2.69 0.18 0.00 0.02 0.00 0.00 55.97 53.58 3kta s LYS 1057Cb -0.10 -3.07 1.11 0.00 -0.52 0.00 0.00 37.83 35.26 3kta s LYS 1057CO 0.01 -1.18 1.90 -1.35 -0.92 0.00 0.00 175.35 173.81 3kta h PRO 1058N 6.18 0.35 -0.35 -1.68 0.11 -1.78 -0.24 132.00 134.58 3kta h PRO 1058Ca 0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3kta h PRO 1058Cb 0.86 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.89 3kta h PRO 1058CO 0.64 0.23 0.00 0.00 -0.21 0.00 0.00 178.00 178.66 3kta n ALA 1059N -2.54 2.35 0.00 -0.75 0.00 -1.26 -3.75 120.51 114.56 3kta n ALA 1059Ca 0.16 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.60 3kta n ALA 1059Cb 0.63 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.42 3kta n ALA 1059CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kta n GLY 1060N 1.07 3.02 3.06 0.00 0.00 -0.33 -4.62 105.19 107.39 3kta n GLY 1060Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 3kta n GLY 1060CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kta s LYS 1061N -0.07 1.03 0.00 1.61 -2.85 -1.26 -4.77 119.74 113.43 3kta s LYS 1061Ca 0.00 -0.41 0.00 0.00 -1.00 0.00 0.00 55.97 54.56 3kta s LYS 1061Cb 0.00 -0.98 0.00 0.00 -2.06 0.00 0.00 37.83 34.79 3kta s LYS 1061CO 0.00 0.22 0.00 -0.25 0.10 0.00 0.00 175.35 175.42 3kta n ASP 1062N 2.93 -1.62 -4.77 0.03 8.00 -1.26 -4.91 116.55 114.95 3kta n ASP 1062Ca -0.15 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.95 3kta n ASP 1062Cb 0.55 -0.81 -0.02 0.00 -0.02 0.00 0.00 41.12 40.82 3kta n ASP 1062CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3kta s VAL 1063N 0.00 3.00 -0.27 2.53 1.01 -1.26 -4.46 120.40 120.95 3kta s VAL 1063Ca 0.00 0.92 -0.03 0.00 0.00 0.00 0.00 61.98 62.87 3kta s VAL 1063Cb 0.00 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.85 3kta s VAL 1063CO 0.00 0.16 -0.03 -0.75 0.00 0.00 0.00 175.10 174.48 3kta s LYS 1064N -2.01 2.81 0.54 2.72 2.20 -0.00 -4.97 119.74 121.04 3kta s LYS 1064Ca 0.53 -1.00 -0.21 0.00 -0.36 0.00 0.00 55.97 54.92 3kta s LYS 1064Cb -0.35 -3.09 -0.06 0.00 -1.51 0.00 0.00 37.83 32.83 3kta s LYS 1064CO 0.45 -0.44 1.22 0.54 -0.36 0.00 0.00 175.35 176.75 3kta n ARG 1065N 4.70 1.46 -0.24 4.03 1.74 -1.26 -4.52 116.66 122.56 3kta n ARG 1065Ca -0.16 0.54 0.02 0.00 -0.77 0.00 0.00 57.85 57.49 3kta n ARG 1065Cb 0.47 -2.41 0.15 0.00 -1.02 0.00 0.00 32.46 29.64 3kta n ARG 1065CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3kta h ILE 1066N 1.22 0.77 0.00 0.55 1.08 -1.96 -0.76 117.51 118.41 3kta h ILE 1066Ca -0.49 -0.18 -0.00 0.00 -0.39 0.00 0.00 64.86 63.80 3kta h ILE 1066Cb 1.32 0.21 -0.00 0.00 -3.07 0.00 0.00 36.82 35.29 3kta h ILE 1066CO 0.56 0.09 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.77 3kta h GLU 1067N 0.51 0.00 -3.41 2.37 3.07 -2.03 -3.45 114.58 111.64 3kta h GLU 1067Ca 0.36 0.00 -0.78 0.00 -0.50 0.00 0.00 59.36 58.44 3kta h GLU 1067Cb 0.45 0.00 -0.23 0.00 -0.84 0.00 0.00 28.75 28.13 3kta h GLU 1067CO -0.32 0.01 1.21 0.00 -1.40 0.00 0.00 179.01 178.51 3kta n ALA 1068N -2.30 4.96 -2.50 3.43 0.00 -0.29 -5.15 120.51 118.65 3kta n ALA 1068Ca -0.03 -4.56 -0.25 0.00 0.00 0.00 0.00 53.44 48.60 3kta n ALA 1068Cb 0.09 -2.65 -0.08 0.00 0.00 0.00 0.00 19.45 16.80 3kta n ALA 1068CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3kta s SER 1070N 0.04 4.27 0.21 0.00 1.04 -1.26 -4.96 113.70 113.04 3kta s SER 1070Ca 0.35 -1.08 -0.09 0.00 0.48 0.00 0.00 55.95 55.62 3kta s SER 1070Cb 0.03 -0.50 0.23 0.00 0.10 0.00 0.00 66.02 65.88 3kta s SER 1070CO 0.04 -0.41 1.84 1.23 0.98 0.00 0.00 173.24 176.91 3kta h GLY 1071N 1.62 1.05 0.96 7.32 0.00 -1.99 -0.65 103.07 111.37 3kta h GLY 1071Ca -0.43 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.56 3kta h GLY 1071CO 0.70 0.24 0.18 -1.33 0.00 0.00 0.00 176.54 176.33 3kta h GLY 1072N 0.82 0.73 1.00 4.60 0.00 -1.87 -1.54 103.07 106.81 3kta h GLY 1072Ca 0.30 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3kta h GLY 1072CO -0.14 0.37 0.36 0.83 0.00 0.00 0.00 176.54 177.96 3kta h GLU 1073N 0.59 0.85 -0.70 4.80 5.08 -1.78 -1.03 114.58 122.39 3kta h GLU 1073Ca 0.15 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3kta h GLU 1073Cb 0.19 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3kta h GLU 1073CO -0.01 0.62 0.46 0.87 -1.00 0.00 0.00 179.01 179.94 3kta h LYS 1074N 0.84 0.92 -0.33 2.33 1.57 -0.94 -1.45 116.57 119.52 3kta h LYS 1074Ca 0.22 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3kta h LYS 1074Cb -0.00 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 3kta h LYS 1074CO -0.04 0.62 0.08 0.00 -0.57 0.00 0.00 179.45 179.54 3kta h ALA 1075N 1.25 0.43 -0.63 3.86 0.00 -0.94 -0.84 119.26 122.39 3kta h ALA 1075Ca 0.25 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3kta h ALA 1075Cb -0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3kta h ALA 1075CO -0.05 0.10 0.16 -0.07 0.00 0.00 0.00 179.25 179.38 3kta h LEU 1076N 0.37 0.92 -0.28 0.00 3.38 -1.05 0.12 115.31 118.77 3kta h LEU 1076Ca 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3kta h LEU 1076Cb 0.30 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3kta h LEU 1076CO 0.00 0.89 0.06 0.74 0.09 0.00 0.00 178.44 180.22 3kta h THR 1077N 0.94 1.22 -0.67 0.22 2.02 -1.04 -0.94 112.91 114.66 3kta h THR 1077Ca 0.20 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.63 3kta h THR 1077Cb 0.33 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 3kta h THR 1077CO -0.00 0.24 0.35 0.00 0.37 0.00 0.00 175.52 176.48 3kta h ALA 1078N 0.89 0.86 -0.65 6.16 0.00 -0.89 -2.38 119.26 123.25 3kta h ALA 1078Ca 0.09 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3kta h ALA 1078Cb 0.30 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3kta h ALA 1078CO 0.00 0.39 0.10 -0.07 0.00 0.00 0.00 179.25 179.67 3kta h LEU 1079N 0.92 1.03 -1.32 0.00 3.38 -0.60 -1.45 115.31 117.27 3kta h LEU 1079Ca 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3kta h LEU 1079Cb 0.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3kta h LEU 1079CO -0.03 1.03 0.35 0.00 0.09 0.00 0.00 178.44 179.88 3kta h ALA 1080N 1.04 1.49 -0.15 1.53 0.00 -0.97 -0.61 119.26 121.59 3kta h ALA 1080Ca 0.20 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3kta h ALA 1080Cb 0.44 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3kta h ALA 1080CO 0.01 0.44 -0.07 0.35 0.00 0.00 0.00 179.25 179.98 3kta h PHE 1081N 0.83 0.35 -0.31 0.00 3.57 -0.94 -0.96 116.94 119.48 3kta h PHE 1081Ca 0.22 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.65 3kta h PHE 1081Cb -0.02 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 3kta h PHE 1081CO 0.00 0.63 0.16 0.28 -2.23 0.00 0.00 178.31 177.15 3kta h VAL 1082N -0.02 1.00 0.00 1.41 2.07 -0.94 -2.30 116.25 117.47 3kta h VAL 1082Ca 0.03 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 3kta h VAL 1082Cb 0.53 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3kta h VAL 1082CO 0.02 0.06 -0.30 -0.26 0.02 0.00 0.00 177.57 177.12 3kta h PHE 1083N 0.33 0.00 -0.55 1.57 0.04 -1.12 -0.89 116.94 116.33 3kta h PHE 1083Ca 0.13 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.82 3kta h PHE 1083Cb 0.03 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 3kta h PHE 1083CO -0.09 0.30 0.06 0.00 -0.60 0.00 0.00 178.31 177.97 3kta h ALA 1084N 1.70 0.73 -0.20 2.45 0.00 -0.69 -1.02 119.26 122.24 3kta h ALA 1084Ca -0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3kta h ALA 1084Cb 0.73 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3kta h ALA 1084CO 0.04 0.51 0.01 0.82 0.00 0.00 0.00 179.25 180.63 3kta h ILE 1085N 0.82 1.25 -0.99 0.00 2.04 -1.14 -3.08 117.51 116.41 3kta h ILE 1085Ca 0.16 -0.83 0.06 0.00 1.00 0.00 0.00 64.86 65.25 3kta h ILE 1085Cb 0.46 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.88 3kta h ILE 1085CO 0.02 0.25 0.64 -0.61 0.00 0.00 0.00 178.15 178.45 3kta h GLN 1086N 0.12 1.14 -0.65 2.37 -0.00 -0.92 0.70 115.11 117.87 3kta h GLN 1086Ca 0.06 -0.07 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 3kta h GLN 1086Cb 0.37 -0.26 -0.03 0.00 0.00 0.00 0.00 27.48 27.57 3kta h GLN 1086CO 0.01 0.75 0.18 -0.22 0.00 0.00 0.00 178.83 179.55 3kta h LYS 1087N 1.17 1.01 -0.06 1.69 3.64 -1.20 -2.04 116.57 120.79 3kta h LYS 1087Ca 0.42 -0.22 -0.18 0.00 -1.27 0.00 0.00 60.65 59.41 3kta h LYS 1087Cb 0.13 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3kta h LYS 1087CO -0.16 0.88 -0.66 0.35 -2.27 0.00 0.00 179.45 177.59 3kta h PHE 1088N 0.97 0.78 -2.43 1.91 3.57 -1.20 -3.42 116.94 117.12 3kta h PHE 1088Ca 0.21 -0.38 -0.51 0.00 3.53 0.00 0.00 57.97 60.82 3kta h PHE 1088Cb 0.31 -0.11 -0.37 0.00 2.79 0.00 0.00 35.95 38.58 3kta h PHE 1088CO 0.02 1.19 -0.79 0.21 -2.23 0.00 0.00 178.31 176.71 3kta s LYS 1089N -3.48 0.51 0.08 1.11 2.20 0.14 -5.12 119.74 115.19 3kta s LYS 1089Ca -0.12 -1.06 -0.31 0.00 -0.36 0.00 0.00 55.97 54.12 3kta s LYS 1089Cb 0.05 -1.11 -0.09 0.00 -1.51 0.00 0.00 37.83 35.18 3kta s LYS 1089CO 0.85 -1.18 1.68 -2.14 -0.36 0.00 0.00 175.35 174.21 3kta s PRO 1090N 1.34 4.19 0.66 4.03 0.02 -0.77 -4.44 135.00 140.03 3kta s PRO 1090Ca 0.16 2.38 -0.12 0.00 0.02 0.00 0.00 61.00 63.44 3kta s PRO 1090Cb -0.20 -3.59 -0.01 0.00 0.02 0.00 0.00 34.50 30.72 3kta s PRO 1090CO -0.06 -0.75 1.05 0.00 -0.33 0.00 0.00 177.00 176.91 3kta s ALA 1091N 2.63 2.75 0.18 -1.55 0.00 -1.26 -4.97 121.76 119.54 3kta s ALA 1091Ca 0.75 0.12 -0.13 0.00 0.00 0.00 0.00 51.96 52.70 3kta s ALA 1091Cb -0.41 -3.17 0.15 0.00 0.00 0.00 0.00 23.12 19.68 3kta s ALA 1091CO 0.33 -1.07 1.76 -1.35 0.00 0.00 0.00 175.76 175.43 3kta h PRO 1092N -0.43 0.37 -3.54 0.00 0.11 -1.93 -3.41 132.00 123.17 3kta h PRO 1092Ca -0.44 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 3kta h PRO 1092Cb 1.21 -0.08 -0.15 0.00 0.11 0.00 0.00 31.00 32.09 3kta h PRO 1092CO 0.58 0.24 -0.26 -0.59 -0.21 0.00 0.00 178.00 177.75 3kta s PHE 1093N -6.13 -0.02 -0.01 0.65 -0.71 -1.26 -1.91 117.98 108.58 3kta s PHE 1093Ca -0.13 -0.28 0.07 0.00 -1.04 0.00 0.00 56.93 55.55 3kta s PHE 1093Cb 0.14 0.07 -0.02 0.00 -1.21 0.00 0.00 43.02 42.00 3kta s PHE 1093CO 0.73 -0.56 -0.22 0.71 -1.34 0.00 0.00 175.22 174.54 3kta s TYR 1094N -3.35 1.94 -0.19 3.49 1.51 0.46 -4.93 117.35 116.28 3kta s TYR 1094Ca 0.01 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 3kta s TYR 1094Cb 0.02 -1.24 0.03 0.00 -0.11 0.00 0.00 41.96 40.66 3kta s TYR 1094CO -0.08 -0.02 -0.16 -1.17 -1.11 0.00 0.00 175.55 173.00 3kta s LEU 1095N -0.56 2.29 -0.17 -1.29 2.96 -1.26 -0.85 118.68 119.81 3kta s LEU 1095Ca 0.08 -0.78 0.01 0.00 -0.22 0.00 0.00 54.13 53.22 3kta s LEU 1095Cb -0.08 -1.41 0.02 0.00 0.50 0.00 0.00 46.19 45.22 3kta s LEU 1095CO -0.01 -0.06 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.42 3kta s PHE 1096N 1.31 2.61 -0.42 5.38 0.08 -0.10 -5.00 117.98 121.85 3kta s PHE 1096Ca 0.02 -1.51 -0.07 0.00 0.12 0.00 0.00 56.93 55.49 3kta s PHE 1096Cb -0.15 -1.83 0.09 0.00 -0.57 0.00 0.00 43.02 40.57 3kta s PHE 1096CO -0.11 -0.76 0.24 0.34 -0.10 0.00 0.00 175.22 174.84 3kta s ASP 1097N 1.29 5.49 -1.34 1.36 -1.08 -1.26 -0.70 116.67 120.43 3kta s ASP 1097Ca 0.04 -1.70 -0.01 0.00 -0.52 0.00 0.00 52.55 50.36 3kta s ASP 1097Cb -0.13 -1.93 -0.00 0.00 -1.46 0.00 0.00 42.92 39.40 3kta s ASP 1097CO -0.11 -0.55 0.59 -0.62 0.52 0.00 0.00 175.17 174.99 3kta n GLU 1098N 4.81 -4.10 0.00 4.34 1.02 0.12 -4.86 120.64 121.97 3kta n GLU 1098Ca -0.08 0.53 0.12 0.00 -0.02 0.00 0.00 57.16 57.71 3kta n GLU 1098Cb 0.42 -4.88 0.56 0.00 -0.02 0.00 0.00 31.44 27.52 3kta n GLU 1098CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3kta n ILE 1099N -4.31 0.23 1.11 -3.67 -5.35 -1.26 -3.01 119.36 103.10 3kta n ILE 1099Ca -0.30 0.06 0.11 0.00 -0.27 0.00 0.00 62.75 62.35 3kta n ILE 1099Cb 0.68 -0.62 0.36 0.00 -1.74 0.00 0.00 39.64 38.31 3kta n ILE 1099CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3kta n ASP 1100N -1.46 2.02 -4.70 7.28 5.68 -1.26 -4.93 116.55 119.17 3kta n ASP 1100Ca 0.07 -1.74 -0.42 0.00 -0.50 0.00 0.00 54.79 52.20 3kta n ASP 1100Cb 0.28 -0.10 -0.00 0.00 -1.14 0.00 0.00 41.12 40.16 3kta n ASP 1100CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3kta n ALA 1101N 0.55 1.30 -0.96 2.12 0.00 -1.17 -2.32 120.51 120.05 3kta n ALA 1101Ca 0.17 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.95 3kta n ALA 1101Cb 0.40 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3kta n ALA 1101CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3kta n HIS 1102N 0.22 0.00 -4.65 0.00 8.25 -1.26 -4.80 115.22 112.98 3kta n HIS 1102Ca 0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.17 3kta n HIS 1102Cb 0.37 -0.54 -0.11 0.00 1.12 0.00 0.00 29.99 30.82 3kta n HIS 1102CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3kta s LEU 1103N 0.00 3.11 0.90 2.41 1.43 -0.98 -3.81 118.68 121.74 3kta s LEU 1103Ca 0.00 -0.06 -0.13 0.00 -1.03 0.00 0.00 54.13 52.91 3kta s LEU 1103Cb 0.00 -1.68 0.13 0.00 0.03 0.00 0.00 46.19 44.67 3kta s LEU 1103CO 0.00 0.35 1.18 1.51 0.23 0.00 0.00 176.35 179.63 3kta s ASP 1104N -0.86 3.69 0.31 2.29 1.47 -1.26 -4.75 116.67 117.57 3kta s ASP 1104Ca 0.13 0.76 0.01 0.00 1.18 0.00 0.00 52.55 54.63 3kta s ASP 1104Cb -0.11 -1.20 0.56 0.00 -0.34 0.00 0.00 42.92 41.83 3kta s ASP 1104CO 0.02 -2.42 1.93 0.44 0.68 0.00 0.00 175.17 175.83 3kta h ASP 1105N -1.41 0.86 -0.49 2.11 5.19 -1.99 -1.03 116.42 119.68 3kta h ASP 1105Ca -0.47 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 3kta h ASP 1105Cb 1.31 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 40.61 3kta h ASP 1105CO 0.58 0.57 0.32 0.00 -3.12 0.00 0.00 179.24 177.59 3kta h ALA 1106N 1.53 0.61 -0.20 3.45 0.00 -2.00 -0.63 119.26 122.02 3kta h ALA 1106Ca 0.35 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 55.05 3kta h ALA 1106Cb 0.14 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.74 3kta h ALA 1106CO -0.12 0.06 -0.60 -0.91 0.00 0.00 0.00 179.25 177.69 3kta h ASN 1107N 0.66 0.87 -0.80 0.00 2.35 -1.81 -2.96 115.58 113.89 3kta h ASN 1107Ca 0.18 -0.58 0.04 0.00 -0.55 0.00 0.00 56.30 55.38 3kta h ASN 1107Cb -0.08 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 37.99 3kta h ASN 1107CO -0.04 1.30 0.51 0.58 -1.65 0.00 0.00 177.43 178.13 3kta h VAL 1108N 0.49 1.10 -0.90 2.81 2.07 -1.02 -1.43 116.25 119.37 3kta h VAL 1108Ca -0.02 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.21 3kta h VAL 1108Cb 1.22 0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 3kta h VAL 1108CO 0.13 0.18 0.58 0.50 0.02 0.00 0.00 177.57 178.98 3kta h LYS 1109N 0.97 1.09 -0.46 1.57 1.63 -1.09 0.13 116.57 120.42 3kta h LYS 1109Ca 0.33 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 59.96 3kta h LYS 1109Cb 0.05 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.42 3kta h LYS 1109CO -0.13 0.72 -0.12 0.00 -3.45 0.00 0.00 179.45 176.47 3kta h ARG 1110N 1.12 0.84 -0.39 1.90 3.08 -1.26 0.47 114.38 120.14 3kta h ARG 1110Ca 0.36 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3kta h ARG 1110Cb 0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3kta h ARG 1110CO -0.12 0.92 0.11 0.28 -1.07 0.00 0.00 179.97 180.08 3kta h VAL 1111N 0.75 1.22 -0.91 2.04 2.07 -0.58 -2.01 116.25 118.83 3kta h VAL 1111Ca 0.12 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 3kta h VAL 1111Cb 0.63 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 3kta h VAL 1111CO 0.04 0.26 0.55 0.00 0.02 0.00 0.00 177.57 178.44 3kta h ALA 1112N 0.95 1.27 -0.66 1.67 0.00 -0.39 0.26 119.26 122.37 3kta h ALA 1112Ca 0.12 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3kta h ALA 1112Cb 0.28 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3kta h ALA 1112CO -0.00 0.63 0.20 -0.44 0.00 0.00 0.00 179.25 179.64 3kta h ASP 1113N 1.25 0.95 -0.41 0.00 3.32 -0.76 -0.43 116.42 120.33 3kta h ASP 1113Ca 0.33 -0.17 -0.13 0.00 0.02 0.00 0.00 57.03 57.07 3kta h ASP 1113Cb -0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.23 3kta h ASP 1113CO -0.06 0.90 -0.24 0.25 -1.72 0.00 0.00 179.24 178.36 3kta h LEU 1114N 0.98 0.96 -0.28 1.55 5.85 -0.62 -1.85 115.31 121.91 3kta h LEU 1114Ca 0.22 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3kta h LEU 1114Cb 0.29 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3kta h LEU 1114CO -0.01 1.15 0.18 0.40 -0.34 0.00 0.00 178.44 179.82 3kta h ILE 1115N 0.80 1.08 -0.32 4.05 2.04 -0.68 -0.41 117.51 124.07 3kta h ILE 1115Ca 0.10 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 65.83 3kta h ILE 1115Cb 0.81 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 3kta h ILE 1115CO 0.07 0.08 0.10 0.50 0.00 0.00 0.00 178.15 178.90 3kta h LYS 1116N 0.37 0.22 -0.44 2.37 1.63 -0.90 0.11 116.57 119.93 3kta h LYS 1116Ca 0.10 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.87 3kta h LYS 1116Cb -0.03 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.53 3kta h LYS 1116CO -0.02 0.15 0.19 1.49 -3.45 0.00 0.00 179.45 177.81 3kta h GLU 1117N 0.23 0.65 0.00 1.90 4.57 -1.26 -2.77 114.58 117.90 3kta h GLU 1117Ca 0.14 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 3kta h GLU 1117Cb 0.13 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.60 3kta h GLU 1117CO -0.16 0.58 -0.17 0.77 -1.18 0.00 0.00 179.01 178.85 3kta h SER 1118N 0.57 0.00 0.34 1.04 0.02 -0.56 -2.75 113.55 112.22 3kta h SER 1118Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3kta h SER 1118Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3kta h SER 1118CO -0.02 0.17 0.00 -1.54 -1.14 0.00 0.00 176.83 174.30 3kta n SER 1119N -3.51 0.00 0.26 3.07 3.41 0.34 -1.37 113.62 115.81 3kta n SER 1119Ca -0.01 0.21 0.13 0.00 -0.26 0.00 0.00 58.87 58.94 3kta n SER 1119Cb 0.32 -0.35 0.67 0.00 -0.26 0.00 0.00 64.21 64.59 3kta n SER 1119CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3kta h LYS 1120N 0.00 0.00 0.00 4.33 1.57 -1.61 -3.35 116.57 117.52 3kta h LYS 1120Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kta h LYS 1120Cb 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 3kta h LYS 1120CO 0.00 0.14 -1.01 0.39 -0.57 0.00 0.00 179.45 178.40 3kta n GLU 1121N -3.52 0.02 -4.11 3.15 -0.58 -0.47 -5.05 120.64 110.07 3kta n GLU 1121Ca -0.01 -0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.63 3kta n GLU 1121Cb 0.29 -1.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.05 3kta n GLU 1121CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 3kta s SER 1122N -2.02 0.80 0.16 1.62 0.01 -0.89 -4.82 113.70 108.55 3kta s SER 1122Ca -0.00 -0.86 -0.26 0.00 1.31 0.00 0.00 55.95 56.14 3kta s SER 1122Cb 0.00 0.12 -0.08 0.00 0.21 0.00 0.00 66.02 66.27 3kta s SER 1122CO 0.00 -0.44 0.79 -1.58 0.41 0.00 0.00 173.24 172.43 3kta s GLN 1123N -3.18 4.59 -0.08 12.44 0.74 -0.80 -4.12 119.66 129.25 3kta s GLN 1123Ca 0.03 1.19 0.03 0.00 0.05 0.00 0.00 55.36 56.66 3kta s GLN 1123Cb 0.02 -3.27 0.01 0.00 1.10 0.00 0.00 33.01 30.86 3kta s GLN 1123CO -0.05 0.54 -0.18 -0.06 -0.55 0.00 0.00 175.29 174.99 3kta s PHE 1124N -1.04 1.99 -0.19 1.67 0.40 -1.26 -0.40 117.98 119.15 3kta s PHE 1124Ca 0.37 -0.79 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 3kta s PHE 1124Cb -0.23 -1.38 0.03 0.00 0.51 0.00 0.00 43.02 41.95 3kta s PHE 1124CO 0.27 -0.35 -0.17 0.42 0.70 0.00 0.00 175.22 176.08 3kta s ILE 1125N 0.54 1.99 -0.12 0.64 1.01 -0.03 -4.96 121.20 120.27 3kta s ILE 1125Ca -0.16 -1.04 -0.00 0.00 0.00 0.00 0.00 60.65 59.44 3kta s ILE 1125Cb -0.17 -1.88 0.02 0.00 0.01 0.00 0.00 42.46 40.44 3kta s ILE 1125CO 0.06 0.39 -0.09 -0.69 0.00 0.00 0.00 174.94 174.61 3kta s VAL 1126N 1.29 1.11 -0.11 2.92 1.01 -1.26 -0.92 120.40 124.44 3kta s VAL 1126Ca 0.02 -0.34 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 3kta s VAL 1126Cb -0.15 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 3kta s VAL 1126CO -0.11 0.38 0.54 -0.63 0.00 0.00 0.00 175.10 175.29 3kta s ILE 1127N 1.64 5.15 -0.04 2.22 1.01 0.12 -5.00 121.20 126.30 3kta s ILE 1127Ca 0.04 1.09 -0.27 0.00 0.00 0.00 0.00 60.65 61.52 3kta s ILE 1127Cb -0.13 -3.88 0.06 0.00 0.01 0.00 0.00 42.46 38.52 3kta s ILE 1127CO -0.08 0.30 0.58 0.28 0.00 0.00 0.00 174.94 176.02 3kta s THR 1128N 0.71 0.02 -1.50 2.92 -1.32 -1.26 -0.70 115.64 114.50 3kta s THR 1128Ca 0.29 -0.13 0.14 0.00 -1.21 0.00 0.00 61.69 60.78 3kta s THR 1128Cb -0.16 -0.90 0.27 0.00 -1.51 0.00 0.00 72.50 70.21 3kta s THR 1128CO 0.12 -0.07 1.17 0.18 -2.21 0.00 0.00 174.62 173.81 3kta n LEU 1129N 0.99 2.76 -4.49 9.08 4.77 -1.26 -4.99 117.00 123.87 3kta n LEU 1129Ca -0.20 -1.54 -0.38 0.00 -0.03 0.00 0.00 56.01 53.86 3kta n LEU 1129Cb 0.57 -0.17 -0.12 0.00 -2.33 0.00 0.00 43.42 41.38 3kta n LEU 1129CO 0.23 0.62 -0.21 -0.13 -1.33 0.00 0.00 177.39 176.58 3kta s ARG 1130N -1.10 3.58 0.27 3.23 1.81 -1.26 -4.94 118.95 120.53 3kta s ARG 1130Ca 0.24 -0.56 -0.00 0.00 -1.72 0.00 0.00 55.73 53.70 3kta s ARG 1130Cb 0.14 -3.56 0.57 0.00 -0.45 0.00 0.00 34.95 31.66 3kta s ARG 1130CO 0.20 -0.31 1.75 0.38 -0.68 0.00 0.00 175.30 176.64 3kta h ASP 1131N 8.34 0.50 -0.18 0.23 3.04 -1.97 -3.43 116.42 122.96 3kta h ASP 1131Ca -0.34 0.10 -0.57 0.00 -3.24 0.00 0.00 57.03 52.98 3kta h ASP 1131Cb 1.16 0.03 0.01 0.00 -1.04 0.00 0.00 39.33 39.49 3kta h ASP 1131CO 0.59 0.18 2.02 1.33 -2.04 0.00 0.00 179.24 181.33 3kta n VAL 1132N -4.90 2.11 0.00 4.15 0.24 -1.26 -4.83 118.33 113.84 3kta n VAL 1132Ca 0.18 -1.97 0.00 0.00 -2.04 0.00 0.00 64.34 60.51 3kta n VAL 1132Cb 0.48 -2.30 0.00 0.00 -1.47 0.00 0.00 33.84 30.54 3kta n VAL 1132CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kta n ALA 1135N 9.34 0.00 -0.99 2.33 0.00 -1.26 -4.53 120.51 125.40 3kta n ALA 1135Ca 0.48 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.99 3kta n ALA 1135Cb 0.42 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.19 3kta n ALA 1135CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kta n ASN 1136N 0.00 4.61 -4.74 0.00 3.02 -1.26 -5.01 115.26 111.88 3kta n ASN 1136Ca 0.00 -3.04 -0.37 0.00 -0.03 0.00 0.00 54.58 51.14 3kta n ASN 1136Cb 0.00 -0.62 0.05 0.00 -0.61 0.00 0.00 39.78 38.60 3kta n ASN 1136CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kta s ALA 1137N -2.85 2.45 0.15 5.41 0.00 -1.26 -4.94 121.76 120.72 3kta s ALA 1137Ca 0.48 1.13 -0.06 0.00 0.00 0.00 0.00 51.96 53.51 3kta s ALA 1137Cb 0.38 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 3kta s ALA 1137CO 0.11 -1.41 1.39 -0.44 0.00 0.00 0.00 175.76 175.42 3kta h ASP 1138N 0.69 0.68 -4.94 0.00 3.32 -1.99 -3.45 116.42 110.73 3kta h ASP 1138Ca -0.51 -0.43 -0.19 0.00 0.02 0.00 0.00 57.03 55.92 3kta h ASP 1138Cb 1.32 -0.20 -0.20 0.00 0.22 0.00 0.00 39.33 40.47 3kta h ASP 1138CO 0.54 1.19 -0.71 -0.54 -1.72 0.00 0.00 179.24 178.01 3kta s LYS 1139N -3.71 0.43 -0.08 3.56 -0.14 -1.26 -5.16 119.74 113.38 3kta s LYS 1139Ca -0.08 -0.77 0.02 0.00 -1.36 0.00 0.00 55.97 53.79 3kta s LYS 1139Cb 0.10 0.00 0.01 0.00 -1.68 0.00 0.00 37.83 36.26 3kta s LYS 1139CO 0.86 -0.03 -0.14 0.42 -0.76 0.00 0.00 175.35 175.70 3kta s ILE 1140N -1.87 1.34 -0.17 2.17 1.01 -1.26 -5.08 121.20 117.34 3kta s ILE 1140Ca -0.10 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 59.91 3kta s ILE 1140Cb -0.07 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 3kta s ILE 1140CO -0.02 0.40 0.00 -0.63 0.00 0.00 0.00 174.94 174.69 3kta s ILE 1141N 0.71 4.23 -0.18 2.92 1.01 -1.26 -1.40 121.20 127.24 3kta s ILE 1141Ca -0.13 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.21 3kta s ILE 1141Cb -0.16 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 3kta s ILE 1141CO 0.03 0.48 0.07 -0.83 0.00 0.00 0.00 174.94 174.69 3kta s GLY 1142N 0.39 1.92 -0.09 6.18 0.00 0.10 -4.91 107.32 110.92 3kta s GLY 1142Ca -0.01 -0.74 -0.00 0.00 0.00 0.00 0.00 44.72 43.97 3kta s GLY 1142CO 0.02 0.01 -0.07 0.14 0.00 0.00 0.00 173.10 173.20 3kta s VAL 1143N 0.25 3.67 0.00 1.40 1.01 -1.26 -1.05 120.40 124.41 3kta s VAL 1143Ca 0.04 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3kta s VAL 1143Cb -0.12 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.73 3kta s VAL 1143CO 0.00 0.57 0.00 -1.54 0.00 0.00 0.00 175.10 174.13 3kta n SER 1144N 2.63 0.00 0.00 3.32 3.41 -0.78 -4.99 113.62 117.21 3kta n SER 1144Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 3kta n SER 1144Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 3kta n SER 1144CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3kta n ARG 1146N 0.00 0.00 -3.83 4.33 0.63 -0.42 -0.94 116.66 116.43 3kta n ARG 1146Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 3kta n ARG 1146Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 3kta n ARG 1146CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3kta n ASP 1147N 0.00 -4.15 0.00 6.15 10.43 -1.26 -0.97 116.55 126.75 3kta n ASP 1147Ca 0.00 -0.73 0.00 0.00 2.57 0.00 0.00 54.79 56.63 3kta n ASP 1147Cb 0.00 -3.36 0.00 0.00 1.84 0.00 0.00 41.12 39.60 3kta n ASP 1147CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3kta n GLY 1148N -1.46 0.92 3.31 0.44 0.00 -1.26 -5.02 105.19 102.12 3kta n GLY 1148Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3kta n GLY 1148CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kta s VAL 1149N -3.67 2.49 0.33 1.61 1.01 -0.14 -5.12 120.40 116.90 3kta s VAL 1149Ca 0.00 -0.88 -0.20 0.00 0.00 0.00 0.00 61.98 60.90 3kta s VAL 1149Cb 0.00 -1.98 -0.10 0.00 0.00 0.00 0.00 36.38 34.31 3kta s VAL 1149CO 0.00 0.55 0.83 -0.44 0.00 0.00 0.00 175.10 176.05 3kta s SER 1150N 0.10 7.00 0.02 3.32 0.01 -1.26 -1.30 113.70 121.59 3kta s SER 1150Ca -0.09 1.53 -0.04 0.00 1.31 0.00 0.00 55.95 58.66 3kta s SER 1150Cb -0.15 -2.47 -0.01 0.00 0.21 0.00 0.00 66.02 63.59 3kta s SER 1150CO 0.06 -0.17 0.07 -1.59 0.41 0.00 0.00 173.24 172.02 3kta s LYS 1151N -2.62 0.48 0.11 12.44 -2.85 -0.11 -4.98 119.74 122.20 3kta s LYS 1151Ca 0.53 -0.61 0.07 0.00 -1.00 0.00 0.00 55.97 54.96 3kta s LYS 1151Cb -0.13 0.19 -0.04 0.00 -2.06 0.00 0.00 37.83 35.79 3kta s LYS 1151CO 0.18 -0.11 -0.11 0.14 0.10 0.00 0.00 175.35 175.55 3kta s VAL 1152N -1.91 3.28 0.10 1.79 -7.23 -1.26 -1.87 120.40 113.30 3kta s VAL 1152Ca -0.11 -1.32 -0.00 0.00 -1.81 0.00 0.00 61.98 58.74 3kta s VAL 1152Cb -0.06 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 3kta s VAL 1152CO -0.02 0.10 0.00 0.68 -0.31 0.00 0.00 175.10 175.56 3kta s VAL 1153N -1.21 0.30 0.15 1.32 -7.23 -0.21 -4.97 120.40 108.54 3kta s VAL 1153Ca 0.21 -1.89 -0.25 0.00 -1.81 0.00 0.00 61.98 58.24 3kta s VAL 1153Cb -0.11 -1.81 -0.08 0.00 0.56 0.00 0.00 36.38 34.94 3kta s VAL 1153CO 0.13 -0.72 0.78 -0.55 -0.31 0.00 0.00 175.10 174.43 3kta s SER 1154N -3.02 7.37 0.01 4.85 0.15 -1.26 0.03 113.70 121.83 3kta s SER 1154Ca 0.16 1.62 0.08 0.00 0.70 0.00 0.00 55.95 58.51 3kta s SER 1154Cb 0.07 -2.50 -0.02 0.00 -1.71 0.00 0.00 66.02 61.86 3kta s SER 1154CO -0.03 0.17 -0.24 -0.76 1.20 0.00 0.00 173.24 173.58 3kta s LEU 1155N -0.95 2.11 0.76 3.45 1.43 -0.49 -4.83 118.68 120.15 3kta s LEU 1155Ca 0.36 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.85 3kta s LEU 1155Cb -0.23 -1.20 0.05 0.00 0.03 0.00 0.00 46.19 44.83 3kta s LEU 1155CO 0.26 0.26 1.09 -0.94 0.23 0.00 0.00 176.35 177.25 3kta s SER 1156N -0.89 4.87 0.19 2.29 1.04 -1.26 -4.26 113.70 115.68 3kta s SER 1156Ca 0.10 1.30 -0.12 0.00 0.48 0.00 0.00 55.95 57.71 3kta s SER 1156Cb -0.09 -2.07 0.12 0.00 0.10 0.00 0.00 66.02 64.07 3kta s SER 1156CO 0.01 -1.73 1.86 0.25 0.98 0.00 0.00 173.24 174.60 3kta h LEU 1157N -0.92 0.77 -0.82 2.42 5.85 -1.98 -0.70 115.31 119.92 3kta h LEU 1157Ca -0.46 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.24 3kta h LEU 1157Cb 1.26 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 3kta h LEU 1157CO 0.60 0.57 0.53 -0.08 -0.34 0.00 0.00 178.44 179.72 3kta h GLU 1158N 0.90 1.09 -0.32 1.25 4.22 -2.02 -2.59 114.58 117.11 3kta h GLU 1158Ca 0.24 -0.08 -0.12 0.00 0.08 0.00 0.00 59.36 59.48 3kta h GLU 1158Cb -0.09 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 28.92 3kta h GLU 1158CO -0.05 0.74 -0.27 0.87 -2.18 0.00 0.00 179.01 178.11 3kta h LYS 1159N 1.12 0.75 -1.88 1.92 1.57 -1.88 -2.80 116.57 115.37 3kta h LYS 1159Ca 0.30 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3kta h LYS 1159Cb -0.11 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3kta h LYS 1159CO -0.06 1.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.82 3kta n ALA 1160N -2.50 1.63 0.00 3.86 0.00 -0.29 -1.87 120.51 121.35 3kta n ALA 1160Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3kta n ALA 1160Cb 0.47 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3kta n ALA 1160CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3kta n LYS 1162N 0.96 0.00 -0.25 0.00 5.02 -1.06 -1.28 118.16 121.55 3kta n LYS 1162Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 3kta n LYS 1162Cb 0.06 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.12 3kta n LYS 1162CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3kta h ILE 1163N 0.00 1.24 -0.14 -0.18 2.04 -1.67 -2.21 117.51 116.59 3kta h ILE 1163Ca 0.00 -0.76 -0.15 0.00 1.00 0.00 0.00 64.86 64.95 3kta h ILE 1163Cb 0.00 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 3kta h ILE 1163CO 0.00 0.31 -0.55 -0.07 0.00 0.00 0.00 178.15 177.83 3kta h LEU 1164N 1.00 0.47 -0.85 1.44 3.38 -1.47 -2.53 115.31 116.74 3kta h LEU 1164Ca 0.23 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3kta h LEU 1164Cb 0.20 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 3kta h LEU 1164CO -0.02 0.92 0.56 -0.08 0.09 0.00 0.00 178.44 179.92 3kta h GLU 1165N 0.32 1.12 -0.38 1.13 4.57 -1.73 -0.71 114.58 118.89 3kta h GLU 1165Ca 0.00 -0.07 -0.11 0.00 -1.18 0.00 0.00 59.36 58.01 3kta h GLU 1165Cb 1.07 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 3kta h GLU 1165CO 0.10 0.74 -0.20 0.93 -1.18 0.00 0.00 179.01 179.39 3kta h GLU 1166N 1.15 0.74 -0.34 1.92 5.08 -1.26 -2.90 114.58 118.96 3kta h GLU 1166Ca 0.31 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 3kta h GLU 1166Cb -0.13 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3kta h GLU 1166CO -0.07 0.88 -0.05 0.82 -1.00 0.00 0.00 179.01 179.59 3kta h ILE 1167N 0.65 1.27 0.00 3.13 2.04 -1.00 -3.08 117.51 120.51 3kta h ILE 1167Ca 0.10 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.88 3kta h ILE 1167Cb 0.69 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3kta h ILE 1167CO 0.05 0.35 0.00 0.03 0.00 0.00 0.00 178.15 178.58 3kta h ARG 1168N 0.43 0.00 0.00 2.37 2.47 -1.05 -2.59 114.38 116.01 3kta h ARG 1168Ca 0.09 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.77 3kta h ARG 1168Cb 0.53 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.85 3kta h ARG 1168CO 0.03 0.00 -0.19 0.87 0.56 0.00 0.00 179.97 181.23 3kta h LYS 1169N 0.00 0.00 -6.19 0.04 1.57 -1.42 -3.45 116.57 107.12 3kta h LYS 1169Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 3kta h LYS 1169Cb 0.34 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 3kta h LYS 1169CO 0.00 0.19 -0.09 0.15 -0.57 0.00 0.00 179.45 179.14 3kta s LYS 1170N -3.55 4.09 0.22 3.15 1.02 -0.98 -5.02 119.74 118.67 3kta s LYS 1170Ca 0.02 0.61 -0.31 0.00 0.02 0.00 0.00 55.97 56.30 3kta s LYS 1170Cb 0.09 -3.18 -0.11 0.00 -0.52 0.00 0.00 37.83 34.11 3kta s LYS 1170CO 0.63 0.62 1.67 -1.14 -0.92 0.00 0.00 175.35 176.21 3kta s GLN 1171N -1.26 4.14 -0.16 1.68 2.00 -1.26 -3.01 119.66 121.79 3kta s GLN 1171Ca 0.29 2.56 0.00 0.00 -2.00 0.00 0.00 55.36 56.21 3kta s GLN 1171Cb -0.18 -3.08 0.00 0.00 0.80 0.00 0.00 33.01 30.56 3kta s GLN 1171CO 0.18 -0.70 0.00 0.41 -0.50 0.00 0.00 175.29 174.68 3kta n GLY 1172N 3.51 0.50 0.42 2.59 0.00 -1.26 -4.92 105.19 106.03 3kta n GLY 1172Ca 0.14 -0.91 0.22 0.00 0.00 0.00 0.00 46.02 45.47 3kta n GLY 1172CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3kta h TRP 1173N 0.00 0.40 -4.02 1.61 5.08 -1.82 -3.43 115.95 113.77 3kta h TRP 1173Ca -0.03 0.01 -0.52 0.00 1.08 0.00 0.00 58.89 59.44 3kta h TRP 1173Cb 0.10 -0.12 0.08 0.00 -3.00 0.00 0.00 29.16 26.22 3kta h TRP 1173CO 0.05 0.09 0.51 -2.00 -1.28 0.00 0.00 178.44 175.80 3kta s GLU 1174N -5.30 3.60 0.31 0.12 2.12 -1.26 -4.95 118.70 113.33 3kta s GLU 1174Ca -0.07 1.86 -0.28 0.00 0.36 0.00 0.00 54.97 56.84 3kta s GLU 1174Cb 0.23 -2.35 -0.13 0.00 0.26 0.00 0.00 34.13 32.14 3kta s GLU 1174CO 0.78 -0.71 1.11 1.58 -0.54 0.00 0.00 175.26 177.48 3kta n HIS 1175N -0.66 1.63 -0.04 5.30 -0.00 -1.26 -3.06 115.22 117.13 3kta n HIS 1175Ca 0.08 0.65 0.00 0.00 -0.00 0.00 0.00 57.72 58.45 3kta n HIS 1175Cb 0.48 -2.31 0.00 0.00 -0.00 0.00 0.00 29.99 28.16 3kta n HIS 1175CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3kta n GLY 1176N 1.05 0.39 0.27 1.57 0.00 -1.26 -4.91 105.19 102.31 3kta n GLY 1176Ca 0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.25 3kta n GLY 1176CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02