#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ziq s LYS 1002N 0.00 0.20 0.01 1.61 2.20 -0.40 -4.40 119.74 118.96 1ziq s LYS 1002Ca 0.00 0.55 0.02 0.00 -0.36 0.00 0.00 55.97 56.18 1ziq s LYS 1002Cb 0.00 -0.12 -0.01 0.00 -1.51 0.00 0.00 37.83 36.19 1ziq s LYS 1002CO 0.00 -0.17 -0.07 -1.50 -0.36 0.00 0.00 175.35 173.25 1ziq s ILE 1003N 1.34 0.54 -0.08 5.43 2.07 -0.24 -0.95 121.20 129.32 1ziq s ILE 1003Ca -0.09 -0.49 0.03 0.00 -1.41 0.00 0.00 60.65 58.70 1ziq s ILE 1003Cb -0.10 -0.49 0.00 0.00 0.13 0.00 0.00 42.46 42.00 1ziq s ILE 1003CO -0.09 0.01 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.89 1ziq s THR 1004N -0.46 1.60 -0.10 4.00 2.01 0.01 -0.94 115.64 121.76 1ziq s THR 1004Ca -0.00 -0.76 -0.06 0.00 0.31 0.00 0.00 61.69 61.17 1ziq s THR 1004Cb -0.04 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 1ziq s THR 1004CO 0.00 0.46 0.14 -0.36 -0.69 0.00 0.00 174.62 174.17 1ziq s PHE 1005N 0.41 3.58 -0.03 4.92 0.40 0.03 -1.35 117.98 125.95 1ziq s PHE 1005Ca -0.15 0.50 0.04 0.00 -0.60 0.00 0.00 56.93 56.72 1ziq s PHE 1005Cb -0.16 -1.92 -0.00 0.00 0.51 0.00 0.00 43.02 41.44 1ziq s PHE 1005CO 0.06 0.72 -0.14 0.71 0.70 0.00 0.00 175.22 177.27 1ziq s TYR 1006N -1.07 1.39 0.33 0.36 1.51 -0.38 -0.84 117.35 118.66 1ziq s TYR 1006Ca 0.17 -0.35 0.10 0.00 -1.01 0.00 0.00 57.07 55.98 1ziq s TYR 1006Cb -0.12 -0.94 0.57 0.00 -0.11 0.00 0.00 41.96 41.36 1ziq s TYR 1006CO 0.06 -0.10 1.75 0.93 -1.11 0.00 0.00 175.55 177.08 1ziq h GLU 1007N 6.13 0.08 -6.16 -0.62 5.08 -0.88 0.01 114.58 118.23 1ziq h GLU 1007Ca -0.34 -0.04 -0.55 0.00 -1.00 0.00 0.00 59.36 57.44 1ziq h GLU 1007Cb 1.17 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 1ziq h GLU 1007CO 0.48 0.50 -0.60 -0.51 -1.00 0.00 0.00 179.01 177.88 1ziq s ASP 1008N -6.90 4.68 0.96 1.42 1.01 -0.55 -3.40 116.67 113.89 1ziq s ASP 1008Ca -0.03 -0.66 -0.12 0.00 0.71 0.00 0.00 52.55 52.45 1ziq s ASP 1008Cb 0.14 -0.85 0.17 0.00 1.01 0.00 0.00 42.92 43.38 1ziq s ASP 1008CO 0.75 -0.11 1.10 0.00 0.21 0.00 0.00 175.17 177.11 1ziq s ARG 1009N -3.75 0.70 -1.88 8.23 1.70 -1.26 -3.45 118.95 119.25 1ziq s ARG 1009Ca 0.34 0.54 0.00 0.00 -0.47 0.00 0.00 55.73 56.14 1ziq s ARG 1009Cb -0.05 -1.77 0.00 0.00 -0.57 0.00 0.00 34.95 32.56 1ziq s ARG 1009CO 0.21 -2.55 0.00 0.41 -1.08 0.00 0.00 175.30 172.29 1ziq n GLY 1010N -1.27 0.13 2.83 3.88 0.00 0.60 -3.21 105.19 108.15 1ziq n GLY 1010Ca 0.06 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 1ziq n GLY 1010CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ziq n PHE 1011N -3.61 -1.76 -4.18 1.61 3.72 -1.24 -5.03 117.46 106.97 1ziq n PHE 1011Ca -0.24 0.58 -0.24 0.00 -0.05 0.00 0.00 57.45 57.50 1ziq n PHE 1011Cb 0.68 -3.65 -0.07 0.00 -0.94 0.00 0.00 39.48 35.50 1ziq n PHE 1011CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ziq s GLN 1012N -5.70 2.25 0.95 -1.08 -1.52 -1.20 -5.03 119.66 108.33 1ziq s GLN 1012Ca 0.33 -1.68 0.00 0.00 -1.95 0.00 0.00 55.36 52.07 1ziq s GLN 1012Cb -0.15 -2.06 0.00 0.00 -0.22 0.00 0.00 33.01 30.59 1ziq s GLN 1012CO 0.41 0.07 0.00 0.41 -0.25 0.00 0.00 175.29 175.93 1ziq n GLY 1013N -1.11 -2.11 3.62 3.09 0.00 -1.26 -1.48 105.19 105.94 1ziq n GLY 1013Ca -0.03 -1.45 -0.47 0.00 0.00 0.00 0.00 46.02 44.07 1ziq n GLY 1013CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ziq n ARG 1014N -0.03 1.53 -4.28 1.61 0.63 -1.26 -4.57 116.66 110.29 1ziq n ARG 1014Ca 0.00 0.54 -0.15 0.00 -0.92 0.00 0.00 57.85 57.32 1ziq n ARG 1014Cb 0.00 -2.11 -0.10 0.00 0.45 0.00 0.00 32.46 30.70 1ziq n ARG 1014CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 1ziq s HIS 1015N -0.14 1.37 -0.08 -0.14 -3.43 -1.26 -0.56 115.29 111.04 1ziq s HIS 1015Ca 0.71 -1.05 -0.03 0.00 -0.80 0.00 0.00 55.06 53.88 1ziq s HIS 1015Cb -0.77 -0.79 0.05 0.00 -1.43 0.00 0.00 32.58 29.64 1ziq s HIS 1015CO 0.51 -0.22 0.17 -0.47 -2.00 0.00 0.00 174.74 172.73 1ziq s TYR 1016N -3.65 -0.20 -0.13 0.38 5.04 -0.02 -4.96 117.35 113.81 1ziq s TYR 1016Ca 0.29 0.62 -0.17 0.00 -2.44 0.00 0.00 57.07 55.37 1ziq s TYR 1016Cb 0.07 -0.18 -0.04 0.00 0.35 0.00 0.00 41.96 42.16 1ziq s TYR 1016CO 0.08 -0.25 0.42 -2.00 -1.34 0.00 0.00 175.55 172.46 1ziq s GLU 1017N 1.93 4.31 -0.02 4.97 2.12 -1.26 -0.79 118.70 129.97 1ziq s GLU 1017Ca -0.01 0.33 0.02 0.00 0.36 0.00 0.00 54.97 55.67 1ziq s GLU 1017Cb -0.12 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.84 1ziq s GLU 1017CO -0.06 0.17 -0.05 0.00 -0.54 0.00 0.00 175.26 174.78 1ziq n SER 1019N 3.43 1.10 -4.15 0.00 3.41 -1.26 -1.08 113.62 115.08 1ziq n SER 1019Ca -0.19 -1.94 -0.10 0.00 -0.26 0.00 0.00 58.87 56.38 1ziq n SER 1019Cb 0.54 -0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.27 1ziq n SER 1019CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ziq s THR 1020N -0.91 0.09 0.43 6.66 -4.23 -1.26 -4.57 115.64 111.85 1ziq s THR 1020Ca 0.07 -1.91 -0.25 0.00 -1.18 0.00 0.00 61.69 58.42 1ziq s THR 1020Cb 0.06 -2.08 -0.10 0.00 1.34 0.00 0.00 72.50 71.72 1ziq s THR 1020CO 0.01 -0.43 1.16 0.47 -0.54 0.00 0.00 174.62 175.29 1ziq n ASP 1021N -0.11 1.99 -3.77 3.99 8.00 -1.26 -4.72 116.55 120.66 1ziq n ASP 1021Ca -0.05 1.07 -0.19 0.00 0.71 0.00 0.00 54.79 56.32 1ziq n ASP 1021Cb 0.64 -1.44 -0.17 0.00 -0.02 0.00 0.00 41.12 40.13 1ziq n ASP 1021CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1ziq s HIS 1022N -1.24 0.36 -0.84 1.24 3.76 -0.14 -4.98 115.29 113.46 1ziq s HIS 1022Ca 0.63 0.01 0.27 0.00 -0.15 0.00 0.00 55.06 55.81 1ziq s HIS 1022Cb -0.52 -0.54 0.86 0.00 1.11 0.00 0.00 32.58 33.49 1ziq s HIS 1022CO 0.57 -0.20 1.73 -1.13 -0.85 0.00 0.00 174.74 174.86 1ziq n SER 1023N 4.69 0.49 -3.29 1.40 3.41 -1.26 -0.78 113.62 118.29 1ziq n SER 1023Ca -0.16 0.41 -0.06 0.00 -0.26 0.00 0.00 58.87 58.81 1ziq n SER 1023Cb 0.50 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.93 1ziq n SER 1023CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1ziq s ASN 1024N -3.83 -0.15 0.00 4.04 2.47 -1.24 -0.06 114.94 116.17 1ziq s ASN 1024Ca 0.11 0.22 0.24 0.00 0.42 0.00 0.00 52.86 53.85 1ziq s ASN 1024Cb 0.15 1.37 0.28 0.00 -1.45 0.00 0.00 41.25 41.60 1ziq s ASN 1024CO 0.60 -0.30 1.28 0.18 -3.72 0.00 0.00 177.10 175.13 1ziq n LEU 1025N 5.38 1.95 -0.24 3.21 4.77 0.65 -4.48 117.00 128.24 1ziq n LEU 1025Ca -0.02 -0.67 0.10 0.00 -0.03 0.00 0.00 56.01 55.39 1ziq n LEU 1025Cb 0.50 -0.03 0.36 0.00 -2.33 0.00 0.00 43.42 41.93 1ziq n LEU 1025CO 0.03 0.35 1.22 1.56 -1.33 0.00 0.00 177.39 179.22 1ziq h GLN 1026N 2.58 0.71 0.00 3.23 4.20 -1.76 -1.01 115.11 123.06 1ziq h GLN 1026Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1ziq h GLN 1026Cb 0.73 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1ziq h GLN 1026CO 0.00 0.47 0.00 -1.35 -0.67 0.00 0.00 178.83 177.28 1ziq h PRO 1027N 0.73 0.00 0.00 1.46 0.11 -1.98 -3.20 132.00 129.12 1ziq h PRO 1027Ca 0.39 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.41 1ziq h PRO 1027Cb 0.53 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 1ziq h PRO 1027CO -0.16 0.00 -1.87 0.66 -0.21 0.00 0.00 178.00 176.41 1ziq n TYR 1028N -2.91 0.00 -3.48 0.65 4.02 -0.40 -5.04 117.16 110.00 1ziq n TYR 1028Ca -0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.77 1ziq n TYR 1028Cb 0.08 -0.51 -0.02 0.00 -0.02 0.00 0.00 39.34 38.87 1ziq n TYR 1028CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 1ziq s PHE 1029N -2.93 -0.40 -0.31 -0.72 -0.12 -1.09 -4.77 117.98 107.65 1ziq s PHE 1029Ca -0.07 0.25 0.09 0.00 -0.05 0.00 0.00 56.93 57.15 1ziq s PHE 1029Cb 0.09 0.54 -0.11 0.00 -0.63 0.00 0.00 43.02 42.91 1ziq s PHE 1029CO 0.69 -0.62 0.34 -1.13 -0.05 0.00 0.00 175.22 174.44 1ziq n SER 1030N -0.27 1.14 -3.78 1.98 3.41 -1.26 -4.26 113.62 110.58 1ziq n SER 1030Ca -0.11 -0.51 -0.10 0.00 -0.26 0.00 0.00 58.87 57.90 1ziq n SER 1030Cb 0.63 1.13 -0.05 0.00 -0.26 0.00 0.00 64.21 65.65 1ziq n SER 1030CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ziq s ARG 1031N -2.10 1.13 -0.23 4.33 1.70 -1.26 -4.90 118.95 117.62 1ziq s ARG 1031Ca 0.01 -0.90 -0.04 0.00 -0.47 0.00 0.00 55.73 54.33 1ziq s ARG 1031Cb 0.07 0.44 0.08 0.00 -0.57 0.00 0.00 34.95 34.97 1ziq s ARG 1031CO 0.38 -0.43 0.11 0.00 -1.08 0.00 0.00 175.30 174.28 1ziq n ASN 1033N 5.25 1.56 -3.49 0.00 3.02 -0.03 -4.55 115.26 117.02 1ziq n ASN 1033Ca -0.06 -1.28 -0.12 0.00 -0.03 0.00 0.00 54.58 53.08 1ziq n ASN 1033Cb 0.45 0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.83 1ziq n ASN 1033CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ziq s SER 1034N -1.16 -0.48 -0.06 6.41 1.04 -1.06 -3.17 113.70 115.22 1ziq s SER 1034Ca 0.11 0.00 -0.05 0.00 0.48 0.00 0.00 55.95 56.49 1ziq s SER 1034Cb 0.09 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.77 1ziq s SER 1034CO 0.20 -0.89 0.15 -0.69 0.98 0.00 0.00 173.24 172.99 1ziq s VAL 1035N -3.41 -0.00 -0.26 5.02 1.01 -0.39 -1.25 120.40 121.11 1ziq s VAL 1035Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 1ziq s VAL 1035Cb -0.00 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.18 1ziq s VAL 1035CO -0.10 0.00 -0.00 -0.13 0.00 0.00 0.00 175.10 174.87 1ziq s ARG 1036N 0.09 2.99 -0.54 2.72 0.52 -0.46 -0.92 118.95 123.36 1ziq s ARG 1036Ca -0.00 -0.90 -0.18 0.00 -0.52 0.00 0.00 55.73 54.13 1ziq s ARG 1036Cb -0.01 -3.14 0.09 0.00 0.52 0.00 0.00 34.95 32.40 1ziq s ARG 1036CO 0.00 -0.40 0.60 0.08 0.02 0.00 0.00 175.30 175.61 1ziq s VAL 1037N 1.41 4.95 0.19 3.52 1.01 0.40 -0.81 120.40 131.08 1ziq s VAL 1037Ca 0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 61.98 61.03 1ziq s VAL 1037Cb -0.17 -4.35 0.06 0.00 0.00 0.00 0.00 36.38 31.93 1ziq s VAL 1037CO -0.02 -0.90 1.64 0.44 0.00 0.00 0.00 175.10 176.27 1ziq h ASP 1038N 9.02 1.01 -4.43 3.32 3.32 -1.33 -0.79 116.42 126.54 1ziq h ASP 1038Ca -0.29 -0.30 0.17 0.00 0.02 0.00 0.00 57.03 56.63 1ziq h ASP 1038Cb 1.10 -0.27 -0.17 0.00 0.22 0.00 0.00 39.33 40.20 1ziq h ASP 1038CO 1.01 1.08 0.63 -0.94 -1.72 0.00 0.00 179.24 179.31 1ziq s SER 1039N -6.62 -0.27 0.00 6.45 1.04 -0.92 -4.82 113.70 108.56 1ziq s SER 1039Ca -0.11 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.34 1ziq s SER 1039Cb 0.14 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1ziq s SER 1039CO 0.85 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 175.24 1ziq n GLY 1040N -0.12 -0.50 3.78 7.32 0.00 -1.26 -1.28 105.19 113.13 1ziq n GLY 1040Ca -0.05 -1.69 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 1ziq n GLY 1040CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ziq s TRP 1042N -0.80 1.15 -0.25 0.00 0.52 0.13 -0.73 118.94 118.96 1ziq s TRP 1042Ca 0.13 -0.30 -0.07 0.00 0.02 0.00 0.00 56.10 55.88 1ziq s TRP 1042Cb -0.12 -0.70 -0.03 0.00 -1.15 0.00 0.00 33.47 31.47 1ziq s TRP 1042CO 0.03 0.01 0.07 1.41 0.02 0.00 0.00 176.95 178.49 1ziq s MET 1043N -0.80 3.66 0.05 4.98 1.75 0.11 -1.19 119.30 127.87 1ziq s MET 1043Ca 0.02 -0.47 -0.02 0.00 -1.25 0.00 0.00 55.69 53.97 1ziq s MET 1043Cb -0.07 -3.32 -0.04 0.00 2.84 0.00 0.00 34.83 34.24 1ziq s MET 1043CO 0.00 -0.17 0.23 -0.51 -0.65 0.00 0.00 175.02 173.93 1ziq s LEU 1044N 1.57 4.35 -0.04 4.11 1.43 0.78 -0.42 118.68 130.47 1ziq s LEU 1044Ca 0.06 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.58 1ziq s LEU 1044Cb -0.15 -2.89 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1ziq s LEU 1044CO 0.04 0.19 -0.18 -0.31 0.23 0.00 0.00 176.35 176.31 1ziq s TYR 1045N -1.46 1.74 0.39 0.29 1.51 -0.02 -0.54 117.35 119.26 1ziq s TYR 1045Ca 0.33 -0.46 0.08 0.00 -1.01 0.00 0.00 57.07 56.01 1ziq s TYR 1045Cb -0.13 -1.16 0.78 0.00 -0.11 0.00 0.00 41.96 41.34 1ziq s TYR 1045CO 0.24 -0.13 1.96 1.49 -1.11 0.00 0.00 175.55 177.99 1ziq h GLU 1046N 6.09 0.39 -6.09 -0.62 4.81 -0.93 0.19 114.58 118.43 1ziq h GLU 1046Ca -0.34 -0.06 -0.61 0.00 -0.13 0.00 0.00 59.36 58.22 1ziq h GLU 1046Cb 1.17 -0.07 -0.14 0.00 0.63 0.00 0.00 28.75 30.34 1ziq h GLU 1046CO 0.48 0.40 -0.73 -0.65 -0.73 0.00 0.00 179.01 177.78 1ziq s GLN 1047N -5.03 1.72 0.98 1.92 -0.21 -0.34 -3.29 119.66 115.41 1ziq s GLN 1047Ca -0.07 -1.82 -0.11 0.00 0.02 0.00 0.00 55.36 53.37 1ziq s GLN 1047Cb 0.16 -1.72 0.18 0.00 1.00 0.00 0.00 33.01 32.63 1ziq s GLN 1047CO 0.74 0.26 1.09 -2.14 -2.12 0.00 0.00 175.29 173.12 1ziq s PRO 1048N -3.55 0.50 -1.48 2.91 0.02 -1.26 -2.89 135.00 129.25 1ziq s PRO 1048Ca 0.31 1.13 -0.07 0.00 0.02 0.00 0.00 61.00 62.39 1ziq s PRO 1048Cb -0.02 -1.70 0.01 0.00 0.02 0.00 0.00 34.50 32.81 1ziq s PRO 1048CO 0.15 -2.85 0.86 0.09 -0.33 0.00 0.00 177.00 174.93 1ziq n ASN 1049N -4.34 -6.23 -3.54 2.53 5.03 0.91 -2.95 115.26 106.67 1ziq n ASN 1049Ca 0.08 -0.40 -0.19 0.00 0.87 0.00 0.00 54.58 54.93 1ziq n ASN 1049Cb 0.54 -4.98 0.07 0.00 -1.02 0.00 0.00 39.78 34.39 1ziq n ASN 1049CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1ziq n PHE 1050N -4.74 -2.20 -4.52 3.10 3.72 -1.24 -5.00 117.46 106.58 1ziq n PHE 1050Ca -0.06 0.92 -0.25 0.00 -0.05 0.00 0.00 57.45 58.02 1ziq n PHE 1050Cb 0.59 -4.87 -0.10 0.00 -0.94 0.00 0.00 39.48 34.17 1ziq n PHE 1050CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1ziq s THR 1051N -3.43 1.18 0.00 4.37 -4.23 -1.14 -5.03 115.64 107.36 1ziq s THR 1051Ca 0.09 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1ziq s THR 1051Cb -0.04 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.13 1ziq s THR 1051CO 0.75 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.44 1ziq n GLY 1052N -0.84 -1.39 3.76 3.99 0.00 -1.26 -1.20 105.19 108.24 1ziq n GLY 1052Ca -0.05 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 1ziq n GLY 1052CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ziq s GLN 1054N -2.35 2.26 -0.02 0.00 -0.21 -1.26 -0.70 119.66 117.39 1ziq s GLN 1054Ca 0.59 -0.89 0.00 0.00 0.02 0.00 0.00 55.36 55.09 1ziq s GLN 1054Cb -0.46 -2.33 0.03 0.00 1.00 0.00 0.00 33.01 31.25 1ziq s GLN 1054CO 0.59 0.56 0.01 0.71 -2.12 0.00 0.00 175.29 175.04 1ziq s TYR 1055N -1.00 0.15 -0.20 0.91 1.51 0.30 -4.09 117.35 114.93 1ziq s TYR 1055Ca 0.17 0.07 -0.20 0.00 -1.01 0.00 0.00 57.07 56.09 1ziq s TYR 1055Cb -0.11 -0.29 -0.03 0.00 -0.11 0.00 0.00 41.96 41.43 1ziq s TYR 1055CO 0.07 -0.10 0.58 0.12 -1.11 0.00 0.00 175.55 175.12 1ziq s PHE 1056N 0.95 3.38 0.09 2.71 5.36 -1.26 -0.15 117.98 129.05 1ziq s PHE 1056Ca -0.09 0.86 0.08 0.00 -0.96 0.00 0.00 56.93 56.82 1ziq s PHE 1056Cb -0.12 -2.74 -0.03 0.00 -0.34 0.00 0.00 43.02 39.79 1ziq s PHE 1056CO -0.02 -0.14 -0.20 -0.51 -1.46 0.00 0.00 175.22 172.89 1ziq s LEU 1057N 1.77 2.27 0.00 6.12 1.02 -0.33 -4.96 118.68 124.57 1ziq s LEU 1057Ca 0.27 -0.64 0.07 0.00 0.02 0.00 0.00 54.13 53.85 1ziq s LEU 1057Cb -0.16 -0.84 -0.03 0.00 0.02 0.00 0.00 46.19 45.18 1ziq s LEU 1057CO 0.10 0.06 0.26 -2.11 0.02 0.00 0.00 176.35 174.68 1ziq n ARG 1058N 1.27 0.45 -1.59 1.70 1.85 -1.26 0.22 116.66 119.30 1ziq n ARG 1058Ca -0.19 -3.43 -0.49 0.00 -1.00 0.00 0.00 57.85 52.74 1ziq n ARG 1058Cb 0.54 2.60 -0.04 0.00 -1.05 0.00 0.00 32.46 34.50 1ziq n ARG 1058CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1ziq n ARG 1059N -0.71 1.24 0.00 2.89 0.63 -1.24 -4.62 116.66 114.84 1ziq n ARG 1059Ca 0.05 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.42 1ziq n ARG 1059Cb 0.62 -1.99 0.00 0.00 0.45 0.00 0.00 32.46 31.54 1ziq n ARG 1059CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ziq n GLY 1060N 2.16 2.54 3.64 5.14 0.00 -0.30 -4.94 105.19 113.43 1ziq n GLY 1060Ca 0.16 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 1ziq n GLY 1060CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ziq s ASP 1061N 0.00 5.52 -0.48 1.61 1.01 -1.26 -0.45 116.67 122.61 1ziq s ASP 1061Ca 0.00 0.10 0.03 0.00 0.71 0.00 0.00 52.55 53.39 1ziq s ASP 1061Cb 0.00 -1.87 0.14 0.00 1.01 0.00 0.00 42.92 42.20 1ziq s ASP 1061CO 0.00 0.23 0.26 -0.31 0.21 0.00 0.00 175.17 175.56 1ziq s TYR 1062N 0.05 2.51 -1.37 4.23 1.51 -0.10 -4.99 117.35 119.20 1ziq s TYR 1062Ca 0.05 -2.76 0.23 0.00 -1.01 0.00 0.00 57.07 53.58 1ziq s TYR 1062Cb -0.12 -2.27 1.15 0.00 -0.11 0.00 0.00 41.96 40.60 1ziq s TYR 1062CO 0.01 -0.75 1.76 -0.35 -1.11 0.00 0.00 175.55 175.11 1ziq n PRO 1063N 3.28 0.29 -3.81 -1.71 -0.04 -1.26 -1.27 135.00 130.47 1ziq n PRO 1063Ca 0.08 0.07 -0.12 0.00 -0.04 0.00 0.00 63.50 63.49 1ziq n PRO 1063Cb 0.34 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.21 1ziq n PRO 1063CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ziq s ASP 1064N -2.63 -0.09 0.59 3.54 1.11 -1.23 -0.29 116.67 117.67 1ziq s ASP 1064Ca 0.21 -0.05 0.36 0.00 0.18 0.00 0.00 52.55 53.25 1ziq s ASP 1064Cb 0.16 0.26 1.76 0.00 1.07 0.00 0.00 42.92 46.17 1ziq s ASP 1064CO 0.36 -0.41 2.14 0.10 1.18 0.00 0.00 175.17 178.55 1ziq h TYR 1065N 4.08 0.00 0.00 4.23 -0.00 -1.84 -2.03 116.97 121.41 1ziq h TYR 1065Ca -0.30 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.41 1ziq h TYR 1065Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.91 1ziq h TYR 1065CO 0.56 0.03 -0.10 1.96 -0.00 0.00 0.00 178.16 180.60 1ziq h GLN 1066N 0.00 0.00 0.00 0.10 7.50 -1.92 -1.26 115.11 119.53 1ziq h GLN 1066Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1ziq h GLN 1066Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.83 1ziq h GLN 1066CO 0.00 0.10 0.00 1.04 -1.50 0.00 0.00 178.83 178.48 1ziq n GLN 1067N -3.62 0.18 -0.55 1.46 1.13 -0.76 -0.51 117.38 114.71 1ziq n GLN 1067Ca -0.02 0.44 0.04 0.00 -1.94 0.00 0.00 57.00 55.52 1ziq n GLN 1067Cb 0.23 -1.87 0.23 0.00 0.11 0.00 0.00 30.24 28.94 1ziq n GLN 1067CO 0.00 0.00 0.00 -2.67 -1.44 0.00 0.00 177.06 172.95 1ziq n TRP 1068N -2.21 0.97 -3.42 1.08 2.14 -0.58 -4.94 117.44 110.47 1ziq n TRP 1068Ca 0.02 -1.14 -0.25 0.00 2.07 0.00 0.00 57.50 58.20 1ziq n TRP 1068Cb 0.21 -0.37 0.03 0.00 -0.81 0.00 0.00 31.31 30.37 1ziq n TRP 1068CO 0.00 0.00 0.00 -1.33 2.07 0.00 0.00 177.69 178.43 1ziq n MET 1069N -0.78 -5.41 -2.15 -2.67 2.81 0.33 -4.70 117.12 104.56 1ziq n MET 1069Ca 0.26 0.73 -0.38 0.00 -1.81 0.00 0.00 57.70 56.50 1ziq n MET 1069Cb 0.94 -5.62 -0.00 0.00 -0.71 0.00 0.00 33.22 27.83 1ziq n MET 1069CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1ziq s GLY 1070N -2.98 2.83 -0.03 3.03 0.00 -0.59 -4.92 107.32 104.67 1ziq s GLY 1070Ca 0.47 1.06 0.20 0.00 0.00 0.00 0.00 44.72 46.45 1ziq s GLY 1070CO 0.58 1.55 1.53 0.69 0.00 0.00 0.00 173.10 177.45 1ziq n PHE 1071N -0.42 1.04 0.00 1.90 0.99 -1.26 -4.68 117.46 115.04 1ziq n PHE 1071Ca 0.07 -0.53 0.00 0.00 -0.00 0.00 0.00 57.45 56.99 1ziq n PHE 1071Cb 0.47 -0.06 0.00 0.00 -1.00 0.00 0.00 39.48 38.88 1ziq n PHE 1071CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1ziq n SER 1072N 1.40 0.00 -0.78 4.37 3.41 -1.26 -4.98 113.62 115.77 1ziq n SER 1072Ca 0.24 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.87 1ziq n SER 1072Cb 0.67 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.74 1ziq n SER 1072CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ziq n ASP 1073N 0.00 2.10 -4.70 4.04 5.68 -1.26 -4.89 116.55 117.52 1ziq n ASP 1073Ca 0.00 -2.20 -0.40 0.00 -0.50 0.00 0.00 54.79 51.69 1ziq n ASP 1073Cb 0.00 -0.44 -0.05 0.00 -1.14 0.00 0.00 41.12 39.49 1ziq n ASP 1073CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1ziq s SER 1074N -0.46 6.94 -0.16 -1.12 0.01 -1.26 -0.52 113.70 117.13 1ziq s SER 1074Ca 0.16 1.14 -0.04 0.00 1.31 0.00 0.00 55.95 58.52 1ziq s SER 1074Cb 0.11 -2.41 0.07 0.00 0.21 0.00 0.00 66.02 64.00 1ziq s SER 1074CO 0.06 -0.19 0.15 -0.69 0.41 0.00 0.00 173.24 172.99 1ziq s VAL 1075N 1.21 -0.22 0.00 3.43 1.01 -1.26 -4.29 120.40 120.28 1ziq s VAL 1075Ca 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1ziq s VAL 1075Cb -0.17 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1ziq s VAL 1075CO 0.16 -0.14 0.23 0.54 0.00 0.00 0.00 175.10 175.89 1ziq n ARG 1076N 5.31 0.59 -3.82 2.72 1.74 0.64 -4.81 116.66 119.03 1ziq n ARG 1076Ca -0.06 -0.23 -0.09 0.00 -0.77 0.00 0.00 57.85 56.70 1ziq n ARG 1076Cb 0.49 -0.68 -0.04 0.00 -1.02 0.00 0.00 32.46 31.21 1ziq n ARG 1076CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ziq s SER 1077N -0.15 -0.22 -0.01 0.55 1.04 -1.02 -0.25 113.70 113.64 1ziq s SER 1077Ca 0.00 -0.61 -0.28 0.00 0.48 0.00 0.00 55.95 55.55 1ziq s SER 1077Cb 0.00 0.60 0.06 0.00 0.10 0.00 0.00 66.02 66.79 1ziq s SER 1077CO 0.00 -1.12 0.62 0.00 0.98 0.00 0.00 173.24 173.72 1ziq s ARG 1079N -1.63 1.66 -0.30 0.00 0.52 0.44 -0.97 118.95 118.68 1ziq s ARG 1079Ca -0.09 -0.66 -0.20 0.00 -0.52 0.00 0.00 55.73 54.26 1ziq s ARG 1079Cb -0.01 -1.53 -0.01 0.00 0.52 0.00 0.00 34.95 33.92 1ziq s ARG 1079CO 0.06 0.35 0.61 -1.17 0.02 0.00 0.00 175.30 175.16 1ziq s LEU 1080N -0.26 4.14 -0.02 2.53 2.96 -1.26 -0.71 118.68 126.06 1ziq s LEU 1080Ca 0.03 0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 54.08 1ziq s LEU 1080Cb -0.09 -2.79 -0.03 0.00 0.50 0.00 0.00 46.19 43.78 1ziq s LEU 1080CO 0.00 -0.45 1.06 -0.63 -1.32 0.00 0.00 176.35 175.02 1ziq s ILE 1081N 2.55 4.60 0.91 6.68 -1.09 0.09 -4.91 121.20 130.03 1ziq s ILE 1081Ca 0.24 1.87 -0.12 0.00 -2.23 0.00 0.00 60.65 60.41 1ziq s ILE 1081Cb -0.15 -4.20 0.14 0.00 -1.58 0.00 0.00 42.46 36.66 1ziq s ILE 1081CO 0.11 0.09 1.13 -2.16 -1.23 0.00 0.00 174.94 172.89 1ziq s PRO 1082N 1.42 1.17 0.39 2.79 0.04 -1.26 -4.52 135.00 135.03 1ziq s PRO 1082Ca 0.53 0.32 -0.25 0.00 0.04 0.00 0.00 61.00 61.63 1ziq s PRO 1082Cb -0.23 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 1ziq s PRO 1082CO 0.25 -2.18 1.13 -1.58 0.04 0.00 0.00 177.00 174.66 1ziq s HIS 1083N -3.26 3.16 -0.14 0.56 5.65 -1.26 -4.93 115.29 115.08 1ziq s HIS 1083Ca 0.64 1.59 0.00 0.00 0.25 0.00 0.00 55.06 57.54 1ziq s HIS 1083Cb -0.15 -3.31 -0.01 0.00 -1.18 0.00 0.00 32.58 27.94 1ziq s HIS 1083CO 0.53 -1.06 -0.15 -1.12 -0.65 0.00 0.00 174.74 172.30 1ziq s SER 1084N -1.24 3.82 0.00 9.88 0.01 -1.26 -4.98 113.70 119.93 1ziq s SER 1084Ca 0.56 -0.40 0.25 0.00 1.31 0.00 0.00 55.95 57.68 1ziq s SER 1084Cb -0.28 -1.58 0.51 0.00 0.21 0.00 0.00 66.02 64.88 1ziq s SER 1084CO 0.35 0.13 1.42 -1.20 0.41 0.00 0.00 173.24 174.36 1ziq n SER 1085N 3.72 0.50 -3.45 2.44 7.64 -1.26 -4.91 113.62 118.30 1ziq n SER 1085Ca -0.18 -0.22 -0.13 0.00 1.01 0.00 0.00 58.87 59.35 1ziq n SER 1085Cb 0.52 0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.93 1ziq n SER 1085CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ziq s SER 1086N -3.06 -0.57 -0.03 6.43 1.04 -1.26 -5.15 113.70 111.10 1ziq s SER 1086Ca 0.11 0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.67 1ziq s SER 1086Cb 0.17 0.58 0.01 0.00 0.10 0.00 0.00 66.02 66.88 1ziq s SER 1086CO 0.70 -0.90 -0.08 -1.00 0.98 0.00 0.00 173.24 172.95 1ziq s HIS 1087N -3.28 0.85 -0.18 5.02 0.09 -1.26 -3.35 115.29 113.18 1ziq s HIS 1087Ca -0.01 -0.22 -0.08 0.00 -0.00 0.00 0.00 55.06 54.76 1ziq s HIS 1087Cb -0.01 -0.64 0.08 0.00 -0.00 0.00 0.00 32.58 32.01 1ziq s HIS 1087CO -0.09 -0.11 0.41 0.50 -0.00 0.00 0.00 174.74 175.44 1ziq s ARG 1088N 0.33 0.34 0.02 1.40 3.52 -0.48 -4.29 118.95 119.79 1ziq s ARG 1088Ca -0.05 0.93 0.01 0.00 -0.13 0.00 0.00 55.73 56.49 1ziq s ARG 1088Cb -0.09 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.46 1ziq s ARG 1088CO 0.00 -0.22 -0.05 -1.50 -0.81 0.00 0.00 175.30 172.72 1ziq s ILE 1089N 2.17 0.31 -0.18 4.11 2.07 -0.27 -0.81 121.20 128.60 1ziq s ILE 1089Ca -0.04 -0.76 -0.06 0.00 -1.41 0.00 0.00 60.65 58.38 1ziq s ILE 1089Cb -0.11 -0.38 -0.03 0.00 0.13 0.00 0.00 42.46 42.07 1ziq s ILE 1089CO -0.12 -0.29 0.02 -0.13 -1.91 0.00 0.00 174.94 172.50 1ziq s ARG 1090N -1.11 3.79 -0.19 3.50 0.52 0.09 -0.76 118.95 124.79 1ziq s ARG 1090Ca -0.09 -0.44 -0.04 0.00 -0.52 0.00 0.00 55.73 54.64 1ziq s ARG 1090Cb -0.07 -3.10 -0.02 0.00 0.52 0.00 0.00 34.95 32.28 1ziq s ARG 1090CO -0.00 0.18 -0.04 0.42 0.02 0.00 0.00 175.30 175.88 1ziq s ILE 1091N 0.57 3.66 0.10 1.52 1.01 0.18 -0.59 121.20 127.65 1ziq s ILE 1091Ca 0.00 -0.42 0.10 0.00 0.00 0.00 0.00 60.65 60.33 1ziq s ILE 1091Cb -0.14 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1ziq s ILE 1091CO 0.02 0.45 -0.24 -0.31 0.00 0.00 0.00 174.94 174.86 1ziq s TYR 1092N 0.90 2.39 0.18 3.97 1.51 -0.20 -1.56 117.35 124.53 1ziq s TYR 1092Ca -0.00 -0.35 -0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1ziq s TYR 1092Cb -0.15 -1.32 0.09 0.00 -0.11 0.00 0.00 41.96 40.47 1ziq s TYR 1092CO 0.01 0.30 1.49 1.49 -1.11 0.00 0.00 175.55 177.73 1ziq h GLU 1093N 4.10 0.58 -5.70 -0.62 4.81 -0.95 -1.16 114.58 115.64 1ziq h GLU 1093Ca -0.49 -0.37 -0.62 0.00 -0.13 0.00 0.00 59.36 57.75 1ziq h GLU 1093Cb 1.16 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 30.47 1ziq h GLU 1093CO 0.42 0.98 -0.58 1.03 -0.73 0.00 0.00 179.01 180.14 1ziq s ARG 1094N -3.98 2.01 0.92 1.92 0.52 0.42 -3.48 118.95 117.28 1ziq s ARG 1094Ca -0.08 -2.06 -0.11 0.00 -0.52 0.00 0.00 55.73 52.96 1ziq s ARG 1094Cb 0.11 -1.71 0.14 0.00 0.52 0.00 0.00 34.95 34.02 1ziq s ARG 1094CO 0.85 -0.06 1.10 -1.21 0.02 0.00 0.00 175.30 175.99 1ziq s GLU 1095N -3.75 1.07 -1.50 3.54 2.02 -1.26 -3.33 118.70 115.48 1ziq s GLU 1095Ca 0.36 1.15 -0.09 0.00 0.02 0.00 0.00 54.97 56.41 1ziq s GLU 1095Cb 0.09 -1.76 0.06 0.00 0.10 0.00 0.00 34.13 32.62 1ziq s GLU 1095CO 0.19 -2.47 0.73 -0.25 0.02 0.00 0.00 175.26 173.48 1ziq n ASP 1096N -4.08 -2.57 -3.41 -0.19 8.00 0.21 -2.57 116.55 111.94 1ziq n ASP 1096Ca 0.08 -0.90 -0.24 0.00 0.71 0.00 0.00 54.79 54.44 1ziq n ASP 1096Cb 0.53 -3.42 0.05 0.00 -0.02 0.00 0.00 41.12 38.26 1ziq n ASP 1096CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1ziq n TYR 1097N -4.46 -2.35 -3.78 1.24 0.53 -1.23 -4.98 117.16 102.11 1ziq n TYR 1097Ca -0.11 0.76 -0.22 0.00 -1.02 0.00 0.00 57.90 57.32 1ziq n TYR 1097Cb 0.59 -4.48 -0.04 0.00 -1.03 0.00 0.00 39.34 34.38 1ziq n TYR 1097CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 1ziq s ARG 1098N -6.10 2.56 1.94 -0.72 1.81 -1.06 -4.99 118.95 112.39 1ziq s ARG 1098Ca 0.48 -1.46 0.00 0.00 -1.72 0.00 0.00 55.73 53.02 1ziq s ARG 1098Cb -0.22 -2.36 0.00 0.00 -0.45 0.00 0.00 34.95 31.92 1ziq s ARG 1098CO 0.59 -0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.59 1ziq n GLY 1099N -1.39 -1.44 3.75 -3.53 0.00 -1.26 -0.43 105.19 100.88 1ziq n GLY 1099Ca 0.00 -1.34 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 1ziq n GLY 1099CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ziq s GLN 1100N 0.00 2.70 0.03 1.61 -0.21 -1.26 -4.71 119.66 117.82 1ziq s GLN 1100Ca 0.00 1.72 0.01 0.00 0.02 0.00 0.00 55.36 57.11 1ziq s GLN 1100Cb 0.00 -1.91 -0.02 0.00 1.00 0.00 0.00 33.01 32.08 1ziq s GLN 1100CO 0.00 -1.39 -0.05 1.41 -2.12 0.00 0.00 175.29 173.14 1ziq s MET 1101N -3.64 0.41 -0.00 2.91 -2.45 -1.26 -0.89 119.30 114.37 1ziq s MET 1101Ca 0.74 -0.70 -0.02 0.00 -1.25 0.00 0.00 55.69 54.47 1ziq s MET 1101Cb -0.28 -0.04 -0.00 0.00 1.25 0.00 0.00 34.83 35.76 1ziq s MET 1101CO 0.38 -0.01 0.03 0.54 1.05 0.00 0.00 175.02 177.01 1ziq s VAL 1102N -1.55 0.04 -0.18 10.11 0.11 -0.60 -4.99 120.40 123.34 1ziq s VAL 1102Ca -0.12 -0.32 -0.02 0.00 -2.93 0.00 0.00 61.98 58.58 1ziq s VAL 1102Cb -0.09 -0.16 -0.01 0.00 -1.53 0.00 0.00 36.38 34.59 1ziq s VAL 1102CO -0.01 -0.18 -0.10 -0.70 -3.33 0.00 0.00 175.10 170.78 1ziq s GLU 1103N -0.53 3.33 0.11 1.54 2.12 -1.26 -0.65 118.70 123.36 1ziq s GLU 1103Ca -0.06 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.65 1ziq s GLU 1103Cb -0.04 -2.79 -0.04 0.00 0.26 0.00 0.00 34.13 31.53 1ziq s GLU 1103CO -0.00 -0.02 -0.13 0.96 -0.54 0.00 0.00 175.26 175.53 1ziq s ILE 1104N 0.96 1.19 -0.05 -3.70 -4.36 0.06 -4.97 121.20 110.34 1ziq s ILE 1104Ca -0.01 -1.65 0.07 0.00 -0.26 0.00 0.00 60.65 58.80 1ziq s ILE 1104Cb -0.15 -1.43 0.11 0.00 1.25 0.00 0.00 42.46 42.25 1ziq s ILE 1104CO -0.01 -0.44 0.99 0.35 0.24 0.00 0.00 174.94 176.08 1ziq n THR 1105N 0.62 1.07 -4.50 8.37 -2.24 -1.26 -1.11 114.28 115.22 1ziq n THR 1105Ca -0.16 -1.21 -0.26 0.00 -2.27 0.00 0.00 64.05 60.14 1ziq n THR 1105Cb 0.57 0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 69.00 1ziq n THR 1105CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ziq n ASP 1106N -0.73 1.09 -4.87 3.42 5.75 -1.26 -4.66 116.55 115.29 1ziq n ASP 1106Ca 0.06 -3.27 -0.31 0.00 -0.01 0.00 0.00 54.79 51.26 1ziq n ASP 1106Cb 0.50 1.13 0.01 0.00 -1.03 0.00 0.00 41.12 41.73 1ziq n ASP 1106CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1ziq s ASP 1107N -3.60 6.17 -0.33 -1.12 1.01 -1.26 -4.78 116.67 112.76 1ziq s ASP 1107Ca 0.23 1.40 -0.01 0.00 0.71 0.00 0.00 52.55 54.88 1ziq s ASP 1107Cb 0.01 -2.43 0.12 0.00 1.01 0.00 0.00 42.92 41.63 1ziq s ASP 1107CO 0.16 -0.91 0.18 0.00 0.21 0.00 0.00 175.17 174.81 1ziq n PRO 1109N 4.50 0.09 -3.33 0.00 -0.04 -1.26 -1.09 135.00 133.87 1ziq n PRO 1109Ca 0.05 0.14 -0.12 0.00 -0.04 0.00 0.00 63.50 63.53 1ziq n PRO 1109Cb 0.39 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.28 1ziq n PRO 1109CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1ziq s HIS 1110N -2.87 -0.83 0.13 0.54 2.46 -1.26 0.08 115.29 113.55 1ziq s HIS 1110Ca 0.13 0.13 -0.17 0.00 0.47 0.00 0.00 55.06 55.61 1ziq s HIS 1110Cb 0.13 -0.26 -0.02 0.00 -0.13 0.00 0.00 32.58 32.30 1ziq s HIS 1110CO 0.35 -0.97 1.69 -0.07 -2.47 0.00 0.00 174.74 173.27 1ziq h LEU 1111N 8.14 0.47 -0.59 8.88 3.38 -1.37 -3.13 115.31 131.09 1ziq h LEU 1111Ca -0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1ziq h LEU 1111Cb 1.10 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1ziq h LEU 1111CO 0.28 0.48 0.28 -0.61 0.09 0.00 0.00 178.44 178.96 1ziq h GLN 1112N 0.42 0.85 -0.00 1.13 4.15 -1.93 -2.48 115.11 117.26 1ziq h GLN 1112Ca 0.12 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1ziq h GLN 1112Cb 0.15 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1ziq h GLN 1112CO -0.01 0.70 -0.16 -0.25 -1.93 0.00 0.00 178.83 177.17 1ziq n ASP 1113N -4.52 0.27 -0.06 -0.69 8.00 -1.22 -2.48 116.55 115.85 1ziq n ASP 1113Ca 0.04 -0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 1ziq n ASP 1113Cb 0.13 -0.16 -0.15 0.00 -0.02 0.00 0.00 41.12 40.92 1ziq n ASP 1113CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1ziq n ARG 1114N -1.32 0.67 0.00 -1.24 0.63 -0.96 -4.73 116.66 109.71 1ziq n ARG 1114Ca 0.09 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 1ziq n ARG 1114Cb 0.31 -1.66 0.00 0.00 0.45 0.00 0.00 32.46 31.57 1ziq n ARG 1114CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1ziq n PHE 1115N -3.02 0.00 -3.22 -0.14 3.72 -1.08 -5.11 117.46 108.61 1ziq n PHE 1115Ca -0.28 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 56.98 1ziq n PHE 1115Cb 1.08 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.63 1ziq n PHE 1115CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1ziq n HIS 1116N -1.90 -2.90 -0.04 1.38 8.25 -1.04 -4.93 115.22 114.04 1ziq n HIS 1116Ca 0.00 1.16 0.01 0.00 -0.26 0.00 0.00 57.72 58.63 1ziq n HIS 1116Cb 0.40 -3.44 -0.14 0.00 1.12 0.00 0.00 29.99 27.93 1ziq n HIS 1116CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1ziq n PHE 1117N -1.22 0.00 0.00 4.41 0.99 -1.26 -4.97 117.46 115.41 1ziq n PHE 1117Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.41 1ziq n PHE 1117Cb 0.56 -0.63 0.00 0.00 -1.00 0.00 0.00 39.48 38.41 1ziq n PHE 1117CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1ziq n SER 1118N -2.38 0.00 -4.05 4.37 3.41 -1.26 -4.88 113.62 108.83 1ziq n SER 1118Ca -0.15 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.19 1ziq n SER 1118Cb 0.75 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.54 1ziq n SER 1118CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ziq s ASP 1119N 0.00 2.23 -0.49 4.04 1.01 -1.26 -5.08 116.67 117.12 1ziq s ASP 1119Ca 0.00 -0.38 -0.14 0.00 0.71 0.00 0.00 52.55 52.74 1ziq s ASP 1119Cb 0.00 -1.01 0.10 0.00 1.01 0.00 0.00 42.92 43.02 1ziq s ASP 1119CO 0.00 0.03 0.41 -0.36 0.21 0.00 0.00 175.17 175.46 1ziq s PHE 1120N 0.81 3.28 0.00 4.23 0.08 -1.25 -3.90 117.98 121.23 1ziq s PHE 1120Ca -0.11 -1.26 0.00 0.00 0.12 0.00 0.00 56.93 55.69 1ziq s PHE 1120Cb -0.16 -3.40 0.00 0.00 -0.57 0.00 0.00 43.02 38.90 1ziq s PHE 1120CO 0.02 -0.91 0.19 0.72 -0.10 0.00 0.00 175.22 175.14 1ziq n HIS 1121N 5.14 0.00 -3.70 0.36 8.25 -0.45 -4.84 115.22 119.98 1ziq n HIS 1121Ca -0.12 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.23 1ziq n HIS 1121Cb 0.42 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.47 1ziq n HIS 1121CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1ziq s SER 1122N -0.18 -0.16 0.00 0.41 1.04 -1.14 -4.01 113.70 109.67 1ziq s SER 1122Ca 0.00 -0.32 -0.00 0.00 0.48 0.00 0.00 55.95 56.11 1ziq s SER 1122Cb 0.00 0.43 -0.00 0.00 0.10 0.00 0.00 66.02 66.54 1ziq s SER 1122CO 0.00 -0.77 -0.01 -0.36 0.98 0.00 0.00 173.24 173.08 1ziq s PHE 1123N -3.47 0.05 -0.26 5.02 0.08 -0.16 -1.04 117.98 118.20 1ziq s PHE 1123Ca 0.01 -0.10 0.03 0.00 0.12 0.00 0.00 56.93 56.98 1ziq s PHE 1123Cb 0.02 -0.04 0.06 0.00 -0.57 0.00 0.00 43.02 42.49 1ziq s PHE 1123CO -0.09 -0.04 -0.08 -1.58 -0.10 0.00 0.00 175.22 173.33 1ziq s HIS 1124N -0.29 3.14 -0.49 0.36 5.65 0.24 -0.22 115.29 123.69 1ziq s HIS 1124Ca -0.03 -2.29 -0.25 0.00 0.25 0.00 0.00 55.06 52.74 1ziq s HIS 1124Cb -0.02 -1.97 0.03 0.00 -1.18 0.00 0.00 32.58 29.44 1ziq s HIS 1124CO -0.00 -0.87 0.90 0.08 -0.65 0.00 0.00 174.74 174.20 1ziq s VAL 1125N 1.14 4.48 -0.05 0.89 1.01 0.02 -0.73 120.40 127.15 1ziq s VAL 1125Ca -0.06 0.52 -0.11 0.00 0.00 0.00 0.00 61.98 62.33 1ziq s VAL 1125Cb -0.20 -4.45 -0.31 0.00 0.00 0.00 0.00 36.38 31.43 1ziq s VAL 1125CO -0.06 -0.91 0.65 0.24 0.00 0.00 0.00 175.10 175.03 1ziq h MET 1126N 9.14 0.39 -3.86 2.72 2.86 -1.25 -0.09 114.93 124.84 1ziq h MET 1126Ca -0.25 -0.67 -0.24 0.00 -2.06 0.00 0.00 59.70 56.48 1ziq h MET 1126Cb 1.08 0.25 -0.27 0.00 0.06 0.00 0.00 31.60 32.71 1ziq h MET 1126CO 1.04 1.32 -0.72 -1.21 1.06 0.00 0.00 176.91 178.39 1ziq s GLU 1127N -2.57 0.10 0.14 1.72 2.02 -0.87 -4.87 118.70 114.37 1ziq s GLU 1127Ca -0.16 -0.09 0.00 0.00 0.02 0.00 0.00 54.97 54.74 1ziq s GLU 1127Cb 0.05 -0.07 0.00 0.00 0.10 0.00 0.00 34.13 34.22 1ziq s GLU 1127CO 0.85 0.02 0.00 0.41 0.02 0.00 0.00 175.26 176.55 1ziq n GLY 1128N 2.93 -2.73 3.35 -1.39 0.00 -1.21 -1.38 105.19 104.76 1ziq n GLY 1128Ca -0.13 -1.69 -0.32 0.00 0.00 0.00 0.00 46.02 43.87 1ziq n GLY 1128CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ziq s TYR 1129N -0.80 2.52 0.15 1.61 1.51 -1.26 -3.55 117.35 117.53 1ziq s TYR 1129Ca 0.00 -0.46 0.04 0.00 -1.01 0.00 0.00 57.07 55.64 1ziq s TYR 1129Cb 0.00 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 1ziq s TYR 1129CO 0.00 -0.04 -0.08 -1.58 -1.11 0.00 0.00 175.55 172.74 1ziq s TRP 1130N -0.42 1.25 -0.14 2.71 0.52 -0.60 -0.89 118.94 121.38 1ziq s TRP 1130Ca 0.04 -0.80 0.01 0.00 0.02 0.00 0.00 56.10 55.37 1ziq s TRP 1130Cb -0.12 -0.66 -0.01 0.00 -1.15 0.00 0.00 33.47 31.54 1ziq s TRP 1130CO 0.02 0.03 -0.16 0.08 0.02 0.00 0.00 176.95 176.94 1ziq s VAL 1131N -3.38 2.69 -0.07 4.03 1.01 0.46 -0.68 120.40 124.46 1ziq s VAL 1131Ca 0.18 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 61.24 1ziq s VAL 1131Cb 0.03 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 1ziq s VAL 1131CO 0.01 0.53 0.34 -0.22 0.00 0.00 0.00 175.10 175.75 1ziq s LEU 1132N 0.57 4.39 0.04 3.92 2.96 0.55 -1.46 118.68 129.64 1ziq s LEU 1132Ca -0.10 0.75 0.09 0.00 -0.22 0.00 0.00 54.13 54.65 1ziq s LEU 1132Cb -0.16 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.05 1ziq s LEU 1132CO 0.04 0.26 -0.26 -0.31 -1.32 0.00 0.00 176.35 174.76 1ziq s TYR 1133N -0.55 2.26 0.25 5.38 1.51 -0.22 -0.80 117.35 125.18 1ziq s TYR 1133Ca 0.21 -0.41 -0.03 0.00 -1.01 0.00 0.00 57.07 55.82 1ziq s TYR 1133Cb -0.15 -1.37 0.43 0.00 -0.11 0.00 0.00 41.96 40.77 1ziq s TYR 1133CO 0.09 0.10 1.82 1.49 -1.11 0.00 0.00 175.55 177.94 1ziq h GLU 1134N 4.89 0.82 -6.45 -0.62 4.81 -0.99 0.30 114.58 117.34 1ziq h GLU 1134Ca -0.46 -0.05 -0.64 0.00 -0.13 0.00 0.00 59.36 58.09 1ziq h GLU 1134Cb 1.14 -0.19 -0.17 0.00 0.63 0.00 0.00 28.75 30.17 1ziq h GLU 1134CO 0.44 0.54 -0.79 -1.64 -0.73 0.00 0.00 179.01 176.83 1ziq s MET 1135N -6.02 1.61 0.98 1.92 -1.94 -0.85 -1.35 119.30 113.65 1ziq s MET 1135Ca -0.12 -1.61 -0.13 0.00 -1.71 0.00 0.00 55.69 52.12 1ziq s MET 1135Cb 0.20 -1.83 0.09 0.00 2.01 0.00 0.00 34.83 35.30 1ziq s MET 1135CO 0.79 0.37 0.57 -2.30 -0.01 0.00 0.00 175.02 174.44 1ziq n PRO 1136N -0.10 -0.65 -3.86 2.03 -0.02 -1.25 -3.07 135.00 128.09 1ziq n PRO 1136Ca -0.10 -0.15 -0.30 0.00 -2.02 0.00 0.00 63.50 60.94 1ziq n PRO 1136Cb 0.58 -1.98 0.01 0.00 -0.02 0.00 0.00 33.50 32.08 1ziq n PRO 1136CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ziq n ASN 1137N -2.31 -4.40 -3.47 2.55 3.02 0.11 -3.55 115.26 107.22 1ziq n ASN 1137Ca 0.07 -0.75 -0.21 0.00 -0.03 0.00 0.00 54.58 53.66 1ziq n ASN 1137Cb 0.54 -3.54 0.06 0.00 -0.61 0.00 0.00 39.78 36.23 1ziq n ASN 1137CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1ziq n TYR 1138N -4.49 -2.18 -4.30 3.10 0.53 -1.17 -5.01 117.16 103.62 1ziq n TYR 1138Ca 0.04 0.74 -0.16 0.00 -1.02 0.00 0.00 57.90 57.49 1ziq n TYR 1138Cb 0.52 -4.04 -0.10 0.00 -1.03 0.00 0.00 39.34 34.69 1ziq n TYR 1138CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 1ziq s ARG 1139N -5.21 1.23 2.68 -0.72 1.81 -1.21 -5.04 118.95 112.49 1ziq s ARG 1139Ca 0.35 -1.59 0.00 0.00 -1.72 0.00 0.00 55.73 52.78 1ziq s ARG 1139Cb -0.08 -0.65 0.00 0.00 -0.45 0.00 0.00 34.95 33.77 1ziq s ARG 1139CO 0.79 -0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.80 1ziq n GLY 1140N -0.33 -0.46 3.77 -3.53 0.00 -1.26 -2.00 105.19 101.37 1ziq n GLY 1140Ca -0.07 -1.19 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 1ziq n GLY 1140CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ziq s ARG 1141N 0.00 4.01 0.03 1.61 0.52 -1.26 -4.77 118.95 119.09 1ziq s ARG 1141Ca 0.00 2.01 0.08 0.00 -0.52 0.00 0.00 55.73 57.31 1ziq s ARG 1141Cb 0.00 -2.73 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1ziq s ARG 1141CO 0.00 -0.41 -0.25 -0.65 0.02 0.00 0.00 175.30 174.02 1ziq s GLN 1142N -2.24 1.77 -0.05 3.54 -0.21 -1.26 -0.72 119.66 120.49 1ziq s GLN 1142Ca 0.57 -1.01 -0.02 0.00 0.02 0.00 0.00 55.36 54.92 1ziq s GLN 1142Cb -0.35 -1.87 0.03 0.00 1.00 0.00 0.00 33.01 31.83 1ziq s GLN 1142CO 0.44 0.49 0.08 0.71 -2.12 0.00 0.00 175.29 174.90 1ziq s TYR 1143N -0.74 -0.03 0.09 0.91 1.51 0.02 -4.02 117.35 115.09 1ziq s TYR 1143Ca 0.10 0.33 -0.30 0.00 -1.01 0.00 0.00 57.07 56.19 1ziq s TYR 1143Cb -0.10 -0.31 -0.06 0.00 -0.11 0.00 0.00 41.96 41.38 1ziq s TYR 1143CO 0.01 -0.18 1.14 -1.17 -1.11 0.00 0.00 175.55 174.25 1ziq s LEU 1144N 1.75 4.41 -0.24 -1.29 2.96 -1.26 -0.33 118.68 124.68 1ziq s LEU 1144Ca -0.01 2.00 -0.04 0.00 -0.22 0.00 0.00 54.13 55.86 1ziq s LEU 1144Cb -0.12 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.98 1ziq s LEU 1144CO -0.04 -0.36 -0.02 -0.76 -1.32 0.00 0.00 176.35 173.84 1ziq s LEU 1145N 0.57 3.13 0.36 -0.68 1.43 0.15 -4.93 118.68 118.70 1ziq s LEU 1145Ca 0.55 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 53.16 1ziq s LEU 1145Cb -0.28 -1.75 -0.00 0.00 0.03 0.00 0.00 46.19 44.18 1ziq s LEU 1145CO 0.31 -0.07 0.49 -0.13 0.23 0.00 0.00 176.35 177.18 1ziq s ARG 1146N 1.45 3.05 0.16 1.70 0.52 -1.26 -1.56 118.95 123.01 1ziq s ARG 1146Ca 0.04 -1.07 -0.34 0.00 -0.52 0.00 0.00 55.73 53.84 1ziq s ARG 1146Cb -0.15 -2.80 -0.15 0.00 0.52 0.00 0.00 34.95 32.36 1ziq s ARG 1146CO -0.03 -0.02 1.32 -2.30 0.02 0.00 0.00 175.30 174.29 1ziq n PRO 1147N -1.69 1.49 0.00 3.54 -0.02 -1.23 -4.69 135.00 132.40 1ziq n PRO 1147Ca 0.02 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1ziq n PRO 1147Cb 0.58 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1ziq n PRO 1147CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ziq n GLY 1148N 2.37 0.92 3.51 -1.23 0.00 -0.05 -4.97 105.19 105.74 1ziq n GLY 1148Ca 0.15 -1.95 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 1ziq n GLY 1148CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ziq s GLU 1149N -1.78 3.02 -0.35 1.61 2.02 -1.26 -0.80 118.70 121.16 1ziq s GLU 1149Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.40 1ziq s GLU 1149Cb 0.00 -2.63 0.11 0.00 0.10 0.00 0.00 34.13 31.71 1ziq s GLU 1149CO 0.00 0.49 0.13 0.71 0.02 0.00 0.00 175.26 176.61 1ziq s TYR 1150N -0.34 1.92 0.09 1.61 1.51 0.70 -4.99 117.35 117.84 1ziq s TYR 1150Ca 0.04 -2.02 0.15 0.00 -1.01 0.00 0.00 57.07 54.23 1ziq s TYR 1150Cb -0.12 -1.84 0.33 0.00 -0.11 0.00 0.00 41.96 40.22 1ziq s TYR 1150CO 0.02 -0.86 1.57 0.00 -1.11 0.00 0.00 175.55 175.17 1ziq h ARG 1151N 7.66 0.00 -2.34 -0.62 3.08 -1.88 -0.41 114.38 119.87 1ziq h ARG 1151Ca -0.09 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.10 1ziq h ARG 1151Cb 0.99 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.93 1ziq h ARG 1151CO 0.47 0.54 0.48 -0.98 -1.07 0.00 0.00 179.97 179.41 1ziq s ARG 1152N -3.29 1.05 0.59 0.04 1.70 -1.26 -0.62 118.95 117.16 1ziq s ARG 1152Ca 0.01 -0.51 0.30 0.00 -0.47 0.00 0.00 55.73 55.06 1ziq s ARG 1152Cb 0.10 0.40 1.82 0.00 -0.57 0.00 0.00 34.95 36.70 1ziq s ARG 1152CO 0.73 -0.47 2.23 0.10 -1.08 0.00 0.00 175.30 176.81 1ziq h TYR 1153N 2.00 0.00 -0.13 5.89 -0.00 -1.89 0.22 116.97 123.06 1ziq h TYR 1153Ca -0.24 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.47 1ziq h TYR 1153Cb 1.24 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.96 1ziq h TYR 1153CO 0.33 0.00 -0.01 0.45 -0.00 0.00 0.00 178.16 178.93 1ziq h HIS 1154N 0.00 0.19 0.00 0.10 3.86 -1.91 -1.20 115.15 116.18 1ziq h HIS 1154Ca 0.01 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1ziq h HIS 1154Cb 0.09 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.50 1ziq h HIS 1154CO 0.00 0.21 -0.10 -0.44 0.86 0.00 0.00 177.93 178.45 1ziq h ASP 1155N 0.19 0.00 -0.28 2.45 3.32 -0.91 -2.78 116.42 118.40 1ziq h ASP 1155Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1ziq h ASP 1155Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1ziq h ASP 1155CO 0.00 0.10 0.00 -2.67 -1.72 0.00 0.00 179.24 174.96 1ziq n TRP 1156N -3.44 0.85 -2.04 4.55 2.14 -0.50 -4.97 117.44 114.03 1ziq n TRP 1156Ca -0.01 -0.79 -0.07 0.00 2.07 0.00 0.00 57.50 58.69 1ziq n TRP 1156Cb 0.26 -0.25 -0.01 0.00 -0.81 0.00 0.00 31.31 30.50 1ziq n TRP 1156CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1ziq n GLY 1157N -0.28 0.16 3.91 -1.67 0.00 -1.05 -4.71 105.19 101.55 1ziq n GLY 1157Ca 0.19 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 1ziq n GLY 1157CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ziq s ALA 1158N -2.35 3.62 -0.68 4.61 0.00 -0.92 -4.98 121.76 121.06 1ziq s ALA 1158Ca 0.00 -0.60 0.24 0.00 0.00 0.00 0.00 51.96 51.61 1ziq s ALA 1158Cb 0.00 -2.29 0.39 0.00 0.00 0.00 0.00 23.12 21.22 1ziq s ALA 1158CO 0.00 0.19 1.35 -1.33 0.00 0.00 0.00 175.76 175.97 1ziq n MET 1159N -1.08 0.26 -2.19 0.00 2.81 -1.26 -4.43 117.12 111.22 1ziq n MET 1159Ca -0.02 0.08 -0.04 0.00 -1.81 0.00 0.00 57.70 55.91 1ziq n MET 1159Cb 0.54 -1.67 -0.00 0.00 -0.71 0.00 0.00 33.22 31.38 1ziq n MET 1159CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1ziq n ASN 1160N -2.05 -0.60 -0.80 7.83 0.23 -1.26 -5.04 115.26 113.56 1ziq n ASN 1160Ca 0.04 -1.60 0.07 0.00 -0.53 0.00 0.00 54.58 52.56 1ziq n ASN 1160Cb 0.43 1.06 0.21 0.00 -2.08 0.00 0.00 39.78 39.39 1ziq n ASN 1160CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ziq n ALA 1161N -2.20 2.43 -2.00 -2.53 0.00 -1.26 -4.85 120.51 110.11 1ziq n ALA 1161Ca -0.05 -0.76 -0.43 0.00 0.00 0.00 0.00 53.44 52.20 1ziq n ALA 1161Cb 0.20 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 1ziq n ALA 1161CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ziq s ARG 1162N -1.44 3.99 0.04 0.00 3.52 -1.26 -4.94 118.95 118.87 1ziq s ARG 1162Ca 0.30 2.03 0.02 0.00 -0.13 0.00 0.00 55.73 57.94 1ziq s ARG 1162Cb 0.16 -4.03 -0.02 0.00 -1.56 0.00 0.00 34.95 29.49 1ziq s ARG 1162CO 0.21 -1.07 -0.07 0.14 -0.81 0.00 0.00 175.30 173.69 1ziq s VAL 1163N 4.68 0.49 0.00 7.11 -7.23 -1.23 -4.39 120.40 119.83 1ziq s VAL 1163Ca 0.75 -1.07 0.00 0.00 -1.81 0.00 0.00 61.98 59.85 1ziq s VAL 1163Cb -0.31 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.05 1ziq s VAL 1163CO 0.30 -0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1ziq n GLY 1164N 1.46 0.00 3.54 2.32 0.00 0.10 -4.79 105.19 107.82 1ziq n GLY 1164Ca -0.23 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 1ziq n GLY 1164CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ziq s SER 1165N -0.82 -0.21 -0.09 1.61 1.04 -1.07 -1.20 113.70 112.95 1ziq s SER 1165Ca 0.00 -0.59 -0.05 0.00 0.48 0.00 0.00 55.95 55.80 1ziq s SER 1165Cb 0.00 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.74 1ziq s SER 1165CO 0.00 -1.07 0.22 -0.76 0.98 0.00 0.00 173.24 172.60 1ziq s LEU 1166N -2.90 0.49 -0.04 2.42 1.43 -0.25 -1.06 118.68 118.77 1ziq s LEU 1166Ca 0.12 0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.69 1ziq s LEU 1166Cb -0.01 0.62 0.01 0.00 0.03 0.00 0.00 46.19 46.85 1ziq s LEU 1166CO -0.00 -0.16 -0.07 -0.60 0.23 0.00 0.00 176.35 175.75 1ziq s ARG 1167N 1.26 0.93 0.31 1.70 3.52 -0.54 -0.89 118.95 125.24 1ziq s ARG 1167Ca -0.09 -0.21 -0.29 0.00 -0.13 0.00 0.00 55.73 55.01 1ziq s ARG 1167Cb -0.11 -0.88 -0.10 0.00 -1.56 0.00 0.00 34.95 32.31 1ziq s ARG 1167CO -0.08 0.02 1.18 1.03 -0.81 0.00 0.00 175.30 176.64 1ziq s ARG 1168N 0.54 4.49 -0.25 5.12 0.52 -1.26 -0.41 118.95 127.70 1ziq s ARG 1168Ca -0.08 1.96 -0.24 0.00 -0.52 0.00 0.00 55.73 56.86 1ziq s ARG 1168Cb -0.12 -3.10 -0.01 0.00 0.52 0.00 0.00 34.95 32.24 1ziq s ARG 1168CO 0.01 0.02 0.79 0.42 0.02 0.00 0.00 175.30 176.56 1ziq s ILE 1169N -1.18 4.86 -0.02 1.52 1.01 -0.07 -4.86 121.20 122.47 1ziq s ILE 1169Ca 0.47 1.46 -0.06 0.00 0.00 0.00 0.00 60.65 62.52 1ziq s ILE 1169Cb -0.35 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.04 1ziq s ILE 1169CO 0.45 -0.08 0.13 0.00 0.00 0.00 0.00 174.94 175.44 1ziq s MET 1170N 2.80 0.34 0.20 2.79 0.23 -1.26 -4.65 119.30 119.76 1ziq s MET 1170Ca 0.33 -0.17 -0.30 0.00 -1.03 0.00 0.00 55.69 54.52 1ziq s MET 1170Cb -0.15 0.14 -0.09 0.00 -1.53 0.00 0.00 34.83 33.21 1ziq s MET 1170CO 0.08 -0.07 1.27 0.16 -2.03 0.00 0.00 175.02 174.43 1ziq s ASP 1171N -0.79 6.95 0.00 -1.18 3.84 -1.26 -5.00 116.67 119.22 1ziq s ASP 1171Ca -0.09 2.37 0.00 0.00 -0.00 0.00 0.00 52.55 54.83 1ziq s ASP 1171Cb -0.05 -2.61 0.00 0.00 -1.38 0.00 0.00 42.92 38.88 1ziq s ASP 1171CO 0.01 -0.48 0.00 0.49 -0.00 0.00 0.00 175.17 175.19 1ziq n PHE 1172N 2.46 0.00 0.00 2.11 0.99 -1.26 -5.14 117.46 116.61 1ziq n PHE 1172Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.50 1ziq n PHE 1172Cb 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.91 1ziq n PHE 1172CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.76 179.24