#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkb n GLN 1004N 0.00 0.09 -2.51 3.44 0.00 -1.26 -4.77 117.38 112.37 3dkb n GLN 1004Ca 0.00 -0.11 -0.40 0.00 0.00 0.00 0.00 57.00 56.48 3dkb n GLN 1004Cb 0.00 -1.45 -0.02 0.00 0.00 0.00 0.00 30.24 28.77 3dkb n GLN 1004CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3dkb s VAL 1005N 3.15 3.97 -0.32 -0.39 0.11 -1.26 -4.86 120.40 120.80 3dkb s VAL 1005Ca 1.27 -1.32 0.02 0.00 -2.93 0.00 0.00 61.98 59.02 3dkb s VAL 1005Cb -0.79 -5.04 0.10 0.00 -1.53 0.00 0.00 36.38 29.12 3dkb s VAL 1005CO 0.49 -1.87 0.06 -0.22 -3.33 0.00 0.00 175.10 170.23 3dkb s LEU 1006N 5.26 3.85 0.29 2.54 2.96 -1.26 -5.10 118.68 127.22 3dkb s LEU 1006Ca 0.53 -1.94 -0.17 0.00 -0.22 0.00 0.00 54.13 52.33 3dkb s LEU 1006Cb 0.02 -1.37 -0.12 0.00 0.50 0.00 0.00 46.19 45.22 3dkb s LEU 1006CO 0.01 -0.38 0.10 -0.81 -1.32 0.00 0.00 176.35 173.95 3dkb n PRO 1007N 4.46 0.00 0.18 0.98 -0.04 -1.26 -4.89 135.00 134.43 3dkb n PRO 1007Ca 0.01 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.61 3dkb n PRO 1007Cb 0.42 -0.76 0.41 0.00 -0.04 0.00 0.00 33.50 33.53 3dkb n PRO 1007CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3dkb h GLN 1008N 0.30 0.00 -4.50 0.54 7.50 -2.00 -3.41 115.11 113.54 3dkb h GLN 1008Ca -0.27 0.00 -0.20 0.00 0.50 0.00 0.00 58.65 58.68 3dkb h GLN 1008Cb 1.10 0.00 -0.16 0.00 0.05 0.00 0.00 27.48 28.47 3dkb h GLN 1008CO 0.36 0.00 -0.70 0.00 -1.50 0.00 0.00 178.83 177.00 3dkb s ALA 1009N -3.29 0.76 0.39 3.87 0.00 -1.26 -4.18 121.76 118.05 3dkb s ALA 1009Ca 0.06 -1.19 0.10 0.00 0.00 0.00 0.00 51.96 50.93 3dkb s ALA 1009Cb 0.09 0.17 0.80 0.00 0.00 0.00 0.00 23.12 24.18 3dkb s ALA 1009CO 0.57 -0.23 1.92 -0.07 0.00 0.00 0.00 175.76 177.94 3dkb h LEU 1010N 3.31 0.20 -0.99 0.00 3.38 -1.88 -2.99 115.31 116.34 3dkb h LEU 1010Ca -0.35 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3dkb h LEU 1010Cb 1.17 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3dkb h LEU 1010CO 0.60 0.36 0.00 0.10 0.09 0.00 0.00 178.44 179.60 3dkb h TYR 1011N 0.21 0.00 0.00 1.13 -0.00 -1.89 -3.13 116.97 113.28 3dkb h TYR 1011Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.73 3dkb h TYR 1011Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.09 3dkb h TYR 1011CO 0.01 0.00 -0.19 -0.07 -0.00 0.00 0.00 178.16 177.91 3dkb h LEU 1012N 0.00 0.00 -0.54 0.10 3.38 -1.90 -3.02 115.31 113.33 3dkb h LEU 1012Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dkb h LEU 1012Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3dkb h LEU 1012CO 0.00 0.19 0.00 -1.54 0.09 0.00 0.00 178.44 177.18 3dkb n SER 1013N -3.24 0.31 -2.71 -0.43 3.41 -1.18 -3.90 113.62 105.88 3dkb n SER 1013Ca 0.01 0.61 -0.04 0.00 -0.26 0.00 0.00 58.87 59.19 3dkb n SER 1013Cb 0.49 -0.66 0.03 0.00 -0.26 0.00 0.00 64.21 63.81 3dkb n SER 1013CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3dkb n ASN 1014N -1.88 -2.39 0.29 4.04 2.85 -1.15 -4.80 115.26 112.22 3dkb n ASN 1014Ca 0.01 -2.11 0.15 0.00 -0.11 0.00 0.00 54.58 52.52 3dkb n ASN 1014Cb 0.11 1.27 0.88 0.00 1.24 0.00 0.00 39.78 43.27 3dkb n ASN 1014CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 3dkb h MET 1015N 4.34 0.00 0.17 1.20 2.86 -1.65 -2.03 114.93 119.83 3dkb h MET 1015Ca -0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3dkb h MET 1015Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 3dkb h MET 1015CO -0.02 0.05 -0.08 -0.09 1.06 0.00 0.00 176.91 177.83 3dkb h ARG 1016N 0.00 -0.22 -0.83 1.72 1.12 -1.94 -1.67 114.38 112.56 3dkb h ARG 1016Ca -0.00 0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.87 3dkb h ARG 1016Cb 0.14 0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 30.11 3dkb h ARG 1016CO 0.01 -0.01 0.47 -0.22 -3.11 0.00 0.00 179.97 177.11 3dkb h LYS 1017N -0.40 1.14 -0.64 0.20 3.64 -1.78 -1.37 116.57 117.35 3dkb h LYS 1017Ca -0.02 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 59.27 3dkb h LYS 1017Cb 0.31 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 3dkb h LYS 1017CO 0.04 0.82 0.43 0.00 -2.27 0.00 0.00 179.45 178.47 3dkb h ALA 1018N 1.36 1.66 -0.02 5.00 0.00 -1.13 0.00 119.26 126.14 3dkb h ALA 1018Ca 0.29 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 3dkb h ALA 1018Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3dkb h ALA 1018CO -0.05 0.27 -0.57 0.28 0.00 0.00 0.00 179.25 179.18 3dkb h VAL 1019N 0.76 1.40 -0.05 0.00 2.07 -0.30 -1.00 116.25 119.12 3dkb h VAL 1019Ca 0.26 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.84 3dkb h VAL 1019Cb 0.09 2.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 3dkb h VAL 1019CO -0.07 0.56 0.03 0.50 0.02 0.00 0.00 177.57 178.61 3dkb h LYS 1020N 0.05 0.07 0.29 1.57 3.64 -0.54 -0.97 116.57 120.68 3dkb h LYS 1020Ca -0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3dkb h LYS 1020Cb 1.02 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3dkb h LYS 1020CO 0.08 0.07 -0.14 0.82 -2.27 0.00 0.00 179.45 178.01 3dkb h ILE 1021N 0.05 0.73 0.00 2.00 2.04 -1.17 -2.06 117.51 119.10 3dkb h ILE 1021Ca 0.02 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3dkb h ILE 1021Cb 0.01 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3dkb h ILE 1021CO -0.00 0.02 0.00 0.54 0.00 0.00 0.00 178.15 178.71 3dkb n ARG 1022N -5.23 0.03 -0.07 2.37 1.74 -0.39 -2.04 116.66 113.06 3dkb n ARG 1022Ca -0.10 0.42 -0.12 0.00 -0.77 0.00 0.00 57.85 57.29 3dkb n ARG 1022Cb 0.19 -1.58 -0.15 0.00 -1.02 0.00 0.00 32.46 29.90 3dkb n ARG 1022CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3dkb n GLU 1023N -1.65 0.67 0.10 5.56 1.02 -0.38 -4.23 120.64 121.74 3dkb n GLU 1023Ca 0.01 0.13 -0.04 0.00 -0.02 0.00 0.00 57.16 57.25 3dkb n GLU 1023Cb 0.08 -1.63 0.13 0.00 -0.02 0.00 0.00 31.44 30.01 3dkb n GLU 1023CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dkb h ARG 1024N 0.01 0.15 -0.26 3.49 3.08 -0.78 -3.36 114.38 116.70 3dkb h ARG 1024Ca -0.46 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 59.52 3dkb h ARG 1024Cb 2.11 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 32.12 3dkb h ARG 1024CO 0.04 0.72 -0.39 1.15 -1.07 0.00 0.00 179.97 180.42 3dkb h THR 1025N 0.11 0.00 0.00 2.04 2.02 -1.60 -2.18 112.91 113.30 3dkb h THR 1025Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3dkb h THR 1025Cb 1.12 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 3dkb h THR 1025CO 0.09 0.00 -0.17 1.55 0.37 0.00 0.00 175.52 177.36 3dkb h PRO 1026N -0.30 0.00 0.00 6.66 0.13 -1.78 -2.05 132.00 134.66 3dkb h PRO 1026Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 3dkb h PRO 1026Cb 0.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.56 3dkb h PRO 1026CO -0.40 0.17 0.00 0.39 -0.23 0.00 0.00 178.00 177.93 3dkb n GLU 1027N -4.08 0.03 0.00 0.86 1.02 -1.03 -2.61 120.64 114.83 3dkb n GLU 1027Ca -0.02 0.05 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 3dkb n GLU 1027Cb 0.25 -1.54 0.31 0.00 -0.02 0.00 0.00 31.44 30.45 3dkb n GLU 1027CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dkb n ASP 1028N -1.59 1.90 -4.68 1.62 -0.08 -0.77 -4.87 116.55 108.07 3dkb n ASP 1028Ca 0.06 -1.53 -0.40 0.00 -1.51 0.00 0.00 54.79 51.41 3dkb n ASP 1028Cb 0.33 0.08 -0.05 0.00 2.34 0.00 0.00 41.12 43.83 3dkb n ASP 1028CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3dkb s ILE 1029N -2.15 5.01 -0.31 5.18 1.01 -1.07 -1.26 121.20 127.61 3dkb s ILE 1029Ca 0.30 1.33 -0.22 0.00 0.00 0.00 0.00 60.65 62.07 3dkb s ILE 1029Cb 0.20 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 3dkb s ILE 1029CO 0.39 0.15 0.70 0.12 0.00 0.00 0.00 174.94 176.30 3dkb s PHE 1030N 1.56 3.20 -0.86 3.97 2.19 0.90 -4.95 117.98 123.99 3dkb s PHE 1030Ca 0.33 0.67 0.01 0.00 0.33 0.00 0.00 56.93 58.27 3dkb s PHE 1030Cb -0.16 -3.11 0.33 0.00 -1.31 0.00 0.00 43.02 38.77 3dkb s PHE 1030CO 0.13 -0.53 1.54 1.63 1.83 0.00 0.00 175.22 179.82 3dkb n LYS 1031N 6.04 4.56 -1.58 10.12 5.02 -1.26 -1.82 118.16 139.23 3dkb n LYS 1031Ca 0.01 -4.67 -0.49 0.00 -2.02 0.00 0.00 58.31 51.14 3dkb n LYS 1031Cb 0.48 -2.38 -0.06 0.00 -0.02 0.00 0.00 35.03 33.06 3dkb n LYS 1031CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3dkb n PRO 1032N -0.16 1.64 -0.17 1.97 -0.04 -1.26 -4.77 135.00 132.21 3dkb n PRO 1032Ca 0.42 0.53 0.04 0.00 -0.04 0.00 0.00 63.50 64.45 3dkb n PRO 1032Cb 0.31 -2.63 0.12 0.00 -0.04 0.00 0.00 33.50 31.26 3dkb n PRO 1032CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3dkb n THR 1033N 6.31 0.48 0.01 0.52 -2.24 -1.26 -4.17 114.28 113.93 3dkb n THR 1033Ca 0.31 -0.38 -0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3dkb n THR 1033Cb 0.28 0.05 -0.00 0.00 -2.10 0.00 0.00 70.33 68.56 3dkb n THR 1033CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 3dkb h ASN 1034N 1.49 -0.01 0.00 3.42 -1.24 -1.91 -3.49 115.58 113.84 3dkb h ASN 1034Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 3dkb h ASN 1034Cb 0.49 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.54 3dkb h ASN 1034CO 0.04 -0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.79 3dkb n GLY 1035N 0.83 0.03 3.75 1.57 0.00 -1.26 -5.03 105.19 105.09 3dkb n GLY 1035Ca -0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3dkb n GLY 1035CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dkb s ILE 1036N -1.24 2.79 0.77 -0.61 1.10 -1.26 -3.16 121.20 119.59 3dkb s ILE 1036Ca 0.00 0.39 -0.12 0.00 -0.51 0.00 0.00 60.65 60.41 3dkb s ILE 1036Cb 0.00 -2.95 0.06 0.00 0.15 0.00 0.00 42.46 39.72 3dkb s ILE 1036CO 0.00 -0.21 1.13 0.27 -2.11 0.00 0.00 174.94 174.02 3dkb s ILE 1037N -2.10 2.89 0.34 2.00 -4.36 -1.26 -4.63 121.20 114.07 3dkb s ILE 1037Ca 0.71 0.34 -0.28 0.00 -0.26 0.00 0.00 60.65 61.16 3dkb s ILE 1037Cb -0.25 -2.76 -0.10 0.00 1.25 0.00 0.00 42.46 40.61 3dkb s ILE 1037CO 0.42 -0.33 1.25 -1.00 0.24 0.00 0.00 174.94 175.51 3dkb s HIS 1038N -2.57 3.14 0.10 1.37 3.76 -1.26 -4.72 115.29 115.11 3dkb s HIS 1038Ca 0.66 1.49 -0.13 0.00 -0.15 0.00 0.00 55.06 56.93 3dkb s HIS 1038Cb -0.21 -3.56 0.02 0.00 1.11 0.00 0.00 32.58 29.94 3dkb s HIS 1038CO 0.51 -1.54 0.30 -3.38 -0.85 0.00 0.00 174.74 169.79 3dkb s HIS 1039N -1.19 -0.05 0.44 1.40 -3.43 -0.76 -4.42 115.29 107.28 3dkb s HIS 1039Ca 0.50 -0.28 -0.16 0.00 -0.80 0.00 0.00 55.06 54.31 3dkb s HIS 1039Cb -0.37 0.11 -0.09 0.00 -1.43 0.00 0.00 32.58 30.80 3dkb s HIS 1039CO 0.48 -0.61 0.89 -0.06 -2.00 0.00 0.00 174.74 173.45 3dkb s PHE 1040N -3.60 3.40 -0.11 0.38 0.40 -0.94 -0.07 117.98 117.43 3dkb s PHE 1040Ca 0.02 1.38 0.13 0.00 -0.60 0.00 0.00 56.93 57.86 3dkb s PHE 1040Cb 0.03 -2.70 -0.24 0.00 0.51 0.00 0.00 43.02 40.62 3dkb s PHE 1040CO -0.10 -0.17 0.41 1.63 0.70 0.00 0.00 175.22 177.68 3dkb n LYS 1041N -1.07 0.66 0.00 0.44 5.02 -0.39 -4.85 118.16 117.97 3dkb n LYS 1041Ca 0.05 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 3dkb n LYS 1041Cb 0.54 -1.68 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 3dkb n LYS 1041CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3dkb n THR 1042N -2.98 0.00 0.27 -0.18 -2.24 -1.26 -4.93 114.28 102.96 3dkb n THR 1042Ca -0.25 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.68 3dkb n THR 1042Cb 1.09 0.00 0.77 0.00 -2.10 0.00 0.00 70.33 70.08 3dkb n THR 1042CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3dkb h MET 1043N 0.00 0.00 0.00 -0.78 2.86 -1.90 -2.55 114.93 112.56 3dkb h MET 1043Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3dkb h MET 1043Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3dkb h MET 1043CO 0.00 0.10 0.00 -2.39 1.06 0.00 0.00 176.91 175.68 3dkb n HIS 1044N -3.53 0.75 1.61 -0.22 1.44 -1.26 -1.92 115.22 112.08 3dkb n HIS 1044Ca -0.02 0.32 0.14 0.00 -2.01 0.00 0.00 57.72 56.15 3dkb n HIS 1044Cb 0.23 -1.01 0.62 0.00 0.12 0.00 0.00 29.99 29.95 3dkb n HIS 1044CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3dkb n ARG 1045N -2.20 1.50 -3.08 -1.40 1.74 -0.96 -4.89 116.66 107.37 3dkb n ARG 1045Ca 0.01 -0.73 -0.36 0.00 -0.77 0.00 0.00 57.85 56.00 3dkb n ARG 1045Cb 0.18 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.07 3dkb n ARG 1045CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3dkb s TYR 1046N -1.99 3.61 -0.07 -1.55 4.12 -0.81 -4.97 117.35 115.68 3dkb s TYR 1046Ca 0.40 1.39 -0.06 0.00 0.02 0.00 0.00 57.07 58.82 3dkb s TYR 1046Cb 0.21 -2.63 0.02 0.00 -1.52 0.00 0.00 41.96 38.04 3dkb s TYR 1046CO 0.34 0.29 0.18 0.99 0.02 0.00 0.00 175.55 177.37 3dkb s THR 1047N -1.61 -0.01 0.17 -0.71 2.01 -1.24 -4.36 115.64 109.90 3dkb s THR 1047Ca 0.45 0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.57 3dkb s THR 1047Cb -0.16 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.05 3dkb s THR 1047CO 0.20 0.01 -0.14 -1.48 -0.69 0.00 0.00 174.62 172.53 3dkb s LEU 1048N 0.24 2.82 0.02 4.42 0.05 -0.91 -1.17 118.68 124.15 3dkb s LEU 1048Ca -0.01 -0.63 0.03 0.00 0.05 0.00 0.00 54.13 53.57 3dkb s LEU 1048Cb -0.03 -1.55 -0.01 0.00 -2.05 0.00 0.00 46.19 42.55 3dkb s LEU 1048CO -0.01 0.12 -0.09 -1.61 -0.55 0.00 0.00 176.35 174.22 3dkb s GLU 1049N -2.67 0.62 0.58 1.48 2.02 -1.26 -4.54 118.70 114.92 3dkb s GLU 1049Ca 0.23 -0.51 -0.16 0.00 0.02 0.00 0.00 54.97 54.55 3dkb s GLU 1049Cb -0.09 -0.54 -0.04 0.00 0.10 0.00 0.00 34.13 33.56 3dkb s GLU 1049CO 0.13 0.13 1.05 -1.64 0.02 0.00 0.00 175.26 174.96 3dkb s MET 1050N -0.80 3.40 0.52 1.61 -1.94 -0.86 -4.79 119.30 116.44 3dkb s MET 1050Ca -0.01 1.18 -0.12 0.00 -1.71 0.00 0.00 55.69 55.03 3dkb s MET 1050Cb -0.06 -2.04 -0.06 0.00 2.01 0.00 0.00 34.83 34.68 3dkb s MET 1050CO 0.00 -0.75 0.92 -0.59 -0.01 0.00 0.00 175.02 174.60 3dkb s PHE 1051N -2.46 3.53 -0.12 -0.03 -0.12 -1.26 -0.63 117.98 116.89 3dkb s PHE 1051Ca 0.63 1.22 -0.30 0.00 -0.05 0.00 0.00 56.93 58.44 3dkb s PHE 1051Cb -0.15 -2.62 -0.01 0.00 -0.63 0.00 0.00 43.02 39.60 3dkb s PHE 1051CO 0.36 -0.41 1.06 0.50 -0.05 0.00 0.00 175.22 176.68 3dkb s ARG 1052N -4.49 4.38 0.00 1.99 6.06 -1.26 -4.76 118.95 120.87 3dkb s ARG 1052Ca 0.54 1.45 0.21 0.00 -2.50 0.00 0.00 55.73 55.43 3dkb s ARG 1052Cb -0.10 -3.57 -0.21 0.00 0.06 0.00 0.00 34.95 31.13 3dkb s ARG 1052CO 0.41 -0.40 0.89 0.25 -2.50 0.00 0.00 175.30 173.95 3dkb n THR 1053N 4.71 0.00 0.86 4.11 -2.24 -1.26 -4.29 114.28 116.17 3dkb n THR 1053Ca 0.10 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 3dkb n THR 1053Cb 0.48 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 3dkb n THR 1053CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dkb n GLN 1055N -0.43 2.13 -4.31 0.00 1.13 -1.26 -4.99 117.38 109.65 3dkb n GLN 1055Ca 0.00 -1.81 -0.25 0.00 -1.94 0.00 0.00 57.00 53.00 3dkb n GLN 1055Cb 0.01 -1.28 -0.08 0.00 0.11 0.00 0.00 30.24 29.00 3dkb n GLN 1055CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3dkb s PHE 1056N -1.01 2.63 0.58 1.08 0.40 -0.22 -5.10 117.98 116.35 3dkb s PHE 1056Ca 0.22 -0.23 -0.20 0.00 -0.60 0.00 0.00 56.93 56.12 3dkb s PHE 1056Cb 0.12 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 3dkb s PHE 1056CO 0.17 0.59 1.16 0.00 0.70 0.00 0.00 175.22 177.84 3dkb h PRO 1058N 0.85 -0.36 -0.83 0.00 0.11 -1.98 0.36 132.00 130.15 3dkb h PRO 1058Ca -0.49 0.02 0.19 0.00 0.11 0.00 0.00 66.00 65.83 3dkb h PRO 1058Cb 1.34 0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.48 3dkb h PRO 1058CO 0.54 -0.24 0.56 1.96 -0.21 0.00 0.00 178.00 180.61 3dkb h GLN 1059N -0.37 0.31 0.19 1.05 4.20 -2.00 -1.51 115.11 116.98 3dkb h GLN 1059Ca 0.09 -0.02 -0.32 0.00 0.06 0.00 0.00 58.65 58.46 3dkb h GLN 1059Cb 0.51 -0.07 0.02 0.00 0.30 0.00 0.00 27.48 28.23 3dkb h GLN 1059CO -0.31 0.21 -1.53 0.35 -0.67 0.00 0.00 178.83 176.88 3dkb h PHE 1060N 0.32 0.73 -0.97 2.96 3.04 -1.75 -3.20 116.94 118.07 3dkb h PHE 1060Ca 0.42 -0.53 0.18 0.00 3.98 0.00 0.00 57.97 62.02 3dkb h PHE 1060Cb 1.14 -0.03 -0.11 0.00 2.56 0.00 0.00 35.95 39.52 3dkb h PHE 1060CO -0.00 1.59 0.57 -0.09 -2.02 0.00 0.00 178.31 178.36 3dkb h ARG 1061N -0.01 0.71 -0.49 1.11 2.43 0.66 0.13 114.38 118.92 3dkb h ARG 1061Ca -0.30 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 58.75 3dkb h ARG 1061Cb 2.01 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 31.38 3dkb h ARG 1061CO 0.18 0.47 -0.02 1.49 -1.51 0.00 0.00 179.97 180.58 3dkb h GLU 1062N 0.73 0.82 -0.80 0.20 4.81 -1.42 -2.41 114.58 116.51 3dkb h GLU 1062Ca 0.56 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 3dkb h GLU 1062Cb 0.86 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 3dkb h GLU 1062CO -0.39 0.84 0.38 0.82 -0.73 0.00 0.00 179.01 179.93 3dkb h ILE 1063N 0.76 1.25 0.13 2.32 2.04 -0.74 -0.62 117.51 122.65 3dkb h ILE 1063Ca 0.14 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 3dkb h ILE 1063Cb 0.49 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3dkb h ILE 1063CO 0.02 0.30 -0.06 0.40 0.00 0.00 0.00 178.15 178.81 3dkb h ILE 1064N 1.13 1.05 -0.90 -0.67 2.04 -1.31 -2.89 117.51 115.96 3dkb h ILE 1064Ca 0.27 -0.86 0.10 0.00 1.00 0.00 0.00 64.86 65.37 3dkb h ILE 1064Cb 0.12 1.58 -0.08 0.00 -0.74 0.00 0.00 36.82 37.70 3dkb h ILE 1064CO -0.03 0.20 0.54 0.45 0.00 0.00 0.00 178.15 179.30 3dkb h HIS 1065N -0.59 0.97 -0.49 1.37 3.86 -1.30 0.51 115.15 119.49 3dkb h HIS 1065Ca -0.02 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 3dkb h HIS 1065Cb 0.46 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 3dkb h HIS 1065CO 0.06 0.40 0.19 -0.22 0.86 0.00 0.00 177.93 179.22 3dkb h LYS 1066N 0.88 0.70 0.28 2.45 1.63 -1.13 -2.35 116.57 119.03 3dkb h LYS 1066Ca 0.44 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 60.12 3dkb h LYS 1066Cb 0.40 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 3dkb h LYS 1066CO -0.25 0.58 -0.14 0.00 -3.45 0.00 0.00 179.45 176.19 3dkb h ALA 1067N 1.52 -0.38 0.14 5.00 0.00 -0.72 -3.41 119.26 121.41 3dkb h ALA 1067Ca 0.17 -0.15 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 3dkb h ALA 1067Cb 0.14 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3dkb h ALA 1067CO -0.02 -0.38 -1.53 -0.07 0.00 0.00 0.00 179.25 177.25 3dkb h LEU 1068N -1.03 0.46 -9.72 0.00 3.38 -1.33 -3.42 115.31 103.64 3dkb h LEU 1068Ca -0.04 -0.61 -0.54 0.00 0.09 0.00 0.00 57.88 56.78 3dkb h LEU 1068Cb 0.42 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 3dkb h LEU 1068CO 0.06 1.50 0.10 -0.63 0.09 0.00 0.00 178.44 179.57 3dkb s ILE 1069N -2.61 4.51 -1.00 1.22 1.01 -0.88 -1.40 121.20 122.04 3dkb s ILE 1069Ca -0.09 1.51 -0.20 0.00 0.00 0.00 0.00 60.65 61.87 3dkb s ILE 1069Cb 0.06 -4.04 0.10 0.00 0.01 0.00 0.00 42.46 38.60 3dkb s ILE 1069CO 0.86 0.52 1.30 -0.62 0.00 0.00 0.00 174.94 177.00 3dkb s ASP 1070N -1.16 6.62 0.36 3.58 -1.08 -0.17 -4.71 116.67 120.11 3dkb s ASP 1070Ca 0.34 -1.91 0.05 0.00 -0.52 0.00 0.00 52.55 50.50 3dkb s ASP 1070Cb -0.22 -2.47 0.71 0.00 -1.46 0.00 0.00 42.92 39.48 3dkb s ASP 1070CO 0.23 -1.21 1.98 0.03 0.52 0.00 0.00 175.17 176.73 3dkb h ARG 1071N 9.01 0.76 0.81 4.34 -0.00 -1.88 -2.04 114.38 125.37 3dkb h ARG 1071Ca 0.20 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.98 59.60 3dkb h ARG 1071Cb 1.00 -0.17 -0.00 0.00 0.00 0.00 0.00 29.97 30.80 3dkb h ARG 1071CO 1.25 0.50 -0.49 -0.91 0.00 0.00 0.00 179.97 180.33 3dkb h ASN 1072N 0.78 -1.23 -0.90 7.04 2.35 -1.99 -0.74 115.58 120.89 3dkb h ASN 1072Ca 0.27 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 56.07 3dkb h ASN 1072Cb 0.11 0.36 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 3dkb h ASN 1072CO -0.08 -0.76 0.49 0.40 -1.65 0.00 0.00 177.43 175.84 3dkb h ILE 1073N -1.21 1.26 0.48 2.81 2.04 -1.97 -0.74 117.51 120.18 3dkb h ILE 1073Ca -0.11 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 3dkb h ILE 1073Cb 0.97 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3dkb h ILE 1073CO 0.11 0.29 -0.35 1.56 0.00 0.00 0.00 178.15 179.76 3dkb h GLN 1074N 1.26 -0.79 -0.17 2.37 1.08 -1.28 -0.76 115.11 116.82 3dkb h GLN 1074Ca 0.32 0.05 0.03 0.00 -1.45 0.00 0.00 58.65 57.60 3dkb h GLN 1074Cb 0.03 0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 3dkb h GLN 1074CO -0.05 -0.52 -0.02 0.00 -0.95 0.00 0.00 178.83 177.28 3dkb h ALA 1075N -0.42 0.13 0.10 3.87 0.00 -1.00 -0.87 119.26 121.08 3dkb h ALA 1075Ca -0.05 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dkb h ALA 1075Cb 0.69 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 3dkb h ALA 1075CO 0.01 -0.46 -0.51 1.15 0.00 0.00 0.00 179.25 179.44 3dkb h THR 1076N 0.03 0.00 -0.07 0.00 2.02 -0.96 0.29 112.91 114.22 3dkb h THR 1076Ca 0.08 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 3dkb h THR 1076Cb 0.11 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 3dkb h THR 1076CO -0.16 0.00 -0.22 -0.07 0.37 0.00 0.00 175.52 175.44 3dkb h LEU 1077N -0.71 0.11 0.01 2.58 3.38 -1.07 -2.79 115.31 116.81 3dkb h LEU 1077Ca -0.00 -0.03 -0.22 0.00 0.09 0.00 0.00 57.88 57.72 3dkb h LEU 1077Cb 0.72 -0.03 0.02 0.00 0.09 0.00 0.00 40.66 41.46 3dkb h LEU 1077CO -0.29 0.34 -0.86 -0.33 0.09 0.00 0.00 178.44 177.39 3dkb h GLU 1078N 0.10 0.57 -0.20 1.13 5.08 -0.88 0.40 114.58 120.78 3dkb h GLU 1078Ca 0.02 -0.62 0.01 0.00 -1.00 0.00 0.00 59.36 57.77 3dkb h GLU 1078Cb 0.45 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3dkb h GLU 1078CO 0.03 1.24 0.14 0.77 -1.00 0.00 0.00 179.01 180.18 3dkb h SER 1079N 0.16 0.20 -0.60 1.42 0.02 -0.22 0.51 113.55 115.03 3dkb h SER 1079Ca -0.11 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.70 3dkb h SER 1079Cb 1.54 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.96 3dkb h SER 1079CO 0.17 0.14 0.17 0.00 -1.14 0.00 0.00 176.83 176.17 3dkb n GLN 1080N -4.51 3.61 -2.32 3.45 10.64 -1.07 -4.90 117.38 122.28 3dkb n GLN 1080Ca 0.00 -2.62 -0.12 0.00 -1.83 0.00 0.00 57.00 52.43 3dkb n GLN 1080Cb 0.11 -2.10 -0.01 0.00 -0.86 0.00 0.00 30.24 27.38 3dkb n GLN 1080CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3dkb n LYS 1081N 0.09 -2.12 0.01 2.61 4.76 0.17 -4.82 118.16 118.86 3dkb n LYS 1081Ca 0.32 0.62 0.11 0.00 -2.87 0.00 0.00 58.31 56.48 3dkb n LYS 1081Cb 1.19 -5.18 -0.02 0.00 -1.84 0.00 0.00 35.03 29.18 3dkb n LYS 1081CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 3dkb n LYS 1082N -2.70 0.19 -4.21 1.97 3.00 -0.05 -4.55 118.16 111.81 3dkb n LYS 1082Ca -0.15 -0.02 -0.17 0.00 -0.00 0.00 0.00 58.31 57.97 3dkb n LYS 1082Cb 0.59 -1.54 -0.13 0.00 0.00 0.00 0.00 35.03 33.95 3dkb n LYS 1082CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3dkb s LEU 1083N -3.53 2.14 -0.81 3.14 2.96 -0.16 -4.83 118.68 117.58 3dkb s LEU 1083Ca 0.05 -0.35 0.00 0.00 -0.22 0.00 0.00 54.13 53.60 3dkb s LEU 1083Cb 0.15 -0.36 0.00 0.00 0.50 0.00 0.00 46.19 46.48 3dkb s LEU 1083CO 0.83 -0.02 0.00 0.59 -1.32 0.00 0.00 176.35 176.42 3dkb n ASN 1084N 2.16 -2.74 0.08 3.68 3.02 -1.26 -4.39 115.26 115.81 3dkb n ASN 1084Ca -0.18 0.26 -0.10 0.00 -0.03 0.00 0.00 54.58 54.53 3dkb n ASN 1084Cb 0.56 -2.50 -0.03 0.00 -0.61 0.00 0.00 39.78 37.20 3dkb n ASN 1084CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 3dkb h TRP 1085N 0.00 0.39 -2.93 3.10 5.08 -1.88 -3.44 115.95 116.27 3dkb h TRP 1085Ca -0.19 -0.22 -0.55 0.00 1.08 0.00 0.00 58.89 59.01 3dkb h TRP 1085Cb 0.92 -0.04 -0.01 0.00 -3.00 0.00 0.00 29.16 27.03 3dkb h TRP 1085CO 0.56 1.05 0.82 0.00 -1.28 0.00 0.00 178.44 179.58 3dkb n ARG 1087N 5.51 0.45 0.00 0.00 0.63 -1.26 -3.90 116.66 118.10 3dkb n ARG 1087Ca 0.13 -0.21 0.11 0.00 -0.92 0.00 0.00 57.85 56.96 3dkb n ARG 1087Cb 0.44 -1.50 0.06 0.00 0.45 0.00 0.00 32.46 31.92 3dkb n ARG 1087CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3dkb n GLU 1088N -1.09 0.01 -4.33 -0.14 -0.58 -1.26 -4.96 120.64 108.29 3dkb n GLU 1088Ca 0.10 -0.01 -0.24 0.00 -0.42 0.00 0.00 57.16 56.60 3dkb n GLU 1088Cb 0.32 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.61 3dkb n GLU 1088CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3dkb s VAL 1089N -2.99 3.04 0.72 2.62 -7.23 -1.25 -2.87 120.40 112.44 3dkb s VAL 1089Ca 0.10 -2.02 -0.14 0.00 -1.81 0.00 0.00 61.98 58.10 3dkb s VAL 1089Cb 0.17 -2.72 0.03 0.00 0.56 0.00 0.00 36.38 34.42 3dkb s VAL 1089CO 0.79 -0.33 1.16 -0.13 -0.31 0.00 0.00 175.10 176.27 3dkb s ARG 1090N -3.66 2.30 0.31 4.82 0.52 0.07 -4.80 118.95 118.51 3dkb s ARG 1090Ca 0.32 1.58 -0.23 0.00 -0.52 0.00 0.00 55.73 56.88 3dkb s ARG 1090Cb -0.05 -1.87 -0.09 0.00 0.52 0.00 0.00 34.95 33.46 3dkb s ARG 1090CO 0.19 -1.67 0.87 0.15 0.02 0.00 0.00 175.30 174.86 3dkb s LYS 1091N -4.08 4.42 0.03 3.54 1.02 -1.26 -4.87 119.74 118.54 3dkb s LYS 1091Ca 0.70 1.14 0.03 0.00 0.02 0.00 0.00 55.97 57.86 3dkb s LYS 1091Cb -0.25 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 3dkb s LYS 1091CO 0.45 0.27 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.63 3dkb s LEU 1092N -2.22 3.45 0.03 3.17 1.43 -1.26 -1.85 118.68 121.43 3dkb s LEU 1092Ca 0.50 -0.09 0.07 0.00 -1.03 0.00 0.00 54.13 53.58 3dkb s LEU 1092Cb -0.16 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 3dkb s LEU 1092CO 0.21 0.24 -0.20 0.54 0.23 0.00 0.00 176.35 177.38 3dkb s VAL 1093N -1.16 1.60 -0.28 -1.59 0.11 0.12 -4.91 120.40 114.29 3dkb s VAL 1093Ca 0.21 -1.08 -0.17 0.00 -2.93 0.00 0.00 61.98 58.02 3dkb s VAL 1093Cb -0.12 -1.37 -0.03 0.00 -1.53 0.00 0.00 36.38 33.33 3dkb s VAL 1093CO 0.13 0.26 0.46 0.00 -3.33 0.00 0.00 175.10 172.62 3dkb s ALA 1094N -0.70 3.56 0.04 1.54 0.00 -1.26 -1.58 121.76 123.37 3dkb s ALA 1094Ca 0.07 -0.77 -0.18 0.00 0.00 0.00 0.00 51.96 51.08 3dkb s ALA 1094Cb -0.08 -2.85 -0.06 0.00 0.00 0.00 0.00 23.12 20.13 3dkb s ALA 1094CO 0.01 -0.81 0.53 -0.51 0.00 0.00 0.00 175.76 174.98 3dkb s LEU 1095N 2.23 4.50 0.36 0.00 1.43 -1.08 -1.00 118.68 125.12 3dkb s LEU 1095Ca 0.18 1.16 -0.27 0.00 -1.03 0.00 0.00 54.13 54.18 3dkb s LEU 1095Cb -0.16 -2.81 -0.12 0.00 0.03 0.00 0.00 46.19 43.13 3dkb s LEU 1095CO 0.10 0.26 1.22 0.29 0.23 0.00 0.00 176.35 178.46 3dkb n LYS 1096N 1.91 1.91 -3.77 1.70 5.02 -0.49 -4.11 118.16 120.34 3dkb n LYS 1096Ca -0.11 0.67 -0.13 0.00 -2.02 0.00 0.00 58.31 56.73 3dkb n LYS 1096Cb 0.51 -2.25 -0.13 0.00 -0.02 0.00 0.00 35.03 33.14 3dkb n LYS 1096CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3dkb s THR 1097N -1.13 -0.03 -0.01 -0.18 -1.32 -1.26 -4.96 115.64 106.76 3dkb s THR 1097Ca 0.58 0.10 -0.35 0.00 -1.21 0.00 0.00 61.69 60.81 3dkb s THR 1097Cb -0.57 -0.29 -0.13 0.00 -1.51 0.00 0.00 72.50 70.00 3dkb s THR 1097CO 0.61 0.04 1.75 -3.20 -2.21 0.00 0.00 174.62 171.60 3dkb n ASN 1098N 3.72 3.18 -3.38 8.08 2.85 -1.26 -4.89 115.26 123.57 3dkb n ASN 1098Ca -0.21 1.02 -0.39 0.00 -0.11 0.00 0.00 54.58 54.90 3dkb n ASN 1098Cb 0.55 -1.37 0.01 0.00 1.24 0.00 0.00 39.78 40.21 3dkb n ASN 1098CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3dkb n GLY 1099N 3.97 5.60 1.39 8.20 0.00 -1.26 -3.88 105.19 119.21 3dkb n GLY 1099Ca 0.21 -2.33 0.06 0.00 0.00 0.00 0.00 46.02 43.95 3dkb n GLY 1099CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dkb n ASP 1100N 0.52 4.08 0.00 1.61 3.85 -1.26 -4.86 116.55 120.49 3dkb n ASP 1100Ca 0.53 -2.52 0.00 0.00 -0.71 0.00 0.00 54.79 52.09 3dkb n ASP 1100Cb 0.28 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 39.48 3dkb n ASP 1100CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dkb n GLY 1101N 0.67 0.83 0.26 6.12 0.00 -1.26 -0.67 105.19 111.13 3dkb n GLY 1101Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 3dkb n GLY 1101CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dkb n ASN 1102N 0.00 2.40 0.30 1.61 5.15 -1.26 -4.19 115.26 119.27 3dkb n ASN 1102Ca 0.00 -3.23 0.20 0.00 -0.60 0.00 0.00 54.58 50.95 3dkb n ASN 1102Cb 0.00 -0.46 0.94 0.00 -0.53 0.00 0.00 39.78 39.73 3dkb n ASN 1102CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dkb h LEU 1104N 0.00 0.85 -0.24 0.00 5.85 -1.87 0.20 115.31 120.10 3dkb h LEU 1104Ca 0.00 -0.31 -0.21 0.00 0.84 0.00 0.00 57.88 58.20 3dkb h LEU 1104Cb 0.27 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 3dkb h LEU 1104CO 0.00 0.95 -0.90 0.24 -0.34 0.00 0.00 178.44 178.39 3dkb h MET 1105N 0.72 0.30 -0.28 1.25 2.86 -1.80 -0.88 114.93 117.11 3dkb h MET 1105Ca 0.14 -0.32 -0.04 0.00 -2.06 0.00 0.00 59.70 57.41 3dkb h MET 1105Cb 0.52 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 3dkb h MET 1105CO 0.03 1.02 0.01 0.45 1.06 0.00 0.00 176.91 179.48 3dkb h HIS 1106N 0.17 0.52 0.34 -0.22 3.86 -1.19 0.18 115.15 118.80 3dkb h HIS 1106Ca -0.06 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.05 3dkb h HIS 1106Cb 1.53 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.87 3dkb h HIS 1106CO 0.04 0.62 -0.16 0.00 0.86 0.00 0.00 177.93 179.29 3dkb h ALA 1107N 0.84 -0.46 -0.30 2.45 0.00 -0.60 -0.81 119.26 120.38 3dkb h ALA 1107Ca 0.08 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3dkb h ALA 1107Cb 0.40 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3dkb h ALA 1107CO 0.01 -0.76 0.17 1.15 0.00 0.00 0.00 179.25 179.83 3dkb h THR 1108N -0.46 1.11 -0.89 0.00 2.02 -1.11 -2.01 112.91 111.58 3dkb h THR 1108Ca -0.05 -0.27 0.02 0.00 0.77 0.00 0.00 66.41 66.89 3dkb h THR 1108Cb 0.35 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.47 3dkb h THR 1108CO 0.08 0.11 0.58 -1.28 0.37 0.00 0.00 175.52 175.38 3dkb h SER 1109N 0.37 0.98 -0.57 4.18 0.87 -0.60 -2.56 113.55 116.22 3dkb h SER 1109Ca 0.11 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 3dkb h SER 1109Cb 0.02 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 3dkb h SER 1109CO -0.02 0.69 0.22 1.56 -0.53 0.00 0.00 176.83 178.75 3dkb h GLN 1110N 1.15 0.86 -0.37 2.24 4.20 -0.51 0.85 115.11 123.53 3dkb h GLN 1110Ca 0.34 -0.16 0.08 0.00 0.06 0.00 0.00 58.65 58.97 3dkb h GLN 1110Cb -0.05 -0.14 -0.08 0.00 0.30 0.00 0.00 27.48 27.51 3dkb h GLN 1110CO -0.10 0.75 -0.21 -0.92 -0.67 0.00 0.00 178.83 177.68 3dkb h TYR 1111N 0.79 -0.55 0.00 2.96 3.20 -0.94 -0.87 116.97 121.56 3dkb h TYR 1111Ca 0.19 0.04 -0.24 0.00 3.14 0.00 0.00 58.73 61.86 3dkb h TYR 1111Cb 0.21 0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 3dkb h TYR 1111CO 0.01 -0.29 -1.58 0.52 -1.64 0.00 0.00 178.16 175.18 3dkb h MET 1112N -0.15 0.00 0.00 1.82 0.00 -1.51 -2.42 114.93 112.66 3dkb h MET 1112Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 59.70 59.82 3dkb h MET 1112Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.03 3dkb h MET 1112CO -0.47 0.42 -1.30 0.91 0.00 0.00 0.00 176.91 176.48 3dkb n TRP 1113N -2.99 0.00 0.00 -0.22 8.01 0.29 -3.64 117.44 118.88 3dkb n TRP 1113Ca -0.14 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.05 3dkb n TRP 1113Cb 0.97 -0.20 0.00 0.00 -2.01 0.00 0.00 31.31 30.07 3dkb n TRP 1113CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3dkb n GLY 1114N 2.60 1.28 3.77 6.99 0.00 -0.34 -4.77 105.19 114.73 3dkb n GLY 1114Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 3dkb n GLY 1114CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dkb s VAL 1115N -2.30 4.16 0.62 1.61 -7.23 -1.26 -3.92 120.40 112.08 3dkb s VAL 1115Ca 0.00 -1.50 0.02 0.00 -1.81 0.00 0.00 61.98 58.69 3dkb s VAL 1115Cb 0.00 -3.22 0.08 0.00 0.56 0.00 0.00 36.38 33.79 3dkb s VAL 1115CO 0.00 -0.32 0.85 -1.10 -0.31 0.00 0.00 175.10 174.23 3dkb s GLN 1116N -3.67 2.18 -0.69 4.82 -1.52 -1.26 -2.00 119.66 117.51 3dkb s GLN 1116Ca 0.32 -1.05 -0.06 0.00 -1.95 0.00 0.00 55.36 52.62 3dkb s GLN 1116Cb -0.08 -2.46 -0.08 0.00 -0.22 0.00 0.00 33.01 30.18 3dkb s GLN 1116CO 0.23 -1.01 3.05 -3.47 -0.25 0.00 0.00 175.29 173.85 3dkb n ASP 1117N -2.50 6.81 0.05 5.90 4.64 -1.26 -4.56 116.55 125.62 3dkb n ASP 1117Ca 0.12 -2.80 0.03 0.00 -1.38 0.00 0.00 54.79 50.75 3dkb n ASP 1117Cb 0.60 -1.39 0.40 0.00 -1.04 0.00 0.00 41.12 39.69 3dkb n ASP 1117CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 3dkb h THR 1118N 2.32 1.14 -0.13 5.18 1.35 -1.96 -1.55 112.91 119.26 3dkb h THR 1118Ca 0.48 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 3dkb h THR 1118Cb 0.84 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 3dkb h THR 1118CO 0.95 0.17 0.00 0.47 -0.25 0.00 0.00 175.52 176.85 3dkb n ASP 1119N -4.39 1.81 -2.24 5.36 10.43 -1.26 -4.94 116.55 121.33 3dkb n ASP 1119Ca 0.01 -1.68 -0.21 0.00 2.57 0.00 0.00 54.79 55.49 3dkb n ASP 1119Cb 0.16 -0.08 -0.02 0.00 1.84 0.00 0.00 41.12 43.02 3dkb n ASP 1119CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3dkb n LEU 1120N 0.42 -1.88 -0.07 0.64 4.77 -0.58 -4.90 117.00 115.40 3dkb n LEU 1120Ca 0.17 0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 56.08 3dkb n LEU 1120Cb 0.37 -2.89 -0.06 0.00 -2.33 0.00 0.00 43.42 38.51 3dkb n LEU 1120CO 0.14 -0.33 0.66 0.58 -1.33 0.00 0.00 177.39 177.11 3dkb h VAL 1121N 0.00 1.31 -0.32 4.08 2.07 -1.92 0.70 116.25 122.17 3dkb h VAL 1121Ca -0.48 -1.16 -0.10 0.00 0.82 0.00 0.00 66.70 65.78 3dkb h VAL 1121Cb 1.36 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.79 3dkb h VAL 1121CO 0.58 0.35 -0.21 -0.07 0.02 0.00 0.00 177.57 178.24 3dkb h LEU 1122N 0.09 0.74 -1.80 2.57 3.38 -1.92 0.99 115.31 119.36 3dkb h LEU 1122Ca 0.04 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.59 3dkb h LEU 1122Cb 0.58 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3dkb h LEU 1122CO 0.03 1.01 0.14 -0.09 0.09 0.00 0.00 178.44 179.62 3dkb h ARG 1123N 0.47 0.27 -0.04 1.13 9.65 -1.92 -1.57 114.38 122.37 3dkb h ARG 1123Ca 0.06 -0.02 -0.15 0.00 -1.10 0.00 0.00 59.98 58.78 3dkb h ARG 1123Cb 0.76 -0.06 0.01 0.00 -1.39 0.00 0.00 29.97 29.29 3dkb h ARG 1123CO 0.06 0.18 -0.57 -0.22 2.80 0.00 0.00 179.97 182.22 3dkb h LYS 1124N 0.27 0.46 -0.97 0.20 1.63 -0.50 -3.02 116.57 114.64 3dkb h LYS 1124Ca 0.08 -0.44 0.05 0.00 -0.85 0.00 0.00 60.65 59.49 3dkb h LYS 1124Cb -0.01 0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 31.67 3dkb h LYS 1124CO -0.02 1.08 0.63 0.00 -3.45 0.00 0.00 179.45 177.69 3dkb h ALA 1125N 0.39 1.31 0.35 5.00 0.00 -0.04 0.38 119.26 126.66 3dkb h ALA 1125Ca -0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3dkb h ALA 1125Cb 1.25 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3dkb h ALA 1125CO 0.11 0.46 -0.19 1.25 0.00 0.00 0.00 179.25 180.89 3dkb h LEU 1126N 1.18 -0.46 -0.93 0.00 5.85 -1.35 -0.76 115.31 118.84 3dkb h LEU 1126Ca 0.40 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.14 3dkb h LEU 1126Cb 0.08 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3dkb h LEU 1126CO -0.15 -0.31 0.57 0.15 -0.34 0.00 0.00 178.44 178.36 3dkb h PHE 1127N -0.50 1.22 -0.53 1.25 3.57 -1.35 -1.73 116.94 118.87 3dkb h PHE 1127Ca -0.04 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 3dkb h PHE 1127Cb 0.40 -0.40 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 3dkb h PHE 1127CO -0.07 0.80 0.30 0.77 -2.23 0.00 0.00 178.31 177.89 3dkb h SER 1128N 1.28 0.64 -0.32 0.41 0.02 -0.68 -2.32 113.55 112.58 3dkb h SER 1128Ca 0.33 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 3dkb h SER 1128Cb -0.07 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 3dkb h SER 1128CO -0.06 0.53 0.14 0.74 -1.14 0.00 0.00 176.83 177.03 3dkb h THR 1129N 0.70 1.18 0.00 -2.27 2.02 -0.74 0.33 112.91 114.13 3dkb h THR 1129Ca 0.19 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.83 3dkb h THR 1129Cb 0.02 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3dkb h THR 1129CO -0.03 0.19 0.00 0.18 0.37 0.00 0.00 175.52 176.23 3dkb n LEU 1130N -4.72 0.00 -0.02 2.58 4.77 -0.69 -2.56 117.00 116.36 3dkb n LEU 1130Ca -0.01 0.34 -0.03 0.00 -0.03 0.00 0.00 56.01 56.28 3dkb n LEU 1130Cb 0.13 -0.34 -0.02 0.00 -2.33 0.00 0.00 43.42 40.86 3dkb n LEU 1130CO 0.36 -0.19 -0.64 0.29 -1.33 0.00 0.00 177.39 175.89 3dkb n LYS 1131N -1.34 0.14 -0.90 3.23 5.02 -0.89 -4.80 118.16 118.61 3dkb n LYS 1131Ca 0.06 0.02 -0.05 0.00 -2.02 0.00 0.00 58.31 56.32 3dkb n LYS 1131Cb 0.12 -1.09 0.18 0.00 -0.02 0.00 0.00 35.03 34.23 3dkb n LYS 1131CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dkb n GLU 1132N -2.62 1.97 -4.12 1.97 1.02 0.11 -5.01 120.64 113.96 3dkb n GLU 1132Ca -0.08 -3.33 -0.10 0.00 -0.02 0.00 0.00 57.16 53.64 3dkb n GLU 1132Cb 0.58 -1.83 -0.09 0.00 -0.02 0.00 0.00 31.44 30.08 3dkb n GLU 1132CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dkb s THR 1133N -3.44 0.06 -0.33 2.62 2.01 -1.06 -4.86 115.64 110.64 3dkb s THR 1133Ca 0.44 -1.81 -0.28 0.00 0.31 0.00 0.00 61.69 60.36 3dkb s THR 1133Cb 0.40 -2.15 0.02 0.00 0.01 0.00 0.00 72.50 70.78 3dkb s THR 1133CO -0.02 -0.27 1.02 -0.62 -0.69 0.00 0.00 174.62 174.05 3dkb s ASP 1134N -3.06 6.86 -0.19 3.53 -1.08 -1.19 -4.88 116.67 116.65 3dkb s ASP 1134Ca 0.27 0.92 0.16 0.00 -0.52 0.00 0.00 52.55 53.38 3dkb s ASP 1134Cb 0.06 -2.52 0.50 0.00 -1.46 0.00 0.00 42.92 39.50 3dkb s ASP 1134CO 0.05 -0.86 1.40 0.35 0.52 0.00 0.00 175.17 176.63 3dkb n THR 1135N 5.88 2.30 -0.22 1.71 -2.24 -1.26 -4.66 114.28 115.79 3dkb n THR 1135Ca 0.10 -2.08 -0.06 0.00 -2.27 0.00 0.00 64.05 59.74 3dkb n THR 1135Cb 0.47 -0.27 0.04 0.00 -2.10 0.00 0.00 70.33 68.47 3dkb n THR 1135CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3dkb h ARG 1136N 1.45 0.86 -0.44 -0.78 2.43 -1.99 0.50 114.38 116.41 3dkb h ARG 1136Ca 0.04 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 3dkb h ARG 1136Cb 1.44 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 3dkb h ARG 1136CO 0.23 0.64 0.07 -2.95 -1.51 0.00 0.00 179.97 176.45 3dkb h ASN 1137N 0.84 0.71 0.03 -3.80 -1.07 -2.00 -1.58 115.58 108.72 3dkb h ASN 1137Ca 0.22 -0.26 -0.00 0.00 0.07 0.00 0.00 56.30 56.33 3dkb h ASN 1137Cb 0.02 -0.19 0.00 0.00 -2.07 0.00 0.00 38.32 36.08 3dkb h ASN 1137CO -0.04 0.79 -0.01 -0.26 0.07 0.00 0.00 177.43 177.98 3dkb h PHE 1138N 0.60 -0.04 -0.66 4.14 0.05 -1.78 -1.83 116.94 117.42 3dkb h PHE 1138Ca 0.13 -0.00 0.11 0.00 3.82 0.00 0.00 57.97 62.03 3dkb h PHE 1138Cb 0.39 0.01 -0.08 0.00 2.00 0.00 0.00 35.95 38.27 3dkb h PHE 1138CO 0.03 0.34 0.24 0.87 -0.18 0.00 0.00 178.31 179.61 3dkb h LYS 1139N -0.42 0.40 0.84 1.51 1.57 -0.00 0.12 116.57 120.60 3dkb h LYS 1139Ca -0.00 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 3dkb h LYS 1139Cb 0.39 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3dkb h LYS 1139CO 0.01 0.26 -0.48 0.35 -0.57 0.00 0.00 179.45 179.02 3dkb h PHE 1140N 0.41 -1.27 -0.17 -1.35 3.57 -1.22 -0.40 116.94 116.51 3dkb h PHE 1140Ca 0.34 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.87 3dkb h PHE 1140Cb 0.46 0.44 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 3dkb h PHE 1140CO -0.17 -0.73 0.13 0.00 -2.23 0.00 0.00 178.31 175.31 3dkb h ARG 1141N -1.23 0.00 -0.02 1.11 3.08 -1.01 -0.71 114.38 115.60 3dkb h ARG 1141Ca -0.11 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 3dkb h ARG 1141Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 3dkb h ARG 1141CO 0.14 0.00 -0.10 2.35 -1.07 0.00 0.00 179.97 181.28 3dkb h TRP 1142N 0.00 0.14 -0.68 3.04 7.01 -0.63 -2.61 115.95 122.23 3dkb h TRP 1142Ca 0.08 -0.06 0.04 0.00 2.11 0.00 0.00 58.89 61.06 3dkb h TRP 1142Cb 0.35 -0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.34 3dkb h TRP 1142CO 0.00 0.77 0.41 1.96 -2.79 0.00 0.00 178.44 178.79 3dkb h GLN 1143N -0.53 0.77 0.29 2.65 4.20 -0.57 -1.66 115.11 120.25 3dkb h GLN 1143Ca -0.01 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3dkb h GLN 1143Cb 0.79 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 3dkb h GLN 1143CO 0.02 0.51 -0.22 1.25 -0.67 0.00 0.00 178.83 179.72 3dkb h LEU 1144N 0.79 -0.57 -0.91 1.46 5.85 -1.18 -2.31 115.31 118.45 3dkb h LEU 1144Ca 0.28 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.04 3dkb h LEU 1144Cb 0.07 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3dkb h LEU 1144CO -0.13 -0.31 0.00 1.21 -0.34 0.00 0.00 178.44 178.87 3dkb n GLU 1145N -3.65 0.13 0.08 1.25 2.13 -0.98 -1.45 120.64 118.16 3dkb n GLU 1145Ca -0.06 0.52 -0.12 0.00 0.66 0.00 0.00 57.16 58.16 3dkb n GLU 1145Cb 0.21 -1.84 -0.08 0.00 0.27 0.00 0.00 31.44 30.00 3dkb n GLU 1145CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3dkb h SER 1146N 0.00 -0.21 0.61 4.31 0.87 -1.01 -2.45 113.55 115.66 3dkb h SER 1146Ca 0.00 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 3dkb h SER 1146Cb 0.15 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 3dkb h SER 1146CO 0.00 0.27 0.00 0.18 -0.53 0.00 0.00 176.83 176.75 3dkb n LEU 1147N -4.98 0.54 -1.34 2.23 4.77 -0.89 -4.95 117.00 112.37 3dkb n LEU 1147Ca -0.08 0.65 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 3dkb n LEU 1147Cb 0.26 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 3dkb n LEU 1147CO 0.28 -0.55 -0.21 0.29 -1.33 0.00 0.00 177.39 175.87 3dkb n LYS 1148N -2.11 -2.38 -2.90 3.23 4.01 -0.53 -5.08 118.16 112.41 3dkb n LYS 1148Ca 0.02 1.98 -0.05 0.00 -0.51 0.00 0.00 58.31 59.75 3dkb n LYS 1148Cb 0.20 -2.05 -0.00 0.00 -0.51 0.00 0.00 35.03 32.66 3dkb n LYS 1148CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3dkb s SER 1149N -0.24 -1.20 0.00 4.39 0.15 -1.24 -4.92 113.70 110.64 3dkb s SER 1149Ca 0.00 -1.66 0.00 0.00 0.70 0.00 0.00 55.95 54.99 3dkb s SER 1149Cb 0.00 1.71 0.00 0.00 -1.71 0.00 0.00 66.02 66.02 3dkb s SER 1149CO 0.00 -0.09 0.00 0.00 1.20 0.00 0.00 173.24 174.35 3dkb n GLN 1150N 3.23 0.00 0.00 5.44 6.02 -1.26 -4.67 117.38 126.14 3dkb n GLN 1150Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 3dkb n GLN 1150Cb 0.55 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.81 3dkb n GLN 1150CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3dkb n GLU 1151N 0.00 0.10 -2.62 -1.09 2.13 -1.26 -4.88 120.64 113.01 3dkb n GLU 1151Ca 0.00 -0.01 -0.13 0.00 0.66 0.00 0.00 57.16 57.68 3dkb n GLU 1151Cb 0.00 -0.31 0.02 0.00 0.27 0.00 0.00 31.44 31.43 3dkb n GLU 1151CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 3dkb n PHE 1152N -0.02 1.69 -3.15 4.31 1.16 -1.26 -4.99 117.46 115.21 3dkb n PHE 1152Ca 0.00 -2.85 0.05 0.00 -1.87 0.00 0.00 57.45 52.78 3dkb n PHE 1152Cb 0.14 -0.31 -0.00 0.00 -1.61 0.00 0.00 39.48 37.70 3dkb n PHE 1152CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3dkb s VAL 1153N -3.71 -0.53 0.00 1.97 0.11 -1.26 -4.78 120.40 112.19 3dkb s VAL 1153Ca 0.32 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.37 3dkb s VAL 1153Cb 0.44 -0.66 0.00 0.00 -1.53 0.00 0.00 36.38 34.63 3dkb s VAL 1153CO -0.02 0.00 0.00 1.21 -3.33 0.00 0.00 175.10 172.96 3dkb n GLU 1154N 5.29 0.00 0.00 1.54 0.00 -1.26 -4.83 120.64 121.38 3dkb n GLU 1154Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.20 3dkb n GLU 1154Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.99 3dkb n GLU 1154CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3dkb n TYR 1159N 11.90 0.00 -2.08 4.31 4.02 -1.26 -5.18 117.16 128.87 3dkb n TYR 1159Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 3dkb n TYR 1159Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3dkb n TYR 1159CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 3dkb n ASP 1160N 0.00 0.00 -3.50 7.72 5.75 -1.26 -5.13 116.55 120.14 3dkb n ASP 1160Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.50 3dkb n ASP 1160Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 39.98 3dkb n ASP 1160CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3dkb s THR 1161N 0.85 0.59 0.09 2.12 2.01 -1.26 -5.04 115.64 115.00 3dkb s THR 1161Ca 0.00 -2.40 0.00 0.00 0.31 0.00 0.00 61.69 59.60 3dkb s THR 1161Cb 0.00 -1.42 0.00 0.00 0.01 0.00 0.00 72.50 71.09 3dkb s THR 1161CO 0.00 -1.08 0.00 -1.14 -0.69 0.00 0.00 174.62 171.71 3dkb n ARG 1162N 3.32 -2.43 0.00 4.92 3.00 -1.26 -5.05 116.66 119.16 3dkb n ARG 1162Ca 0.20 2.00 0.00 0.00 -0.00 0.00 0.00 57.85 60.05 3dkb n ARG 1162Cb 0.41 -1.85 0.00 0.00 0.00 0.00 0.00 32.46 31.02 3dkb n ARG 1162CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 3dkb n ASN 1163N 0.82 0.00 -0.00 6.15 5.15 -1.26 -5.05 115.26 121.07 3dkb n ASN 1163Ca 0.00 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3dkb n ASN 1163Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3dkb n ASN 1163CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 3dkb n TRP 1164N 0.00 -0.00 -0.16 1.20 5.03 -1.26 -0.17 117.44 122.08 3dkb n TRP 1164Ca 0.00 0.01 0.16 0.00 3.03 0.00 0.00 57.50 60.69 3dkb n TRP 1164Cb 0.00 -0.26 0.29 0.00 -1.03 0.00 0.00 31.31 30.31 3dkb n TRP 1164CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 3dkb n ASN 1165N -2.53 0.15 -0.05 -0.99 4.13 -1.26 0.61 115.26 115.33 3dkb n ASN 1165Ca 0.00 0.75 -0.05 0.00 1.68 0.00 0.00 54.58 56.96 3dkb n ASN 1165Cb 0.00 -0.37 -0.05 0.00 -1.54 0.00 0.00 39.78 37.82 3dkb n ASN 1165CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 3dkb h ASP 1166N 0.00 -0.02 -1.03 6.41 5.19 -0.99 -2.44 116.42 123.54 3dkb h ASP 1166Ca 0.40 -0.35 0.29 0.00 -0.62 0.00 0.00 57.03 56.74 3dkb h ASP 1166Cb 1.11 0.01 -0.05 0.00 0.18 0.00 0.00 39.33 40.57 3dkb h ASP 1166CO -0.33 0.65 0.72 -0.08 -3.12 0.00 0.00 179.24 177.08 3dkb h GLU 1167N -1.00 0.11 0.15 3.56 4.81 0.43 0.29 114.58 122.93 3dkb h GLU 1167Ca -0.00 -0.01 -0.31 0.00 -0.13 0.00 0.00 59.36 58.92 3dkb h GLU 1167Cb 0.37 -0.02 0.03 0.00 0.63 0.00 0.00 28.75 29.76 3dkb h GLU 1167CO 0.00 0.07 -1.29 2.35 -0.73 0.00 0.00 179.01 179.42 3dkb h TRP 1168N 0.11 1.01 0.00 0.92 2.91 -0.68 -2.87 115.95 117.36 3dkb h TRP 1168Ca 0.51 -0.66 -0.08 0.00 1.13 0.00 0.00 58.89 59.80 3dkb h TRP 1168Cb 1.82 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 30.39 3dkb h TRP 1168CO -0.00 1.50 -0.36 -0.44 -1.03 0.00 0.00 178.44 178.11 3dkb h ASP 1169N 0.23 0.00 -0.16 2.65 5.19 -0.28 -2.71 116.42 121.35 3dkb h ASP 1169Ca -0.20 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.12 3dkb h ASP 1169Cb 1.97 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.48 3dkb h ASP 1169CO 0.25 0.36 -0.24 -1.13 -3.12 0.00 0.00 179.24 175.36 3dkb h ASN 1170N 0.00 0.48 -0.62 6.45 -0.00 -0.61 -2.30 115.58 118.99 3dkb h ASN 1170Ca -0.00 -0.52 0.18 0.00 -0.00 0.00 0.00 56.30 55.95 3dkb h ASN 1170Cb 0.88 -0.14 -0.02 0.00 -0.00 0.00 0.00 38.32 39.03 3dkb h ASN 1170CO 0.05 0.91 0.52 -0.07 -0.00 0.00 0.00 177.43 178.84 3dkb h LEU 1171N 0.07 0.00 -0.59 0.34 3.38 -1.25 0.99 115.31 118.25 3dkb h LEU 1171Ca 0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 3dkb h LEU 1171Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3dkb h LEU 1171CO 0.05 0.00 -0.62 0.40 0.09 0.00 0.00 178.44 178.37 3dkb h ILE 1172N 0.00 1.37 -0.23 1.22 2.04 -1.14 -3.04 117.51 117.72 3dkb h ILE 1172Ca 0.29 -1.98 -0.16 0.00 1.00 0.00 0.00 64.86 64.02 3dkb h ILE 1172Cb 1.33 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 3dkb h ILE 1172CO -0.00 0.59 -0.49 0.11 0.00 0.00 0.00 178.15 178.35 3dkb h LYS 1173N 0.24 0.63 -0.08 2.37 6.56 0.13 -2.85 116.57 123.57 3dkb h LYS 1173Ca -0.01 -0.37 -0.03 0.00 -1.06 0.00 0.00 60.65 59.18 3dkb h LYS 1173Cb 1.14 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.82 3dkb h LYS 1173CO 0.10 0.98 -0.10 0.52 -2.06 0.00 0.00 179.45 178.89 3dkb h MET 1174N 0.50 0.12 0.00 3.15 2.86 -1.24 -1.43 114.93 118.89 3dkb h MET 1174Ca 0.02 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3dkb h MET 1174Cb 1.04 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.68 3dkb h MET 1174CO 0.10 0.23 0.00 0.00 1.06 0.00 0.00 176.91 178.30 3dkb h ALA 1175N 1.78 1.00 -2.38 6.32 0.00 -1.40 -3.41 119.26 121.18 3dkb h ALA 1175Ca 0.03 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.44 3dkb h ALA 1175Cb 0.26 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.16 3dkb h ALA 1175CO 0.02 0.00 0.33 -1.54 0.00 0.00 0.00 179.25 178.05 3dkb s SER 1176N -5.56 4.52 0.00 0.00 1.04 -0.54 -4.26 113.70 108.90 3dkb s SER 1176Ca 0.01 1.44 0.29 0.00 0.48 0.00 0.00 55.95 58.17 3dkb s SER 1176Cb 0.09 -2.19 1.68 0.00 0.10 0.00 0.00 66.02 65.70 3dkb s SER 1176CO 0.53 -1.97 2.07 0.35 0.98 0.00 0.00 173.24 175.20 3dkb n THR 1177N -3.45 0.02 -1.15 2.02 -2.24 -1.26 -4.61 114.28 103.62 3dkb n THR 1177Ca 0.07 0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.52 3dkb n THR 1177Cb 0.55 -0.54 0.12 0.00 -2.10 0.00 0.00 70.33 68.36 3dkb n THR 1177CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3dkb s ASP 1178N -2.14 3.64 -0.13 3.42 -0.00 -1.26 -4.92 116.67 115.28 3dkb s ASP 1178Ca 0.40 2.38 -0.08 0.00 -0.00 0.00 0.00 52.55 55.26 3dkb s ASP 1178Cb 0.20 -2.59 -0.04 0.00 -0.00 0.00 0.00 42.92 40.49 3dkb s ASP 1178CO 0.36 -2.63 0.14 -0.89 -0.00 0.00 0.00 175.17 172.15 3dkb s THR 1179N -2.10 5.49 0.74 -1.27 2.01 -1.26 -3.94 115.64 115.31 3dkb s THR 1179Ca 0.74 0.21 -0.11 0.00 0.31 0.00 0.00 61.69 62.84 3dkb s THR 1179Cb -0.29 -3.42 0.04 0.00 0.01 0.00 0.00 72.50 68.84 3dkb s THR 1179CO 0.50 0.59 1.08 -2.84 -0.69 0.00 0.00 174.62 173.25 3dkb s PRO 1180N -0.79 2.53 -1.03 4.92 0.02 -1.26 -4.89 135.00 134.49 3dkb s PRO 1180Ca 0.14 0.88 -0.06 0.00 0.02 0.00 0.00 61.00 61.99 3dkb s PRO 1180Cb -0.12 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.49 3dkb s PRO 1180CO 0.03 -1.37 2.69 -1.33 -0.33 0.00 0.00 177.00 176.69 3dkb n MET 1181N -3.30 3.68 -3.70 5.54 2.81 -1.26 -4.64 117.12 116.25 3dkb n MET 1181Ca 0.08 -2.77 -0.22 0.00 -1.81 0.00 0.00 57.70 52.97 3dkb n MET 1181Cb 0.54 -2.48 0.03 0.00 -0.71 0.00 0.00 33.22 30.61 3dkb n MET 1181CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dkb n ALA 1182N 1.86 -2.10 0.41 3.04 0.00 -1.26 -4.85 120.51 117.61 3dkb n ALA 1182Ca 0.60 -0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.99 3dkb n ALA 1182Cb 0.38 -2.35 0.49 0.00 0.00 0.00 0.00 19.45 17.97 3dkb n ALA 1182CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dkb h ARG 1183N -1.82 0.00 0.00 0.00 3.08 -1.93 -3.33 114.38 110.37 3dkb h ARG 1183Ca -0.62 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.43 3dkb h ARG 1183Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.41 3dkb h ARG 1183CO 0.55 0.00 0.00 0.45 -1.07 0.00 0.00 179.97 179.90 3dkb n SER 1184N -2.30 0.00 0.00 7.04 2.88 -1.26 -5.06 113.62 114.92 3dkb n SER 1184Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 3dkb n SER 1184Cb 0.26 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 3dkb n SER 1184CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dkb n GLY 1185N 0.00 1.99 3.56 0.46 0.00 -1.25 -5.13 105.19 104.82 3dkb n GLY 1185Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3dkb n GLY 1185CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dkb s LEU 1186N 0.00 2.92 0.43 0.99 2.01 -1.26 -5.04 118.68 118.73 3dkb s LEU 1186Ca 0.00 -0.79 0.15 0.00 0.01 0.00 0.00 54.13 53.51 3dkb s LEU 1186Cb 0.00 -1.46 0.95 0.00 0.01 0.00 0.00 46.19 45.69 3dkb s LEU 1186CO 0.00 0.03 1.95 -0.61 1.01 0.00 0.00 176.35 178.73 3dkb h GLN 1187N 2.19 0.00 -5.11 1.70 4.15 -1.86 -3.40 115.11 112.78 3dkb h GLN 1187Ca -0.43 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 58.62 3dkb h GLN 1187Cb 1.25 0.00 -0.14 0.00 0.21 0.00 0.00 27.48 28.79 3dkb h GLN 1187CO 0.59 0.24 -0.67 0.71 -1.93 0.00 0.00 178.83 177.77 3dkb s TYR 1188N -4.45 1.51 0.38 3.99 1.51 0.15 -4.41 117.35 116.04 3dkb s TYR 1188Ca -0.03 -0.87 -0.25 0.00 -1.01 0.00 0.00 57.07 54.91 3dkb s TYR 1188Cb 0.15 -0.85 -0.09 0.00 -0.11 0.00 0.00 41.96 41.06 3dkb s TYR 1188CO 0.70 0.01 1.09 0.54 -1.11 0.00 0.00 175.55 176.77 3dkb s ASN 1189N -3.28 6.75 0.40 2.29 6.03 -1.25 -4.39 114.94 121.48 3dkb s ASN 1189Ca 0.26 2.16 -0.23 0.00 -1.03 0.00 0.00 52.86 54.01 3dkb s ASN 1189Cb 0.05 -2.60 -0.10 0.00 -3.03 0.00 0.00 41.25 35.57 3dkb s ASN 1189CO 0.07 -0.50 0.98 -0.44 -2.03 0.00 0.00 177.10 175.17 3dkb s SER 1190N -1.35 6.96 0.13 3.54 0.01 -1.26 -4.61 113.70 117.12 3dkb s SER 1190Ca 0.56 1.82 0.04 0.00 1.31 0.00 0.00 55.95 59.68 3dkb s SER 1190Cb -0.26 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.37 3dkb s SER 1190CO 0.32 -0.34 0.15 -0.76 0.41 0.00 0.00 173.24 173.02 3dkb s LEU 1191N -2.79 3.92 0.54 2.44 1.43 -1.26 -4.88 118.68 118.08 3dkb s LEU 1191Ca 0.58 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.67 3dkb s LEU 1191Cb -0.15 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.54 3dkb s LEU 1191CO 0.20 0.10 0.08 -1.83 0.23 0.00 0.00 176.35 175.13 3dkb s GLU 1192N -2.90 2.24 0.19 1.70 4.04 -1.26 -5.01 118.70 117.70 3dkb s GLU 1192Ca 0.31 -2.38 -0.25 0.00 0.04 0.00 0.00 54.97 52.70 3dkb s GLU 1192Cb -0.11 -1.62 0.08 0.00 0.02 0.00 0.00 34.13 32.49 3dkb s GLU 1192CO 0.24 -0.47 1.55 0.93 -1.84 0.00 0.00 175.26 175.67 3dkb h GLU 1193N 1.16 -0.03 -0.95 -4.83 3.07 -1.96 0.12 114.58 111.16 3dkb h GLU 1193Ca -0.42 0.00 0.19 0.00 -0.50 0.00 0.00 59.36 58.62 3dkb h GLU 1193Cb 1.33 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 29.16 3dkb h GLU 1193CO 0.70 -0.02 0.60 0.97 -1.40 0.00 0.00 179.01 179.86 3dkb h ILE 1194N -0.03 0.72 -0.73 3.13 6.09 -1.99 0.19 117.51 124.89 3dkb h ILE 1194Ca 0.24 -0.21 -0.06 0.00 -1.37 0.00 0.00 64.86 63.46 3dkb h ILE 1194Cb 0.51 0.06 -0.03 0.00 0.47 0.00 0.00 36.82 37.83 3dkb h ILE 1194CO -0.93 0.11 0.23 0.45 -3.07 0.00 0.00 178.15 174.94 3dkb h HIS 1195N 0.61 1.18 -0.60 2.19 3.86 -1.17 -0.95 115.15 120.28 3dkb h HIS 1195Ca 0.51 -0.12 -0.06 0.00 -1.16 0.00 0.00 60.37 59.54 3dkb h HIS 1195Cb 0.98 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 29.08 3dkb h HIS 1195CO -0.00 0.94 0.14 0.82 0.86 0.00 0.00 177.93 180.69 3dkb h ILE 1196N 1.09 1.24 -0.11 2.45 2.04 -0.32 -0.81 117.51 123.09 3dkb h ILE 1196Ca 0.24 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 65.22 3dkb h ILE 1196Cb 0.31 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 3dkb h ILE 1196CO -0.01 0.33 0.06 0.15 0.00 0.00 0.00 178.15 178.68 3dkb h PHE 1197N 0.89 0.16 -0.90 1.37 3.04 -0.75 -1.24 116.94 119.51 3dkb h PHE 1197Ca 0.19 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.15 3dkb h PHE 1197Cb 0.32 -0.05 -0.05 0.00 2.56 0.00 0.00 35.95 38.74 3dkb h PHE 1197CO 0.02 0.21 0.60 0.28 -2.02 0.00 0.00 178.31 177.40 3dkb h VAL 1198N 0.07 1.22 -0.42 1.41 2.07 -1.00 -2.70 116.25 116.91 3dkb h VAL 1198Ca 0.04 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 3dkb h VAL 1198Cb 0.10 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 3dkb h VAL 1198CO -0.01 0.22 0.24 0.25 0.02 0.00 0.00 177.57 178.30 3dkb h LEU 1199N 1.21 0.51 -1.86 2.57 7.12 -0.62 -1.25 115.31 122.99 3dkb h LEU 1199Ca 0.34 -0.07 -0.02 0.00 0.13 0.00 0.00 57.88 58.26 3dkb h LEU 1199Cb -0.12 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 39.88 3dkb h LEU 1199CO -0.08 0.43 -0.08 0.00 -0.13 0.00 0.00 178.44 178.58 3dkb h ASN 1201N 0.00 0.76 -0.49 0.00 2.35 -1.19 0.22 115.58 117.23 3dkb h ASN 1201Ca -0.00 -0.80 -0.01 0.00 -0.55 0.00 0.00 56.30 54.93 3dkb h ASN 1201Cb 0.38 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 3dkb h ASN 1201CO 0.01 1.62 0.27 0.40 -1.65 0.00 0.00 177.43 178.08 3dkb h ILE 1202N 0.15 1.17 0.00 2.81 2.04 -0.64 -1.75 117.51 121.28 3dkb h ILE 1202Ca -0.22 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.19 3dkb h ILE 1202Cb 2.10 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 3dkb h ILE 1202CO 0.26 0.19 -0.69 0.18 0.00 0.00 0.00 178.15 178.09 3dkb n LEU 1203N -4.39 0.61 -3.82 1.44 4.77 -0.59 -2.23 117.00 112.79 3dkb n LEU 1203Ca 0.04 0.07 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 3dkb n LEU 1203Cb 0.11 -0.18 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 3dkb n LEU 1203CO 0.37 0.04 -0.11 0.54 -1.33 0.00 0.00 177.39 176.90 3dkb n ARG 1204N -1.85 -4.33 -3.68 3.23 1.74 0.60 -4.81 116.66 107.57 3dkb n ARG 1204Ca 0.04 0.53 -0.10 0.00 -0.77 0.00 0.00 57.85 57.55 3dkb n ARG 1204Cb 0.40 -4.96 -0.09 0.00 -1.02 0.00 0.00 32.46 26.78 3dkb n ARG 1204CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3dkb s ARG 1205N -6.26 0.53 0.36 5.56 3.52 -0.13 -1.32 118.95 121.20 3dkb s ARG 1205Ca 0.07 0.88 -0.26 0.00 -0.13 0.00 0.00 55.73 56.29 3dkb s ARG 1205Cb -0.04 0.10 -0.09 0.00 -1.56 0.00 0.00 34.95 33.36 3dkb s ARG 1205CO 0.84 -0.13 1.09 -1.25 -0.81 0.00 0.00 175.30 175.04 3dkb s PRO 1206N 1.15 4.31 -0.11 5.12 0.04 -1.26 -4.51 135.00 139.75 3dkb s PRO 1206Ca -0.07 1.68 0.01 0.00 0.04 0.00 0.00 61.00 62.66 3dkb s PRO 1206Cb -0.06 -2.80 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 3dkb s PRO 1206CO -0.11 -0.05 -0.14 0.42 0.04 0.00 0.00 177.00 177.17 3dkb s ILE 1207N -1.43 3.03 -0.18 0.56 1.01 -0.43 0.05 121.20 123.82 3dkb s ILE 1207Ca 0.53 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 60.50 3dkb s ILE 1207Cb -0.27 -2.25 0.03 0.00 0.01 0.00 0.00 42.46 39.98 3dkb s ILE 1207CO 0.35 0.54 -0.12 -0.63 0.00 0.00 0.00 174.94 175.08 3dkb s ILE 1208N 0.07 1.64 -0.25 2.92 1.01 0.11 -0.07 121.20 126.62 3dkb s ILE 1208Ca -0.05 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 3dkb s ILE 1208Cb -0.15 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.65 3dkb s ILE 1208CO 0.04 0.31 0.16 -0.69 0.00 0.00 0.00 174.94 174.76 3dkb s VAL 1209N 1.43 5.29 -0.45 2.92 1.01 -0.56 -1.19 120.40 128.85 3dkb s VAL 1209Ca 0.02 0.16 -0.17 0.00 0.00 0.00 0.00 61.98 61.98 3dkb s VAL 1209Cb -0.15 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 32.79 3dkb s VAL 1209CO -0.09 0.32 0.46 -0.63 0.00 0.00 0.00 175.10 175.16 3dkb s ILE 1210N 1.24 5.09 0.32 2.22 1.01 0.65 -1.68 121.20 130.05 3dkb s ILE 1210Ca 0.07 -0.55 0.08 0.00 0.00 0.00 0.00 60.65 60.25 3dkb s ILE 1210Cb -0.14 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 3dkb s ILE 1210CO 0.06 -0.53 0.15 -0.94 0.00 0.00 0.00 174.94 173.68 3dkb s SER 1211N 2.15 4.82 -0.07 3.58 1.04 -1.26 -0.58 113.70 123.38 3dkb s SER 1211Ca 0.11 -0.67 -0.27 0.00 0.48 0.00 0.00 55.95 55.59 3dkb s SER 1211Cb -0.19 -0.83 -0.03 0.00 0.10 0.00 0.00 66.02 65.07 3dkb s SER 1211CO 0.12 -0.25 0.87 -0.62 0.98 0.00 0.00 173.24 174.34 3dkb s ASP 1212N -3.85 7.15 -0.14 7.02 -1.08 -0.36 -4.93 116.67 120.48 3dkb s ASP 1212Ca 0.37 1.40 0.18 0.00 -0.52 0.00 0.00 52.55 53.97 3dkb s ASP 1212Cb -0.04 -2.50 -0.25 0.00 -1.46 0.00 0.00 42.92 38.68 3dkb s ASP 1212CO 0.23 -0.28 0.26 2.29 0.52 0.00 0.00 175.17 178.19 3dkb n LYS 1213N 4.33 0.67 -1.54 4.34 2.85 -1.26 -4.85 118.16 122.70 3dkb n LYS 1213Ca 0.04 0.03 -0.16 0.00 -1.05 0.00 0.00 58.31 57.17 3dkb n LYS 1213Cb 0.50 -1.58 -0.11 0.00 -0.65 0.00 0.00 35.03 33.19 3dkb n LYS 1213CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 3dkb n MET 1214N -2.75 0.43 -2.68 -1.58 2.81 -1.26 -4.63 117.12 107.46 3dkb n MET 1214Ca -0.26 -0.62 -0.08 0.00 -1.81 0.00 0.00 57.70 54.93 3dkb n MET 1214Cb 1.05 -3.02 0.08 0.00 -0.71 0.00 0.00 33.22 30.62 3dkb n MET 1214CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3dkb n LEU 1215N 15.41 -0.27 0.26 4.03 4.77 -1.26 -4.91 117.00 135.02 3dkb n LEU 1215Ca 0.52 -3.58 0.17 0.00 -0.03 0.00 0.00 56.01 53.09 3dkb n LEU 1215Cb 0.36 0.22 0.79 0.00 -2.33 0.00 0.00 43.42 42.46 3dkb n LEU 1215CO 0.69 1.73 1.01 -0.09 -1.33 0.00 0.00 177.39 179.40 3dkb h ARG 1216N 2.49 0.00 -0.48 3.23 2.43 -2.03 -1.72 114.38 118.30 3dkb h ARG 1216Ca -0.19 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.97 3dkb h ARG 1216Cb 1.24 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 3dkb h ARG 1216CO 0.21 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.54 3dkb n SER 1217N -2.88 5.17 -4.74 -3.80 3.41 -1.26 -5.00 113.62 104.51 3dkb n SER 1217Ca -0.00 -2.97 -0.35 0.00 -0.26 0.00 0.00 58.87 55.28 3dkb n SER 1217Cb 0.21 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 63.57 3dkb n SER 1217CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3dkb s LEU 1218N -2.80 3.51 -0.34 1.04 0.20 -0.65 -4.99 118.68 114.64 3dkb s LEU 1218Ca 0.51 2.37 0.15 0.00 0.69 0.00 0.00 54.13 57.85 3dkb s LEU 1218Cb 0.40 -4.59 0.41 0.00 -0.43 0.00 0.00 46.19 41.97 3dkb s LEU 1218CO 0.14 -1.87 0.86 -0.62 -0.29 0.00 0.00 176.35 174.56 3dkb n GLU 1219N -2.09 1.06 -1.13 1.98 1.02 -1.26 -4.94 120.64 115.28 3dkb n GLU 1219Ca 0.13 -3.28 -0.27 0.00 -0.02 0.00 0.00 57.16 53.73 3dkb n GLU 1219Cb 0.50 -1.43 0.06 0.00 -0.02 0.00 0.00 31.44 30.55 3dkb n GLU 1219CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3dkb n SER 1220N 0.09 7.11 0.00 1.62 2.88 -1.26 -5.17 113.62 118.89 3dkb n SER 1220Ca 0.16 -3.46 0.00 0.00 -1.33 0.00 0.00 58.87 54.24 3dkb n SER 1220Cb 0.75 -1.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 3dkb n SER 1220CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dkb n GLY 1221N -0.36 2.82 0.00 0.46 0.00 -1.26 -5.14 105.19 101.72 3dkb n GLY 1221Ca 0.48 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3dkb n GLY 1221CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dkb n PRO 1226N 0.00 0.00 -2.18 1.61 -0.02 -1.26 -5.24 135.00 127.91 3dkb n PRO 1226Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.45 3dkb n PRO 1226Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3dkb n PRO 1226CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3dkb n LEU 1227N 0.00 -4.84 -4.35 2.45 7.94 -1.26 -4.92 117.00 112.02 3dkb n LEU 1227Ca 0.00 0.22 -0.43 0.00 -1.11 0.00 0.00 56.01 54.69 3dkb n LEU 1227Cb 0.00 -2.18 0.00 0.00 0.53 0.00 0.00 43.42 41.77 3dkb n LEU 1227CO 0.00 -1.07 1.96 0.29 -1.11 0.00 0.00 177.39 177.46 3dkb n LYS 1228N -0.56 3.22 0.06 1.96 4.01 -1.26 -4.77 118.16 120.81 3dkb n LYS 1228Ca 0.05 -3.32 -0.07 0.00 -0.51 0.00 0.00 58.31 54.45 3dkb n LYS 1228Cb 0.27 -3.30 -0.12 0.00 -0.51 0.00 0.00 35.03 31.36 3dkb n LYS 1228CO 0.00 0.00 0.00 -0.24 -1.11 0.00 0.00 177.40 176.05 3dkb h VAL 1229N 4.92 1.67 -3.07 -0.18 3.04 -1.98 -3.47 116.25 117.18 3dkb h VAL 1229Ca 0.43 -3.38 -0.58 0.00 -1.01 0.00 0.00 66.70 62.16 3dkb h VAL 1229Cb 0.81 2.83 0.15 0.00 -2.01 0.00 0.00 31.29 33.08 3dkb h VAL 1229CO 1.50 0.95 -0.11 0.61 -1.01 0.00 0.00 177.57 179.51 3dkb n GLY 1230N 1.37 -0.84 0.00 3.17 0.00 -1.26 -4.76 105.19 102.87 3dkb n GLY 1230Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3dkb n GLY 1230CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dkb n GLY 1231N 1.49 0.96 3.38 -0.02 0.00 -0.68 -4.75 105.19 105.57 3dkb n GLY 1231Ca 0.12 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 3dkb n GLY 1231CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dkb s ILE 1232N -1.85 3.64 -0.37 -0.61 1.01 0.23 -1.50 121.20 121.75 3dkb s ILE 1232Ca 0.00 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 3dkb s ILE 1232Cb 0.00 -2.64 0.06 0.00 0.01 0.00 0.00 42.46 39.89 3dkb s ILE 1232CO 0.00 0.43 0.15 -0.31 0.00 0.00 0.00 174.94 175.21 3dkb s TYR 1233N 1.21 3.32 -0.05 3.97 1.51 0.90 -1.65 117.35 126.56 3dkb s TYR 1233Ca 0.03 -1.63 -0.06 0.00 -1.01 0.00 0.00 57.07 54.40 3dkb s TYR 1233Cb -0.14 -2.57 -0.04 0.00 -0.11 0.00 0.00 41.96 39.09 3dkb s TYR 1233CO -0.00 -0.80 0.19 -0.51 -1.11 0.00 0.00 175.55 173.32 3dkb s LEU 1234N 1.36 4.38 -0.99 -1.29 1.43 -1.26 -1.31 118.68 120.99 3dkb s LEU 1234Ca 0.01 0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 53.50 3dkb s LEU 1234Cb -0.21 -2.41 -0.13 0.00 0.03 0.00 0.00 46.19 43.48 3dkb s LEU 1234CO 0.01 0.32 2.87 -0.81 0.23 0.00 0.00 176.35 178.98 3dkb n PRO 1235N 1.43 2.79 0.32 1.29 -0.04 -1.26 -4.72 135.00 134.81 3dkb n PRO 1235Ca -0.15 -1.65 0.14 0.00 -0.04 0.00 0.00 63.50 61.81 3dkb n PRO 1235Cb 0.54 -2.47 0.76 0.00 -0.04 0.00 0.00 33.50 32.29 3dkb n PRO 1235CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3dkb h LEU 1236N 6.70 0.00 0.00 1.53 4.07 -1.94 -0.73 115.31 124.95 3dkb h LEU 1236Ca 0.59 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.55 3dkb h LEU 1236Cb 0.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.31 3dkb h LEU 1236CO 1.26 0.00 0.00 1.41 -1.08 0.00 0.00 178.44 180.03 3dkb n HIS 1237N -2.80 0.00 -4.17 1.13 8.25 -1.26 -4.74 115.22 111.62 3dkb n HIS 1237Ca -0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.33 3dkb n HIS 1237Cb 0.38 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.39 3dkb n HIS 1237CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3dkb s TRP 1238N -2.00 0.91 0.21 4.41 0.52 -0.28 -5.07 118.94 117.63 3dkb s TRP 1238Ca 0.23 -0.95 -0.21 0.00 0.02 0.00 0.00 56.10 55.19 3dkb s TRP 1238Cb 0.11 -0.53 -0.08 0.00 -1.15 0.00 0.00 33.47 31.82 3dkb s TRP 1238CO 0.18 -0.19 0.74 -1.25 0.02 0.00 0.00 176.95 176.45 3dkb s PRO 1239N -3.86 4.32 0.39 4.98 0.04 -1.26 -4.93 135.00 134.68 3dkb s PRO 1239Ca 0.14 0.93 0.17 0.00 0.04 0.00 0.00 61.00 62.28 3dkb s PRO 1239Cb 0.06 -2.96 0.93 0.00 0.04 0.00 0.00 34.50 32.56 3dkb s PRO 1239CO -0.04 0.43 1.45 0.00 0.04 0.00 0.00 177.00 178.88 3dkb h ALA 1240N 3.62 1.20 0.02 8.56 0.00 -1.90 0.73 119.26 131.48 3dkb h ALA 1240Ca -0.48 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.23 3dkb h ALA 1240Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3dkb h ALA 1240CO 0.65 -0.20 -0.93 -0.56 0.00 0.00 0.00 179.25 178.22 3dkb h GLN 1241N 0.00 0.19 -0.32 0.00 3.07 -1.91 -3.17 115.11 112.98 3dkb h GLN 1241Ca 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 58.65 58.51 3dkb h GLN 1241Cb 0.55 0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.18 3dkb h GLN 1241CO 0.00 0.99 0.00 0.39 0.09 0.00 0.00 178.83 180.30 3dkb n GLU 1242N -3.62 1.96 -4.37 0.06 1.02 0.24 -4.92 120.64 111.01 3dkb n GLU 1242Ca -0.04 -1.47 -0.24 0.00 -0.02 0.00 0.00 57.16 55.40 3dkb n GLU 1242Cb 0.84 -1.39 -0.08 0.00 -0.02 0.00 0.00 31.44 30.79 3dkb n GLU 1242CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dkb s TYR 1244N -2.43 3.53 -1.50 0.00 5.04 -0.43 -4.96 117.35 116.60 3dkb s TYR 1244Ca 0.32 1.38 0.06 0.00 -2.44 0.00 0.00 57.07 56.39 3dkb s TYR 1244Cb -0.05 -2.98 0.24 0.00 0.35 0.00 0.00 41.96 39.52 3dkb s TYR 1244CO 0.18 -0.08 1.07 0.54 -1.34 0.00 0.00 175.55 175.93 3dkb n ARG 1245N 4.43 1.86 -4.68 4.97 5.12 -1.26 -4.25 116.66 122.85 3dkb n ARG 1245Ca 0.03 -0.95 -0.33 0.00 -1.93 0.00 0.00 57.85 54.67 3dkb n ARG 1245Cb 0.50 -1.42 -0.13 0.00 -1.16 0.00 0.00 32.46 30.26 3dkb n ARG 1245CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3dkb s TYR 1246N -1.64 2.87 0.69 -1.55 1.51 -1.26 -3.02 117.35 114.95 3dkb s TYR 1246Ca 0.17 -0.25 -0.09 0.00 -1.01 0.00 0.00 57.07 55.89 3dkb s TYR 1246Cb 0.11 -1.78 0.04 0.00 -0.11 0.00 0.00 41.96 40.22 3dkb s TYR 1246CO 0.09 0.09 1.04 -1.25 -1.11 0.00 0.00 175.55 174.40 3dkb s PRO 1247N -0.26 2.51 -0.21 -1.71 0.04 -1.26 -4.31 135.00 129.80 3dkb s PRO 1247Ca 0.03 0.06 -0.05 0.00 0.04 0.00 0.00 61.00 61.09 3dkb s PRO 1247Cb -0.13 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.28 3dkb s PRO 1247CO 0.03 -1.11 -0.01 0.42 0.04 0.00 0.00 177.00 176.36 3dkb s ILE 1248N -3.27 3.72 -0.25 0.56 1.01 0.11 -4.76 121.20 118.32 3dkb s ILE 1248Ca 0.58 -0.38 -0.09 0.00 0.00 0.00 0.00 60.65 60.76 3dkb s ILE 1248Cb -0.11 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 3dkb s ILE 1248CO 0.47 0.42 0.12 -0.69 0.00 0.00 0.00 174.94 175.26 3dkb s VAL 1249N 1.25 4.81 0.25 2.92 1.01 -1.26 0.09 120.40 129.47 3dkb s VAL 1249Ca 0.03 -0.01 0.11 0.00 0.00 0.00 0.00 61.98 62.12 3dkb s VAL 1249Cb -0.15 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 3dkb s VAL 1249CO 0.00 0.33 -0.14 -0.76 0.00 0.00 0.00 175.10 174.53 3dkb s LEU 1250N 1.40 2.78 0.14 3.92 1.43 -0.33 -0.70 118.68 127.32 3dkb s LEU 1250Ca 0.06 -0.85 0.10 0.00 -1.03 0.00 0.00 54.13 52.41 3dkb s LEU 1250Cb -0.15 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 3dkb s LEU 1250CO 0.06 0.05 -0.19 -0.83 0.23 0.00 0.00 176.35 175.66 3dkb s GLY 1251N -3.36 1.68 -0.11 -3.19 0.00 0.86 -0.25 107.32 102.94 3dkb s GLY 1251Ca 0.29 -1.44 -0.08 0.00 0.00 0.00 0.00 44.72 43.49 3dkb s GLY 1251CO 0.16 -1.43 0.28 -0.47 0.00 0.00 0.00 173.10 171.64 3dkb s TYR 1252N -1.30 -0.36 0.00 1.90 5.04 0.25 -2.05 117.35 120.83 3dkb s TYR 1252Ca 0.19 0.84 0.00 0.00 -2.44 0.00 0.00 57.07 55.66 3dkb s TYR 1252Cb -0.10 0.10 0.00 0.00 0.35 0.00 0.00 41.96 42.31 3dkb s TYR 1252CO 0.10 -0.21 0.00 -0.40 -1.34 0.00 0.00 175.55 173.70 3dkb n ASP 1253N 3.68 0.00 0.30 4.32 5.68 -1.11 -1.23 116.55 128.19 3dkb n ASP 1253Ca -0.20 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 53.95 3dkb n ASP 1253Cb 0.55 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.46 3dkb n ASP 1253CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3dkb h SER 1254N 0.00 -0.94 -0.07 -1.12 4.64 -1.99 -3.42 113.55 110.66 3dkb h SER 1254Ca 0.00 0.06 -0.23 0.00 -0.47 0.00 0.00 61.79 61.15 3dkb h SER 1254Cb 0.00 0.28 -0.17 0.00 -0.31 0.00 0.00 62.40 62.20 3dkb h SER 1254CO 0.00 -0.54 -0.41 1.57 -0.87 0.00 0.00 176.83 176.57 3dkb n HIS 1255N -4.66 -2.26 -3.78 4.77 -0.00 -1.26 -5.12 115.22 102.91 3dkb n HIS 1255Ca -0.11 -1.99 -0.13 0.00 -0.00 0.00 0.00 57.72 55.50 3dkb n HIS 1255Cb 0.36 1.48 -0.12 0.00 -0.00 0.00 0.00 29.99 31.71 3dkb n HIS 1255CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 3dkb s HIS 1256N -0.02 -0.27 0.01 1.57 5.04 -1.26 -5.07 115.29 115.30 3dkb s HIS 1256Ca 0.22 0.65 -0.02 0.00 -1.54 0.00 0.00 55.06 54.37 3dkb s HIS 1256Cb 0.40 0.08 -0.04 0.00 0.04 0.00 0.00 32.58 33.06 3dkb s HIS 1256CO -0.08 -0.14 0.18 -0.06 -2.34 0.00 0.00 174.74 172.30 3dkb s PHE 1257N 0.31 3.51 -0.02 3.88 0.40 -1.26 -2.76 117.98 122.03 3dkb s PHE 1257Ca -0.01 0.31 -0.13 0.00 -0.60 0.00 0.00 56.93 56.49 3dkb s PHE 1257Cb -0.03 -1.80 0.02 0.00 0.51 0.00 0.00 43.02 41.72 3dkb s PHE 1257CO -0.01 0.62 0.28 0.54 0.70 0.00 0.00 175.22 177.35 3dkb s VAL 1258N -1.37 0.06 0.29 -0.44 0.11 -0.87 -4.72 120.40 113.46 3dkb s VAL 1258Ca 0.29 -0.46 -0.21 0.00 -2.93 0.00 0.00 61.98 58.68 3dkb s VAL 1258Cb -0.13 -0.57 -0.09 0.00 -1.53 0.00 0.00 36.38 34.07 3dkb s VAL 1258CO 0.21 -0.25 0.81 -2.16 -3.33 0.00 0.00 175.10 170.38 3dkb s PRO 1259N -1.18 4.30 -0.87 1.54 0.04 -1.26 -0.10 135.00 137.47 3dkb s PRO 1259Ca -0.12 0.99 -0.00 0.00 0.04 0.00 0.00 61.00 61.90 3dkb s PRO 1259Cb -0.05 -2.70 0.22 0.00 0.04 0.00 0.00 34.50 32.01 3dkb s PRO 1259CO 0.03 0.27 0.77 1.28 0.04 0.00 0.00 177.00 179.39 3dkb n LEU 1260N 0.33 4.10 -4.78 -3.56 4.77 0.12 -2.62 117.00 115.35 3dkb n LEU 1260Ca 0.01 -5.16 -0.36 0.00 -0.03 0.00 0.00 56.01 50.46 3dkb n LEU 1260Cb 0.51 -1.04 -0.05 0.00 -2.33 0.00 0.00 43.42 40.51 3dkb n LEU 1260CO 0.42 1.62 0.69 0.68 -1.33 0.00 0.00 177.39 179.47 3dkb s VAL 1261N -1.49 4.02 0.65 4.08 -7.23 -0.61 -4.61 120.40 115.19 3dkb s VAL 1261Ca 0.28 1.58 -0.13 0.00 -1.81 0.00 0.00 61.98 61.90 3dkb s VAL 1261Cb -0.05 -3.83 -0.01 0.00 0.56 0.00 0.00 36.38 33.04 3dkb s VAL 1261CO -0.12 0.04 1.06 -0.89 -0.31 0.00 0.00 175.10 174.88 3dkb s THR 1262N -1.68 3.92 0.37 5.32 2.01 -1.26 0.13 115.64 124.44 3dkb s THR 1262Ca 0.54 0.76 -0.15 0.00 0.31 0.00 0.00 61.69 63.15 3dkb s THR 1262Cb -0.19 -3.38 -0.09 0.00 0.01 0.00 0.00 72.50 68.85 3dkb s THR 1262CO 0.25 -0.68 0.79 -0.76 -0.69 0.00 0.00 174.62 173.52 3dkb s LEU 1263N -5.04 3.97 0.04 4.42 2.01 -0.77 -2.02 118.68 121.29 3dkb s LEU 1263Ca 0.61 1.33 -0.16 0.00 0.01 0.00 0.00 54.13 55.92 3dkb s LEU 1263Cb -0.15 -4.16 -0.30 0.00 0.01 0.00 0.00 46.19 41.59 3dkb s LEU 1263CO 0.46 -0.29 1.08 0.50 1.01 0.00 0.00 176.35 179.11 3dkb h LYS 1264N 1.92 0.60 0.00 1.70 3.64 -1.17 -3.46 116.57 119.80 3dkb h LYS 1264Ca -0.48 -0.83 0.00 0.00 -1.27 0.00 0.00 60.65 58.07 3dkb h LYS 1264Cb 1.18 0.28 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 3dkb h LYS 1264CO 0.64 1.38 0.00 -0.25 -2.27 0.00 0.00 179.45 178.95 3dkb n ASP 1265N -3.81 0.00 0.00 4.20 10.43 -1.26 -5.04 116.55 121.07 3dkb n ASP 1265Ca -0.14 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.22 3dkb n ASP 1265Cb 0.99 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.95 3dkb n ASP 1265CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 3dkb n SER 1266N 0.00 0.00 -1.35 -2.24 2.88 -1.26 -4.88 113.62 106.77 3dkb n SER 1266Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 3dkb n SER 1266Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 3dkb n SER 1266CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dkb n GLY 1267N 0.00 -2.97 0.62 0.46 0.00 -1.26 -4.70 105.19 97.34 3dkb n GLY 1267Ca 0.00 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.24 3dkb n GLY 1267CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dkb n PRO 1268N -4.17 1.80 -1.15 1.61 -0.02 -1.26 -4.95 135.00 126.86 3dkb n PRO 1268Ca -0.08 -1.21 -0.33 0.00 -2.02 0.00 0.00 63.50 59.85 3dkb n PRO 1268Cb 0.60 -1.37 0.12 0.00 -0.02 0.00 0.00 33.50 32.83 3dkb n PRO 1268CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3dkb s GLU 1269N -1.70 1.70 0.28 -0.52 8.01 -1.26 -5.00 118.70 120.20 3dkb s GLU 1269Ca 0.31 1.73 0.03 0.00 0.01 0.00 0.00 54.97 57.05 3dkb s GLU 1269Cb 0.17 -1.79 -0.03 0.00 -4.31 0.00 0.00 34.13 28.17 3dkb s GLU 1269CO 0.24 -2.16 0.43 0.96 0.01 0.00 0.00 175.26 174.74 3dkb s ILE 1270N -2.17 5.20 -0.72 -1.63 -4.36 -1.14 -4.62 121.20 111.76 3dkb s ILE 1270Ca 0.73 -0.75 -0.26 0.00 -0.26 0.00 0.00 60.65 60.10 3dkb s ILE 1270Cb -0.28 -3.85 0.04 0.00 1.25 0.00 0.00 42.46 39.61 3dkb s ILE 1270CO 0.50 -0.40 1.23 -0.13 0.24 0.00 0.00 174.94 176.38 3dkb s ARG 1271N -4.05 3.19 0.02 0.37 0.52 -1.26 -0.75 118.95 116.98 3dkb s ARG 1271Ca 0.36 -0.31 -0.28 0.00 -0.52 0.00 0.00 55.73 54.99 3dkb s ARG 1271Cb -0.09 -4.18 0.08 0.00 0.52 0.00 0.00 34.95 31.28 3dkb s ARG 1271CO 0.32 -2.08 0.73 0.00 0.02 0.00 0.00 175.30 174.28 3dkb s ALA 1272N 5.47 -1.74 -0.21 2.13 0.00 -1.26 -1.18 121.76 124.97 3dkb s ALA 1272Ca 0.33 1.00 0.01 0.00 0.00 0.00 0.00 51.96 53.30 3dkb s ALA 1272Cb -0.09 0.31 0.05 0.00 0.00 0.00 0.00 23.12 23.39 3dkb s ALA 1272CO 0.15 -0.56 -0.07 0.54 0.00 0.00 0.00 175.76 175.81 3dkb s VAL 1273N -2.46 1.49 0.25 0.00 0.11 0.56 -4.58 120.40 115.79 3dkb s VAL 1273Ca -0.03 -1.01 -0.29 0.00 -2.93 0.00 0.00 61.98 57.72 3dkb s VAL 1273Cb -0.01 -1.66 -0.15 0.00 -1.53 0.00 0.00 36.38 33.04 3dkb s VAL 1273CO -0.03 0.06 1.05 -0.81 -3.33 0.00 0.00 175.10 172.04 3dkb n PRO 1274N 4.72 1.28 -0.80 1.54 -0.04 -1.26 -1.77 135.00 138.66 3dkb n PRO 1274Ca -0.13 0.45 -0.04 0.00 -0.04 0.00 0.00 63.50 63.74 3dkb n PRO 1274Cb 0.46 -1.86 0.24 0.00 -0.04 0.00 0.00 33.50 32.31 3dkb n PRO 1274CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dkb n LEU 1275N 1.51 5.19 -4.17 1.53 4.77 0.19 -4.84 117.00 121.17 3dkb n LEU 1275Ca 0.11 -2.69 -0.11 0.00 -0.03 0.00 0.00 56.01 53.30 3dkb n LEU 1275Cb 0.30 -0.69 -0.10 0.00 -2.33 0.00 0.00 43.42 40.59 3dkb n LEU 1275CO 0.60 0.70 -0.33 0.68 -1.33 0.00 0.00 177.39 177.71 3dkb s VAL 1276N -2.45 0.41 -0.02 4.08 -7.23 -1.26 -1.92 120.40 112.01 3dkb s VAL 1276Ca 0.43 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.69 3dkb s VAL 1276Cb 0.34 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 3dkb s VAL 1276CO 0.11 -0.63 0.01 0.20 -0.31 0.00 0.00 175.10 174.48 3dkb s ASN 1277N -3.07 5.21 -1.47 4.85 0.01 0.59 -4.89 114.94 116.18 3dkb s ASN 1277Ca 0.19 0.04 -0.13 0.00 -0.71 0.00 0.00 52.86 52.25 3dkb s ASN 1277Cb 0.07 -1.40 0.03 0.00 0.41 0.00 0.00 41.25 40.37 3dkb s ASN 1277CO -0.01 0.30 2.32 -1.14 -1.51 0.00 0.00 177.10 177.06 3dkb n ARG 1278N 1.50 3.13 0.00 -0.60 0.63 -1.26 -2.34 116.66 117.72 3dkb n ARG 1278Ca -0.15 -2.66 0.00 0.00 -0.92 0.00 0.00 57.85 54.12 3dkb n ARG 1278Cb 0.53 -3.15 0.00 0.00 0.45 0.00 0.00 32.46 30.29 3dkb n ARG 1278CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3dkb n ASP 1279N 5.31 -1.30 -4.57 6.15 9.92 -0.69 -4.77 116.55 126.61 3dkb n ASP 1279Ca 0.55 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 54.43 3dkb n ASP 1279Cb 0.36 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.81 3dkb n ASP 1279CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3dkb s ARG 1280N -1.95 3.48 0.00 -1.24 1.70 -1.26 -4.11 118.95 115.57 3dkb s ARG 1280Ca 0.00 -1.23 0.00 0.00 -0.47 0.00 0.00 55.73 54.03 3dkb s ARG 1280Cb 0.00 -5.36 0.00 0.00 -0.57 0.00 0.00 34.95 29.02 3dkb s ARG 1280CO 0.00 -2.50 0.00 0.41 -1.08 0.00 0.00 175.30 172.13 3dkb n GLY 1281N 6.43 2.77 3.75 3.88 0.00 -1.26 -4.99 105.19 115.76 3dkb n GLY 1281Ca 0.39 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 3dkb n GLY 1281CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dkb s ARG 1282N -0.06 2.36 -0.42 1.61 6.06 -1.26 -4.95 118.95 122.29 3dkb s ARG 1282Ca 0.00 -1.60 -0.07 0.00 -2.50 0.00 0.00 55.73 51.56 3dkb s ARG 1282Cb 0.00 -2.16 0.09 0.00 0.06 0.00 0.00 34.95 32.94 3dkb s ARG 1282CO 0.00 0.04 0.24 -0.06 -2.50 0.00 0.00 175.30 173.02 3dkb s PHE 1283N -2.46 3.41 0.01 5.12 2.99 -1.26 -1.71 117.98 124.08 3dkb s PHE 1283Ca 0.39 -1.84 -0.21 0.00 0.00 0.00 0.00 56.93 55.27 3dkb s PHE 1283Cb -0.01 -3.07 -0.05 0.00 0.00 0.00 0.00 43.02 39.88 3dkb s PHE 1283CO 0.23 -0.91 0.62 -2.00 -0.00 0.00 0.00 175.22 173.17 3dkb s GLU 1284N 1.33 4.34 0.49 0.44 2.56 -0.99 -4.84 118.70 122.04 3dkb s GLU 1284Ca 0.04 0.78 -0.23 0.00 0.00 0.00 0.00 54.97 55.56 3dkb s GLU 1284Cb -0.23 -3.34 -0.07 0.00 2.00 0.00 0.00 34.13 32.49 3dkb s GLU 1284CO -0.00 0.37 1.35 -0.51 -0.56 0.00 0.00 175.26 175.90 3dkb s ASP 1285N -0.21 5.69 0.44 -1.70 -0.00 -1.26 -0.30 116.67 119.34 3dkb s ASP 1285Ca 0.32 2.74 -0.22 0.00 -0.00 0.00 0.00 52.55 55.38 3dkb s ASP 1285Cb -0.19 -2.64 -0.09 0.00 -0.00 0.00 0.00 42.92 40.01 3dkb s ASP 1285CO 0.18 -1.28 1.06 -0.22 -0.00 0.00 0.00 175.17 174.90 3dkb s LEU 1286N -3.09 4.00 0.18 1.23 2.96 -0.81 -4.78 118.68 118.37 3dkb s LEU 1286Ca 0.66 2.02 -0.30 0.00 -0.22 0.00 0.00 54.13 56.29 3dkb s LEU 1286Cb -0.40 -4.35 -0.08 0.00 0.50 0.00 0.00 46.19 41.86 3dkb s LEU 1286CO 0.49 -0.66 1.19 -0.75 -1.32 0.00 0.00 176.35 175.30 3dkb s LYS 1287N -2.83 4.50 -0.36 1.98 2.20 -1.26 -4.84 119.74 119.12 3dkb s LYS 1287Ca 0.62 1.87 -0.08 0.00 -0.36 0.00 0.00 55.97 58.02 3dkb s LYS 1287Cb -0.20 -3.24 0.04 0.00 -1.51 0.00 0.00 37.83 32.92 3dkb s LYS 1287CO 0.25 -0.08 0.16 0.08 -0.36 0.00 0.00 175.35 175.40 3dkb s VAL 1288N -0.07 4.10 0.58 4.02 1.01 -1.26 0.77 120.40 129.55 3dkb s VAL 1288Ca 0.53 -1.10 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 3dkb s VAL 1288Cb -0.32 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 3dkb s VAL 1288CO 0.37 -0.26 1.15 -1.00 0.00 0.00 0.00 175.10 175.35 3dkb s HIS 1289N 1.45 2.57 -1.68 5.22 0.09 -0.66 -4.14 115.29 118.14 3dkb s HIS 1289Ca 0.00 1.54 -0.14 0.00 -0.00 0.00 0.00 55.06 56.46 3dkb s HIS 1289Cb -0.20 -3.32 0.13 0.00 -0.00 0.00 0.00 32.58 29.19 3dkb s HIS 1289CO 0.04 -1.79 0.58 1.19 -0.00 0.00 0.00 174.74 174.76 3dkb n PHE 1290N -1.63 -1.53 -3.06 1.40 3.01 -1.26 -4.79 117.46 109.60 3dkb n PHE 1290Ca 0.12 0.74 -0.31 0.00 1.01 0.00 0.00 57.45 59.01 3dkb n PHE 1290Cb 0.51 -2.81 -0.04 0.00 -0.01 0.00 0.00 39.48 37.13 3dkb n PHE 1290CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dkb s LEU 1291N -7.23 3.96 0.36 4.37 1.43 -1.26 -4.93 118.68 115.38 3dkb s LEU 1291Ca 0.54 1.10 -0.00 0.00 -1.03 0.00 0.00 54.13 54.74 3dkb s LEU 1291Cb -0.30 -3.93 -0.03 0.00 0.03 0.00 0.00 46.19 41.95 3dkb s LEU 1291CO 0.96 -0.28 0.57 0.42 0.23 0.00 0.00 176.35 178.25 3dkb s THR 1292N -2.16 5.08 0.24 5.49 -4.23 -1.26 -4.82 115.64 113.99 3dkb s THR 1292Ca 0.51 -0.38 -0.12 0.00 -1.18 0.00 0.00 61.69 60.52 3dkb s THR 1292Cb -0.10 -3.86 0.34 0.00 1.34 0.00 0.00 72.50 70.21 3dkb s THR 1292CO 0.26 -0.58 1.58 0.44 -0.54 0.00 0.00 174.62 175.78 3dkb h ASP 1293N 0.72 -0.89 0.54 3.99 5.19 -1.99 0.23 116.42 124.21 3dkb h ASP 1293Ca -0.49 0.26 -0.02 0.00 -0.62 0.00 0.00 57.03 56.16 3dkb h ASP 1293Cb 1.22 0.56 -0.02 0.00 0.18 0.00 0.00 39.33 41.26 3dkb h ASP 1293CO 0.61 -0.28 -0.50 -0.65 -3.12 0.00 0.00 179.24 175.30 3dkb h PRO 1294N -0.02 -0.99 -1.00 3.56 0.11 -1.99 -2.89 132.00 128.78 3dkb h PRO 1294Ca 0.39 0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.62 3dkb h PRO 1294Cb 0.61 0.22 -0.06 0.00 0.11 0.00 0.00 31.00 31.89 3dkb h PRO 1294CO -0.87 -0.66 0.65 0.93 -0.21 0.00 0.00 178.00 177.84 3dkb h GLU 1295N -1.02 1.18 -0.18 1.05 5.08 -1.72 -1.03 114.58 117.94 3dkb h GLU 1295Ca -0.07 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.27 3dkb h GLU 1295Cb 0.88 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 3dkb h GLU 1295CO -0.04 0.78 0.17 -0.97 -1.00 0.00 0.00 179.01 177.95 3dkb h ASN 1296N 1.21 0.00 -0.13 1.42 -0.00 -0.42 0.17 115.58 117.83 3dkb h ASN 1296Ca 0.42 0.00 -0.06 0.00 -0.00 0.00 0.00 56.30 56.66 3dkb h ASN 1296Cb 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.42 3dkb h ASN 1296CO -0.15 0.00 -0.16 -0.33 -0.00 0.00 0.00 177.43 176.79 3dkb h GLU 1297N 0.00 0.35 -0.94 6.67 4.39 -0.98 -3.17 114.58 120.89 3dkb h GLU 1297Ca 0.08 -0.19 -0.36 0.00 0.34 0.00 0.00 59.36 59.23 3dkb h GLU 1297Cb 0.41 0.01 -0.22 0.00 -0.10 0.00 0.00 28.75 28.86 3dkb h GLU 1297CO -0.00 0.76 0.46 0.00 -1.16 0.00 0.00 179.01 179.06 3dkb n MET 1298N -4.55 2.44 -0.22 2.33 0.00 -0.07 -4.67 117.12 112.39 3dkb n MET 1298Ca -0.06 -2.55 0.00 0.00 0.00 0.00 0.00 57.70 55.09 3dkb n MET 1298Cb 0.37 -2.02 0.12 0.00 0.00 0.00 0.00 33.22 31.69 3dkb n MET 1298CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 175.97 177.54 3dkb h LYS 1299N 1.28 0.49 0.00 3.17 2.10 -0.73 -0.16 116.57 122.71 3dkb h LYS 1299Ca 0.44 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 59.06 3dkb h LYS 1299Cb 2.44 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 33.66 3dkb h LYS 1299CO 0.84 0.32 -0.02 1.49 -2.00 0.00 0.00 179.45 180.08 3dkb h GLU 1300N 0.50 0.00 0.02 0.07 4.81 -1.87 -1.97 114.58 116.14 3dkb h GLU 1300Ca 0.32 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.50 3dkb h GLU 1300Cb 0.36 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.75 3dkb h GLU 1300CO -0.28 0.02 -0.21 0.87 -0.73 0.00 0.00 179.01 178.68 3dkb h LYS 1301N 0.00 0.11 -0.79 1.92 6.56 -1.41 -3.11 116.57 119.85 3dkb h LYS 1301Ca -0.00 -0.14 0.05 0.00 -1.06 0.00 0.00 60.65 59.49 3dkb h LYS 1301Cb 0.10 0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 31.76 3dkb h LYS 1301CO 0.00 0.97 0.52 -0.07 -2.06 0.00 0.00 179.45 178.81 3dkb h LEU 1302N -0.68 0.81 -0.63 2.94 3.38 -0.79 -1.36 115.31 118.98 3dkb h LEU 1302Ca -0.03 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 3dkb h LEU 1302Cb 1.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3dkb h LEU 1302CO 0.04 0.54 -0.05 -0.07 0.09 0.00 0.00 178.44 178.99 3dkb h LEU 1303N 0.93 1.01 -0.61 1.67 3.38 -1.46 0.42 115.31 120.64 3dkb h LEU 1303Ca 0.33 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dkb h LEU 1303Cb 0.12 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3dkb h LEU 1303CO -0.10 1.09 0.00 0.11 0.09 0.00 0.00 178.44 179.63 3dkb h LYS 1304N 0.92 0.00 0.04 1.13 1.57 -1.32 0.43 116.57 119.35 3dkb h LYS 1304Ca 0.15 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.71 3dkb h LYS 1304Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 3dkb h LYS 1304CO 0.04 0.00 -1.18 1.49 -0.57 0.00 0.00 179.45 179.23 3dkb h GLU 1305N 0.00 0.09 0.00 3.15 4.81 -0.49 -3.39 114.58 118.75 3dkb h GLU 1305Ca 0.00 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3dkb h GLU 1305Cb 0.61 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3dkb h GLU 1305CO 0.00 1.08 -0.49 0.66 -0.73 0.00 0.00 179.01 179.53 3dkb n TYR 1306N -4.23 0.12 -4.26 0.92 4.02 0.14 -4.78 117.16 109.08 3dkb n TYR 1306Ca -0.27 0.03 -0.15 0.00 -0.01 0.00 0.00 57.90 57.51 3dkb n TYR 1306Cb 0.75 -0.36 -0.10 0.00 -0.02 0.00 0.00 39.34 39.61 3dkb n TYR 1306CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3dkb s LEU 1307N -3.26 2.35 -1.04 7.72 1.43 0.14 -4.37 118.68 121.65 3dkb s LEU 1307Ca 0.10 -1.10 -0.11 0.00 -1.03 0.00 0.00 54.13 51.99 3dkb s LEU 1307Cb 0.17 -0.24 0.26 0.00 0.03 0.00 0.00 46.19 46.40 3dkb s LEU 1307CO 0.69 -0.44 1.04 -0.04 0.23 0.00 0.00 176.35 177.83 3dkb s MET 1308N -3.82 4.04 0.25 1.70 -1.94 -1.17 -4.30 119.30 114.06 3dkb s MET 1308Ca 0.21 -2.97 -0.30 0.00 -1.71 0.00 0.00 55.69 50.93 3dkb s MET 1308Cb 0.04 -4.56 -0.09 0.00 2.01 0.00 0.00 34.83 32.24 3dkb s MET 1308CO 0.03 -1.29 1.16 0.08 -0.01 0.00 0.00 175.02 174.99 3dkb s VAL 1309N -0.68 3.40 0.07 -6.03 1.01 -1.26 -1.96 120.40 114.94 3dkb s VAL 1309Ca 0.28 1.32 -0.00 0.00 0.00 0.00 0.00 61.98 63.58 3dkb s VAL 1309Cb -0.10 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3dkb s VAL 1309CO -0.08 0.28 -0.04 0.27 0.00 0.00 0.00 175.10 175.53 3dkb s ILE 1310N -0.76 0.36 -0.14 2.22 -4.36 0.21 -4.96 121.20 113.77 3dkb s ILE 1310Ca 0.48 -1.85 -0.06 0.00 -0.26 0.00 0.00 60.65 58.97 3dkb s ILE 1310Cb -0.33 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 41.76 3dkb s ILE 1310CO 0.41 -0.95 0.06 -1.61 0.24 0.00 0.00 174.94 173.09 3dkb s GLU 1311N -3.90 3.52 -0.08 0.37 0.41 -1.26 -0.79 118.70 116.98 3dkb s GLU 1311Ca 0.09 -0.31 0.01 0.00 -0.41 0.00 0.00 54.97 54.35 3dkb s GLU 1311Cb 0.07 -3.07 0.02 0.00 -1.78 0.00 0.00 34.13 29.37 3dkb s GLU 1311CO -0.08 0.54 -0.09 0.42 -0.49 0.00 0.00 175.26 175.56 3dkb s ILE 1312N -0.40 0.97 -0.62 -1.63 1.01 0.68 -4.93 121.20 116.28 3dkb s ILE 1312Ca 0.09 -0.34 -0.27 0.00 0.00 0.00 0.00 60.65 60.14 3dkb s ILE 1312Cb -0.12 -0.94 -0.00 0.00 0.01 0.00 0.00 42.46 41.41 3dkb s ILE 1312CO 0.02 0.33 1.62 -2.84 0.00 0.00 0.00 174.94 174.07 3dkb s PRO 1313N 1.07 2.94 0.17 2.79 0.02 -1.26 -1.55 135.00 139.19 3dkb s PRO 1313Ca -0.07 0.40 0.02 0.00 0.02 0.00 0.00 61.00 61.37 3dkb s PRO 1313Cb -0.14 -4.27 -0.04 0.00 0.02 0.00 0.00 34.50 30.07 3dkb s PRO 1313CO -0.01 -2.38 0.32 0.08 -0.33 0.00 0.00 177.00 174.68 3dkb s VAL 1314N 7.51 5.29 0.28 3.83 1.01 0.48 -4.93 120.40 133.87 3dkb s VAL 1314Ca 0.57 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 3dkb s VAL 1314Cb -0.12 -3.76 -0.13 0.00 0.00 0.00 0.00 36.38 32.38 3dkb s VAL 1314CO 0.21 -0.14 1.35 1.67 0.00 0.00 0.00 175.10 178.18 3dkb n GLN 1315N -0.69 2.07 0.00 2.72 7.27 -1.26 -1.56 117.38 125.92 3dkb n GLN 1315Ca -0.07 0.73 0.00 0.00 0.07 0.00 0.00 57.00 57.74 3dkb n GLN 1315Cb 0.54 -2.35 0.00 0.00 2.41 0.00 0.00 30.24 30.84 3dkb n GLN 1315CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3dkb n GLY 1316N 1.57 -1.10 2.89 1.69 0.00 0.23 -4.56 105.19 105.90 3dkb n GLY 1316Ca 0.09 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.52 3dkb n GLY 1316CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3dkb n TRP 1317N 0.00 2.55 -3.64 1.61 8.01 -1.26 -4.80 117.44 119.90 3dkb n TRP 1317Ca 0.00 -2.91 -0.25 0.00 -1.31 0.00 0.00 57.50 53.04 3dkb n TRP 1317Cb 0.00 -1.11 0.04 0.00 -2.01 0.00 0.00 31.31 28.22 3dkb n TRP 1317CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 3dkb n ASP 1318N 1.23 -3.60 -2.69 -0.99 -0.08 -1.26 -4.96 116.55 104.20 3dkb n ASP 1318Ca 0.27 -0.90 -0.05 0.00 -1.51 0.00 0.00 54.79 52.60 3dkb n ASP 1318Cb 0.35 -3.88 0.08 0.00 2.34 0.00 0.00 41.12 40.00 3dkb n ASP 1318CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dkb n HIS 1319N -4.08 -1.21 -0.10 -0.67 1.44 -1.26 -4.99 115.22 104.35 3dkb n HIS 1319Ca -0.18 -0.98 0.00 0.00 -2.01 0.00 0.00 57.72 54.55 3dkb n HIS 1319Cb 0.64 1.22 0.00 0.00 0.12 0.00 0.00 29.99 31.97 3dkb n HIS 1319CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3dkb n GLY 1320N 1.38 0.00 3.87 -1.39 0.00 -1.26 -4.86 105.19 102.93 3dkb n GLY 1320Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3dkb n GLY 1320CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3dkb s THR 1321N -0.17 4.85 -0.02 2.61 -1.32 -1.26 -4.96 115.64 115.37 3dkb s THR 1321Ca 0.00 0.56 0.00 0.00 -1.21 0.00 0.00 61.69 61.04 3dkb s THR 1321Cb 0.00 -3.66 0.02 0.00 -1.51 0.00 0.00 72.50 67.35 3dkb s THR 1321CO 0.00 -0.25 0.02 0.42 -2.21 0.00 0.00 174.62 172.60 3dkb s THR 1322N -2.03 -0.00 0.13 5.08 -4.23 -1.26 0.76 115.64 114.08 3dkb s THR 1322Ca 0.49 0.15 0.05 0.00 -1.18 0.00 0.00 61.69 61.20 3dkb s THR 1322Cb -0.11 -0.11 -0.04 0.00 1.34 0.00 0.00 72.50 73.59 3dkb s THR 1322CO 0.24 0.09 0.07 -1.00 -0.54 0.00 0.00 174.62 173.48 3dkb s HIS 1323N 0.87 3.09 -0.30 3.99 3.76 -0.60 -4.84 115.29 121.26 3dkb s HIS 1323Ca -0.08 -0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 54.71 3dkb s HIS 1323Cb -0.11 -1.53 -0.04 0.00 1.11 0.00 0.00 32.58 32.01 3dkb s HIS 1323CO -0.02 0.51 0.21 -1.17 -0.85 0.00 0.00 174.74 173.42 3dkb s LEU 1324N -2.72 4.17 0.31 0.89 2.96 -1.26 -0.39 118.68 122.64 3dkb s LEU 1324Ca 0.29 -0.13 0.11 0.00 -0.22 0.00 0.00 54.13 54.18 3dkb s LEU 1324Cb -0.11 -2.14 -0.06 0.00 0.50 0.00 0.00 46.19 44.39 3dkb s LEU 1324CO 0.21 -0.11 -0.15 0.27 -1.32 0.00 0.00 176.35 175.25 3dkb s ILE 1325N 1.76 2.40 -0.01 6.68 -4.36 -0.59 -4.89 121.20 122.18 3dkb s ILE 1325Ca 0.07 -2.32 -0.23 0.00 -0.26 0.00 0.00 60.65 57.91 3dkb s ILE 1325Cb -0.16 -2.45 -0.05 0.00 1.25 0.00 0.00 42.46 41.05 3dkb s ILE 1325CO 0.11 -0.32 0.70 0.20 0.24 0.00 0.00 174.94 175.87 3dkb s ASN 1326N -3.55 7.07 -0.02 4.36 0.02 -1.26 -0.23 114.94 121.32 3dkb s ASN 1326Ca 0.31 1.28 -0.03 0.00 -1.02 0.00 0.00 52.86 53.39 3dkb s ASN 1326Cb -0.02 -2.42 0.00 0.00 0.02 0.00 0.00 41.25 38.83 3dkb s ASN 1326CO 0.16 -0.02 0.08 0.00 0.02 0.00 0.00 177.10 177.34 3dkb s ALA 1327N 0.26 -0.20 -0.07 0.60 0.00 0.03 0.53 121.76 122.91 3dkb s ALA 1327Ca 0.36 0.11 -0.17 0.00 0.00 0.00 0.00 51.96 52.27 3dkb s ALA 1327Cb -0.19 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 3dkb s ALA 1327CO 0.20 -0.08 0.45 0.00 0.00 0.00 0.00 175.76 176.33 3dkb s ALA 1328N -0.31 3.56 0.23 0.00 0.00 -0.73 -0.62 121.76 123.90 3dkb s ALA 1328Ca -0.04 -0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.43 3dkb s ALA 1328Cb -0.03 -2.55 -0.09 0.00 0.00 0.00 0.00 23.12 20.45 3dkb s ALA 1328CO 0.00 0.18 1.35 0.15 0.00 0.00 0.00 175.76 177.44 3dkb s LYS 1329N -0.02 4.35 -0.12 0.00 -0.14 -0.83 -0.32 119.74 122.66 3dkb s LYS 1329Ca 0.25 2.15 -0.10 0.00 -1.36 0.00 0.00 55.97 56.91 3dkb s LYS 1329Cb -0.16 -3.15 -0.05 0.00 -1.68 0.00 0.00 37.83 32.80 3dkb s LYS 1329CO 0.11 -0.29 0.22 -0.51 -0.76 0.00 0.00 175.35 174.12 3dkb s LEU 1330N -0.42 4.35 0.86 3.17 1.43 -0.32 -4.42 118.68 123.32 3dkb s LEU 1330Ca 0.56 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 54.10 3dkb s LEU 1330Cb -0.39 -2.24 0.12 0.00 0.03 0.00 0.00 46.19 43.71 3dkb s LEU 1330CO 0.42 0.29 1.14 -0.62 0.23 0.00 0.00 176.35 177.81 3dkb s ASP 1331N -0.50 3.39 0.07 2.29 3.68 -1.26 -4.76 116.67 119.59 3dkb s ASP 1331Ca 0.16 2.13 0.03 0.00 2.13 0.00 0.00 52.55 57.00 3dkb s ASP 1331Cb -0.13 -2.56 -0.04 0.00 -1.45 0.00 0.00 42.92 38.74 3dkb s ASP 1331CO 0.05 -2.79 0.06 -1.83 0.13 0.00 0.00 175.17 170.79 3dkb s GLU 1332N -4.63 2.82 -0.29 4.34 -1.05 -1.26 -4.98 118.70 113.64 3dkb s GLU 1332Ca 0.66 -0.70 -0.43 0.00 -0.15 0.00 0.00 54.97 54.36 3dkb s GLU 1332Cb -0.22 -2.70 -0.18 0.00 -0.44 0.00 0.00 34.13 30.59 3dkb s GLU 1332CO 0.56 0.57 1.54 0.00 0.95 0.00 0.00 175.26 178.88 3dkb n ALA 1333N 0.60 -1.28 -1.36 -0.84 0.00 -1.26 -4.70 120.51 111.66 3dkb n ALA 1333Ca -0.10 0.48 0.02 0.00 0.00 0.00 0.00 53.44 53.84 3dkb n ALA 1333Cb 0.52 -2.01 0.03 0.00 0.00 0.00 0.00 19.45 17.99 3dkb n ALA 1333CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3dkb n ASN 1334N 3.92 0.72 -4.71 0.00 0.23 -0.32 -4.99 115.26 110.11 3dkb n ASN 1334Ca 0.27 -2.01 -0.42 0.00 -0.53 0.00 0.00 54.58 51.89 3dkb n ASN 1334Cb 0.05 -0.18 -0.03 0.00 -2.08 0.00 0.00 39.78 37.54 3dkb n ASN 1334CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3dkb s LEU 1335N -0.72 4.35 0.52 -4.53 1.43 -1.25 -4.84 118.68 113.63 3dkb s LEU 1335Ca 0.07 1.77 -0.23 0.00 -1.03 0.00 0.00 54.13 54.71 3dkb s LEU 1335Cb 0.06 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.65 3dkb s LEU 1335CO 0.01 -0.38 1.35 -2.84 0.23 0.00 0.00 176.35 174.72 3dkb s PRO 1336N 1.25 3.32 0.25 1.29 0.02 -1.26 -4.64 135.00 135.23 3dkb s PRO 1336Ca 0.54 2.22 -0.12 0.00 0.02 0.00 0.00 61.00 63.67 3dkb s PRO 1336Cb -0.24 -2.36 0.35 0.00 0.02 0.00 0.00 34.50 32.28 3dkb s PRO 1336CO 0.27 -1.05 1.57 -0.22 -0.33 0.00 0.00 177.00 177.24 3dkb h LYS 1337N 1.70 -0.01 0.00 5.54 1.63 -1.94 0.26 116.57 123.75 3dkb h LYS 1337Ca -0.51 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 3dkb h LYS 1337Cb 1.29 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 3dkb h LYS 1337CO 0.58 -0.01 0.08 -0.85 -3.45 0.00 0.00 179.45 175.81 3dkb n GLU 1338N -5.55 0.07 -0.46 1.90 0.00 -1.26 -1.09 120.64 114.25 3dkb n GLU 1338Ca 0.13 0.54 0.03 0.00 0.00 0.00 0.00 57.16 57.86 3dkb n GLU 1338Cb 0.44 -1.81 0.05 0.00 0.00 0.00 0.00 31.44 30.11 3dkb n GLU 1338CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 3dkb n ILE 1339N -1.87 0.59 -3.35 3.84 -5.35 0.80 -4.95 119.36 109.06 3dkb n ILE 1339Ca -0.01 -0.79 -0.45 0.00 -0.27 0.00 0.00 62.75 61.23 3dkb n ILE 1339Cb 0.10 0.31 -0.06 0.00 -1.74 0.00 0.00 39.64 38.25 3dkb n ILE 1339CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3dkb s ASN 1340N -1.66 6.11 0.41 7.28 3.84 -0.25 -4.80 114.94 125.87 3dkb s ASN 1340Ca 0.12 -1.76 0.23 0.00 0.21 0.00 0.00 52.86 51.67 3dkb s ASN 1340Cb 0.12 -2.18 0.30 0.00 -0.55 0.00 0.00 41.25 38.94 3dkb s ASN 1340CO -0.01 -0.81 1.54 -0.07 -2.79 0.00 0.00 177.10 174.96 3dkb h LEU 1341N 8.81 0.00 -0.80 3.21 3.38 -1.86 -3.28 115.31 124.78 3dkb h LEU 1341Ca -0.29 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 3dkb h LEU 1341Cb 1.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 3dkb h LEU 1341CO 1.00 0.00 0.17 0.58 0.09 0.00 0.00 178.44 180.28 3dkb h VAL 1342N 0.00 1.26 -0.08 1.22 2.07 -1.91 -1.63 116.25 117.18 3dkb h VAL 1342Ca 0.00 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 3dkb h VAL 1342Cb 1.00 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3dkb h VAL 1342CO 0.00 0.36 0.03 0.44 0.02 0.00 0.00 177.57 178.42 3dkb h ASP 1343N 1.03 0.11 -0.28 0.57 3.45 -1.96 -0.33 116.42 119.00 3dkb h ASP 1343Ca 0.22 -0.16 0.01 0.00 0.43 0.00 0.00 57.03 57.52 3dkb h ASP 1343Cb 0.35 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.07 3dkb h ASP 1343CO -0.00 0.24 0.16 0.44 -1.57 0.00 0.00 179.24 178.52 3dkb h ASP 1344N -0.03 0.27 -0.91 6.45 3.32 -1.63 -0.07 116.42 123.83 3dkb h ASP 1344Ca 0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 3dkb h ASP 1344Cb 0.17 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 3dkb h ASP 1344CO -0.00 0.20 0.51 0.22 -1.72 0.00 0.00 179.24 178.44 3dkb h TYR 1345N 0.34 1.24 -0.61 4.55 3.20 -1.23 -2.01 116.97 122.45 3dkb h TYR 1345Ca 0.11 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 3dkb h TYR 1345Cb -0.01 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 37.84 3dkb h TYR 1345CO -0.07 0.85 0.08 0.35 -1.64 0.00 0.00 178.16 177.72 3dkb h PHE 1346N 1.26 1.06 -0.10 -3.82 3.57 -0.45 -2.06 116.94 116.40 3dkb h PHE 1346Ca 0.32 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 3dkb h PHE 1346Cb 0.01 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 3dkb h PHE 1346CO 0.01 0.91 -0.14 0.93 -2.23 0.00 0.00 178.31 177.79 3dkb h GLU 1347N 0.94 0.15 0.24 1.11 5.08 -0.48 0.11 114.58 121.73 3dkb h GLU 1347Ca 0.19 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3dkb h GLU 1347Cb 0.43 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3dkb h GLU 1347CO 0.01 0.30 -0.11 1.25 -1.00 0.00 0.00 179.01 179.46 3dkb h LEU 1348N 0.14 -0.27 -1.26 1.33 5.85 -0.75 -1.94 115.31 118.41 3dkb h LEU 1348Ca 0.03 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 3dkb h LEU 1348Cb 0.34 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3dkb h LEU 1348CO 0.02 -0.00 -0.26 -0.37 -0.34 0.00 0.00 178.44 177.49 3dkb h VAL 1349N -0.54 1.23 -0.74 1.05 -1.51 -1.04 -0.97 116.25 113.73 3dkb h VAL 1349Ca -0.03 -1.08 -0.05 0.00 -1.23 0.00 0.00 66.70 64.31 3dkb h VAL 1349Cb 0.40 1.45 -0.03 0.00 -2.13 0.00 0.00 31.29 30.98 3dkb h VAL 1349CO 0.05 0.32 0.28 -0.61 -1.23 0.00 0.00 177.57 176.38 3dkb h GLN 1350N 0.16 1.11 0.06 5.19 4.15 -0.63 -1.82 115.11 123.33 3dkb h GLN 1350Ca 0.02 -0.20 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 3dkb h GLN 1350Cb 0.55 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.07 3dkb h GLN 1350CO 0.04 0.91 -0.03 1.25 -1.93 0.00 0.00 178.83 179.07 3dkb h HIS 1351N 1.08 -0.08 0.00 3.99 2.76 -0.97 -2.83 115.15 119.10 3dkb h HIS 1351Ca 0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 3dkb h HIS 1351Cb 0.23 0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.22 3dkb h HIS 1351CO 0.02 0.52 0.00 0.93 -1.30 0.00 0.00 177.93 178.10 3dkb h GLU 1352N -0.87 0.00 0.12 5.26 4.39 -1.21 -1.52 114.58 120.74 3dkb h GLU 1352Ca -0.01 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.52 3dkb h GLU 1352Cb 0.63 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 3dkb h GLU 1352CO 0.01 0.00 -0.80 -0.92 -1.16 0.00 0.00 179.01 176.15 3dkb h TYR 1353N 0.00 0.45 -0.48 4.33 3.20 -1.33 -1.41 116.97 121.72 3dkb h TYR 1353Ca 0.00 -0.33 0.01 0.00 3.14 0.00 0.00 58.73 61.55 3dkb h TYR 1353Cb 0.02 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 3dkb h TYR 1353CO 0.00 1.31 0.32 -0.22 -1.64 0.00 0.00 178.16 177.92 3dkb h LYS 1354N -0.46 0.62 0.00 1.82 3.64 -1.10 0.71 116.57 121.79 3dkb h LYS 1354Ca -0.15 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 3dkb h LYS 1354Cb 1.57 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 3dkb h LYS 1354CO 0.11 0.41 0.00 1.63 -2.27 0.00 0.00 179.45 179.33 3dkb n LYS 1355N -4.47 0.42 -0.06 1.90 5.02 -0.65 -2.04 118.16 118.28 3dkb n LYS 1355Ca 0.04 0.02 -0.01 0.00 -2.02 0.00 0.00 58.31 56.34 3dkb n LYS 1355Cb 0.06 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.41 3dkb n LYS 1355CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 3dkb n TRP 1356N -1.27 0.00 0.09 2.13 -0.00 0.22 -3.31 117.44 115.30 3dkb n TRP 1356Ca 0.14 0.00 -0.23 0.00 -0.00 0.00 0.00 57.50 57.41 3dkb n TRP 1356Cb 0.22 -0.78 -0.15 0.00 -0.00 0.00 0.00 31.31 30.60 3dkb n TRP 1356CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 177.69 179.65 3dkb h GLN 1357N 0.00 0.42 0.00 5.87 4.20 -0.68 -1.34 115.11 123.58 3dkb h GLN 1357Ca -0.31 -0.71 -0.08 0.00 0.06 0.00 0.00 58.65 57.61 3dkb h GLN 1357Cb 1.70 0.27 -0.01 0.00 0.30 0.00 0.00 27.48 29.74 3dkb h GLN 1357CO 0.02 1.34 -0.36 0.93 -0.67 0.00 0.00 178.83 180.09 3dkb h GLU 1358N -0.09 0.00 0.06 1.46 5.08 -1.61 -3.09 114.58 116.38 3dkb h GLU 1358Ca -0.23 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.93 3dkb h GLU 1358Cb 1.93 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.20 3dkb h GLU 1358CO 0.20 0.36 -0.84 -0.91 -1.00 0.00 0.00 179.01 176.82 3dkb h ASN 1359N 0.00 0.64 0.00 1.42 4.21 -1.57 -3.26 115.58 117.02 3dkb h ASN 1359Ca -0.00 -0.81 0.00 0.00 1.21 0.00 0.00 56.30 56.70 3dkb h ASN 1359Cb 0.70 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 3dkb h ASN 1359CO 0.05 1.38 0.00 -1.54 -1.29 0.00 0.00 177.43 176.03 3dkb n SER 1360N -4.06 0.43 -0.76 5.81 3.41 -0.51 -2.85 113.62 115.09 3dkb n SER 1360Ca -0.12 -0.67 0.05 0.00 -0.26 0.00 0.00 58.87 57.87 3dkb n SER 1360Cb 0.80 -0.17 0.16 0.00 -0.26 0.00 0.00 64.21 64.74 3dkb n SER 1360CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dkb n GLU 1361N 0.40 2.05 0.00 4.33 1.02 -1.23 -5.05 120.64 122.16 3dkb n GLU 1361Ca 0.00 -1.32 0.08 0.00 -0.02 0.00 0.00 57.16 55.90 3dkb n GLU 1361Cb 0.10 -1.41 0.07 0.00 -0.02 0.00 0.00 31.44 30.18 3dkb n GLU 1361CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35