#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fth s ILE 1004N 0.00 3.97 -0.03 1.12 1.01 -1.26 -2.21 121.20 123.80 1fth s ILE 1004Ca 0.00 1.89 0.04 0.00 0.00 0.00 0.00 60.65 62.58 1fth s ILE 1004Cb 0.00 -4.17 0.06 0.00 0.01 0.00 0.00 42.46 38.36 1fth s ILE 1004CO 0.00 0.38 0.89 1.33 0.00 0.00 0.00 174.94 177.54 1fth n VAL 1005N 1.18 0.76 0.00 2.92 0.24 -0.29 -4.97 118.33 118.16 1fth n VAL 1005Ca -0.01 -0.83 0.00 0.00 -2.04 0.00 0.00 64.34 61.46 1fth n VAL 1005Cb 0.47 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 1fth n VAL 1005CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fth n GLY 1006N -0.47 2.79 3.37 7.63 0.00 -1.25 -4.92 105.19 112.34 1fth n GLY 1006Ca 0.03 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1fth n GLY 1006CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fth s HIS 1007N -2.00 -0.60 -0.00 1.61 5.04 -1.25 -1.46 115.29 116.63 1fth s HIS 1007Ca 0.00 1.37 -0.14 0.00 -1.54 0.00 0.00 55.06 54.74 1fth s HIS 1007Cb 0.00 0.25 0.02 0.00 0.04 0.00 0.00 32.58 32.89 1fth s HIS 1007CO 0.00 -0.31 0.30 0.20 -2.34 0.00 0.00 174.74 172.59 1fth s GLY 1008N 0.76 -0.14 0.16 1.59 0.00 -0.80 -4.12 107.32 104.76 1fth s GLY 1008Ca -0.04 0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.94 1fth s GLY 1008CO -0.06 0.05 0.04 -0.26 0.00 0.00 0.00 173.10 172.88 1fth s ILE 1009N -1.52 0.36 -0.15 0.90 -4.36 -1.26 -1.22 121.20 113.95 1fth s ILE 1009Ca -0.12 -1.95 -0.27 0.00 -0.26 0.00 0.00 60.65 58.05 1fth s ILE 1009Cb -0.05 -2.16 0.07 0.00 1.25 0.00 0.00 42.46 41.57 1fth s ILE 1009CO 0.03 -0.40 0.66 -0.62 0.24 0.00 0.00 174.94 174.86 1fth s ASP 1010N -3.13 -0.66 -0.02 4.36 -1.08 -0.84 -4.70 116.67 110.59 1fth s ASP 1010Ca 0.26 1.00 0.01 0.00 -0.52 0.00 0.00 52.55 53.30 1fth s ASP 1010Cb 0.07 0.93 0.01 0.00 -1.46 0.00 0.00 42.92 42.47 1fth s ASP 1010CO 0.04 -0.43 -0.04 -0.51 0.52 0.00 0.00 175.17 174.75 1fth s ILE 1011N -0.47 0.43 -0.00 4.11 2.07 -1.26 -1.74 121.20 124.33 1fth s ILE 1011Ca -0.06 -0.15 -0.02 0.00 -1.41 0.00 0.00 60.65 59.01 1fth s ILE 1011Cb -0.02 -0.41 -0.00 0.00 0.13 0.00 0.00 42.46 42.15 1fth s ILE 1011CO 0.05 0.16 0.03 -0.70 -1.91 0.00 0.00 174.94 172.57 1fth s GLU 1012N 0.37 0.18 -0.11 3.50 2.56 -0.77 -5.02 118.70 119.42 1fth s GLU 1012Ca -0.04 -0.21 -0.25 0.00 0.00 0.00 0.00 54.97 54.47 1fth s GLU 1012Cb -0.08 0.07 -0.03 0.00 2.00 0.00 0.00 34.13 36.10 1fth s GLU 1012CO -0.00 -0.03 0.80 -2.00 -0.56 0.00 0.00 175.26 173.46 1fth s GLU 1013N -0.61 4.39 0.41 4.30 2.12 -1.26 -2.14 118.70 125.90 1fth s GLU 1013Ca -0.07 1.02 0.09 0.00 0.36 0.00 0.00 54.97 56.36 1fth s GLU 1013Cb -0.04 -3.51 0.88 0.00 0.26 0.00 0.00 34.13 31.72 1fth s GLU 1013CO -0.00 -0.14 2.02 -0.07 -0.54 0.00 0.00 175.26 176.53 1fth h LEU 1014N 7.50 0.48 -1.61 2.70 4.07 -1.77 -2.46 115.31 124.22 1fth h LEU 1014Ca -0.35 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.60 1fth h LEU 1014Cb 1.17 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.78 1fth h LEU 1014CO 0.79 0.33 0.26 0.00 -1.08 0.00 0.00 178.44 178.74 1fth h ALA 1015N 1.71 1.72 -0.43 1.53 0.00 -1.94 -1.77 119.26 120.08 1fth h ALA 1015Ca 0.21 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 1fth h ALA 1015Cb 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1fth h ALA 1015CO -0.06 0.26 -0.17 0.77 0.00 0.00 0.00 179.25 180.06 1fth h SER 1016N 0.53 0.83 0.20 0.00 0.02 -1.85 -2.04 113.55 111.24 1fth h SER 1016Ca 0.14 -0.28 -0.18 0.00 -0.84 0.00 0.00 61.79 60.63 1fth h SER 1016Cb -0.06 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.25 1fth h SER 1016CO -0.03 0.99 -0.72 0.40 -1.14 0.00 0.00 176.83 176.34 1fth h ILE 1017N 0.73 1.36 -0.53 3.27 1.08 -1.46 -3.03 117.51 118.93 1fth h ILE 1017Ca 0.11 -2.09 -0.12 0.00 -0.39 0.00 0.00 64.86 62.37 1fth h ILE 1017Cb 0.68 2.07 -0.02 0.00 -3.07 0.00 0.00 36.82 36.48 1fth h ILE 1017CO 0.05 0.63 -0.14 -0.08 -0.69 0.00 0.00 178.15 177.93 1fth h GLU 1018N 0.31 1.02 -0.60 2.37 4.81 -1.19 -2.92 114.58 118.39 1fth h GLU 1018Ca -0.03 -0.39 -0.07 0.00 -0.13 0.00 0.00 59.36 58.73 1fth h GLU 1018Cb 1.29 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 1fth h GLU 1018CO 0.13 1.08 0.09 0.77 -0.73 0.00 0.00 179.01 180.35 1fth h SER 1019N 0.90 0.94 -0.83 1.04 0.02 -1.41 -2.20 113.55 112.01 1fth h SER 1019Ca 0.13 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1fth h SER 1019Cb 0.71 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 1fth h SER 1019CO 0.05 0.94 0.47 0.00 -1.14 0.00 0.00 176.83 177.16 1fth h ALA 1020N 1.17 1.25 -0.14 3.77 0.00 -1.41 -1.80 119.26 122.10 1fth h ALA 1020Ca 0.19 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1fth h ALA 1020Cb 0.42 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fth h ALA 1020CO 0.01 0.61 -0.37 0.28 0.00 0.00 0.00 179.25 179.79 1fth h VAL 1021N 1.16 1.36 -0.23 0.00 2.07 -1.32 -3.15 116.25 116.14 1fth h VAL 1021Ca 0.30 -1.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1fth h VAL 1021Cb 0.01 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1fth h VAL 1021CO -0.05 0.50 0.11 0.74 0.02 0.00 0.00 177.57 178.89 1fth h THR 1022N 0.13 1.08 0.00 2.57 2.02 -1.24 -2.06 112.91 115.41 1fth h THR 1022Ca -0.01 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1fth h THR 1022Cb 0.98 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1fth h THR 1022CO 0.08 0.09 0.05 -0.09 0.37 0.00 0.00 175.52 176.02 1fth h ARG 1023N 0.31 0.00 -5.67 6.66 2.43 -1.28 -3.46 114.38 113.36 1fth h ARG 1023Ca 0.08 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.94 1fth h ARG 1023Cb 0.03 0.00 0.16 0.00 -0.42 0.00 0.00 29.97 29.74 1fth h ARG 1023CO -0.01 0.00 -0.86 1.58 -1.51 0.00 0.00 179.97 179.17 1fth n HIS 1024N -2.99 -2.28 0.07 2.20 -0.00 -0.78 -4.94 115.22 106.50 1fth n HIS 1024Ca -0.03 0.80 0.01 0.00 -0.00 0.00 0.00 57.72 58.50 1fth n HIS 1024Cb 0.11 -4.19 0.01 0.00 -0.00 0.00 0.00 29.99 25.92 1fth n HIS 1024CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1fth n GLU 1025N -3.63 -0.75 -0.57 1.57 0.28 -1.26 -5.00 120.64 111.28 1fth n GLU 1025Ca -0.13 -0.60 0.00 0.00 -0.16 0.00 0.00 57.16 56.27 1fth n GLU 1025Cb 0.63 -1.03 0.00 0.00 1.43 0.00 0.00 31.44 32.47 1fth n GLU 1025CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1fth n GLY 1026N 0.10 0.88 0.40 -1.84 0.00 -1.26 -5.02 105.19 98.45 1fth n GLY 1026Ca 0.01 -0.46 -0.17 0.00 0.00 0.00 0.00 46.02 45.40 1fth n GLY 1026CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1fth h PHE 1027N 0.00 -1.00 -0.80 1.61 3.57 -1.94 -2.81 116.94 115.58 1fth h PHE 1027Ca 0.00 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.59 1fth h PHE 1027Cb 0.13 0.37 -0.07 0.00 2.79 0.00 0.00 35.95 39.17 1fth h PHE 1027CO 0.00 -0.55 0.46 0.00 -2.23 0.00 0.00 178.31 175.99 1fth h ALA 1028N -0.49 1.13 0.00 2.41 0.00 -1.95 -1.51 119.26 118.85 1fth h ALA 1028Ca -0.05 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1fth h ALA 1028Cb 0.72 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1fth h ALA 1028CO 0.01 0.09 -0.15 -0.22 0.00 0.00 0.00 179.25 178.99 1fth h LYS 1029N 0.78 0.00 0.11 0.00 3.11 -1.86 -2.04 116.57 116.67 1fth h LYS 1029Ca 0.38 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.94 1fth h LYS 1029Cb 0.33 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.56 1fth h LYS 1029CO -0.24 0.15 -1.33 -0.09 -2.81 0.00 0.00 179.45 175.13 1fth h ARG 1030N 0.00 0.24 0.05 1.90 2.43 -1.02 -3.38 114.38 114.59 1fth h ARG 1030Ca -0.00 -0.41 -0.28 0.00 -0.81 0.00 0.00 59.98 58.48 1fth h ARG 1030Cb 0.29 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1fth h ARG 1030CO 0.02 1.15 -1.48 0.28 -1.51 0.00 0.00 179.97 178.43 1fth h VAL 1031N 0.07 1.17 -3.22 0.20 2.07 -1.26 -3.42 116.25 111.86 1fth h VAL 1031Ca -0.16 -2.90 -0.64 0.00 0.82 0.00 0.00 66.70 63.81 1fth h VAL 1031Cb 1.97 2.66 -0.10 0.00 -1.52 0.00 0.00 31.29 34.30 1fth h VAL 1031CO 0.18 0.75 -0.61 -0.76 0.02 0.00 0.00 177.57 177.15 1fth s LEU 1032N -6.62 3.73 0.00 2.57 1.43 -0.78 -4.70 118.68 114.30 1fth s LEU 1032Ca -0.06 -0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.86 1fth s LEU 1032Cb 0.08 -2.39 0.21 0.00 0.03 0.00 0.00 46.19 44.12 1fth s LEU 1032CO 0.83 0.19 1.23 0.35 0.23 0.00 0.00 176.35 179.18 1fth n THR 1033N 0.59 0.00 0.01 5.49 -2.24 -1.26 -4.82 114.28 112.06 1fth n THR 1033Ca -0.10 -0.90 -0.12 0.00 -2.27 0.00 0.00 64.05 60.66 1fth n THR 1033Cb 0.52 -1.54 -0.08 0.00 -2.10 0.00 0.00 70.33 67.13 1fth n THR 1033CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fth h ALA 1034N -1.83 0.01 -0.64 6.98 0.00 -1.99 -1.23 119.26 120.56 1fth h ALA 1034Ca -0.40 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.41 1fth h ALA 1034Cb 1.10 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1fth h ALA 1034CO 0.28 -0.39 0.42 -0.07 0.00 0.00 0.00 179.25 179.50 1fth h LEU 1035N -0.21 0.72 -0.92 0.00 3.38 -2.01 -2.08 115.31 114.19 1fth h LEU 1035Ca 0.00 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1fth h LEU 1035Cb 0.22 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1fth h LEU 1035CO -0.00 0.52 0.28 -0.33 0.09 0.00 0.00 178.44 179.00 1fth h GLU 1036N 0.85 1.06 -0.77 1.13 5.08 -1.92 -2.72 114.58 117.30 1fth h GLU 1036Ca 0.24 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1fth h GLU 1036Cb -0.08 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 28.96 1fth h GLU 1036CO -0.06 0.87 0.50 1.98 -1.00 0.00 0.00 179.01 181.29 1fth h MET 1037N 1.04 1.02 -0.47 2.33 4.05 -0.57 -2.32 114.93 120.00 1fth h MET 1037Ca 0.24 -0.07 0.01 0.00 -0.28 0.00 0.00 59.70 59.60 1fth h MET 1037Cb 0.21 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 1fth h MET 1037CO -0.02 0.68 0.31 0.93 0.23 0.00 0.00 176.91 179.05 1fth h GLU 1038N 1.05 0.59 -0.07 0.39 5.08 -1.08 -2.37 114.58 118.16 1fth h GLU 1038Ca 0.28 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 58.37 1fth h GLU 1038Cb -0.10 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.03 1fth h GLU 1038CO -0.06 0.39 -0.86 -0.09 -1.00 0.00 0.00 179.01 177.39 1fth h ARG 1039N 0.61 0.70 -0.73 2.33 9.65 -1.46 -3.30 114.38 122.18 1fth h ARG 1039Ca 0.18 -0.67 0.04 0.00 -1.10 0.00 0.00 59.98 58.43 1fth h ARG 1039Cb -0.02 0.17 -0.05 0.00 -1.39 0.00 0.00 29.97 28.68 1fth h ARG 1039CO -0.04 1.26 0.45 0.35 2.80 0.00 0.00 179.97 184.79 1fth h PHE 1040N 0.39 0.84 0.00 2.20 3.57 -1.09 -2.74 116.94 120.11 1fth h PHE 1040Ca -0.09 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1fth h PHE 1040Cb 1.51 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1fth h PHE 1040CO 0.10 0.46 0.00 1.79 -2.23 0.00 0.00 178.31 178.43 1fth h THR 1041N 0.86 0.00 0.00 4.41 1.35 -1.55 -3.10 112.91 114.88 1fth h THR 1041Ca 0.30 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1fth h THR 1041Cb 0.07 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1fth h THR 1041CO -0.13 0.00 -0.26 -1.54 -0.25 0.00 0.00 175.52 173.34 1fth n SER 1042N -2.96 0.35 -4.96 5.36 3.41 -1.03 -4.91 113.62 108.87 1fth n SER 1042Ca 0.02 0.19 -0.22 0.00 -0.26 0.00 0.00 58.87 58.60 1fth n SER 1042Cb 0.35 -0.18 0.02 0.00 -0.26 0.00 0.00 64.21 64.13 1fth n SER 1042CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fth s LEU 1043N -3.31 3.58 0.07 1.04 1.43 -1.17 -5.13 118.68 115.20 1fth s LEU 1043Ca 0.12 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 1fth s LEU 1043Cb 0.17 -3.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1fth s LEU 1043CO 0.62 -0.79 -0.08 -1.59 0.23 0.00 0.00 176.35 174.74 1fth s LYS 1044N -4.58 0.70 4.68 1.70 -2.85 -1.26 -4.79 119.74 113.34 1fth s LYS 1044Ca 0.50 -1.04 0.00 0.00 -1.00 0.00 0.00 55.97 54.43 1fth s LYS 1044Cb -0.10 -0.30 0.00 0.00 -2.06 0.00 0.00 37.83 35.37 1fth s LYS 1044CO 0.38 0.03 0.00 0.41 0.10 0.00 0.00 175.35 176.27 1fth n GLY 1045N 0.75 1.60 0.27 0.59 0.00 -1.26 -2.93 105.19 104.21 1fth n GLY 1045Ca -0.18 -0.59 0.04 0.00 0.00 0.00 0.00 46.02 45.29 1fth n GLY 1045CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1fth h ARG 1046N 0.00 0.32 -0.12 1.61 3.08 -2.01 -2.30 114.38 114.96 1fth h ARG 1046Ca 0.00 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1fth h ARG 1046Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1fth h ARG 1046CO 0.00 0.32 -0.07 0.00 -1.07 0.00 0.00 179.97 179.15 1fth h ARG 1047N 0.32 0.18 -0.51 0.04 3.08 -1.96 -1.91 114.38 113.62 1fth h ARG 1047Ca 0.08 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 1fth h ARG 1047Cb 0.17 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1fth h ARG 1047CO -0.00 0.27 0.05 0.37 -1.07 0.00 0.00 179.97 179.59 1fth h GLN 1048N 0.18 0.87 -0.17 0.04 4.15 -1.34 -2.48 115.11 116.35 1fth h GLN 1048Ca 0.04 -0.25 -0.18 0.00 0.77 0.00 0.00 58.65 59.03 1fth h GLN 1048Cb 0.25 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 1fth h GLN 1048CO 0.01 0.88 -0.61 0.82 -1.93 0.00 0.00 178.83 178.00 1fth h ILE 1049N 0.74 1.32 -0.09 2.39 1.08 -1.46 -3.17 117.51 118.31 1fth h ILE 1049Ca 0.15 -1.88 -0.06 0.00 -0.39 0.00 0.00 64.86 62.68 1fth h ILE 1049Cb 0.45 1.85 -0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1fth h ILE 1049CO 0.02 0.59 -0.22 -0.08 -0.69 0.00 0.00 178.15 177.76 1fth h GLU 1050N 0.43 0.16 -0.26 2.37 4.57 -1.26 -1.73 114.58 118.85 1fth h GLU 1050Ca -0.01 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.08 1fth h GLU 1050Cb 1.18 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 1fth h GLU 1050CO 0.12 0.38 -0.02 -0.92 -1.18 0.00 0.00 179.01 177.39 1fth h TYR 1051N 0.14 0.52 -0.13 0.92 5.03 -1.42 -1.38 116.97 120.65 1fth h TYR 1051Ca 0.03 -0.10 -0.01 0.00 2.58 0.00 0.00 58.73 61.23 1fth h TYR 1051Cb 0.48 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.62 1fth h TYR 1051CO 0.00 0.65 0.05 1.25 -1.32 0.00 0.00 178.16 178.79 1fth h LEU 1052N 0.25 0.18 -0.64 2.82 5.85 -1.53 -2.66 115.31 119.58 1fth h LEU 1052Ca 0.07 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.67 1fth h LEU 1052Cb 0.45 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1fth h LEU 1052CO 0.02 0.31 0.35 0.00 -0.34 0.00 0.00 178.44 178.77 1fth h ALA 1053N 0.88 0.85 -0.65 1.25 0.00 -1.31 -2.10 119.26 118.19 1fth h ALA 1053Ca 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1fth h ALA 1053Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1fth h ALA 1053CO -0.00 0.01 0.35 0.78 0.00 0.00 0.00 179.25 180.39 1fth h GLY 1054N 0.64 0.97 1.64 0.00 0.00 -1.15 -1.72 103.07 103.45 1fth h GLY 1054Ca 0.29 -0.44 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 1fth h GLY 1054CO -0.18 0.43 -0.19 3.21 0.00 0.00 0.00 176.54 179.80 1fth h ARG 1055N 0.88 0.43 -0.29 4.80 -0.00 -1.15 -1.96 114.38 117.09 1fth h ARG 1055Ca 0.23 -0.14 -0.07 0.00 -0.50 0.00 0.00 59.98 59.50 1fth h ARG 1055Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 29.97 29.97 1fth h ARG 1055CO -0.04 0.61 -0.09 2.35 0.00 0.00 0.00 179.97 182.80 1fth h TRP 1056N 0.39 0.64 -0.64 3.04 2.91 -1.06 -2.83 115.95 118.40 1fth h TRP 1056Ca 0.07 -0.15 -0.06 0.00 1.13 0.00 0.00 58.89 59.88 1fth h TRP 1056Cb 0.56 -0.15 -0.03 0.00 -0.51 0.00 0.00 29.16 29.03 1fth h TRP 1056CO 0.02 0.78 0.15 1.03 -1.03 0.00 0.00 178.44 179.38 1fth h SER 1057N 0.32 0.98 -0.61 2.65 0.87 -1.17 -2.61 113.55 113.99 1fth h SER 1057Ca 0.07 -0.24 -0.09 0.00 -1.23 0.00 0.00 61.79 60.30 1fth h SER 1057Cb 0.58 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 1fth h SER 1057CO 0.03 0.96 0.04 0.00 -0.53 0.00 0.00 176.83 177.33 1fth h ALA 1058N 1.05 0.89 -0.58 6.23 0.00 -1.38 -2.03 119.26 123.45 1fth h ALA 1058Ca 0.20 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1fth h ALA 1058Cb 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1fth h ALA 1058CO 0.00 0.66 -0.06 0.87 0.00 0.00 0.00 179.25 180.73 1fth h LYS 1059N 0.98 1.05 -0.28 0.00 1.57 -1.41 -1.96 116.57 116.52 1fth h LYS 1059Ca 0.18 -0.36 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 1fth h LYS 1059Cb 0.51 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1fth h LYS 1059CO 0.02 1.06 -0.29 0.93 -0.57 0.00 0.00 179.45 180.60 1fth h GLU 1060N 0.95 0.56 -0.48 3.15 5.08 -1.38 -2.67 114.58 119.79 1fth h GLU 1060Ca 0.16 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 1fth h GLU 1060Cb 0.62 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1fth h GLU 1060CO 0.04 0.79 -0.12 0.00 -1.00 0.00 0.00 179.01 178.73 1fth h ALA 1061N 1.20 0.88 -0.63 3.43 0.00 -1.15 -2.80 119.26 120.18 1fth h ALA 1061Ca 0.06 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1fth h ALA 1061Cb 0.75 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1fth h ALA 1061CO 0.06 0.64 0.05 0.35 0.00 0.00 0.00 179.25 180.35 1fth h PHE 1062N 0.80 1.17 -0.32 0.00 3.04 -1.23 -2.59 116.94 117.81 1fth h PHE 1062Ca 0.13 -0.19 -0.05 0.00 3.98 0.00 0.00 57.97 61.84 1fth h PHE 1062Cb 0.64 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.83 1fth h PHE 1062CO 0.04 1.01 -0.02 0.66 -2.02 0.00 0.00 178.31 177.98 1fth h SER 1063N 0.99 0.47 0.36 0.41 4.64 -1.34 -2.20 113.55 116.89 1fth h SER 1063Ca 0.19 -0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.27 1fth h SER 1063Cb 0.51 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1fth h SER 1063CO 0.02 0.55 -0.62 0.11 -0.87 0.00 0.00 176.83 176.02 1fth h LYS 1064N 0.48 0.25 0.00 4.77 1.57 -1.34 -2.16 116.57 120.14 1fth h LYS 1064Ca 0.10 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1fth h LYS 1064Cb 0.34 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1fth h LYS 1064CO 0.01 0.79 -0.25 0.00 -0.57 0.00 0.00 179.45 179.43 1fth h ALA 1065N 1.16 1.51 0.00 3.86 0.00 -1.02 -1.38 119.26 123.40 1fth h ALA 1065Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1fth h ALA 1065Cb 1.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1fth h ALA 1065CO 0.10 0.32 -0.41 0.52 0.00 0.00 0.00 179.25 179.78 1fth h MET 1066N 0.00 0.00 -0.16 0.00 2.86 -1.22 -3.33 114.93 113.08 1fth h MET 1066Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1fth h MET 1066Cb 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1fth h MET 1066CO 0.03 0.00 -0.04 0.41 1.06 0.00 0.00 176.91 178.37 1fth n GLY 1067N 1.24 0.47 0.01 8.32 0.00 -0.52 -4.94 105.19 109.77 1fth n GLY 1067Ca 0.03 -0.94 0.01 0.00 0.00 0.00 0.00 46.02 45.12 1fth n GLY 1067CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fth n THR 1068N -3.24 0.07 -0.05 2.61 -2.24 -1.01 -5.03 114.28 105.39 1fth n THR 1068Ca -0.02 -0.10 0.01 0.00 -2.27 0.00 0.00 64.05 61.66 1fth n THR 1068Cb 0.20 -0.03 -0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1fth n THR 1068CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fth n GLY 1069N 2.47 -2.67 3.48 3.38 0.00 -1.11 -4.81 105.19 105.93 1fth n GLY 1069Ca -0.02 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 1fth n GLY 1069CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1fth s ILE 1070N -3.19 4.68 0.00 -0.61 2.07 -1.26 -4.34 121.20 118.54 1fth s ILE 1070Ca 0.00 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.09 1fth s ILE 1070Cb 0.00 -3.26 0.00 0.00 0.13 0.00 0.00 42.46 39.33 1fth s ILE 1070CO 0.00 0.23 0.00 -1.54 -1.91 0.00 0.00 174.94 171.72 1fth n SER 1071N 4.98 0.00 0.12 4.50 3.41 -1.26 -4.84 113.62 120.53 1fth n SER 1071Ca -0.15 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.57 1fth n SER 1071Cb 0.51 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 64.93 1fth n SER 1071CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fth n LYS 1072N 0.00 0.15 -3.68 4.33 4.76 -1.26 -4.57 118.16 117.89 1fth n LYS 1072Ca 0.00 0.45 -0.14 0.00 -2.87 0.00 0.00 58.31 55.75 1fth n LYS 1072Cb 0.00 -1.83 -0.14 0.00 -1.84 0.00 0.00 35.03 31.22 1fth n LYS 1072CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1fth s LEU 1073N -4.25 -0.12 0.96 -0.35 0.20 -1.26 -5.17 118.68 108.68 1fth s LEU 1073Ca 0.03 0.53 -0.13 0.00 0.69 0.00 0.00 54.13 55.25 1fth s LEU 1073Cb 0.08 0.62 0.16 0.00 -0.43 0.00 0.00 46.19 46.62 1fth s LEU 1073CO 0.32 -0.23 1.13 -0.83 -0.29 0.00 0.00 176.35 176.45 1fth s GLY 1074N 2.18 1.58 0.49 7.98 0.00 -1.26 -4.73 107.32 113.56 1fth s GLY 1074Ca -0.00 -0.53 0.27 0.00 0.00 0.00 0.00 44.72 44.46 1fth s GLY 1074CO -0.08 0.07 1.92 0.74 0.00 0.00 0.00 173.10 175.76 1fth h PHE 1075N -1.68 0.00 0.00 1.90 -1.00 -1.89 -3.03 116.94 111.24 1fth h PHE 1075Ca -0.51 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.27 1fth h PHE 1075Cb 1.33 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.89 1fth h PHE 1075CO 0.13 0.15 0.00 1.04 -1.61 0.00 0.00 178.31 178.02 1fth n GLN 1076N -3.36 0.21 0.00 1.51 1.13 -1.26 -2.34 117.38 113.26 1fth n GLN 1076Ca -0.00 0.15 0.12 0.00 -1.94 0.00 0.00 57.00 55.33 1fth n GLN 1076Cb 0.36 -1.50 0.27 0.00 0.11 0.00 0.00 30.24 29.47 1fth n GLN 1076CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1fth n ASP 1077N -1.29 1.56 -4.30 1.08 2.03 -1.14 -4.91 116.55 109.57 1fth n ASP 1077Ca 0.07 -1.26 -0.23 0.00 0.52 0.00 0.00 54.79 53.89 1fth n ASP 1077Cb 0.12 0.20 -0.12 0.00 -0.72 0.00 0.00 41.12 40.60 1fth n ASP 1077CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1fth s LEU 1078N -2.37 2.37 -0.14 -2.67 1.43 -0.99 -4.31 118.68 112.00 1fth s LEU 1078Ca 0.25 -0.77 -0.10 0.00 -1.03 0.00 0.00 54.13 52.48 1fth s LEU 1078Cb 0.19 -0.84 0.04 0.00 0.03 0.00 0.00 46.19 45.61 1fth s LEU 1078CO 0.49 0.01 0.36 -0.70 0.23 0.00 0.00 176.35 176.73 1fth s GLU 1079N -2.35 0.37 -0.20 1.70 2.12 -1.06 -4.84 118.70 114.45 1fth s GLU 1079Ca 0.11 0.60 0.01 0.00 0.36 0.00 0.00 54.97 56.05 1fth s GLU 1079Cb -0.08 0.07 0.04 0.00 0.26 0.00 0.00 34.13 34.43 1fth s GLU 1079CO 0.05 -0.11 -0.11 0.08 -0.54 0.00 0.00 175.26 174.63 1fth s VAL 1080N 0.78 1.71 0.06 3.70 1.01 -1.26 -1.08 120.40 125.32 1fth s VAL 1080Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1fth s VAL 1080Cb -0.06 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1fth s VAL 1080CO -0.05 0.20 0.02 0.18 0.00 0.00 0.00 175.10 175.44 1fth n LEU 1081N 4.66 0.00 -4.26 3.92 4.77 -0.79 -4.88 117.00 120.42 1fth n LEU 1081Ca -0.15 -0.34 -0.32 0.00 -0.03 0.00 0.00 56.01 55.16 1fth n LEU 1081Cb 0.47 0.02 -0.16 0.00 -2.33 0.00 0.00 43.42 41.42 1fth n LEU 1081CO 0.21 -0.14 -0.53 0.20 -1.33 0.00 0.00 177.39 175.80 1fth s ASN 1082N -1.33 3.35 1.04 -1.43 -0.87 -1.26 -1.23 114.94 113.21 1fth s ASN 1082Ca 0.01 -0.49 -0.13 0.00 -1.57 0.00 0.00 52.86 50.68 1fth s ASN 1082Cb -0.00 -1.45 0.18 0.00 -0.02 0.00 0.00 41.25 39.96 1fth s ASN 1082CO 0.01 0.16 0.95 -0.46 -2.57 0.00 0.00 177.10 175.19 1fth n ASN 1083N 3.50 -0.38 0.00 -1.22 2.04 -0.52 -4.83 115.26 113.86 1fth n ASN 1083Ca -0.19 -1.27 0.05 0.00 -0.44 0.00 0.00 54.58 52.74 1fth n ASN 1083Cb 0.53 -0.75 0.30 0.00 -2.53 0.00 0.00 39.78 37.33 1fth n ASN 1083CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1fth n GLU 1084N -3.31 0.29 0.00 -3.83 0.28 -1.26 -0.79 120.64 112.02 1fth n GLU 1084Ca 0.12 0.05 0.05 0.00 -0.16 0.00 0.00 57.16 57.22 1fth n GLU 1084Cb 0.43 -1.50 0.03 0.00 1.43 0.00 0.00 31.44 31.83 1fth n GLU 1084CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1fth n ARG 1085N -1.07 1.09 -0.55 3.44 5.12 -1.26 -4.99 116.66 118.43 1fth n ARG 1085Ca 0.07 -0.98 0.00 0.00 -1.93 0.00 0.00 57.85 55.02 1fth n ARG 1085Cb 0.05 -1.17 0.00 0.00 -1.16 0.00 0.00 32.46 30.17 1fth n ARG 1085CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1fth n GLY 1086N 0.73 0.74 3.87 -0.13 0.00 0.03 -5.07 105.19 105.36 1fth n GLY 1086Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 1fth n GLY 1086CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fth s ALA 1087N -2.28 3.79 0.39 4.61 0.00 -1.26 -4.74 121.76 122.27 1fth s ALA 1087Ca 0.00 -0.46 -0.26 0.00 0.00 0.00 0.00 51.96 51.23 1fth s ALA 1087Cb 0.00 -2.17 -0.09 0.00 0.00 0.00 0.00 23.12 20.86 1fth s ALA 1087CO 0.00 0.59 1.27 -1.25 0.00 0.00 0.00 175.76 176.37 1fth s PRO 1088N -1.58 4.07 0.05 0.00 0.04 -1.26 -1.43 135.00 134.88 1fth s PRO 1088Ca 0.27 2.08 -0.21 0.00 0.04 0.00 0.00 61.00 63.18 1fth s PRO 1088Cb -0.14 -2.80 0.05 0.00 0.04 0.00 0.00 34.50 31.65 1fth s PRO 1088CO 0.15 -0.38 0.49 1.52 0.04 0.00 0.00 177.00 178.82 1fth s TYR 1089N -1.27 -0.39 -0.47 0.56 -0.85 -0.37 -4.88 117.35 109.69 1fth s TYR 1089Ca 0.55 0.40 -0.29 0.00 -0.52 0.00 0.00 57.07 57.21 1fth s TYR 1089Cb -0.36 0.32 0.03 0.00 0.38 0.00 0.00 41.96 42.32 1fth s TYR 1089CO 0.47 -0.63 1.14 -0.06 -1.52 0.00 0.00 175.55 174.95 1fth s PHE 1090N -2.50 2.82 -0.44 -3.49 0.40 -1.26 -1.89 117.98 111.63 1fth s PHE 1090Ca -0.05 0.74 0.23 0.00 -0.60 0.00 0.00 56.93 57.26 1fth s PHE 1090Cb -0.01 -4.39 0.23 0.00 0.51 0.00 0.00 43.02 39.36 1fth s PHE 1090CO -0.02 -1.26 1.28 0.66 0.70 0.00 0.00 175.22 176.58 1fth h SER 1091N 9.20 0.00 -3.47 1.36 4.64 -1.47 -3.45 113.55 120.35 1fth h SER 1091Ca -0.23 -0.07 -0.25 0.00 -0.47 0.00 0.00 61.79 60.77 1fth h SER 1091Cb 1.06 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.84 1fth h SER 1091CO 1.12 0.04 -0.61 -1.10 -0.87 0.00 0.00 176.83 175.41 1fth s GLN 1092N -3.25 0.08 -0.24 4.77 -1.52 -1.19 -4.97 119.66 113.34 1fth s GLN 1092Ca 0.04 0.33 -0.30 0.00 -1.95 0.00 0.00 55.36 53.48 1fth s GLN 1092Cb 0.10 -0.17 0.17 0.00 -0.22 0.00 0.00 33.01 32.90 1fth s GLN 1092CO 0.73 -0.15 1.25 0.00 -0.25 0.00 0.00 175.29 176.87 1fth s ALA 1093N 1.07 -2.07 -1.37 6.09 0.00 -1.26 -2.56 121.76 121.66 1fth s ALA 1093Ca -0.08 1.79 -0.08 0.00 0.00 0.00 0.00 51.96 53.59 1fth s ALA 1093Cb -0.11 -1.19 0.09 0.00 0.00 0.00 0.00 23.12 21.91 1fth s ALA 1093CO -0.05 -0.29 2.32 -0.35 0.00 0.00 0.00 175.76 177.39 1fth n PRO 1094N 0.53 4.03 -3.68 0.00 -0.04 -1.26 -4.87 135.00 129.71 1fth n PRO 1094Ca -0.03 -3.21 -0.14 0.00 -0.04 0.00 0.00 63.50 60.09 1fth n PRO 1094Cb 0.59 -2.80 -0.08 0.00 -0.04 0.00 0.00 33.50 31.16 1fth n PRO 1094CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1fth s PHE 1095N 0.19 -0.50 -0.91 0.54 2.19 -1.26 -5.08 117.98 113.15 1fth s PHE 1095Ca 0.52 1.12 0.12 0.00 0.33 0.00 0.00 56.93 59.02 1fth s PHE 1095Cb 0.15 0.21 -0.04 0.00 -1.31 0.00 0.00 43.02 42.03 1fth s PHE 1095CO -0.06 -0.35 0.63 -1.13 1.83 0.00 0.00 175.22 176.14 1fth n SER 1096N 2.19 1.07 -0.93 6.13 3.41 -1.26 -5.01 113.62 119.22 1fth n SER 1096Ca -0.16 -1.04 0.00 0.00 -0.26 0.00 0.00 58.87 57.41 1fth n SER 1096Cb 0.56 0.65 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1fth n SER 1096CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fth n GLY 1097N 1.07 1.09 3.77 5.00 0.00 -1.26 -5.07 105.19 109.79 1fth n GLY 1097Ca 0.04 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.76 1fth n GLY 1097CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fth s LYS 1098N 2.08 4.43 -0.24 1.61 1.02 -0.12 -4.96 119.74 123.56 1fth s LYS 1098Ca 0.00 0.98 0.01 0.00 0.02 0.00 0.00 55.97 56.97 1fth s LYS 1098Cb 0.00 -3.30 0.04 0.00 -0.52 0.00 0.00 37.83 34.05 1fth s LYS 1098CO 0.00 0.46 -0.11 0.42 -0.92 0.00 0.00 175.35 175.20 1fth s ILE 1099N -0.63 2.41 -0.27 2.17 1.01 -1.26 -2.04 121.20 122.59 1fth s ILE 1099Ca 0.34 -1.27 -0.13 0.00 0.00 0.00 0.00 60.65 59.60 1fth s ILE 1099Cb -0.21 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 1fth s ILE 1099CO 0.22 0.17 0.29 0.26 0.00 0.00 0.00 174.94 175.89 1fth s TRP 1100N 1.22 3.25 0.02 3.97 0.52 -0.70 -4.91 118.94 122.30 1fth s TRP 1100Ca -0.03 0.30 0.05 0.00 0.02 0.00 0.00 56.10 56.44 1fth s TRP 1100Cb -0.17 -2.48 -0.02 0.00 -1.15 0.00 0.00 33.47 29.65 1fth s TRP 1100CO -0.07 -0.17 -0.16 -1.17 0.02 0.00 0.00 176.95 175.41 1fth s LEU 1101N 1.85 2.10 -0.07 2.99 2.96 -1.26 -1.82 118.68 125.43 1fth s LEU 1101Ca 0.12 -0.38 -0.06 0.00 -0.22 0.00 0.00 54.13 53.59 1fth s LEU 1101Cb -0.16 -0.75 0.02 0.00 0.50 0.00 0.00 46.19 45.81 1fth s LEU 1101CO 0.10 0.13 0.18 -0.55 -1.32 0.00 0.00 176.35 174.89 1fth s SER 1102N -0.77 -0.19 0.02 3.68 0.15 -1.04 -4.96 113.70 110.60 1fth s SER 1102Ca 0.05 0.37 0.04 0.00 0.70 0.00 0.00 55.95 57.11 1fth s SER 1102Cb -0.07 0.36 -0.02 0.00 -1.71 0.00 0.00 66.02 64.58 1fth s SER 1102CO 0.00 -0.08 -0.13 -0.63 1.20 0.00 0.00 173.24 173.61 1fth s ILE 1103N 0.25 1.02 0.05 6.45 1.01 -1.26 -2.12 121.20 126.61 1fth s ILE 1103Ca -0.01 -0.85 -0.13 0.00 0.00 0.00 0.00 60.65 59.65 1fth s ILE 1103Cb -0.03 -0.91 0.02 0.00 0.01 0.00 0.00 42.46 41.55 1fth s ILE 1103CO -0.01 0.06 0.29 -0.55 0.00 0.00 0.00 174.94 174.73 1fth s SER 1104N -0.90 -0.09 0.17 3.58 0.15 -0.85 -5.03 113.70 110.72 1fth s SER 1104Ca 0.02 -0.27 -0.19 0.00 0.70 0.00 0.00 55.95 56.22 1fth s SER 1104Cb -0.07 0.36 0.04 0.00 -1.71 0.00 0.00 66.02 64.64 1fth s SER 1104CO 0.01 -0.64 0.51 -1.38 1.20 0.00 0.00 173.24 172.93 1fth s HIS 1105N -2.79 -0.25 0.00 3.44 -3.43 -1.26 -1.33 115.29 109.66 1fth s HIS 1105Ca -0.03 -0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.18 1fth s HIS 1105Cb -0.00 0.40 0.00 0.00 -1.43 0.00 0.00 32.58 31.55 1fth s HIS 1105CO -0.05 -0.84 0.00 0.25 -2.00 0.00 0.00 174.74 172.10 1fth n THR 1106N -0.32 0.00 1.51 -5.38 -2.24 -0.65 -5.02 114.28 102.18 1fth n THR 1106Ca -0.14 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.79 1fth n THR 1106Cb 0.63 0.00 0.74 0.00 -2.10 0.00 0.00 70.33 69.61 1fth n THR 1106CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1fth n ASP 1107N -0.74 0.15 0.00 3.42 3.85 -1.26 -4.18 116.55 117.79 1fth n ASP 1107Ca 0.00 -0.41 0.00 0.00 -0.71 0.00 0.00 54.79 53.67 1fth n ASP 1107Cb 0.00 -0.18 0.00 0.00 -1.35 0.00 0.00 41.12 39.59 1fth n ASP 1107CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1fth n GLN 1108N -1.13 2.81 -4.28 0.11 6.02 -1.26 -4.96 117.38 114.68 1fth n GLN 1108Ca 0.16 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 57.00 1fth n GLN 1108Cb 0.23 -0.91 -0.10 0.00 1.02 0.00 0.00 30.24 30.48 1fth n GLN 1108CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1fth s PHE 1109N -1.78 1.38 0.01 1.08 0.40 -1.26 -2.09 117.98 115.72 1fth s PHE 1109Ca 0.00 -0.99 0.01 0.00 -0.60 0.00 0.00 56.93 55.35 1fth s PHE 1109Cb 0.00 -0.79 -0.01 0.00 0.51 0.00 0.00 43.02 42.73 1fth s PHE 1109CO 0.00 -0.15 -0.05 0.54 0.70 0.00 0.00 175.22 176.26 1fth s VAL 1110N -3.57 0.35 0.06 -0.44 0.11 -0.91 -1.64 120.40 114.36 1fth s VAL 1110Ca 0.27 -0.45 0.02 0.00 -2.93 0.00 0.00 61.98 58.89 1fth s VAL 1110Cb 0.06 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 1fth s VAL 1110CO 0.07 -0.07 -0.08 0.42 -3.33 0.00 0.00 175.10 172.10 1fth s THR 1111N -0.52 0.62 -0.00 5.04 -4.23 -0.44 -1.84 115.64 114.27 1fth s THR 1111Ca -0.03 -1.35 -0.11 0.00 -1.18 0.00 0.00 61.69 59.02 1fth s THR 1111Cb -0.04 -0.96 0.01 0.00 1.34 0.00 0.00 72.50 72.85 1fth s THR 1111CO -0.00 -0.52 0.23 0.00 -0.54 0.00 0.00 174.62 173.78 1fth s ALA 1112N -2.06 -0.56 -0.03 3.99 0.00 -0.71 -2.01 121.76 120.39 1fth s ALA 1112Ca -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 51.99 1fth s ALA 1112Cb -0.05 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1fth s ALA 1112CO -0.01 -0.25 0.06 0.45 0.00 0.00 0.00 175.76 176.01 1fth s SER 1113N -1.45 -0.04 -0.00 0.00 0.15 -0.90 -1.99 113.70 109.47 1fth s SER 1113Ca -0.13 0.12 0.03 0.00 0.70 0.00 0.00 55.95 56.67 1fth s SER 1113Cb -0.06 0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.32 1fth s SER 1113CO 0.02 -0.06 -0.11 -0.69 1.20 0.00 0.00 173.24 173.61 1fth s VAL 1114N 0.38 0.83 -0.05 4.45 1.01 -0.36 -2.48 120.40 124.18 1fth s VAL 1114Ca -0.03 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1fth s VAL 1114Cb -0.04 -0.70 0.02 0.00 0.00 0.00 0.00 36.38 35.66 1fth s VAL 1114CO -0.01 0.21 -0.05 -0.63 0.00 0.00 0.00 175.10 174.61 1fth s ILE 1115N -0.30 0.58 -0.13 2.22 1.01 -0.76 -1.91 121.20 121.92 1fth s ILE 1115Ca 0.04 -0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 1fth s ILE 1115Cb -0.04 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1fth s ILE 1115CO -0.00 0.24 0.08 -0.76 0.00 0.00 0.00 174.94 174.49 1fth s LEU 1116N 0.93 4.00 -0.01 2.97 1.43 -0.53 -1.72 118.68 125.74 1fth s LEU 1116Ca -0.11 0.26 -0.09 0.00 -1.03 0.00 0.00 54.13 53.17 1fth s LEU 1116Cb -0.14 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.11 1fth s LEU 1116CO 0.00 0.33 0.18 -0.70 0.23 0.00 0.00 176.35 176.39 1fth s GLU 1117N -0.56 0.50 -0.05 1.70 2.12 -0.86 -1.14 118.70 120.41 1fth s GLU 1117Ca 0.11 -0.29 -0.02 0.00 0.36 0.00 0.00 54.97 55.13 1fth s GLU 1117Cb -0.12 0.21 0.04 0.00 0.26 0.00 0.00 34.13 34.52 1fth s GLU 1117CO 0.02 -0.12 0.11 -1.83 -0.54 0.00 0.00 175.26 172.90 1fth s GLU 1118N -1.24 0.04 0.00 4.30 -1.05 -0.94 -0.94 118.70 118.87 1fth s GLU 1118Ca -0.13 0.33 0.04 0.00 -0.15 0.00 0.00 54.97 55.06 1fth s GLU 1118Cb -0.07 -0.22 0.03 0.00 -0.44 0.00 0.00 34.13 33.44 1fth s GLU 1118CO 0.02 -0.18 0.63 0.09 0.95 0.00 0.00 175.26 176.76