#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ya6 s MET 1001N 0.00 1.26 -0.19 -1.46 1.00 -1.26 -5.05 119.30 113.60 1ya6 s MET 1001Ca 0.00 -1.05 -0.10 0.00 0.00 0.00 0.00 55.69 54.54 1ya6 s MET 1001Cb 0.00 0.44 -0.05 0.00 0.00 0.00 0.00 34.83 35.22 1ya6 s MET 1001CO 0.00 -0.50 0.16 1.03 0.00 0.00 0.00 175.02 175.71 1ya6 s ARG 1002N -3.93 4.16 -0.05 2.03 0.52 -1.26 -1.14 118.95 119.28 1ya6 s ARG 1002Ca 0.14 -0.17 0.06 0.00 -0.52 0.00 0.00 55.73 55.24 1ya6 s ARG 1002Cb 0.01 -3.41 -0.01 0.00 0.52 0.00 0.00 34.95 32.07 1ya6 s ARG 1002CO -0.01 0.32 -0.22 0.42 0.02 0.00 0.00 175.30 175.83 1ya6 s ILE 1003N 0.29 1.81 -0.21 1.52 -1.09 0.21 -0.99 121.20 122.75 1ya6 s ILE 1003Ca 0.10 -0.93 -0.01 0.00 -2.23 0.00 0.00 60.65 57.57 1ya6 s ILE 1003Cb -0.11 -1.53 0.01 0.00 -1.58 0.00 0.00 42.46 39.24 1ya6 s ILE 1003CO -0.01 0.51 -0.11 0.00 -1.23 0.00 0.00 174.94 174.10 1ya6 s ILE 1005N 1.36 5.24 -0.19 0.00 1.01 -0.49 -0.90 121.20 127.23 1ya6 s ILE 1005Ca 0.04 0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.78 1ya6 s ILE 1005Cb -0.14 -3.69 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 1ya6 s ILE 1005CO -0.08 0.07 -0.07 0.12 0.00 0.00 0.00 174.94 174.98 1ya6 s PHE 1006N 1.89 2.92 -0.79 3.97 5.99 0.12 -0.77 117.98 131.30 1ya6 s PHE 1006Ca 0.10 -0.86 0.01 0.00 0.00 0.00 0.00 56.93 56.17 1ya6 s PHE 1006Cb -0.16 -2.02 0.19 0.00 0.00 0.00 0.00 43.02 41.03 1ya6 s PHE 1006CO 0.11 -0.44 0.64 -1.64 -0.00 0.00 0.00 175.22 173.88 1ya6 s MET 1007N 1.10 2.90 0.00 10.12 -1.94 -0.31 -1.31 119.30 129.86 1ya6 s MET 1007Ca 0.01 -3.22 0.03 0.00 -1.71 0.00 0.00 55.69 50.79 1ya6 s MET 1007Cb -0.15 -3.73 0.15 0.00 2.01 0.00 0.00 34.83 33.11 1ya6 s MET 1007CO -0.01 -1.26 0.72 0.00 -0.01 0.00 0.00 175.02 174.46 1ya6 n ALA 1008N 2.32 1.51 -0.07 3.03 0.00 -0.90 -1.49 120.51 124.92 1ya6 n ALA 1008Ca 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 53.44 53.54 1ya6 n ALA 1008Cb 0.36 -1.04 -0.15 0.00 0.00 0.00 0.00 19.45 18.62 1ya6 n ALA 1008CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ya6 n ARG 1009N -1.09 0.67 0.00 0.00 0.63 -1.23 -2.59 116.66 113.06 1ya6 n ARG 1009Ca 0.02 0.07 0.00 0.00 -0.92 0.00 0.00 57.85 57.01 1ya6 n ARG 1009Cb 0.01 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.32 1ya6 n ARG 1009CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ya6 n GLY 1010N 1.65 0.79 3.31 5.14 0.00 -0.55 -4.56 105.19 110.97 1ya6 n GLY 1010Ca -0.26 -2.28 -0.46 0.00 0.00 0.00 0.00 46.02 43.02 1ya6 n GLY 1010CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ya6 s LEU 1011N 0.00 6.24 0.38 0.99 0.20 -1.26 -4.86 118.68 120.37 1ya6 s LEU 1011Ca 0.00 -1.89 0.26 0.00 0.69 0.00 0.00 54.13 53.19 1ya6 s LEU 1011Cb 0.00 -2.20 0.81 0.00 -0.43 0.00 0.00 46.19 44.36 1ya6 s LEU 1011CO 0.00 -0.82 1.76 1.05 -0.29 0.00 0.00 176.35 178.04 1ya6 h GLU 1012N 8.76 0.00 0.00 1.98 -0.00 -1.93 -3.42 114.58 119.97 1ya6 h GLU 1012Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.11 1ya6 h GLU 1012Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.84 1ya6 h GLU 1012CO 1.00 0.00 0.00 0.41 -0.00 0.00 0.00 179.01 180.42 1ya6 n GLY 1013N 0.73 0.38 0.00 1.06 0.00 -1.26 -4.13 105.19 101.96 1ya6 n GLY 1013Ca 0.03 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1ya6 n GLY 1013CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ya6 h GLY 1015N 0.00 0.33 1.32 0.00 0.00 -1.97 0.21 103.07 102.95 1ya6 h GLY 1015Ca 0.00 -0.23 -0.23 0.00 0.00 0.00 0.00 47.33 46.86 1ya6 h GLY 1015CO 0.00 0.21 -0.90 -2.08 0.00 0.00 0.00 176.54 173.78 1ya6 h VAL 1016N 0.28 1.31 -0.19 4.60 2.07 -1.96 0.28 116.25 122.64 1ya6 h VAL 1016Ca 0.05 -2.18 -0.06 0.00 0.82 0.00 0.00 66.70 65.33 1ya6 h VAL 1016Cb 0.52 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1ya6 h VAL 1016CO 0.03 0.67 -0.11 0.74 0.02 0.00 0.00 177.57 178.92 1ya6 h THR 1017N 0.40 1.31 0.63 2.57 2.02 -1.88 -0.96 112.91 117.00 1ya6 h THR 1017Ca -0.08 -1.20 -0.02 0.00 0.77 0.00 0.00 66.41 65.88 1ya6 h THR 1017Cb 1.53 1.69 -0.02 0.00 -1.74 0.00 0.00 68.15 69.61 1ya6 h THR 1017CO 0.17 0.36 -0.50 0.50 0.37 0.00 0.00 175.52 176.42 1ya6 h LYS 1018N 0.10 -1.06 -0.84 6.66 1.63 -0.53 0.12 116.57 122.65 1ya6 h LYS 1018Ca 0.04 0.07 0.19 0.00 -0.85 0.00 0.00 60.65 60.10 1ya6 h LYS 1018Cb 0.61 0.24 -0.15 0.00 -0.60 0.00 0.00 32.23 32.33 1ya6 h LYS 1018CO 0.03 -0.71 -0.08 0.35 -3.45 0.00 0.00 179.45 175.59 1ya6 h PHE 1019N -1.10 -0.22 -0.74 1.91 3.57 -0.41 0.29 116.94 120.24 1ya6 h PHE 1019Ca -0.08 0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.55 1ya6 h PHE 1019Cb 0.92 0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.83 1ya6 h PHE 1019CO -0.20 -0.33 0.43 0.77 -2.23 0.00 0.00 178.31 176.75 1ya6 h SER 1020N 0.04 0.65 -0.23 0.41 0.02 -0.27 0.81 113.55 114.98 1ya6 h SER 1020Ca 0.45 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.37 1ya6 h SER 1020Cb 0.78 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1ya6 h SER 1020CO -0.81 0.41 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.14 1ya6 h LEU 1021N 0.78 0.47 -1.75 5.07 3.38 0.15 -1.39 115.31 122.01 1ya6 h LEU 1021Ca 0.33 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1ya6 h LEU 1021Cb 0.20 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1ya6 h LEU 1021CO -0.19 0.75 -0.17 -0.33 0.09 0.00 0.00 178.44 178.60 1ya6 h GLU 1022N 0.18 0.00 -0.07 1.13 4.39 -0.73 -0.48 114.58 119.01 1ya6 h GLU 1022Ca 0.05 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.57 1ya6 h GLU 1022Cb 0.56 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1ya6 h GLU 1022CO 0.03 0.17 -0.67 0.37 -1.16 0.00 0.00 179.01 177.75 1ya6 h GLN 1023N 0.00 0.57 -0.11 2.33 4.15 -0.63 -2.77 115.11 118.65 1ya6 h GLN 1023Ca -0.00 -0.52 -0.01 0.00 0.77 0.00 0.00 58.65 58.89 1ya6 h GLN 1023Cb 0.38 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1ya6 h GLN 1023CO 0.02 1.15 0.05 -0.09 -1.93 0.00 0.00 178.83 178.03 1ya6 h ARG 1024N 0.17 0.16 -0.69 1.69 2.43 -0.60 -2.62 114.38 114.93 1ya6 h ARG 1024Ca -0.06 -0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.19 1ya6 h ARG 1024Cb 1.33 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.77 1ya6 h ARG 1024CO 0.13 0.25 0.30 -0.44 -1.51 0.00 0.00 179.97 178.71 1ya6 h ASP 1025N 0.04 0.34 -0.28 -3.80 3.32 -1.15 -1.73 116.42 113.15 1ya6 h ASP 1025Ca 0.04 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 1ya6 h ASP 1025Cb 0.15 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1ya6 h ASP 1025CO -0.00 0.18 0.06 -0.25 -1.72 0.00 0.00 179.24 177.50 1ya6 h TRP 1026N 0.50 0.48 -0.56 4.55 7.01 -1.35 0.01 115.95 126.59 1ya6 h TRP 1026Ca 0.36 -0.06 -0.02 0.00 2.11 0.00 0.00 58.89 61.27 1ya6 h TRP 1026Cb 0.45 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 27.35 1ya6 h TRP 1026CO -0.14 0.54 0.27 0.74 -2.79 0.00 0.00 178.44 177.06 1ya6 h PHE 1027N 0.28 0.81 -0.22 2.65 -1.00 -1.18 -1.11 116.94 117.18 1ya6 h PHE 1027Ca 0.09 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.82 1ya6 h PHE 1027Cb 0.31 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 1ya6 h PHE 1027CO 0.02 0.62 0.11 0.82 -1.61 0.00 0.00 178.31 178.27 1ya6 h ILE 1028N 0.76 1.12 -0.04 -0.55 2.04 -1.24 -1.73 117.51 117.87 1ya6 h ILE 1028Ca 0.19 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.72 1ya6 h ILE 1028Cb 0.12 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1ya6 h ILE 1028CO -0.02 0.12 0.06 0.50 0.00 0.00 0.00 178.15 178.81 1ya6 h LYS 1029N 0.23 0.00 -0.57 2.37 3.64 -0.69 0.27 116.57 121.82 1ya6 h LYS 1029Ca 0.07 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.29 1ya6 h LYS 1029Cb 0.09 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 31.81 1ya6 h LYS 1029CO -0.01 0.00 0.16 0.09 -2.27 0.00 0.00 179.45 177.42 1ya6 n ASN 1030N -3.57 4.25 -2.76 4.20 4.13 -0.45 -4.97 115.26 116.10 1ya6 n ASN 1030Ca -0.02 -3.27 -0.01 0.00 1.68 0.00 0.00 54.58 52.96 1ya6 n ASN 1030Cb 0.15 -0.68 0.00 0.00 -1.54 0.00 0.00 39.78 37.71 1ya6 n ASN 1030CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ya6 n GLY 1031N -0.40 -1.08 3.18 7.41 0.00 0.08 -4.99 105.19 109.39 1ya6 n GLY 1031Ca 0.36 0.42 -0.09 0.00 0.00 0.00 0.00 46.02 46.71 1ya6 n GLY 1031CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ya6 s HIS 1032N -2.92 0.19 -0.18 1.61 3.76 -0.74 -4.47 115.29 112.53 1ya6 s HIS 1032Ca 0.02 -0.59 -0.13 0.00 -0.15 0.00 0.00 55.06 54.22 1ya6 s HIS 1032Cb -0.01 -0.10 -0.05 0.00 1.11 0.00 0.00 32.58 33.54 1ya6 s HIS 1032CO 0.62 -0.49 0.24 -1.21 -0.85 0.00 0.00 174.74 173.04 1ya6 s GLU 1033N -3.59 4.22 -0.05 1.40 2.02 -0.29 -4.28 118.70 118.13 1ya6 s GLU 1033Ca 0.03 -0.02 0.03 0.00 0.02 0.00 0.00 54.97 55.03 1ya6 s GLU 1033Cb 0.04 -3.44 0.01 0.00 0.10 0.00 0.00 34.13 30.84 1ya6 s GLU 1033CO -0.09 0.22 -0.12 0.08 0.02 0.00 0.00 175.26 175.36 1ya6 s VAL 1034N 0.56 1.08 -0.10 2.63 1.01 -1.26 0.68 120.40 125.00 1ya6 s VAL 1034Ca 0.13 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.67 1ya6 s VAL 1034Cb -0.13 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.27 1ya6 s VAL 1034CO 0.02 0.34 -0.23 0.42 0.00 0.00 0.00 175.10 175.65 1ya6 s THR 1035N 0.46 2.17 -0.29 3.92 -4.23 -0.44 -4.97 115.64 112.26 1ya6 s THR 1035Ca -0.10 -0.99 -0.09 0.00 -1.18 0.00 0.00 61.69 59.33 1ya6 s THR 1035Cb -0.13 -1.83 -0.02 0.00 1.34 0.00 0.00 72.50 71.86 1ya6 s THR 1035CO 0.03 0.56 0.13 -0.22 -0.54 0.00 0.00 174.62 174.57 1ya6 s LEU 1036N 0.27 3.88 -0.03 4.79 2.96 -1.26 -1.40 118.68 127.89 1ya6 s LEU 1036Ca -0.16 -0.38 0.07 0.00 -0.22 0.00 0.00 54.13 53.44 1ya6 s LEU 1036Cb -0.17 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1ya6 s LEU 1036CO 0.08 -0.13 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.05 1ya6 s VAL 1037N 1.63 1.94 0.03 1.68 1.01 0.05 0.47 120.40 127.19 1ya6 s VAL 1037Ca 0.05 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.00 1ya6 s VAL 1037Cb -0.16 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1ya6 s VAL 1037CO 0.06 0.55 -0.02 -0.72 0.00 0.00 0.00 175.10 174.96 1ya6 s TYR 1038N -0.42 0.30 -0.29 5.22 1.13 -0.31 -1.16 117.35 121.82 1ya6 s TYR 1038Ca 0.05 -0.62 -0.26 0.00 -1.41 0.00 0.00 57.07 54.83 1ya6 s TYR 1038Cb -0.11 -0.22 0.00 0.00 -1.10 0.00 0.00 41.96 40.53 1ya6 s TYR 1038CO 0.01 -0.23 0.89 0.00 -2.51 0.00 0.00 175.55 173.71 1ya6 s ALA 1039N -1.92 3.56 -2.20 9.51 0.00 -0.95 -1.71 121.76 128.04 1ya6 s ALA 1039Ca -0.12 -0.23 0.29 0.00 0.00 0.00 0.00 51.96 51.90 1ya6 s ALA 1039Cb -0.07 -3.41 1.45 0.00 0.00 0.00 0.00 23.12 21.09 1ya6 s ALA 1039CO -0.03 -1.21 1.96 1.17 0.00 0.00 0.00 175.76 177.65 1ya6 n LYS 1040N 6.35 1.29 -0.14 0.00 4.81 0.17 -3.60 118.16 127.05 1ya6 n LYS 1040Ca 0.07 -0.43 -0.07 0.00 -0.87 0.00 0.00 58.31 57.01 1ya6 n LYS 1040Cb 0.48 -1.47 -0.01 0.00 0.02 0.00 0.00 35.03 34.04 1ya6 n LYS 1040CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1ya6 h ASP 1041N 1.01 -1.15 -2.75 3.14 3.45 -1.91 -3.39 116.42 114.81 1ya6 h ASP 1041Ca 0.00 0.20 -0.65 0.00 0.43 0.00 0.00 57.03 57.01 1ya6 h ASP 1041Cb 0.22 0.54 -0.06 0.00 -0.56 0.00 0.00 39.33 39.47 1ya6 h ASP 1041CO 0.00 -0.32 -0.49 -0.75 -1.57 0.00 0.00 179.24 176.11 1ya6 s LYS 1042N -5.97 3.44 0.08 3.56 2.20 -1.26 -5.10 119.74 116.69 1ya6 s LYS 1042Ca -0.15 -0.25 0.05 0.00 -0.36 0.00 0.00 55.97 55.26 1ya6 s LYS 1042Cb 0.14 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 33.29 1ya6 s LYS 1042CO 0.68 0.71 -0.02 -1.54 -0.36 0.00 0.00 175.35 174.82 1ya6 s SER 1043N -1.62 4.89 0.26 1.43 1.04 -1.26 -4.74 113.70 113.70 1ya6 s SER 1043Ca 0.23 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.47 1ya6 s SER 1043Cb -0.12 -1.13 -0.00 0.00 0.10 0.00 0.00 66.02 64.86 1ya6 s SER 1043CO 0.14 0.19 0.04 0.49 0.98 0.00 0.00 173.24 175.08 1ya6 n PHE 1044N 0.74 0.39 -0.12 5.02 3.01 -1.26 -5.11 117.46 120.13 1ya6 n PHE 1044Ca -0.12 -1.47 -0.25 0.00 1.01 0.00 0.00 57.45 56.62 1ya6 n PHE 1044Cb 0.52 -0.10 -0.10 0.00 -0.01 0.00 0.00 39.48 39.79 1ya6 n PHE 1044CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1ya6 n THR 1045N -0.63 1.53 0.64 4.37 -1.04 -1.26 -4.40 114.28 113.48 1ya6 n THR 1045Ca -0.08 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 1ya6 n THR 1045Cb 0.36 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 66.88 1ya6 n THR 1045CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1ya6 n ARG 1046N -4.35 0.64 -0.25 -2.82 1.74 -1.26 -4.24 116.66 106.12 1ya6 n ARG 1046Ca -0.42 0.00 0.23 0.00 -0.77 0.00 0.00 57.85 56.89 1ya6 n ARG 1046Cb 0.76 -1.22 0.57 0.00 -1.02 0.00 0.00 32.46 31.55 1ya6 n ARG 1046CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ya6 h THR 1047N 0.25 0.61 -0.69 0.55 1.03 -1.80 -0.50 112.91 112.36 1ya6 h THR 1047Ca 0.00 -0.10 0.00 0.00 -0.01 0.00 0.00 66.41 66.30 1ya6 h THR 1047Cb 0.54 0.28 0.00 0.00 -1.07 0.00 0.00 68.15 67.90 1ya6 h THR 1047CO 0.00 0.05 0.00 -1.20 -0.01 0.00 0.00 175.52 174.36 1ya6 n SER 1048N -4.47 4.62 0.15 0.00 7.64 -1.26 -4.48 113.62 115.83 1ya6 n SER 1048Ca 0.21 -2.33 0.01 0.00 1.01 0.00 0.00 58.87 57.77 1ya6 n SER 1048Cb 0.82 -0.57 0.22 0.00 -1.01 0.00 0.00 64.21 63.67 1ya6 n SER 1048CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1ya6 h SER 1049N 4.25 0.00 -3.47 6.43 0.02 -1.34 -3.45 113.55 115.99 1ya6 h SER 1049Ca 0.00 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.34 1ya6 h SER 1049Cb 1.35 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.70 1ya6 h SER 1049CO 0.17 0.54 -0.82 -1.00 -1.14 0.00 0.00 176.83 174.58 1ya6 s HIS 1050N -3.57 2.11 -0.35 3.45 3.76 -1.26 -0.37 115.29 119.07 1ya6 s HIS 1050Ca -0.01 -0.40 -0.24 0.00 -0.15 0.00 0.00 55.06 54.27 1ya6 s HIS 1050Cb 0.12 -1.07 0.01 0.00 1.11 0.00 0.00 32.58 32.75 1ya6 s HIS 1050CO 0.74 0.41 0.82 0.34 -0.85 0.00 0.00 174.74 176.19 1ya6 s ASP 1051N -2.53 6.62 0.00 1.40 2.15 -1.26 -4.74 116.67 118.31 1ya6 s ASP 1051Ca 0.17 0.51 0.00 0.00 0.43 0.00 0.00 52.55 53.66 1ya6 s ASP 1051Cb -0.08 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 1ya6 s ASP 1051CO 0.08 -0.73 0.00 0.00 -0.17 0.00 0.00 175.17 174.35 1ya6 n HIS 1052N 6.44 0.00 -0.32 -5.34 1.44 -1.26 -4.97 115.22 111.21 1ya6 n HIS 1052Ca 0.04 0.00 0.19 0.00 -2.01 0.00 0.00 57.72 55.94 1ya6 n HIS 1052Cb 0.48 0.00 0.39 0.00 0.12 0.00 0.00 29.99 30.98 1ya6 n HIS 1052CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 1ya6 h LYS 1053N 0.00 0.21 0.00 -1.40 1.57 -1.92 -0.13 116.57 114.90 1ya6 h LYS 1053Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1ya6 h LYS 1053Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1ya6 h LYS 1053CO 0.00 0.14 0.00 -1.13 -0.57 0.00 0.00 179.45 177.89 1ya6 n SER 1054N -5.19 0.00 0.00 0.86 3.41 -1.26 -3.95 113.62 107.49 1ya6 n SER 1054Ca 0.27 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 1ya6 n SER 1054Cb 0.87 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1ya6 n SER 1054CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1ya6 n PHE 1055N -1.34 0.00 -2.69 7.33 -1.74 -0.20 -5.09 117.46 113.73 1ya6 n PHE 1055Ca 0.06 0.00 -0.36 0.00 -0.56 0.00 0.00 57.45 56.59 1ya6 n PHE 1055Cb 0.13 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.07 1ya6 n PHE 1055CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1ya6 s SER 1056N -0.07 7.02 -0.32 5.98 1.04 -0.41 -4.44 113.70 122.50 1ya6 s SER 1056Ca 0.00 1.89 -0.04 0.00 0.48 0.00 0.00 55.95 58.29 1ya6 s SER 1056Cb 0.00 -2.57 0.05 0.00 0.10 0.00 0.00 66.02 63.59 1ya6 s SER 1056CO 0.00 -0.30 0.04 -0.63 0.98 0.00 0.00 173.24 173.33 1ya6 s ILE 1057N -1.74 3.31 0.53 -1.02 1.01 0.17 -4.94 121.20 118.53 1ya6 s ILE 1057Ca 0.56 -1.28 -0.08 0.00 0.00 0.00 0.00 60.65 59.85 1ya6 s ILE 1057Cb -0.18 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.36 1ya6 s ILE 1057CO 0.23 -0.13 0.89 -2.16 0.00 0.00 0.00 174.94 173.77 1ya6 s PRO 1058N 1.32 3.60 -0.27 2.79 0.04 -1.26 -1.16 135.00 140.06 1ya6 s PRO 1058Ca -0.04 0.47 -0.24 0.00 0.04 0.00 0.00 61.00 61.24 1ya6 s PRO 1058Cb -0.20 -2.25 0.07 0.00 0.04 0.00 0.00 34.50 32.17 1ya6 s PRO 1058CO 0.01 -0.34 0.71 0.54 0.04 0.00 0.00 177.00 177.95 1ya6 s VAL 1059N -2.89 -0.00 -0.52 -0.36 0.11 -0.69 -4.89 120.40 111.16 1ya6 s VAL 1059Ca 0.51 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 59.40 1ya6 s VAL 1059Cb -0.11 -0.99 0.10 0.00 -1.53 0.00 0.00 36.38 33.85 1ya6 s VAL 1059CO 0.47 0.00 0.51 -0.63 -3.33 0.00 0.00 175.10 172.12 1ya6 s ILE 1060N 0.52 5.12 0.28 7.04 1.01 -1.26 0.46 121.20 134.37 1ya6 s ILE 1060Ca -0.01 -1.15 -0.00 0.00 0.00 0.00 0.00 60.65 59.49 1ya6 s ILE 1060Cb -0.05 -4.29 0.28 0.00 0.01 0.00 0.00 42.46 38.41 1ya6 s ILE 1060CO -0.01 -0.80 1.86 -0.07 0.00 0.00 0.00 174.94 175.92 1ya6 h LEU 1061N 9.12 0.97 -0.28 2.97 3.38 -1.93 0.70 115.31 130.24 1ya6 h LEU 1061Ca -0.29 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1ya6 h LEU 1061Cb 1.10 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1ya6 h LEU 1061CO 0.99 0.57 0.00 0.00 0.09 0.00 0.00 178.44 180.09 1ya6 n ALA 1062N -2.36 1.65 0.00 1.53 0.00 -1.26 -3.82 120.51 116.25 1ya6 n ALA 1062Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1ya6 n ALA 1062Cb 0.27 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1ya6 n ALA 1062CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ya6 n LYS 1063N -1.79 3.03 -1.98 0.00 4.76 -0.60 -4.84 118.16 116.73 1ya6 n LYS 1063Ca 0.03 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.30 1ya6 n LYS 1063Cb 0.19 -0.36 0.04 0.00 -1.84 0.00 0.00 35.03 33.06 1ya6 n LYS 1063CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1ya6 n GLU 1064N -0.32 3.06 -0.32 1.97 1.02 0.23 -4.90 120.64 121.38 1ya6 n GLU 1064Ca 0.00 -3.94 0.09 0.00 -0.02 0.00 0.00 57.16 53.29 1ya6 n GLU 1064Cb 0.00 -2.07 0.20 0.00 -0.02 0.00 0.00 31.44 29.56 1ya6 n GLU 1064CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 1ya6 h TYR 1065N 2.09 -0.22 -0.39 -0.32 5.03 -1.74 0.11 116.97 121.53 1ya6 h TYR 1065Ca 0.24 0.07 -0.07 0.00 2.58 0.00 0.00 58.73 61.55 1ya6 h TYR 1065Cb 1.45 0.25 -0.02 0.00 1.55 0.00 0.00 36.73 39.96 1ya6 h TYR 1065CO 0.78 -0.38 -0.07 -0.44 -1.32 0.00 0.00 178.16 176.72 1ya6 h ASP 1066N 0.02 0.63 -0.43 -2.11 5.19 -1.94 0.33 116.42 118.12 1ya6 h ASP 1066Ca 0.51 -0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.72 1ya6 h ASP 1066Cb 0.92 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 40.24 1ya6 h ASP 1066CO -0.89 0.75 0.14 0.50 -3.12 0.00 0.00 179.24 176.62 1ya6 h LYS 1067N 0.61 0.66 -0.42 3.56 3.64 -1.23 0.19 116.57 123.58 1ya6 h LYS 1067Ca 0.11 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1ya6 h LYS 1067Cb 0.48 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1ya6 h LYS 1067CO 0.03 0.64 0.13 0.00 -2.27 0.00 0.00 179.45 177.98 1ya6 h ALA 1068N 0.99 0.54 -0.18 5.00 0.00 -0.77 -1.20 119.26 123.64 1ya6 h ALA 1068Ca 0.14 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ya6 h ALA 1068Cb 0.25 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ya6 h ALA 1068CO -0.01 0.19 0.06 1.25 0.00 0.00 0.00 179.25 180.74 1ya6 h LEU 1069N 0.53 0.07 -0.61 0.00 5.85 -0.01 -0.38 115.31 120.76 1ya6 h LEU 1069Ca 0.13 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.92 1ya6 h LEU 1069Cb 0.26 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1ya6 h LEU 1069CO -0.00 0.07 0.34 0.50 -0.34 0.00 0.00 178.44 179.01 1ya6 h LYS 1070N 0.15 0.64 0.88 1.25 3.64 -0.83 -2.17 116.57 120.13 1ya6 h LYS 1070Ca 0.08 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1ya6 h LYS 1070Cb 0.05 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1ya6 h LYS 1070CO -0.08 0.42 -0.42 -0.07 -2.27 0.00 0.00 179.45 177.03 1ya6 h LEU 1071N 0.66 -1.00 -1.01 5.20 3.38 -0.42 -2.94 115.31 119.18 1ya6 h LEU 1071Ca 0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1ya6 h LEU 1071Cb 0.12 0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1ya6 h LEU 1071CO -0.15 -0.70 0.00 -0.37 0.09 0.00 0.00 178.44 177.31 1ya6 h VAL 1072N -1.22 0.00 -0.18 1.22 -1.51 -1.07 -2.37 116.25 111.13 1ya6 h VAL 1072Ca -0.12 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.12 1ya6 h VAL 1072Cb 0.91 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 1ya6 h VAL 1072CO 0.20 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.13 1ya6 n ASN 1073N -2.39 2.42 -3.81 4.19 3.02 -0.82 -4.50 115.26 113.36 1ya6 n ASN 1073Ca 0.01 -1.81 -0.40 0.00 -0.03 0.00 0.00 54.58 52.35 1ya6 n ASN 1073Cb 0.20 -0.11 -0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1ya6 n ASN 1073CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ya6 n ASP 1074N 0.84 6.21 -3.62 6.41 4.64 -0.89 -4.94 116.55 125.19 1ya6 n ASP 1074Ca 0.17 -3.49 0.02 0.00 -1.38 0.00 0.00 54.79 50.11 1ya6 n ASP 1074Cb 0.47 -1.14 -0.00 0.00 -1.04 0.00 0.00 41.12 39.40 1ya6 n ASP 1074CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1ya6 n ASP 1076N -0.52 1.59 -3.98 0.00 10.43 -0.16 -4.80 116.55 119.12 1ya6 n ASP 1076Ca -0.08 0.18 -0.24 0.00 2.57 0.00 0.00 54.79 57.22 1ya6 n ASP 1076Cb 0.63 -0.41 -0.17 0.00 1.84 0.00 0.00 41.12 43.01 1ya6 n ASP 1076CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1ya6 s ILE 1077N -2.56 1.03 -0.23 0.53 1.01 -0.91 -2.10 121.20 117.97 1ya6 s ILE 1077Ca -0.19 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1ya6 s ILE 1077Cb 0.07 -0.97 -0.01 0.00 0.01 0.00 0.00 42.46 41.56 1ya6 s ILE 1077CO 0.76 0.34 -0.01 -0.22 0.00 0.00 0.00 174.94 175.81 1ya6 s LEU 1078N 0.87 3.09 -0.21 2.97 2.96 -0.63 -0.87 118.68 126.87 1ya6 s LEU 1078Ca -0.11 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.40 1ya6 s LEU 1078Cb -0.15 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.72 1ya6 s LEU 1078CO 0.01 -0.03 0.01 -0.63 -1.32 0.00 0.00 176.35 174.39 1ya6 s ILE 1079N 1.52 4.02 -0.26 6.68 1.01 -0.08 0.54 121.20 134.64 1ya6 s ILE 1079Ca 0.06 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 1ya6 s ILE 1079Cb -0.15 -2.83 0.01 0.00 0.01 0.00 0.00 42.46 39.50 1ya6 s ILE 1079CO -0.01 0.42 0.01 -0.63 0.00 0.00 0.00 174.94 174.72 1ya6 s ILE 1080N 1.08 3.52 -0.51 2.92 1.01 0.13 0.14 121.20 129.48 1ya6 s ILE 1080Ca 0.03 -0.69 0.22 0.00 0.00 0.00 0.00 60.65 60.20 1ya6 s ILE 1080Cb -0.14 -2.74 -0.28 0.00 0.01 0.00 0.00 42.46 39.31 1ya6 s ILE 1080CO 0.02 0.23 0.69 0.59 0.00 0.00 0.00 174.94 176.47 1ya6 n ASN 1081N 4.80 0.50 -3.63 3.58 3.02 -0.43 -2.05 115.26 121.06 1ya6 n ASN 1081Ca -0.16 -0.50 -0.10 0.00 -0.03 0.00 0.00 54.58 53.79 1ya6 n ASN 1081Cb 0.49 1.50 -0.03 0.00 -0.61 0.00 0.00 39.78 41.13 1ya6 n ASN 1081CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ya6 s SER 1082N -3.76 -0.36 0.23 6.41 1.04 -1.25 -4.56 113.70 111.44 1ya6 s SER 1082Ca -0.00 -0.30 0.03 0.00 0.48 0.00 0.00 55.95 56.16 1ya6 s SER 1082Cb 0.15 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 66.81 1ya6 s SER 1082CO 0.89 -1.03 -0.00 0.68 0.98 0.00 0.00 173.24 174.76 1ya6 s VAL 1083N -3.83 1.03 0.52 5.02 -7.23 -1.26 -2.12 120.40 112.53 1ya6 s VAL 1083Ca 0.06 -2.03 -0.21 0.00 -1.81 0.00 0.00 61.98 57.99 1ya6 s VAL 1083Cb -0.01 -2.35 -0.08 0.00 0.56 0.00 0.00 36.38 34.50 1ya6 s VAL 1083CO -0.07 -0.31 0.91 -2.65 -0.31 0.00 0.00 175.10 172.67 1ya6 n PRO 1084N -0.42 1.03 -2.16 4.82 -0.02 -1.07 -3.53 135.00 133.65 1ya6 n PRO 1084Ca -0.05 0.38 -0.27 0.00 -2.02 0.00 0.00 63.50 61.54 1ya6 n PRO 1084Cb 0.64 -2.04 0.06 0.00 -0.02 0.00 0.00 33.50 32.13 1ya6 n PRO 1084CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ya6 s ALA 1085N -1.45 3.08 -0.46 3.55 0.00 -1.26 -2.27 121.76 122.95 1ya6 s ALA 1085Ca 0.69 -0.73 0.24 0.00 0.00 0.00 0.00 51.96 52.17 1ya6 s ALA 1085Cb -0.48 -2.72 1.00 0.00 0.00 0.00 0.00 23.12 20.92 1ya6 s ALA 1085CO 0.52 -1.19 1.73 0.25 0.00 0.00 0.00 175.76 177.07 1ya6 n THR 1086N -2.90 0.81 0.84 0.00 -2.24 -1.21 -2.79 114.28 106.79 1ya6 n THR 1086Ca 0.07 0.21 0.05 0.00 -2.27 0.00 0.00 64.05 62.10 1ya6 n THR 1086Cb 0.59 -1.15 0.15 0.00 -2.10 0.00 0.00 70.33 67.82 1ya6 n THR 1086CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ya6 n SER 1087N -2.28 1.94 -4.94 3.42 3.41 -1.26 -4.91 113.62 109.00 1ya6 n SER 1087Ca 0.02 -2.07 -0.24 0.00 -0.26 0.00 0.00 58.87 56.32 1ya6 n SER 1087Cb 0.24 -0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 63.90 1ya6 n SER 1087CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ya6 s VAL 1088N -1.61 5.10 0.75 -3.33 -7.23 -1.12 -5.08 120.40 107.88 1ya6 s VAL 1088Ca 0.22 -0.44 -0.11 0.00 -1.81 0.00 0.00 61.98 59.83 1ya6 s VAL 1088Cb 0.12 -3.86 0.04 0.00 0.56 0.00 0.00 36.38 33.24 1ya6 s VAL 1088CO 0.13 -0.56 1.08 -1.10 -0.31 0.00 0.00 175.10 174.34 1ya6 s GLN 1089N -4.32 2.43 0.19 4.82 -0.21 -1.26 -4.86 119.66 116.45 1ya6 s GLN 1089Ca 0.40 1.06 -0.12 0.00 0.02 0.00 0.00 55.36 56.72 1ya6 s GLN 1089Cb -0.10 -1.92 0.21 0.00 1.00 0.00 0.00 33.01 32.20 1ya6 s GLN 1089CO 0.36 -1.49 1.71 0.93 -2.12 0.00 0.00 175.29 174.69 1ya6 h GLU 1090N -1.01 0.23 -0.86 2.91 4.39 -1.99 -1.85 114.58 116.40 1ya6 h GLU 1090Ca -0.44 -0.01 0.14 0.00 0.34 0.00 0.00 59.36 59.39 1ya6 h GLU 1090Cb 1.23 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.76 1ya6 h GLU 1090CO 0.54 0.15 0.56 0.00 -1.16 0.00 0.00 179.01 179.09 1ya6 h ALA 1091N 1.41 1.88 0.29 3.43 0.00 -1.93 0.46 119.26 124.80 1ya6 h ALA 1091Ca 0.26 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ya6 h ALA 1091Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ya6 h ALA 1091CO -0.35 -0.10 -0.14 1.15 0.00 0.00 0.00 179.25 179.81 1ya6 h THR 1092N 0.64 0.48 -0.56 0.00 2.02 -1.64 -0.14 112.91 113.71 1ya6 h THR 1092Ca 0.42 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1ya6 h THR 1092Cb 0.71 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1ya6 h THR 1092CO -0.18 0.12 0.20 -0.29 0.37 0.00 0.00 175.52 175.73 1ya6 h ILE 1093N -0.97 1.23 0.06 3.11 6.09 -1.28 -0.42 117.51 125.34 1ya6 h ILE 1093Ca -0.04 -0.74 -0.00 0.00 -1.37 0.00 0.00 64.86 62.70 1ya6 h ILE 1093Cb 0.49 0.67 0.00 0.00 0.47 0.00 0.00 36.82 38.45 1ya6 h ILE 1093CO 0.07 0.28 -0.03 0.78 -3.07 0.00 0.00 178.15 176.18 1ya6 h ASN 1094N 0.77 -0.07 0.50 2.19 -0.26 -0.18 -1.01 115.58 117.53 1ya6 h ASN 1094Ca 0.18 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.89 1ya6 h ASN 1094Cb 0.24 0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.51 1ya6 h ASN 1094CO -0.01 -0.04 -0.13 0.78 -1.06 0.00 0.00 177.43 176.97 1ya6 h ASN 1095N -0.09 0.00 -0.10 5.81 2.35 -0.89 -1.87 115.58 120.79 1ya6 h ASN 1095Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1ya6 h ASN 1095Cb 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 1ya6 h ASN 1095CO 0.01 0.13 0.00 0.22 -1.65 0.00 0.00 177.43 176.15 1ya6 h TYR 1096N 0.00 0.20 -0.46 1.19 5.03 -0.26 -2.39 116.97 120.27 1ya6 h TYR 1096Ca -0.00 -0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.30 1ya6 h TYR 1096Cb 0.42 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.62 1ya6 h TYR 1096CO 0.00 0.43 0.31 0.87 -1.32 0.00 0.00 178.16 178.45 1ya6 h LYS 1097N -0.09 0.51 0.00 1.82 1.57 -0.70 -0.67 116.57 119.00 1ya6 h LYS 1097Ca 0.03 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1ya6 h LYS 1097Cb 0.35 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1ya6 h LYS 1097CO 0.01 0.34 -0.19 -0.22 -0.57 0.00 0.00 179.45 178.81 1ya6 h LYS 1098N 0.53 0.00 -0.22 3.15 3.64 -1.07 -2.77 116.57 119.83 1ya6 h LYS 1098Ca 0.18 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.41 1ya6 h LYS 1098Cb 0.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1ya6 h LYS 1098CO -0.04 0.19 -0.45 -0.07 -2.27 0.00 0.00 179.45 176.81 1ya6 h LEU 1099N 0.00 0.78 -1.45 5.20 3.38 -0.62 -3.11 115.31 119.50 1ya6 h LEU 1099Ca -0.00 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.49 1ya6 h LEU 1099Cb 0.67 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1ya6 h LEU 1099CO 0.03 1.19 0.45 -0.07 0.09 0.00 0.00 178.44 180.12 1ya6 h LEU 1100N 0.41 0.58 -0.17 1.67 3.38 -1.33 -1.36 115.31 118.50 1ya6 h LEU 1100Ca 0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ya6 h LEU 1100Cb 1.06 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1ya6 h LEU 1100CO 0.10 0.37 0.00 0.44 0.09 0.00 0.00 178.44 179.44 1ya6 h ASP 1101N 0.66 0.00 -0.16 -0.43 3.45 -1.55 -3.30 116.42 115.08 1ya6 h ASP 1101Ca 0.30 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.69 1ya6 h ASP 1101Cb 0.32 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.05 1ya6 h ASP 1101CO -0.10 0.00 -0.18 0.59 -1.57 0.00 0.00 179.24 177.98 1ya6 n ASN 1102N -2.61 2.42 -4.64 6.45 4.13 -0.53 -4.97 115.26 115.51 1ya6 n ASN 1102Ca 0.04 -3.57 -0.41 0.00 1.68 0.00 0.00 54.58 52.32 1ya6 n ASN 1102Cb 0.44 -0.55 -0.06 0.00 -1.54 0.00 0.00 39.78 38.07 1ya6 n ASN 1102CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ya6 s ILE 1103N -3.11 4.97 -0.07 2.41 1.01 -1.07 -4.97 121.20 120.36 1ya6 s ILE 1103Ca 0.40 1.23 -0.34 0.00 0.00 0.00 0.00 60.65 61.93 1ya6 s ILE 1103Cb 0.36 -3.97 -0.17 0.00 0.01 0.00 0.00 42.46 38.69 1ya6 s ILE 1103CO -0.00 0.03 0.97 0.29 0.00 0.00 0.00 174.94 176.23 1ya6 n LYS 1104N 5.57 0.00 0.26 2.79 5.02 -1.26 -4.74 118.16 125.80 1ya6 n LYS 1104Ca 0.00 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.47 1ya6 n LYS 1104Cb 0.49 -1.26 0.86 0.00 -0.02 0.00 0.00 35.03 35.10 1ya6 n LYS 1104CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1ya6 h PRO 1105N 2.79 0.00 0.00 1.97 0.11 -1.98 -0.54 132.00 134.35 1ya6 h PRO 1105Ca -0.42 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.63 1ya6 h PRO 1105Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1ya6 h PRO 1105CO 0.59 0.00 -0.42 0.66 -0.21 0.00 0.00 178.00 178.62 1ya6 h SER 1106N 0.00 0.00 -3.12 -2.05 4.64 -1.99 -3.45 113.55 107.58 1ya6 h SER 1106Ca 0.06 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.84 1ya6 h SER 1106Cb 0.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1ya6 h SER 1106CO -0.00 0.27 0.63 -0.63 -0.87 0.00 0.00 176.83 176.23 1ya6 s ILE 1107N -3.09 4.01 -0.37 0.95 1.01 -0.21 -4.97 121.20 118.52 1ya6 s ILE 1107Ca 0.04 1.42 -0.27 0.00 0.00 0.00 0.00 60.65 61.84 1ya6 s ILE 1107Cb 0.07 -3.91 0.02 0.00 0.01 0.00 0.00 42.46 38.65 1ya6 s ILE 1107CO 0.72 0.07 0.99 -0.60 0.00 0.00 0.00 174.94 176.13 1ya6 s ARG 1108N 1.49 3.87 -0.31 2.79 3.52 -0.89 -4.90 118.95 124.52 1ya6 s ARG 1108Ca 0.59 0.68 -0.19 0.00 -0.13 0.00 0.00 55.73 56.68 1ya6 s ARG 1108Cb -0.29 -3.80 -0.01 0.00 -1.56 0.00 0.00 34.95 29.29 1ya6 s ARG 1108CO 0.27 -1.00 0.59 0.08 -0.81 0.00 0.00 175.30 174.43 1ya6 s VAL 1109N 3.66 4.97 -0.21 7.11 1.01 -1.26 -1.60 120.40 134.08 1ya6 s VAL 1109Ca 0.41 0.74 -0.05 0.00 0.00 0.00 0.00 61.98 63.08 1ya6 s VAL 1109Cb -0.11 -3.97 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1ya6 s VAL 1109CO 0.20 -0.13 -0.00 -0.69 0.00 0.00 0.00 175.10 174.47 1ya6 s VAL 1110N 2.53 3.85 -0.18 2.92 1.01 0.19 0.67 120.40 131.39 1ya6 s VAL 1110Ca 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 1ya6 s VAL 1110Cb -0.15 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 1ya6 s VAL 1110CO 0.12 0.41 -0.06 -0.69 0.00 0.00 0.00 175.10 174.88 1ya6 s VAL 1111N 1.20 3.47 -0.23 2.92 1.01 0.63 -0.70 120.40 128.69 1ya6 s VAL 1111Ca 0.03 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 1ya6 s VAL 1111Cb -0.15 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 1ya6 s VAL 1111CO 0.01 0.47 0.05 -0.31 0.00 0.00 0.00 175.10 175.32 1ya6 s TYR 1112N 0.87 3.09 -0.77 5.22 2.02 -0.87 -1.09 117.35 125.83 1ya6 s TYR 1112Ca -0.01 -0.36 -0.17 0.00 -0.37 0.00 0.00 57.07 56.15 1ya6 s TYR 1112Cb -0.15 -2.18 0.15 0.00 -0.40 0.00 0.00 41.96 39.39 1ya6 s TYR 1112CO 0.01 -0.26 0.84 -1.14 -1.57 0.00 0.00 175.55 173.43 1ya6 s GLN 1113N 1.29 3.39 0.48 -0.62 2.00 0.73 -4.63 119.66 122.29 1ya6 s GLN 1113Ca 0.05 -1.85 0.29 0.00 -2.00 0.00 0.00 55.36 51.84 1ya6 s GLN 1113Cb -0.15 -4.51 0.97 0.00 0.80 0.00 0.00 33.01 30.13 1ya6 s GLN 1113CO 0.03 -1.51 1.83 0.45 -0.50 0.00 0.00 175.29 175.59 1ya6 h HIS 1114N 8.59 0.00 -3.28 1.67 3.86 -1.85 -3.36 115.15 120.79 1ya6 h HIS 1114Ca -0.03 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.61 1ya6 h HIS 1114Cb 1.05 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.47 1ya6 h HIS 1114CO 0.99 0.00 0.47 -0.51 0.86 0.00 0.00 177.93 179.74 1ya6 s ASP 1115N -5.71 7.07 -0.63 2.45 -0.00 -1.26 -4.97 116.67 113.62 1ya6 s ASP 1115Ca 0.04 1.32 0.05 0.00 -0.00 0.00 0.00 52.55 53.96 1ya6 s ASP 1115Cb 0.08 -2.49 0.30 0.00 -0.00 0.00 0.00 42.92 40.80 1ya6 s ASP 1115CO 0.58 -0.42 0.88 0.00 -0.00 0.00 0.00 175.17 176.21 1ya6 n HIS 1116N 5.16 3.82 -3.59 4.23 1.44 -1.26 -4.88 115.22 120.14 1ya6 n HIS 1116Ca 0.06 -4.02 -0.16 0.00 -2.01 0.00 0.00 57.72 51.59 1ya6 n HIS 1116Cb 0.49 -0.55 -0.07 0.00 0.12 0.00 0.00 29.99 29.98 1ya6 n HIS 1116CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1ya6 s SER 1117N -2.94 -0.68 0.27 4.39 0.15 -1.26 -4.82 113.70 108.80 1ya6 s SER 1117Ca 0.44 1.08 0.04 0.00 0.70 0.00 0.00 55.95 58.21 1ya6 s SER 1117Cb 0.21 1.02 0.37 0.00 -1.71 0.00 0.00 66.02 65.91 1ya6 s SER 1117CO -0.07 -0.40 1.66 -0.37 1.20 0.00 0.00 173.24 175.26 1ya6 h VAL 1118N 3.61 1.31 -0.46 4.45 -1.51 -1.99 -1.97 116.25 119.69 1ya6 h VAL 1118Ca -0.28 -1.54 0.12 0.00 -1.23 0.00 0.00 66.70 63.77 1ya6 h VAL 1118Cb 1.15 1.64 -0.02 0.00 -2.13 0.00 0.00 31.29 31.93 1ya6 h VAL 1118CO 0.21 0.47 0.33 0.25 -1.23 0.00 0.00 177.57 177.60 1ya6 h LEU 1119N 0.29 0.06 0.00 4.19 6.46 -2.01 -3.41 115.31 120.90 1ya6 h LEU 1119Ca 0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1ya6 h LEU 1119Cb 0.85 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.77 1ya6 h LEU 1119CO 0.07 0.03 0.00 -1.54 -0.62 0.00 0.00 178.44 176.38 1ya6 n SER 1120N -4.42 -0.91 0.00 1.25 3.41 -0.74 -3.44 113.62 108.77 1ya6 n SER 1120Ca 0.08 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1ya6 n SER 1120Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1ya6 n SER 1120CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ya6 n LEU 1121N 0.00 0.00 0.05 1.04 4.77 -1.26 -4.27 117.00 117.33 1ya6 n LEU 1121Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 1ya6 n LEU 1121Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1ya6 n LEU 1121CO 0.00 0.00 -0.53 0.03 -1.33 0.00 0.00 177.39 175.56 1ya6 h ARG 1122N 0.03 0.29 -0.19 3.23 3.08 -1.78 -3.24 114.38 115.80 1ya6 h ARG 1122Ca 0.00 -0.49 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1ya6 h ARG 1122Cb 0.00 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1ya6 h ARG 1122CO 0.00 1.16 0.00 0.54 -1.07 0.00 0.00 179.97 180.60 1ya6 n ARG 1123N -3.47 1.16 -4.78 0.04 3.00 -1.26 -4.76 116.66 106.58 1ya6 n ARG 1123Ca -0.23 -0.21 -0.33 0.00 -0.01 0.00 0.00 57.85 57.07 1ya6 n ARG 1123Cb 1.06 -1.12 -0.13 0.00 0.00 0.00 0.00 32.46 32.27 1ya6 n ARG 1123CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1ya6 s ASN 1124N -0.86 4.17 0.14 0.55 -0.87 -1.23 -3.32 114.94 113.53 1ya6 s ASN 1124Ca 0.04 -0.21 0.11 0.00 -1.57 0.00 0.00 52.86 51.23 1ya6 s ASN 1124Cb 0.02 -1.21 -0.04 0.00 -0.02 0.00 0.00 41.25 40.01 1ya6 s ASN 1124CO 0.02 0.28 -0.24 -0.76 -2.57 0.00 0.00 177.10 173.83 1ya6 s LEU 1125N -0.33 2.43 -1.60 0.60 1.43 -0.96 -4.60 118.68 115.65 1ya6 s LEU 1125Ca 0.03 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1ya6 s LEU 1125Cb -0.13 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 44.82 1ya6 s LEU 1125CO 0.02 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.38 1ya6 n GLY 1126N 0.72 1.54 0.21 -3.19 0.00 -1.26 -4.26 105.19 98.95 1ya6 n GLY 1126Ca -0.16 -0.29 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 1ya6 n GLY 1126CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ya6 h LEU 1127N 0.00 0.77 -0.85 0.99 5.85 -1.96 -2.45 115.31 117.67 1ya6 h LEU 1127Ca -0.31 -0.48 -0.12 0.00 0.84 0.00 0.00 57.88 57.81 1ya6 h LEU 1127Cb 1.00 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1ya6 h LEU 1127CO 0.45 1.25 -0.56 -0.08 -0.34 0.00 0.00 178.44 179.16 1ya6 h GLU 1128N 0.46 0.00 0.00 1.25 4.81 -1.94 -2.00 114.58 117.17 1ya6 h GLU 1128Ca -0.03 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.07 1ya6 h GLU 1128Cb 1.31 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.67 1ya6 h GLU 1128CO 0.14 0.56 -0.61 0.93 -0.73 0.00 0.00 179.01 179.30 1ya6 h GLU 1129N 0.00 0.00 -0.22 1.92 3.07 -1.95 -2.45 114.58 114.95 1ya6 h GLU 1129Ca -0.01 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.70 1ya6 h GLU 1129Cb 1.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1ya6 h GLU 1129CO 0.07 0.61 -0.48 1.15 -1.40 0.00 0.00 179.01 178.96 1ya6 h THR 1130N 0.00 1.31 -0.21 1.13 2.02 -1.18 -2.92 112.91 113.06 1ya6 h THR 1130Ca -0.01 -1.70 -0.07 0.00 0.77 0.00 0.00 66.41 65.40 1ya6 h THR 1130Cb 1.34 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 69.55 1ya6 h THR 1130CO 0.08 0.54 -0.20 0.58 0.37 0.00 0.00 175.52 176.89 1ya6 h VAL 1131N 0.43 1.23 0.00 3.16 2.07 -1.31 -0.67 116.25 121.16 1ya6 h VAL 1131Ca 0.00 -1.08 -0.08 0.00 0.82 0.00 0.00 66.70 66.37 1ya6 h VAL 1131Cb 1.09 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1ya6 h VAL 1131CO 0.11 0.34 -0.36 0.03 0.02 0.00 0.00 177.57 177.70 1ya6 h ARG 1132N 0.33 0.00 0.00 1.57 3.08 -1.38 -3.15 114.38 114.82 1ya6 h ARG 1132Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1ya6 h ARG 1132Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1ya6 h ARG 1132CO 0.04 0.36 -1.31 -2.13 -1.07 0.00 0.00 179.97 175.86 1ya6 n ARG 1133N -3.51 0.35 -1.98 0.04 3.00 -1.05 -4.96 116.66 108.54 1ya6 n ARG 1133Ca -0.00 -0.05 -0.39 0.00 -0.00 0.00 0.00 57.85 57.40 1ya6 n ARG 1133Cb 0.51 -1.56 0.01 0.00 0.00 0.00 0.00 32.46 31.41 1ya6 n ARG 1133CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ya6 s ALA 1134N -3.26 3.12 -0.09 5.13 0.00 -0.29 -4.68 121.76 121.70 1ya6 s ALA 1134Ca 0.01 1.25 0.19 0.00 0.00 0.00 0.00 51.96 53.41 1ya6 s ALA 1134Cb 0.14 -3.51 -0.28 0.00 0.00 0.00 0.00 23.12 19.48 1ya6 s ALA 1134CO 0.85 -0.98 0.28 -0.25 0.00 0.00 0.00 175.76 175.66 1ya6 n ASP 1135N -0.26 0.43 -3.78 0.00 9.92 0.21 -4.65 116.55 118.42 1ya6 n ASP 1135Ca 0.06 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.19 1ya6 n ASP 1135Cb 0.44 1.52 -0.12 0.00 -0.64 0.00 0.00 41.12 42.32 1ya6 n ASP 1135CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1ya6 s VAL 1136N -3.00 -0.01 -0.03 2.53 1.01 -1.02 -4.82 120.40 115.06 1ya6 s VAL 1136Ca -0.08 0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.97 1ya6 s VAL 1136Cb 0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 36.38 36.16 1ya6 s VAL 1136CO 0.80 0.02 -0.12 -0.63 0.00 0.00 0.00 175.10 175.16 1ya6 s ILE 1137N 0.41 1.02 0.00 2.22 1.01 -1.26 -0.27 121.20 124.33 1ya6 s ILE 1137Ca -0.02 -0.51 0.07 0.00 0.00 0.00 0.00 60.65 60.18 1ya6 s ILE 1137Cb -0.04 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1ya6 s ILE 1137CO -0.02 0.30 -0.21 -0.36 0.00 0.00 0.00 174.94 174.66 1ya6 s PHE 1138N -0.00 1.84 0.29 3.97 0.40 -0.25 -0.88 117.98 123.36 1ya6 s PHE 1138Ca -0.01 -0.35 0.03 0.00 -0.60 0.00 0.00 56.93 56.00 1ya6 s PHE 1138Cb -0.08 -1.16 -0.04 0.00 0.51 0.00 0.00 43.02 42.25 1ya6 s PHE 1138CO 0.01 0.00 0.16 -1.54 0.70 0.00 0.00 175.22 174.55 1ya6 s SER 1139N -0.68 1.38 0.24 1.36 1.04 -0.21 -0.19 113.70 116.64 1ya6 s SER 1139Ca 0.08 -1.55 0.23 0.00 0.48 0.00 0.00 55.95 55.19 1ya6 s SER 1139Cb -0.08 0.39 0.21 0.00 0.10 0.00 0.00 66.02 66.64 1ya6 s SER 1139CO -0.00 -0.89 1.28 0.45 0.98 0.00 0.00 173.24 175.06 1ya6 h HIS 1140N 2.26 0.00 -2.26 5.02 3.86 -1.84 -2.89 115.15 119.31 1ya6 h HIS 1140Ca -0.33 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 58.81 1ya6 h HIS 1140Cb 1.25 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.52 1ya6 h HIS 1140CO 0.99 0.00 0.05 0.45 0.86 0.00 0.00 177.93 180.28 1ya6 s SER 1141N -5.23 -0.58 -0.03 2.45 0.15 -1.26 -4.30 113.70 104.89 1ya6 s SER 1141Ca 0.03 0.80 -0.13 0.00 0.70 0.00 0.00 55.95 57.35 1ya6 s SER 1141Cb 0.10 0.75 -0.32 0.00 -1.71 0.00 0.00 66.02 64.84 1ya6 s SER 1141CO 0.74 -0.45 0.75 0.44 1.20 0.00 0.00 173.24 175.92 1ya6 h ASP 1142N 3.90 0.65 -0.81 5.45 3.32 -1.92 -3.35 116.42 123.66 1ya6 h ASP 1142Ca -0.28 -0.93 -0.67 0.00 0.02 0.00 0.00 57.03 55.17 1ya6 h ASP 1142Cb 1.16 -0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.40 1ya6 h ASP 1142CO 0.30 1.74 2.42 0.59 -1.72 0.00 0.00 179.24 182.56 1ya6 n ASN 1143N -3.69 7.93 -4.13 6.45 3.02 -1.26 -4.66 115.26 118.93 1ya6 n ASN 1143Ca -0.22 -2.98 -0.12 0.00 -0.03 0.00 0.00 54.58 51.23 1ya6 n ASN 1143Cb 1.06 -1.40 -0.09 0.00 -0.61 0.00 0.00 39.78 38.74 1ya6 n ASN 1143CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ya6 s GLY 1144N 0.88 1.33 0.24 7.41 0.00 -1.26 -4.25 107.32 111.67 1ya6 s GLY 1144Ca 0.59 -1.58 -0.12 0.00 0.00 0.00 0.00 44.72 43.60 1ya6 s GLY 1144CO -0.10 -1.28 1.58 -1.80 0.00 0.00 0.00 173.10 171.50 1ya6 h ASP 1145N 2.54 -0.96 -0.86 1.64 -0.00 -1.90 -1.81 116.42 115.08 1ya6 h ASP 1145Ca -0.34 0.27 0.21 0.00 -0.00 0.00 0.00 57.03 57.17 1ya6 h ASP 1145Cb 1.25 0.58 -0.15 0.00 -0.00 0.00 0.00 39.33 41.01 1ya6 h ASP 1145CO 0.49 -0.29 0.01 0.15 -0.00 0.00 0.00 179.24 179.60 1ya6 h PHE 1146N -0.02 -0.06 -3.30 0.28 3.57 -1.92 -3.51 116.94 111.97 1ya6 h PHE 1146Ca 0.39 0.06 -0.57 0.00 3.53 0.00 0.00 57.97 61.38 1ya6 h PHE 1146Cb 0.62 0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.48 1ya6 h PHE 1146CO -0.71 -0.31 -0.01 -0.80 -2.23 0.00 0.00 178.31 174.25 1ya6 s ASN 1147N -5.14 6.99 0.03 0.41 -0.87 -0.68 -5.22 114.94 110.46 1ya6 s ASN 1147Ca -0.13 1.18 -0.15 0.00 -1.57 0.00 0.00 52.86 52.18 1ya6 s ASN 1147Cb 0.25 -2.37 -0.08 0.00 -0.02 0.00 0.00 41.25 39.03 1ya6 s ASN 1147CO 0.76 0.12 1.24 1.55 -2.57 0.00 0.00 177.10 178.20 1ya6 h PRO 1169N 5.51 -0.47 -5.18 -0.60 0.13 -1.83 -3.49 132.00 126.07 1ya6 h PRO 1169Ca -0.46 0.03 -0.62 0.00 -0.87 0.00 0.00 66.00 64.09 1ya6 h PRO 1169Cb 1.20 0.11 -0.14 0.00 0.13 0.00 0.00 31.00 32.30 1ya6 h PRO 1169CO 0.69 -0.31 -0.33 0.99 -0.23 0.00 0.00 178.00 178.81 1ya6 s THR 1170N -4.22 5.25 -0.34 1.56 2.01 -1.26 -5.05 115.64 113.59 1ya6 s THR 1170Ca -0.08 0.46 -0.17 0.00 0.31 0.00 0.00 61.69 62.21 1ya6 s THR 1170Cb 0.01 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 1ya6 s THR 1170CO 0.25 0.24 0.46 -0.69 -0.69 0.00 0.00 174.62 174.20 1ya6 s VAL 1171N 1.55 5.07 0.31 3.82 1.01 -1.26 -4.07 120.40 126.83 1ya6 s VAL 1171Ca 0.13 0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.46 1ya6 s VAL 1171Cb -0.15 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1ya6 s VAL 1171CO 0.08 -0.14 0.47 -0.31 0.00 0.00 0.00 175.10 175.20 1ya6 s TYR 1172N 2.26 3.36 0.23 5.22 2.02 -0.05 -4.93 117.35 125.46 1ya6 s TYR 1172Ca 0.17 0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.93 1ya6 s TYR 1172Cb -0.16 -1.83 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 1ya6 s TYR 1172CO 0.12 0.17 0.41 1.21 -1.57 0.00 0.00 175.55 175.89 1ya6 s ASN 1173N -4.06 6.36 0.22 2.29 3.84 -1.26 -1.05 114.94 121.28 1ya6 s ASN 1173Ca 0.40 0.36 -0.18 0.00 0.21 0.00 0.00 52.86 53.65 1ya6 s ASN 1173Cb -0.09 -1.99 0.02 0.00 -0.55 0.00 0.00 41.25 38.64 1ya6 s ASN 1173CO 0.32 -0.08 0.56 0.72 -2.79 0.00 0.00 177.10 175.83 1ya6 s PHE 1174N -1.95 -0.06 -0.02 0.43 -0.12 -1.09 -4.84 117.98 110.33 1ya6 s PHE 1174Ca 0.38 -0.31 0.03 0.00 -0.05 0.00 0.00 56.93 56.99 1ya6 s PHE 1174Cb -0.11 0.43 -0.00 0.00 -0.63 0.00 0.00 43.02 42.71 1ya6 s PHE 1174CO 0.30 -1.00 -0.12 -0.65 -0.05 0.00 0.00 175.22 173.70 1ya6 s GLN 1175N -3.91 1.18 -0.84 1.99 -0.21 -1.26 -4.64 119.66 111.98 1ya6 s GLN 1175Ca 0.12 -0.43 -0.25 0.00 0.02 0.00 0.00 55.36 54.82 1ya6 s GLN 1175Cb -0.02 -1.09 0.01 0.00 1.00 0.00 0.00 33.01 32.90 1ya6 s GLN 1175CO 0.01 0.20 1.60 -1.25 -2.12 0.00 0.00 175.29 173.74 1ya6 s PRO 1176N -0.02 3.05 1.03 2.91 0.04 -1.26 -4.90 135.00 135.85 1ya6 s PRO 1176Ca -0.00 -0.36 -0.13 0.00 0.04 0.00 0.00 61.00 60.55 1ya6 s PRO 1176Cb -0.08 -4.79 0.21 0.00 0.04 0.00 0.00 34.50 29.87 1ya6 s PRO 1176CO 0.00 -2.57 1.09 -1.25 0.04 0.00 0.00 177.00 174.31 1ya6 s PRO 1177N 6.06 0.16 -0.05 0.56 0.05 -1.26 -4.82 135.00 135.70 1ya6 s PRO 1177Ca 0.53 0.50 -0.24 0.00 0.05 0.00 0.00 61.00 61.84 1ya6 s PRO 1177Cb -0.06 -1.71 0.05 0.00 0.05 0.00 0.00 34.50 32.83 1ya6 s PRO 1177CO 0.05 -2.91 0.53 1.41 0.05 0.00 0.00 177.00 176.13 1ya6 s MET 1178N -4.92 0.88 -1.20 4.56 1.75 -0.91 -4.83 119.30 114.63 1ya6 s MET 1178Ca 0.66 0.14 -0.17 0.00 -1.25 0.00 0.00 55.69 55.07 1ya6 s MET 1178Cb -0.19 0.41 0.11 0.00 2.84 0.00 0.00 34.83 37.99 1ya6 s MET 1178CO 0.58 -0.25 1.54 0.34 -0.65 0.00 0.00 175.02 176.58 1ya6 s ASP 1179N -1.10 6.85 0.43 1.11 -1.08 -1.26 -0.47 116.67 121.15 1ya6 s ASP 1179Ca -0.11 -2.46 0.10 0.00 -0.52 0.00 0.00 52.55 49.56 1ya6 s ASP 1179Cb -0.02 -2.50 0.94 0.00 -1.46 0.00 0.00 42.92 39.88 1ya6 s ASP 1179CO 0.07 -1.06 2.03 0.40 0.52 0.00 0.00 175.17 177.12 1ya6 h ILE 1180N 5.46 1.10 -0.11 4.11 2.04 -1.94 -2.64 117.51 125.54 1ya6 h ILE 1180Ca 0.35 -0.37 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ya6 h ILE 1180Cb 0.90 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1ya6 h ILE 1180CO 1.35 0.13 0.04 0.58 0.00 0.00 0.00 178.15 180.25 1ya6 h VAL 1181N 0.27 0.97 -0.20 1.67 2.07 -1.97 -2.59 116.25 116.48 1ya6 h VAL 1181Ca 0.07 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1ya6 h VAL 1181Cb 0.13 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1ya6 h VAL 1181CO -0.00 0.02 0.11 0.50 0.02 0.00 0.00 177.57 178.21 1ya6 h LYS 1182N 0.09 0.22 -0.50 1.57 3.64 -1.89 -2.89 116.57 116.82 1ya6 h LYS 1182Ca 0.05 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1ya6 h LYS 1182Cb 0.03 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1ya6 h LYS 1182CO -0.05 0.15 0.24 0.28 -2.27 0.00 0.00 179.45 177.80 1ya6 h VAL 1183N 0.23 0.94 0.20 2.00 2.07 -1.40 -2.94 116.25 117.34 1ya6 h VAL 1183Ca 0.08 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1ya6 h VAL 1183Cb 0.00 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1ya6 h VAL 1183CO -0.04 0.09 -0.23 -0.09 0.02 0.00 0.00 177.57 177.31 1ya6 h ARG 1184N 0.47 -0.42 0.00 1.57 2.43 -1.35 -0.93 114.38 116.15 1ya6 h ARG 1184Ca 0.22 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1ya6 h ARG 1184Cb 0.15 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1ya6 h ARG 1184CO -0.17 -0.28 0.02 -1.13 -1.51 0.00 0.00 179.97 176.90 1ya6 n SER 1185N -3.76 0.00 -0.05 -3.80 3.41 -1.10 -0.18 113.62 108.13 1ya6 n SER 1185Ca -0.05 0.04 -0.09 0.00 -0.26 0.00 0.00 58.87 58.51 1ya6 n SER 1185Cb 0.21 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.08 1ya6 n SER 1185CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1ya6 n THR 1186N -0.86 0.58 -0.04 6.66 -1.04 -0.72 -4.87 114.28 113.98 1ya6 n THR 1186Ca 0.00 -0.19 -0.03 0.00 -2.04 0.00 0.00 64.05 61.79 1ya6 n THR 1186Cb 0.02 -1.17 -0.08 0.00 -1.82 0.00 0.00 70.33 67.28 1ya6 n THR 1186CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1ya6 n TYR 1187N -3.07 0.00 -1.61 -1.42 4.02 -0.43 -5.00 117.16 109.65 1ya6 n TYR 1187Ca -0.19 0.00 -0.63 0.00 -0.01 0.00 0.00 57.90 57.07 1ya6 n TYR 1187Cb 0.67 -0.45 -0.10 0.00 -0.02 0.00 0.00 39.34 39.45 1ya6 n TYR 1187CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 1ya6 n TRP 1188N -2.27 1.70 -3.05 -0.72 -0.00 0.74 -4.82 117.44 109.02 1ya6 n TRP 1188Ca -0.13 0.86 -0.19 0.00 -0.00 0.00 0.00 57.50 58.03 1ya6 n TRP 1188Cb 0.72 -2.32 0.04 0.00 -0.00 0.00 0.00 31.31 29.75 1ya6 n TRP 1188CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1ya6 s LYS 1189N 4.01 2.46 -0.07 5.87 -0.14 -1.26 -4.96 119.74 125.64 1ya6 s LYS 1189Ca 1.07 -1.53 -0.20 0.00 -1.36 0.00 0.00 55.97 53.95 1ya6 s LYS 1189Cb -1.35 -2.67 -0.04 0.00 -1.68 0.00 0.00 37.83 32.09 1ya6 s LYS 1189CO 0.72 -0.68 0.56 0.34 -0.76 0.00 0.00 175.35 175.53 1ya6 s ASP 1190N -4.56 6.83 0.22 2.83 -1.08 -1.26 -4.96 116.67 114.69 1ya6 s ASP 1190Ca 0.59 0.99 -0.07 0.00 -0.52 0.00 0.00 52.55 53.54 1ya6 s ASP 1190Cb -0.07 -2.33 0.34 0.00 -1.46 0.00 0.00 42.92 39.40 1ya6 s ASP 1190CO 0.37 0.01 1.25 0.55 0.52 0.00 0.00 175.17 177.87 1ya6 n VAL 1191N 3.39 -0.35 0.11 1.11 3.14 -1.26 0.15 118.33 124.62 1ya6 n VAL 1191Ca -0.06 1.84 0.04 0.00 -2.96 0.00 0.00 64.34 63.20 1ya6 n VAL 1191Cb 0.51 -2.53 0.20 0.00 -1.06 0.00 0.00 33.84 30.96 1ya6 n VAL 1191CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1ya6 n SER 1192N -5.29 0.19 -0.00 6.55 3.41 -1.26 0.41 113.62 117.62 1ya6 n SER 1192Ca 0.12 0.41 0.09 0.00 -0.26 0.00 0.00 58.87 59.24 1ya6 n SER 1192Cb 0.39 -0.35 -0.12 0.00 -0.26 0.00 0.00 64.21 63.87 1ya6 n SER 1192CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ya6 n GLU 1193N -1.75 0.67 -2.77 4.33 1.02 0.40 -4.92 120.64 117.62 1ya6 n GLU 1193Ca -0.00 -0.05 -0.43 0.00 -0.02 0.00 0.00 57.16 56.66 1ya6 n GLU 1193Cb 0.36 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.32 1ya6 n GLU 1193CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ya6 s ILE 1194N -2.95 4.47 -0.45 -3.67 1.01 0.17 -4.83 121.20 114.95 1ya6 s ILE 1194Ca 0.03 1.05 -0.28 0.00 0.00 0.00 0.00 60.65 61.45 1ya6 s ILE 1194Cb 0.14 -4.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.17 1ya6 s ILE 1194CO 0.79 -0.73 1.75 0.21 0.00 0.00 0.00 174.94 176.96 1ya6 s ASN 1195N 2.12 5.75 0.00 3.58 3.84 -1.21 -4.69 114.94 124.33 1ya6 s ASN 1195Ca 0.40 0.86 0.12 0.00 0.21 0.00 0.00 52.86 54.45 1ya6 s ASN 1195Cb -0.10 -2.53 0.53 0.00 -0.55 0.00 0.00 41.25 38.60 1ya6 s ASN 1195CO 0.24 -1.90 1.37 0.23 -2.79 0.00 0.00 177.10 174.25 1ya6 n MET 1196N 8.65 0.03 -0.46 0.43 2.81 -1.26 -0.18 117.12 127.13 1ya6 n MET 1196Ca 0.21 0.27 0.08 0.00 -1.81 0.00 0.00 57.70 56.45 1ya6 n MET 1196Cb 0.49 -1.50 0.29 0.00 -0.71 0.00 0.00 33.22 31.79 1ya6 n MET 1196CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1ya6 n ASN 1197N -1.46 3.81 -4.16 7.83 3.02 -1.26 -4.68 115.26 118.35 1ya6 n ASN 1197Ca 0.03 -2.29 -0.33 0.00 -0.03 0.00 0.00 54.58 51.97 1ya6 n ASN 1197Cb 0.13 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.65 1ya6 n ASN 1197CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ya6 s ILE 1198N -1.67 2.12 -0.24 2.41 -1.09 -1.12 -1.14 121.20 120.46 1ya6 s ILE 1198Ca 0.41 -0.95 -0.04 0.00 -2.23 0.00 0.00 60.65 57.85 1ya6 s ILE 1198Cb 0.26 -1.86 0.00 0.00 -1.58 0.00 0.00 42.46 39.28 1ya6 s ILE 1198CO 0.22 0.54 -0.03 0.20 -1.23 0.00 0.00 174.94 174.63 1ya6 s ASN 1199N 0.99 4.39 -0.16 3.58 -0.87 -0.11 -1.92 114.94 120.83 1ya6 s ASN 1199Ca -0.03 -0.58 -0.03 0.00 -1.57 0.00 0.00 52.86 50.66 1ya6 s ASN 1199Cb -0.15 -1.73 -0.02 0.00 -0.02 0.00 0.00 41.25 39.33 1ya6 s ASN 1199CO -0.06 -0.07 -0.07 -0.60 -2.57 0.00 0.00 177.10 173.73 1ya6 s ARG 1200N 1.43 3.52 -0.11 -0.60 3.52 0.12 0.69 118.95 127.53 1ya6 s ARG 1200Ca 0.04 -0.59 -0.01 0.00 -0.13 0.00 0.00 55.73 55.04 1ya6 s ARG 1200Cb -0.15 -2.85 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 1ya6 s ARG 1200CO -0.03 0.14 -0.07 -0.46 -0.81 0.00 0.00 175.30 174.07 1ya6 s TRP 1201N 0.59 2.94 -0.01 5.12 -0.00 0.15 0.10 118.94 127.83 1ya6 s TRP 1201Ca -0.04 -0.21 0.04 0.00 -0.00 0.00 0.00 56.10 55.88 1ya6 s TRP 1201Cb -0.15 -1.82 -0.01 0.00 -0.00 0.00 0.00 33.47 31.50 1ya6 s TRP 1201CO 0.03 0.11 -0.13 0.96 -0.00 0.00 0.00 176.95 177.92 1ya6 s ILE 1202N -0.20 0.99 -0.80 5.86 -4.36 -1.06 -0.56 121.20 121.06 1ya6 s ILE 1202Ca 0.02 -0.55 0.00 0.00 -0.26 0.00 0.00 60.65 59.86 1ya6 s ILE 1202Cb -0.13 -0.83 0.00 0.00 1.25 0.00 0.00 42.46 42.75 1ya6 s ILE 1202CO 0.03 0.27 0.00 0.61 0.24 0.00 0.00 174.94 176.08 1ya6 n GLY 1203N 2.74 -0.68 3.58 6.27 0.00 -1.00 -4.76 105.19 111.33 1ya6 n GLY 1203Ca -0.14 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.44 1ya6 n GLY 1203CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ya6 s ARG 1204N -1.30 1.74 -1.26 1.61 1.70 -1.26 -4.27 118.95 115.91 1ya6 s ARG 1204Ca 0.00 -1.45 -0.12 0.00 -0.47 0.00 0.00 55.73 53.69 1ya6 s ARG 1204Cb 0.00 0.48 -0.06 0.00 -0.57 0.00 0.00 34.95 34.80 1ya6 s ARG 1204CO 0.00 -0.74 2.38 2.41 -1.08 0.00 0.00 175.30 178.28 1ya6 n THR 1205N -0.46 3.20 -4.04 4.99 -1.04 -1.26 -4.77 114.28 110.91 1ya6 n THR 1205Ca -0.01 -2.25 -0.17 0.00 -2.04 0.00 0.00 64.05 59.58 1ya6 n THR 1205Cb 0.62 -2.45 -0.15 0.00 -1.82 0.00 0.00 70.33 66.52 1ya6 n THR 1205CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ya6 s THR 1206N 3.23 0.30 0.37 12.58 2.01 -1.26 -4.76 115.64 128.12 1ya6 s THR 1206Ca 0.54 -0.05 0.20 0.00 0.31 0.00 0.00 61.69 62.69 1ya6 s THR 1206Cb 0.14 -0.33 0.38 0.00 0.01 0.00 0.00 72.50 72.70 1ya6 s THR 1206CO -0.03 0.14 1.65 0.71 -0.69 0.00 0.00 174.62 176.40 1ya6 h THR 1207N 5.78 0.23 0.00 -0.82 1.35 -1.99 -1.08 112.91 116.38 1ya6 h THR 1207Ca -0.36 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1ya6 h THR 1207Cb 1.16 -0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1ya6 h THR 1207CO 0.49 0.04 0.00 -2.67 -0.25 0.00 0.00 175.52 173.13 1ya6 n TRP 1208N -4.95 0.00 1.35 4.73 4.27 -1.26 -1.79 117.44 119.79 1ya6 n TRP 1208Ca 0.33 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 54.09 1ya6 n TRP 1208Cb 1.13 -0.03 0.63 0.00 -1.36 0.00 0.00 31.31 31.68 1ya6 n TRP 1208CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1ya6 n LYS 1209N -1.03 0.51 -2.75 -2.67 4.76 -0.41 -1.07 118.16 115.50 1ya6 n LYS 1209Ca 0.16 -0.13 -0.09 0.00 -2.87 0.00 0.00 58.31 55.37 1ya6 n LYS 1209Cb 0.08 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 31.80 1ya6 n LYS 1209CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ya6 n GLY 1210N 1.32 0.28 0.17 0.72 0.00 -0.74 -3.80 105.19 103.13 1ya6 n GLY 1210Ca 0.13 -0.36 0.04 0.00 0.00 0.00 0.00 46.02 45.84 1ya6 n GLY 1210CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1ya6 h PHE 1211N -0.83 0.00 0.16 1.61 -0.00 -1.84 -2.92 116.94 113.13 1ya6 h PHE 1211Ca -0.22 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 57.74 1ya6 h PHE 1211Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 1ya6 h PHE 1211CO 0.21 0.43 -0.08 1.88 -0.00 0.00 0.00 178.31 180.75 1ya6 h TYR 1212N 0.00 -0.20 -0.84 6.09 0.99 -1.93 -2.07 116.97 119.01 1ya6 h TYR 1212Ca -0.00 -0.00 0.24 0.00 2.00 0.00 0.00 58.73 60.96 1ya6 h TYR 1212Cb 1.05 0.07 -0.03 0.00 1.00 0.00 0.00 36.73 38.81 1ya6 h TYR 1212CO 0.00 0.23 0.64 1.96 -0.00 0.00 0.00 178.16 180.99 1ya6 h GLN 1213N -0.73 0.00 -0.05 4.88 7.50 -1.95 0.11 115.11 124.86 1ya6 h GLN 1213Ca -0.02 0.00 -0.11 0.00 0.50 0.00 0.00 58.65 59.01 1ya6 h GLN 1213Cb 0.51 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.05 1ya6 h GLN 1213CO 0.04 0.00 -0.41 1.98 -1.50 0.00 0.00 178.83 178.94 1ya6 h MET 1214N 0.00 0.37 -0.43 1.46 4.05 -1.31 -1.77 114.93 117.30 1ya6 h MET 1214Ca 0.40 -0.33 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 1ya6 h MET 1214Cb 1.68 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 32.53 1ya6 h MET 1214CO -0.00 0.98 0.19 0.74 0.23 0.00 0.00 176.91 179.05 1ya6 h PHE 1215N -0.12 0.60 0.62 1.39 0.04 -0.15 -1.98 116.94 117.33 1ya6 h PHE 1215Ca -0.04 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.69 1ya6 h PHE 1215Cb 1.08 -0.19 0.01 0.00 2.20 0.00 0.00 35.95 39.05 1ya6 h PHE 1215CO 0.13 0.46 -0.30 0.22 -0.60 0.00 0.00 178.31 178.23 1ya6 h ASP 1216N 0.61 -0.70 -0.92 2.17 -0.00 -1.07 -2.60 116.42 113.91 1ya6 h ASP 1216Ca 0.15 0.02 0.27 0.00 -0.00 0.00 0.00 57.03 57.46 1ya6 h ASP 1216Cb 0.09 0.18 -0.15 0.00 -0.00 0.00 0.00 39.33 39.46 1ya6 h ASP 1216CO -0.02 -0.31 0.33 0.15 -0.00 0.00 0.00 179.24 179.39 1ya6 h PHE 1217N -1.21 0.51 -0.01 0.28 3.57 -1.14 0.22 116.94 119.16 1ya6 h PHE 1217Ca -0.08 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 1ya6 h PHE 1217Cb 0.64 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 1ya6 h PHE 1217CO 0.00 -0.22 0.00 1.25 -2.23 0.00 0.00 178.31 177.11 1ya6 h HIS 1218N 0.23 0.01 -0.28 0.41 2.76 -1.39 0.56 115.15 117.46 1ya6 h HIS 1218Ca 0.61 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.75 1ya6 h HIS 1218Cb 1.30 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.25 1ya6 h HIS 1218CO -0.20 0.25 0.05 1.49 -1.30 0.00 0.00 177.93 178.22 1ya6 h GLU 1219N -0.23 0.40 0.00 5.26 4.81 -0.38 0.60 114.58 125.05 1ya6 h GLU 1219Ca 0.00 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 1ya6 h GLU 1219Cb 0.24 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1ya6 h GLU 1219CO 0.00 0.39 -1.48 1.63 -0.73 0.00 0.00 179.01 178.82 1ya6 n LYS 1220N -4.37 0.62 0.10 1.92 5.02 0.50 -4.66 118.16 117.30 1ya6 n LYS 1220Ca 0.01 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1ya6 n LYS 1220Cb 0.17 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 1ya6 n LYS 1220CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1ya6 n PHE 1221N -2.92 -1.56 -0.08 2.13 3.01 0.16 -4.81 117.46 113.40 1ya6 n PHE 1221Ca -0.11 0.28 -0.07 0.00 1.01 0.00 0.00 57.45 58.55 1ya6 n PHE 1221Cb 0.88 0.37 -0.01 0.00 -0.01 0.00 0.00 39.48 40.72 1ya6 n PHE 1221CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1ya6 h LEU 1222N 0.00 -0.65 -0.01 4.37 3.38 -1.30 -2.40 115.31 118.70 1ya6 h LEU 1222Ca 0.00 0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ya6 h LEU 1222Cb 0.00 0.33 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1ya6 h LEU 1222CO 0.00 -0.23 0.00 0.50 0.09 0.00 0.00 178.44 178.80 1ya6 h LYS 1223N -0.17 0.01 -0.57 1.13 3.64 0.01 -0.67 116.57 119.95 1ya6 h LYS 1223Ca 0.16 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.65 1ya6 h LYS 1223Cb 0.41 -0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.12 1ya6 h LYS 1223CO -0.40 0.08 -0.17 -1.35 -2.27 0.00 0.00 179.45 175.34 1ya6 h PRO 1224N -0.07 -0.03 -1.11 1.90 0.11 -1.68 0.54 132.00 131.67 1ya6 h PRO 1224Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ya6 h PRO 1224Cb 0.07 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.19 1ya6 h PRO 1224CO -0.00 -0.02 0.00 0.00 -0.21 0.00 0.00 178.00 177.77 1ya6 n ALA 1225N -3.00 2.25 -1.20 -0.75 0.00 -0.93 -4.75 120.51 112.12 1ya6 n ALA 1225Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 1ya6 n ALA 1225Cb 0.31 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 1ya6 n ALA 1225CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ya6 n GLY 1226N 0.49 0.97 3.84 0.00 0.00 0.18 -4.93 105.19 105.75 1ya6 n GLY 1226Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ya6 n GLY 1226CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ya6 s LYS 1227N -2.68 0.93 0.13 1.61 -0.14 -0.27 -4.10 119.74 115.23 1ya6 s LYS 1227Ca 0.00 -0.03 0.07 0.00 -1.36 0.00 0.00 55.97 54.65 1ya6 s LYS 1227Cb 0.00 -1.84 -0.04 0.00 -1.68 0.00 0.00 37.83 34.27 1ya6 s LYS 1227CO 0.00 -2.28 -0.17 -1.12 -0.76 0.00 0.00 175.35 171.03 1ya6 s SER 1228N -4.45 2.29 -0.04 2.83 0.01 -0.29 -4.13 113.70 109.92 1ya6 s SER 1228Ca 0.68 -0.80 0.02 0.00 1.31 0.00 0.00 55.95 57.16 1ya6 s SER 1228Cb -0.09 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.04 1ya6 s SER 1228CO 0.52 -0.07 -0.09 -0.89 0.41 0.00 0.00 173.24 173.12 1ya6 s THR 1229N -1.90 0.80 0.02 1.44 2.01 -1.26 -0.93 115.64 115.81 1ya6 s THR 1229Ca 0.10 -0.33 0.07 0.00 0.31 0.00 0.00 61.69 61.84 1ya6 s THR 1229Cb -0.06 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.69 1ya6 s THR 1229CO 0.04 0.26 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.35 1ya6 s VAL 1230N 0.44 1.59 -0.21 3.82 1.01 0.22 -1.71 120.40 125.57 1ya6 s VAL 1230Ca -0.07 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 60.85 1ya6 s VAL 1230Cb -0.11 -1.36 0.06 0.00 0.00 0.00 0.00 36.38 34.97 1ya6 s VAL 1230CO 0.01 0.29 0.02 -0.04 0.00 0.00 0.00 175.10 175.38 1ya6 s MET 1231N -0.88 0.88 -0.12 2.72 -1.94 -0.18 0.32 119.30 120.09 1ya6 s MET 1231Ca 0.07 -0.58 -0.07 0.00 -1.71 0.00 0.00 55.69 53.40 1ya6 s MET 1231Cb -0.08 -2.22 -0.04 0.00 2.01 0.00 0.00 34.83 34.50 1ya6 s MET 1231CO 0.01 -0.65 0.12 -1.21 -0.01 0.00 0.00 175.02 173.28 1ya6 s GLU 1232N 1.74 3.44 0.00 2.03 2.02 0.27 -0.60 118.70 127.60 1ya6 s GLU 1232Ca -0.02 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 54.81 1ya6 s GLU 1232Cb -0.18 -3.16 0.00 0.00 0.10 0.00 0.00 34.13 30.90 1ya6 s GLU 1232CO -0.08 0.74 0.00 0.41 0.02 0.00 0.00 175.26 176.35 1ya6 n GLY 1233N 2.10 0.23 3.56 -1.39 0.00 0.51 -2.39 105.19 107.81 1ya6 n GLY 1233Ca -0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1ya6 n GLY 1233CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ya6 s LEU 1234N 0.00 3.19 0.47 0.99 1.43 -1.13 -4.21 118.68 119.42 1ya6 s LEU 1234Ca 0.00 -0.65 -0.22 0.00 -1.03 0.00 0.00 54.13 52.23 1ya6 s LEU 1234Cb 0.00 -2.56 -0.07 0.00 0.03 0.00 0.00 46.19 43.59 1ya6 s LEU 1234CO 0.00 -2.64 1.14 -1.83 0.23 0.00 0.00 176.35 173.24 1ya6 s GLU 1235N 6.89 3.72 -0.57 1.70 1.03 -1.26 -4.47 118.70 125.74 1ya6 s GLU 1235Ca 0.68 1.69 -0.06 0.00 0.03 0.00 0.00 54.97 57.31 1ya6 s GLU 1235Cb -0.07 -2.32 -0.10 0.00 -0.80 0.00 0.00 34.13 30.84 1ya6 s GLU 1235CO 0.00 -0.56 3.13 0.54 -1.33 0.00 0.00 175.26 177.04 1ya6 n ARG 1236N -0.63 2.73 -1.55 -4.83 1.74 -1.26 -4.61 116.66 108.25 1ya6 n ARG 1236Ca 0.08 -1.88 -0.29 0.00 -0.77 0.00 0.00 57.85 54.98 1ya6 n ARG 1236Cb 0.49 -2.26 0.18 0.00 -1.02 0.00 0.00 32.46 29.85 1ya6 n ARG 1236CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ya6 s SER 1237N 1.38 2.75 0.34 0.55 1.04 -1.26 -4.79 113.70 113.71 1ya6 s SER 1237Ca 0.64 0.66 0.14 0.00 0.48 0.00 0.00 55.95 57.87 1ya6 s SER 1237Cb 0.30 -0.99 1.03 0.00 0.10 0.00 0.00 66.02 66.46 1ya6 s SER 1237CO -0.08 -2.99 1.69 -0.65 0.98 0.00 0.00 173.24 172.19 1ya6 h PRO 1238N -1.81 0.40 -0.70 4.02 0.11 -1.97 0.41 132.00 132.48 1ya6 h PRO 1238Ca -0.47 -0.02 0.16 0.00 0.11 0.00 0.00 66.00 65.78 1ya6 h PRO 1238Cb 1.29 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1ya6 h PRO 1238CO 0.48 0.27 0.48 0.00 -0.21 0.00 0.00 178.00 179.01 1ya6 h ALA 1239N 1.78 2.30 0.00 -0.75 0.00 -1.91 -0.23 119.26 120.46 1ya6 h ALA 1239Ca 0.70 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.60 1ya6 h ALA 1239Cb 1.54 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1ya6 h ALA 1239CO -0.53 -0.49 -0.02 0.35 0.00 0.00 0.00 179.25 178.56 1ya6 h PHE 1240N 0.25 0.00 -0.13 0.00 3.57 -0.41 -2.48 116.94 117.74 1ya6 h PHE 1240Ca 0.34 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 1ya6 h PHE 1240Cb 0.98 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1ya6 h PHE 1240CO -0.00 0.02 -0.00 0.82 -2.23 0.00 0.00 178.31 176.91 1ya6 h ILE 1241N 0.00 1.09 -0.62 1.41 2.04 -1.15 -2.45 117.51 117.83 1ya6 h ILE 1241Ca -0.00 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 1ya6 h ILE 1241Cb 0.08 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1ya6 h ILE 1241CO 0.00 0.11 0.27 0.00 0.00 0.00 0.00 178.15 178.54 1ya6 h ALA 1242N 1.82 0.80 -0.98 1.87 0.00 -1.62 -0.02 119.26 121.15 1ya6 h ALA 1242Ca 0.04 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.86 1ya6 h ALA 1242Cb 0.13 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1ya6 h ALA 1242CO 0.00 0.40 0.64 0.82 0.00 0.00 0.00 179.25 181.10 1ya6 h ILE 1243N 0.86 1.11 0.00 0.00 2.04 -1.60 -1.60 117.51 118.32 1ya6 h ILE 1243Ca 0.21 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1ya6 h ILE 1243Cb 0.16 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1ya6 h ILE 1243CO -0.02 0.21 -0.00 0.11 0.00 0.00 0.00 178.15 178.45 1ya6 h LYS 1244N 1.16 -0.00 -0.30 2.37 1.57 -1.38 -2.99 116.57 117.00 1ya6 h LYS 1244Ca 0.41 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.28 1ya6 h LYS 1244Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1ya6 h LYS 1244CO -0.15 0.58 0.32 0.93 -0.57 0.00 0.00 179.45 180.56 1ya6 h GLU 1245N -0.59 0.00 -0.18 3.15 5.08 -0.67 0.25 114.58 121.62 1ya6 h GLU 1245Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ya6 h GLU 1245Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1ya6 h GLU 1245CO 0.00 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.64 1ya6 n LYS 1246N -3.80 1.88 -2.19 2.33 5.02 -0.63 -4.96 118.16 115.81 1ya6 n LYS 1246Ca 0.05 -1.31 -0.18 0.00 -2.02 0.00 0.00 58.31 54.84 1ya6 n LYS 1246Cb 0.47 -1.42 -0.03 0.00 -0.02 0.00 0.00 35.03 34.03 1ya6 n LYS 1246CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ya6 n GLY 1247N 1.20 0.07 3.70 0.72 0.00 0.86 -4.95 105.19 106.79 1ya6 n GLY 1247Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1ya6 n GLY 1247CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ya6 s ILE 1248N -2.82 3.43 0.16 -0.61 1.01 -1.14 -4.98 121.20 116.26 1ya6 s ILE 1248Ca 0.00 0.92 -0.31 0.00 0.00 0.00 0.00 60.65 61.26 1ya6 s ILE 1248Cb 0.00 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.79 1ya6 s ILE 1248CO 0.00 0.02 1.47 -2.16 0.00 0.00 0.00 174.94 174.27 1ya6 s PRO 1249N 1.98 4.27 0.02 2.79 0.04 -1.26 -4.91 135.00 137.94 1ya6 s PRO 1249Ca 0.66 2.24 -0.28 0.00 0.04 0.00 0.00 61.00 63.66 1ya6 s PRO 1249Cb -0.35 -3.18 0.10 0.00 0.04 0.00 0.00 34.50 31.11 1ya6 s PRO 1249CO 0.29 -0.50 0.87 1.52 0.04 0.00 0.00 177.00 179.22 1ya6 s TYR 1250N 0.87 -0.34 -0.13 0.56 -0.85 -1.26 -3.93 117.35 112.27 1ya6 s TYR 1250Ca 0.66 0.18 0.00 0.00 -0.52 0.00 0.00 57.07 57.39 1ya6 s TYR 1250Cb -0.41 0.55 0.02 0.00 0.38 0.00 0.00 41.96 42.51 1ya6 s TYR 1250CO 0.33 -0.60 -0.12 -1.21 -1.52 0.00 0.00 175.55 172.44 1ya6 s GLU 1251N -3.19 1.99 -0.07 -3.49 2.02 -0.78 -4.97 118.70 110.21 1ya6 s GLU 1251Ca 0.05 -0.44 -0.16 0.00 0.02 0.00 0.00 54.97 54.44 1ya6 s GLU 1251Cb -0.01 -1.87 -0.05 0.00 0.10 0.00 0.00 34.13 32.30 1ya6 s GLU 1251CO -0.08 -0.22 0.41 -0.47 0.02 0.00 0.00 175.26 174.92 1ya6 s TYR 1252N 1.47 3.60 0.10 1.61 5.04 -1.26 -1.28 117.35 126.63 1ya6 s TYR 1252Ca 0.03 0.88 0.05 0.00 -2.44 0.00 0.00 57.07 55.59 1ya6 s TYR 1252Cb -0.13 -2.40 -0.03 0.00 0.35 0.00 0.00 41.96 39.75 1ya6 s TYR 1252CO -0.08 0.39 -0.13 0.71 -1.34 0.00 0.00 175.55 175.10 1ya6 s TYR 1253N -0.15 1.25 0.42 4.97 1.51 0.14 -4.97 117.35 120.52 1ya6 s TYR 1253Ca 0.23 -0.56 0.08 0.00 -1.01 0.00 0.00 57.07 55.81 1ya6 s TYR 1253Cb -0.15 -0.67 -0.01 0.00 -0.11 0.00 0.00 41.96 41.01 1ya6 s TYR 1253CO 0.10 0.08 0.43 0.20 -1.11 0.00 0.00 175.55 175.25 1ya6 s GLY 1254N -2.27 2.10 0.56 0.71 0.00 -1.26 -2.80 107.32 104.36 1ya6 s GLY 1254Ca 0.05 -1.83 0.23 0.00 0.00 0.00 0.00 44.72 43.17 1ya6 s GLY 1254CO 0.02 -1.67 2.19 3.43 0.00 0.00 0.00 173.10 177.07 1ya6 h ASN 1255N 0.92 0.00 1.06 1.64 2.35 -1.91 -1.06 115.58 118.58 1ya6 h ASN 1255Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1ya6 h ASN 1255Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1ya6 h ASN 1255CO 0.55 0.00 -0.47 0.03 -1.65 0.00 0.00 177.43 175.89 1ya6 h ARG 1256N 0.00 0.00 -0.48 0.81 3.08 -1.99 -3.25 114.38 112.54 1ya6 h ARG 1256Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1ya6 h ARG 1256Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1ya6 h ARG 1256CO -0.00 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.29 1ya6 n GLU 1257N -2.21 3.40 0.00 0.04 1.02 -0.45 -4.54 120.64 117.89 1ya6 n GLU 1257Ca 0.04 -2.70 0.05 0.00 -0.02 0.00 0.00 57.16 54.52 1ya6 n GLU 1257Cb 0.45 -1.76 0.28 0.00 -0.02 0.00 0.00 31.44 30.39 1ya6 n GLU 1257CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1ya6 n ILE 1258N 0.56 0.29 -0.01 -3.67 3.06 -0.91 -1.69 119.36 117.00 1ya6 n ILE 1258Ca 0.22 0.07 -0.14 0.00 -2.50 0.00 0.00 62.75 60.40 1ya6 n ILE 1258Cb 0.80 -0.91 -0.14 0.00 0.54 0.00 0.00 39.64 39.93 1ya6 n ILE 1258CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 1ya6 h ASP 1259N 0.00 0.17 0.62 9.51 3.32 -1.88 -3.30 116.42 124.86 1ya6 h ASP 1259Ca 0.00 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1ya6 h ASP 1259Cb 0.03 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1ya6 h ASP 1259CO 0.00 1.33 0.00 0.29 -1.72 0.00 0.00 179.24 179.14 1ya6 n LYS 1260N -3.22 0.00 -1.64 3.56 4.76 -0.68 -4.83 118.16 116.10 1ya6 n LYS 1260Ca -0.22 0.19 -0.48 0.00 -2.87 0.00 0.00 58.31 54.93 1ya6 n LYS 1260Cb 1.05 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.70 1ya6 n LYS 1260CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1ya6 n MET 1261N -1.50 1.78 -3.11 1.97 1.56 -1.23 -4.90 117.12 111.68 1ya6 n MET 1261Ca 0.04 0.64 -0.45 0.00 -0.27 0.00 0.00 57.70 57.67 1ya6 n MET 1261Cb 0.21 -2.33 -0.05 0.00 2.15 0.00 0.00 33.22 33.21 1ya6 n MET 1261CO 0.00 0.00 0.00 1.21 -0.73 0.00 0.00 175.97 176.45 1ya6 s ASN 1262N 0.59 6.18 -0.37 6.12 3.04 -1.26 -4.92 114.94 124.33 1ya6 s ASN 1262Ca 0.78 -1.42 0.03 0.00 0.04 0.00 0.00 52.86 52.29 1ya6 s ASN 1262Cb -0.76 -2.30 0.53 0.00 -1.54 0.00 0.00 41.25 37.18 1ya6 s ASN 1262CO 0.44 -1.11 1.75 0.18 -3.04 0.00 0.00 177.10 175.32 1ya6 n LEU 1263N 6.32 6.05 0.00 3.21 4.77 -1.26 -4.93 117.00 131.16 1ya6 n LEU 1263Ca -0.09 -3.22 -0.25 0.00 -0.03 0.00 0.00 56.01 52.42 1ya6 n LEU 1263Cb 0.42 -0.78 0.17 0.00 -2.33 0.00 0.00 43.42 40.90 1ya6 n LEU 1263CO 0.58 0.96 0.74 0.00 -1.33 0.00 0.00 177.39 178.34 1ya6 n ALA 1264N -0.80 -1.29 -1.81 -1.18 0.00 -1.26 -4.91 120.51 109.25 1ya6 n ALA 1264Ca 0.48 -1.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.18 1ya6 n ALA 1264Cb 1.41 -0.07 0.07 0.00 0.00 0.00 0.00 19.45 20.85 1ya6 n ALA 1264CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ya6 s PRO 1265N -5.43 2.43 -0.21 0.00 0.02 -1.26 -4.43 135.00 126.12 1ya6 s PRO 1265Ca 0.63 0.40 -0.06 0.00 0.02 0.00 0.00 61.00 61.99 1ya6 s PRO 1265Cb -0.02 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.53 1ya6 s PRO 1265CO 0.44 -1.33 0.21 -1.71 -0.33 0.00 0.00 177.00 174.28 1ya6 n ASN 1266N -3.19 -1.67 -4.32 2.53 2.85 -1.25 -4.94 115.26 105.27 1ya6 n ASN 1266Ca 0.07 -0.20 -0.16 0.00 -0.11 0.00 0.00 54.58 54.18 1ya6 n ASN 1266Cb 0.58 -0.52 -0.10 0.00 1.24 0.00 0.00 39.78 40.98 1ya6 n ASN 1266CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1ya6 s GLN 1267N -1.97 1.35 0.58 1.20 -1.52 -1.26 -5.10 119.66 112.94 1ya6 s GLN 1267Ca 0.06 -1.70 -0.06 0.00 -1.95 0.00 0.00 55.36 51.71 1ya6 s GLN 1267Cb -0.01 -0.41 0.01 0.00 -0.22 0.00 0.00 33.01 32.38 1ya6 s GLN 1267CO 0.29 -0.20 0.89 -1.25 -0.25 0.00 0.00 175.29 174.77 1ya6 s PRO 1268N -3.95 2.97 0.10 2.91 0.04 -1.26 -4.86 135.00 130.95 1ya6 s PRO 1268Ca 0.32 0.01 -0.35 0.00 0.04 0.00 0.00 61.00 61.02 1ya6 s PRO 1268Cb 0.07 -2.28 -0.15 0.00 0.04 0.00 0.00 34.50 32.18 1ya6 s PRO 1268CO 0.10 -0.66 1.53 0.00 0.04 0.00 0.00 177.00 178.01 1ya6 n ALA 1269N -2.56 0.50 -2.68 8.56 0.00 -1.25 -4.70 120.51 118.37 1ya6 n ALA 1269Ca 0.04 0.46 -0.39 0.00 0.00 0.00 0.00 53.44 53.55 1ya6 n ALA 1269Cb 0.57 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.69 1ya6 n ALA 1269CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ya6 s GLN 1270N 1.08 4.25 -0.16 0.00 -1.52 -0.69 -1.86 119.66 120.75 1ya6 s GLN 1270Ca 0.82 0.43 -0.01 0.00 -1.95 0.00 0.00 55.36 54.65 1ya6 s GLN 1270Cb -0.79 -3.51 -0.01 0.00 -0.22 0.00 0.00 33.01 28.48 1ya6 s GLN 1270CO 0.43 -0.03 -0.11 0.42 -0.25 0.00 0.00 175.29 175.74 1ya6 s ILE 1271N 1.25 3.01 -0.08 1.08 -1.09 -0.40 -1.02 121.20 123.96 1ya6 s ILE 1271Ca 0.25 -0.65 -0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1ya6 s ILE 1271Cb -0.15 -2.30 -0.03 0.00 -1.58 0.00 0.00 42.46 38.40 1ya6 s ILE 1271CO 0.10 0.49 -0.04 -0.22 -1.23 0.00 0.00 174.94 174.04 1ya6 s LEU 1272N 0.83 3.33 0.00 2.97 2.96 0.23 -0.68 118.68 128.31 1ya6 s LEU 1272Ca -0.04 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 1ya6 s LEU 1272Cb -0.15 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 44.80 1ya6 s LEU 1272CO 0.01 0.36 0.00 -0.90 -1.32 0.00 0.00 176.35 174.49 1ya6 n ASP 1273N 2.26 0.00 -4.64 3.68 3.85 -1.12 -0.36 116.55 120.21 1ya6 n ASP 1273Ca -0.18 0.00 -0.66 0.00 -0.71 0.00 0.00 54.79 53.23 1ya6 n ASP 1273Cb 0.53 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.20 1ya6 n ASP 1273CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1ya6 s TYR 1275N 3.36 2.75 -0.00 0.00 -0.85 -1.26 -4.76 117.35 116.58 1ya6 s TYR 1275Ca 1.06 -0.24 -0.30 0.00 -0.52 0.00 0.00 57.07 57.07 1ya6 s TYR 1275Cb -1.49 -1.31 -0.03 0.00 0.38 0.00 0.00 41.96 39.51 1ya6 s TYR 1275CO 0.79 0.55 0.99 0.42 -1.52 0.00 0.00 175.55 176.78 1ya6 s ILE 1276N -2.32 4.85 0.19 -3.49 -1.09 -1.26 -4.64 121.20 113.44 1ya6 s ILE 1276Ca 0.33 2.05 -0.12 0.00 -2.23 0.00 0.00 60.65 60.67 1ya6 s ILE 1276Cb -0.06 -4.31 0.10 0.00 -1.58 0.00 0.00 42.46 36.61 1ya6 s ILE 1276CO 0.21 0.15 1.81 -1.13 -1.23 0.00 0.00 174.94 174.75 1ya6 h ASN 1277N 6.81 0.50 0.36 3.58 -0.73 -1.02 -1.53 115.58 123.55 1ya6 h ASN 1277Ca -0.41 0.02 -0.02 0.00 1.87 0.00 0.00 56.30 57.76 1ya6 h ASN 1277Cb 1.22 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.73 1ya6 h ASN 1277CO 0.76 0.34 -0.17 0.77 -0.37 0.00 0.00 177.43 178.75 1ya6 h SER 1278N 0.62 -0.41 -0.97 1.15 4.64 -1.94 -2.01 113.55 114.63 1ya6 h SER 1278Ca 0.24 -0.03 0.14 0.00 -0.47 0.00 0.00 61.79 61.67 1ya6 h SER 1278Cb 0.09 0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 62.20 1ya6 h SER 1278CO -0.14 -0.24 0.59 -0.33 -0.87 0.00 0.00 176.83 175.85 1ya6 h GLU 1279N -0.56 0.87 -0.53 4.77 5.08 -1.92 -1.51 114.58 120.78 1ya6 h GLU 1279Ca -0.05 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1ya6 h GLU 1279Cb 0.42 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1ya6 h GLU 1279CO 0.08 0.57 0.27 1.98 -1.00 0.00 0.00 179.01 180.91 1ya6 h MET 1280N 0.89 0.75 -0.53 2.33 4.05 -1.02 -1.24 114.93 120.16 1ya6 h MET 1280Ca 0.50 -0.10 0.02 0.00 -0.28 0.00 0.00 59.70 59.84 1ya6 h MET 1280Cb 0.58 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.22 1ya6 h MET 1280CO -0.30 0.60 0.35 -0.07 0.23 0.00 0.00 176.91 177.72 1ya6 h LEU 1281N 0.70 0.57 0.36 3.39 3.38 -0.54 -0.14 115.31 123.03 1ya6 h LEU 1281Ca 0.18 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1ya6 h LEU 1281Cb 0.08 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1ya6 h LEU 1281CO -0.03 0.40 -0.17 -0.08 0.09 0.00 0.00 178.44 178.65 1ya6 h GLU 1282N 0.67 -0.47 -0.49 1.13 4.57 -0.83 -1.73 114.58 117.43 1ya6 h GLU 1282Ca 0.20 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.52 1ya6 h GLU 1282Cb 0.00 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 1ya6 h GLU 1282CO -0.05 -0.15 0.34 0.00 -1.18 0.00 0.00 179.01 177.97 1ya6 h ARG 1283N -0.88 0.21 -0.05 1.92 3.08 -1.00 -2.76 114.38 114.90 1ya6 h ARG 1283Ca -0.05 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 1ya6 h ARG 1283Cb 0.54 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.55 1ya6 h ARG 1283CO 0.08 0.14 -0.52 1.98 -1.07 0.00 0.00 179.97 180.58 1ya6 h MET 1284N 0.21 0.43 -0.14 0.04 4.05 -0.95 -3.21 114.93 115.37 1ya6 h MET 1284Ca 0.23 -0.40 0.04 0.00 -0.28 0.00 0.00 59.70 59.29 1ya6 h MET 1284Cb 0.62 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1ya6 h MET 1284CO -0.04 1.05 0.31 0.66 0.23 0.00 0.00 176.91 179.12 1ya6 h SER 1285N -0.04 0.00 -0.67 1.39 4.64 -1.01 0.31 113.55 118.18 1ya6 h SER 1285Ca -0.05 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.89 1ya6 h SER 1285Cb 1.20 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.07 1ya6 h SER 1285CO 0.10 0.00 0.21 0.29 -0.87 0.00 0.00 176.83 176.57 1ya6 n LYS 1286N -3.29 2.19 -4.66 4.77 5.02 -1.21 -4.44 118.16 116.54 1ya6 n LYS 1286Ca 0.01 -3.22 -0.29 0.00 -2.02 0.00 0.00 58.31 52.79 1ya6 n LYS 1286Cb 0.40 -2.02 -0.17 0.00 -0.02 0.00 0.00 35.03 33.23 1ya6 n LYS 1286CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ya6 s SER 1287N -2.14 2.62 0.18 4.39 0.01 0.11 -3.33 113.70 115.54 1ya6 s SER 1287Ca 0.51 -0.47 -0.16 0.00 1.31 0.00 0.00 55.95 57.14 1ya6 s SER 1287Cb 0.44 -1.19 0.15 0.00 0.21 0.00 0.00 66.02 65.63 1ya6 s SER 1287CO 0.03 0.06 1.64 1.23 0.41 0.00 0.00 173.24 176.62 1ya6 h GLY 1288N 7.21 0.31 -5.22 3.44 0.00 -0.47 -3.43 103.07 104.91 1ya6 h GLY 1288Ca -0.29 0.19 -0.35 0.00 0.00 0.00 0.00 47.33 46.88 1ya6 h GLY 1288CO 0.50 -0.20 -0.76 -1.36 0.00 0.00 0.00 176.54 174.72 1ya6 s PHE 1289N -6.21 0.65 -0.09 5.60 0.40 -0.81 -3.67 117.98 113.85 1ya6 s PHE 1289Ca -0.14 -0.17 0.04 0.00 -0.60 0.00 0.00 56.93 56.06 1ya6 s PHE 1289Cb 0.16 -0.41 -0.01 0.00 0.51 0.00 0.00 43.02 43.28 1ya6 s PHE 1289CO 0.72 -0.02 -0.23 0.20 0.70 0.00 0.00 175.22 176.60 1ya6 s GLY 1290N -0.35 1.35 -0.13 4.36 0.00 -0.77 0.16 107.32 111.93 1ya6 s GLY 1290Ca 0.01 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 43.73 1ya6 s GLY 1290CO -0.00 -0.44 -0.09 -0.19 0.00 0.00 0.00 173.10 172.38 1ya6 s TYR 1291N 0.13 2.90 -0.34 1.90 2.02 0.28 -0.34 117.35 123.91 1ya6 s TYR 1291Ca -0.12 -0.44 -0.01 0.00 -0.37 0.00 0.00 57.07 56.14 1ya6 s TYR 1291Cb -0.16 -1.87 0.12 0.00 -0.40 0.00 0.00 41.96 39.65 1ya6 s TYR 1291CO 0.06 -0.08 0.18 -1.14 -1.57 0.00 0.00 175.55 173.00 1ya6 s GLN 1292N 0.22 0.57 -0.65 -0.62 -0.44 -0.02 -2.55 119.66 116.17 1ya6 s GLN 1292Ca -0.06 -1.16 0.00 0.00 -2.50 0.00 0.00 55.36 51.65 1ya6 s GLN 1292Cb -0.15 -1.50 0.42 0.00 -1.64 0.00 0.00 33.01 30.14 1ya6 s GLN 1292CO 0.04 -1.12 1.82 1.28 0.50 0.00 0.00 175.29 177.81 1ya6 n LEU 1293N 4.43 6.94 -4.75 3.68 4.77 -1.25 -2.79 117.00 128.03 1ya6 n LEU 1293Ca 0.04 -4.64 -0.41 0.00 -0.03 0.00 0.00 56.01 50.98 1ya6 n LEU 1293Cb 0.39 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 1ya6 n LEU 1293CO 0.12 1.74 0.82 -0.44 -1.33 0.00 0.00 177.39 178.30 1ya6 s SER 1294N -2.02 7.20 -0.50 -1.43 0.01 -1.25 -3.13 113.70 112.58 1ya6 s SER 1294Ca 0.57 2.25 0.08 0.00 1.31 0.00 0.00 55.95 60.16 1ya6 s SER 1294Cb 0.46 -2.62 0.30 0.00 0.21 0.00 0.00 66.02 64.37 1ya6 s SER 1294CO -0.16 -0.22 0.76 0.29 0.41 0.00 0.00 173.24 174.32 1ya6 n LYS 1295N 1.64 2.00 -2.50 12.44 5.02 -0.23 -4.57 118.16 131.96 1ya6 n LYS 1295Ca 0.01 -4.12 -0.35 0.00 -2.02 0.00 0.00 58.31 51.83 1ya6 n LYS 1295Cb 0.45 -1.91 -0.03 0.00 -0.02 0.00 0.00 35.03 33.52 1ya6 n LYS 1295CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ya6 s LEU 1296N -2.52 3.93 0.18 -0.35 1.43 -1.26 -4.98 118.68 115.10 1ya6 s LEU 1296Ca 0.42 2.00 -0.31 0.00 -1.03 0.00 0.00 54.13 55.22 1ya6 s LEU 1296Cb 0.24 -4.44 -0.09 0.00 0.03 0.00 0.00 46.19 41.93 1ya6 s LEU 1296CO -0.09 -0.75 1.42 0.21 0.23 0.00 0.00 176.35 177.37 1ya6 s ASN 1297N -1.81 6.75 0.07 2.29 3.84 -1.26 -4.90 114.94 119.92 1ya6 s ASN 1297Ca 0.65 2.49 0.03 0.00 0.21 0.00 0.00 52.86 56.24 1ya6 s ASN 1297Cb -0.19 -2.60 0.17 0.00 -0.55 0.00 0.00 41.25 38.08 1ya6 s ASN 1297CO 0.23 -0.67 0.94 1.67 -2.79 0.00 0.00 177.10 176.49 1ya6 n GLN 1298N 3.22 0.02 0.17 0.43 7.27 -1.26 -2.30 117.38 124.93 1ya6 n GLN 1298Ca 0.09 0.38 -0.14 0.00 0.07 0.00 0.00 57.00 57.40 1ya6 n GLN 1298Cb 0.41 -1.76 -0.08 0.00 2.41 0.00 0.00 30.24 31.22 1ya6 n GLN 1298CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1ya6 h LYS 1299N 0.00 -0.37 -0.27 3.69 1.57 -1.91 -2.63 116.57 116.66 1ya6 h LYS 1299Ca 0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1ya6 h LYS 1299Cb 0.39 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1ya6 h LYS 1299CO 0.00 -0.16 0.00 0.66 -0.57 0.00 0.00 179.45 179.38 1ya6 n TYR 1300N -5.20 0.30 -3.72 -1.35 4.01 -0.97 -4.07 117.16 106.15 1ya6 n TYR 1300Ca -0.10 -0.14 -0.36 0.00 -0.16 0.00 0.00 57.90 57.14 1ya6 n TYR 1300Cb 0.21 -0.02 -0.09 0.00 -0.31 0.00 0.00 39.34 39.12 1ya6 n TYR 1300CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1ya6 s LEU 1301N -0.98 4.09 0.00 7.72 1.43 -0.99 -4.50 118.68 125.44 1ya6 s LEU 1301Ca 0.14 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1ya6 s LEU 1301Cb 0.08 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1ya6 s LEU 1301CO 0.09 0.11 0.00 1.67 0.23 0.00 0.00 176.35 178.44 1ya6 n GLN 1302N 4.01 0.00 0.00 1.70 7.27 -1.26 -4.90 117.38 124.20 1ya6 n GLN 1302Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.92 1ya6 n GLN 1302Cb 0.52 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.17 1ya6 n GLN 1302CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1ya6 n ARG 1303N -1.18 2.52 -2.50 3.69 1.74 -1.26 0.10 116.66 119.77 1ya6 n ARG 1303Ca 0.00 -0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.64 1ya6 n ARG 1303Cb 0.00 -0.21 -0.02 0.00 -1.02 0.00 0.00 32.46 31.21 1ya6 n ARG 1303CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ya6 s SER 1304N -0.36 6.78 0.60 0.55 0.01 -1.26 -4.84 113.70 115.17 1ya6 s SER 1304Ca 0.00 1.17 0.03 0.00 1.31 0.00 0.00 55.95 58.46 1ya6 s SER 1304Cb 0.00 -2.54 0.07 0.00 0.21 0.00 0.00 66.02 63.76 1ya6 s SER 1304CO 0.00 -1.00 0.84 -0.76 0.41 0.00 0.00 173.24 172.73 1ya6 s LEU 1305N 4.07 3.18 0.10 2.44 1.43 -1.26 -5.05 118.68 123.59 1ya6 s LEU 1305Ca 0.52 -0.31 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1ya6 s LEU 1305Cb -0.15 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 1ya6 s LEU 1305CO 0.20 -1.40 0.15 -1.61 0.23 0.00 0.00 176.35 173.93 1ya6 s GLU 1306N -4.84 3.10 0.29 1.70 2.02 -1.26 -4.69 118.70 115.02 1ya6 s GLU 1306Ca 0.61 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 54.95 1ya6 s GLU 1306Cb -0.08 -2.82 0.68 0.00 0.10 0.00 0.00 34.13 32.01 1ya6 s GLU 1306CO 0.40 0.55 1.62 1.88 0.02 0.00 0.00 175.26 179.73 1ya6 h TYR 1307N 2.90 0.15 0.00 1.61 -1.99 -1.96 0.85 116.97 118.52 1ya6 h TYR 1307Ca -0.47 0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.32 1ya6 h TYR 1307Cb 1.17 0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1ya6 h TYR 1307CO 0.59 -0.29 0.00 1.79 -0.00 0.00 0.00 178.16 180.25 1ya6 h THR 1308N 0.12 0.00 -0.02 -2.88 1.35 -1.96 -0.11 112.91 109.40 1ya6 h THR 1308Ca 0.54 -0.21 -0.02 0.00 -0.55 0.00 0.00 66.41 66.18 1ya6 h THR 1308Cb 1.09 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1ya6 h THR 1308CO -0.74 0.00 -0.06 0.45 -0.25 0.00 0.00 175.52 174.92 1ya6 h HIS 1309N 0.00 0.10 0.00 4.73 3.86 0.33 -3.26 115.15 120.91 1ya6 h HIS 1309Ca 0.00 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1ya6 h HIS 1309Cb 0.21 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 1ya6 h HIS 1309CO 0.00 0.66 -0.05 -0.07 0.86 0.00 0.00 177.93 179.33 1ya6 h LEU 1310N -0.49 0.00 -0.15 2.43 3.38 -1.01 -3.06 115.31 116.41 1ya6 h LEU 1310Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ya6 h LEU 1310Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1ya6 h LEU 1310CO 0.01 0.05 0.00 -0.62 0.09 0.00 0.00 178.44 177.97 1ya6 n GLU 1311N -3.13 0.24 0.01 1.13 1.02 -0.13 -2.82 120.64 116.95 1ya6 n GLU 1311Ca 0.02 0.25 -0.22 0.00 -0.02 0.00 0.00 57.16 57.20 1ya6 n GLU 1311Cb 0.42 -1.81 -0.14 0.00 -0.02 0.00 0.00 31.44 29.89 1ya6 n GLU 1311CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1ya6 h LEU 1312N 0.00 0.40 -0.76 -4.62 3.38 -1.58 -2.92 115.31 109.21 1ya6 h LEU 1312Ca 0.00 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.11 1ya6 h LEU 1312Cb 0.65 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1ya6 h LEU 1312CO 0.00 1.68 0.00 1.23 0.09 0.00 0.00 178.44 181.44 1ya6 h GLY 1313N 0.29 0.00 0.68 0.83 0.00 -1.62 -3.20 103.07 100.05 1ya6 h GLY 1313Ca -0.34 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.65 1ya6 h GLY 1313CO 0.07 0.00 -1.94 0.00 0.00 0.00 0.00 176.54 174.67 1ya6 n ALA 1314N -1.92 1.18 0.55 3.60 0.00 -1.13 -4.03 120.51 118.76 1ya6 n ALA 1314Ca 0.02 -0.72 0.12 0.00 0.00 0.00 0.00 53.44 52.86 1ya6 n ALA 1314Cb 0.32 -0.69 0.45 0.00 0.00 0.00 0.00 19.45 19.54 1ya6 n ALA 1314CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ya6 n GLY 1316N 0.69 0.69 3.21 0.00 0.00 -1.24 -3.45 105.19 105.09 1ya6 n GLY 1316Ca 0.04 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1ya6 n GLY 1316CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ya6 s THR 1317N -1.51 0.47 -0.04 2.61 -1.32 -1.21 -4.81 115.64 109.85 1ya6 s THR 1317Ca 0.00 -1.95 -0.30 0.00 -1.21 0.00 0.00 61.69 58.23 1ya6 s THR 1317Cb 0.00 -2.08 -0.03 0.00 -1.51 0.00 0.00 72.50 68.88 1ya6 s THR 1317CO 0.00 -0.48 1.04 -0.63 -2.21 0.00 0.00 174.62 172.34 1ya6 s ILE 1318N -3.79 4.67 -0.19 5.08 -1.09 -1.24 -4.61 121.20 120.04 1ya6 s ILE 1318Ca 0.24 1.93 -0.22 0.00 -2.23 0.00 0.00 60.65 60.37 1ya6 s ILE 1318Cb 0.07 -4.24 -0.02 0.00 -1.58 0.00 0.00 42.46 36.68 1ya6 s ILE 1318CO 0.03 0.08 0.66 -2.84 -1.23 0.00 0.00 174.94 171.65 1ya6 s PRO 1319N 1.49 4.24 -0.40 2.79 0.02 -1.26 -1.85 135.00 140.03 1ya6 s PRO 1319Ca 0.52 0.69 -0.10 0.00 0.02 0.00 0.00 61.00 62.13 1ya6 s PRO 1319Cb -0.21 -3.57 0.06 0.00 0.02 0.00 0.00 34.50 30.79 1ya6 s PRO 1319CO 0.24 -0.23 0.23 0.08 -0.33 0.00 0.00 177.00 176.99 1ya6 s VAL 1320N 1.87 4.33 0.22 3.83 1.01 0.54 -1.63 120.40 130.57 1ya6 s VAL 1320Ca 0.31 -1.18 0.07 0.00 0.00 0.00 0.00 61.98 61.18 1ya6 s VAL 1320Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1ya6 s VAL 1320CO 0.11 -0.38 0.12 -0.36 0.00 0.00 0.00 175.10 174.59 1ya6 s PHE 1321N 1.47 3.01 0.07 5.22 0.08 -0.64 -0.84 117.98 126.36 1ya6 s PHE 1321Ca 0.02 -0.11 -0.31 0.00 0.12 0.00 0.00 56.93 56.65 1ya6 s PHE 1321Cb -0.21 -1.39 -0.08 0.00 -0.57 0.00 0.00 43.02 40.77 1ya6 s PHE 1321CO 0.04 0.54 1.60 -0.46 -0.10 0.00 0.00 175.22 176.83 1ya6 s TRP 1322N -2.02 2.58 0.19 0.36 -0.11 -1.12 0.28 118.94 119.11 1ya6 s TRP 1322Ca 0.31 0.45 -0.13 0.00 1.22 0.00 0.00 56.10 57.96 1ya6 s TRP 1322Cb -0.08 -3.90 0.22 0.00 -1.50 0.00 0.00 33.47 28.20 1ya6 s TRP 1322CO 0.23 -3.55 1.69 -0.22 -4.62 0.00 0.00 176.95 170.48 1ya6 h LYS 1323N 8.04 0.15 0.00 5.86 3.64 -1.14 -2.55 116.57 130.56 1ya6 h LYS 1323Ca -0.42 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1ya6 h LYS 1323Cb 1.20 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1ya6 h LYS 1323CO 0.92 0.10 0.00 0.66 -2.27 0.00 0.00 179.45 178.86 1ya6 h SER 1324N 0.15 0.00 -0.04 4.20 4.64 -1.92 -2.74 113.55 117.84 1ya6 h SER 1324Ca 0.27 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.36 1ya6 h SER 1324Cb 0.41 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.51 1ya6 h SER 1324CO -0.42 0.00 -0.87 0.74 -0.87 0.00 0.00 176.83 175.41 1ya6 h THR 1325N 0.00 1.31 -0.41 2.95 2.02 -1.74 -2.53 112.91 114.51 1ya6 h THR 1325Ca 0.00 -2.13 -0.07 0.00 0.77 0.00 0.00 66.41 64.98 1ya6 h THR 1325Cb 0.51 2.34 -0.02 0.00 -1.74 0.00 0.00 68.15 69.23 1ya6 h THR 1325CO 0.00 0.65 -0.02 1.23 0.37 0.00 0.00 175.52 177.75 1ya6 h GLY 1326N 0.31 0.72 2.00 2.16 0.00 -1.46 -0.38 103.07 106.42 1ya6 h GLY 1326Ca -0.10 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1ya6 h GLY 1326CO 0.17 0.43 0.00 0.83 0.00 0.00 0.00 176.54 177.98 1ya6 h GLU 1327N 0.63 0.00 0.00 4.80 5.08 -1.40 -2.47 114.58 121.22 1ya6 h GLU 1327Ca 0.12 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1ya6 h GLU 1327Cb 0.43 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1ya6 h GLU 1327CO 0.02 0.00 -1.70 0.09 -1.00 0.00 0.00 179.01 176.42 1ya6 n ASN 1328N -2.66 1.73 -4.82 1.42 5.03 -0.62 -4.87 115.26 110.47 1ya6 n ASN 1328Ca 0.01 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.08 1ya6 n ASN 1328Cb 0.25 1.50 -0.06 0.00 -1.02 0.00 0.00 39.78 40.46 1ya6 n ASN 1328CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1ya6 s LEU 1329N -4.17 4.50 0.20 3.41 1.43 -0.25 -4.54 118.68 119.25 1ya6 s LEU 1329Ca -0.05 1.15 -0.12 0.00 -1.03 0.00 0.00 54.13 54.08 1ya6 s LEU 1329Cb 0.08 -2.83 -0.07 0.00 0.03 0.00 0.00 46.19 43.41 1ya6 s LEU 1329CO 0.59 0.28 0.55 -0.54 0.23 0.00 0.00 176.35 177.46 1ya6 s LYS 1330N -1.17 3.88 0.26 1.70 1.02 0.29 -2.17 119.74 123.55 1ya6 s LYS 1330Ca 0.28 0.37 -0.29 0.00 0.02 0.00 0.00 55.97 56.35 1ya6 s LYS 1330Cb -0.18 -2.76 -0.09 0.00 -0.52 0.00 0.00 37.83 34.28 1ya6 s LYS 1330CO 0.17 0.38 0.97 0.12 -0.92 0.00 0.00 175.35 176.07 1ya6 s PHE 1331N -1.67 3.87 0.32 3.18 5.36 0.13 -4.48 117.98 124.69 1ya6 s PHE 1331Ca 0.44 1.86 0.05 0.00 -0.96 0.00 0.00 56.93 58.32 1ya6 s PHE 1331Cb -0.13 -3.03 0.70 0.00 -0.34 0.00 0.00 43.02 40.22 1ya6 s PHE 1331CO 0.20 0.23 1.86 -0.09 -1.46 0.00 0.00 175.22 175.96 1ya6 h ARG 1332N 3.95 0.80 0.01 10.12 2.43 -1.88 -0.36 114.38 129.46 1ya6 h ARG 1332Ca -0.46 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1ya6 h ARG 1332Cb 1.20 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1ya6 h ARG 1332CO 0.67 0.53 -0.00 0.28 -1.51 0.00 0.00 179.97 179.94 1ya6 h VAL 1333N 0.83 1.59 0.00 0.20 2.07 -1.93 -3.40 116.25 115.61 1ya6 h VAL 1333Ca 0.46 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 65.94 1ya6 h VAL 1333Cb 0.59 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.28 1ya6 h VAL 1333CO -0.22 0.51 -0.89 -0.90 0.02 0.00 0.00 177.57 176.09 1ya6 n ASP 1334N -4.67 0.81 -1.45 0.57 5.68 -1.24 -5.00 116.55 111.26 1ya6 n ASP 1334Ca -0.09 -0.80 -0.08 0.00 -0.50 0.00 0.00 54.79 53.32 1ya6 n ASP 1334Cb 0.41 1.08 0.02 0.00 -1.14 0.00 0.00 41.12 41.49 1ya6 n ASP 1334CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1ya6 n ASN 1335N -1.46 -3.38 -4.38 -1.12 5.15 -0.14 -4.98 115.26 104.95 1ya6 n ASN 1335Ca 0.03 -0.16 -0.23 0.00 -0.60 0.00 0.00 54.58 53.62 1ya6 n ASN 1335Cb 0.28 -2.01 -0.11 0.00 -0.53 0.00 0.00 39.78 37.41 1ya6 n ASN 1335CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1ya6 s THR 1336N -3.02 2.04 0.15 -0.44 -4.23 -1.25 -4.70 115.64 104.18 1ya6 s THR 1336Ca 0.17 -2.09 -0.33 0.00 -1.18 0.00 0.00 61.69 58.27 1ya6 s THR 1336Cb -0.08 -2.02 -0.17 0.00 1.34 0.00 0.00 72.50 71.58 1ya6 s THR 1336CO 0.21 -0.34 1.02 -2.65 -0.54 0.00 0.00 174.62 172.32 1ya6 n PRO 1337N -0.01 0.72 0.17 3.99 -0.02 -1.26 0.17 135.00 138.76 1ya6 n PRO 1337Ca -0.11 0.26 0.04 0.00 -2.02 0.00 0.00 63.50 61.67 1ya6 n PRO 1337Cb 0.58 -1.65 0.44 0.00 -0.02 0.00 0.00 33.50 32.84 1ya6 n PRO 1337CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ya6 h LEU 1338N 2.79 0.11 -0.71 2.45 3.38 -0.94 -1.96 115.31 120.43 1ya6 h LEU 1338Ca -0.42 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1ya6 h LEU 1338Cb 1.38 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1ya6 h LEU 1338CO 0.66 0.29 0.00 0.71 0.09 0.00 0.00 178.44 180.20 1ya6 h THR 1339N 0.11 0.00 -1.61 0.22 1.35 -1.86 -3.22 112.91 107.91 1ya6 h THR 1339Ca 0.02 -0.28 -0.68 0.00 -0.55 0.00 0.00 66.41 64.92 1ya6 h THR 1339Cb 0.37 1.06 -0.24 0.00 -1.73 0.00 0.00 68.15 67.61 1ya6 h THR 1339CO 0.02 0.00 0.86 -1.54 -0.25 0.00 0.00 175.52 174.61 1ya6 n SER 1340N -2.32 7.25 -3.82 5.36 3.41 -0.74 -4.90 113.62 117.86 1ya6 n SER 1340Ca 0.02 -3.65 -0.10 0.00 -0.26 0.00 0.00 58.87 54.89 1ya6 n SER 1340Cb 0.25 -1.10 -0.05 0.00 -0.26 0.00 0.00 64.21 63.05 1ya6 n SER 1340CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1ya6 s HIS 1341N -3.38 0.09 -1.10 7.33 4.02 -1.22 -4.92 115.29 116.10 1ya6 s HIS 1341Ca 0.54 -0.44 -0.07 0.00 1.02 0.00 0.00 55.06 56.11 1ya6 s HIS 1341Cb 0.43 0.17 0.29 0.00 -1.02 0.00 0.00 32.58 32.45 1ya6 s HIS 1341CO -0.31 -0.79 1.25 -3.47 1.02 0.00 0.00 174.74 172.44 1ya6 n ASP 1342N -0.26 5.83 0.07 1.40 2.03 -1.26 -4.76 116.55 119.60 1ya6 n ASP 1342Ca -0.10 -3.19 0.12 0.00 0.52 0.00 0.00 54.79 52.15 1ya6 n ASP 1342Cb 0.63 -1.33 0.24 0.00 -0.72 0.00 0.00 41.12 39.94 1ya6 n ASP 1342CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1ya6 n SER 1343N 2.14 0.70 0.00 1.67 3.41 -1.26 -4.86 113.62 115.42 1ya6 n SER 1343Ca 0.25 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 1ya6 n SER 1343Cb 0.37 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1ya6 n SER 1343CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ya6 n GLY 1344N 1.34 0.45 3.68 5.00 0.00 -1.26 -0.56 105.19 113.84 1ya6 n GLY 1344Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1ya6 n GLY 1344CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ya6 s ILE 1345N -1.98 4.90 -0.42 -0.61 1.01 -1.26 -4.72 121.20 118.12 1ya6 s ILE 1345Ca 0.00 1.61 -0.28 0.00 0.00 0.00 0.00 60.65 61.99 1ya6 s ILE 1345Cb 0.00 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.37 1ya6 s ILE 1345CO 0.00 0.05 1.03 -0.63 0.00 0.00 0.00 174.94 175.40 1ya6 s ILE 1346N 1.98 4.40 -0.39 2.92 1.01 -0.64 -4.96 121.20 125.52 1ya6 s ILE 1346Ca 0.38 1.22 -0.25 0.00 0.00 0.00 0.00 60.65 62.00 1ya6 s ILE 1346Cb -0.17 -4.47 0.02 0.00 0.01 0.00 0.00 42.46 37.85 1ya6 s ILE 1346CO 0.13 -0.77 0.87 0.26 0.00 0.00 0.00 174.94 175.43 1ya6 s TRP 1347N 3.93 3.05 0.03 3.97 0.52 -1.26 -1.61 118.94 127.57 1ya6 s TRP 1347Ca 0.43 0.58 -0.30 0.00 0.02 0.00 0.00 56.10 56.82 1ya6 s TRP 1347Cb -0.10 -3.62 -0.05 0.00 -1.15 0.00 0.00 33.47 28.55 1ya6 s TRP 1347CO 0.25 -0.86 1.30 0.12 0.02 0.00 0.00 176.95 177.77 1ya6 s PHE 1348N 3.38 3.16 -0.21 -1.98 2.19 0.14 -4.69 117.98 119.98 1ya6 s PHE 1348Ca 0.35 1.07 0.01 0.00 0.33 0.00 0.00 56.93 58.69 1ya6 s PHE 1348Cb -0.12 -3.54 0.03 0.00 -1.31 0.00 0.00 43.02 38.08 1ya6 s PHE 1348CO 0.20 -1.84 -0.16 0.34 1.83 0.00 0.00 175.22 175.58 1ya6 s ASP 1349N 1.43 3.59 0.62 6.13 -1.08 -1.26 -0.62 116.67 125.47 1ya6 s ASP 1349Ca 0.61 -0.88 0.40 0.00 -0.52 0.00 0.00 52.55 52.16 1ya6 s ASP 1349Cb -0.30 -1.51 2.04 0.00 -1.46 0.00 0.00 42.92 41.68 1ya6 s ASP 1349CO 0.27 -0.06 2.24 1.05 0.52 0.00 0.00 175.17 179.18 1ya6 h GLU 1350N 7.90 0.00 -0.97 4.34 4.11 -1.99 -2.40 114.58 125.56 1ya6 h GLU 1350Ca -0.37 0.00 -0.65 0.00 0.07 0.00 0.00 59.36 58.41 1ya6 h GLU 1350Cb 1.11 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.03 1ya6 h GLU 1350CO 0.58 0.01 0.39 0.09 0.07 0.00 0.00 179.01 180.15 1ya6 n ASN 1351N -3.14 6.90 0.00 3.06 5.03 -1.26 -4.42 115.26 121.42 1ya6 n ASN 1351Ca -0.02 -3.78 0.00 0.00 0.87 0.00 0.00 54.58 51.65 1ya6 n ASN 1351Cb 0.15 -0.80 0.00 0.00 -1.02 0.00 0.00 39.78 38.11 1ya6 n ASN 1351CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ya6 n ASP 1352N -0.84 0.00 0.32 6.41 4.64 -0.94 -5.04 116.55 121.09 1ya6 n ASP 1352Ca 0.57 0.00 0.21 0.00 -1.38 0.00 0.00 54.79 54.19 1ya6 n ASP 1352Cb 0.73 0.00 1.08 0.00 -1.04 0.00 0.00 41.12 41.89 1ya6 n ASP 1352CO 0.00 0.00 0.00 0.24 -0.82 0.00 0.00 177.20 176.62 1ya6 h MET 1353N 0.00 0.00 -0.01 -0.67 2.86 -1.67 -2.48 114.93 112.96 1ya6 h MET 1353Ca 0.00 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.38 1ya6 h MET 1353Cb 0.00 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.68 1ya6 h MET 1353CO 0.00 0.01 -1.01 1.49 1.06 0.00 0.00 176.91 178.46 1ya6 h GLU 1354N 0.00 0.64 -0.39 1.72 4.81 -1.96 -2.19 114.58 117.21 1ya6 h GLU 1354Ca -0.00 -0.68 -0.05 0.00 -0.13 0.00 0.00 59.36 58.50 1ya6 h GLU 1354Cb 0.11 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1ya6 h GLU 1354CO 0.00 1.27 0.02 1.03 -0.73 0.00 0.00 179.01 180.61 1ya6 h SER 1355N 0.37 0.56 0.37 1.04 0.87 -1.84 -0.74 113.55 114.18 1ya6 h SER 1355Ca -0.11 -0.11 -0.12 0.00 -1.23 0.00 0.00 61.79 60.22 1ya6 h SER 1355Cb 1.65 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.45 1ya6 h SER 1355CO 0.19 0.62 -0.50 0.74 -0.53 0.00 0.00 176.83 177.36 1ya6 h THR 1356N 0.58 1.35 0.00 2.23 2.02 -1.50 -2.18 112.91 115.41 1ya6 h THR 1356Ca 0.12 -1.73 -0.07 0.00 0.77 0.00 0.00 66.41 65.51 1ya6 h THR 1356Cb 0.33 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 1ya6 h THR 1356CO 0.01 0.51 -0.32 0.15 0.37 0.00 0.00 175.52 176.23 1ya6 h PHE 1357N 0.12 0.00 0.75 3.16 3.57 -0.62 -3.17 116.94 120.74 1ya6 h PHE 1357Ca 0.00 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1ya6 h PHE 1357Cb 0.92 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.67 1ya6 h PHE 1357CO 0.01 0.32 -0.36 0.93 -2.23 0.00 0.00 178.31 176.98 1ya6 h GLU 1358N 0.00 -0.97 0.00 1.11 4.39 -0.52 -2.47 114.58 116.13 1ya6 h GLU 1358Ca -0.00 0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1ya6 h GLU 1358Cb 0.96 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1ya6 h GLU 1358CO 0.04 -0.64 0.14 -2.13 -1.16 0.00 0.00 179.01 175.25 1ya6 n ARG 1359N -5.01 0.05 -0.08 2.33 3.00 -1.16 -1.47 116.66 114.33 1ya6 n ARG 1359Ca -0.12 0.49 -0.08 0.00 -0.00 0.00 0.00 57.85 58.14 1ya6 n ARG 1359Cb 0.40 -1.81 -0.03 0.00 0.00 0.00 0.00 32.46 31.01 1ya6 n ARG 1359CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1ya6 n ILE 1360N -1.74 1.44 -0.29 5.15 5.41 -1.04 -3.46 119.36 124.82 1ya6 n ILE 1360Ca -0.01 0.17 0.06 0.00 1.00 0.00 0.00 62.75 63.98 1ya6 n ILE 1360Cb 0.15 -2.34 0.28 0.00 -0.71 0.00 0.00 39.64 37.02 1ya6 n ILE 1360CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1ya6 h LYS 1361N -1.00 0.91 -0.03 0.38 1.57 -1.21 -0.03 116.57 117.16 1ya6 h LYS 1361Ca -0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1ya6 h LYS 1361Cb 0.65 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 1ya6 h LYS 1361CO -0.04 0.60 -0.03 1.49 -0.57 0.00 0.00 179.45 180.90 1ya6 h GLU 1362N 0.93 -0.02 0.00 3.15 4.81 -1.43 -0.23 114.58 121.79 1ya6 h GLU 1362Ca 0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 1ya6 h GLU 1362Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1ya6 h GLU 1362CO -0.17 -0.01 0.00 1.28 -0.73 0.00 0.00 179.01 179.38 1ya6 n LEU 1363N -2.89 0.36 -0.29 1.64 4.32 -1.03 -2.55 117.00 116.55 1ya6 n LEU 1363Ca -0.00 0.60 0.15 0.00 -0.02 0.00 0.00 56.01 56.73 1ya6 n LEU 1363Cb 0.02 -0.56 0.68 0.00 -1.62 0.00 0.00 43.42 41.93 1ya6 n LEU 1363CO -0.00 -0.48 0.96 -0.24 -1.22 0.00 0.00 177.39 176.41 1ya6 n SER 1364N -1.91 0.91 -0.04 -1.43 2.88 -0.05 -4.06 113.62 109.92 1ya6 n SER 1364Ca 0.02 -1.32 -0.08 0.00 -1.33 0.00 0.00 58.87 56.17 1ya6 n SER 1364Cb 0.17 -0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.60 1ya6 n SER 1364CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ya6 n SER 1365N -0.28 1.18 -4.10 -3.46 3.41 -0.95 -4.79 113.62 104.62 1ya6 n SER 1365Ca 0.21 0.07 -0.43 0.00 -0.26 0.00 0.00 58.87 58.46 1ya6 n SER 1365Cb 0.26 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1ya6 n SER 1365CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ya6 n ASP 1366N -3.23 5.22 0.20 4.04 4.64 -1.21 -4.81 116.55 121.40 1ya6 n ASP 1366Ca -0.16 -3.08 0.06 0.00 -1.38 0.00 0.00 54.79 50.24 1ya6 n ASP 1366Cb 0.62 -1.50 0.32 0.00 -1.04 0.00 0.00 41.12 39.52 1ya6 n ASP 1366CO 0.00 0.00 0.00 0.03 -0.82 0.00 0.00 177.20 176.41 1ya6 h ARG 1367N 6.25 0.00 -0.14 -0.67 3.08 -1.87 0.91 114.38 121.94 1ya6 h ARG 1367Ca 0.35 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.20 1ya6 h ARG 1367Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1ya6 h ARG 1367CO 1.46 0.00 -0.71 0.00 -1.07 0.00 0.00 179.97 179.65 1ya6 h ALA 1368N 0.84 0.48 -0.01 0.04 0.00 -1.90 -2.73 119.26 115.99 1ya6 h ALA 1368Ca 0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 1ya6 h ALA 1368Cb 0.93 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1ya6 h ALA 1368CO 0.00 0.71 -0.03 1.25 0.00 0.00 0.00 179.25 181.19 1ya6 h LEU 1369N 0.44 0.03 -1.11 0.00 5.85 0.51 -2.94 115.31 118.10 1ya6 h LEU 1369Ca -0.03 -0.67 0.31 0.00 0.84 0.00 0.00 57.88 58.33 1ya6 h LEU 1369Cb 1.30 -0.01 -0.13 0.00 0.37 0.00 0.00 40.66 42.19 1ya6 h LEU 1369CO 0.14 0.69 0.63 0.22 -0.34 0.00 0.00 178.44 179.78 1ya6 h TYR 1370N -0.63 0.86 0.00 1.25 3.20 -1.51 0.46 116.97 120.60 1ya6 h TYR 1370Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1ya6 h TYR 1370Cb 0.69 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.73 1ya6 h TYR 1370CO 0.16 -0.08 -0.14 -3.47 -1.64 0.00 0.00 178.16 172.99 1ya6 n ASP 1371N -4.90 0.74 -0.37 -2.11 4.64 -1.03 -1.74 116.55 111.78 1ya6 n ASP 1371Ca 0.30 0.46 0.12 0.00 -1.38 0.00 0.00 54.79 54.30 1ya6 n ASP 1371Cb 0.96 -0.56 0.20 0.00 -1.04 0.00 0.00 41.12 40.67 1ya6 n ASP 1371CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1ya6 n ARG 1372N -2.17 1.03 -0.13 -0.67 1.74 0.15 -3.70 116.66 112.91 1ya6 n ARG 1372Ca 0.05 -0.74 -0.23 0.00 -0.77 0.00 0.00 57.85 56.16 1ya6 n ARG 1372Cb 0.43 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 30.28 1ya6 n ARG 1372CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1ya6 n GLU 1373N -0.34 0.59 0.22 5.56 -0.58 -0.51 -3.81 120.64 121.77 1ya6 n GLU 1373Ca 0.11 0.19 0.16 0.00 -0.42 0.00 0.00 57.16 57.20 1ya6 n GLU 1373Cb 0.41 -1.46 0.75 0.00 -0.57 0.00 0.00 31.44 30.56 1ya6 n GLU 1373CO 0.00 0.00 0.00 0.07 -0.48 0.00 0.00 177.13 176.72 1ya6 h ARG 1374N -0.47 0.00 0.08 3.49 0.11 -1.50 0.86 114.38 116.95 1ya6 h ARG 1374Ca -0.61 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.19 1ya6 h ARG 1374Cb 1.72 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.78 1ya6 h ARG 1374CO -0.24 0.00 -1.41 0.93 0.10 0.00 0.00 179.97 179.34 1ya6 h GLU 1375N 0.00 0.17 -0.15 0.08 4.39 -1.75 -3.10 114.58 114.21 1ya6 h GLU 1375Ca 0.00 -0.28 -0.13 0.00 0.34 0.00 0.00 59.36 59.29 1ya6 h GLU 1375Cb 0.21 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1ya6 h GLU 1375CO 0.00 1.02 -0.47 0.87 -1.16 0.00 0.00 179.01 179.27 1ya6 h LYS 1376N 0.05 0.39 -0.03 2.33 1.57 -0.96 -2.84 116.57 117.06 1ya6 h LYS 1376Ca -0.19 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 58.22 1ya6 h LYS 1376Cb 1.96 0.01 0.01 0.00 0.08 0.00 0.00 32.23 34.29 1ya6 h LYS 1376CO 0.15 0.78 -0.61 0.00 -0.57 0.00 0.00 179.45 179.19 1ya6 h ALA 1377N 1.19 0.11 -0.73 3.86 0.00 0.07 -2.56 119.26 121.21 1ya6 h ALA 1377Ca 0.02 -0.56 0.08 0.00 0.00 0.00 0.00 54.91 54.44 1ya6 h ALA 1377Cb 0.94 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1ya6 h ALA 1377CO 0.08 0.39 0.40 -0.92 0.00 0.00 0.00 179.25 179.20 1ya6 h TYR 1378N 0.01 0.73 -0.37 0.00 5.03 -1.56 0.40 116.97 121.21 1ya6 h TYR 1378Ca -0.07 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.20 1ya6 h TYR 1378Cb 1.30 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 39.35 1ya6 h TYR 1378CO 0.13 0.32 -0.02 1.49 -1.32 0.00 0.00 178.16 178.77 1ya6 h GLU 1379N 0.71 0.67 0.02 1.82 4.57 -1.55 0.30 114.58 121.12 1ya6 h GLU 1379Ca 0.34 -0.22 -0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1ya6 h GLU 1379Cb 0.27 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1ya6 h GLU 1379CO -0.22 0.78 -0.01 0.35 -1.18 0.00 0.00 179.01 178.74 1ya6 h PHE 1380N 0.48 -0.02 -0.12 0.92 3.57 -0.88 -0.25 116.94 120.63 1ya6 h PHE 1380Ca 0.10 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.51 1ya6 h PHE 1380Cb 0.49 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1ya6 h PHE 1380CO 0.04 0.03 -0.34 -0.07 -2.23 0.00 0.00 178.31 175.73 1ya6 h LEU 1381N -0.06 0.25 0.23 0.59 3.38 -0.22 -1.89 115.31 117.60 1ya6 h LEU 1381Ca -0.00 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1ya6 h LEU 1381Cb 0.05 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1ya6 h LEU 1381CO 0.00 0.59 -0.11 0.22 0.09 0.00 0.00 178.44 179.23 1ya6 h TYR 1382N 0.22 -0.29 0.00 1.13 3.20 -0.60 -1.31 116.97 119.31 1ya6 h TYR 1382Ca 0.03 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1ya6 h TYR 1382Cb 0.71 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 39.08 1ya6 h TYR 1382CO 0.01 -0.11 -0.05 1.96 -1.64 0.00 0.00 178.16 178.34 1ya6 h GLN 1383N -0.41 0.00 0.19 1.82 1.08 -0.88 -2.62 115.11 114.30 1ya6 h GLN 1383Ca -0.03 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.82 1ya6 h GLN 1383Cb 0.31 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.75 1ya6 h GLN 1383CO 0.05 0.05 -1.73 1.25 -0.95 0.00 0.00 178.83 177.50 1ya6 h HIS 1384N 0.00 0.75 0.00 2.96 2.76 -0.71 -3.44 115.15 117.46 1ya6 h HIS 1384Ca -0.00 -0.54 -0.14 0.00 -2.20 0.00 0.00 60.37 57.49 1ya6 h HIS 1384Cb 0.14 -0.03 -0.26 0.00 1.55 0.00 0.00 27.41 28.82 1ya6 h HIS 1384CO 0.00 1.67 -0.75 0.94 -1.30 0.00 0.00 177.93 178.49 1ya6 n GLN 1385N -3.60 0.00 -2.48 5.26 7.27 -0.55 -4.65 117.38 118.62 1ya6 n GLN 1385Ca -0.24 -1.54 -0.35 0.00 0.07 0.00 0.00 57.00 54.94 1ya6 n GLN 1385Cb 1.08 0.04 -0.03 0.00 2.41 0.00 0.00 30.24 33.74 1ya6 n GLN 1385CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1ya6 s ASP 1386N -1.54 6.37 0.27 1.69 2.15 -0.99 -2.14 116.67 122.48 1ya6 s ASP 1386Ca 0.20 2.03 -0.01 0.00 0.43 0.00 0.00 52.55 55.20 1ya6 s ASP 1386Cb 0.23 -2.57 0.47 0.00 -0.30 0.00 0.00 42.92 40.75 1ya6 s ASP 1386CO -0.10 -0.76 1.83 0.28 -0.17 0.00 0.00 175.17 176.25 1ya6 h SER 1387N 1.85 0.85 -0.81 -0.34 0.02 -1.09 -1.91 113.55 112.12 1ya6 h SER 1387Ca -0.49 0.04 0.19 0.00 -0.84 0.00 0.00 61.79 60.69 1ya6 h SER 1387Cb 1.23 -0.13 -0.12 0.00 0.14 0.00 0.00 62.40 63.52 1ya6 h SER 1387CO 0.60 0.48 0.24 0.77 -1.14 0.00 0.00 176.83 177.77 1ya6 h SER 1388N 0.94 0.08 0.00 3.07 4.64 -1.91 -1.66 113.55 118.71 1ya6 h SER 1388Ca 0.45 0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.85 1ya6 h SER 1388Cb 0.40 0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1ya6 h SER 1388CO -0.25 -0.05 -0.50 -0.26 -0.87 0.00 0.00 176.83 174.90 1ya6 h PHE 1389N 0.29 0.00 -0.46 4.77 0.04 -1.79 -3.36 116.94 116.43 1ya6 h PHE 1389Ca 0.48 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.20 1ya6 h PHE 1389Cb 0.87 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.00 1ya6 h PHE 1389CO -0.24 0.87 0.10 0.00 -0.60 0.00 0.00 178.31 178.44 1ya6 h PHE 1391N 0.62 0.28 -0.59 0.00 -1.00 -1.53 -0.31 116.94 114.41 1ya6 h PHE 1391Ca 0.14 -0.10 -0.08 0.00 2.81 0.00 0.00 57.97 60.74 1ya6 h PHE 1391Cb 0.35 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.83 1ya6 h PHE 1391CO 0.02 0.73 0.04 -0.22 -1.61 0.00 0.00 178.31 177.27 1ya6 h LYS 1392N 0.18 1.00 0.62 1.51 1.63 -1.66 0.67 116.57 120.52 1ya6 h LYS 1392Ca 0.00 -0.28 -0.03 0.00 -0.85 0.00 0.00 60.65 59.49 1ya6 h LYS 1392Cb 1.03 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.55 1ya6 h LYS 1392CO 0.08 0.96 -0.35 1.49 -3.45 0.00 0.00 179.45 178.18 1ya6 h GLU 1393N 0.93 -0.87 -0.02 1.90 4.81 -0.89 -1.68 114.58 118.75 1ya6 h GLU 1393Ca 0.18 0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.42 1ya6 h GLU 1393Cb 0.48 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1ya6 h GLU 1393CO 0.02 -0.58 -0.19 1.96 -0.73 0.00 0.00 179.01 179.49 1ya6 h GLN 1394N -0.90 0.03 -0.15 1.92 4.20 -0.71 -2.70 115.11 116.80 1ya6 h GLN 1394Ca -0.08 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.46 1ya6 h GLN 1394Cb 0.72 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1ya6 h GLN 1394CO 0.10 0.23 -0.58 0.35 -0.67 0.00 0.00 178.83 178.25 1ya6 h PHE 1395N 0.03 0.62 -0.45 2.96 3.04 0.58 -2.22 116.94 121.51 1ya6 h PHE 1395Ca 0.01 -0.23 -0.08 0.00 3.98 0.00 0.00 57.97 61.65 1ya6 h PHE 1395Cb 0.36 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.74 1ya6 h PHE 1395CO 0.00 0.95 -0.05 -0.44 -2.02 0.00 0.00 178.31 176.76 1ya6 h ASP 1396N 0.37 0.74 0.13 0.41 3.45 -0.98 -1.76 116.42 118.77 1ya6 h ASP 1396Ca -0.00 -0.19 -0.20 0.00 0.43 0.00 0.00 57.03 57.07 1ya6 h ASP 1396Cb 1.13 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.70 1ya6 h ASP 1396CO 0.11 0.83 -0.74 0.40 -1.57 0.00 0.00 179.24 178.27 1ya6 h ILE 1397N 0.70 1.35 -0.63 0.35 2.04 -1.41 0.12 117.51 120.03 1ya6 h ILE 1397Ca 0.13 -2.08 -0.09 0.00 1.00 0.00 0.00 64.86 63.82 1ya6 h ILE 1397Cb 0.50 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.62 1ya6 h ILE 1397CO 0.03 0.64 0.04 0.40 0.00 0.00 0.00 178.15 179.25 1ya6 h ILE 1398N 0.36 1.27 -0.03 -0.67 2.04 -1.26 -3.01 117.51 116.21 1ya6 h ILE 1398Ca -0.04 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.71 1ya6 h ILE 1398Cb 1.33 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 1ya6 h ILE 1398CO 0.14 0.41 -0.00 0.35 0.00 0.00 0.00 178.15 179.04 1ya6 n THR 1399N -4.20 0.00 0.00 -0.27 -2.24 -0.68 -5.05 114.28 101.85 1ya6 n THR 1399Ca 0.03 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1ya6 n THR 1399Cb 0.33 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1ya6 n THR 1399CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67