#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1awq n ASN 1003N 0.00 3.81 -4.61 4.52 3.02 -1.26 -4.92 115.26 115.83 1awq n ASN 1003Ca 0.00 0.62 -0.40 0.00 -0.03 0.00 0.00 54.58 54.78 1awq n ASN 1003Cb 0.00 -1.54 0.03 0.00 -0.61 0.00 0.00 39.78 37.66 1awq n ASN 1003CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1awq n PRO 1004N 8.02 1.18 -4.54 3.52 -0.02 -1.23 -4.67 135.00 137.27 1awq n PRO 1004Ca 0.24 0.43 -0.28 0.00 -2.02 0.00 0.00 63.50 61.87 1awq n PRO 1004Cb 0.42 -2.08 -0.17 0.00 -0.02 0.00 0.00 33.50 31.65 1awq n PRO 1004CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1awq s THR 1005N -1.38 1.50 0.35 3.45 2.01 -1.26 -0.66 115.64 119.65 1awq s THR 1005Ca 0.68 -0.65 0.03 0.00 0.31 0.00 0.00 61.69 62.06 1awq s THR 1005Cb -0.50 -1.36 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 1awq s THR 1005CO 0.53 0.44 0.10 0.68 -0.69 0.00 0.00 174.62 175.69 1awq s VAL 1006N 0.89 0.79 0.19 3.82 -7.23 -0.71 -1.21 120.40 116.93 1awq s VAL 1006Ca -0.09 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 57.97 1awq s VAL 1006Cb -0.15 -2.55 -0.00 0.00 0.56 0.00 0.00 36.38 34.23 1awq s VAL 1006CO -0.00 0.00 0.37 0.72 -0.31 0.00 0.00 175.10 175.88 1awq s PHE 1007N -3.33 0.30 -0.05 2.82 -0.71 -0.47 -0.65 117.98 115.89 1awq s PHE 1007Ca 0.31 -0.66 0.02 0.00 -1.04 0.00 0.00 56.93 55.55 1awq s PHE 1007Cb 0.06 0.07 0.02 0.00 -1.21 0.00 0.00 43.02 41.95 1awq s PHE 1007CO 0.15 -0.81 -0.08 -0.06 -1.34 0.00 0.00 175.22 173.07 1awq s PHE 1008N -3.96 1.03 -0.43 3.49 0.08 0.32 -2.92 117.98 115.58 1awq s PHE 1008Ca 0.17 -0.32 -0.14 0.00 0.12 0.00 0.00 56.93 56.76 1awq s PHE 1008Cb 0.02 -0.80 0.05 0.00 -0.57 0.00 0.00 43.02 41.72 1awq s PHE 1008CO 0.02 -0.20 0.33 -0.51 -0.10 0.00 0.00 175.22 174.75 1awq s ASP 1009N 0.69 6.02 0.18 1.36 1.01 0.11 0.48 116.67 126.52 1awq s ASP 1009Ca -0.11 -1.18 -0.15 0.00 0.71 0.00 0.00 52.55 51.81 1awq s ASP 1009Cb -0.14 -2.13 -0.07 0.00 1.01 0.00 0.00 42.92 41.59 1awq s ASP 1009CO 0.02 -0.54 0.59 -0.63 0.21 0.00 0.00 175.17 174.82 1awq s ILE 1010N 1.61 4.80 0.01 0.77 -1.09 0.19 -0.00 121.20 127.49 1awq s ILE 1010Ca 0.04 0.88 0.01 0.00 -2.23 0.00 0.00 60.65 59.36 1awq s ILE 1010Cb -0.22 -3.74 -0.01 0.00 -1.58 0.00 0.00 42.46 36.91 1awq s ILE 1010CO 0.07 0.18 -0.05 0.00 -1.23 0.00 0.00 174.94 173.91 1awq s ALA 1011N -1.54 0.40 -0.45 9.38 0.00 -0.92 0.12 121.76 128.74 1awq s ALA 1011Ca 0.41 -0.39 -0.07 0.00 0.00 0.00 0.00 51.96 51.90 1awq s ALA 1011Cb -0.15 -0.03 0.12 0.00 0.00 0.00 0.00 23.12 23.06 1awq s ALA 1011CO 0.20 0.03 0.30 0.08 0.00 0.00 0.00 175.76 176.37 1awq s VAL 1012N -0.60 3.89 -0.79 0.00 1.01 -0.43 -2.03 120.40 121.44 1awq s VAL 1012Ca -0.03 -1.90 -0.02 0.00 0.00 0.00 0.00 61.98 60.02 1awq s VAL 1012Cb -0.05 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 1awq s VAL 1012CO -0.00 -0.75 0.68 0.47 0.00 0.00 0.00 175.10 175.50 1awq n ASP 1013N 4.78 -3.65 0.00 3.32 8.00 -0.50 -3.30 116.55 125.20 1awq n ASP 1013Ca -0.06 -0.47 0.00 0.00 0.71 0.00 0.00 54.79 54.97 1awq n ASP 1013Cb 0.41 -3.80 0.00 0.00 -0.02 0.00 0.00 41.12 37.71 1awq n ASP 1013CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1awq n GLY 1014N -1.20 1.72 3.61 0.44 0.00 -1.26 -4.95 105.19 103.55 1awq n GLY 1014Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1awq n GLY 1014CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1awq s GLU 1015N 0.00 3.75 -0.12 1.61 2.12 -1.21 -4.96 118.70 119.89 1awq s GLU 1015Ca 0.00 1.02 -0.39 0.00 0.36 0.00 0.00 54.97 55.96 1awq s GLU 1015Cb 0.00 -3.94 -0.17 0.00 0.26 0.00 0.00 34.13 30.28 1awq s GLU 1015CO 0.00 -1.33 1.53 -0.35 -0.54 0.00 0.00 175.26 174.56 1awq n PRO 1016N 7.69 1.02 -0.12 4.30 -0.04 -1.26 -1.31 135.00 145.27 1awq n PRO 1016Ca 0.15 0.37 -0.24 0.00 -0.04 0.00 0.00 63.50 63.74 1awq n PRO 1016Cb 0.47 -2.02 -0.10 0.00 -0.04 0.00 0.00 33.50 31.82 1awq n PRO 1016CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1awq n LEU 1017N 3.87 1.91 0.00 1.53 7.94 0.32 -4.81 117.00 127.75 1awq n LEU 1017Ca 0.23 0.39 0.00 0.00 -1.11 0.00 0.00 56.01 55.52 1awq n LEU 1017Cb 0.14 -0.87 0.00 0.00 0.53 0.00 0.00 43.42 43.22 1awq n LEU 1017CO 0.72 0.34 0.00 0.61 -1.11 0.00 0.00 177.39 177.95 1awq n GLY 1018N 1.36 -0.83 3.71 -3.96 0.00 -0.66 -4.99 105.19 99.81 1awq n GLY 1018Ca -0.41 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.12 1awq n GLY 1018CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1awq s ARG 1019N -2.00 2.95 -0.09 1.61 3.52 -1.26 0.54 118.95 124.22 1awq s ARG 1019Ca 0.00 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.13 1awq s ARG 1019Cb 0.00 -2.78 0.02 0.00 -1.56 0.00 0.00 34.95 30.63 1awq s ARG 1019CO 0.00 0.67 -0.09 0.08 -0.81 0.00 0.00 175.30 175.15 1awq s VAL 1020N -1.01 1.05 0.14 7.11 1.01 0.18 -4.21 120.40 124.65 1awq s VAL 1020Ca 0.17 -0.35 0.09 0.00 0.00 0.00 0.00 61.98 61.89 1awq s VAL 1020Cb -0.12 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1awq s VAL 1020CO 0.07 0.36 -0.15 -0.94 0.00 0.00 0.00 175.10 174.44 1awq s SER 1021N 1.27 4.04 0.06 3.32 1.04 -0.22 0.12 113.70 123.33 1awq s SER 1021Ca -0.03 -0.56 0.04 0.00 0.48 0.00 0.00 55.95 55.88 1awq s SER 1021Cb -0.14 -0.62 -0.03 0.00 0.10 0.00 0.00 66.02 65.33 1awq s SER 1021CO -0.03 0.15 -0.11 -0.36 0.98 0.00 0.00 173.24 173.87 1awq s PHE 1022N -1.34 0.99 -0.19 5.02 0.08 0.18 0.22 117.98 122.93 1awq s PHE 1022Ca 0.21 -0.50 -0.07 0.00 0.12 0.00 0.00 56.93 56.68 1awq s PHE 1022Cb -0.10 -0.56 -0.04 0.00 -0.57 0.00 0.00 43.02 41.75 1awq s PHE 1022CO 0.12 -0.00 0.06 -2.00 -0.10 0.00 0.00 175.22 173.30 1awq s GLU 1023N -1.82 3.93 -0.24 0.44 2.12 0.25 -1.74 118.70 121.64 1awq s GLU 1023Ca -0.04 -0.36 -0.07 0.00 0.36 0.00 0.00 54.97 54.85 1awq s GLU 1023Cb -0.09 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 31.05 1awq s GLU 1023CO 0.01 0.22 0.07 -0.51 -0.54 0.00 0.00 175.26 174.51 1awq s LEU 1024N 0.51 3.47 -1.26 2.70 1.43 0.16 -1.43 118.68 124.27 1awq s LEU 1024Ca 0.03 -0.18 -0.14 0.00 -1.03 0.00 0.00 54.13 52.81 1awq s LEU 1024Cb -0.13 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 1awq s LEU 1024CO 0.01 -0.01 2.29 0.49 0.23 0.00 0.00 176.35 179.36 1awq n PHE 1025N 4.74 2.62 0.31 0.29 3.72 -0.15 -3.52 117.46 125.48 1awq n PHE 1025Ca -0.16 -2.59 0.20 0.00 -0.05 0.00 0.00 57.45 54.85 1awq n PHE 1025Cb 0.52 -2.22 1.02 0.00 -0.94 0.00 0.00 39.48 37.85 1awq n PHE 1025CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1awq h ALA 1026N 6.29 1.05 0.00 4.37 0.00 -1.84 0.25 119.26 129.38 1awq h ALA 1026Ca 0.59 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.37 1awq h ALA 1026Cb 0.51 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1awq h ALA 1026CO 1.83 0.01 -0.59 0.38 0.00 0.00 0.00 179.25 180.89 1awq h ASP 1027N 0.00 0.00 0.00 0.00 2.03 -1.96 -2.86 116.42 113.63 1awq h ASP 1027Ca -0.00 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 56.02 1awq h ASP 1027Cb 0.18 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.63 1awq h ASP 1027CO 0.00 0.59 -1.89 0.29 -1.03 0.00 0.00 179.24 177.20 1awq n LYS 1028N -3.71 0.50 -3.82 4.15 5.02 -0.73 -4.82 118.16 114.75 1awq n LYS 1028Ca -0.01 0.21 -0.30 0.00 -2.02 0.00 0.00 58.31 56.20 1awq n LYS 1028Cb 0.61 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 34.17 1awq n LYS 1028CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1awq n VAL 1029N -4.18 2.04 0.46 -0.18 0.24 0.80 -4.97 118.33 112.54 1awq n VAL 1029Ca -0.37 -4.95 -0.19 0.00 -2.04 0.00 0.00 64.34 56.79 1awq n VAL 1029Cb 0.72 -2.24 -0.09 0.00 -1.47 0.00 0.00 33.84 30.76 1awq n VAL 1029CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1awq h PRO 1030N 5.51 -1.13 -0.84 7.34 0.11 -1.67 0.26 132.00 141.57 1awq h PRO 1030Ca 0.15 0.08 -0.03 0.00 0.11 0.00 0.00 66.00 66.32 1awq h PRO 1030Cb 0.76 0.26 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1awq h PRO 1030CO 0.76 -0.75 0.42 -0.22 -0.21 0.00 0.00 178.00 178.01 1awq h LYS 1031N -1.22 1.20 -0.19 1.05 3.64 -1.93 0.43 116.57 119.55 1awq h LYS 1031Ca -0.12 -0.17 -0.11 0.00 -1.27 0.00 0.00 60.65 58.98 1awq h LYS 1031Cb 0.90 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1awq h LYS 1031CO 0.20 0.91 -0.32 1.15 -2.27 0.00 0.00 179.45 179.12 1awq h THR 1032N 1.19 1.34 0.08 1.00 2.02 -1.96 -1.36 112.91 115.21 1awq h THR 1032Ca 0.29 -1.54 -0.00 0.00 0.77 0.00 0.00 66.41 65.93 1awq h THR 1032Cb 0.09 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1awq h THR 1032CO -0.04 0.47 -0.04 0.00 0.37 0.00 0.00 175.52 176.28 1awq h ALA 1033N 0.60 -0.11 0.00 6.16 0.00 -0.33 -2.50 119.26 123.09 1awq h ALA 1033Ca 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1awq h ALA 1033Cb 0.90 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1awq h ALA 1033CO 0.07 -0.38 -0.01 1.05 0.00 0.00 0.00 179.25 179.98 1awq h GLU 1034N -0.49 0.00 0.03 0.00 4.11 -0.18 -0.32 114.58 117.74 1awq h GLU 1034Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1awq h GLU 1034Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1awq h GLU 1034CO 0.02 0.01 -0.02 -0.97 0.07 0.00 0.00 179.01 178.12 1awq h ASN 1035N 0.00 -0.04 -0.67 3.06 -1.24 -1.05 -2.23 115.58 113.41 1awq h ASN 1035Ca -0.00 -0.59 -0.03 0.00 0.71 0.00 0.00 56.30 56.39 1awq h ASN 1035Cb 0.13 0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.16 1awq h ASN 1035CO 0.00 0.60 0.32 0.15 -1.29 0.00 0.00 177.43 177.21 1awq h PHE 1036N -0.70 0.98 0.00 0.67 3.57 -0.87 -2.19 116.94 118.40 1awq h PHE 1036Ca -0.00 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.45 1awq h PHE 1036Cb 0.63 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1awq h PHE 1036CO 0.14 0.73 -0.05 -0.09 -2.23 0.00 0.00 178.31 176.81 1awq h ARG 1037N 0.94 -0.09 0.00 1.11 2.43 -1.18 -0.26 114.38 117.33 1awq h ARG 1037Ca 0.23 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.38 1awq h ARG 1037Cb 0.13 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1awq h ARG 1037CO -0.03 -0.06 -0.13 0.00 -1.51 0.00 0.00 179.97 178.24 1awq h ALA 1038N 0.90 1.11 0.00 2.80 0.00 -1.28 -2.69 119.26 120.09 1awq h ALA 1038Ca 0.02 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1awq h ALA 1038Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1awq h ALA 1038CO -0.05 0.16 -1.27 -0.07 0.00 0.00 0.00 179.25 178.03 1awq h LEU 1039N 0.00 0.00 -0.21 0.00 3.38 -1.10 -2.18 115.31 115.19 1awq h LEU 1039Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 1awq h LEU 1039Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1awq h LEU 1039CO 0.02 0.40 -0.87 0.28 0.09 0.00 0.00 178.44 178.36 1awq h SER 1040N 0.00 0.63 0.02 -0.43 0.02 -0.78 0.55 113.55 113.56 1awq h SER 1040Ca -0.11 -0.46 -0.00 0.00 -0.84 0.00 0.00 61.79 60.38 1awq h SER 1040Cb 1.41 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1awq h SER 1040CO 0.03 1.24 -0.01 0.71 -1.14 0.00 0.00 176.83 177.67 1awq h THR 1041N 0.31 0.57 0.00 -2.27 1.35 -1.62 -2.93 112.91 108.33 1awq h THR 1041Ca -0.07 -1.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 1awq h THR 1041Cb 1.49 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 1awq h THR 1041CO 0.16 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 1awq n GLY 1042N 1.63 1.95 0.00 5.82 0.00 -0.97 -4.77 105.19 108.85 1awq n GLY 1042Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1awq n GLY 1042CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1awq n GLU 1043N -0.22 0.00 0.00 1.61 1.02 -0.86 -2.17 120.64 120.02 1awq n GLU 1043Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1awq n GLU 1043Cb 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1awq n GLU 1043CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1awq n LYS 1044N -0.45 0.00 0.00 3.49 4.01 -1.26 -5.05 118.16 118.90 1awq n LYS 1044Ca 0.00 -0.20 0.00 0.00 -0.51 0.00 0.00 58.31 57.60 1awq n LYS 1044Cb 0.00 -0.35 0.00 0.00 -0.51 0.00 0.00 35.03 34.17 1awq n LYS 1044CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1awq n GLY 1045N 0.00 3.46 0.00 0.72 0.00 -0.92 -4.97 105.19 103.48 1awq n GLY 1045Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1awq n GLY 1045CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1awq n PHE 1046N -2.00 0.00 -0.78 1.61 -1.74 -1.26 -5.13 117.46 108.16 1awq n PHE 1046Ca 0.00 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 57.00 1awq n PHE 1046Cb 0.00 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 40.97 1awq n PHE 1046CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1awq n GLY 1047N 4.47 -1.68 0.01 4.97 0.00 -1.26 -4.48 105.19 107.22 1awq n GLY 1047Ca 0.00 -1.33 0.08 0.00 0.00 0.00 0.00 46.02 44.77 1awq n GLY 1047CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1awq n TYR 1048N -2.83 0.08 -2.09 1.61 4.01 0.19 -4.69 117.16 113.44 1awq n TYR 1048Ca 0.00 0.03 -0.42 0.00 -0.16 0.00 0.00 57.90 57.35 1awq n TYR 1048Cb 0.36 -0.55 -0.03 0.00 -0.31 0.00 0.00 39.34 38.80 1awq n TYR 1048CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1awq s LYS 1049N -3.03 4.29 0.00 -0.72 2.20 -1.26 -2.47 119.74 118.75 1awq s LYS 1049Ca 0.07 2.18 0.00 0.00 -0.36 0.00 0.00 55.97 57.86 1awq s LYS 1049Cb 0.10 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1awq s LYS 1049CO 0.29 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 175.20 1awq n GLY 1050N 3.47 2.69 3.66 5.54 0.00 -1.05 -5.02 105.19 114.50 1awq n GLY 1050Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1awq n GLY 1050CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1awq s SER 1051N 0.34 2.89 0.43 1.61 1.04 -1.03 -4.60 113.70 114.39 1awq s SER 1051Ca 0.00 1.85 0.03 0.00 0.48 0.00 0.00 55.95 58.31 1awq s SER 1051Cb 0.00 -2.42 -0.03 0.00 0.10 0.00 0.00 66.02 63.67 1awq s SER 1051CO 0.00 -3.06 0.08 0.00 0.98 0.00 0.00 173.24 171.24 1awq s PHE 1053N -3.10 3.50 0.35 0.00 0.40 -0.79 -4.16 117.98 114.17 1awq s PHE 1053Ca 0.20 -1.72 0.15 0.00 -0.60 0.00 0.00 56.93 54.96 1awq s PHE 1053Cb 0.03 -3.97 0.79 0.00 0.51 0.00 0.00 43.02 40.38 1awq s PHE 1053CO 0.11 -1.16 1.84 1.12 0.70 0.00 0.00 175.22 177.83 1awq h HIS 1054N 8.23 0.00 -3.48 0.36 2.07 -1.81 -3.42 115.15 117.10 1awq h HIS 1054Ca 0.08 0.00 -0.62 0.00 -2.85 0.00 0.00 60.37 56.99 1awq h HIS 1054Cb 1.04 0.00 -0.37 0.00 2.57 0.00 0.00 27.41 30.65 1awq h HIS 1054CO 1.05 0.35 -0.81 0.50 -3.07 0.00 0.00 177.93 175.96 1awq s ARG 1055N -4.09 1.96 -0.10 5.12 3.52 -1.16 -4.38 118.95 119.82 1awq s ARG 1055Ca -0.02 -0.88 -0.01 0.00 -0.13 0.00 0.00 55.73 54.68 1awq s ARG 1055Cb 0.14 -2.46 0.03 0.00 -1.56 0.00 0.00 34.95 31.10 1awq s ARG 1055CO 0.70 -0.46 -0.02 0.42 -0.81 0.00 0.00 175.30 175.13 1awq s ILE 1056N 1.39 0.65 -0.30 4.11 1.01 -0.49 0.68 121.20 128.24 1awq s ILE 1056Ca -0.02 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.53 1awq s ILE 1056Cb -0.17 -0.79 0.08 0.00 0.01 0.00 0.00 42.46 41.59 1awq s ILE 1056CO -0.08 0.24 0.01 -0.63 0.00 0.00 0.00 174.94 174.48 1awq s ILE 1057N 1.86 1.89 -0.10 2.92 1.01 0.10 -1.46 121.20 127.42 1awq s ILE 1057Ca 0.04 -1.84 -0.37 0.00 0.00 0.00 0.00 60.65 58.48 1awq s ILE 1057Cb -0.13 -2.27 -0.15 0.00 0.01 0.00 0.00 42.46 39.92 1awq s ILE 1057CO -0.07 -0.40 1.64 -2.65 0.00 0.00 0.00 174.94 173.47 1awq n PRO 1058N 4.46 1.44 -0.14 2.79 -0.02 -1.25 -0.75 135.00 141.53 1awq n PRO 1058Ca -0.04 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1awq n PRO 1058Cb 0.42 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1awq n PRO 1058CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1awq n GLY 1059N 3.70 0.89 0.12 -1.23 0.00 -1.26 -4.88 105.19 102.53 1awq n GLY 1059Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1awq n GLY 1059CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1awq n PHE 1060N -2.00 0.00 -3.81 1.61 7.35 0.07 -4.39 117.46 116.28 1awq n PHE 1060Ca 0.00 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.64 1awq n PHE 1060Cb 0.00 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 39.83 1awq n PHE 1060CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1awq s MET 1061N -0.13 1.45 -0.16 -4.13 0.23 -0.68 -1.69 119.30 114.20 1awq s MET 1061Ca 0.00 -0.86 0.00 0.00 -1.03 0.00 0.00 55.69 53.80 1awq s MET 1061Cb 0.00 0.45 0.03 0.00 -1.53 0.00 0.00 34.83 33.79 1awq s MET 1061CO 0.00 -0.67 -0.11 0.00 -2.03 0.00 0.00 175.02 172.21 1awq s GLN 1063N 1.52 3.50 0.00 0.00 0.74 0.21 -0.26 119.66 125.37 1awq s GLN 1063Ca 0.03 -0.54 0.00 0.00 0.05 0.00 0.00 55.36 54.90 1awq s GLN 1063Cb -0.14 -2.83 0.00 0.00 1.10 0.00 0.00 33.01 31.13 1awq s GLN 1063CO -0.09 0.31 0.00 0.41 -0.55 0.00 0.00 175.29 175.37 1awq n GLY 1064N 3.30 4.34 0.00 2.59 0.00 -0.11 -2.75 105.19 112.56 1awq n GLY 1064Ca -0.18 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1awq n GLY 1064CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1awq n GLY 1065N 0.00 2.65 3.51 -0.02 0.00 -1.26 -1.27 105.19 108.79 1awq n GLY 1065Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1awq n GLY 1065CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1awq s ASP 1066N -1.37 6.82 0.33 1.61 2.15 -1.26 -3.86 116.67 121.09 1awq s ASP 1066Ca 0.00 -2.40 0.17 0.00 0.43 0.00 0.00 52.55 50.76 1awq s ASP 1066Cb 0.00 -2.47 0.17 0.00 -0.30 0.00 0.00 42.92 40.32 1awq s ASP 1066CO 0.00 -1.05 1.50 2.19 -0.17 0.00 0.00 175.17 177.65 1awq h PHE 1067N 8.06 0.00 0.05 -5.34 -5.15 -1.93 -2.34 116.94 110.29 1awq h PHE 1067Ca 0.30 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.96 1awq h PHE 1067Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.10 1awq h PHE 1067CO 1.23 0.36 -0.49 1.79 -2.00 0.00 0.00 178.31 179.20 1awq h THR 1068N 0.00 1.57 0.00 0.88 1.35 -1.92 -3.41 112.91 111.38 1awq h THR 1068Ca -0.00 -2.40 -0.34 0.00 -0.55 0.00 0.00 66.41 63.12 1awq h THR 1068Cb 1.26 3.18 -0.06 0.00 -1.73 0.00 0.00 68.15 70.79 1awq h THR 1068CO 0.05 0.63 -2.27 0.54 -0.25 0.00 0.00 175.52 174.21 1awq n ARG 1069N -4.38 0.93 -1.65 4.72 3.00 -1.26 -4.95 116.66 113.06 1awq n ARG 1069Ca -0.14 0.02 -0.13 0.00 -0.01 0.00 0.00 57.85 57.58 1awq n ARG 1069Cb 0.64 -1.47 -0.04 0.00 0.00 0.00 0.00 32.46 31.59 1awq n ARG 1069CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1awq n HIS 1070N -2.78 -0.20 0.00 -1.55 8.25 -0.88 -4.82 115.22 113.25 1awq n HIS 1070Ca -0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.14 1awq n HIS 1070Cb 1.07 -2.56 0.00 0.00 1.12 0.00 0.00 29.99 29.61 1awq n HIS 1070CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1awq n ASN 1071N -0.28 1.94 0.00 0.41 0.23 -1.26 -4.76 115.26 111.53 1awq n ASN 1071Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.91 1awq n ASN 1071Cb 0.50 0.18 0.00 0.00 -2.08 0.00 0.00 39.78 38.37 1awq n ASN 1071CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1awq n GLY 1072N 1.56 0.57 0.18 4.83 0.00 -1.26 -4.89 105.19 106.17 1awq n GLY 1072Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1awq n GLY 1072CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1awq h THR 1073N 0.00 0.62 0.00 2.61 2.02 -1.96 -3.48 112.91 112.73 1awq h THR 1073Ca 0.00 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.30 1awq h THR 1073Cb 0.00 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1awq h THR 1073CO 0.00 0.15 0.00 0.61 0.37 0.00 0.00 175.52 176.65 1awq n GLY 1074N 0.31 0.81 0.25 2.16 0.00 -1.26 -5.10 105.19 102.36 1awq n GLY 1074Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.97 1awq n GLY 1074CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1awq n GLY 1075N 4.83 -1.74 3.58 -0.02 0.00 -1.26 -4.73 105.19 105.84 1awq n GLY 1075Ca 0.00 -1.45 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 1awq n GLY 1075CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1awq s LYS 1076N -1.74 0.85 0.00 1.61 -2.85 -1.26 -4.75 119.74 111.59 1awq s LYS 1076Ca 0.00 0.54 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 1awq s LYS 1076Cb 0.00 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.18 1awq s LYS 1076CO 0.00 -0.20 0.00 -1.13 0.10 0.00 0.00 175.35 174.12 1awq n SER 1077N 1.66 0.00 -0.39 0.03 3.41 -0.50 -4.12 113.62 113.71 1awq n SER 1077Ca -0.15 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.57 1awq n SER 1077Cb 0.56 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 1awq n SER 1077CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1awq n ILE 1078N -0.18 0.00 -2.76 -1.33 -5.35 -1.26 -4.48 119.36 103.99 1awq n ILE 1078Ca 0.00 -0.20 -0.35 0.00 -0.27 0.00 0.00 62.75 61.92 1awq n ILE 1078Cb 0.00 1.19 -0.00 0.00 -1.74 0.00 0.00 39.64 39.09 1awq n ILE 1078CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1awq n TYR 1079N -0.33 3.30 0.00 4.28 4.01 -1.26 -4.97 117.16 122.18 1awq n TYR 1079Ca 0.08 -3.15 0.00 0.00 -0.16 0.00 0.00 57.90 54.67 1awq n TYR 1079Cb 0.44 -0.91 0.00 0.00 -0.31 0.00 0.00 39.34 38.56 1awq n TYR 1079CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1awq n GLY 1080N -0.13 2.37 0.24 2.72 0.00 -1.26 -4.35 105.19 104.77 1awq n GLY 1080Ca 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1awq n GLY 1080CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1awq n GLU 1081N 0.00 0.00 -4.56 1.61 -0.58 -1.26 -4.56 120.64 111.29 1awq n GLU 1081Ca 0.00 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.48 1awq n GLU 1081Cb 0.00 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.77 1awq n GLU 1081CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1awq s LYS 1082N -0.18 1.88 0.10 3.49 -0.14 -1.26 -1.41 119.74 122.21 1awq s LYS 1082Ca 0.00 -2.10 -0.12 0.00 -1.36 0.00 0.00 55.97 52.39 1awq s LYS 1082Cb 0.00 -1.09 0.01 0.00 -1.68 0.00 0.00 37.83 35.08 1awq s LYS 1082CO 0.00 -0.26 0.28 -0.59 -0.76 0.00 0.00 175.35 174.02 1awq s PHE 1083N -3.08 0.01 1.12 3.18 -0.71 -0.12 -4.93 117.98 113.44 1awq s PHE 1083Ca 0.28 -0.39 -0.15 0.00 -1.04 0.00 0.00 56.93 55.62 1awq s PHE 1083Cb 0.06 0.07 0.25 0.00 -1.21 0.00 0.00 43.02 42.19 1awq s PHE 1083CO 0.14 -0.61 1.09 -1.83 -1.34 0.00 0.00 175.22 172.66 1awq s GLU 1084N -3.84 -0.53 -0.07 1.99 1.03 -1.26 -1.35 118.70 114.68 1awq s GLU 1084Ca 0.04 0.29 -0.30 0.00 0.03 0.00 0.00 54.97 55.03 1awq s GLU 1084Cb 0.04 -1.65 -0.03 0.00 -0.80 0.00 0.00 34.13 31.69 1awq s GLU 1084CO -0.11 -3.32 1.12 -0.51 -1.33 0.00 0.00 175.26 171.10 1awq s ASP 1085N -3.53 7.14 0.05 0.83 1.01 -1.26 -4.70 116.67 116.21 1awq s ASP 1085Ca 0.68 1.71 -0.22 0.00 0.71 0.00 0.00 52.55 55.43 1awq s ASP 1085Cb -0.16 -2.56 -0.14 0.00 1.01 0.00 0.00 42.92 41.07 1awq s ASP 1085CO 0.58 -0.52 1.49 -0.08 0.21 0.00 0.00 175.17 176.85 1awq h GLU 1086N 7.27 0.18 0.00 8.23 4.81 -2.00 -3.49 114.58 129.58 1awq h GLU 1086Ca -0.33 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1awq h GLU 1086Cb 1.16 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1awq h GLU 1086CO 0.86 0.42 0.00 0.27 -0.73 0.00 0.00 179.01 179.83 1awq n ASN 1087N -4.82 0.00 -0.48 1.04 0.23 -1.26 -5.05 115.26 104.92 1awq n ASN 1087Ca -0.06 0.00 0.05 0.00 -0.53 0.00 0.00 54.58 54.04 1awq n ASN 1087Cb 0.19 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 37.97 1awq n ASN 1087CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1awq n PHE 1088N 0.59 0.00 -0.18 -2.53 3.72 -1.26 -4.64 117.46 113.16 1awq n PHE 1088Ca 0.00 -0.58 -0.06 0.00 -0.05 0.00 0.00 57.45 56.76 1awq n PHE 1088Cb 0.00 -0.12 -0.00 0.00 -0.94 0.00 0.00 39.48 38.42 1awq n PHE 1088CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1awq h ILE 1089N 3.85 0.19 -3.80 4.37 2.04 -1.97 -3.41 117.51 118.78 1awq h ILE 1089Ca -0.03 0.00 -0.48 0.00 1.00 0.00 0.00 64.86 65.35 1awq h ILE 1089Cb 1.27 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1awq h ILE 1089CO 0.01 0.00 0.35 -0.76 0.00 0.00 0.00 178.15 177.75 1awq s LEU 1090N -10.67 4.53 0.23 1.44 2.01 -1.26 -5.07 118.68 109.89 1awq s LEU 1090Ca -0.14 1.91 0.10 0.00 0.01 0.00 0.00 54.13 56.01 1awq s LEU 1090Cb 0.15 -3.77 -0.04 0.00 0.01 0.00 0.00 46.19 42.53 1awq s LEU 1090CO 0.69 0.07 -0.13 -0.54 1.01 0.00 0.00 176.35 177.44 1awq s LYS 1091N -1.53 1.90 -1.20 1.70 1.02 -1.26 -4.24 119.74 116.13 1awq s LYS 1091Ca 0.45 -1.50 -0.19 0.00 0.02 0.00 0.00 55.97 54.75 1awq s LYS 1091Cb -0.23 -1.99 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 1awq s LYS 1091CO 0.29 0.38 1.96 0.72 -0.92 0.00 0.00 175.35 177.78 1awq n HIS 1092N -0.32 3.33 0.17 3.18 8.25 -1.26 -4.72 115.22 123.85 1awq n HIS 1092Ca -0.08 -2.36 0.04 0.00 -0.26 0.00 0.00 57.72 55.05 1awq n HIS 1092Cb 0.58 -2.41 0.27 0.00 1.12 0.00 0.00 29.99 29.55 1awq n HIS 1092CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1awq h THR 1093N 5.01 0.98 0.00 1.59 1.35 -1.92 -2.86 112.91 117.06 1awq h THR 1093Ca 0.43 -1.72 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 1awq h THR 1093Cb 0.78 2.03 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 1awq h THR 1093CO 1.64 0.43 0.00 0.61 -0.25 0.00 0.00 175.52 177.95 1awq n GLY 1094N 0.36 -1.05 3.75 5.82 0.00 -1.26 -4.55 105.19 108.25 1awq n GLY 1094Ca -0.00 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 1awq n GLY 1094CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1awq s PRO 1095N -0.44 2.99 0.00 1.61 0.04 -1.25 -3.09 135.00 134.86 1awq s PRO 1095Ca 0.00 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1awq s PRO 1095Cb 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1awq s PRO 1095CO 0.00 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.22 1awq n GLY 1096N 0.66 3.31 3.69 0.56 0.00 0.17 -4.91 105.19 108.68 1awq n GLY 1096Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 1awq n GLY 1096CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1awq n ILE 1097N -1.52 0.09 -3.73 -0.61 2.08 -1.18 -0.40 119.36 114.10 1awq n ILE 1097Ca 0.00 -0.02 -0.37 0.00 0.56 0.00 0.00 62.75 62.92 1awq n ILE 1097Cb 0.00 -1.68 -0.12 0.00 -0.75 0.00 0.00 39.64 37.08 1awq n ILE 1097CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1awq s LEU 1098N 0.89 3.62 0.16 1.39 2.96 0.36 -0.27 118.68 127.79 1awq s LEU 1098Ca 0.77 -0.30 0.06 0.00 -0.22 0.00 0.00 54.13 54.43 1awq s LEU 1098Cb -0.62 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.09 1awq s LEU 1098CO 0.37 -0.08 -0.13 -0.55 -1.32 0.00 0.00 176.35 174.65 1awq s SER 1099N 1.61 2.12 0.03 3.68 0.15 -0.45 -1.63 113.70 119.21 1awq s SER 1099Ca 0.06 -0.95 -0.29 0.00 0.70 0.00 0.00 55.95 55.46 1awq s SER 1099Cb -0.16 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.04 1awq s SER 1099CO 0.04 -0.22 0.94 -0.04 1.20 0.00 0.00 173.24 175.16 1awq s MET 1100N -3.39 4.59 -0.65 5.44 -1.94 -0.58 -0.42 119.30 122.35 1awq s MET 1100Ca 0.16 1.37 -0.17 0.00 -1.71 0.00 0.00 55.69 55.34 1awq s MET 1100Cb -0.01 -3.43 0.13 0.00 2.01 0.00 0.00 34.83 33.54 1awq s MET 1100CO 0.03 0.06 0.70 0.00 -0.01 0.00 0.00 175.02 175.81 1awq s ALA 1101N 0.61 3.58 0.46 3.03 0.00 -0.68 -4.37 121.76 124.38 1awq s ALA 1101Ca 0.48 -2.54 0.04 0.00 0.00 0.00 0.00 51.96 49.95 1awq s ALA 1101Cb -0.21 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.47 1awq s ALA 1101CO 0.28 -2.32 0.58 0.27 0.00 0.00 0.00 175.76 174.57 1awq n ASN 1102N 5.70 1.26 -3.20 0.00 0.23 -1.26 -4.61 115.26 113.38 1awq n ASN 1102Ca -0.04 -1.95 -0.23 0.00 -0.53 0.00 0.00 54.58 51.83 1awq n ASN 1102Cb 0.43 -0.33 -0.06 0.00 -2.08 0.00 0.00 39.78 37.74 1awq n ASN 1102CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1awq n ALA 1103N -2.67 2.77 0.00 -2.53 0.00 -1.26 -5.06 120.51 111.76 1awq n ALA 1103Ca -0.10 -3.73 0.00 0.00 0.00 0.00 0.00 53.44 49.61 1awq n ALA 1103Cb 0.40 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1awq n ALA 1103CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1awq n GLY 1104N 0.87 1.22 3.48 0.00 0.00 -1.26 -4.86 105.19 104.64 1awq n GLY 1104Ca 0.24 -1.63 -0.54 0.00 0.00 0.00 0.00 46.02 44.09 1awq n GLY 1104CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1awq n PRO 1105N 1.34 0.20 -3.36 1.61 -0.02 -1.26 -3.11 135.00 130.40 1awq n PRO 1105Ca 0.00 0.07 -0.19 0.00 -2.02 0.00 0.00 63.50 61.37 1awq n PRO 1105Cb 0.00 -1.42 0.07 0.00 -0.02 0.00 0.00 33.50 32.12 1awq n PRO 1105CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1awq n ASN 1106N 1.76 -5.12 -2.21 2.55 5.03 -1.26 -4.96 115.26 111.05 1awq n ASN 1106Ca 0.19 -0.44 -0.06 0.00 0.87 0.00 0.00 54.58 55.13 1awq n ASN 1106Cb 0.16 -4.16 0.05 0.00 -1.02 0.00 0.00 39.78 34.81 1awq n ASN 1106CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1awq n THR 1107N -4.40 1.54 -2.16 3.41 -2.24 -1.18 -4.15 114.28 105.09 1awq n THR 1107Ca -0.02 -3.05 -0.43 0.00 -2.27 0.00 0.00 64.05 58.28 1awq n THR 1107Cb 0.56 0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 1awq n THR 1107CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1awq s ASN 1108N -3.44 6.66 0.00 3.42 0.01 -0.46 -4.39 114.94 116.75 1awq s ASN 1108Ca 0.36 1.89 0.00 0.00 -0.71 0.00 0.00 52.86 54.40 1awq s ASN 1108Cb 0.36 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 39.49 1awq s ASN 1108CO -0.04 -0.98 0.00 0.61 -1.51 0.00 0.00 177.10 175.18 1awq n GLY 1109N 4.15 0.69 0.02 0.66 0.00 -1.26 -0.94 105.19 108.50 1awq n GLY 1109Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1awq n GLY 1109CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1awq n SER 1110N 0.00 3.52 -4.75 1.61 3.41 -1.26 -3.85 113.62 112.29 1awq n SER 1110Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.22 1awq n SER 1110Cb 0.00 0.87 0.03 0.00 -0.26 0.00 0.00 64.21 64.85 1awq n SER 1110CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1awq s GLN 1111N -2.25 3.27 0.25 4.33 -0.21 -1.25 -4.61 119.66 119.19 1awq s GLN 1111Ca -0.03 2.25 -0.16 0.00 0.02 0.00 0.00 55.36 57.44 1awq s GLN 1111Cb 0.03 -2.34 0.01 0.00 1.00 0.00 0.00 33.01 31.70 1awq s GLN 1111CO 0.25 -1.09 0.56 -0.59 -2.12 0.00 0.00 175.29 172.31 1awq s PHE 1112N -1.30 0.14 -0.00 0.91 -0.12 -0.40 -1.69 117.98 115.53 1awq s PHE 1112Ca 0.69 -0.54 -0.03 0.00 -0.05 0.00 0.00 56.93 57.00 1awq s PHE 1112Cb -0.40 0.38 -0.00 0.00 -0.63 0.00 0.00 43.02 42.36 1awq s PHE 1112CO 0.49 -1.07 0.05 -0.59 -0.05 0.00 0.00 175.22 174.05 1awq s PHE 1113N -3.98 0.08 -0.23 3.49 -0.71 0.43 -0.93 117.98 116.14 1awq s PHE 1113Ca 0.18 -0.17 -0.08 0.00 -1.04 0.00 0.00 56.93 55.82 1awq s PHE 1113Cb -0.03 -0.08 -0.03 0.00 -1.21 0.00 0.00 43.02 41.68 1awq s PHE 1113CO 0.08 -0.17 0.08 0.42 -1.34 0.00 0.00 175.22 174.29 1awq s ILE 1114N -0.93 4.52 0.41 -4.49 1.01 0.64 -1.34 121.20 121.01 1awq s ILE 1114Ca -0.10 -0.11 -0.24 0.00 0.00 0.00 0.00 60.65 60.20 1awq s ILE 1114Cb -0.06 -3.09 -0.09 0.00 0.01 0.00 0.00 42.46 39.23 1awq s ILE 1114CO 0.00 0.36 1.04 0.00 0.00 0.00 0.00 174.94 176.34 1awq n THR 1116N -0.15 1.28 -3.60 0.00 -2.24 -0.68 0.46 114.28 109.34 1awq n THR 1116Ca 0.05 -1.87 0.01 0.00 -2.27 0.00 0.00 64.05 59.97 1awq n THR 1116Cb 0.50 0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 1awq n THR 1116CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1awq s ALA 1117N -1.91 -2.32 0.05 6.98 0.00 -1.25 -4.62 121.76 118.69 1awq s ALA 1117Ca 0.27 1.26 -0.31 0.00 0.00 0.00 0.00 51.96 53.18 1awq s ALA 1117Cb 0.27 0.04 -0.06 0.00 0.00 0.00 0.00 23.12 23.36 1awq s ALA 1117CO -0.04 -0.86 1.34 0.21 0.00 0.00 0.00 175.76 176.41 1awq s LYS 1118N -2.16 4.34 -0.45 0.00 2.20 -1.26 -3.81 119.74 118.59 1awq s LYS 1118Ca 0.13 1.94 0.09 0.00 -0.36 0.00 0.00 55.97 57.77 1awq s LYS 1118Cb 0.04 -3.40 0.37 0.00 -1.51 0.00 0.00 37.83 33.32 1awq s LYS 1118CO -0.05 -0.44 0.88 0.25 -0.36 0.00 0.00 175.35 175.64 1awq n THR 1119N 4.23 1.51 0.30 3.43 -2.24 -1.08 -4.94 114.28 115.48 1awq n THR 1119Ca 0.11 -4.84 0.18 0.00 -2.27 0.00 0.00 64.05 57.24 1awq n THR 1119Cb 0.44 -0.71 1.00 0.00 -2.10 0.00 0.00 70.33 68.96 1awq n THR 1119CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1awq h GLU 1120N 2.94 0.00 0.00 -0.78 9.09 -1.91 -1.51 114.58 122.42 1awq h GLU 1120Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.52 1awq h GLU 1120Cb 0.81 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 1awq h GLU 1120CO 0.66 0.00 0.00 -2.67 0.05 0.00 0.00 179.01 177.05 1awq n TRP 1121N -3.46 0.77 1.05 2.06 2.14 -1.26 -0.98 117.44 117.76 1awq n TRP 1121Ca -0.02 0.34 0.12 0.00 2.07 0.00 0.00 57.50 60.01 1awq n TRP 1121Cb 0.17 -1.04 0.27 0.00 -0.81 0.00 0.00 31.31 29.90 1awq n TRP 1121CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1awq n LEU 1122N -2.23 0.62 -4.64 5.67 4.77 -0.57 -4.84 117.00 115.78 1awq n LEU 1122Ca 0.01 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.50 1awq n LEU 1122Cb 0.15 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 1awq n LEU 1122CO 0.16 0.14 1.56 -1.81 -1.33 0.00 0.00 177.39 176.10 1awq s ASP 1123N -2.89 6.31 0.00 -1.43 1.01 -0.15 -1.30 116.67 118.22 1awq s ASP 1123Ca 0.14 2.26 0.00 0.00 0.71 0.00 0.00 52.55 55.66 1awq s ASP 1123Cb 0.18 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.58 1awq s ASP 1123CO 0.66 -1.22 0.00 0.61 0.21 0.00 0.00 175.17 175.43 1awq n GLY 1124N 4.69 1.94 0.12 0.21 0.00 -1.26 -4.85 105.19 106.03 1awq n GLY 1124Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 1awq n GLY 1124CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1awq n LYS 1125N -1.68 0.46 -5.14 1.61 5.02 -0.50 -4.98 118.16 112.95 1awq n LYS 1125Ca 0.00 0.11 -0.32 0.00 -2.02 0.00 0.00 58.31 56.08 1awq n LYS 1125Cb 0.00 -1.36 -0.17 0.00 -0.02 0.00 0.00 35.03 33.49 1awq n LYS 1125CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1awq s HIS 1126N -2.37 2.60 -0.31 2.13 3.76 -0.42 -4.86 115.29 115.82 1awq s HIS 1126Ca -0.25 -1.01 -0.29 0.00 -0.15 0.00 0.00 55.06 53.36 1awq s HIS 1126Cb 0.07 -1.73 -0.01 0.00 1.11 0.00 0.00 32.58 32.02 1awq s HIS 1126CO 0.42 -0.40 1.50 0.08 -0.85 0.00 0.00 174.74 175.49 1awq s VAL 1127N 0.36 3.84 -0.28 -0.90 1.01 -1.26 -4.76 120.40 118.40 1awq s VAL 1127Ca -0.17 0.91 -0.26 0.00 0.00 0.00 0.00 61.98 62.46 1awq s VAL 1127Cb -0.18 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1awq s VAL 1127CO 0.08 -0.48 0.89 -0.69 0.00 0.00 0.00 175.10 174.90 1awq s VAL 1128N 5.28 4.73 0.00 2.92 1.01 -1.26 -1.52 120.40 131.56 1awq s VAL 1128Ca 0.66 1.50 0.00 0.00 0.00 0.00 0.00 61.98 64.14 1awq s VAL 1128Cb -0.19 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1awq s VAL 1128CO 0.29 -0.25 0.40 2.22 0.00 0.00 0.00 175.10 177.76 1awq n PHE 1129N 6.32 0.00 -3.61 5.22 -1.74 -0.65 -4.58 117.46 118.42 1awq n PHE 1129Ca 0.07 -0.04 -0.03 0.00 -0.56 0.00 0.00 57.45 56.89 1awq n PHE 1129Cb 0.47 -0.00 0.01 0.00 1.52 0.00 0.00 39.48 41.48 1awq n PHE 1129CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1awq n GLY 1130N -0.04 1.09 3.60 4.97 0.00 -1.05 -0.97 105.19 112.78 1awq n GLY 1130Ca 0.00 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 1awq n GLY 1130CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1awq s LYS 1131N -2.04 0.70 0.30 1.61 2.20 -0.52 -0.49 119.74 121.51 1awq s LYS 1131Ca 0.11 0.49 -0.30 0.00 -0.36 0.00 0.00 55.97 55.91 1awq s LYS 1131Cb -0.02 0.34 -0.11 0.00 -1.51 0.00 0.00 37.83 36.53 1awq s LYS 1131CO 0.04 -0.15 1.53 0.08 -0.36 0.00 0.00 175.35 176.48 1awq s VAL 1132N -0.39 2.24 -0.25 4.02 1.01 0.47 -0.58 120.40 126.91 1awq s VAL 1132Ca -0.02 0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.15 1awq s VAL 1132Cb -0.03 -3.13 -0.15 0.00 0.00 0.00 0.00 36.38 33.07 1awq s VAL 1132CO 0.01 0.04 -0.25 0.29 0.00 0.00 0.00 175.10 175.18 1awq n LYS 1133N 1.86 0.59 -3.78 2.72 5.02 0.13 -4.82 118.16 119.89 1awq n LYS 1133Ca 0.06 0.17 -0.13 0.00 -2.02 0.00 0.00 58.31 56.39 1awq n LYS 1133Cb 0.39 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.83 1awq n LYS 1133CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1awq s GLU 1134N -2.48 0.50 0.00 1.97 2.12 -1.20 -4.93 118.70 114.67 1awq s GLU 1134Ca -0.34 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.07 1awq s GLU 1134Cb 0.10 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.72 1awq s GLU 1134CO 0.53 -0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.56 1awq n GLY 1135N 2.09 1.20 0.14 -1.50 0.00 -1.26 -1.06 105.19 104.80 1awq n GLY 1135Ca -0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.96 1awq n GLY 1135CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1awq n MET 1136N -1.63 0.18 0.09 1.61 0.00 -1.26 -1.20 117.12 114.90 1awq n MET 1136Ca 0.00 0.48 0.12 0.00 0.00 0.00 0.00 57.70 58.30 1awq n MET 1136Cb 0.00 -1.88 0.15 0.00 0.00 0.00 0.00 33.22 31.48 1awq n MET 1136CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 175.97 173.02 1awq h ASN 1137N 0.00 0.00 0.06 6.12 -1.07 -1.94 -2.62 115.58 116.13 1awq h ASN 1137Ca 0.00 -0.14 -0.15 0.00 0.07 0.00 0.00 56.30 56.09 1awq h ASN 1137Cb 0.26 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.51 1awq h ASN 1137CO 0.00 0.07 -0.73 0.40 0.07 0.00 0.00 177.43 177.24 1awq h ILE 1138N 0.00 1.41 -0.95 6.14 1.08 -1.47 -2.52 117.51 121.19 1awq h ILE 1138Ca 0.00 -2.37 0.10 0.00 -0.39 0.00 0.00 64.86 62.19 1awq h ILE 1138Cb 0.82 2.99 -0.07 0.00 -3.07 0.00 0.00 36.82 37.49 1awq h ILE 1138CO 0.00 0.60 0.61 0.58 -0.69 0.00 0.00 178.15 179.25 1awq h VAL 1139N -0.70 0.98 0.00 1.67 2.07 -1.51 0.18 116.25 118.93 1awq h VAL 1139Ca -0.16 -0.34 -0.11 0.00 0.82 0.00 0.00 66.70 66.91 1awq h VAL 1139Cb 1.37 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1awq h VAL 1139CO 0.01 0.18 -0.53 -0.08 0.02 0.00 0.00 177.57 177.17 1awq h GLU 1140N 0.98 0.00 -0.07 1.57 4.81 -1.55 -2.16 114.58 118.16 1awq h GLU 1140Ca 0.44 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.50 1awq h GLU 1140Cb 0.39 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.78 1awq h GLU 1140CO -0.20 0.53 -0.61 0.00 -0.73 0.00 0.00 179.01 178.00 1awq h ALA 1141N 1.47 0.17 0.00 2.92 0.00 -0.55 -3.14 119.26 120.13 1awq h ALA 1141Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1awq h ALA 1141Cb 1.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1awq h ALA 1141CO 0.07 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1awq h MET 1142N 0.13 0.00 -0.47 0.00 -0.00 -1.21 -3.15 114.93 110.22 1awq h MET 1142Ca -0.06 0.00 -0.12 0.00 -0.00 0.00 0.00 59.70 59.53 1awq h MET 1142Cb 1.27 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.85 1awq h MET 1142CO 0.12 0.00 -0.17 1.49 -0.00 0.00 0.00 176.91 178.36 1awq h GLU 1143N 0.00 0.91 0.00 -0.10 4.81 -1.34 -2.69 114.58 116.17 1awq h GLU 1143Ca 0.00 -0.35 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1awq h GLU 1143Cb 0.59 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 1awq h GLU 1143CO 0.00 1.00 -0.00 0.00 -0.73 0.00 0.00 179.01 179.28 1awq h ARG 1144N 0.80 0.00 -0.92 1.92 3.08 -1.61 -1.21 114.38 116.44 1awq h ARG 1144Ca 0.12 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.95 1awq h ARG 1144Cb 0.71 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.63 1awq h ARG 1144CO 0.05 0.00 0.27 1.19 -1.07 0.00 0.00 179.97 180.42 1awq n PHE 1145N -3.10 1.69 -1.98 3.04 3.72 -1.01 -4.85 117.46 114.95 1awq n PHE 1145Ca -0.02 -1.04 0.00 0.00 -0.05 0.00 0.00 57.45 56.33 1awq n PHE 1145Cb 0.13 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.09 1awq n PHE 1145CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1awq n GLY 1146N -0.22 4.54 0.00 1.37 0.00 -0.46 -1.74 105.19 108.67 1awq n GLY 1146Ca 0.30 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1awq n GLY 1146CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1awq n SER 1147N 0.00 0.00 0.00 1.61 3.41 -0.54 -4.40 113.62 113.71 1awq n SER 1147Ca 0.00 -0.58 -0.17 0.00 -0.26 0.00 0.00 58.87 57.85 1awq n SER 1147Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1awq n SER 1147CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1awq h ARG 1148N 0.00 0.36 -0.01 4.33 9.65 -1.87 -3.29 114.38 123.54 1awq h ARG 1148Ca 0.00 -0.41 0.00 0.00 -1.10 0.00 0.00 59.98 58.47 1awq h ARG 1148Cb 0.00 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.70 1awq h ARG 1148CO 0.00 1.09 -0.03 0.27 2.80 0.00 0.00 179.97 184.10 1awq n ASN 1149N -4.25 1.13 0.00 -3.80 0.23 -1.26 -4.91 115.26 102.39 1awq n ASN 1149Ca -0.11 -1.29 0.00 0.00 -0.53 0.00 0.00 54.58 52.66 1awq n ASN 1149Cb 0.66 0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.37 1awq n ASN 1149CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1awq n GLY 1150N 1.17 0.65 3.75 4.83 0.00 -1.24 -4.89 105.19 109.45 1awq n GLY 1150Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1awq n GLY 1150CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1awq s LYS 1151N -0.74 4.40 -0.26 1.61 2.20 -1.26 -1.40 119.74 124.29 1awq s LYS 1151Ca 0.00 2.07 -0.13 0.00 -0.36 0.00 0.00 55.97 57.55 1awq s LYS 1151Cb 0.00 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 1awq s LYS 1151CO 0.00 -0.20 0.29 0.95 -0.36 0.00 0.00 175.35 176.03 1awq s THR 1152N -0.28 5.25 -1.32 3.43 -4.23 -1.26 -2.83 115.64 114.40 1awq s THR 1152Ca 0.54 0.41 0.12 0.00 -1.18 0.00 0.00 61.69 61.58 1awq s THR 1152Cb -0.37 -3.62 0.18 0.00 1.34 0.00 0.00 72.50 70.03 1awq s THR 1152CO 0.42 0.23 1.32 -1.54 -0.54 0.00 0.00 174.62 174.50 1awq n SER 1153N 4.96 0.00 -3.75 3.99 3.41 -0.71 -4.68 113.62 116.84 1awq n SER 1153Ca -0.11 0.21 -0.11 0.00 -0.26 0.00 0.00 58.87 58.60 1awq n SER 1153Cb 0.51 -0.34 -0.07 0.00 -0.26 0.00 0.00 64.21 64.05 1awq n SER 1153CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1awq s LYS 1154N -2.68 0.84 -0.96 4.33 1.02 -1.26 -5.08 119.74 115.95 1awq s LYS 1154Ca 0.10 -0.58 -0.23 0.00 0.02 0.00 0.00 55.97 55.28 1awq s LYS 1154Cb 0.08 0.36 0.06 0.00 -0.52 0.00 0.00 37.83 37.81 1awq s LYS 1154CO 0.19 -0.28 1.37 0.21 -0.92 0.00 0.00 175.35 175.93 1awq s LYS 1155N -2.83 3.52 -0.23 1.68 2.47 -1.26 -4.92 119.74 118.17 1awq s LYS 1155Ca -0.03 -1.06 -0.26 0.00 -1.56 0.00 0.00 55.97 53.06 1awq s LYS 1155Cb 0.00 -5.11 -0.00 0.00 -1.46 0.00 0.00 37.83 31.26 1awq s LYS 1155CO -0.05 -2.14 0.87 0.42 0.16 0.00 0.00 175.35 174.61 1awq s ILE 1156N 4.80 4.81 0.25 5.43 1.09 -1.26 -1.41 121.20 134.91 1awq s ILE 1156Ca 0.42 1.67 0.09 0.00 -1.10 0.00 0.00 60.65 61.73 1awq s ILE 1156Cb -0.02 -4.16 -0.05 0.00 -1.06 0.00 0.00 42.46 37.17 1awq s ILE 1156CO -0.06 -0.08 -0.14 -0.89 -0.10 0.00 0.00 174.94 173.68 1awq s THR 1157N 2.78 1.96 -1.15 2.92 2.01 -0.86 -1.89 115.64 121.41 1awq s THR 1157Ca 0.37 -2.25 -0.10 0.00 0.31 0.00 0.00 61.69 60.02 1awq s THR 1157Cb -0.15 -2.23 0.25 0.00 0.01 0.00 0.00 72.50 70.37 1awq s THR 1157CO 0.08 -0.46 1.26 -0.38 -0.69 0.00 0.00 174.62 174.43 1awq n ILE 1158N -0.51 4.53 -0.41 1.82 5.41 -0.54 -2.17 119.36 127.49 1awq n ILE 1158Ca -0.06 -5.20 0.38 0.00 1.00 0.00 0.00 62.75 58.86 1awq n ILE 1158Cb 0.61 -2.51 0.73 0.00 -0.71 0.00 0.00 39.64 37.76 1awq n ILE 1158CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1awq h ALA 1159N 6.67 3.14 -2.65 -1.39 0.00 -0.74 -2.77 119.26 121.53 1awq h ALA 1159Ca 0.23 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1awq h ALA 1159Cb 0.85 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.61 1awq h ALA 1159CO 1.13 -1.56 0.35 0.34 0.00 0.00 0.00 179.25 179.51 1awq s ASP 1160N -4.85 -0.44 -0.04 0.00 2.15 -1.16 -4.73 116.67 107.60 1awq s ASP 1160Ca -0.06 -0.07 -0.29 0.00 0.43 0.00 0.00 52.55 52.56 1awq s ASP 1160Cb 0.25 0.51 0.11 0.00 -0.30 0.00 0.00 42.92 43.48 1awq s ASP 1160CO 0.83 -0.84 0.92 0.00 -0.17 0.00 0.00 175.17 175.90 1awq n GLY 1162N -0.11 -1.36 3.53 0.00 0.00 -1.11 -4.52 105.19 101.61 1awq n GLY 1162Ca -0.08 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 1awq n GLY 1162CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1awq s GLN 1163N -1.07 3.79 0.01 1.61 0.74 -1.26 -1.37 119.66 122.10 1awq s GLN 1163Ca 0.00 -0.43 0.23 0.00 0.05 0.00 0.00 55.36 55.21 1awq s GLN 1163Cb 0.00 -3.24 0.18 0.00 1.10 0.00 0.00 33.01 31.05 1awq s GLN 1163CO 0.00 0.05 1.17 1.28 -0.55 0.00 0.00 175.29 177.24 1awq n LEU 1164N 4.20 0.69 0.00 3.68 4.77 -0.35 -4.98 117.00 125.00 1awq n LEU 1164Ca -0.16 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1awq n LEU 1164Cb 0.52 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1awq n LEU 1164CO 0.33 0.15 0.00 -1.84 -1.33 0.00 0.00 177.39 174.70