#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hwc s ARG 1002N 0.00 1.74 0.10 0.03 3.52 -1.26 -5.02 118.95 118.05 3hwc s ARG 1002Ca 0.00 1.56 0.03 0.00 -0.13 0.00 0.00 55.73 57.19 3hwc s ARG 1002Cb 0.00 -1.81 -0.04 0.00 -1.56 0.00 0.00 34.95 31.54 3hwc s ARG 1002CO 0.00 -2.10 0.09 0.99 -0.81 0.00 0.00 175.30 173.47 3hwc s THR 1003N -2.42 4.53 0.18 4.11 2.01 -1.26 -4.64 115.64 118.15 3hwc s THR 1003Ca 0.69 -0.82 -0.13 0.00 0.31 0.00 0.00 61.69 61.73 3hwc s THR 1003Cb -0.24 -3.21 0.10 0.00 0.01 0.00 0.00 72.50 69.16 3hwc s THR 1003CO 0.52 0.08 1.71 1.23 -0.69 0.00 0.00 174.62 177.47 3hwc h GLY 1004N 3.12 0.58 0.58 4.40 0.00 -1.85 0.10 103.07 109.99 3hwc h GLY 1004Ca -0.47 -0.02 0.04 0.00 0.00 0.00 0.00 47.33 46.89 3hwc h GLY 1004CO 0.65 -0.07 -0.04 1.70 0.00 0.00 0.00 176.54 178.78 3hwc h LYS 1005N 0.22 0.01 -0.70 4.80 3.64 -1.95 0.82 116.57 123.42 3hwc h LYS 1005Ca 0.24 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 3hwc h LYS 1005Cb 0.32 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.09 3hwc h LYS 1005CO -0.32 0.01 0.42 1.96 -2.27 0.00 0.00 179.45 179.25 3hwc h GLN 1006N 0.01 0.77 -0.39 1.90 4.20 -1.78 -1.72 115.11 118.10 3hwc h GLN 1006Ca 0.11 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 3hwc h GLN 1006Cb 0.16 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3hwc h GLN 1006CO -0.22 0.51 0.13 -0.92 -0.67 0.00 0.00 178.83 177.66 3hwc h TYR 1007N 0.80 0.62 -0.88 2.96 3.20 -0.22 -2.37 116.97 121.08 3hwc h TYR 1007Ca 0.29 -0.06 0.08 0.00 3.14 0.00 0.00 58.73 62.18 3hwc h TYR 1007Cb 0.09 -0.18 -0.07 0.00 1.54 0.00 0.00 36.73 38.12 3hwc h TYR 1007CO -0.05 0.58 0.54 -0.07 -1.64 0.00 0.00 178.16 177.51 3hwc h LEU 1008N 0.48 0.82 -0.93 2.82 4.07 -0.41 -2.13 115.31 120.04 3hwc h LEU 1008Ca 0.13 0.03 -0.10 0.00 0.08 0.00 0.00 57.88 58.01 3hwc h LEU 1008Cb 0.25 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 3hwc h LEU 1008CO -0.00 0.50 -0.50 -0.33 -1.08 0.00 0.00 178.44 177.03 3hwc h GLU 1009N 0.94 0.00 0.00 1.13 5.08 -1.12 -2.75 114.58 117.86 3hwc h GLU 1009Ca 0.40 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.74 3hwc h GLU 1009Cb 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3hwc h GLU 1009CO -0.20 0.50 -0.07 0.66 -1.00 0.00 0.00 179.01 178.89 3hwc h SER 1010N 0.00 0.00 0.31 1.42 4.64 -0.85 -2.98 113.55 116.08 3hwc h SER 1010Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 3hwc h SER 1010Cb 0.94 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 3hwc h SER 1010CO 0.06 0.07 -0.48 -0.07 -0.87 0.00 0.00 176.83 175.54 3hwc h LEU 1011N 0.00 0.22 -5.98 5.97 3.38 -1.37 -3.34 115.31 114.19 3hwc h LEU 1011Ca -0.00 -0.11 -0.71 0.00 0.09 0.00 0.00 57.88 57.15 3hwc h LEU 1011Cb 0.50 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 3hwc h LEU 1011CO 0.01 0.68 3.07 -3.20 0.09 0.00 0.00 178.44 179.08 3hwc n ASN 1012N -3.97 4.32 -0.15 -0.43 2.85 -1.13 -4.52 115.26 112.24 3hwc n ASN 1012Ca -0.02 -2.85 0.07 0.00 -0.11 0.00 0.00 54.58 51.67 3hwc n ASN 1012Cb 0.53 -1.63 0.09 0.00 1.24 0.00 0.00 39.78 40.01 3hwc n ASN 1012CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 3hwc n ASP 1013N 5.69 1.77 -0.38 1.20 3.85 -1.26 -4.97 116.55 122.45 3hwc n ASP 1013Ca 0.52 -2.71 -0.05 0.00 -0.71 0.00 0.00 54.79 51.85 3hwc n ASP 1013Cb 0.38 -0.33 -0.02 0.00 -1.35 0.00 0.00 41.12 39.80 3hwc n ASP 1013CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hwc n GLY 1014N -1.02 0.69 3.76 6.12 0.00 -1.26 -4.90 105.19 108.58 3hwc n GLY 1014Ca 0.11 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 3hwc n GLY 1014CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hwc s ARG 1015N -2.58 4.32 -0.40 1.61 1.70 -1.26 -4.95 118.95 117.38 3hwc s ARG 1015Ca 0.00 2.24 -0.17 0.00 -0.47 0.00 0.00 55.73 57.33 3hwc s ARG 1015Cb 0.00 -3.10 0.01 0.00 -0.57 0.00 0.00 34.95 31.29 3hwc s ARG 1015CO 0.00 -0.30 0.45 0.54 -1.08 0.00 0.00 175.30 174.91 3hwc s VAL 1016N -0.51 5.07 -0.01 4.99 0.11 -1.26 -4.95 120.40 123.84 3hwc s VAL 1016Ca 0.54 -0.19 0.01 0.00 -2.93 0.00 0.00 61.98 59.41 3hwc s VAL 1016Cb -0.40 -4.01 0.01 0.00 -1.53 0.00 0.00 36.38 30.44 3hwc s VAL 1016CO 0.47 -0.37 -0.02 0.54 -3.33 0.00 0.00 175.10 172.40 3hwc s VAL 1017N 2.19 0.22 -0.09 2.04 0.11 -1.26 -1.97 120.40 121.64 3hwc s VAL 1017Ca 0.13 -0.05 -0.01 0.00 -2.93 0.00 0.00 61.98 59.12 3hwc s VAL 1017Cb -0.17 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.43 3hwc s VAL 1017CO 0.14 0.09 -0.05 0.26 -3.33 0.00 0.00 175.10 172.21 3hwc s TRP 1018N 0.32 3.00 -0.43 1.54 0.52 -0.10 -0.20 118.94 123.58 3hwc s TRP 1018Ca -0.03 -0.04 -0.06 0.00 0.02 0.00 0.00 56.10 56.00 3hwc s TRP 1018Cb -0.06 -1.79 0.11 0.00 -1.15 0.00 0.00 33.47 30.58 3hwc s TRP 1018CO -0.01 0.26 0.25 0.08 0.02 0.00 0.00 176.95 177.55 3hwc s VAL 1019N -0.52 3.67 0.00 4.03 1.01 0.71 0.10 120.40 129.40 3hwc s VAL 1019Ca 0.08 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.17 3hwc s VAL 1019Cb -0.12 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.82 3hwc s VAL 1019CO 0.02 -0.69 0.00 0.61 0.00 0.00 0.00 175.10 175.05 3hwc n GLY 1020N 4.73 3.67 0.19 4.51 0.00 -0.64 -2.13 105.19 115.52 3hwc n GLY 1020Ca -0.05 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.03 3hwc n GLY 1020CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3hwc h ASN 1021N 0.00 0.00 -3.21 1.61 2.35 -1.94 -3.46 115.58 110.93 3hwc h ASN 1021Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 3hwc h ASN 1021Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 3hwc h ASN 1021CO 0.00 0.09 0.60 -1.61 -1.65 0.00 0.00 177.43 174.86 3hwc s GLU 1022N -3.20 4.33 0.08 0.81 0.41 -0.91 -5.04 118.70 115.19 3hwc s GLU 1022Ca 0.05 1.27 -0.30 0.00 -0.41 0.00 0.00 54.97 55.58 3hwc s GLU 1022Cb 0.06 -3.59 -0.05 0.00 -1.78 0.00 0.00 34.13 28.77 3hwc s GLU 1022CO 0.71 -0.43 1.03 0.15 -0.49 0.00 0.00 175.26 176.22 3hwc s LYS 1023N 2.48 4.60 -0.27 1.61 1.02 -1.26 -0.21 119.74 127.71 3hwc s LYS 1023Ca 0.44 1.54 -0.13 0.00 0.02 0.00 0.00 55.97 57.84 3hwc s LYS 1023Cb -0.17 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 3hwc s LYS 1023CO 0.12 0.04 0.28 0.42 -0.92 0.00 0.00 175.35 175.29 3hwc s ILE 1024N 0.40 5.25 0.02 2.17 -1.09 0.72 -4.94 121.20 123.73 3hwc s ILE 1024Ca 0.51 0.37 -0.19 0.00 -2.23 0.00 0.00 60.65 59.11 3hwc s ILE 1024Cb -0.25 -3.61 -0.23 0.00 -1.58 0.00 0.00 42.46 36.80 3hwc s ILE 1024CO 0.30 0.22 1.13 -2.24 -1.23 0.00 0.00 174.94 173.11 3hwc h ASP 1025N 8.18 0.60 -2.71 3.58 -0.00 -1.92 -3.41 116.42 120.74 3hwc h ASP 1025Ca -0.34 -0.74 -0.39 0.00 -0.00 0.00 0.00 57.03 55.56 3hwc h ASP 1025Cb 1.18 -0.18 -0.38 0.00 -0.00 0.00 0.00 39.33 39.94 3hwc h ASP 1025CO 0.60 1.26 -0.68 0.21 -0.00 0.00 0.00 179.24 180.63 3hwc s ASN 1026N -6.82 1.91 0.48 4.15 2.47 -1.26 -4.81 114.94 111.05 3hwc s ASN 1026Ca -0.13 -0.48 0.21 0.00 0.42 0.00 0.00 52.86 52.89 3hwc s ASN 1026Cb 0.04 0.11 1.24 0.00 -1.45 0.00 0.00 41.25 41.19 3hwc s ASN 1026CO 0.84 -0.35 1.94 0.58 -3.72 0.00 0.00 177.10 176.39 3hwc h VAL 1027N 6.36 0.74 0.00 -5.21 2.07 -1.85 0.32 116.25 118.68 3hwc h VAL 1027Ca -0.16 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 3hwc h VAL 1027Cb 1.14 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3hwc h VAL 1027CO 0.30 0.04 -0.19 0.00 0.02 0.00 0.00 177.57 177.74 3hwc h ALA 1028N 1.67 1.00 0.00 1.67 0.00 -1.88 -3.20 119.26 118.53 3hwc h ALA 1028Ca 0.34 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3hwc h ALA 1028Cb 1.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3hwc h ALA 1028CO -0.06 0.24 -0.89 0.25 0.00 0.00 0.00 179.25 178.78 3hwc n THR 1029N -3.32 0.00 -1.86 0.00 -2.24 -0.49 -4.49 114.28 101.88 3hwc n THR 1029Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 3hwc n THR 1029Cb 0.43 0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 3hwc n THR 1029CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hwc s HIS 1030N -1.80 2.73 0.52 4.78 5.04 -0.02 -4.69 115.29 121.85 3hwc s HIS 1030Ca 0.00 1.11 0.22 0.00 -1.54 0.00 0.00 55.06 54.85 3hwc s HIS 1030Cb 0.00 -3.96 1.33 0.00 0.04 0.00 0.00 32.58 29.98 3hwc s HIS 1030CO 0.00 -2.92 2.02 -1.35 -2.34 0.00 0.00 174.74 170.14 3hwc h PRO 1031N 3.64 0.06 0.00 2.88 0.11 -1.94 0.42 132.00 137.16 3hwc h PRO 1031Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3hwc h PRO 1031Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hwc h PRO 1031CO 0.69 0.04 -0.01 1.28 -0.21 0.00 0.00 178.00 179.78 3hwc n LEU 1032N -4.42 0.39 0.00 2.35 4.77 -1.26 -4.42 117.00 114.41 3hwc n LEU 1032Ca 0.08 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 3hwc n LEU 1032Cb 0.50 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3hwc n LEU 1032CO 0.36 -0.08 -0.16 0.41 -1.33 0.00 0.00 177.39 176.58 3hwc n THR 1033N -1.86 0.00 0.04 -5.08 -1.04 -0.51 -4.86 114.28 100.97 3hwc n THR 1033Ca 0.06 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.22 3hwc n THR 1033Cb 0.38 -0.31 0.62 0.00 -1.82 0.00 0.00 70.33 69.21 3hwc n THR 1033CO 0.00 0.00 0.00 0.08 -0.64 0.00 0.00 175.07 174.51 3hwc h ARG 1034N 0.00 0.12 -0.12 -2.82 0.11 -0.20 -2.32 114.38 109.14 3hwc h ARG 1034Ca 0.00 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.04 3hwc h ARG 1034Cb 0.33 -0.03 -0.00 0.00 1.11 0.00 0.00 29.97 31.38 3hwc h ARG 1034CO 0.00 0.08 -0.05 -0.44 0.10 0.00 0.00 179.97 179.65 3hwc h ASP 1035N 0.12 0.25 -0.56 0.08 3.32 -1.85 -0.11 116.42 117.68 3hwc h ASP 1035Ca 0.20 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.78 3hwc h ASP 1035Cb 0.64 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 3hwc h ASP 1035CO -0.02 0.61 0.09 0.22 -1.72 0.00 0.00 179.24 178.42 3hwc h TYR 1036N -0.10 0.98 -0.66 4.55 5.03 -1.58 -2.22 116.97 122.97 3hwc h TYR 1036Ca 0.03 -0.13 0.08 0.00 2.58 0.00 0.00 58.73 61.28 3hwc h TYR 1036Cb 0.51 -0.27 -0.04 0.00 1.55 0.00 0.00 36.73 38.48 3hwc h TYR 1036CO 0.06 0.86 0.43 0.00 -1.32 0.00 0.00 178.16 178.20 3hwc h ALA 1037N 1.00 1.86 0.00 1.82 0.00 -1.30 0.18 119.26 122.81 3hwc h ALA 1037Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hwc h ALA 1037Cb 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hwc h ALA 1037CO 0.01 0.02 0.00 0.93 0.00 0.00 0.00 179.25 180.21 3hwc h GLU 1038N 0.58 0.00 -0.02 0.00 5.08 -0.61 -1.26 114.58 118.35 3hwc h GLU 1038Ca 0.29 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.41 3hwc h GLU 1038Cb 0.40 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.66 3hwc h GLU 1038CO -0.09 0.00 -0.98 0.00 -1.00 0.00 0.00 179.01 176.94 3hwc h ARG 1039N 0.00 0.61 -0.27 2.33 2.47 -0.09 0.11 114.38 119.54 3hwc h ARG 1039Ca 0.00 -0.64 -0.12 0.00 -1.26 0.00 0.00 59.98 57.96 3hwc h ARG 1039Cb 0.73 0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 29.22 3hwc h ARG 1039CO 0.00 1.24 -0.34 0.28 0.56 0.00 0.00 179.97 181.71 3hwc h VAL 1040N 0.36 1.29 -0.61 2.04 2.07 -1.06 -0.57 116.25 119.76 3hwc h VAL 1040Ca -0.10 -1.48 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 3hwc h VAL 1040Cb 1.62 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 32.81 3hwc h VAL 1040CO 0.19 0.47 0.25 0.00 0.02 0.00 0.00 177.57 178.50 3hwc h ALA 1041N 1.12 0.79 -0.93 1.67 0.00 -1.21 -2.67 119.26 118.03 3hwc h ALA 1041Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hwc h ALA 1041Cb 0.84 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 3hwc h ALA 1041CO 0.07 0.40 0.59 0.37 0.00 0.00 0.00 179.25 180.67 3hwc h GLN 1042N 0.85 1.25 -0.68 0.00 4.15 -0.35 -1.38 115.11 118.95 3hwc h GLN 1042Ca 0.20 -0.10 0.07 0.00 0.77 0.00 0.00 58.65 59.60 3hwc h GLN 1042Cb 0.19 -0.27 -0.06 0.00 0.21 0.00 0.00 27.48 27.54 3hwc h GLN 1042CO -0.02 0.86 0.36 0.35 -1.93 0.00 0.00 178.83 178.45 3hwc h PHE 1043N 1.28 0.66 -0.17 3.99 3.57 -0.80 -0.43 116.94 125.04 3hwc h PHE 1043Ca 0.34 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.76 3hwc h PHE 1043Cb -0.09 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.45 3hwc h PHE 1043CO 0.00 0.28 -0.32 1.88 -2.23 0.00 0.00 178.31 177.93 3hwc h TYR 1044N 0.65 0.64 -0.19 0.41 -1.99 -1.11 -3.21 116.97 112.17 3hwc h TYR 1044Ca 0.32 -0.23 -0.03 0.00 2.00 0.00 0.00 58.73 60.78 3hwc h TYR 1044Cb 0.26 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 3hwc h TYR 1044CO -0.09 0.95 -0.02 -0.44 -0.00 0.00 0.00 178.16 178.56 3hwc h ASP 1045N 0.15 0.26 -0.79 3.88 3.45 -1.04 -2.19 116.42 120.14 3hwc h ASP 1045Ca 0.01 -0.04 0.16 0.00 0.43 0.00 0.00 57.03 57.59 3hwc h ASP 1045Cb 0.91 -0.07 -0.05 0.00 -0.56 0.00 0.00 39.33 39.56 3hwc h ASP 1045CO 0.07 0.33 0.53 -0.07 -1.57 0.00 0.00 179.24 178.53 3hwc h LEU 1046N 0.28 0.38 -0.65 1.55 3.38 -1.07 -0.44 115.31 118.74 3hwc h LEU 1046Ca 0.06 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3hwc h LEU 1046Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3hwc h LEU 1046CO 0.01 0.19 0.00 0.45 0.09 0.00 0.00 178.44 179.17 3hwc h HIS 1047N 0.40 0.00 -0.01 1.13 3.86 -1.49 -2.87 115.15 116.17 3hwc h HIS 1047Ca 0.39 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.60 3hwc h HIS 1047Cb 0.94 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.41 3hwc h HIS 1047CO -0.00 0.00 -0.57 0.72 0.86 0.00 0.00 177.93 178.94 3hwc n HIS 1048N -2.38 0.00 -1.99 2.45 8.25 -0.18 -4.79 115.22 116.59 3hwc n HIS 1048Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.06 3hwc n HIS 1048Cb 0.29 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.32 3hwc n HIS 1048CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3hwc s ARG 1049N -2.67 4.20 0.43 -0.41 0.52 -1.09 -4.90 118.95 115.04 3hwc s ARG 1049Ca 0.16 2.24 0.10 0.00 -0.52 0.00 0.00 55.73 57.71 3hwc s ARG 1049Cb 0.18 -3.78 0.96 0.00 0.52 0.00 0.00 34.95 32.83 3hwc s ARG 1049CO 0.65 -0.77 2.06 -1.35 0.02 0.00 0.00 175.30 175.91 3hwc h PRO 1050N 8.87 0.42 0.00 3.54 0.11 -1.90 -1.12 132.00 141.93 3hwc h PRO 1050Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3hwc h PRO 1050Cb 1.19 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3hwc h PRO 1050CO 0.94 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.61 3hwc n ASP 1051N -4.48 0.00 -0.05 -2.05 3.85 -1.26 -3.12 116.55 109.44 3hwc n ASP 1051Ca 0.04 0.34 0.01 0.00 -0.71 0.00 0.00 54.79 54.46 3hwc n ASP 1051Cb 0.13 -0.44 0.01 0.00 -1.35 0.00 0.00 41.12 39.48 3hwc n ASP 1051CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3hwc n LEU 1052N -1.44 1.72 -0.29 -2.12 4.77 -0.44 -4.73 117.00 114.48 3hwc n LEU 1052Ca 0.07 -1.64 0.04 0.00 -0.03 0.00 0.00 56.01 54.45 3hwc n LEU 1052Cb 0.23 -0.01 0.18 0.00 -2.33 0.00 0.00 43.42 41.49 3hwc n LEU 1052CO 0.19 0.43 1.12 -0.61 -1.33 0.00 0.00 177.39 177.19 3hwc h GLN 1053N 0.19 0.71 0.33 3.23 4.15 -1.44 -0.58 115.11 121.70 3hwc h GLN 1053Ca 0.00 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 3hwc h GLN 1053Cb 0.35 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.88 3hwc h GLN 1053CO 0.00 0.47 -0.17 -0.44 -1.93 0.00 0.00 178.83 176.76 3hwc h ASP 1054N 0.73 -0.39 1.33 -0.69 5.19 -1.84 -1.44 116.42 119.31 3hwc h ASP 1054Ca 0.41 0.02 -0.13 0.00 -0.62 0.00 0.00 57.03 56.71 3hwc h ASP 1054Cb 0.45 0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.05 3hwc h ASP 1054CO -0.28 -0.28 -0.61 1.62 -3.12 0.00 0.00 179.24 176.57 3hwc h VAL 1055N -0.46 1.06 0.00 -1.35 3.04 -1.82 -3.35 116.25 113.37 3hwc h VAL 1055Ca -0.04 -2.44 0.00 0.00 -1.01 0.00 0.00 66.70 63.21 3hwc h VAL 1055Cb 0.35 2.48 0.00 0.00 -2.01 0.00 0.00 31.29 32.12 3hwc h VAL 1055CO 0.07 0.59 -1.84 0.18 -1.01 0.00 0.00 177.57 175.57 3hwc n LEU 1056N -3.28 0.06 -4.29 3.16 4.77 -0.26 -4.45 117.00 112.71 3hwc n LEU 1056Ca 0.01 -0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 3hwc n LEU 1056Cb 0.76 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.75 3hwc n LEU 1056CO 0.42 0.01 -0.43 0.42 -1.33 0.00 0.00 177.39 176.48 3hwc s THR 1057N -3.33 1.47 0.13 -5.08 -4.23 -0.54 0.13 115.64 104.19 3hwc s THR 1057Ca -0.06 -2.07 -0.10 0.00 -1.18 0.00 0.00 61.69 58.28 3hwc s THR 1057Cb 0.13 -1.89 -0.00 0.00 1.34 0.00 0.00 72.50 72.08 3hwc s THR 1057CO 0.82 -0.61 0.26 0.72 -0.54 0.00 0.00 174.62 175.27 3hwc s PHE 1058N -2.94 0.23 -0.28 3.99 -0.12 0.05 -4.66 117.98 114.25 3hwc s PHE 1058Ca 0.18 -0.61 -0.21 0.00 -0.05 0.00 0.00 56.93 56.23 3hwc s PHE 1058Cb -0.00 -0.02 -0.01 0.00 -0.63 0.00 0.00 43.02 42.36 3hwc s PHE 1058CO 0.04 -0.65 0.67 0.08 -0.05 0.00 0.00 175.22 175.31 3hwc s VAL 1059N -3.91 4.92 0.65 -2.49 1.01 -1.26 -0.43 120.40 118.90 3hwc s VAL 1059Ca 0.11 1.05 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 3hwc s VAL 1059Cb 0.04 -4.01 0.15 0.00 0.00 0.00 0.00 36.38 32.56 3hwc s VAL 1059CO -0.06 -0.10 0.77 -0.67 0.00 0.00 0.00 175.10 175.04 3hwc n ASP 1060N 5.89 -0.49 0.22 3.32 -0.08 -0.18 -4.88 116.55 120.35 3hwc n ASP 1060Ca 0.00 -1.17 0.08 0.00 -1.51 0.00 0.00 54.79 52.20 3hwc n ASP 1060Cb 0.49 -0.62 0.48 0.00 2.34 0.00 0.00 41.12 43.81 3hwc n ASP 1060CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hwc h ALA 1061N -2.06 1.14 -0.10 -1.67 0.00 -1.97 -2.31 119.26 112.29 3hwc h ALA 1061Ca -0.26 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3hwc h ALA 1061Cb 0.74 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3hwc h ALA 1061CO 0.18 0.33 0.00 -0.40 0.00 0.00 0.00 179.25 179.36 3hwc n ASP 1062N -3.61 1.44 0.00 0.00 5.75 -1.26 -4.89 116.55 113.98 3hwc n ASP 1062Ca -0.01 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 3hwc n ASP 1062Cb 0.39 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 3hwc n ASP 1062CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hwc n GLY 1063N 1.12 0.73 3.70 6.12 0.00 -0.87 -5.04 105.19 110.94 3hwc n GLY 1063Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3hwc n GLY 1063CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 1064N -2.40 5.16 0.09 1.61 1.01 -1.26 -4.70 120.40 119.92 3hwc s VAL 1064Ca 0.00 0.93 -0.31 0.00 0.00 0.00 0.00 61.98 62.60 3hwc s VAL 1064Cb 0.00 -3.81 -0.08 0.00 0.00 0.00 0.00 36.38 32.48 3hwc s VAL 1064CO 0.00 0.27 1.52 -0.60 0.00 0.00 0.00 175.10 176.29 3hwc s ARG 1065N 1.02 4.25 0.22 2.72 3.52 -1.26 -1.01 118.95 128.41 3hwc s ARG 1065Ca 0.25 2.21 -0.00 0.00 -0.13 0.00 0.00 55.73 58.05 3hwc s ARG 1065Cb -0.15 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.81 3hwc s ARG 1065CO 0.10 -0.59 0.12 1.03 -0.81 0.00 0.00 175.30 175.14 3hwc s ARG 1066N 1.80 1.26 0.40 5.12 0.52 0.43 -4.48 118.95 124.00 3hwc s ARG 1066Ca 0.69 -1.67 -0.26 0.00 -0.52 0.00 0.00 55.73 53.97 3hwc s ARG 1066Cb -0.39 0.11 -0.09 0.00 0.52 0.00 0.00 34.95 35.10 3hwc s ARG 1066CO 0.30 -0.36 1.35 0.45 0.02 0.00 0.00 175.30 177.07 3hwc s SER 1067N -3.20 6.29 0.00 0.23 0.15 -1.26 -0.77 113.70 115.13 3hwc s SER 1067Ca 0.38 2.77 0.09 0.00 0.70 0.00 0.00 55.95 59.89 3hwc s SER 1067Cb 0.07 -2.65 0.52 0.00 -1.71 0.00 0.00 66.02 62.26 3hwc s SER 1067CO 0.12 -0.88 0.94 0.54 1.20 0.00 0.00 173.24 175.17 3hwc n ARG 1068N 0.20 0.33 0.26 5.44 1.74 0.12 -1.86 116.66 122.89 3hwc n ARG 1068Ca 0.03 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.27 3hwc n ARG 1068Cb 0.42 -1.42 0.57 0.00 -1.02 0.00 0.00 32.46 31.02 3hwc n ARG 1068CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 3hwc h GLN 1069N 0.00 0.00 -0.02 5.56 3.07 -1.90 -2.82 115.11 119.01 3hwc h GLN 1069Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hwc h GLN 1069Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 3hwc h GLN 1069CO 0.00 0.01 -0.12 0.91 0.09 0.00 0.00 178.83 179.72 3hwc n TRP 1070N -3.10 0.00 -3.07 0.06 7.02 -0.78 -4.74 117.44 112.84 3hwc n TRP 1070Ca 0.01 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.13 3hwc n TRP 1070Cb 0.36 -0.02 -0.06 0.00 -2.42 0.00 0.00 31.31 29.17 3hwc n TRP 1070CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 3hwc s GLN 1071N -2.15 4.29 -0.20 -0.99 0.74 -1.06 -5.06 119.66 115.21 3hwc s GLN 1071Ca 0.29 0.92 -0.08 0.00 0.05 0.00 0.00 55.36 56.54 3hwc s GLN 1071Cb 0.20 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.40 3hwc s GLN 1071CO 0.39 0.38 0.08 -0.51 -0.55 0.00 0.00 175.29 175.08 3hwc s ASP 1072N -1.65 5.65 0.04 6.67 -0.00 -1.26 -5.07 116.67 121.05 3hwc s ASP 1072Ca 0.44 0.05 -0.30 0.00 -0.00 0.00 0.00 52.55 52.74 3hwc s ASP 1072Cb -0.17 -1.98 -0.04 0.00 -0.00 0.00 0.00 42.92 40.73 3hwc s ASP 1072CO 0.21 0.13 1.03 -2.84 -0.00 0.00 0.00 175.17 173.71 3hwc s PRO 1073N 0.62 4.55 0.00 8.23 0.02 -1.26 -4.94 135.00 142.22 3hwc s PRO 1073Ca 0.04 1.51 0.10 0.00 0.02 0.00 0.00 61.00 62.68 3hwc s PRO 1073Cb -0.13 -3.42 -0.09 0.00 0.02 0.00 0.00 34.50 30.89 3hwc s PRO 1073CO 0.01 -0.06 0.49 1.63 -0.33 0.00 0.00 177.00 178.75 3hwc n LYS 1074N 3.69 3.24 -2.08 5.54 4.76 -1.26 -0.27 118.16 131.78 3hwc n LYS 1074Ca 0.06 -0.14 -0.04 0.00 -2.87 0.00 0.00 58.31 55.33 3hwc n LYS 1074Cb 0.50 -1.02 0.01 0.00 -1.84 0.00 0.00 35.03 32.68 3hwc n LYS 1074CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3hwc n ASP 1075N -1.03 -0.80 -0.17 4.39 3.85 -1.26 -4.54 116.55 116.99 3hwc n ASP 1075Ca 0.03 -1.60 -0.07 0.00 -0.71 0.00 0.00 54.79 52.43 3hwc n ASP 1075Cb 0.18 1.35 0.07 0.00 -1.35 0.00 0.00 41.12 41.37 3hwc n ASP 1075CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3hwc h ALA 1076N 1.95 0.92 -0.71 2.12 0.00 -1.94 -0.63 119.26 120.98 3hwc h ALA 1076Ca -0.12 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 3hwc h ALA 1076Cb 0.45 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3hwc h ALA 1076CO 0.15 0.64 0.19 0.00 0.00 0.00 0.00 179.25 180.23 3hwc h ALA 1077N 1.08 0.93 -0.77 0.00 0.00 -1.97 -1.94 119.26 116.59 3hwc h ALA 1077Ca 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3hwc h ALA 1077Cb 0.55 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3hwc h ALA 1077CO 0.03 0.64 0.31 0.78 0.00 0.00 0.00 179.25 181.02 3hwc h GLY 1078N 1.06 1.23 1.42 0.00 0.00 -1.82 -2.37 103.07 102.60 3hwc h GLY 1078Ca 0.22 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 3hwc h GLY 1078CO -0.00 0.62 0.12 -2.00 0.00 0.00 0.00 176.54 175.28 3hwc h LEU 1079N 1.12 0.67 -0.98 3.11 5.85 -0.77 -1.96 115.31 122.36 3hwc h LEU 1079Ca 0.26 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.78 3hwc h LEU 1079Cb 0.20 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3hwc h LEU 1079CO -0.02 0.67 -0.27 0.03 -0.34 0.00 0.00 178.44 178.51 3hwc h ARG 1080N 0.71 0.42 -0.54 1.25 3.08 -0.90 0.46 114.38 118.86 3hwc h ARG 1080Ca 0.16 -0.16 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3hwc h ARG 1080Cb 0.26 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 3hwc h ARG 1080CO -0.00 0.66 0.11 0.28 -1.07 0.00 0.00 179.97 179.95 3hwc h VAL 1081N 0.37 1.25 -0.58 2.04 2.07 -0.94 -0.47 116.25 119.99 3hwc h VAL 1081Ca 0.05 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.63 3hwc h VAL 1081Cb 0.66 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3hwc h VAL 1081CO 0.05 0.33 0.24 0.50 0.02 0.00 0.00 177.57 178.71 3hwc h LYS 1082N 0.77 0.87 -0.69 1.57 3.64 -0.99 -1.52 116.57 120.22 3hwc h LYS 1082Ca 0.17 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3hwc h LYS 1082Cb 0.37 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 3hwc h LYS 1082CO 0.01 0.74 0.42 -0.09 -2.27 0.00 0.00 179.45 178.26 3hwc h ARG 1083N 0.81 0.93 -0.19 1.90 2.43 -0.70 -1.51 114.38 118.06 3hwc h ARG 1083Ca 0.20 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 3hwc h ARG 1083Cb 0.19 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3hwc h ARG 1083CO -0.02 0.66 -0.09 -0.22 -1.51 0.00 0.00 179.97 178.79 3hwc h LYS 1084N 0.94 0.29 0.68 0.20 3.64 -0.87 -0.64 116.57 120.81 3hwc h LYS 1084Ca 0.25 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 3hwc h LYS 1084Cb -0.04 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3hwc h LYS 1084CO -0.05 0.39 -0.33 -0.92 -2.27 0.00 0.00 179.45 176.28 3hwc h TYR 1085N 0.28 -0.85 -0.66 1.91 3.20 -0.59 -2.23 116.97 118.02 3hwc h TYR 1085Ca 0.06 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.95 3hwc h TYR 1085Cb 0.33 0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.84 3hwc h TYR 1085CO 0.01 -0.50 0.39 0.45 -1.64 0.00 0.00 178.16 176.87 3hwc h HIS 1086N -1.01 0.73 -0.37 -3.82 3.86 -0.95 -2.25 115.15 111.34 3hwc h HIS 1086Ca -0.09 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.07 3hwc h HIS 1086Cb 0.73 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 3hwc h HIS 1086CO -0.01 0.39 -0.06 0.93 0.86 0.00 0.00 177.93 180.03 3hwc h GLU 1087N 0.75 0.61 -0.68 2.45 5.08 -1.17 -1.17 114.58 120.44 3hwc h GLU 1087Ca 0.28 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3hwc h GLU 1087Cb 0.10 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3hwc h GLU 1087CO -0.14 0.68 0.37 1.15 -1.00 0.00 0.00 179.01 180.07 3hwc h THR 1088N 0.57 1.21 0.17 1.13 2.02 -0.82 0.73 112.91 117.92 3hwc h THR 1088Ca 0.11 -0.54 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 3hwc h THR 1088Cb 0.46 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3hwc h THR 1088CO 0.02 0.24 -0.08 0.40 0.37 0.00 0.00 175.52 176.47 3hwc h ILE 1089N 0.93 0.85 -0.74 3.11 1.08 -1.04 -2.67 117.51 119.04 3hwc h ILE 1089Ca 0.24 -0.07 -0.02 0.00 -0.39 0.00 0.00 64.86 64.62 3hwc h ILE 1089Cb 0.05 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 3hwc h ILE 1089CO -0.04 0.02 0.39 -0.07 -0.69 0.00 0.00 178.15 177.76 3hwc h LEU 1090N -0.26 0.94 -1.15 1.44 3.38 -0.93 -2.10 115.31 116.62 3hwc h LEU 1090Ca -0.02 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3hwc h LEU 1090Cb 0.20 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3hwc h LEU 1090CO 0.04 0.78 0.00 0.03 0.09 0.00 0.00 178.44 179.38 3hwc h ARG 1091N 1.03 0.00 0.00 1.13 3.08 -0.83 -0.01 114.38 118.77 3hwc h ARG 1091Ca 0.26 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.18 3hwc h ARG 1091Cb 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3hwc h ARG 1091CO -0.04 0.00 -1.35 0.39 -1.07 0.00 0.00 179.97 177.90 3hwc n GLU 1092N -2.90 0.62 -3.96 0.04 -0.58 -0.85 -4.64 120.64 108.37 3hwc n GLU 1092Ca 0.01 0.19 -0.33 0.00 -0.42 0.00 0.00 57.16 56.62 3hwc n GLU 1092Cb 0.31 -1.80 -0.14 0.00 -0.57 0.00 0.00 31.44 29.24 3hwc n GLU 1092CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3hwc s ILE 1093N -3.02 2.58 -1.40 -3.67 1.01 -0.86 -4.81 121.20 111.04 3hwc s ILE 1093Ca -0.03 -2.07 -0.07 0.00 0.00 0.00 0.00 60.65 58.48 3hwc s ILE 1093Cb 0.09 -2.76 0.04 0.00 0.01 0.00 0.00 42.46 39.83 3hwc s ILE 1093CO 0.81 -0.48 0.93 0.00 0.00 0.00 0.00 174.94 176.20 3hwc n ALA 1094N 4.40 -1.59 -3.18 9.38 0.00 -1.26 -2.46 120.51 125.79 3hwc n ALA 1094Ca -0.02 0.09 -0.23 0.00 0.00 0.00 0.00 53.44 53.28 3hwc n ALA 1094Cb 0.42 -3.66 0.03 0.00 0.00 0.00 0.00 19.45 16.24 3hwc n ALA 1094CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hwc n ALA 1095N -4.56 -1.03 -3.25 0.00 0.00 -1.26 -2.06 120.51 108.34 3hwc n ALA 1095Ca -0.10 0.25 -0.22 0.00 0.00 0.00 0.00 53.44 53.36 3hwc n ALA 1095Cb 0.59 -3.79 0.05 0.00 0.00 0.00 0.00 19.45 16.31 3hwc n ALA 1095CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hwc n GLY 1096N -1.49 -0.48 0.13 0.00 0.00 -0.03 -4.90 105.19 98.42 3hwc n GLY 1096Ca -0.08 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.20 3hwc n GLY 1096CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hwc h SER 1097N -1.93 0.00 -3.26 1.61 0.02 -1.54 -3.46 113.55 104.99 3hwc h SER 1097Ca -0.53 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 59.83 3hwc h SER 1097Cb 1.35 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.81 3hwc h SER 1097CO 0.54 0.05 -0.24 -0.31 -1.14 0.00 0.00 176.83 175.73 3hwc s TYR 1098N -3.30 3.51 -1.61 3.45 2.02 -1.26 -4.98 117.35 115.19 3hwc s TYR 1098Ca 0.01 0.75 0.15 0.00 -0.37 0.00 0.00 57.07 57.61 3hwc s TYR 1098Cb 0.09 -2.41 0.05 0.00 -0.40 0.00 0.00 41.96 39.29 3hwc s TYR 1098CO 0.77 0.27 0.89 0.41 -1.57 0.00 0.00 175.55 176.32 3hwc n GLY 1099N 3.13 0.02 1.79 0.71 0.00 -1.26 -4.59 105.19 104.99 3hwc n GLY 1099Ca -0.10 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.49 3hwc n GLY 1099CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hwc n ARG 1100N 0.26 0.91 -1.04 1.61 5.12 -1.26 -4.86 116.66 117.41 3hwc n ARG 1100Ca 0.07 -2.72 -0.33 0.00 -1.93 0.00 0.00 57.85 52.95 3hwc n ARG 1100Cb 0.35 -0.79 0.13 0.00 -1.16 0.00 0.00 32.46 30.99 3hwc n ARG 1100CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3hwc s LEU 1101N -1.69 3.07 0.39 0.55 1.43 -1.26 -4.80 118.68 116.37 3hwc s LEU 1101Ca 0.34 2.30 0.17 0.00 -1.03 0.00 0.00 54.13 55.91 3hwc s LEU 1101Cb 0.37 -4.58 1.08 0.00 0.03 0.00 0.00 46.19 43.09 3hwc s LEU 1101CO -0.11 -2.73 1.76 -0.65 0.23 0.00 0.00 176.35 174.85 3hwc h PRO 1102N -1.12 0.40 0.00 1.29 0.11 -1.97 0.26 132.00 130.96 3hwc h PRO 1102Ca -0.45 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3hwc h PRO 1102Cb 1.29 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hwc h PRO 1102CO 0.45 0.27 -0.14 0.38 -0.21 0.00 0.00 178.00 178.75 3hwc h ASP 1103N 0.42 0.00 -0.07 -2.05 2.03 -1.97 -1.66 116.42 113.12 3hwc h ASP 1103Ca 0.61 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.89 3hwc h ASP 1103Cb 1.49 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.98 3hwc h ASP 1103CO -0.32 0.14 -0.01 0.00 -1.03 0.00 0.00 179.24 178.02 3hwc h ALA 1104N 1.86 0.09 0.00 4.15 0.00 -0.80 -3.37 119.26 121.19 3hwc h ALA 1104Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3hwc h ALA 1104Cb 0.39 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 3hwc h ALA 1104CO 0.02 -0.21 -1.87 -2.39 0.00 0.00 0.00 179.25 174.80 3hwc n HIS 1105N -4.83 0.00 -0.32 0.00 1.44 -1.21 -4.44 115.22 105.85 3hwc n HIS 1105Ca -0.07 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.63 3hwc n HIS 1105Cb 0.21 -0.46 0.15 0.00 0.12 0.00 0.00 29.99 30.02 3hwc n HIS 1105CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 3hwc h ASN 1106N 0.00 1.06 0.53 4.39 2.35 -1.46 -2.67 115.58 119.78 3hwc h ASN 1106Ca -0.04 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3hwc h ASN 1106Cb 0.94 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 39.04 3hwc h ASN 1106CO 0.00 0.78 0.00 0.00 -1.65 0.00 0.00 177.43 176.56 3hwc n TYR 1107N -4.39 0.36 0.31 1.19 9.36 -1.26 -2.57 117.16 120.17 3hwc n TYR 1107Ca 0.11 0.15 0.16 0.00 3.32 0.00 0.00 57.90 61.63 3hwc n TYR 1107Cb 0.02 -0.74 0.70 0.00 -0.63 0.00 0.00 39.34 38.70 3hwc n TYR 1107CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 3hwc h THR 1108N 0.00 0.00 0.00 2.97 1.35 -1.75 -2.33 112.91 113.15 3hwc h THR 1108Ca 0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 3hwc h THR 1108Cb 0.27 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 3hwc h THR 1108CO 0.00 0.00 0.00 -0.26 -0.25 0.00 0.00 175.52 175.01 3hwc h PHE 1109N 0.00 0.00 0.00 4.73 0.04 -1.70 -2.45 116.94 117.56 3hwc h PHE 1109Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hwc h PHE 1109Cb 0.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 3hwc h PHE 1109CO 0.00 0.00 0.00 1.79 -0.60 0.00 0.00 178.31 179.50 3hwc h THR 1110N 0.00 0.00 -0.20 -1.55 1.35 -1.66 -1.77 112.91 109.07 3hwc h THR 1110Ca 0.00 -0.20 0.05 0.00 -0.55 0.00 0.00 66.41 65.70 3hwc h THR 1110Cb 0.36 1.16 -0.05 0.00 -1.73 0.00 0.00 68.15 67.90 3hwc h THR 1110CO 0.00 0.00 -0.09 0.74 -0.25 0.00 0.00 175.52 175.92 3hwc h THR 1111N 0.00 0.71 -0.67 6.82 2.02 -1.66 0.50 112.91 120.64 3hwc h THR 1111Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 3hwc h THR 1111Cb 0.21 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 3hwc h THR 1111CO 0.00 0.00 0.39 1.88 0.37 0.00 0.00 175.52 178.16 3hwc h TYR 1112N -0.06 0.71 -0.17 3.16 -1.99 -1.53 -2.54 116.97 114.55 3hwc h TYR 1112Ca 0.11 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.84 3hwc h TYR 1112Cb 0.22 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 3hwc h TYR 1112CO -0.25 0.36 0.01 0.00 -0.00 0.00 0.00 178.16 178.28 3hwc h ALA 1113N 1.33 1.70 -0.43 3.88 0.00 -1.16 -1.79 119.26 122.78 3hwc h ALA 1113Ca 0.29 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hwc h ALA 1113Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3hwc h ALA 1113CO -0.16 0.23 0.26 -0.44 0.00 0.00 0.00 179.25 179.15 3hwc h ASP 1114N 0.24 0.51 -0.93 0.00 3.45 -0.49 -3.39 116.42 115.80 3hwc h ASP 1114Ca 0.06 -0.02 -0.09 0.00 0.43 0.00 0.00 57.03 57.41 3hwc h ASP 1114Cb 0.16 -0.13 -0.17 0.00 -0.56 0.00 0.00 39.33 38.63 3hwc h ASP 1114CO 0.00 0.39 -0.44 -0.62 -1.57 0.00 0.00 179.24 177.00 3hwc s ASP 1115N -6.66 -1.39 0.10 6.45 3.68 -0.85 -3.69 116.67 114.31 3hwc s ASP 1115Ca -0.08 -1.18 -0.15 0.00 2.13 0.00 0.00 52.55 53.26 3hwc s ASP 1115Cb 0.17 1.80 -0.08 0.00 -1.45 0.00 0.00 42.92 43.35 3hwc s ASP 1115CO 0.74 -0.10 1.42 -0.65 0.13 0.00 0.00 175.17 176.71 3hwc h PRO 1116N 5.86 0.70 -0.82 4.34 0.11 -1.55 -3.32 132.00 137.31 3hwc h PRO 1116Ca 0.05 -0.36 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 3hwc h PRO 1116Cb 1.15 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 3hwc h PRO 1116CO 0.04 0.97 0.47 0.93 -0.21 0.00 0.00 178.00 180.20 3hwc h GLU 1117N 0.44 1.14 -0.20 1.05 3.07 -1.93 -2.98 114.58 115.17 3hwc h GLU 1117Ca 0.05 -0.12 0.06 0.00 -0.50 0.00 0.00 59.36 58.85 3hwc h GLU 1117Cb 0.84 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 3hwc h GLU 1117CO 0.07 0.82 0.18 -0.24 -1.40 0.00 0.00 179.01 178.44 3hwc h VAL 1118N 1.15 0.60 0.00 3.13 3.04 -1.97 -0.31 116.25 121.89 3hwc h VAL 1118Ca 0.29 0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.88 3hwc h VAL 1118Cb 0.00 0.86 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 3hwc h VAL 1118CO -0.05 0.00 -0.50 -0.50 -1.01 0.00 0.00 177.57 175.51 3hwc h TRP 1119N 0.00 0.00 0.00 3.17 4.06 -1.74 -2.52 115.95 118.93 3hwc h TRP 1119Ca 0.09 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.91 3hwc h TRP 1119Cb 0.46 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.60 3hwc h TRP 1119CO 0.00 0.50 -0.77 1.49 -3.56 0.00 0.00 178.44 176.10 3hwc h GLU 1120N 0.00 0.00 -0.26 0.49 4.81 -1.25 -3.31 114.58 115.07 3hwc h GLU 1120Ca -0.00 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 3hwc h GLU 1120Cb 1.03 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 3hwc h GLU 1120CO 0.06 0.93 0.27 0.87 -0.73 0.00 0.00 179.01 180.42 3hwc h LYS 1121N -1.00 0.00 -0.02 1.92 6.56 -1.38 -0.03 116.57 122.62 3hwc h LYS 1121Ca -0.21 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.38 3hwc h LYS 1121Cb 1.13 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.79 3hwc h LYS 1121CO -0.13 0.00 -0.18 1.04 -2.06 0.00 0.00 179.45 178.13 3hwc n GLN 1122N -3.83 1.72 -2.20 3.15 1.13 -0.95 -4.95 117.38 111.45 3hwc n GLN 1122Ca 0.03 -1.35 -0.35 0.00 -1.94 0.00 0.00 57.00 53.40 3hwc n GLN 1122Cb 0.41 -1.47 0.01 0.00 0.11 0.00 0.00 30.24 29.30 3hwc n GLN 1122CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 3hwc s SER 1123N -2.20 5.63 -0.05 1.08 0.01 -0.03 -4.43 113.70 113.72 3hwc s SER 1123Ca 0.26 2.19 0.02 0.00 1.31 0.00 0.00 55.95 59.73 3hwc s SER 1123Cb 0.19 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.86 3hwc s SER 1123CO 0.41 -1.28 -0.09 -0.63 0.41 0.00 0.00 173.24 172.06 3hwc s ILE 1124N -1.78 0.87 0.00 1.44 1.01 0.91 -4.72 121.20 118.92 3hwc s ILE 1124Ca 0.73 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.03 3hwc s ILE 1124Cb -0.24 -0.80 0.00 0.00 0.01 0.00 0.00 42.46 41.42 3hwc s ILE 1124CO 0.28 0.29 0.00 0.61 0.00 0.00 0.00 174.94 176.12 3hwc n GLY 1125N 3.69 0.75 0.16 6.18 0.00 -1.26 -3.90 105.19 110.80 3hwc n GLY 1125Ca -0.22 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.87 3hwc n GLY 1125CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwc n ALA 1126N -0.47 2.19 -1.63 4.61 0.00 -1.26 -5.07 120.51 118.88 3hwc n ALA 1126Ca 0.00 -2.22 -0.54 0.00 0.00 0.00 0.00 53.44 50.68 3hwc n ALA 1126Cb 0.00 -0.40 -0.06 0.00 0.00 0.00 0.00 19.45 18.99 3hwc n ALA 1126CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hwc n GLU 1127N -1.09 1.16 0.00 0.00 4.71 -1.26 -1.21 120.64 122.94 3hwc n GLU 1127Ca 0.12 0.42 0.00 0.00 -0.01 0.00 0.00 57.16 57.69 3hwc n GLU 1127Cb 0.65 -2.08 0.00 0.00 -1.01 0.00 0.00 31.44 29.00 3hwc n GLU 1127CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3hwc n GLY 1128N 3.05 0.81 3.83 0.62 0.00 -1.26 -5.06 105.19 107.18 3hwc n GLY 1128Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 3hwc n GLY 1128CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hwc s ARG 1129N -0.90 4.11 -0.54 1.61 1.81 -0.35 -5.04 118.95 119.64 3hwc s ARG 1129Ca 0.00 0.65 -0.17 0.00 -1.72 0.00 0.00 55.73 54.49 3hwc s ARG 1129Cb 0.00 -3.00 0.10 0.00 -0.45 0.00 0.00 34.95 31.60 3hwc s ARG 1129CO 0.00 0.50 0.58 1.21 -0.68 0.00 0.00 175.30 176.91 3hwc s ASN 1130N -1.54 6.19 -0.11 0.23 2.47 -1.26 -4.88 114.94 116.03 3hwc s ASN 1130Ca 0.37 -1.47 0.12 0.00 0.42 0.00 0.00 52.86 52.30 3hwc s ASN 1130Cb -0.17 -2.25 -0.24 0.00 -1.45 0.00 0.00 41.25 37.15 3hwc s ASN 1130CO 0.20 -0.92 0.40 0.18 -3.72 0.00 0.00 177.10 173.23 3hwc n LEU 1131N 5.77 0.85 -0.20 3.21 4.32 -1.26 -4.37 117.00 125.31 3hwc n LEU 1131Ca -0.11 0.23 0.01 0.00 -0.02 0.00 0.00 56.01 56.12 3hwc n LEU 1131Cb 0.42 0.11 0.11 0.00 -1.62 0.00 0.00 43.42 42.44 3hwc n LEU 1131CO 0.55 0.49 0.91 0.74 -1.22 0.00 0.00 177.39 178.86 3hwc h THR 1132N 0.01 0.63 -0.09 -5.08 2.02 -1.89 0.12 112.91 108.63 3hwc h THR 1132Ca -0.40 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 66.72 3hwc h THR 1132Cb 2.09 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.86 3hwc h THR 1132CO 0.05 0.05 0.08 0.06 0.37 0.00 0.00 175.52 176.13 3hwc h GLN 1133N 0.25 0.00 -0.47 6.66 3.07 -1.96 -1.90 115.11 120.75 3hwc h GLN 1133Ca 0.31 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.92 3hwc h GLN 1133Cb 0.47 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.02 3hwc h GLN 1133CO -0.41 0.00 -0.23 -0.91 0.09 0.00 0.00 178.83 177.37 3hwc h ASN 1134N 0.00 1.02 -0.00 0.06 2.35 -0.97 -0.89 115.58 117.15 3hwc h ASN 1134Ca 0.04 -0.40 0.02 0.00 -0.55 0.00 0.00 56.30 55.41 3hwc h ASN 1134Cb 0.20 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 3hwc h ASN 1134CO -0.00 1.19 -0.10 0.40 -1.65 0.00 0.00 177.43 177.27 3hwc h ILE 1135N 0.83 0.74 -0.77 2.81 2.04 -1.14 0.28 117.51 122.31 3hwc h ILE 1135Ca 0.10 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 3hwc h ILE 1135Cb 0.82 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 3hwc h ILE 1135CO 0.07 0.00 0.38 0.45 0.00 0.00 0.00 178.15 179.05 3hwc h HIS 1136N -0.18 1.08 0.59 1.37 3.86 -1.45 0.21 115.15 120.63 3hwc h HIS 1136Ca 0.04 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 3hwc h HIS 1136Cb 0.23 -0.34 0.01 0.00 1.06 0.00 0.00 27.41 28.36 3hwc h HIS 1136CO -0.17 0.77 -0.28 -0.91 0.86 0.00 0.00 177.93 178.20 3hwc h ASN 1137N 1.08 -0.67 -0.51 2.45 2.35 -0.73 -1.67 115.58 117.88 3hwc h ASN 1137Ca 0.27 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.94 3hwc h ASN 1137Cb 0.08 0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 3hwc h ASN 1137CO -0.04 -0.41 0.08 0.15 -1.65 0.00 0.00 177.43 175.56 3hwc h PHE 1138N -0.90 0.95 -0.48 1.19 3.57 -0.87 -1.12 116.94 119.28 3hwc h PHE 1138Ca -0.08 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.35 3hwc h PHE 1138Cb 0.64 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 3hwc h PHE 1138CO -0.02 0.82 0.22 -0.07 -2.23 0.00 0.00 178.31 177.03 3hwc h LEU 1139N 0.85 0.28 -0.38 0.59 -0.00 -0.92 0.69 115.31 116.42 3hwc h LEU 1139Ca 0.17 0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 58.07 3hwc h LEU 1139Cb 0.40 -0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 41.03 3hwc h LEU 1139CO 0.01 0.20 0.16 0.50 -0.00 0.00 0.00 178.44 179.31 3hwc h LYS 1140N 0.43 0.57 -0.01 1.13 3.64 -0.95 -2.44 116.57 118.93 3hwc h LYS 1140Ca 0.22 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 3hwc h LYS 1140Cb 0.17 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 3hwc h LYS 1140CO -0.18 0.54 -0.05 1.25 -2.27 0.00 0.00 179.45 178.74 3hwc h LEU 1141N 0.47 -0.14 -0.46 5.20 5.85 -0.49 -0.65 115.31 125.10 3hwc h LEU 1141Ca 0.13 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.96 3hwc h LEU 1141Cb 0.18 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 41.17 3hwc h LEU 1141CO -0.01 -0.07 -0.25 0.25 -0.34 0.00 0.00 178.44 178.01 3hwc h LEU 1142N -0.08 -0.86 -0.01 2.25 6.46 0.46 -1.53 115.31 121.98 3hwc h LEU 1142Ca 0.02 0.18 -0.23 0.00 -0.12 0.00 0.00 57.88 57.74 3hwc h LEU 1142Cb 0.11 0.44 0.02 0.00 -0.73 0.00 0.00 40.66 40.51 3hwc h LEU 1142CO -0.06 -0.27 -0.88 -0.09 -0.62 0.00 0.00 178.44 176.52 3hwc h ARG 1143N -0.16 0.62 0.26 1.25 2.43 -1.24 -0.36 114.38 117.19 3hwc h ARG 1143Ca 0.21 -0.65 -0.34 0.00 -0.81 0.00 0.00 59.98 58.39 3hwc h ARG 1143Cb 0.49 0.18 0.04 0.00 -0.42 0.00 0.00 29.97 30.26 3hwc h ARG 1143CO -0.55 1.25 -1.49 0.93 -1.51 0.00 0.00 179.97 178.59 3hwc h GLU 1144N 0.25 0.54 -0.00 0.20 5.08 -1.05 -3.11 114.58 116.49 3hwc h GLU 1144Ca -0.11 -0.93 0.00 0.00 -1.00 0.00 0.00 59.36 57.32 3hwc h GLU 1144Cb 1.55 0.35 0.00 0.00 0.50 0.00 0.00 28.75 31.14 3hwc h GLU 1144CO 0.17 1.45 -0.08 1.63 -1.00 0.00 0.00 179.01 181.18 3hwc n LYS 1145N -3.72 0.41 -3.51 2.33 4.76 -0.58 -4.88 118.16 112.97 3hwc n LYS 1145Ca -0.17 -0.08 -0.19 0.00 -2.87 0.00 0.00 58.31 55.00 3hwc n LYS 1145Cb 1.11 -1.50 0.08 0.00 -1.84 0.00 0.00 35.03 32.88 3hwc n LYS 1145CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3hwc n ASP 1146N -1.22 -2.36 -4.85 4.39 2.03 -0.72 -4.82 116.55 109.00 3hwc n ASP 1146Ca 0.12 -0.65 -0.31 0.00 0.52 0.00 0.00 54.79 54.47 3hwc n ASP 1146Cb 0.28 -4.90 0.04 0.00 -0.72 0.00 0.00 41.12 35.82 3hwc n ASP 1146CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hwc s LEU 1147N -6.53 3.06 -0.24 -2.67 1.43 -0.22 -4.81 118.68 108.70 3hwc s LEU 1147Ca 0.07 1.41 -0.02 0.00 -1.03 0.00 0.00 54.13 54.56 3hwc s LEU 1147Cb -0.03 -4.31 0.02 0.00 0.03 0.00 0.00 46.19 41.90 3hwc s LEU 1147CO 0.75 -1.27 -0.07 0.21 0.23 0.00 0.00 176.35 176.21 3hwc s ASN 1148N -4.06 4.22 -0.50 2.29 2.47 -1.26 -4.94 114.94 113.15 3hwc s ASN 1148Ca 0.57 -0.72 0.03 0.00 0.42 0.00 0.00 52.86 53.16 3hwc s ASN 1148Cb -0.12 -1.67 0.15 0.00 -1.45 0.00 0.00 41.25 38.15 3hwc s ASN 1148CO 0.54 -0.09 0.32 0.00 -3.72 0.00 0.00 177.10 174.15 3hwc n PRO 1150N 3.01 0.53 -2.91 0.00 -0.02 -1.21 -4.50 135.00 129.90 3hwc n PRO 1150Ca 0.15 0.25 -0.35 0.00 -2.02 0.00 0.00 63.50 61.53 3hwc n PRO 1150Cb 0.37 -2.48 -0.07 0.00 -0.02 0.00 0.00 33.50 31.30 3hwc n PRO 1150CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hwc s LEU 1151N -5.20 4.16 -0.41 2.45 1.43 -1.26 0.04 118.68 119.88 3hwc s LEU 1151Ca 0.77 1.62 0.07 0.00 -1.03 0.00 0.00 54.13 55.56 3hwc s LEU 1151Cb -0.32 -4.13 0.23 0.00 0.03 0.00 0.00 46.19 42.00 3hwc s LEU 1151CO 0.47 -0.17 0.56 -3.20 0.23 0.00 0.00 176.35 174.24 3hwc n ASN 1152N 0.03 -0.57 -0.04 2.29 2.85 -0.05 -4.37 115.26 115.40 3hwc n ASN 1152Ca 0.03 -2.76 -0.03 0.00 -0.11 0.00 0.00 54.58 51.72 3hwc n ASN 1152Cb 0.52 -0.13 -0.08 0.00 1.24 0.00 0.00 39.78 41.33 3hwc n ASN 1152CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 3hwc n PHE 1153N 1.71 0.00 -2.30 1.20 3.01 -1.26 -2.88 117.46 116.94 3hwc n PHE 1153Ca 0.20 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.24 3hwc n PHE 1153Cb 0.54 -0.46 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 3hwc n PHE 1153CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hwc s VAL 1154N -2.37 3.62 0.26 -4.37 1.01 -1.26 -4.22 120.40 113.07 3hwc s VAL 1154Ca -0.05 1.20 0.06 0.00 0.00 0.00 0.00 61.98 63.19 3hwc s VAL 1154Cb 0.04 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 3hwc s VAL 1154CO 0.44 0.11 0.29 -1.81 0.00 0.00 0.00 175.10 174.13 3hwc s ASP 1155N 0.90 5.86 0.35 3.32 1.01 -1.26 -0.41 116.67 126.44 3hwc s ASP 1155Ca 0.60 -0.14 -0.27 0.00 0.71 0.00 0.00 52.55 53.45 3hwc s ASP 1155Cb -0.33 -1.54 -0.12 0.00 1.01 0.00 0.00 42.92 41.93 3hwc s ASP 1155CO 0.31 -0.10 1.19 -2.65 0.21 0.00 0.00 175.17 174.13 3hwc n PRO 1156N -1.32 1.84 -1.68 8.23 -0.02 -1.26 -4.65 135.00 136.14 3hwc n PRO 1156Ca -0.07 0.65 -0.46 0.00 -2.02 0.00 0.00 63.50 61.59 3hwc n PRO 1156Cb 0.58 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.82 3hwc n PRO 1156CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 3hwc n GLN 1157N 0.48 2.30 -2.06 -0.52 7.27 -1.26 -4.81 117.38 118.77 3hwc n GLN 1157Ca 0.07 0.84 -0.28 0.00 0.07 0.00 0.00 57.00 57.69 3hwc n GLN 1157Cb 0.36 -2.67 -0.06 0.00 2.41 0.00 0.00 30.24 30.28 3hwc n GLN 1157CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 3hwc s THR 1158N 2.69 3.53 0.24 1.69 2.01 -1.26 -4.91 115.64 119.62 3hwc s THR 1158Ca 0.86 -0.86 -0.31 0.00 0.31 0.00 0.00 61.69 61.69 3hwc s THR 1158Cb -0.64 -4.51 -0.11 0.00 0.01 0.00 0.00 72.50 67.25 3hwc s THR 1158CO 0.44 -0.98 1.58 -1.81 -0.69 0.00 0.00 174.62 173.16 3hwc s ASP 1159N 6.67 6.47 -0.02 3.53 1.11 -1.26 -4.88 116.67 128.31 3hwc s ASP 1159Ca 0.69 2.81 0.00 0.00 0.18 0.00 0.00 52.55 56.23 3hwc s ASP 1159Cb -0.01 -2.62 0.02 0.00 1.07 0.00 0.00 42.92 41.38 3hwc s ASP 1159CO 0.12 -0.87 1.16 0.54 1.18 0.00 0.00 175.17 177.30 3hwc n ARG 1160N 2.94 1.04 0.00 8.23 1.74 -1.26 -3.55 116.66 125.80 3hwc n ARG 1160Ca 0.11 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3hwc n ARG 1160Cb 0.38 -1.04 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 3hwc n ARG 1160CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3hwc n SER 1161N 0.58 0.00 0.00 0.55 7.64 -1.26 -5.02 113.62 116.11 3hwc n SER 1161Ca 0.02 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.39 3hwc n SER 1161Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 3hwc n SER 1161CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3hwc n SER 1162N -0.57 0.00 -0.89 6.43 7.64 -1.26 -4.92 113.62 120.06 3hwc n SER 1162Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 3hwc n SER 1162Cb 0.00 0.00 0.24 0.00 -1.01 0.00 0.00 64.21 63.44 3hwc n SER 1162CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3hwc n ASP 1163N 0.00 2.72 0.10 6.43 9.92 -1.26 -2.90 116.55 131.55 3hwc n ASP 1163Ca 0.00 -1.88 -0.21 0.00 -0.53 0.00 0.00 54.79 52.17 3hwc n ASP 1163Cb 0.00 -0.09 -0.15 0.00 -0.64 0.00 0.00 41.12 40.24 3hwc n ASP 1163CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3hwc h ALA 1164N 4.51 0.09 -0.43 2.24 0.00 -1.86 -3.01 119.26 120.80 3hwc h ALA 1164Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 3hwc h ALA 1164Cb 0.85 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3hwc h ALA 1164CO 0.00 0.95 0.00 0.00 0.00 0.00 0.00 179.25 180.20 3hwc n ALA 1165N -2.73 3.00 -3.57 0.00 0.00 -1.23 -3.48 120.51 112.50 3hwc n ALA 1165Ca -0.18 -1.10 -0.28 0.00 0.00 0.00 0.00 53.44 51.87 3hwc n ALA 1165Cb 1.07 -1.03 -0.15 0.00 0.00 0.00 0.00 19.45 19.34 3hwc n ALA 1165CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3hwc s GLN 1166N -1.82 0.20 0.00 0.00 0.74 -1.14 -4.99 119.66 112.65 3hwc s GLN 1166Ca 0.35 -0.47 0.00 0.00 0.05 0.00 0.00 55.36 55.29 3hwc s GLN 1166Cb 0.23 -1.34 0.00 0.00 1.10 0.00 0.00 33.01 33.00 3hwc s GLN 1166CO 0.16 -0.95 0.00 0.00 -0.55 0.00 0.00 175.29 173.95 3hwc n ALA 1167N 5.23 0.00 0.52 1.58 0.00 -1.26 -4.50 120.51 122.07 3hwc n ALA 1167Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3hwc n ALA 1167Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 3hwc n ALA 1167CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hwc n ARG 1168N 0.00 0.94 -1.24 0.00 3.00 -1.14 -4.89 116.66 113.34 3hwc n ARG 1168Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.54 3hwc n ARG 1168Cb 0.00 -1.03 0.11 0.00 0.00 0.00 0.00 32.46 31.54 3hwc n ARG 1168CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 3hwc s SER 1169N 1.30 4.11 0.00 6.15 0.01 -1.23 -4.71 113.70 119.33 3hwc s SER 1169Ca 0.00 1.70 0.30 0.00 1.31 0.00 0.00 55.95 59.26 3hwc s SER 1169Cb 0.00 -2.39 1.48 0.00 0.21 0.00 0.00 66.02 65.33 3hwc s SER 1169CO 0.00 -2.27 2.03 -2.65 0.41 0.00 0.00 173.24 170.77 3hwc n PRO 1170N -3.66 0.42 -1.67 12.44 -0.02 -1.26 -4.93 135.00 136.31 3hwc n PRO 1170Ca 0.08 -0.01 -0.44 0.00 -2.02 0.00 0.00 63.50 61.11 3hwc n PRO 1170Cb 0.54 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.50 3hwc n PRO 1170CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hwc n ASN 1171N -1.28 2.65 -4.69 2.55 4.13 -1.26 0.52 115.26 117.88 3hwc n ASN 1171Ca 0.14 1.16 -0.42 0.00 1.68 0.00 0.00 54.58 57.14 3hwc n ASN 1171Cb 0.25 -1.43 -0.03 0.00 -1.54 0.00 0.00 39.78 37.03 3hwc n ASN 1171CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3hwc s LEU 1172N -0.18 4.37 0.05 3.41 2.96 -1.16 -4.39 118.68 123.74 3hwc s LEU 1172Ca 0.64 2.58 0.01 0.00 -0.22 0.00 0.00 54.13 57.14 3hwc s LEU 1172Cb -0.63 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.46 3hwc s LEU 1172CO 0.54 -0.91 -0.05 0.00 -1.32 0.00 0.00 176.35 174.60 3hwc s ARG 1173N 2.46 0.53 -0.26 1.98 1.70 -0.62 -4.42 118.95 120.33 3hwc s ARG 1173Ca 0.75 -0.93 -0.29 0.00 -0.47 0.00 0.00 55.73 54.79 3hwc s ARG 1173Cb -0.42 -0.03 -0.00 0.00 -0.57 0.00 0.00 34.95 33.93 3hwc s ARG 1173CO 0.33 -0.03 1.24 0.42 -1.08 0.00 0.00 175.30 176.18 3hwc s ILE 1174N -2.43 4.27 -0.20 4.99 1.01 0.12 -1.85 121.20 127.10 3hwc s ILE 1174Ca -0.04 1.47 0.17 0.00 0.00 0.00 0.00 60.65 62.25 3hwc s ILE 1174Cb -0.03 -4.16 -0.24 0.00 0.01 0.00 0.00 42.46 38.04 3hwc s ILE 1174CO -0.04 -0.36 0.06 1.33 0.00 0.00 0.00 174.94 175.93 3hwc n VAL 1175N 5.87 1.37 -3.78 2.92 0.24 -0.34 -4.96 118.33 119.65 3hwc n VAL 1175Ca 0.14 -0.83 -0.15 0.00 -2.04 0.00 0.00 64.34 61.46 3hwc n VAL 1175Cb 0.46 -0.51 -0.16 0.00 -1.47 0.00 0.00 33.84 32.17 3hwc n VAL 1175CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3hwc s GLU 1176N -2.48 -0.03 -0.41 7.34 2.56 -1.05 -5.00 118.70 119.62 3hwc s GLU 1176Ca -0.11 0.17 -0.06 0.00 0.00 0.00 0.00 54.97 54.97 3hwc s GLU 1176Cb 0.06 -0.22 0.10 0.00 2.00 0.00 0.00 34.13 36.06 3hwc s GLU 1176CO 0.81 -0.15 0.23 0.15 -0.56 0.00 0.00 175.26 175.73 3hwc s LYS 1177N 0.95 2.31 0.66 4.30 1.02 -1.26 0.32 119.74 128.03 3hwc s LYS 1177Ca -0.08 -1.66 -0.03 0.00 0.02 0.00 0.00 55.97 54.22 3hwc s LYS 1177Cb -0.11 -3.67 0.06 0.00 -0.52 0.00 0.00 37.83 33.59 3hwc s LYS 1177CO -0.03 -1.02 0.93 0.99 -0.92 0.00 0.00 175.35 175.30 3hwc s THR 1178N 1.28 2.39 -1.67 2.17 2.01 0.32 -4.99 115.64 117.14 3hwc s THR 1178Ca 0.05 -0.44 0.28 0.00 0.31 0.00 0.00 61.69 61.89 3hwc s THR 1178Cb -0.23 -2.95 0.40 0.00 0.01 0.00 0.00 72.50 69.73 3hwc s THR 1178CO -0.01 0.00 1.78 -0.90 -0.69 0.00 0.00 174.62 174.80 3hwc n ASP 1179N -2.73 0.62 -0.02 3.53 3.85 -1.26 -3.59 116.55 116.96 3hwc n ASP 1179Ca 0.09 -0.65 0.08 0.00 -0.71 0.00 0.00 54.79 53.59 3hwc n ASP 1179Cb 0.60 -0.02 -0.15 0.00 -1.35 0.00 0.00 41.12 40.20 3hwc n ASP 1179CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3hwc n ASP 1180N -0.87 0.57 0.00 -1.12 10.43 -1.26 -4.99 116.55 119.31 3hwc n ASP 1180Ca 0.14 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.50 3hwc n ASP 1180Cb 0.30 1.79 0.00 0.00 1.84 0.00 0.00 41.12 45.04 3hwc n ASP 1180CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hwc n GLY 1181N 1.45 -0.59 3.43 0.44 0.00 -1.24 -2.00 105.19 106.69 3hwc n GLY 1181Ca -0.06 -0.65 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 3hwc n GLY 1181CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hwc s ILE 1182N -3.28 2.27 -0.13 -0.61 -4.36 0.58 -0.52 121.20 115.15 3hwc s ILE 1182Ca 0.00 -2.35 0.01 0.00 -0.26 0.00 0.00 60.65 58.05 3hwc s ILE 1182Cb 0.00 -2.22 -0.01 0.00 1.25 0.00 0.00 42.46 41.48 3hwc s ILE 1182CO 0.00 -0.45 -0.16 -0.63 0.24 0.00 0.00 174.94 173.93 3hwc s ILE 1183N -2.64 2.72 0.06 8.37 1.01 0.15 0.22 121.20 131.09 3hwc s ILE 1183Ca 0.28 -0.78 0.08 0.00 0.00 0.00 0.00 60.65 60.24 3hwc s ILE 1183Cb -0.04 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.28 3hwc s ILE 1183CO 0.13 0.53 -0.23 0.54 0.00 0.00 0.00 174.94 175.91 3hwc s VAL 1184N 0.45 1.88 -0.10 2.92 0.11 0.09 -1.20 120.40 124.55 3hwc s VAL 1184Ca -0.12 -1.34 -0.05 0.00 -2.93 0.00 0.00 61.98 57.54 3hwc s VAL 1184Cb -0.16 -1.63 0.04 0.00 -1.53 0.00 0.00 36.38 33.10 3hwc s VAL 1184CO 0.05 0.23 0.23 0.21 -3.33 0.00 0.00 175.10 172.49 3hwc s ASN 1185N -1.34 -0.24 0.00 3.54 2.47 -0.77 -1.55 114.94 117.05 3hwc s ASN 1185Ca 0.09 0.49 0.00 0.00 0.42 0.00 0.00 52.86 53.86 3hwc s ASN 1185Cb -0.09 0.38 0.00 0.00 -1.45 0.00 0.00 41.25 40.09 3hwc s ASN 1185CO 0.02 -0.15 0.00 0.61 -3.72 0.00 0.00 177.10 173.86 3hwc n GLY 1186N 4.07 0.83 3.10 1.21 0.00 -0.65 -1.59 105.19 112.16 3hwc n GLY 1186Ca -0.24 -1.71 -0.20 0.00 0.00 0.00 0.00 46.02 43.87 3hwc n GLY 1186CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 1187N -3.60 1.01 -0.27 1.61 1.01 0.18 -0.18 120.40 120.16 3hwc s VAL 1187Ca 0.00 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 3hwc s VAL 1187Cb 0.00 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 3hwc s VAL 1187CO 0.00 0.14 0.11 -0.54 0.00 0.00 0.00 175.10 174.81 3hwc s LYS 1188N -0.67 3.57 0.00 2.72 -0.14 -0.12 -3.01 119.74 122.09 3hwc s LYS 1188Ca 0.03 -0.54 0.00 0.00 -1.36 0.00 0.00 55.97 54.10 3hwc s LYS 1188Cb -0.06 -3.43 0.00 0.00 -1.68 0.00 0.00 37.83 32.66 3hwc s LYS 1188CO 0.00 -0.26 0.70 0.00 -0.76 0.00 0.00 175.35 175.02 3hwc n ALA 1189N 4.95 -0.25 -2.74 5.17 0.00 0.45 -1.46 120.51 126.64 3hwc n ALA 1189Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.96 3hwc n ALA 1189Cb 0.51 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.83 3hwc n ALA 1189CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3hwc s VAL 1190N -1.95 3.23 -0.17 0.00 1.01 -1.24 -3.46 120.40 117.82 3hwc s VAL 1190Ca 0.00 -0.63 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 3hwc s VAL 1190Cb 0.00 -2.32 0.06 0.00 0.00 0.00 0.00 36.38 34.12 3hwc s VAL 1190CO 0.00 0.56 0.41 -0.83 0.00 0.00 0.00 175.10 175.25 3hwc s GLY 1191N -0.28 -0.33 -0.20 4.51 0.00 -0.57 -4.09 107.32 106.36 3hwc s GLY 1191Ca 0.03 1.47 -0.08 0.00 0.00 0.00 0.00 44.72 46.14 3hwc s GLY 1191CO 0.03 1.56 0.07 -1.59 0.00 0.00 0.00 173.10 173.17 3hwc s THR 1192N 1.17 4.71 -0.50 0.90 2.01 -1.26 0.98 115.64 123.64 3hwc s THR 1192Ca -0.08 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 61.87 3hwc s THR 1192Cb -0.07 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.29 3hwc s THR 1192CO -0.10 0.42 0.00 0.61 -0.69 0.00 0.00 174.62 174.86 3hwc n GLY 1193N 3.92 0.72 0.35 4.40 0.00 -0.26 -4.65 105.19 109.67 3hwc n GLY 1193Ca -0.16 -0.43 -0.00 0.00 0.00 0.00 0.00 46.02 45.43 3hwc n GLY 1193CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hwc h ILE 1194N 0.00 1.12 0.00 -0.61 1.08 -1.82 -1.36 117.51 115.92 3hwc h ILE 1194Ca -0.10 -0.39 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 3hwc h ILE 1194Cb 0.45 -0.10 0.00 0.00 -3.07 0.00 0.00 36.82 34.10 3hwc h ILE 1194CO 0.14 0.21 0.00 0.00 -0.69 0.00 0.00 178.15 177.81 3hwc n ALA 1195N -2.36 2.09 -0.07 1.87 0.00 -1.26 -2.65 120.51 118.13 3hwc n ALA 1195Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3hwc n ALA 1195Cb 0.12 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.30 3hwc n ALA 1195CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hwc n PHE 1196N -1.02 0.00 -3.39 0.00 3.72 -0.52 -4.96 117.46 111.29 3hwc n PHE 1196Ca 0.12 -0.14 -0.23 0.00 -0.05 0.00 0.00 57.45 57.16 3hwc n PHE 1196Cb 0.06 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 38.58 3hwc n PHE 1196CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hwc s GLY 1197N -0.27 1.40 0.06 1.37 0.00 -1.09 -4.98 107.32 103.81 3hwc s GLY 1197Ca 0.00 -1.06 -0.11 0.00 0.00 0.00 0.00 44.72 43.55 3hwc s GLY 1197CO 0.00 -0.98 1.09 -0.55 0.00 0.00 0.00 173.10 172.66 3hwc h ASP 1198N 0.75 0.72 -3.70 1.64 5.19 -0.78 -3.42 116.42 116.82 3hwc h ASP 1198Ca -0.49 -0.72 -0.39 0.00 -0.62 0.00 0.00 57.03 54.81 3hwc h ASP 1198Cb 1.23 -0.23 -0.14 0.00 0.18 0.00 0.00 39.33 40.37 3hwc h ASP 1198CO 0.59 1.55 -0.68 -0.31 -3.12 0.00 0.00 179.24 177.28 3hwc s TYR 1199N -2.77 1.57 -0.05 4.55 1.51 -1.10 -1.68 117.35 119.39 3hwc s TYR 1199Ca -0.07 -0.83 0.06 0.00 -1.01 0.00 0.00 57.07 55.21 3hwc s TYR 1199Cb 0.06 -0.88 -0.02 0.00 -0.11 0.00 0.00 41.96 41.01 3hwc s TYR 1199CO 0.92 0.06 -0.22 0.00 -1.11 0.00 0.00 175.55 175.20 3hwc s MET 1200N -3.80 2.43 -0.88 -0.62 0.23 0.02 -3.36 119.30 113.32 3hwc s MET 1200Ca 0.26 -0.85 -0.19 0.00 -1.03 0.00 0.00 55.69 53.87 3hwc s MET 1200Cb 0.04 -2.20 0.13 0.00 -1.53 0.00 0.00 34.83 31.27 3hwc s MET 1200CO 0.07 0.49 1.08 -1.58 -2.03 0.00 0.00 175.02 173.05 3hwc s HIS 1201N -0.42 3.08 0.25 3.16 2.46 0.11 -2.71 115.29 121.22 3hwc s HIS 1201Ca 0.04 -1.29 -0.30 0.00 0.47 0.00 0.00 55.06 53.99 3hwc s HIS 1201Cb -0.12 -4.26 -0.09 0.00 -0.13 0.00 0.00 32.58 27.99 3hwc s HIS 1201CO 0.01 -1.48 1.12 0.42 -2.47 0.00 0.00 174.74 172.34 3hwc s ILE 1202N 2.77 3.55 0.07 0.89 1.01 0.23 -0.87 121.20 128.86 3hwc s ILE 1202Ca 0.30 1.48 -0.25 0.00 0.00 0.00 0.00 60.65 62.19 3hwc s ILE 1202Cb -0.07 -3.94 0.08 0.00 0.01 0.00 0.00 42.46 38.54 3hwc s ILE 1202CO -0.06 0.32 1.14 0.61 0.00 0.00 0.00 174.94 176.94 3hwc n GLY 1203N 1.47 0.41 3.38 6.18 0.00 -1.14 -1.71 105.19 113.77 3hwc n GLY 1203Ca 0.00 -1.09 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 3hwc n GLY 1203CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwc s LEU 1205N -2.88 2.79 0.54 0.00 1.43 -1.26 -4.75 118.68 114.55 3hwc s LEU 1205Ca 0.09 -0.28 -0.21 0.00 -1.03 0.00 0.00 54.13 52.71 3hwc s LEU 1205Cb 0.02 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 3hwc s LEU 1205CO -0.06 0.29 1.22 -0.47 0.23 0.00 0.00 176.35 177.57 3hwc s TYR 1206N -0.88 2.54 -0.07 0.29 6.14 -0.87 -5.04 117.35 119.46 3hwc s TYR 1206Ca 0.14 1.49 -0.13 0.00 0.64 0.00 0.00 57.07 59.21 3hwc s TYR 1206Cb -0.11 -3.51 0.03 0.00 0.42 0.00 0.00 41.96 38.79 3hwc s TYR 1206CO 0.04 -2.10 0.32 -0.98 0.64 0.00 0.00 175.55 173.48 3hwc s ARG 1207N -3.03 0.54 -0.08 4.97 1.70 -1.26 -5.02 118.95 116.76 3hwc s ARG 1207Ca 0.71 0.12 -0.40 0.00 -0.47 0.00 0.00 55.73 55.69 3hwc s ARG 1207Cb -0.32 0.25 -0.18 0.00 -0.57 0.00 0.00 34.95 34.13 3hwc s ARG 1207CO 0.36 -0.12 1.34 -2.30 -1.08 0.00 0.00 175.30 173.51 3hwc n PRO 1208N 2.04 0.58 -2.36 3.89 -0.02 -1.26 -2.06 135.00 135.81 3hwc n PRO 1208Ca -0.18 0.21 -0.09 0.00 -2.02 0.00 0.00 63.50 61.43 3hwc n PRO 1208Cb 0.57 -1.79 0.01 0.00 -0.02 0.00 0.00 33.50 32.26 3hwc n PRO 1208CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hwc n GLY 1209N 2.63 0.11 3.72 -1.23 0.00 -1.26 -5.01 105.19 104.14 3hwc n GLY 1209Ca 0.22 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 3hwc n GLY 1209CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hwc s ILE 1210N -2.61 4.79 0.64 -0.61 2.07 -0.88 -5.03 121.20 119.58 3hwc s ILE 1210Ca 0.06 1.92 -0.18 0.00 -1.41 0.00 0.00 60.65 61.04 3hwc s ILE 1210Cb -0.03 -4.25 -0.01 0.00 0.13 0.00 0.00 42.46 38.30 3hwc s ILE 1210CO 0.08 0.24 1.30 -2.84 -1.91 0.00 0.00 174.94 171.81 3hwc s PRO 1211N 0.59 2.58 0.43 3.50 0.02 -1.26 -4.83 135.00 136.03 3hwc s PRO 1211Ca 0.47 2.09 0.20 0.00 0.02 0.00 0.00 61.00 63.78 3hwc s PRO 1211Cb -0.21 -1.87 0.96 0.00 0.02 0.00 0.00 34.50 33.41 3hwc s PRO 1211CO 0.26 -1.59 1.88 0.78 -0.33 0.00 0.00 177.00 178.01 3hwc h GLY 1212N 0.59 0.00 2.00 0.52 0.00 -1.96 -2.80 103.07 101.42 3hwc h GLY 1212Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3hwc h GLY 1212CO 0.53 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 175.23 3hwc n GLU 1213N -3.74 0.09 0.00 4.80 0.28 -1.26 -2.13 120.64 118.67 3hwc n GLU 1213Ca -0.01 0.24 0.11 0.00 -0.16 0.00 0.00 57.16 57.34 3hwc n GLU 1213Cb 0.38 -1.64 0.08 0.00 1.43 0.00 0.00 31.44 31.69 3hwc n GLU 1213CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3hwc n GLN 1214N -1.80 2.05 -3.08 3.44 6.02 -1.06 0.15 117.38 123.11 3hwc n GLN 1214Ca 0.04 -1.75 -0.45 0.00 -0.01 0.00 0.00 57.00 54.83 3hwc n GLN 1214Cb 0.25 -1.44 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 3hwc n GLN 1214CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hwc s VAL 1215N -1.94 5.15 -0.05 5.09 1.01 -0.91 -4.88 120.40 123.86 3hwc s VAL 1215Ca 0.25 -2.22 0.03 0.00 0.00 0.00 0.00 61.98 60.04 3hwc s VAL 1215Cb 0.19 -4.71 0.01 0.00 0.00 0.00 0.00 36.38 31.86 3hwc s VAL 1215CO 0.31 -1.38 -0.13 -0.51 0.00 0.00 0.00 175.10 173.39 3hwc s ILE 1216N 1.40 1.16 -0.09 2.22 1.10 -1.26 -1.31 121.20 124.42 3hwc s ILE 1216Ca 0.31 -0.53 0.03 0.00 -0.51 0.00 0.00 60.65 59.95 3hwc s ILE 1216Cb -0.06 -1.03 0.01 0.00 0.15 0.00 0.00 42.46 41.53 3hwc s ILE 1216CO -0.07 0.35 -0.18 -0.36 -2.11 0.00 0.00 174.94 172.57 3hwc s PHE 1217N 0.37 2.00 0.17 3.50 0.40 -0.14 -3.51 117.98 120.77 3hwc s PHE 1217Ca -0.09 -0.81 -0.24 0.00 -0.60 0.00 0.00 56.93 55.20 3hwc s PHE 1217Cb -0.13 -1.39 0.07 0.00 0.51 0.00 0.00 43.02 42.08 3hwc s PHE 1217CO 0.03 -0.36 0.99 0.00 0.70 0.00 0.00 175.22 176.58 3hwc s ALA 1218N 0.56 -1.61 -0.16 5.36 0.00 -0.70 -0.05 121.76 125.15 3hwc s ALA 1218Ca -0.16 -0.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.71 3hwc s ALA 1218Cb -0.17 0.67 0.06 0.00 0.00 0.00 0.00 23.12 23.68 3hwc s ALA 1218CO 0.05 -1.05 0.07 0.00 0.00 0.00 0.00 175.76 174.83 3hwc s ALA 1219N -2.82 0.57 0.18 0.00 0.00 -0.94 -0.60 121.76 118.14 3hwc s ALA 1219Ca 0.16 -0.36 0.11 0.00 0.00 0.00 0.00 51.96 51.86 3hwc s ALA 1219Cb -0.02 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 3hwc s ALA 1219CO 0.04 -1.10 -0.21 0.96 0.00 0.00 0.00 175.76 175.44 3hwc s ILE 1220N 2.06 2.52 0.68 0.00 -4.36 -1.10 -4.85 121.20 116.16 3hwc s ILE 1220Ca 0.02 -1.92 -0.17 0.00 -0.26 0.00 0.00 60.65 58.32 3hwc s ILE 1220Cb -0.16 -2.21 0.01 0.00 1.25 0.00 0.00 42.46 41.35 3hwc s ILE 1220CO -0.08 -0.09 1.26 -2.65 0.24 0.00 0.00 174.94 173.62 3hwc n PRO 1221N 0.30 0.91 0.18 0.37 -0.02 -1.26 -0.80 135.00 134.68 3hwc n PRO 1221Ca -0.13 0.37 0.03 0.00 -2.02 0.00 0.00 63.50 61.75 3hwc n PRO 1221Cb 0.55 -2.49 0.34 0.00 -0.02 0.00 0.00 33.50 31.88 3hwc n PRO 1221CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3hwc h THR 1222N 0.23 1.20 -0.44 3.45 2.02 -1.58 -2.83 112.91 114.96 3hwc h THR 1222Ca -0.50 -1.43 -0.10 0.00 0.77 0.00 0.00 66.41 65.15 3hwc h THR 1222Cb 1.33 1.79 -0.06 0.00 -1.74 0.00 0.00 68.15 69.47 3hwc h THR 1222CO 0.51 0.40 0.13 -0.46 0.37 0.00 0.00 175.52 176.47 3hwc n ASN 1223N -3.92 3.80 -4.76 4.18 6.94 -1.26 -4.77 115.26 115.47 3hwc n ASN 1223Ca -0.01 -2.71 -0.41 0.00 -0.02 0.00 0.00 54.58 51.42 3hwc n ASN 1223Cb 0.45 -0.65 -0.01 0.00 -2.36 0.00 0.00 39.78 37.21 3hwc n ASN 1223CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3hwc s THR 1224N -2.08 2.14 0.30 5.53 2.01 -1.07 -4.80 115.64 117.68 3hwc s THR 1224Ca 0.34 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 62.17 3hwc s THR 1224Cb 0.27 -3.08 -0.12 0.00 0.01 0.00 0.00 72.50 69.58 3hwc s THR 1224CO 0.09 0.02 1.60 -2.65 -0.69 0.00 0.00 174.62 172.99 3hwc n PRO 1225N 1.58 2.73 -0.07 4.92 -0.02 -1.26 -2.76 135.00 140.12 3hwc n PRO 1225Ca 0.05 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 3hwc n PRO 1225Cb 0.38 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 3hwc n PRO 1225CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hwc n GLY 1226N 2.06 0.51 3.57 -1.23 0.00 -1.26 -4.51 105.19 104.32 3hwc n GLY 1226Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 3hwc n GLY 1226CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 1227N -2.22 4.76 -0.14 1.61 1.01 -1.11 -0.85 120.40 123.47 3hwc s VAL 1227Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.97 3hwc s VAL 1227Cb 0.00 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.19 3hwc s VAL 1227CO 0.00 0.38 -0.21 -0.89 0.00 0.00 0.00 175.10 174.38 3hwc s THR 1228N 1.04 1.98 -0.42 3.92 2.01 -0.58 -4.47 115.64 119.11 3hwc s THR 1228Ca 0.05 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 60.94 3hwc s THR 1228Cb -0.14 -1.76 0.02 0.00 0.01 0.00 0.00 72.50 70.63 3hwc s THR 1228CO 0.03 0.53 0.52 -0.69 -0.69 0.00 0.00 174.62 174.33 3hwc s VAL 1229N 0.88 4.98 -0.43 3.82 1.01 -0.83 -1.17 120.40 128.67 3hwc s VAL 1229Ca -0.06 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 3hwc s VAL 1229Cb -0.15 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.16 3hwc s VAL 1229CO -0.03 -0.47 0.38 -0.36 0.00 0.00 0.00 175.10 174.62 3hwc s PHE 1230N 2.41 3.20 0.09 5.22 0.08 -0.12 -0.92 117.98 127.95 3hwc s PHE 1230Ca 0.16 -0.56 -0.06 0.00 0.12 0.00 0.00 56.93 56.60 3hwc s PHE 1230Cb -0.16 -2.84 -0.05 0.00 -0.57 0.00 0.00 43.02 39.40 3hwc s PHE 1230CO 0.16 -0.69 0.35 0.00 -0.10 0.00 0.00 175.22 174.94 3hwc s ARG 1232N -2.26 0.76 0.58 0.00 1.70 -0.99 -1.62 118.95 117.12 3hwc s ARG 1232Ca 0.36 1.41 -0.20 0.00 -0.47 0.00 0.00 55.73 56.82 3hwc s ARG 1232Cb -0.13 -1.71 -0.04 0.00 -0.57 0.00 0.00 34.95 32.51 3hwc s ARG 1232CO 0.21 -2.76 1.32 -1.83 -1.08 0.00 0.00 175.30 171.16 3hwc s GLU 1233N -4.64 2.97 0.15 3.89 -1.05 -1.26 -4.05 118.70 114.72 3hwc s GLU 1233Ca 0.67 2.13 -0.19 0.00 -0.15 0.00 0.00 54.97 57.43 3hwc s GLU 1233Cb -0.23 -2.11 -0.07 0.00 -0.44 0.00 0.00 34.13 31.28 3hwc s GLU 1233CO 0.59 -1.29 0.65 0.45 0.95 0.00 0.00 175.26 176.60 3hwc s SER 1234N -1.16 7.05 -0.15 0.83 0.15 -1.26 -4.96 113.70 114.20 3hwc s SER 1234Ca 0.75 1.32 0.16 0.00 0.70 0.00 0.00 55.95 58.88 3hwc s SER 1234Cb -0.38 -2.38 0.52 0.00 -1.71 0.00 0.00 66.02 62.07 3hwc s SER 1234CO 0.43 0.14 1.43 0.35 1.20 0.00 0.00 173.24 176.79 3hwc n THR 1235N 1.14 2.09 -1.92 6.45 -2.24 -1.26 -5.02 114.28 113.52 3hwc n THR 1235Ca -0.06 -1.67 -0.42 0.00 -2.27 0.00 0.00 64.05 59.64 3hwc n THR 1235Cb 0.51 -0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.60 3hwc n THR 1235CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3hwc s VAL 1236N -2.47 2.48 0.41 2.28 1.01 -1.26 -4.51 120.40 118.34 3hwc s VAL 1236Ca 0.40 0.38 -0.12 0.00 0.00 0.00 0.00 61.98 62.65 3hwc s VAL 1236Cb 0.31 -3.24 -0.07 0.00 0.00 0.00 0.00 36.38 33.38 3hwc s VAL 1236CO 0.11 0.05 0.79 -0.54 0.00 0.00 0.00 175.10 175.51 3hwc s LYS 1237N 0.21 3.83 -0.07 2.72 -0.14 -0.57 -4.96 119.74 120.75 3hwc s LYS 1237Ca 0.65 0.55 0.11 0.00 -1.36 0.00 0.00 55.97 55.92 3hwc s LYS 1237Cb -0.44 -2.36 -0.24 0.00 -1.68 0.00 0.00 37.83 33.11 3hwc s LYS 1237CO 0.39 -0.04 0.55 0.27 -0.76 0.00 0.00 175.35 175.76 3hwc n ASN 1238N -1.21 0.95 -4.27 2.83 6.94 -1.26 -4.31 115.26 114.93 3hwc n ASN 1238Ca 0.03 0.34 -0.39 0.00 -0.02 0.00 0.00 54.58 54.54 3hwc n ASN 1238Cb 0.54 -0.05 -0.11 0.00 -2.36 0.00 0.00 39.78 37.79 3hwc n ASN 1238CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3hwc s ASP 1239N -6.15 5.48 0.57 0.53 3.68 -1.26 -4.95 116.67 114.57 3hwc s ASP 1239Ca -0.08 -1.36 0.35 0.00 2.13 0.00 0.00 52.55 53.59 3hwc s ASP 1239Cb 0.08 -1.93 1.54 0.00 -1.45 0.00 0.00 42.92 41.16 3hwc s ASP 1239CO 0.82 -0.44 2.05 -0.65 0.13 0.00 0.00 175.17 177.08 3hwc h PRO 1240N 8.30 0.00 0.00 4.34 0.11 -1.88 0.15 132.00 143.02 3hwc h PRO 1240Ca -0.22 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.73 3hwc h PRO 1240Cb 1.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3hwc h PRO 1240CO 0.68 0.02 -0.73 0.00 -0.21 0.00 0.00 178.00 177.76 3hwc h ALA 1241N 1.98 0.73 0.00 -0.75 0.00 -1.97 -3.06 119.26 116.19 3hwc h ALA 1241Ca -0.00 -0.67 -0.24 0.00 0.00 0.00 0.00 54.91 54.00 3hwc h ALA 1241Cb 0.42 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 3hwc h ALA 1241CO 0.00 0.92 -2.13 0.39 0.00 0.00 0.00 179.25 178.43 3hwc n GLU 1242N -3.58 0.67 -3.63 0.00 -0.58 -1.04 -4.75 120.64 107.73 3hwc n GLU 1242Ca -0.00 -0.02 -0.28 0.00 -0.42 0.00 0.00 57.16 56.44 3hwc n GLU 1242Cb 0.73 -1.57 -0.12 0.00 -0.57 0.00 0.00 31.44 29.92 3hwc n GLU 1242CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 3hwc s HIS 1243N -2.82 1.95 0.43 -0.32 3.76 0.49 -4.91 115.29 113.87 3hwc s HIS 1243Ca -0.08 -2.53 0.13 0.00 -0.15 0.00 0.00 55.06 52.43 3hwc s HIS 1243Cb 0.09 -1.68 0.92 0.00 1.11 0.00 0.00 32.58 33.01 3hwc s HIS 1243CO 0.85 -0.75 1.95 -1.35 -0.85 0.00 0.00 174.74 174.59 3hwc h PRO 1244N 6.11 0.03 0.00 8.40 0.11 -1.79 -2.82 132.00 142.04 3hwc h PRO 1244Ca 0.12 -0.01 -0.39 0.00 0.11 0.00 0.00 66.00 65.84 3hwc h PRO 1244Cb 0.89 -0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.94 3hwc h PRO 1244CO 0.48 0.24 -2.28 1.28 -0.21 0.00 0.00 178.00 177.52 3hwc n LEU 1245N -4.27 1.81 0.25 2.35 4.77 -1.26 -4.58 117.00 116.06 3hwc n LEU 1245Ca -0.02 0.31 0.17 0.00 -0.03 0.00 0.00 56.01 56.44 3hwc n LEU 1245Cb 0.28 -0.75 0.81 0.00 -2.33 0.00 0.00 43.42 41.43 3hwc n LEU 1245CO 0.37 0.45 1.00 0.00 -1.33 0.00 0.00 177.39 177.87 3hwc h ALA 1246N -0.92 1.00 -0.00 -1.18 0.00 -1.89 -0.94 119.26 115.33 3hwc h ALA 1246Ca -0.58 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3hwc h ALA 1246Cb 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3hwc h ALA 1246CO -0.35 0.00 -0.14 -1.13 0.00 0.00 0.00 179.25 177.62 3hwc n SER 1247N -2.75 0.45 0.11 0.00 3.41 -1.07 -1.52 113.62 112.26 3hwc n SER 1247Ca -0.01 -0.45 0.12 0.00 -0.26 0.00 0.00 58.87 58.28 3hwc n SER 1247Cb 0.15 -0.08 0.25 0.00 -0.26 0.00 0.00 64.21 64.27 3hwc n SER 1247CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3hwc h GLN 1248N 0.49 0.00 0.00 4.33 4.20 -1.41 -3.43 115.11 119.29 3hwc h GLN 1248Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3hwc h GLN 1248Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 3hwc h GLN 1248CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 3hwc n GLY 1249N 1.28 4.71 3.37 3.46 0.00 -1.26 -3.89 105.19 112.86 3hwc n GLY 1249Ca 0.04 -1.08 -0.37 0.00 0.00 0.00 0.00 46.02 44.61 3hwc n GLY 1249CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hwc s ASP 1250N 0.00 5.02 -1.05 1.61 3.68 -1.26 -4.78 116.67 119.88 3hwc s ASP 1250Ca 0.00 -0.53 -0.23 0.00 2.13 0.00 0.00 52.55 53.92 3hwc s ASP 1250Cb 0.00 -1.87 -0.01 0.00 -1.45 0.00 0.00 42.92 39.58 3hwc s ASP 1250CO 0.00 -0.13 1.78 -0.70 0.13 0.00 0.00 175.17 176.25 3hwc s GLU 1251N 1.53 3.03 0.69 4.34 2.12 -1.26 -4.74 118.70 124.41 3hwc s GLU 1251Ca 0.04 -0.96 -0.16 0.00 0.36 0.00 0.00 54.97 54.25 3hwc s GLU 1251Cb -0.16 -5.25 0.02 0.00 0.26 0.00 0.00 34.13 28.99 3hwc s GLU 1251CO 0.02 -3.03 1.22 -0.51 -0.54 0.00 0.00 175.26 172.42 3hwc s LEU 1252N 8.04 3.42 0.08 2.70 1.43 -1.26 -4.74 118.68 128.35 3hwc s LEU 1252Ca 0.61 2.39 0.08 0.00 -1.03 0.00 0.00 54.13 56.18 3hwc s LEU 1252Cb -0.02 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.57 3hwc s LEU 1252CO 0.01 -2.09 -0.20 -1.81 0.23 0.00 0.00 176.35 172.49 3hwc s ASP 1253N -1.88 3.69 0.10 2.29 1.11 -1.26 -1.10 116.67 119.63 3hwc s ASP 1253Ca 0.76 -0.53 0.03 0.00 0.18 0.00 0.00 52.55 52.99 3hwc s ASP 1253Cb -0.30 -0.50 -0.04 0.00 1.07 0.00 0.00 42.92 43.14 3hwc s ASP 1253CO 0.42 0.22 -0.09 -0.44 1.18 0.00 0.00 175.17 176.47 3hwc s SER 1254N -1.72 1.35 -0.19 0.27 0.01 0.27 -2.34 113.70 111.36 3hwc s SER 1254Ca 0.15 -0.90 -0.03 0.00 1.31 0.00 0.00 55.95 56.48 3hwc s SER 1254Cb -0.10 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 3hwc s SER 1254CO 0.07 -0.34 -0.05 0.42 0.41 0.00 0.00 173.24 173.74 3hwc s THR 1255N -2.95 3.50 -0.21 1.44 -4.23 0.12 -1.51 115.64 111.80 3hwc s THR 1255Ca 0.09 -0.47 -0.08 0.00 -1.18 0.00 0.00 61.69 60.05 3hwc s THR 1255Cb 0.01 -2.56 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 3hwc s THR 1255CO -0.02 0.45 0.09 -0.89 -0.54 0.00 0.00 174.62 173.71 3hwc s THR 1256N 1.01 4.79 -0.15 3.99 2.01 -0.54 -0.94 115.64 125.82 3hwc s THR 1256Ca 0.00 -0.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.93 3hwc s THR 1256Cb -0.15 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 3hwc s THR 1256CO 0.00 0.40 0.02 0.68 -0.69 0.00 0.00 174.62 175.03 3hwc s VAL 1257N 0.88 4.47 -0.44 3.82 -7.23 -0.32 -0.94 120.40 120.63 3hwc s VAL 1257Ca 0.05 -0.16 -0.05 0.00 -1.81 0.00 0.00 61.98 60.00 3hwc s VAL 1257Cb -0.14 -2.96 0.12 0.00 0.56 0.00 0.00 36.38 33.96 3hwc s VAL 1257CO 0.03 0.52 0.27 -0.36 -0.31 0.00 0.00 175.10 175.24 3hwc s PHE 1258N -0.04 3.53 -0.94 2.82 0.40 0.74 -1.52 117.98 122.98 3hwc s PHE 1258Ca 0.04 -2.24 -0.19 0.00 -0.60 0.00 0.00 56.93 53.94 3hwc s PHE 1258Cb -0.13 -3.33 0.12 0.00 0.51 0.00 0.00 43.02 40.20 3hwc s PHE 1258CO 0.02 -0.98 1.16 -0.51 0.70 0.00 0.00 175.22 175.61 3hwc s ASP 1259N 2.08 6.61 -1.21 1.36 1.01 -0.03 -1.64 116.67 124.85 3hwc s ASP 1259Ca 0.08 -1.97 -0.25 0.00 0.71 0.00 0.00 52.55 51.12 3hwc s ASP 1259Cb -0.24 -2.42 0.02 0.00 1.01 0.00 0.00 42.92 41.29 3hwc s ASP 1259CO -0.03 -1.11 0.68 0.59 0.21 0.00 0.00 175.17 175.51 3hwc n ASN 1260N 6.79 -4.12 -4.84 0.27 3.02 -1.17 -4.71 115.26 110.50 3hwc n ASN 1260Ca 0.25 -1.16 -0.34 0.00 -0.03 0.00 0.00 54.58 53.30 3hwc n ASN 1260Cb 0.49 -2.51 -0.06 0.00 -0.61 0.00 0.00 39.78 37.09 3hwc n ASN 1260CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3hwc s VAL 1261N -3.57 4.65 -0.27 2.41 -7.23 -0.60 -4.81 120.40 110.98 3hwc s VAL 1261Ca 0.43 1.05 -0.10 0.00 -1.81 0.00 0.00 61.98 61.55 3hwc s VAL 1261Cb -0.20 -3.70 -0.04 0.00 0.56 0.00 0.00 36.38 33.00 3hwc s VAL 1261CO 0.92 -0.04 0.15 0.12 -0.31 0.00 0.00 175.10 175.94 3hwc s PHE 1262N -1.81 3.18 -0.26 2.82 2.19 -1.26 -0.73 117.98 122.10 3hwc s PHE 1262Ca 0.50 -0.05 -0.09 0.00 0.33 0.00 0.00 56.93 57.62 3hwc s PHE 1262Cb -0.13 -2.33 -0.04 0.00 -1.31 0.00 0.00 43.02 39.21 3hwc s PHE 1262CO 0.19 -0.22 0.12 0.42 1.83 0.00 0.00 175.22 177.56 3hwc s ILE 1263N 1.70 4.73 0.48 3.12 1.01 0.13 -4.97 121.20 127.40 3hwc s ILE 1263Ca 0.07 -0.03 -0.24 0.00 0.00 0.00 0.00 60.65 60.45 3hwc s ILE 1263Cb -0.16 -3.23 -0.07 0.00 0.01 0.00 0.00 42.46 39.02 3hwc s ILE 1263CO 0.09 0.31 1.33 -2.84 0.00 0.00 0.00 174.94 173.83 3hwc s PRO 1264N 1.62 3.56 0.39 2.79 0.02 -1.26 -0.31 135.00 141.81 3hwc s PRO 1264Ca 0.06 2.19 0.14 0.00 0.02 0.00 0.00 61.00 63.42 3hwc s PRO 1264Cb -0.15 -2.50 0.98 0.00 0.02 0.00 0.00 34.50 32.85 3hwc s PRO 1264CO 0.06 -0.84 1.85 -1.49 -0.33 0.00 0.00 177.00 176.26 3hwc h TRP 1265N 2.05 0.67 0.00 6.54 4.06 -1.73 -1.21 115.95 126.33 3hwc h TRP 1265Ca -0.50 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.47 3hwc h TRP 1265Cb 1.27 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 29.23 3hwc h TRP 1265CO 0.50 0.19 0.00 -0.85 -3.56 0.00 0.00 178.44 174.72 3hwc n GLU 1266N -4.55 0.58 0.00 0.49 0.00 -1.26 -1.52 120.64 114.37 3hwc n GLU 1266Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.35 3hwc n GLU 1266Cb 0.62 -1.12 0.00 0.00 0.00 0.00 0.00 31.44 30.94 3hwc n GLU 1266CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3hwc n GLN 1267N -0.21 -0.28 -3.52 3.44 6.02 -0.46 -4.87 117.38 117.50 3hwc n GLN 1267Ca 0.00 -0.43 -0.38 0.00 -0.01 0.00 0.00 57.00 56.18 3hwc n GLN 1267Cb 0.06 -0.82 -0.06 0.00 1.02 0.00 0.00 30.24 30.44 3hwc n GLN 1267CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hwc s VAL 1268N -0.09 5.16 -0.12 5.09 1.01 -0.58 -2.22 120.40 128.66 3hwc s VAL 1268Ca 0.00 0.73 0.10 0.00 0.00 0.00 0.00 61.98 62.81 3hwc s VAL 1268Cb 0.00 -3.68 -0.14 0.00 0.00 0.00 0.00 36.38 32.56 3hwc s VAL 1268CO 0.00 0.51 0.03 0.49 0.00 0.00 0.00 175.10 176.13 3hwc n PHE 1269N 2.45 0.00 -3.60 5.22 3.72 0.92 -4.79 117.46 121.39 3hwc n PHE 1269Ca -0.13 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.18 3hwc n PHE 1269Cb 0.52 -0.57 -0.05 0.00 -0.94 0.00 0.00 39.48 38.44 3hwc n PHE 1269CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3hwc s HIS 1270N -2.28 -0.32 0.02 1.38 5.65 -1.13 -4.15 115.29 114.45 3hwc s HIS 1270Ca -0.06 0.60 -0.13 0.00 0.25 0.00 0.00 55.06 55.72 3hwc s HIS 1270Cb 0.03 0.45 0.02 0.00 -1.18 0.00 0.00 32.58 31.90 3hwc s HIS 1270CO 0.47 -0.27 0.27 0.96 -0.65 0.00 0.00 174.74 175.53 3hwc s ILE 1271N -0.86 0.08 0.00 0.89 -4.36 -1.25 -0.97 121.20 114.73 3hwc s ILE 1271Ca 0.01 -0.65 0.00 0.00 -0.26 0.00 0.00 60.65 59.75 3hwc s ILE 1271Cb -0.01 -0.79 0.00 0.00 1.25 0.00 0.00 42.46 42.91 3hwc s ILE 1271CO -0.02 -0.36 0.00 0.61 0.24 0.00 0.00 174.94 175.42 3hwc n GLY 1272N 0.89 3.07 3.21 6.27 0.00 -0.43 -0.06 105.19 118.14 3hwc n GLY 1272Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 3hwc n GLY 1272CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hwc s ASN 1273N -1.19 5.19 0.39 1.61 3.04 -1.26 -4.42 114.94 118.30 3hwc s ASN 1273Ca 0.00 -1.38 0.14 0.00 0.04 0.00 0.00 52.86 51.66 3hwc s ASN 1273Cb 0.00 -1.82 0.80 0.00 -1.54 0.00 0.00 41.25 38.69 3hwc s ASN 1273CO 0.00 -0.36 1.86 -0.65 -3.04 0.00 0.00 177.10 174.91 3hwc h PRO 1274N 8.13 0.00 -0.01 0.43 0.11 -1.88 -2.93 132.00 135.84 3hwc h PRO 1274Ca -0.21 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.83 3hwc h PRO 1274Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3hwc h PRO 1274CO 0.61 0.33 -0.35 0.93 -0.21 0.00 0.00 178.00 179.31 3hwc h GLU 1275N 0.00 0.03 0.00 1.05 4.39 -1.97 -2.29 114.58 115.78 3hwc h GLU 1275Ca -0.00 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.53 3hwc h GLU 1275Cb 0.60 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 3hwc h GLU 1275CO 0.04 0.38 -0.74 1.25 -1.16 0.00 0.00 179.01 178.78 3hwc h HIS 1276N 0.02 0.00 0.00 4.33 2.76 -1.88 -3.10 115.15 117.28 3hwc h HIS 1276Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3hwc h HIS 1276Cb 0.63 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.59 3hwc h HIS 1276CO 0.00 0.74 0.00 0.00 -1.30 0.00 0.00 177.93 177.37 3hwc n ALA 1277N -2.40 2.38 -0.05 5.26 0.00 -0.87 -3.28 120.51 121.56 3hwc n ALA 1277Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 53.44 53.32 3hwc n ALA 1277Cb 0.72 -1.28 -0.00 0.00 0.00 0.00 0.00 19.45 18.89 3hwc n ALA 1277CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3hwc h LYS 1278N 0.00 0.00 0.00 0.00 1.57 -1.54 -2.30 116.57 114.30 3hwc h LYS 1278Ca 0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 3hwc h LYS 1278Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 3hwc h LYS 1278CO 0.00 0.00 -2.11 1.28 -0.57 0.00 0.00 179.45 178.05 3hwc n LEU 1279N -4.72 0.00 0.06 2.94 4.77 -1.25 -4.43 117.00 114.37 3hwc n LEU 1279Ca -0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3hwc n LEU 1279Cb 0.00 0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.39 3hwc n LEU 1279CO 0.00 0.32 0.26 1.88 -1.33 0.00 0.00 177.39 178.51 3hwc h TYR 1280N 0.00 0.58 0.00 -1.77 -1.99 -1.82 -2.46 116.97 109.51 3hwc h TYR 1280Ca -0.35 -0.29 -0.04 0.00 2.00 0.00 0.00 58.73 60.06 3hwc h TYR 1280Cb 1.75 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 40.40 3hwc h TYR 1280CO 0.00 1.09 -0.17 -1.35 -0.00 0.00 0.00 178.16 177.72 3hwc h PRO 1281N 0.25 0.00 -0.62 4.88 0.11 -1.78 -2.05 132.00 132.78 3hwc h PRO 1281Ca -0.06 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.96 3hwc h PRO 1281Cb 1.46 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.55 3hwc h PRO 1281CO 0.15 0.17 0.03 1.96 -0.21 0.00 0.00 178.00 180.10 3hwc h GLN 1282N 0.00 1.08 -0.21 1.05 4.20 -1.67 -2.90 115.11 116.66 3hwc h GLN 1282Ca -0.00 -0.33 -0.13 0.00 0.06 0.00 0.00 58.65 58.25 3hwc h GLN 1282Cb 0.43 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3hwc h GLN 1282CO 0.02 1.03 -0.43 0.00 -0.67 0.00 0.00 178.83 178.78 3hwc h ARG 1283N 0.99 0.51 -0.81 1.46 3.08 -1.06 -2.80 114.38 115.74 3hwc h ARG 1283Ca 0.18 -0.27 0.14 0.00 0.07 0.00 0.00 59.98 60.10 3hwc h ARG 1283Cb 0.53 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.50 3hwc h ARG 1283CO 0.03 0.85 0.39 0.82 -1.07 0.00 0.00 179.97 180.99 3hwc h ILE 1284N 0.41 0.73 -0.00 2.04 1.08 -1.20 -2.43 117.51 118.14 3hwc h ILE 1284Ca 0.03 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 3hwc h ILE 1284Cb 0.93 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 34.78 3hwc h ILE 1284CO 0.08 0.11 -0.18 0.49 -0.69 0.00 0.00 178.15 177.95 3hwc n PHE 1285N -4.90 0.00 0.13 1.37 3.01 -1.07 -4.29 117.46 111.71 3hwc n PHE 1285Ca 0.16 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.46 3hwc n PHE 1285Cb 0.41 -0.19 -0.09 0.00 -0.01 0.00 0.00 39.48 39.59 3hwc n PHE 1285CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3hwc h ASP 1286N 0.67 -1.49 0.23 4.37 3.32 -1.25 -0.66 116.42 121.61 3hwc h ASP 1286Ca 0.00 0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.16 3hwc h ASP 1286Cb 0.42 0.54 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 3hwc h ASP 1286CO 0.00 -0.54 -0.21 -0.50 -1.72 0.00 0.00 179.24 176.27 3hwc h TRP 1287N -0.75 0.00 -0.11 4.55 4.06 -1.77 -1.54 115.95 120.39 3hwc h TRP 1287Ca -0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.92 3hwc h TRP 1287Cb 0.74 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.89 3hwc h TRP 1287CO -0.42 0.21 0.02 0.28 -3.56 0.00 0.00 178.44 174.96 3hwc h VAL 1288N 0.00 1.22 -0.94 1.49 2.07 -1.69 -1.27 116.25 117.13 3hwc h VAL 1288Ca -0.00 -0.69 0.08 0.00 0.82 0.00 0.00 66.70 66.91 3hwc h VAL 1288Cb 0.37 1.47 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 3hwc h VAL 1288CO 0.03 0.20 0.58 0.45 0.02 0.00 0.00 177.57 178.85 3hwc h HIS 1289N -0.05 1.07 -0.42 1.57 3.86 -0.35 0.01 115.15 120.84 3hwc h HIS 1289Ca 0.03 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.24 3hwc h HIS 1289Cb 0.30 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 3hwc h HIS 1289CO 0.02 0.50 0.15 -0.92 0.86 0.00 0.00 177.93 178.54 3hwc h TYR 1290N 1.01 0.66 -0.67 2.45 5.03 -1.18 -2.36 116.97 121.92 3hwc h TYR 1290Ca 0.43 -0.06 -0.01 0.00 2.58 0.00 0.00 58.73 61.67 3hwc h TYR 1290Cb 0.28 -0.19 -0.03 0.00 1.55 0.00 0.00 36.73 38.33 3hwc h TYR 1290CO -0.02 0.59 0.37 1.25 -1.32 0.00 0.00 178.16 179.03 3hwc h HIS 1291N 0.54 0.92 -0.59 -3.82 2.76 -0.41 -1.98 115.15 112.58 3hwc h HIS 1291Ca 0.14 -0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.36 3hwc h HIS 1291Cb 0.22 -0.30 -0.06 0.00 1.55 0.00 0.00 27.41 28.82 3hwc h HIS 1291CO 0.01 0.66 0.25 0.82 -1.30 0.00 0.00 177.93 178.36 3hwc h ILE 1292N 0.92 0.84 -0.40 6.26 2.04 -0.83 -1.08 117.51 125.25 3hwc h ILE 1292Ca 0.24 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.95 3hwc h ILE 1292Cb 0.04 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 3hwc h ILE 1292CO -0.04 0.08 0.24 0.25 0.00 0.00 0.00 178.15 178.69 3hwc h LEU 1293N 0.46 0.41 -0.81 1.44 6.46 -0.95 0.18 115.31 122.50 3hwc h LEU 1293Ca 0.28 -0.00 0.12 0.00 -0.12 0.00 0.00 57.88 58.16 3hwc h LEU 1293Cb 0.30 -0.09 -0.08 0.00 -0.73 0.00 0.00 40.66 40.06 3hwc h LEU 1293CO -0.26 0.29 0.42 0.40 -0.62 0.00 0.00 178.44 178.68 3hwc h ILE 1294N 0.50 0.80 -0.19 4.05 2.04 -0.70 -0.27 117.51 123.74 3hwc h ILE 1294Ca 0.16 -0.22 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 3hwc h ILE 1294Cb -0.01 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 3hwc h ILE 1294CO -0.06 0.12 -0.48 -0.09 0.00 0.00 0.00 178.15 177.63 3hwc h ARG 1295N 0.65 0.51 -0.13 2.37 2.43 -0.27 -2.78 114.38 117.16 3hwc h ARG 1295Ca 0.42 -0.29 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 3hwc h ARG 1295Cb 0.51 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3hwc h ARG 1295CO -0.31 0.88 -0.50 1.96 -1.51 0.00 0.00 179.97 180.49 3hwc h GLN 1296N 0.40 0.35 -0.25 0.20 4.20 0.24 -2.22 115.11 118.03 3hwc h GLN 1296Ca 0.02 -0.20 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 3hwc h GLN 1296Cb 1.00 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 3hwc h GLN 1296CO 0.09 0.77 -0.38 0.28 -0.67 0.00 0.00 178.83 178.92 3hwc h VAL 1297N 0.28 1.30 -0.32 -0.54 2.07 -0.97 -1.89 116.25 116.17 3hwc h VAL 1297Ca 0.01 -1.54 -0.04 0.00 0.82 0.00 0.00 66.70 65.95 3hwc h VAL 1297Cb 0.98 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 3hwc h VAL 1297CO 0.08 0.49 0.03 -0.07 0.02 0.00 0.00 177.57 178.12 3hwc h LEU 1298N 0.48 0.53 -0.78 2.57 3.38 -1.33 -1.70 115.31 118.47 3hwc h LEU 1298Ca 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 3hwc h LEU 1298Cb 0.88 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 3hwc h LEU 1298CO 0.08 0.68 0.43 -0.09 0.09 0.00 0.00 178.44 179.63 3hwc h ARG 1299N 0.37 1.10 -0.63 1.13 9.65 -1.32 0.28 114.38 124.96 3hwc h ARG 1299Ca 0.10 -0.13 -0.02 0.00 -1.10 0.00 0.00 59.98 58.82 3hwc h ARG 1299Cb 0.39 -0.21 -0.03 0.00 -1.39 0.00 0.00 29.97 28.73 3hwc h ARG 1299CO 0.01 0.81 0.29 0.00 2.80 0.00 0.00 179.97 183.88 3hwc h ALA 1300N 1.22 1.33 -0.30 2.80 0.00 -1.28 0.14 119.26 123.18 3hwc h ALA 1300Ca 0.28 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3hwc h ALA 1300Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hwc h ALA 1300CO -0.04 0.52 -0.04 1.49 0.00 0.00 0.00 179.25 181.17 3hwc h GLU 1301N 0.89 0.55 -0.48 0.00 4.81 -0.35 -2.48 114.58 117.51 3hwc h GLU 1301Ca 0.22 -0.19 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3hwc h GLU 1301Cb 0.11 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.41 3hwc h GLU 1301CO -0.03 0.72 0.25 1.25 -0.73 0.00 0.00 179.01 180.47 3hwc h LEU 1302N 0.32 0.36 -0.81 1.64 5.85 0.12 -2.29 115.31 120.51 3hwc h LEU 1302Ca 0.08 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3hwc h LEU 1302Cb 0.50 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 3hwc h LEU 1302CO 0.02 0.26 0.52 0.40 -0.34 0.00 0.00 178.44 179.30 3hwc h ILE 1303N 0.49 1.21 -0.35 4.05 2.04 -0.66 -0.49 117.51 123.80 3hwc h ILE 1303Ca 0.20 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.66 3hwc h ILE 1303Cb 0.10 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 3hwc h ILE 1303CO -0.14 0.21 0.22 0.58 0.00 0.00 0.00 178.15 179.03 3hwc h VAL 1304N 1.10 1.08 -0.26 1.67 2.07 -1.16 -2.08 116.25 118.66 3hwc h VAL 1304Ca 0.29 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.69 3hwc h VAL 1304Cb -0.11 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 3hwc h VAL 1304CO -0.06 0.08 0.06 1.23 0.02 0.00 0.00 177.57 178.91 3hwc h GLY 1305N 0.46 0.31 1.01 2.17 0.00 -0.76 -0.66 103.07 105.59 3hwc h GLY 1305Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3hwc h GLY 1305CO -0.04 0.00 0.49 1.41 0.00 0.00 0.00 176.54 178.41 3hwc h LEU 1306N 0.17 0.89 -0.64 3.11 3.38 -1.00 0.28 115.31 121.50 3hwc h LEU 1306Ca 0.12 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3hwc h LEU 1306Cb 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3hwc h LEU 1306CO -0.15 0.67 0.25 0.00 0.09 0.00 0.00 178.44 179.30 3hwc h ALA 1307N 1.27 0.84 0.11 1.53 0.00 -1.02 -0.48 119.26 121.51 3hwc h ALA 1307Ca 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3hwc h ALA 1307Cb -0.09 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3hwc h ALA 1307CO -0.06 0.46 -0.06 0.82 0.00 0.00 0.00 179.25 180.41 3hwc h ILE 1308N 0.91 0.98 0.25 0.00 2.04 -0.74 -2.29 117.51 118.65 3hwc h ILE 1308Ca 0.21 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3hwc h ILE 1308Cb 0.21 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3hwc h ILE 1308CO -0.02 0.09 -0.24 -0.07 0.00 0.00 0.00 178.15 177.91 3hwc h LEU 1309N -0.32 -0.64 -0.77 1.44 3.38 -0.67 0.10 115.31 117.82 3hwc h LEU 1309Ca -0.02 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 3hwc h LEU 1309Cb 0.26 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3hwc h LEU 1309CO 0.03 -0.35 -0.08 -0.29 0.09 0.00 0.00 178.44 177.83 3hwc h ILE 1310N -0.52 1.26 -0.17 1.22 6.09 -1.18 -0.40 117.51 123.81 3hwc h ILE 1310Ca -0.01 -1.16 -0.12 0.00 -1.37 0.00 0.00 64.86 62.20 3hwc h ILE 1310Cb 0.48 0.97 -0.01 0.00 0.47 0.00 0.00 36.82 38.73 3hwc h ILE 1310CO -0.05 0.40 -0.41 0.00 -3.07 0.00 0.00 178.15 175.02 3hwc h THR 1311N 0.77 1.31 -0.03 2.19 1.03 -1.24 -1.35 112.91 115.60 3hwc h THR 1311Ca 0.13 -1.56 -0.26 0.00 -0.01 0.00 0.00 66.41 64.71 3hwc h THR 1311Cb 0.58 1.64 0.02 0.00 -1.07 0.00 0.00 68.15 69.31 3hwc h THR 1311CO 0.04 0.48 -1.00 -0.33 -0.01 0.00 0.00 175.52 174.69 3hwc h GLU 1312N 0.32 0.72 -0.20 0.00 5.08 -0.63 -0.20 114.58 119.68 3hwc h GLU 1312Ca 0.03 -0.74 -0.10 0.00 -1.00 0.00 0.00 59.36 57.54 3hwc h GLU 1312Cb 0.87 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 3hwc h GLU 1312CO 0.07 1.32 -0.33 1.25 -1.00 0.00 0.00 179.01 180.33 3hwc h HIS 1313N 0.42 0.47 0.00 4.33 2.76 -0.91 -2.22 115.15 120.00 3hwc h HIS 1313Ca -0.12 -0.11 -0.04 0.00 -2.20 0.00 0.00 60.37 57.90 3hwc h HIS 1313Cb 1.65 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.50 3hwc h HIS 1313CO 0.10 0.69 -0.21 0.82 -1.30 0.00 0.00 177.93 178.03 3hwc h ILE 1314N 0.35 0.39 0.00 6.26 2.04 -1.33 -3.33 117.51 121.89 3hwc h ILE 1314Ca 0.04 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 64.53 3hwc h ILE 1314Cb 0.75 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 3hwc h ILE 1314CO 0.06 0.20 0.00 0.61 0.00 0.00 0.00 178.15 179.02 3hwc n GLY 1315N 0.85 0.60 0.86 5.37 0.00 -0.84 -4.65 105.19 107.39 3hwc n GLY 1315Ca 0.02 -0.79 0.10 0.00 0.00 0.00 0.00 46.02 45.35 3hwc n GLY 1315CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hwc n THR 1316N -3.10 0.21 0.24 2.61 5.66 -0.15 -4.59 114.28 115.17 3hwc n THR 1316Ca 0.00 -0.61 0.12 0.00 -3.05 0.00 0.00 64.05 60.51 3hwc n THR 1316Cb 0.20 1.22 0.56 0.00 -1.55 0.00 0.00 70.33 70.76 3hwc n THR 1316CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 3hwc h SER 1317N 3.78 0.00 1.66 1.09 4.64 -1.72 -3.01 113.55 119.99 3hwc h SER 1317Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3hwc h SER 1317Cb 0.83 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 3hwc h SER 1317CO 0.00 0.16 -0.34 0.11 -0.87 0.00 0.00 176.83 175.89 3hwc h LYS 1318N 0.00 0.00 -6.55 4.77 1.79 -1.89 -3.37 116.57 111.32 3hwc h LYS 1318Ca -0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 3hwc h LYS 1318Cb 0.63 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 31.33 3hwc h LYS 1318CO 0.02 0.03 1.01 1.28 -1.08 0.00 0.00 179.45 180.71 3hwc n LEU 1319N -2.98 3.81 -0.26 2.94 4.77 -1.14 -4.84 117.00 119.30 3hwc n LEU 1319Ca 0.02 1.03 0.04 0.00 -0.03 0.00 0.00 56.01 57.08 3hwc n LEU 1319Cb 0.55 -1.52 0.18 0.00 -2.33 0.00 0.00 43.42 40.29 3hwc n LEU 1319CO 0.36 0.08 1.04 -0.65 -1.33 0.00 0.00 177.39 176.89 3hwc h PRO 1320N 7.40 0.49 -0.21 3.23 0.11 -1.91 0.33 132.00 141.45 3hwc h PRO 1320Ca -0.45 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 3hwc h PRO 1320Cb 1.22 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3hwc h PRO 1320CO 0.94 0.33 -0.15 1.79 -0.21 0.00 0.00 178.00 180.70 3hwc h THR 1321N 0.51 1.21 0.02 -1.15 1.35 -1.96 -1.88 112.91 111.01 3hwc h THR 1321Ca 0.40 -0.96 -0.08 0.00 -0.55 0.00 0.00 66.41 65.22 3hwc h THR 1321Cb 0.55 1.22 0.01 0.00 -1.73 0.00 0.00 68.15 68.20 3hwc h THR 1321CO -0.36 0.30 -0.31 0.58 -0.25 0.00 0.00 175.52 175.48 3hwc h VAL 1322N 0.33 1.58 0.00 6.82 2.07 -1.46 -2.97 116.25 122.61 3hwc h VAL 1322Ca 0.06 -2.11 -0.03 0.00 0.82 0.00 0.00 66.70 65.43 3hwc h VAL 1322Cb 0.47 2.93 -0.00 0.00 -1.52 0.00 0.00 31.29 33.17 3hwc h VAL 1322CO 0.03 0.58 -0.16 0.77 0.02 0.00 0.00 177.57 178.80 3hwc h SER 1323N -0.54 0.00 -0.66 0.57 4.64 -0.99 -0.46 113.55 116.11 3hwc h SER 1323Ca -0.05 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 3hwc h SER 1323Cb 1.12 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.18 3hwc h SER 1323CO 0.06 0.16 0.28 0.00 -0.87 0.00 0.00 176.83 176.46 3hwc h ALA 1324N 1.84 0.85 -0.36 5.18 0.00 -1.37 -1.76 119.26 123.64 3hwc h ALA 1324Ca -0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 3hwc h ALA 1324Cb 0.32 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3hwc h ALA 1324CO 0.02 0.46 -0.19 0.00 0.00 0.00 0.00 179.25 179.53 3hwc h ARG 1325N 0.92 0.77 -0.72 0.00 3.08 -0.97 -2.62 114.38 114.84 3hwc h ARG 1325Ca 0.22 -0.34 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 3hwc h ARG 1325Cb 0.18 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 3hwc h ARG 1325CO -0.02 0.96 0.43 0.28 -1.07 0.00 0.00 179.97 180.55 3hwc h VAL 1326N 0.56 1.20 -0.36 2.04 2.07 -1.15 -1.66 116.25 118.95 3hwc h VAL 1326Ca 0.08 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3hwc h VAL 1326Cb 0.74 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3hwc h VAL 1326CO 0.06 0.21 0.16 0.00 0.02 0.00 0.00 177.57 178.02 3hwc h ALA 1327N 1.48 1.61 -0.64 1.67 0.00 -1.08 -0.70 119.26 121.60 3hwc h ALA 1327Ca 0.26 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3hwc h ALA 1327Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3hwc h ALA 1327CO -0.05 0.31 0.13 0.87 0.00 0.00 0.00 179.25 180.52 3hwc h LYS 1328N 0.50 1.03 -0.30 0.00 1.57 -0.95 -0.15 116.57 118.27 3hwc h LYS 1328Ca 0.13 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 3hwc h LYS 1328Cb 0.08 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3hwc h LYS 1328CO -0.02 0.93 0.03 -0.07 -0.57 0.00 0.00 179.45 179.75 3hwc h LEU 1329N 0.97 0.50 -1.17 2.94 4.07 -0.89 -0.93 115.31 120.79 3hwc h LEU 1329Ca 0.20 -0.28 0.04 0.00 0.08 0.00 0.00 57.88 57.92 3hwc h LEU 1329Cb 0.38 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 41.94 3hwc h LEU 1329CO 0.01 0.65 0.57 0.58 -1.08 0.00 0.00 178.44 179.17 3hwc h VAL 1330N 0.32 1.12 -0.75 1.22 2.07 -1.03 -2.10 116.25 117.10 3hwc h VAL 1330Ca 0.09 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3hwc h VAL 1330Cb 0.38 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 3hwc h VAL 1330CO 0.01 0.19 0.32 0.00 0.02 0.00 0.00 177.57 178.12 3hwc h ALA 1331N 1.50 0.98 -0.19 1.67 0.00 -0.53 -0.25 119.26 122.44 3hwc h ALA 1331Ca 0.35 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3hwc h ALA 1331Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hwc h ALA 1331CO -0.11 0.58 0.12 0.35 0.00 0.00 0.00 179.25 180.18 3hwc h PHE 1332N 1.08 0.24 -0.28 0.00 3.57 -0.55 -0.30 116.94 120.70 3hwc h PHE 1332Ca 0.25 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 3hwc h PHE 1332Cb 0.18 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 3hwc h PHE 1332CO 0.01 0.18 0.13 1.25 -2.23 0.00 0.00 178.31 177.66 3hwc h HIS 1333N 0.24 0.41 -0.42 0.41 2.76 -1.17 -0.52 115.15 116.87 3hwc h HIS 1333Ca 0.07 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.27 3hwc h HIS 1333Cb 0.00 -0.13 -0.05 0.00 1.55 0.00 0.00 27.41 28.79 3hwc h HIS 1333CO -0.06 0.38 0.15 -0.07 -1.30 0.00 0.00 177.93 177.03 3hwc h LEU 1334N 0.32 0.16 -0.35 0.26 4.07 -0.93 0.15 115.31 119.00 3hwc h LEU 1334Ca 0.10 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.11 3hwc h LEU 1334Cb 0.13 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 3hwc h LEU 1334CO -0.01 0.13 0.23 0.00 -1.08 0.00 0.00 178.44 177.70 3hwc h ALA 1335N 1.27 0.44 -0.20 1.53 0.00 -0.84 0.77 119.26 122.23 3hwc h ALA 1335Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3hwc h ALA 1335Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3hwc h ALA 1335CO -0.20 -0.09 0.12 0.52 0.00 0.00 0.00 179.25 179.61 3hwc h MET 1336N 0.46 0.26 -0.55 0.00 2.86 -0.76 -2.58 114.93 114.62 3hwc h MET 1336Ca 0.13 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 3hwc h MET 1336Cb -0.04 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 3hwc h MET 1336CO -0.03 0.20 0.25 0.37 1.06 0.00 0.00 176.91 178.76 3hwc h GLN 1337N 0.25 0.78 -0.53 1.72 4.15 -0.49 -2.45 115.11 118.54 3hwc h GLN 1337Ca 0.07 -0.10 -0.10 0.00 0.77 0.00 0.00 58.65 59.29 3hwc h GLN 1337Cb -0.00 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 3hwc h GLN 1337CO -0.01 0.61 -0.08 0.00 -1.93 0.00 0.00 178.83 177.41 3hwc h ALA 1338N 1.51 0.85 -0.82 3.38 0.00 -0.58 0.71 119.26 124.30 3hwc h ALA 1338Ca 0.19 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.79 3hwc h ALA 1338Cb 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3hwc h ALA 1338CO -0.02 0.65 0.54 0.45 0.00 0.00 0.00 179.25 180.87 3hwc h HIS 1339N 0.87 1.01 0.38 0.00 3.86 -1.10 -0.04 115.15 120.14 3hwc h HIS 1339Ca 0.14 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 3hwc h HIS 1339Cb 0.63 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.76 3hwc h HIS 1339CO 0.04 0.62 -0.18 1.25 0.86 0.00 0.00 177.93 180.51 3hwc h LEU 1340N 1.08 -0.44 0.01 2.43 5.85 -0.93 -1.61 115.31 121.71 3hwc h LEU 1340Ca 0.31 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 59.01 3hwc h LEU 1340Cb -0.07 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3hwc h LEU 1340CO -0.08 -0.23 -0.18 0.40 -0.34 0.00 0.00 178.44 178.01 3hwc h ILE 1341N -0.62 0.57 -0.85 4.05 1.08 -0.72 -2.60 117.51 118.43 3hwc h ILE 1341Ca -0.05 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.45 3hwc h ILE 1341Cb 0.45 0.57 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 3hwc h ILE 1341CO 0.09 0.00 0.56 0.00 -0.69 0.00 0.00 178.15 178.10 3hwc h ALA 1342N 0.60 1.48 -0.52 1.87 0.00 -0.99 -1.24 119.26 120.46 3hwc h ALA 1342Ca 0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3hwc h ALA 1342Cb 0.37 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3hwc h ALA 1342CO -0.16 0.44 0.04 0.66 0.00 0.00 0.00 179.25 180.23 3hwc h SER 1343N 1.05 0.82 0.90 0.00 4.64 -1.09 -2.33 113.55 117.54 3hwc h SER 1343Ca 0.34 -0.19 -0.09 0.00 -0.47 0.00 0.00 61.79 61.38 3hwc h SER 1343Cb 0.03 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 3hwc h SER 1343CO -0.10 0.86 -0.42 -0.33 -0.87 0.00 0.00 176.83 175.97 3hwc h GLU 1344N 0.80 0.00 0.00 4.77 5.08 -0.87 0.55 114.58 124.91 3hwc h GLU 1344Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3hwc h GLU 1344Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3hwc h GLU 1344CO 0.02 0.42 -0.51 0.93 -1.00 0.00 0.00 179.01 178.87 3hwc h GLU 1345N 0.00 0.00 -0.22 2.33 4.39 -1.09 -3.36 114.58 116.63 3hwc h GLU 1345Ca -0.00 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 3hwc h GLU 1345Cb 0.99 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 29.53 3hwc h GLU 1345CO 0.05 0.00 -0.51 0.25 -1.16 0.00 0.00 179.01 177.65 3hwc n THR 1346N -2.74 2.34 -1.48 1.13 -2.24 -0.90 -5.05 114.28 105.34 3hwc n THR 1346Ca 0.02 -3.41 -0.09 0.00 -2.27 0.00 0.00 64.05 58.31 3hwc n THR 1346Cb 0.52 -0.46 0.06 0.00 -2.10 0.00 0.00 70.33 68.35 3hwc n THR 1346CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hwc n GLY 1347N -1.03 -0.89 3.38 3.38 0.00 -1.19 -4.31 105.19 104.55 3hwc n GLY 1347Ca 0.27 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.41 3hwc n GLY 1347CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hwc s PHE 1348N -1.71 1.13 -0.05 1.61 -0.12 -0.39 -4.92 117.98 113.53 3hwc s PHE 1348Ca 0.23 -1.31 -0.04 0.00 -0.05 0.00 0.00 56.93 55.76 3hwc s PHE 1348Cb -0.01 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.04 3hwc s PHE 1348CO 0.16 -0.93 0.15 -1.01 -0.05 0.00 0.00 175.22 173.55 3hwc s HIS 1349N -3.58 3.54 0.77 3.49 3.76 -1.26 -0.09 115.29 121.92 3hwc s HIS 1349Ca 0.34 0.41 -0.08 0.00 -0.15 0.00 0.00 55.06 55.57 3hwc s HIS 1349Cb 0.02 -1.87 0.10 0.00 1.11 0.00 0.00 32.58 31.95 3hwc s HIS 1349CO 0.18 0.67 1.09 0.95 -0.85 0.00 0.00 174.74 176.79 3hwc s THR 1350N -1.19 2.17 0.43 1.30 -4.23 0.45 -4.92 115.64 109.64 3hwc s THR 1350Ca 0.22 -0.22 0.13 0.00 -1.18 0.00 0.00 61.69 60.63 3hwc s THR 1350Cb -0.12 -2.94 0.32 0.00 1.34 0.00 0.00 72.50 71.10 3hwc s THR 1350CO 0.12 0.00 1.98 0.11 -0.54 0.00 0.00 174.62 176.29 3hwc h LYS 1351N -0.86 0.44 0.00 3.99 6.56 -1.90 -1.07 116.57 123.72 3hwc h LYS 1351Ca -0.44 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.13 3hwc h LYS 1351Cb 1.30 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 3hwc h LYS 1351CO 0.54 0.29 0.00 0.41 -2.06 0.00 0.00 179.45 178.63 3hwc n GLY 1352N -1.51 -0.95 1.91 3.86 0.00 -1.24 -4.86 105.19 102.40 3hwc n GLY 1352Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3hwc n GLY 1352CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hwc n GLY 1353N 0.72 0.60 3.72 -0.02 0.00 -0.41 -5.01 105.19 104.80 3hwc n GLY 1353Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3hwc n GLY 1353CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hwc s ARG 1354N -0.11 4.51 -0.51 1.61 0.52 -1.26 -4.56 118.95 119.16 3hwc s ARG 1354Ca 0.00 1.13 -0.25 0.00 -0.52 0.00 0.00 55.73 56.09 3hwc s ARG 1354Cb 0.00 -3.43 0.03 0.00 0.52 0.00 0.00 34.95 32.08 3hwc s ARG 1354CO 0.00 0.09 0.94 -0.47 0.02 0.00 0.00 175.30 175.88 3hwc s TYR 1355N 0.60 2.85 -0.08 -0.53 6.14 0.62 -0.41 117.35 126.54 3hwc s TYR 1355Ca 0.43 0.20 -0.07 0.00 0.64 0.00 0.00 57.07 58.26 3hwc s TYR 1355Cb -0.20 -4.03 -0.04 0.00 0.42 0.00 0.00 41.96 38.11 3hwc s TYR 1355CO 0.23 -1.23 0.19 0.21 0.64 0.00 0.00 175.55 175.59 3hwc s LYS 1356N 3.88 3.51 1.05 4.97 2.20 0.87 -4.82 119.74 131.40 3hwc s LYS 1356Ca 0.34 -0.08 -0.12 0.00 -0.36 0.00 0.00 55.97 55.75 3hwc s LYS 1356Cb -0.11 -3.17 0.22 0.00 -1.51 0.00 0.00 37.83 33.25 3hwc s LYS 1356CO 0.23 0.74 1.07 -2.14 -0.36 0.00 0.00 175.35 174.89 3hwc s PRO 1357N -1.22 0.04 -0.53 4.03 0.02 -1.26 -1.26 135.00 134.82 3hwc s PRO 1357Ca 0.19 0.80 -0.29 0.00 0.02 0.00 0.00 61.00 61.72 3hwc s PRO 1357Cb -0.13 -1.67 0.03 0.00 0.02 0.00 0.00 34.50 32.75 3hwc s PRO 1357CO 0.08 -3.07 1.16 1.21 -0.33 0.00 0.00 177.00 176.06 3hwc s ASN 1358N -2.98 6.54 0.22 2.53 3.04 0.18 -4.67 114.94 119.78 3hwc s ASN 1358Ca 0.66 0.28 -0.08 0.00 0.04 0.00 0.00 52.86 53.77 3hwc s ASN 1358Cb -0.22 -2.55 0.17 0.00 -1.54 0.00 0.00 41.25 37.11 3hwc s ASN 1358CO 0.60 -1.37 1.79 -0.65 -3.04 0.00 0.00 177.10 174.44 3hwc h PRO 1359N 9.39 1.21 -0.79 0.43 0.11 -1.92 -2.06 132.00 138.37 3hwc h PRO 1359Ca -0.24 -0.21 0.14 0.00 0.11 0.00 0.00 66.00 65.80 3hwc h PRO 1359Cb 1.06 -0.20 -0.09 0.00 0.11 0.00 0.00 31.00 31.87 3hwc h PRO 1359CO 1.16 0.97 0.35 1.25 -0.21 0.00 0.00 178.00 181.52 3hwc h LEU 1360N 1.19 0.38 0.02 2.35 5.85 -1.99 0.15 115.31 123.26 3hwc h LEU 1360Ca 0.27 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 59.04 3hwc h LEU 1360Cb 0.19 0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.28 3hwc h LEU 1360CO -0.03 0.15 -0.23 0.40 -0.34 0.00 0.00 178.44 178.40 3hwc h ILE 1361N 0.51 1.61 0.00 4.05 2.04 -1.83 -2.74 117.51 121.16 3hwc h ILE 1361Ca 0.43 -2.10 -0.04 0.00 1.00 0.00 0.00 64.86 64.15 3hwc h ILE 1361Cb 0.63 2.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 3hwc h ILE 1361CO -0.38 0.57 -0.19 0.10 0.00 0.00 0.00 178.15 178.24 3hwc h TYR 1362N -0.64 0.00 -0.00 1.37 -0.00 -1.24 0.59 116.97 117.05 3hwc h TYR 1362Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 58.73 58.45 3hwc h TYR 1362Cb 1.06 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.80 3hwc h TYR 1362CO 0.21 0.19 -1.00 -0.44 -0.00 0.00 0.00 178.16 177.12 3hwc h ASP 1363N 0.00 0.76 0.67 0.10 3.32 -0.79 -0.90 116.42 119.57 3hwc h ASP 1363Ca -0.00 -0.61 -0.09 0.00 0.02 0.00 0.00 57.03 56.36 3hwc h ASP 1363Cb 0.81 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3hwc h ASP 1363CO 0.02 1.41 -0.41 -0.26 -1.72 0.00 0.00 179.24 178.28 3hwc h PHE 1364N 0.33 0.00 0.30 4.55 0.04 -1.33 -1.75 116.94 119.08 3hwc h PHE 1364Ca -0.11 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 3hwc h PHE 1364Cb 1.65 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.79 3hwc h PHE 1364CO 0.08 0.41 -0.19 0.78 -0.60 0.00 0.00 178.31 178.80 3hwc h GLY 1365N 1.75 -0.48 0.48 -1.45 0.00 -0.73 -0.53 103.07 102.10 3hwc h GLY 1365Ca -0.00 0.21 0.07 0.00 0.00 0.00 0.00 47.33 47.60 3hwc h GLY 1365CO 0.05 -0.19 0.14 3.21 0.00 0.00 0.00 176.54 179.75 3hwc h ARG 1366N -0.47 0.28 -0.86 4.80 3.08 -0.99 -2.09 114.38 118.12 3hwc h ARG 1366Ca -0.03 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.08 3hwc h ARG 1366Cb 0.39 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.31 3hwc h ARG 1366CO 0.03 0.19 0.52 0.00 -1.07 0.00 0.00 179.97 179.64 3hwc h ALA 1367N 1.34 1.22 -0.51 0.04 0.00 -1.14 -0.23 119.26 119.98 3hwc h ALA 1367Ca 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3hwc h ALA 1367Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3hwc h ALA 1367CO -0.27 0.20 0.27 1.25 0.00 0.00 0.00 179.25 180.71 3hwc h HIS 1368N 0.91 0.67 -0.12 0.00 -0.00 -0.43 -1.22 115.15 114.96 3hwc h HIS 1368Ca 0.40 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.69 3hwc h HIS 1368Cb 0.28 -0.22 0.00 0.00 -0.00 0.00 0.00 27.41 27.47 3hwc h HIS 1368CO -0.04 0.48 -0.22 0.35 -0.00 0.00 0.00 177.93 178.50 3hwc h PHE 1369N 0.70 0.45 -0.49 5.26 3.57 -0.78 -2.84 116.94 122.81 3hwc h PHE 1369Ca 0.18 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3hwc h PHE 1369Cb 0.03 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 3hwc h PHE 1369CO 0.00 0.83 0.25 -0.07 -2.23 0.00 0.00 178.31 177.09 3hwc h LEU 1370N -0.06 0.61 -0.12 0.59 4.07 -0.66 0.74 115.31 120.48 3hwc h LEU 1370Ca 0.01 -0.05 -0.24 0.00 0.08 0.00 0.00 57.88 57.68 3hwc h LEU 1370Cb 0.80 -0.15 0.01 0.00 1.08 0.00 0.00 40.66 42.39 3hwc h LEU 1370CO 0.05 0.51 -0.91 1.56 -1.08 0.00 0.00 178.44 178.57 3hwc h GLN 1371N 0.69 0.68 -0.01 1.13 4.20 -1.29 -3.35 115.11 117.15 3hwc h GLN 1371Ca 0.17 -0.64 0.00 0.00 0.06 0.00 0.00 58.65 58.24 3hwc h GLN 1371Cb 0.05 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.00 3hwc h GLN 1371CO -0.03 1.24 -0.70 0.09 -0.67 0.00 0.00 178.83 178.77 3hwc n ASN 1372N -3.87 1.55 -0.06 1.46 4.13 -1.05 -4.50 115.26 112.93 3hwc n ASN 1372Ca -0.09 -1.27 0.06 0.00 1.68 0.00 0.00 54.58 54.97 3hwc n ASN 1372Cb 0.81 0.69 0.42 0.00 -1.54 0.00 0.00 39.78 40.16 3hwc n ASN 1372CO 0.00 0.00 0.00 0.06 0.28 0.00 0.00 177.26 177.60 3hwc h GLN 1373N 1.34 0.57 -0.10 3.52 3.07 -1.00 -1.85 115.11 120.67 3hwc h GLN 1373Ca 0.00 -0.03 -0.07 0.00 0.09 0.00 0.00 58.65 58.63 3hwc h GLN 1373Cb 0.64 -0.13 0.00 0.00 0.08 0.00 0.00 27.48 28.07 3hwc h GLN 1373CO 0.00 0.38 -0.21 1.98 0.09 0.00 0.00 178.83 181.06 3hwc h MET 1374N 0.59 0.33 -0.47 0.06 4.05 -1.83 -2.20 114.93 115.45 3hwc h MET 1374Ca 0.21 -0.21 -0.03 0.00 -0.28 0.00 0.00 59.70 59.39 3hwc h MET 1374Cb 0.12 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.92 3hwc h MET 1374CO -0.06 0.81 0.18 0.66 0.23 0.00 0.00 176.91 178.73 3hwc h SER 1375N -0.12 0.67 0.70 1.39 4.64 -1.76 -1.50 113.55 117.57 3hwc h SER 1375Ca 0.00 -0.18 -0.06 0.00 -0.47 0.00 0.00 61.79 61.08 3hwc h SER 1375Cb 0.81 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 3hwc h SER 1375CO 0.05 0.67 -0.29 -0.37 -0.87 0.00 0.00 176.83 176.01 3hwc h VAL 1376N 0.63 0.79 -0.00 0.95 -1.51 -1.40 -1.47 116.25 114.24 3hwc h VAL 1376Ca 0.16 -1.20 -0.00 0.00 -1.23 0.00 0.00 66.70 64.42 3hwc h VAL 1376Cb 0.22 1.75 -0.00 0.00 -2.13 0.00 0.00 31.29 31.12 3hwc h VAL 1376CO -0.01 0.29 0.00 -0.03 -1.23 0.00 0.00 177.57 176.59 3hwc h MET 1377N 0.00 0.00 -0.62 5.19 -1.53 -1.00 -2.31 114.93 114.66 3hwc h MET 1377Ca -0.00 -0.00 0.08 0.00 -3.44 0.00 0.00 59.70 56.34 3hwc h MET 1377Cb 0.72 -0.00 -0.06 0.00 -0.55 0.00 0.00 31.60 31.71 3hwc h MET 1377CO 0.04 0.22 0.29 -0.92 0.14 0.00 0.00 176.91 176.68 3hwc h TYR 1378N -0.22 0.51 -0.85 1.39 3.20 -0.84 -0.92 116.97 119.24 3hwc h TYR 1378Ca 0.00 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.91 3hwc h TYR 1378Cb 0.22 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 3hwc h TYR 1378CO -0.00 0.19 0.57 0.93 -1.64 0.00 0.00 178.16 178.20 3hwc h GLU 1379N 0.51 1.12 -0.15 1.82 4.39 -1.24 0.20 114.58 121.23 3hwc h GLU 1379Ca 0.30 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.93 3hwc h GLU 1379Cb 0.30 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 3hwc h GLU 1379CO -0.25 0.74 0.09 1.25 -1.16 0.00 0.00 179.01 179.68 3hwc h LEU 1380N 1.16 0.19 -0.48 1.33 6.46 -0.73 -0.85 115.31 122.38 3hwc h LEU 1380Ca 0.31 -0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 57.92 3hwc h LEU 1380Cb -0.13 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.73 3hwc h LEU 1380CO -0.07 0.19 -0.07 -0.07 -0.62 0.00 0.00 178.44 177.81 3hwc h LEU 1381N 0.16 0.89 -1.16 2.25 3.38 -0.77 -0.85 115.31 119.21 3hwc h LEU 1381Ca 0.05 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 3hwc h LEU 1381Cb 0.05 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3hwc h LEU 1381CO -0.01 1.02 -0.07 -0.78 0.09 0.00 0.00 178.44 178.68 3hwc h ASP 1382N 0.74 0.47 0.35 -0.43 3.58 -0.55 -2.05 116.42 118.54 3hwc h ASP 1382Ca 0.13 -0.11 -0.14 0.00 0.42 0.00 0.00 57.03 57.33 3hwc h ASP 1382Cb 0.60 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 3hwc h ASP 1382CO 0.04 0.59 -0.58 -0.07 -2.88 0.00 0.00 179.24 176.34 3hwc h LEU 1383N 0.47 0.26 -0.31 2.28 4.07 -0.77 -3.24 115.31 118.07 3hwc h LEU 1383Ca 0.09 -0.14 -0.17 0.00 0.08 0.00 0.00 57.88 57.74 3hwc h LEU 1383Cb 0.42 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 3hwc h LEU 1383CO 0.02 0.78 -0.80 0.00 -1.08 0.00 0.00 178.44 177.37 3hwc h ALA 1384N 1.22 0.62 -0.36 1.53 0.00 -0.65 -3.44 119.26 118.17 3hwc h ALA 1384Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3hwc h ALA 1384Cb 1.07 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3hwc h ALA 1384CO 0.09 1.00 0.00 0.41 0.00 0.00 0.00 179.25 180.75 3hwc n GLY 1385N 0.91 1.29 0.00 0.00 0.00 -0.82 -3.02 105.19 103.55 3hwc n GLY 1385Ca -0.00 -0.73 0.10 0.00 0.00 0.00 0.00 46.02 45.39 3hwc n GLY 1385CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3hwc n ARG 1386N 12.52 0.08 0.28 1.61 0.00 -1.26 -3.67 116.66 126.22 3hwc n ARG 1386Ca 0.00 0.13 0.13 0.00 -0.00 0.00 0.00 57.85 58.11 3hwc n ARG 1386Cb 0.00 -1.50 0.82 0.00 -0.00 0.00 0.00 32.46 31.78 3hwc n ARG 1386CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 3hwc h SER 1387N 0.00 0.00 -0.25 2.89 0.02 -1.85 0.46 113.55 114.82 3hwc h SER 1387Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hwc h SER 1387Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3hwc h SER 1387CO 0.00 0.04 0.00 -1.54 -1.14 0.00 0.00 176.83 174.19 3hwc n SER 1388N -3.91 2.44 0.04 3.07 3.41 -1.24 -4.45 113.62 112.98 3hwc n SER 1388Ca -0.03 -1.84 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 3hwc n SER 1388Cb 0.12 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 3hwc n SER 1388CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3hwc n LEU 1389N 0.84 0.31 -3.68 1.04 -0.00 -0.08 -4.58 117.00 110.85 3hwc n LEU 1389Ca 0.17 0.14 -0.43 0.00 -0.00 0.00 0.00 56.01 55.90 3hwc n LEU 1389Cb 0.45 -0.02 -0.03 0.00 -0.00 0.00 0.00 43.42 43.83 3hwc n LEU 1389CO 0.14 -0.64 2.43 0.23 -0.00 0.00 0.00 177.39 179.55 3hwc n MET 1390N -3.00 2.23 -3.63 1.96 2.81 0.14 -4.90 117.12 112.73 3hwc n MET 1390Ca 0.00 -2.25 -0.38 0.00 -1.81 0.00 0.00 57.70 53.26 3hwc n MET 1390Cb 0.00 -3.11 -0.11 0.00 -0.71 0.00 0.00 33.22 29.28 3hwc n MET 1390CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3hwc s ILE 1391N 4.03 4.87 -0.03 2.02 1.01 -1.26 -4.81 121.20 127.03 3hwc s ILE 1391Ca 0.52 -0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.67 3hwc s ILE 1391Cb 0.14 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 3hwc s ILE 1391CO 0.01 0.14 1.42 -2.84 0.00 0.00 0.00 174.94 173.66 3hwc s PRO 1392N 1.67 4.26 1.20 2.79 0.02 -1.26 -5.00 135.00 138.68 3hwc s PRO 1392Ca 0.06 1.96 -0.15 0.00 0.02 0.00 0.00 61.00 62.88 3hwc s PRO 1392Cb -0.17 -3.66 0.29 0.00 0.02 0.00 0.00 34.50 30.99 3hwc s PRO 1392CO 0.08 -0.63 1.03 -1.54 -0.33 0.00 0.00 177.00 175.60 3hwc s SER 1393N 2.11 0.78 0.13 2.53 1.04 -1.26 -4.70 113.70 114.33 3hwc s SER 1393Ca 0.64 1.20 -0.22 0.00 0.48 0.00 0.00 55.95 58.05 3hwc s SER 1393Cb -0.30 -1.84 -0.02 0.00 0.10 0.00 0.00 66.02 63.96 3hwc s SER 1393CO 0.25 -4.28 1.68 -0.08 0.98 0.00 0.00 173.24 171.79 3hwc h GLU 1394N -2.68 -0.13 -0.81 4.02 4.57 -1.94 -1.92 114.58 115.68 3hwc h GLU 1394Ca -0.56 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 57.73 3hwc h GLU 1394Cb 1.33 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 29.90 3hwc h GLU 1394CO 0.46 -0.09 0.53 0.78 -1.18 0.00 0.00 179.01 179.51 3hwc h GLY 1395N -0.14 1.07 1.53 1.92 0.00 -1.98 0.33 103.07 105.81 3hwc h GLY 1395Ca 0.09 -0.30 -0.21 0.00 0.00 0.00 0.00 47.33 46.91 3hwc h GLY 1395CO -0.23 0.17 -0.83 1.46 0.00 0.00 0.00 176.54 177.12 3hwc h GLN 1396N 0.74 0.44 -0.33 4.80 4.20 -1.82 -2.14 115.11 121.00 3hwc h GLN 1396Ca 0.38 -0.41 -0.15 0.00 0.06 0.00 0.00 58.65 58.53 3hwc h GLN 1396Cb 0.47 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 3hwc h GLN 1396CO -0.15 1.05 -0.39 2.35 -0.67 0.00 0.00 178.83 181.03 3hwc h TRP 1397N 0.28 0.95 0.00 2.96 2.91 -0.50 -3.13 115.95 119.42 3hwc h TRP 1397Ca -0.05 -0.28 0.00 0.00 1.13 0.00 0.00 58.89 59.69 3hwc h TRP 1397Cb 1.43 -0.20 0.00 0.00 -0.51 0.00 0.00 29.16 29.88 3hwc h TRP 1397CO 0.05 1.06 -0.11 -0.25 -1.03 0.00 0.00 178.44 178.16 3hwc n ASP 1398N -4.05 0.68 -4.60 2.65 8.00 0.01 -4.46 116.55 114.79 3hwc n ASP 1398Ca -0.02 0.47 -0.49 0.00 0.71 0.00 0.00 54.79 55.47 3hwc n ASP 1398Cb 0.53 -0.58 -0.04 0.00 -0.02 0.00 0.00 41.12 41.01 3hwc n ASP 1398CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3hwc n ASP 1399N -2.12 1.73 0.08 -2.24 -0.08 -0.81 -4.84 116.55 108.28 3hwc n ASP 1399Ca 0.05 1.13 -0.07 0.00 -1.51 0.00 0.00 54.79 54.39 3hwc n ASP 1399Cb 0.42 -1.26 0.05 0.00 2.34 0.00 0.00 41.12 42.68 3hwc n ASP 1399CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3hwc h SER 1400N 3.92 0.31 0.28 1.67 4.64 -1.91 -0.67 113.55 121.79 3hwc h SER 1400Ca -0.45 -0.21 -0.34 0.00 -0.47 0.00 0.00 61.79 60.33 3hwc h SER 1400Cb 1.33 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3hwc h SER 1400CO 0.74 0.93 -1.67 1.56 -0.87 0.00 0.00 176.83 177.53 3hwc h GLN 1401N 0.17 0.36 0.00 4.77 4.20 -1.98 -3.43 115.11 119.21 3hwc h GLN 1401Ca -0.03 -0.61 -0.07 0.00 0.06 0.00 0.00 58.65 58.00 3hwc h GLN 1401Cb 1.30 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 29.29 3hwc h GLN 1401CO 0.12 1.26 -1.30 0.43 -0.67 0.00 0.00 178.83 178.66 3hwc n SER 1402N -3.55 3.83 -0.26 1.46 7.64 -1.24 -4.71 113.62 116.78 3hwc n SER 1402Ca -0.21 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.75 3hwc n SER 1402Cb 1.07 0.75 0.17 0.00 -1.01 0.00 0.00 64.21 65.19 3hwc n SER 1402CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hwc n GLY 1403N 2.60 -1.12 0.40 0.23 0.00 -0.26 0.11 105.19 107.14 3hwc n GLY 1403Ca -0.06 0.76 0.28 0.00 0.00 0.00 0.00 46.02 47.00 3hwc n GLY 1403CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3hwc h GLN 1404N 0.00 0.25 -0.47 1.61 3.07 -1.83 0.13 115.11 117.87 3hwc h GLN 1404Ca 0.41 -0.01 -0.11 0.00 0.09 0.00 0.00 58.65 59.03 3hwc h GLN 1404Cb 0.77 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 28.25 3hwc h GLN 1404CO -0.73 0.16 -0.14 -1.49 0.09 0.00 0.00 178.83 176.72 3hwc h TRP 1405N 0.25 0.99 -0.34 0.06 4.06 0.38 -1.79 115.95 119.56 3hwc h TRP 1405Ca 0.73 -0.20 -0.11 0.00 2.06 0.00 0.00 58.89 61.37 3hwc h TRP 1405Cb 1.95 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 29.85 3hwc h TRP 1405CO -0.01 0.96 -0.22 0.74 -3.56 0.00 0.00 178.44 176.35 3hwc h PHE 1406N 0.79 0.74 -0.42 0.49 -1.00 -1.06 -0.57 116.94 115.92 3hwc h PHE 1406Ca 0.12 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.72 3hwc h PHE 1406Cb 0.66 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.02 3hwc h PHE 1406CO 0.04 0.83 0.19 0.28 -1.61 0.00 0.00 178.31 178.04 3hwc h VAL 1407N 0.58 1.18 0.00 -0.55 2.07 -1.15 -1.20 116.25 117.18 3hwc h VAL 1407Ca 0.08 -0.53 -0.08 0.00 0.82 0.00 0.00 66.70 66.99 3hwc h VAL 1407Cb 0.69 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3hwc h VAL 1407CO 0.05 0.20 -0.36 0.50 0.02 0.00 0.00 177.57 177.98 3hwc h LYS 1408N 0.54 0.00 -0.22 1.57 3.11 -1.16 -2.53 116.57 117.88 3hwc h LYS 1408Ca 0.14 0.00 -0.17 0.00 -2.81 0.00 0.00 60.65 57.81 3hwc h LYS 1408Cb 0.14 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.36 3hwc h LYS 1408CO -0.02 0.36 -0.56 1.25 -2.81 0.00 0.00 179.45 177.68 3hwc h LEU 1409N 0.00 0.77 -2.37 5.20 5.85 -0.58 -3.16 115.31 121.01 3hwc h LEU 1409Ca -0.00 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3hwc h LEU 1409Cb 0.72 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.53 3hwc h LEU 1409CO 0.05 1.17 0.00 0.59 -0.34 0.00 0.00 178.44 179.90 3hwc n ASN 1410N -3.97 3.45 -4.74 1.25 3.02 -0.50 -4.93 115.26 108.83 3hwc n ASN 1410Ca -0.04 -1.99 -0.41 0.00 -0.03 0.00 0.00 54.58 52.11 3hwc n ASN 1410Cb 0.62 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 39.33 3hwc n ASN 1410CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hwc s ASN 1411N -1.05 7.32 0.26 6.41 2.47 -0.97 -4.29 114.94 125.09 3hwc s ASN 1411Ca 0.43 2.08 0.05 0.00 0.42 0.00 0.00 52.86 55.84 3hwc s ASN 1411Cb 0.23 -2.61 -0.02 0.00 -1.45 0.00 0.00 41.25 37.40 3hwc s ASN 1411CO 0.30 -0.17 0.18 0.61 -3.72 0.00 0.00 177.10 174.30 3hwc n GLY 1412N 1.90 3.28 0.14 1.21 0.00 -1.26 -4.99 105.19 105.47 3hwc n GLY 1412Ca 0.02 -1.90 0.07 0.00 0.00 0.00 0.00 46.02 44.20 3hwc n GLY 1412CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hwc n PRO 1413N -0.53 0.09 -0.04 1.61 -0.02 -1.25 -0.60 135.00 134.25 3hwc n PRO 1413Ca 0.03 0.56 0.02 0.00 -2.02 0.00 0.00 63.50 62.08 3hwc n PRO 1413Cb 0.45 -2.01 0.04 0.00 -0.02 0.00 0.00 33.50 31.96 3hwc n PRO 1413CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3hwc n LYS 1414N -2.01 2.50 0.00 -0.52 5.02 -1.26 -5.10 118.16 116.80 3hwc n LYS 1414Ca -0.01 -1.53 0.00 0.00 -2.02 0.00 0.00 58.31 54.75 3hwc n LYS 1414Cb 0.24 -1.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 3hwc n LYS 1414CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hwc n GLY 1415N -0.16 1.31 3.74 0.72 0.00 0.23 -4.94 105.19 106.09 3hwc n GLY 1415Ca 0.03 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.18 3hwc n GLY 1415CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hwc n ASN 1416N -1.78 -3.20 -0.33 1.61 3.02 -1.26 -4.33 115.26 108.99 3hwc n ASN 1416Ca 0.00 -0.97 0.23 0.00 -0.03 0.00 0.00 54.58 53.82 3hwc n ASN 1416Cb 0.00 -3.49 0.46 0.00 -0.61 0.00 0.00 39.78 36.14 3hwc n ASN 1416CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3hwc h PRO 1417N -1.84 0.29 -0.32 3.52 0.11 -1.88 0.32 132.00 132.20 3hwc h PRO 1417Ca -0.64 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.54 3hwc h PRO 1417Cb 1.36 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3hwc h PRO 1417CO 0.53 0.19 0.27 0.00 -0.21 0.00 0.00 178.00 178.79 3hwc h ARG 1418N 0.30 0.00 -0.36 1.05 2.47 -1.88 -2.42 114.38 113.54 3hwc h ARG 1418Ca 0.72 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 59.32 3hwc h ARG 1418Cb 1.65 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.96 3hwc h ARG 1418CO -0.62 0.00 -0.29 0.93 0.56 0.00 0.00 179.97 180.55 3hwc h GLU 1419N 0.00 0.76 -0.94 0.04 5.08 -1.26 -1.87 114.58 116.39 3hwc h GLU 1419Ca 0.15 -0.34 0.11 0.00 -1.00 0.00 0.00 59.36 58.29 3hwc h GLU 1419Cb 0.69 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.84 3hwc h GLU 1419CO -0.00 0.95 0.57 -0.09 -1.00 0.00 0.00 179.01 179.44 3hwc h ARG 1420N 0.65 0.88 -0.31 2.33 9.65 -1.58 0.86 114.38 126.86 3hwc h ARG 1420Ca 0.08 -0.05 -0.13 0.00 -1.10 0.00 0.00 59.98 58.77 3hwc h ARG 1420Cb 0.81 -0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 29.19 3hwc h ARG 1420CO 0.07 0.58 -0.32 0.28 2.80 0.00 0.00 179.97 183.39 3hwc h VAL 1421N 0.91 1.29 -0.35 0.20 2.07 -1.57 -1.08 116.25 117.73 3hwc h VAL 1421Ca 0.46 -1.49 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 3hwc h VAL 1421Cb 0.45 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 3hwc h VAL 1421CO -0.26 0.48 0.06 1.56 0.02 0.00 0.00 177.57 179.43 3hwc h GLN 1422N 0.53 0.57 -0.34 1.57 4.20 -0.49 -0.11 115.11 121.04 3hwc h GLN 1422Ca 0.05 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 3hwc h GLN 1422Cb 0.89 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 3hwc h GLN 1422CO 0.08 0.64 0.04 0.82 -0.67 0.00 0.00 178.83 179.74 3hwc h ILE 1423N 0.41 1.24 -0.94 2.54 2.04 -0.93 -2.93 117.51 118.94 3hwc h ILE 1423Ca 0.11 -0.86 0.05 0.00 1.00 0.00 0.00 64.86 65.16 3hwc h ILE 1423Cb 0.34 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 3hwc h ILE 1423CO 0.01 0.28 0.61 1.23 0.00 0.00 0.00 178.15 180.28 3hwc h GLY 1424N 0.39 1.38 1.29 5.37 0.00 -0.95 -1.84 103.07 108.71 3hwc h GLY 1424Ca 0.10 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 3hwc h GLY 1424CO 0.01 0.36 -0.28 3.21 0.00 0.00 0.00 176.54 179.84 3hwc h ARG 1425N 1.14 0.80 -0.61 4.80 3.08 -0.98 -1.38 114.38 121.24 3hwc h ARG 1425Ca 0.39 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 3hwc h ARG 1425Cb 0.09 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3hwc h ARG 1425CO -0.13 0.99 0.17 0.28 -1.07 0.00 0.00 179.97 180.20 3hwc h VAL 1426N 0.69 1.25 -0.39 2.04 2.07 -1.23 -1.74 116.25 118.93 3hwc h VAL 1426Ca 0.08 -0.87 -0.10 0.00 0.82 0.00 0.00 66.70 66.63 3hwc h VAL 1426Cb 0.82 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3hwc h VAL 1426CO 0.07 0.33 -0.15 0.40 0.02 0.00 0.00 177.57 178.24 3hwc h ILE 1427N 0.88 1.28 -0.67 4.57 2.04 -1.25 -2.13 117.51 122.22 3hwc h ILE 1427Ca 0.19 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 3hwc h ILE 1427Cb 0.32 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 3hwc h ILE 1427CO -0.00 0.42 0.38 -0.09 0.00 0.00 0.00 178.15 178.86 3hwc h ARG 1428N 0.60 0.93 -0.65 2.37 2.43 -1.14 -1.54 114.38 117.38 3hwc h ARG 1428Ca 0.09 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3hwc h ARG 1428Cb 0.69 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 3hwc h ARG 1428CO 0.05 0.69 0.25 -0.44 -1.51 0.00 0.00 179.97 179.01 3hwc h ASP 1429N 0.92 0.91 -0.52 -3.80 3.45 -1.25 0.35 116.42 116.47 3hwc h ASP 1429Ca 0.24 -0.18 -0.05 0.00 0.43 0.00 0.00 57.03 57.47 3hwc h ASP 1429Cb 0.02 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.53 3hwc h ASP 1429CO -0.04 0.84 0.14 -0.07 -1.57 0.00 0.00 179.24 178.54 3hwc h LEU 1430N 0.92 0.77 -0.20 1.55 4.07 -0.99 -3.24 115.31 118.20 3hwc h LEU 1430Ca 0.21 -0.22 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3hwc h LEU 1430Cb 0.23 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.76 3hwc h LEU 1430CO -0.02 0.79 0.00 -1.22 -1.08 0.00 0.00 178.44 176.91 3hwc n TYR 1431N -4.46 0.00 -1.23 1.13 4.02 -0.62 -4.31 117.16 111.70 3hwc n TYR 1431Ca 0.02 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.00 3hwc n TYR 1431Cb 0.21 0.00 0.15 0.00 -0.02 0.00 0.00 39.34 39.69 3hwc n TYR 1431CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3hwc n LEU 1432N -0.31 2.38 -4.26 7.72 4.32 0.12 -4.83 117.00 122.15 3hwc n LEU 1432Ca 0.00 -3.24 -0.14 0.00 -0.02 0.00 0.00 56.01 52.61 3hwc n LEU 1432Cb 0.05 -0.44 -0.10 0.00 -1.62 0.00 0.00 43.42 41.31 3hwc n LEU 1432CO 0.00 0.87 -0.35 0.42 -1.22 0.00 0.00 177.39 177.11 3hwc s THR 1433N -2.89 0.86 0.21 -5.08 -4.23 -1.11 -4.89 115.64 98.51 3hwc s THR 1433Ca 0.33 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 3hwc s THR 1433Cb 0.30 -2.09 0.01 0.00 1.34 0.00 0.00 72.50 72.06 3hwc s THR 1433CO 0.00 -0.52 1.60 -2.24 -0.54 0.00 0.00 174.62 172.93 3hwc h ASP 1434N 2.67 0.72 -0.80 3.99 -0.00 -1.92 -0.97 116.42 120.11 3hwc h ASP 1434Ca -0.37 -0.29 0.12 0.00 -0.00 0.00 0.00 57.03 56.49 3hwc h ASP 1434Cb 1.20 -0.20 -0.08 0.00 -0.00 0.00 0.00 39.33 40.25 3hwc h ASP 1434CO 0.63 0.98 0.41 -0.25 -0.00 0.00 0.00 179.24 181.02 3hwc h TRP 1435N 0.59 0.73 -0.19 4.15 7.01 -1.88 -0.78 115.95 125.58 3hwc h TRP 1435Ca 0.07 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.00 3hwc h TRP 1435Cb 0.83 -0.21 -0.00 0.00 -2.10 0.00 0.00 29.16 27.68 3hwc h TRP 1435CO 0.04 0.23 -0.25 0.78 -2.79 0.00 0.00 178.44 176.45 3hwc h GLY 1436N 0.65 0.55 1.70 2.65 0.00 -1.49 -3.27 103.07 103.85 3hwc h GLY 1436Ca 0.41 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3hwc h GLY 1436CO -0.31 0.54 0.10 -1.33 0.00 0.00 0.00 176.54 175.54 3hwc h GLY 1437N 0.17 0.42 0.34 4.60 0.00 -0.69 -0.23 103.07 107.69 3hwc h GLY 1437Ca 0.02 -0.19 0.21 0.00 0.00 0.00 0.00 47.33 47.37 3hwc h GLY 1437CO 0.06 0.18 0.59 -0.09 0.00 0.00 0.00 176.54 177.28 3hwc h ARG 1438N 0.40 0.32 -0.15 4.80 2.43 -1.20 -2.47 114.38 118.50 3hwc h ARG 1438Ca 0.10 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.13 3hwc h ARG 1438Cb 0.10 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3hwc h ARG 1438CO -0.01 0.21 -0.42 1.96 -1.51 0.00 0.00 179.97 180.20 3hwc h GLN 1439N 0.33 0.34 -2.28 0.20 4.20 -1.15 -1.70 115.11 115.05 3hwc h GLN 1439Ca 0.45 -0.17 -0.81 0.00 0.06 0.00 0.00 58.65 58.18 3hwc h GLN 1439Cb 1.22 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 28.73 3hwc h GLN 1439CO -0.14 0.70 1.00 1.97 -0.67 0.00 0.00 178.83 181.69 3hwc n PHE 1440N -4.02 2.77 0.07 2.96 1.16 -0.93 -4.21 117.46 115.26 3hwc n PHE 1440Ca -0.02 -2.59 0.00 0.00 -1.87 0.00 0.00 57.45 52.98 3hwc n PHE 1440Cb 0.50 -1.19 0.00 0.00 -1.61 0.00 0.00 39.48 37.18 3hwc n PHE 1440CO 0.00 0.00 0.00 -0.12 -1.87 0.00 0.00 176.76 174.77 3hwc n MET 1441N -0.01 0.00 -0.34 3.97 1.56 -1.21 -4.90 117.12 116.20 3hwc n MET 1441Ca 0.46 0.00 0.36 0.00 -0.27 0.00 0.00 57.70 58.25 3hwc n MET 1441Cb 0.27 0.00 0.71 0.00 2.15 0.00 0.00 33.22 36.35 3hwc n MET 1441CO 0.00 0.00 0.00 0.35 -0.73 0.00 0.00 175.97 175.59 3hwc h PHE 1442N 0.00 0.00 0.24 1.12 3.57 -1.52 -1.16 116.94 119.20 3hwc h PHE 1442Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3hwc h PHE 1442Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 3hwc h PHE 1442CO 0.00 0.00 -0.12 0.93 -2.23 0.00 0.00 178.31 176.89 3hwc h GLU 1443N 0.00 -0.31 -5.02 1.11 5.08 -1.80 -3.43 114.58 110.22 3hwc h GLU 1443Ca 0.59 0.02 -0.65 0.00 -1.00 0.00 0.00 59.36 58.33 3hwc h GLU 1443Cb 2.61 0.07 -0.24 0.00 0.50 0.00 0.00 28.75 31.69 3hwc h GLU 1443CO -0.01 -0.21 -0.65 0.54 -1.00 0.00 0.00 179.01 177.68 3hwc s ASN 1444N -2.93 4.89 0.00 1.42 4.22 -0.44 -4.87 114.94 117.24 3hwc s ASN 1444Ca -0.05 -0.23 0.00 0.00 -2.14 0.00 0.00 52.86 50.44 3hwc s ASN 1444Cb 0.00 -1.86 0.00 0.00 1.28 0.00 0.00 41.25 40.68 3hwc s ASN 1444CO 0.14 0.00 0.00 2.22 -2.04 0.00 0.00 177.10 177.42 3hwc n PHE 1445N 4.67 0.00 0.03 1.54 1.16 -1.25 -4.67 117.46 118.94 3hwc n PHE 1445Ca -0.17 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.33 3hwc n PHE 1445Cb 0.51 0.01 -0.13 0.00 -1.61 0.00 0.00 39.48 38.26 3hwc n PHE 1445CO 0.00 0.00 0.00 -0.91 -1.87 0.00 0.00 176.76 173.98 3hwc h ASN 1446N 0.00 0.04 0.00 5.98 4.21 -1.93 -3.50 115.58 120.38 3hwc h ASN 1446Ca 0.00 -0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.46 3hwc h ASN 1446Cb 0.20 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 3hwc h ASN 1446CO 0.00 1.04 0.00 0.61 -1.29 0.00 0.00 177.43 177.79 3hwc n GLY 1447N 1.45 -0.39 3.28 2.83 0.00 -1.26 -5.12 105.19 105.98 3hwc n GLY 1447Ca -0.07 0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 3hwc n GLY 1447CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hwc s THR 1448N 0.00 3.16 0.02 2.61 2.01 -1.26 -5.05 115.64 117.14 3hwc s THR 1448Ca 0.00 -0.59 -0.05 0.00 0.31 0.00 0.00 61.69 61.36 3hwc s THR 1448Cb 0.00 -2.44 -0.01 0.00 0.01 0.00 0.00 72.50 70.06 3hwc s THR 1448CO 0.00 0.42 1.09 -0.65 -0.69 0.00 0.00 174.62 174.79 3hwc h PRO 1449N 8.09 -0.02 -0.74 4.92 0.11 -1.98 0.15 132.00 142.53 3hwc h PRO 1449Ca -0.42 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.73 3hwc h PRO 1449Cb 1.15 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3hwc h PRO 1449CO 0.61 -0.01 0.47 1.25 -0.21 0.00 0.00 178.00 180.10 3hwc h LEU 1450N -0.02 0.76 0.36 2.35 5.85 -1.97 0.23 115.31 122.87 3hwc h LEU 1450Ca 0.02 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3hwc h LEU 1450Cb 0.08 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3hwc h LEU 1450CO -0.13 0.52 -0.17 0.15 -0.34 0.00 0.00 178.44 178.47 3hwc h PHE 1451N 0.90 -0.45 -0.87 1.25 3.57 -1.92 -1.95 116.94 117.47 3hwc h PHE 1451Ca 0.30 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.81 3hwc h PHE 1451Cb 0.03 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.87 3hwc h PHE 1451CO -0.04 -0.11 0.57 0.00 -2.23 0.00 0.00 178.31 176.50 3hwc h ALA 1452N -0.51 1.12 -0.76 2.41 0.00 -0.62 0.60 119.26 121.49 3hwc h ALA 1452Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hwc h ALA 1452Cb 0.53 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 3hwc h ALA 1452CO 0.08 0.46 0.48 0.28 0.00 0.00 0.00 179.25 180.56 3hwc h VAL 1453N 1.14 1.20 0.09 0.00 2.07 -0.60 0.16 116.25 120.31 3hwc h VAL 1453Ca 0.33 -0.40 -0.25 0.00 0.82 0.00 0.00 66.70 67.20 3hwc h VAL 1453Cb -0.08 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 3hwc h VAL 1453CO -0.09 0.20 -1.16 0.15 0.02 0.00 0.00 177.57 176.69 3hwc h PHE 1454N 1.03 0.35 -0.60 1.57 -0.00 -0.46 -0.97 116.94 117.86 3hwc h PHE 1454Ca 0.28 -0.25 -0.04 0.00 -0.00 0.00 0.00 57.97 57.96 3hwc h PHE 1454Cb -0.09 -0.01 -0.03 0.00 -0.00 0.00 0.00 35.95 35.82 3hwc h PHE 1454CO 0.00 1.19 0.22 0.00 -0.00 0.00 0.00 178.31 179.73 3hwc h ALA 1455N 0.71 0.78 0.00 2.41 0.00 0.56 0.17 119.26 123.89 3hwc h ALA 1455Ca -0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hwc h ALA 1455Cb 1.90 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3hwc h ALA 1455CO 0.18 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.85 3hwc h ALA 1456N 1.08 1.00 0.06 0.00 0.00 -0.72 -3.21 119.26 117.47 3hwc h ALA 1456Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 3hwc h ALA 1456Cb 0.23 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.04 3hwc h ALA 1456CO -0.01 0.00 -0.71 1.15 0.00 0.00 0.00 179.25 179.68 3hwc h THR 1457N 0.00 1.46 -0.21 0.00 2.02 -0.19 -3.24 112.91 112.75 3hwc h THR 1457Ca 0.00 -2.29 0.06 0.00 0.77 0.00 0.00 66.41 64.95 3hwc h THR 1457Cb 0.67 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.94 3hwc h THR 1457CO 0.00 0.66 0.26 0.24 0.37 0.00 0.00 175.52 177.05 3hwc h MET 1458N -0.22 0.00 0.01 6.66 2.86 -0.71 0.38 114.93 123.91 3hwc h MET 1458Ca -0.11 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.29 3hwc h MET 1458Cb 1.47 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.14 3hwc h MET 1458CO 0.14 0.00 -1.00 1.15 1.06 0.00 0.00 176.91 178.25 3hwc h THR 1459N 0.00 1.36 0.13 2.22 2.02 -1.64 -3.36 112.91 113.64 3hwc h THR 1459Ca 0.10 -2.41 -0.35 0.00 0.77 0.00 0.00 66.41 64.52 3hwc h THR 1459Cb 0.62 2.44 -0.01 0.00 -1.74 0.00 0.00 68.15 69.46 3hwc h THR 1459CO -0.00 0.73 -1.88 0.03 0.37 0.00 0.00 175.52 174.76 3hwc h ARG 1460N 0.28 0.27 -6.64 6.66 3.08 -1.08 -3.47 114.38 113.48 3hwc h ARG 1460Ca -0.10 -0.46 -0.66 0.00 0.07 0.00 0.00 59.98 58.82 3hwc h ARG 1460Cb 1.65 0.17 -0.17 0.00 0.08 0.00 0.00 29.97 31.70 3hwc h ARG 1460CO 0.18 1.17 -0.78 -0.51 -1.07 0.00 0.00 179.97 178.95 3hwc s ASP 1461N -7.01 3.93 -0.50 7.04 1.01 0.12 -5.09 116.67 116.16 3hwc s ASP 1461Ca -0.18 -0.60 -0.25 0.00 0.71 0.00 0.00 52.55 52.23 3hwc s ASP 1461Cb 0.06 -0.56 0.03 0.00 1.01 0.00 0.00 42.92 43.47 3hwc s ASP 1461CO 0.80 0.15 0.94 -0.62 0.21 0.00 0.00 175.17 176.65 3hwc s ASP 1462N -2.38 6.43 -0.27 0.27 -1.08 -1.26 -4.18 116.67 114.21 3hwc s ASP 1462Ca 0.20 -0.08 0.12 0.00 -0.52 0.00 0.00 52.55 52.27 3hwc s ASP 1462Cb -0.10 -2.45 0.56 0.00 -1.46 0.00 0.00 42.92 39.48 3hwc s ASP 1462CO 0.11 -1.14 1.53 0.80 0.52 0.00 0.00 175.17 177.00 3hwc n MET 1463N 7.33 2.54 -1.73 4.34 1.56 -1.26 -3.94 117.12 125.97 3hwc n MET 1463Ca 0.04 -3.03 -0.14 0.00 -0.27 0.00 0.00 57.70 54.31 3hwc n MET 1463Cb 0.48 -1.91 0.07 0.00 2.15 0.00 0.00 33.22 34.01 3hwc n MET 1463CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 3hwc n SER 1464N -0.76 0.76 0.15 6.12 3.41 -1.26 -4.92 113.62 117.11 3hwc n SER 1464Ca 0.32 -1.65 0.13 0.00 -0.26 0.00 0.00 58.87 57.41 3hwc n SER 1464Cb 1.08 -0.38 0.50 0.00 -0.26 0.00 0.00 64.21 65.15 3hwc n SER 1464CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hwc h ALA 1465N -0.59 1.00 -0.00 7.33 0.00 -1.97 -1.38 119.26 123.65 3hwc h ALA 1465Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hwc h ALA 1465Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hwc h ALA 1465CO 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 179.25 179.12 3hwc n ALA 1466N -1.83 3.16 -1.00 0.00 0.00 -1.26 -4.16 120.51 115.42 3hwc n ALA 1466Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3hwc n ALA 1466Cb 0.28 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3hwc n ALA 1466CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hwc n GLY 1467N 1.48 -1.30 0.19 0.00 0.00 -0.52 -4.91 105.19 100.12 3hwc n GLY 1467Ca 0.07 -1.64 0.04 0.00 0.00 0.00 0.00 46.02 44.49 3hwc n GLY 1467CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hwc h THR 1468N -1.04 1.10 0.00 2.61 1.35 -1.81 -2.68 112.91 112.44 3hwc h THR 1468Ca 0.00 -1.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.43 3hwc h THR 1468Cb 0.00 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3hwc h THR 1468CO 0.00 0.38 0.00 -1.22 -0.25 0.00 0.00 175.52 174.43 3hwc n TYR 1469N -3.81 0.63 0.20 4.73 4.02 -1.26 -3.49 117.16 118.18 3hwc n TYR 1469Ca -0.01 0.20 0.11 0.00 -0.01 0.00 0.00 57.90 58.19 3hwc n TYR 1469Cb 0.46 -0.82 0.14 0.00 -0.02 0.00 0.00 39.34 39.10 3hwc n TYR 1469CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3hwc h GLY 1470N 3.99 0.00 0.73 2.72 0.00 -1.63 -3.39 103.07 105.48 3hwc h GLY 1470Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3hwc h GLY 1470CO 0.00 0.00 -0.35 1.70 0.00 0.00 0.00 176.54 177.89 3hwc h LYS 1471N 0.00 -0.94 0.40 4.80 3.64 -1.70 -2.34 116.57 120.43 3hwc h LYS 1471Ca -0.00 0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3hwc h LYS 1471Cb 1.05 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3hwc h LYS 1471CO 0.01 -0.63 -0.19 0.35 -2.27 0.00 0.00 179.45 176.72 3hwc h PHE 1472N -1.11 -0.50 -0.74 1.91 -0.00 -1.81 -2.53 116.94 112.16 3hwc h PHE 1472Ca -0.10 -0.01 0.06 0.00 -0.00 0.00 0.00 57.97 57.92 3hwc h PHE 1472Cb 0.75 0.16 -0.05 0.00 -0.00 0.00 0.00 35.95 36.82 3hwc h PHE 1472CO 0.03 -0.29 0.48 0.00 -0.00 0.00 0.00 178.31 178.53 3hwc h ALA 1473N 0.03 1.69 -0.43 2.41 0.00 -1.76 -2.22 119.26 118.98 3hwc h ALA 1473Ca -0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3hwc h ALA 1473Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3hwc h ALA 1473CO 0.09 0.19 0.13 0.77 0.00 0.00 0.00 179.25 180.43 3hwc h SER 1474N 0.77 0.64 -0.67 0.00 0.02 -1.12 -0.87 113.55 112.33 3hwc h SER 1474Ca 0.32 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 3hwc h SER 1474Cb 0.26 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 3hwc h SER 1474CO -0.11 0.68 0.18 1.56 -1.14 0.00 0.00 176.83 178.00 3hwc h GLN 1475N 0.56 1.06 -0.44 3.45 4.20 -1.09 0.42 115.11 123.27 3hwc h GLN 1475Ca 0.14 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 3hwc h GLN 1475Cb 0.27 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 3hwc h GLN 1475CO -0.00 0.94 0.01 0.28 -0.67 0.00 0.00 178.83 179.38 3hwc h VAL 1476N 0.99 1.23 -0.01 -0.54 2.07 -1.19 -2.11 116.25 116.68 3hwc h VAL 1476Ca 0.21 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.80 3hwc h VAL 1476Cb 0.34 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3hwc h VAL 1476CO -0.00 0.33 -0.03 0.00 0.02 0.00 0.00 177.57 177.88 3hwc n GLY 1478N 1.15 -0.05 3.51 0.00 0.00 -0.46 -5.02 105.19 104.33 3hwc n GLY 1478Ca 0.19 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 3hwc n GLY 1478CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hwc s ILE 1479N -2.61 3.61 0.27 -0.61 1.01 0.14 -5.01 121.20 117.99 3hwc s ILE 1479Ca 0.03 -0.49 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 3hwc s ILE 1479Cb -0.02 -2.52 -0.11 0.00 0.01 0.00 0.00 42.46 39.82 3hwc s ILE 1479CO 0.04 0.55 1.61 -0.70 0.00 0.00 0.00 174.94 176.44 3hwc s GLU 1480N -0.19 4.14 -0.14 2.79 2.12 -1.26 -4.14 118.70 122.02 3hwc s GLU 1480Ca 0.02 2.55 0.01 0.00 0.36 0.00 0.00 54.97 57.91 3hwc s GLU 1480Cb -0.13 -3.05 -0.01 0.00 0.26 0.00 0.00 34.13 31.21 3hwc s GLU 1480CO 0.03 -0.64 -0.16 0.12 -0.54 0.00 0.00 175.26 174.06 3hwc s PHE 1481N 0.29 2.75 0.00 5.30 5.36 -1.26 -5.04 117.98 125.37 3hwc s PHE 1481Ca 0.66 -0.90 0.00 0.00 -0.96 0.00 0.00 56.93 55.72 3hwc s PHE 1481Cb -0.48 -1.84 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 3hwc s PHE 1481CO 0.44 -0.37 0.00 0.41 -1.46 0.00 0.00 175.22 174.23