#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fwt s LYS 1003N 0.00 4.24 0.22 5.31 2.20 -1.26 -4.98 119.74 125.47 1fwt s LYS 1003Ca 0.00 1.93 -0.30 0.00 -0.36 0.00 0.00 55.97 57.24 1fwt s LYS 1003Cb 0.00 -3.76 -0.09 0.00 -1.51 0.00 0.00 37.83 32.47 1fwt s LYS 1003CO 0.00 -0.69 1.28 0.12 -0.36 0.00 0.00 175.35 175.69 1fwt s PHE 1004N 3.23 3.28 -0.16 4.03 2.19 -1.21 -4.76 117.98 124.59 1fwt s PHE 1004Ca 0.64 1.31 -0.10 0.00 0.33 0.00 0.00 56.93 59.10 1fwt s PHE 1004Cb -0.29 -3.56 -0.05 0.00 -1.31 0.00 0.00 43.02 37.81 1fwt s PHE 1004CO 0.24 -1.68 0.19 -1.17 1.83 0.00 0.00 175.22 174.63 1fwt s LEU 1005N -0.40 4.29 -0.23 6.12 2.96 -0.77 -0.43 118.68 130.22 1fwt s LEU 1005Ca 0.54 0.41 0.01 0.00 -0.22 0.00 0.00 54.13 54.88 1fwt s LEU 1005Cb -0.36 -2.18 0.06 0.00 0.50 0.00 0.00 46.19 44.20 1fwt s LEU 1005CO 0.40 0.23 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.90 1fwt s VAL 1006N -0.09 1.67 -0.34 1.68 1.01 -0.45 -0.73 120.40 123.15 1fwt s VAL 1006Ca 0.13 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.71 1fwt s VAL 1006Cb -0.12 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1fwt s VAL 1006CO 0.02 -0.04 0.26 -0.63 0.00 0.00 0.00 175.10 174.71 1fwt s ILE 1007N 1.34 5.27 0.03 2.22 1.01 0.31 -1.49 121.20 129.89 1fwt s ILE 1007Ca -0.06 -0.15 -0.09 0.00 0.00 0.00 0.00 60.65 60.36 1fwt s ILE 1007Cb -0.19 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1fwt s ILE 1007CO -0.06 -0.01 0.17 0.00 0.00 0.00 0.00 174.94 175.04 1fwt s ALA 1008N 1.77 -0.31 0.00 9.38 0.00 -0.61 -0.41 121.76 131.58 1fwt s ALA 1008Ca 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.73 1fwt s ALA 1008Cb -0.17 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1fwt s ALA 1008CO 0.11 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1fwt n GLY 1009N 0.82 0.48 3.77 0.00 0.00 -1.14 -1.31 105.19 107.81 1fwt n GLY 1009Ca -0.19 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.19 1fwt n GLY 1009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fwt s PRO 1010N -1.99 4.41 0.18 1.61 0.04 -1.08 -1.10 135.00 137.07 1fwt s PRO 1010Ca 0.00 2.00 -0.20 0.00 0.04 0.00 0.00 61.00 62.83 1fwt s PRO 1010Cb 0.00 -3.05 0.10 0.00 0.04 0.00 0.00 34.50 31.60 1fwt s PRO 1010CO 0.00 -0.06 1.61 0.00 0.04 0.00 0.00 177.00 178.59 1fwt s ALA 1012N -6.06 2.03 -1.29 0.00 0.00 -1.26 -1.75 121.76 113.42 1fwt s ALA 1012Ca -0.15 -1.40 -0.18 0.00 0.00 0.00 0.00 51.96 50.24 1fwt s ALA 1012Cb 0.15 -0.26 0.04 0.00 0.00 0.00 0.00 23.12 23.06 1fwt s ALA 1012CO 0.69 0.36 1.82 -0.89 0.00 0.00 0.00 175.76 177.74 1fwt n ILE 1013N 0.73 3.61 0.21 0.00 5.41 -0.63 -4.73 119.36 123.96 1fwt n ILE 1013Ca -0.17 -3.69 0.06 0.00 1.00 0.00 0.00 62.75 59.95 1fwt n ILE 1013Cb 0.55 -2.36 0.53 0.00 -0.71 0.00 0.00 39.64 37.65 1fwt n ILE 1013CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1fwt h GLU 1014N 7.66 0.05 -1.31 0.38 5.08 -1.95 -3.41 114.58 121.07 1fwt h GLU 1014Ca 0.44 -0.01 0.24 0.00 -1.00 0.00 0.00 59.36 59.03 1fwt h GLU 1014Cb 0.85 -0.01 -0.22 0.00 0.50 0.00 0.00 28.75 29.87 1fwt h GLU 1014CO 1.49 0.15 0.85 -1.54 -1.00 0.00 0.00 179.01 178.96 1fwt s SER 1015N -7.00 -0.12 0.44 1.42 1.04 -1.26 -4.99 113.70 103.22 1fwt s SER 1015Ca -0.05 0.06 0.12 0.00 0.48 0.00 0.00 55.95 56.56 1fwt s SER 1015Cb 0.16 0.11 0.96 0.00 0.10 0.00 0.00 66.02 67.35 1fwt s SER 1015CO 0.69 -0.16 2.01 -0.08 0.98 0.00 0.00 173.24 176.68 1fwt h GLU 1016N 2.08 0.17 -0.34 4.02 4.81 -1.96 -2.40 114.58 120.95 1fwt h GLU 1016Ca -0.09 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1fwt h GLU 1016Cb 1.17 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 1fwt h GLU 1016CO 0.23 0.24 0.17 1.49 -0.73 0.00 0.00 179.01 180.41 1fwt h GLU 1017N 0.17 0.49 -0.54 1.92 4.81 -1.99 -2.02 114.58 117.41 1fwt h GLU 1017Ca 0.04 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1fwt h GLU 1017Cb 0.21 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1fwt h GLU 1017CO 0.01 0.44 0.29 1.25 -0.73 0.00 0.00 179.01 180.26 1fwt h LEU 1018N 0.42 0.43 -0.33 1.64 5.85 -1.82 -1.94 115.31 119.56 1fwt h LEU 1018Ca 0.12 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1fwt h LEU 1018Cb 0.10 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1fwt h LEU 1018CO -0.02 0.29 0.15 -0.07 -0.34 0.00 0.00 178.44 178.45 1fwt h LEU 1019N 0.56 0.20 -1.35 2.25 4.07 -1.24 -1.74 115.31 118.06 1fwt h LEU 1019Ca 0.24 0.02 -0.05 0.00 0.08 0.00 0.00 57.88 58.17 1fwt h LEU 1019Cb 0.12 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1fwt h LEU 1019CO -0.15 0.15 -0.11 -0.07 -1.08 0.00 0.00 178.44 177.17 1fwt h LEU 1020N 0.31 0.28 -0.29 1.67 3.38 -1.08 0.56 115.31 120.14 1fwt h LEU 1020Ca 0.14 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1fwt h LEU 1020Cb 0.08 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1fwt h LEU 1020CO -0.12 0.43 -0.10 0.50 0.09 0.00 0.00 178.44 179.24 1fwt h LYS 1021N 0.28 0.57 -0.09 1.13 3.64 -0.89 -1.06 116.57 120.14 1fwt h LYS 1021Ca 0.06 -0.24 -0.17 0.00 -1.27 0.00 0.00 60.65 59.03 1fwt h LYS 1021Cb 0.38 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1fwt h LYS 1021CO 0.02 0.79 -0.60 0.28 -2.27 0.00 0.00 179.45 177.68 1fwt h VAL 1022N 0.32 1.35 -0.93 2.00 2.07 -1.03 -3.21 116.25 116.82 1fwt h VAL 1022Ca 0.07 -1.91 0.09 0.00 0.82 0.00 0.00 66.70 65.77 1fwt h VAL 1022Cb 0.60 2.22 -0.07 0.00 -1.52 0.00 0.00 31.29 32.52 1fwt h VAL 1022CO 0.03 0.58 0.60 1.23 0.02 0.00 0.00 177.57 180.03 1fwt h GLY 1023N 0.19 1.40 0.95 2.17 0.00 0.16 -0.65 103.07 107.29 1fwt h GLY 1023Ca -0.05 -0.40 0.01 0.00 0.00 0.00 0.00 47.33 46.89 1fwt h GLY 1023CO 0.12 0.23 0.18 -2.09 0.00 0.00 0.00 176.54 174.98 1fwt h GLU 1024N 0.97 0.36 -0.46 4.80 4.81 -1.20 0.14 114.58 124.00 1fwt h GLU 1024Ca 0.43 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.57 1fwt h GLU 1024Cb 0.37 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1fwt h GLU 1024CO -0.19 0.24 -0.01 1.49 -0.73 0.00 0.00 179.01 179.81 1fwt h GLU 1025N 0.37 0.82 -0.54 1.92 4.57 -1.38 -1.44 114.58 118.89 1fwt h GLU 1025Ca 0.11 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 57.99 1fwt h GLU 1025Cb -0.01 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 1fwt h GLU 1025CO -0.05 0.87 0.19 0.82 -1.18 0.00 0.00 179.01 179.66 1fwt h ILE 1026N 0.66 1.21 -0.54 2.32 2.04 -0.84 -1.26 117.51 121.10 1fwt h ILE 1026Ca 0.13 -0.69 -0.05 0.00 1.00 0.00 0.00 64.86 65.25 1fwt h ILE 1026Cb 0.51 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1fwt h ILE 1026CO 0.02 0.27 0.14 0.50 0.00 0.00 0.00 178.15 179.08 1fwt h LYS 1027N 0.79 0.86 -0.68 2.37 1.63 -0.44 -0.76 116.57 120.35 1fwt h LYS 1027Ca 0.18 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1fwt h LYS 1027Cb 0.21 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.69 1fwt h LYS 1027CO -0.01 0.81 0.42 -0.09 -3.45 0.00 0.00 179.45 177.13 1fwt h ARG 1028N 0.76 0.91 -0.11 1.90 2.43 -0.53 -2.35 114.38 117.39 1fwt h ARG 1028Ca 0.17 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.16 1fwt h ARG 1028Cb 0.33 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1fwt h ARG 1028CO 0.00 0.63 -0.43 -0.07 -1.51 0.00 0.00 179.97 178.59 1fwt h LEU 1029N 0.92 0.26 -1.59 3.80 3.38 -0.99 -2.54 115.31 118.54 1fwt h LEU 1029Ca 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1fwt h LEU 1029Cb -0.06 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1fwt h LEU 1029CO -0.05 0.66 -0.20 0.77 0.09 0.00 0.00 178.44 179.71 1fwt h SER 1030N 0.20 0.00 0.85 -0.43 4.64 -0.63 0.61 113.55 118.79 1fwt h SER 1030Ca 0.02 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.12 1fwt h SER 1030Cb 0.85 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.92 1fwt h SER 1030CO 0.07 0.20 -1.01 -0.33 -0.87 0.00 0.00 176.83 174.90 1fwt h GLU 1031N 0.00 0.08 0.00 4.77 4.39 -1.06 -3.32 114.58 119.43 1fwt h GLU 1031Ca -0.00 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1fwt h GLU 1031Cb 0.49 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1fwt h GLU 1031CO 0.03 1.01 -0.06 -0.22 -1.16 0.00 0.00 179.01 178.61 1fwt h LYS 1032N 0.03 0.00 -4.21 2.33 3.64 -0.97 -3.38 116.57 114.00 1fwt h LYS 1032Ca -0.04 0.00 -0.74 0.00 -1.27 0.00 0.00 60.65 58.60 1fwt h LYS 1032Cb 1.73 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 33.39 1fwt h LYS 1032CO 0.14 0.47 1.71 1.19 -2.27 0.00 0.00 179.45 180.69 1fwt n PHE 1033N -4.69 4.03 0.32 1.91 3.01 0.20 -4.79 117.46 117.47 1fwt n PHE 1033Ca -0.06 -3.09 0.15 0.00 1.01 0.00 0.00 57.45 55.46 1fwt n PHE 1033Cb 0.24 -2.10 0.63 0.00 -0.01 0.00 0.00 39.48 38.25 1fwt n PHE 1033CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1fwt h LYS 1034N 6.50 0.00 -0.02 -1.08 1.57 -1.76 -2.06 116.57 119.71 1fwt h LYS 1034Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1fwt h LYS 1034Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1fwt h LYS 1034CO 1.43 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 179.46 1fwt n GLU 1035N -2.60 1.30 -4.68 3.15 0.00 -1.26 -4.80 120.64 111.76 1fwt n GLU 1035Ca 0.01 -0.44 -0.33 0.00 0.00 0.00 0.00 57.16 56.39 1fwt n GLU 1035Cb 0.22 -1.45 -0.12 0.00 0.00 0.00 0.00 31.44 30.09 1fwt n GLU 1035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1fwt s VAL 1036N -1.98 3.53 -0.37 3.84 1.01 -0.78 -3.36 120.40 122.31 1fwt s VAL 1036Ca 0.40 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.68 1fwt s VAL 1036Cb 0.20 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1fwt s VAL 1036CO 0.32 0.57 0.24 -0.70 0.00 0.00 0.00 175.10 175.54 1fwt s GLU 1037N -0.86 3.17 0.09 2.72 2.12 0.43 -4.97 118.70 121.40 1fwt s GLU 1037Ca 0.13 -0.86 -0.14 0.00 0.36 0.00 0.00 54.97 54.45 1fwt s GLU 1037Cb -0.11 -3.82 -0.06 0.00 0.26 0.00 0.00 34.13 30.40 1fwt s GLU 1037CO 0.02 -0.59 0.50 -0.06 -0.54 0.00 0.00 175.26 174.58 1fwt s PHE 1038N 1.66 3.66 -0.08 5.30 0.40 -1.26 -1.35 117.98 126.32 1fwt s PHE 1038Ca 0.05 1.03 -0.01 0.00 -0.60 0.00 0.00 56.93 57.40 1fwt s PHE 1038Cb -0.18 -2.33 0.03 0.00 0.51 0.00 0.00 43.02 41.04 1fwt s PHE 1038CO 0.09 0.52 -0.02 0.08 0.70 0.00 0.00 175.22 176.59 1fwt s VAL 1039N -1.32 0.53 -0.10 -0.44 1.01 -0.56 -4.06 120.40 115.47 1fwt s VAL 1039Ca 0.33 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 1fwt s VAL 1039Cb -0.16 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1fwt s VAL 1039CO 0.18 0.28 1.04 0.12 0.00 0.00 0.00 175.10 176.72 1fwt s PHE 1040N 1.87 3.46 -0.03 5.22 5.36 0.15 -1.58 117.98 132.43 1fwt s PHE 1040Ca 0.04 1.53 0.07 0.00 -0.96 0.00 0.00 56.93 57.61 1fwt s PHE 1040Cb -0.12 -3.23 -0.02 0.00 -0.34 0.00 0.00 43.02 39.31 1fwt s PHE 1040CO -0.06 -0.42 -0.25 0.21 -1.46 0.00 0.00 175.22 173.24 1fwt s LYS 1041N 2.04 2.19 -0.29 10.12 2.36 -0.43 -1.11 119.74 134.62 1fwt s LYS 1041Ca 0.50 -0.90 -0.16 0.00 -2.55 0.00 0.00 55.97 52.85 1fwt s LYS 1041Cb -0.19 -2.08 0.16 0.00 -1.05 0.00 0.00 37.83 34.66 1fwt s LYS 1041CO 0.19 0.55 1.03 0.45 1.55 0.00 0.00 175.35 179.12 1fwt s SER 1042N -0.59 -0.44 -0.04 1.43 0.15 -1.18 -3.12 113.70 109.92 1fwt s SER 1042Ca 0.09 0.68 -0.30 0.00 0.70 0.00 0.00 55.95 57.12 1fwt s SER 1042Cb -0.10 1.26 -0.03 0.00 -1.71 0.00 0.00 66.02 65.44 1fwt s SER 1042CO -0.00 -0.10 1.01 -0.44 1.20 0.00 0.00 173.24 174.90 1fwt s SER 1043N 1.53 7.29 0.14 5.45 0.01 -0.72 -4.63 113.70 122.77 1fwt s SER 1043Ca -0.07 1.64 0.25 0.00 1.31 0.00 0.00 55.95 59.08 1fwt s SER 1043Cb -0.04 -2.57 0.94 0.00 0.21 0.00 0.00 66.02 64.57 1fwt s SER 1043CO -0.15 -0.35 1.78 2.22 0.41 0.00 0.00 173.24 177.15 1fwt n PHE 1044N 4.35 0.57 -3.66 2.43 1.16 -1.26 -1.61 117.46 119.45 1fwt n PHE 1044Ca 0.07 0.18 -0.08 0.00 -1.87 0.00 0.00 57.45 55.75 1fwt n PHE 1044Cb 0.50 -0.79 -0.08 0.00 -1.61 0.00 0.00 39.48 37.49 1fwt n PHE 1044CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1fwt s ASP 1045N -3.92 -0.82 -0.97 5.98 2.15 -1.26 -3.98 116.67 113.84 1fwt s ASP 1045Ca 0.10 1.33 -0.13 0.00 0.43 0.00 0.00 52.55 54.29 1fwt s ASP 1045Cb 0.13 1.22 0.23 0.00 -0.30 0.00 0.00 42.92 44.21 1fwt s ASP 1045CO 0.51 -0.23 0.98 -0.54 -0.17 0.00 0.00 175.17 175.73 1fwt s LYS 1046N 1.60 3.86 0.00 4.34 -0.14 0.27 -4.87 119.74 124.81 1fwt s LYS 1046Ca -0.10 -2.68 0.31 0.00 -1.36 0.00 0.00 55.97 52.14 1fwt s LYS 1046Cb -0.06 -4.58 1.87 0.00 -1.68 0.00 0.00 37.83 33.38 1fwt s LYS 1046CO -0.18 -1.36 2.19 0.00 -0.76 0.00 0.00 175.35 175.25 1fwt n ALA 1047N 3.90 2.66 -2.04 5.17 0.00 -1.26 -3.90 120.51 125.05 1fwt n ALA 1047Ca 0.20 -0.20 0.05 0.00 0.00 0.00 0.00 53.44 53.50 1fwt n ALA 1047Cb 0.44 -1.51 0.12 0.00 0.00 0.00 0.00 19.45 18.50 1fwt n ALA 1047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1fwt n ASN 1048N -1.00 1.37 -4.63 0.00 2.04 -1.26 -5.09 115.26 106.69 1fwt n ASN 1048Ca 0.23 -2.98 -0.34 0.00 -0.44 0.00 0.00 54.58 51.05 1fwt n ASN 1048Cb 0.11 -0.42 0.11 0.00 -2.53 0.00 0.00 39.78 37.05 1fwt n ASN 1048CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1fwt n ARG 1049N -0.33 0.28 -0.08 -3.83 5.12 -1.25 -4.91 116.66 111.65 1fwt n ARG 1049Ca 0.13 0.16 -0.14 0.00 -1.93 0.00 0.00 57.85 56.07 1fwt n ARG 1049Cb 0.91 -2.28 -0.05 0.00 -1.16 0.00 0.00 32.46 29.88 1fwt n ARG 1049CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1fwt h SER 1050N -0.68 0.83 -3.20 0.55 0.02 -1.97 -3.45 113.55 105.65 1fwt h SER 1050Ca -0.46 -0.51 -0.67 0.00 -0.84 0.00 0.00 61.79 59.30 1fwt h SER 1050Cb 1.31 -0.24 -0.12 0.00 0.14 0.00 0.00 62.40 63.49 1fwt h SER 1050CO 0.45 1.18 -0.60 -0.55 -1.14 0.00 0.00 176.83 176.18 1fwt s SER 1051N -6.72 5.45 0.48 3.07 0.15 -1.20 -4.99 113.70 109.94 1fwt s SER 1051Ca -0.12 0.14 0.32 0.00 0.70 0.00 0.00 55.95 57.00 1fwt s SER 1051Cb 0.09 -1.54 1.50 0.00 -1.71 0.00 0.00 66.02 64.36 1fwt s SER 1051CO 0.85 0.33 1.97 -0.29 1.20 0.00 0.00 173.24 177.30 1fwt h ILE 1052N 3.70 0.00 -0.01 6.45 6.09 -1.92 -2.55 117.51 129.28 1fwt h ILE 1052Ca -0.50 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.72 1fwt h ILE 1052Cb 1.19 1.14 0.00 0.00 0.47 0.00 0.00 36.82 39.62 1fwt h ILE 1052CO 0.58 0.00 -0.31 1.41 -3.07 0.00 0.00 178.15 176.76 1fwt n HIS 1053N -2.79 0.00 -2.34 2.19 8.25 -1.26 -4.94 115.22 114.33 1fwt n HIS 1053Ca -0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 1fwt n HIS 1053Cb 0.20 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 1fwt n HIS 1053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1fwt s SER 1054N -2.58 6.56 0.29 0.41 0.01 -0.96 -5.00 113.70 112.43 1fwt s SER 1054Ca 0.22 1.53 -0.30 0.00 1.31 0.00 0.00 55.95 58.71 1fwt s SER 1054Cb 0.19 -2.49 -0.12 0.00 0.21 0.00 0.00 66.02 63.81 1fwt s SER 1054CO 0.55 -0.62 1.62 0.12 0.41 0.00 0.00 173.24 175.32 1fwt s PHE 1055N -2.69 2.74 -0.12 2.43 5.36 -1.26 -4.94 117.98 119.50 1fwt s PHE 1055Ca 0.58 0.71 -0.05 0.00 -0.96 0.00 0.00 56.93 57.21 1fwt s PHE 1055Cb -0.10 -4.10 -0.06 0.00 -0.34 0.00 0.00 43.02 38.42 1fwt s PHE 1055CO 0.35 -3.75 -0.15 0.54 -1.46 0.00 0.00 175.22 170.74 1fwt n ARG 1056N 2.36 0.26 -2.29 10.12 1.74 -1.26 -4.74 116.66 122.85 1fwt n ARG 1056Ca 0.09 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1fwt n ARG 1056Cb 0.37 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.82 1fwt n ARG 1056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fwt n GLY 1057N 2.35 -1.08 1.49 -0.13 0.00 -1.26 -0.56 105.19 106.00 1fwt n GLY 1057Ca -0.24 -1.58 0.05 0.00 0.00 0.00 0.00 46.02 44.26 1fwt n GLY 1057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fwt n HIS 1058N 0.58 1.66 0.00 1.61 8.25 -1.26 -5.04 115.22 121.03 1fwt n HIS 1058Ca 0.00 -0.89 0.00 0.00 -0.26 0.00 0.00 57.72 56.57 1fwt n HIS 1058Cb 0.00 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 30.65 1fwt n HIS 1058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fwt n GLY 1059N 0.01 0.88 0.24 -1.41 0.00 -1.26 -4.39 105.19 99.26 1fwt n GLY 1059Ca 0.27 -1.73 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 1fwt n GLY 1059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1fwt h LEU 1060N 0.00 -0.53 -0.24 0.99 7.12 -1.98 -1.68 115.31 118.99 1fwt h LEU 1060Ca 0.00 0.05 0.06 0.00 0.13 0.00 0.00 57.88 58.12 1fwt h LEU 1060Cb 0.00 0.18 -0.07 0.00 -0.53 0.00 0.00 40.66 40.23 1fwt h LEU 1060CO 0.00 -0.30 -0.33 -0.08 -0.13 0.00 0.00 178.44 177.60 1fwt h GLU 1061N -0.44 -0.33 -0.16 1.25 4.81 -1.97 -0.28 114.58 117.45 1fwt h GLU 1061Ca -0.01 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1fwt h GLU 1061Cb 0.41 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1fwt h GLU 1061CO -0.03 -0.22 0.06 -0.92 -0.73 0.00 0.00 179.01 177.17 1fwt h TYR 1062N -0.34 0.12 -0.21 0.92 3.20 -1.75 -2.20 116.97 116.71 1fwt h TYR 1062Ca 0.13 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.04 1fwt h TYR 1062Cb 0.55 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 1fwt h TYR 1062CO -0.47 0.06 -0.03 0.78 -1.64 0.00 0.00 178.16 176.87 1fwt h GLY 1063N 0.15 0.17 1.13 1.82 0.00 -0.74 0.34 103.07 105.94 1fwt h GLY 1063Ca 0.07 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1fwt h GLY 1063CO -0.06 -0.06 0.48 -2.08 0.00 0.00 0.00 176.54 174.82 1fwt h VAL 1064N 0.03 1.24 -0.44 4.60 2.07 -1.00 0.44 116.25 123.19 1fwt h VAL 1064Ca 0.10 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1fwt h VAL 1064Cb 0.14 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1fwt h VAL 1064CO -0.19 0.26 0.17 0.50 0.02 0.00 0.00 177.57 178.32 1fwt h LYS 1065N 1.16 0.66 -0.43 1.57 3.64 -0.82 0.36 116.57 122.71 1fwt h LYS 1065Ca 0.30 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1fwt h LYS 1065Cb -0.01 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1fwt h LYS 1065CO -0.05 0.62 0.04 0.00 -2.27 0.00 0.00 179.45 177.78 1fwt h ALA 1066N 1.01 0.57 -0.72 5.00 0.00 -0.39 -1.97 119.26 122.76 1fwt h ALA 1066Ca 0.14 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1fwt h ALA 1066Cb 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1fwt h ALA 1066CO -0.01 0.33 0.24 -0.07 0.00 0.00 0.00 179.25 179.74 1fwt h LEU 1067N 0.58 1.03 -1.29 0.00 3.38 -0.77 -2.25 115.31 115.99 1fwt h LEU 1067Ca 0.13 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1fwt h LEU 1067Cb 0.43 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1fwt h LEU 1067CO 0.02 0.94 0.11 -0.09 0.09 0.00 0.00 178.44 179.50 1fwt h ARG 1068N 1.07 0.59 -0.65 1.13 2.43 -0.69 -1.56 114.38 116.69 1fwt h ARG 1068Ca 0.24 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 59.25 1fwt h ARG 1068Cb 0.27 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1fwt h ARG 1068CO -0.01 0.54 0.17 -0.22 -1.51 0.00 0.00 179.97 178.93 1fwt h LYS 1069N 0.58 1.03 -0.19 0.20 1.63 -0.79 0.47 116.57 119.51 1fwt h LYS 1069Ca 0.14 -0.24 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1fwt h LYS 1069Cb 0.21 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.69 1fwt h LYS 1069CO -0.01 0.92 0.09 0.28 -3.45 0.00 0.00 179.45 177.29 1fwt h VAL 1070N 0.96 1.14 -0.63 2.00 2.07 -0.92 0.22 116.25 121.09 1fwt h VAL 1070Ca 0.21 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1fwt h VAL 1070Cb 0.35 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 1fwt h VAL 1070CO 0.00 0.13 0.32 0.50 0.02 0.00 0.00 177.57 178.55 1fwt h LYS 1071N 0.17 0.90 -0.30 1.57 3.64 -1.08 0.05 116.57 121.52 1fwt h LYS 1071Ca 0.06 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1fwt h LYS 1071Cb 0.13 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1fwt h LYS 1071CO -0.01 0.70 -0.04 1.49 -2.27 0.00 0.00 179.45 179.32 1fwt h GLU 1072N 0.87 0.56 0.03 1.90 4.81 -0.73 0.32 114.58 122.33 1fwt h GLU 1072Ca 0.22 -0.20 -0.22 0.00 -0.13 0.00 0.00 59.36 59.03 1fwt h GLU 1072Cb 0.08 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1fwt h GLU 1072CO -0.03 0.73 -0.97 1.49 -0.73 0.00 0.00 179.01 179.50 1fwt h GLU 1073N 0.33 0.25 -0.00 1.92 4.81 -0.45 -3.37 114.58 118.07 1fwt h GLU 1073Ca 0.08 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 1fwt h GLU 1073Cb 0.51 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.98 1fwt h GLU 1073CO 0.02 1.05 -0.22 1.19 -0.73 0.00 0.00 179.01 180.32 1fwt n PHE 1074N -3.64 0.00 -2.72 0.92 3.72 -0.00 -5.01 117.46 110.73 1fwt n PHE 1074Ca -0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.19 1fwt n PHE 1074Cb 0.86 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.43 1fwt n PHE 1074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fwt n GLY 1075N 1.00 -0.21 3.91 1.37 0.00 0.11 -4.98 105.19 106.39 1fwt n GLY 1075Ca 0.01 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1fwt n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fwt s LEU 1076N -4.91 4.36 0.66 0.99 1.43 -1.24 -5.04 118.68 114.92 1fwt s LEU 1076Ca 0.18 0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 53.47 1fwt s LEU 1076Cb -0.08 -2.87 -0.00 0.00 0.03 0.00 0.00 46.19 43.27 1fwt s LEU 1076CO 0.23 0.19 1.08 -0.54 0.23 0.00 0.00 176.35 177.54 1fwt s LYS 1077N -2.33 2.93 0.05 1.70 1.02 -1.26 -4.41 119.74 117.45 1fwt s LYS 1077Ca 0.33 1.19 0.07 0.00 0.02 0.00 0.00 55.97 57.57 1fwt s LYS 1077Cb -0.13 -1.98 -0.03 0.00 -0.52 0.00 0.00 37.83 35.18 1fwt s LYS 1077CO 0.25 -1.12 -0.19 0.42 -0.92 0.00 0.00 175.35 173.79 1fwt s ILE 1078N -2.63 1.49 -0.05 2.17 -1.09 -1.26 -0.68 121.20 119.16 1fwt s ILE 1078Ca 0.63 -1.20 -0.04 0.00 -2.23 0.00 0.00 60.65 57.80 1fwt s ILE 1078Cb -0.17 -1.33 0.01 0.00 -1.58 0.00 0.00 42.46 39.40 1fwt s ILE 1078CO 0.45 0.09 0.13 0.28 -1.23 0.00 0.00 174.94 174.66 1fwt s THR 1079N -0.89 -0.00 0.11 2.92 -1.32 -0.27 0.36 115.64 116.56 1fwt s THR 1079Ca 0.05 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.39 1fwt s THR 1079Cb -0.09 -0.19 0.03 0.00 -1.51 0.00 0.00 72.50 70.74 1fwt s THR 1079CO 0.02 0.00 0.36 0.28 -2.21 0.00 0.00 174.62 173.07 1fwt s THR 1080N 0.07 0.08 0.09 5.08 -1.32 -1.22 -3.07 115.64 115.36 1fwt s THR 1080Ca -0.00 -0.69 -0.01 0.00 -1.21 0.00 0.00 61.69 59.78 1fwt s THR 1080Cb -0.01 -1.19 -0.04 0.00 -1.51 0.00 0.00 72.50 69.75 1fwt s THR 1080CO 0.00 -0.38 0.26 1.51 -2.21 0.00 0.00 174.62 173.80 1fwt s ASP 1081N -2.78 6.39 0.19 8.08 -4.77 -1.26 -1.33 116.67 121.19 1fwt s ASP 1081Ca 0.03 0.34 0.08 0.00 -3.30 0.00 0.00 52.55 49.70 1fwt s ASP 1081Cb 0.02 -1.99 -0.04 0.00 -1.09 0.00 0.00 42.92 39.83 1fwt s ASP 1081CO -0.11 0.13 -0.04 0.27 0.70 0.00 0.00 175.17 176.11 1fwt s ILE 1082N -1.57 3.44 0.00 2.11 -4.36 -0.87 -4.77 121.20 115.18 1fwt s ILE 1082Ca 0.36 -1.61 0.00 0.00 -0.26 0.00 0.00 60.65 59.15 1fwt s ILE 1082Cb -0.13 -2.73 0.00 0.00 1.25 0.00 0.00 42.46 40.85 1fwt s ILE 1082CO 0.27 -0.15 0.00 1.41 0.24 0.00 0.00 174.94 176.71 1fwt n HIS 1083N -0.17 0.00 -3.97 1.37 8.25 -1.26 -4.34 115.22 115.10 1fwt n HIS 1083Ca -0.10 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.27 1fwt n HIS 1083Cb 0.56 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.56 1fwt n HIS 1083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1fwt s GLU 1084N -1.93 0.41 0.29 -0.41 2.02 -1.26 -5.07 118.70 112.75 1fwt s GLU 1084Ca 0.00 -0.67 0.05 0.00 0.02 0.00 0.00 54.97 54.37 1fwt s GLU 1084Cb 0.00 0.15 0.75 0.00 0.10 0.00 0.00 34.13 35.13 1fwt s GLU 1084CO 0.00 -0.08 1.70 0.77 0.02 0.00 0.00 175.26 177.67 1fwt h SER 1085N 4.29 0.39 0.20 -0.19 0.02 -1.91 -1.61 113.55 114.75 1fwt h SER 1085Ca -0.32 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1fwt h SER 1085Cb 1.20 0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1fwt h SER 1085CO 0.45 0.02 0.00 4.11 -1.14 0.00 0.00 176.83 180.27 1fwt h TRP 1086N 0.43 0.00 0.00 3.45 5.08 -1.97 -2.55 115.95 120.40 1fwt h TRP 1086Ca 0.57 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.54 1fwt h TRP 1086Cb 1.08 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.24 1fwt h TRP 1086CO -0.11 0.00 -0.13 1.96 -1.28 0.00 0.00 178.44 178.88 1fwt h GLN 1087N 0.00 0.00 -0.34 0.12 4.20 -1.72 -3.36 115.11 114.01 1fwt h GLN 1087Ca 0.00 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 1fwt h GLN 1087Cb 0.10 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 1fwt h GLN 1087CO 0.00 0.00 0.12 0.00 -0.67 0.00 0.00 178.83 178.28 1fwt h ALA 1088N 2.21 0.39 0.76 3.87 0.00 -1.60 -1.79 119.26 123.09 1fwt h ALA 1088Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1fwt h ALA 1088Cb 0.90 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.71 1fwt h ALA 1088CO 0.00 -0.27 -0.36 1.49 0.00 0.00 0.00 179.25 180.10 1fwt h GLU 1089N 0.27 -0.98 -0.73 0.00 4.81 -1.79 0.03 114.58 116.18 1fwt h GLU 1089Ca 0.15 0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1fwt h GLU 1089Cb 0.12 0.22 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1fwt h GLU 1089CO -0.15 -0.64 0.43 -1.00 -0.73 0.00 0.00 179.01 176.91 1fwt h PRO 1090N -1.09 1.00 -0.48 0.92 0.13 -1.76 -2.57 132.00 128.15 1fwt h PRO 1090Ca -0.10 -0.09 -0.10 0.00 -0.87 0.00 0.00 66.00 64.83 1fwt h PRO 1090Cb 0.80 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 1fwt h PRO 1090CO 0.17 0.71 -0.10 0.28 -0.23 0.00 0.00 178.00 178.83 1fwt h VAL 1091N 1.01 1.26 0.00 1.56 2.07 -1.28 -2.69 116.25 118.18 1fwt h VAL 1091Ca 0.26 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1fwt h VAL 1091Cb -0.02 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1fwt h VAL 1091CO -0.05 0.42 0.03 0.00 0.02 0.00 0.00 177.57 177.99 1fwt h ALA 1092N 1.09 1.03 0.00 1.67 0.00 -0.56 -0.34 119.26 122.15 1fwt h ALA 1092Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1fwt h ALA 1092Cb 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1fwt h ALA 1092CO 0.04 -0.03 -0.08 0.93 0.00 0.00 0.00 179.25 180.11 1fwt h GLU 1093N 0.00 0.00 0.00 0.00 5.08 -1.46 -3.35 114.58 114.85 1fwt h GLU 1093Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1fwt h GLU 1093Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1fwt h GLU 1093CO 0.00 0.08 -0.86 1.55 -1.00 0.00 0.00 179.01 178.78 1fwt n VAL 1094N -3.27 0.00 -2.56 3.13 3.14 -0.50 -5.04 118.33 113.23 1fwt n VAL 1094Ca -0.00 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.95 1fwt n VAL 1094Cb 0.31 -0.68 -0.03 0.00 -1.06 0.00 0.00 33.84 32.38 1fwt n VAL 1094CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1fwt s ALA 1095N -1.86 3.47 0.12 1.55 0.00 -0.26 -4.53 121.76 120.24 1fwt s ALA 1095Ca 0.00 0.49 0.06 0.00 0.00 0.00 0.00 51.96 52.52 1fwt s ALA 1095Cb 0.00 -3.49 -0.20 0.00 0.00 0.00 0.00 23.12 19.44 1fwt s ALA 1095CO 0.00 -0.72 1.28 -0.44 0.00 0.00 0.00 175.76 175.88 1fwt h ASP 1096N 7.32 0.03 -3.22 0.00 3.32 -0.42 -3.43 116.42 120.02 1fwt h ASP 1096Ca -0.32 -0.03 -0.53 0.00 0.02 0.00 0.00 57.03 56.17 1fwt h ASP 1096Cb 1.15 -0.01 -0.36 0.00 0.22 0.00 0.00 39.33 40.33 1fwt h ASP 1096CO 0.88 1.01 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.97 1fwt s ILE 1097N -2.73 1.08 -0.19 0.35 1.01 -0.89 -2.32 121.20 117.51 1fwt s ILE 1097Ca 0.01 -0.34 -0.17 0.00 0.00 0.00 0.00 60.65 60.14 1fwt s ILE 1097Cb 0.10 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 1fwt s ILE 1097CO 0.82 0.37 0.46 -0.63 0.00 0.00 0.00 174.94 175.96 1fwt s ILE 1098N 1.51 5.16 -0.10 2.92 1.01 0.42 -3.37 121.20 128.75 1fwt s ILE 1098Ca 0.02 0.85 -0.13 0.00 0.00 0.00 0.00 60.65 61.38 1fwt s ILE 1098Cb -0.13 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 1fwt s ILE 1098CO -0.06 0.23 0.31 -1.58 0.00 0.00 0.00 174.94 173.83 1fwt s GLN 1099N 1.35 3.97 -0.26 2.79 0.74 -0.44 -1.07 119.66 126.75 1fwt s GLN 1099Ca 0.22 0.17 -0.08 0.00 0.05 0.00 0.00 55.36 55.73 1fwt s GLN 1099Cb -0.15 -3.31 -0.03 0.00 1.10 0.00 0.00 33.01 30.63 1fwt s GLN 1099CO 0.09 0.50 0.08 0.42 -0.55 0.00 0.00 175.29 175.83 1fwt s ILE 1100N -0.37 4.35 0.63 -2.34 -1.09 0.33 -2.04 121.20 120.66 1fwt s ILE 1100Ca 0.19 -0.20 -0.18 0.00 -2.23 0.00 0.00 60.65 58.23 1fwt s ILE 1100Cb -0.14 -3.06 -0.03 0.00 -1.58 0.00 0.00 42.46 37.65 1fwt s ILE 1100CO 0.07 0.30 0.98 -2.65 -1.23 0.00 0.00 174.94 172.42 1fwt n PRO 1101N 4.93 0.82 -0.14 2.79 -0.02 -1.26 -1.62 135.00 140.50 1fwt n PRO 1101Ca -0.16 0.33 -0.05 0.00 -2.02 0.00 0.00 63.50 61.60 1fwt n PRO 1101Cb 0.51 -2.20 0.04 0.00 -0.02 0.00 0.00 33.50 31.83 1fwt n PRO 1101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fwt h ALA 1102N 0.31 0.53 0.00 3.55 0.00 -1.89 -1.57 119.26 120.19 1fwt h ALA 1102Ca -0.49 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1fwt h ALA 1102Cb 1.36 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1fwt h ALA 1102CO 0.50 -0.22 -0.08 0.74 0.00 0.00 0.00 179.25 180.19 1fwt h PHE 1103N 0.34 0.00 -0.54 0.00 0.04 -1.91 -2.85 116.94 112.02 1fwt h PHE 1103Ca 0.20 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.97 1fwt h PHE 1103Cb 0.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1fwt h PHE 1103CO -0.14 0.08 0.00 1.28 -0.60 0.00 0.00 178.31 178.93 1fwt n LEU 1104N -3.50 4.52 0.00 1.54 4.77 -0.63 -4.60 117.00 119.11 1fwt n LEU 1104Ca -0.02 -2.54 0.04 0.00 -0.03 0.00 0.00 56.01 53.46 1fwt n LEU 1104Cb 0.21 -0.54 0.17 0.00 -2.33 0.00 0.00 43.42 40.92 1fwt n LEU 1104CO 0.28 0.76 0.62 0.00 -1.33 0.00 0.00 177.39 177.73 1fwt n ARG 1106N -1.51 0.63 -2.43 0.00 1.74 -1.26 -4.92 116.66 108.91 1fwt n ARG 1106Ca 0.02 -1.20 -0.39 0.00 -0.77 0.00 0.00 57.85 55.51 1fwt n ARG 1106Cb 0.09 -1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 1fwt n ARG 1106CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1fwt s GLN 1107N -0.93 3.15 0.24 5.56 -1.52 -0.83 -4.89 119.66 120.43 1fwt s GLN 1107Ca 0.13 -0.32 -0.09 0.00 -1.95 0.00 0.00 55.36 53.13 1fwt s GLN 1107Cb 0.09 -4.57 0.37 0.00 -0.22 0.00 0.00 33.01 28.68 1fwt s GLN 1107CO 0.14 -2.36 1.63 1.15 -0.25 0.00 0.00 175.29 175.60 1fwt h THR 1108N 6.46 0.32 -0.11 -0.19 2.02 -1.91 -1.77 112.91 117.72 1fwt h THR 1108Ca -0.13 -0.02 -0.07 0.00 0.77 0.00 0.00 66.41 66.97 1fwt h THR 1108Cb 1.05 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1fwt h THR 1108CO 1.30 0.01 -0.23 0.44 0.37 0.00 0.00 175.52 177.41 1fwt h ASP 1109N 0.06 0.19 -0.22 4.18 3.32 -1.99 -1.08 116.42 120.88 1fwt h ASP 1109Ca 0.38 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.30 1fwt h ASP 1109Cb 0.64 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 1fwt h ASP 1109CO -0.69 0.43 -0.19 0.25 -1.72 0.00 0.00 179.24 177.32 1fwt h LEU 1110N 0.18 0.55 -0.44 1.55 5.85 -1.71 -0.36 115.31 120.93 1fwt h LEU 1110Ca 0.03 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 1fwt h LEU 1110Cb 0.51 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1fwt h LEU 1110CO 0.04 0.90 0.25 -0.07 -0.34 0.00 0.00 178.44 179.21 1fwt h LEU 1111N 0.22 0.55 -0.58 2.25 3.38 -1.28 -1.82 115.31 118.03 1fwt h LEU 1111Ca 0.04 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1fwt h LEU 1111Cb 0.73 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1fwt h LEU 1111CO 0.05 0.48 0.25 -0.07 0.09 0.00 0.00 178.44 179.23 1fwt h LEU 1112N 0.58 0.79 -0.94 1.67 4.07 -1.14 -0.34 115.31 120.00 1fwt h LEU 1112Ca 0.16 -0.16 0.01 0.00 0.08 0.00 0.00 57.88 57.97 1fwt h LEU 1112Cb 0.04 -0.20 -0.05 0.00 1.08 0.00 0.00 40.66 41.53 1fwt h LEU 1112CO -0.03 0.73 0.62 0.00 -1.08 0.00 0.00 178.44 178.68 1fwt h ALA 1113N 1.09 1.20 -0.20 1.53 0.00 -0.83 -2.05 119.26 120.00 1fwt h ALA 1113Ca 0.20 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1fwt h ALA 1113Cb 0.18 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1fwt h ALA 1113CO -0.02 0.60 -0.16 0.00 0.00 0.00 0.00 179.25 179.68 1fwt h ALA 1114N 1.34 0.29 -0.84 0.00 0.00 -1.02 -3.29 119.26 115.73 1fwt h ALA 1114Ca 0.34 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1fwt h ALA 1114Cb -0.13 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 1fwt h ALA 1114CO -0.07 0.18 0.53 0.00 0.00 0.00 0.00 179.25 179.89 1fwt h ALA 1115N 0.66 1.12 0.00 0.00 0.00 -0.75 -2.60 119.26 117.70 1fwt h ALA 1115Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1fwt h ALA 1115Cb 0.68 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1fwt h ALA 1115CO 0.04 0.34 0.00 0.36 0.00 0.00 0.00 179.25 179.99 1fwt n LYS 1116N -4.59 0.19 0.21 0.00 2.85 -0.80 -2.77 118.16 113.25 1fwt n LYS 1116Ca 0.11 0.13 0.14 0.00 -1.05 0.00 0.00 58.31 57.63 1fwt n LYS 1116Cb 0.12 -1.50 0.41 0.00 -0.65 0.00 0.00 35.03 33.41 1fwt n LYS 1116CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1fwt h THR 1117N 0.00 0.00 0.00 0.58 1.35 -1.56 -3.47 112.91 109.82 1fwt h THR 1117Ca 0.00 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1fwt h THR 1117Cb 0.23 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 1fwt h THR 1117CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1fwt n GLY 1118N 0.67 1.32 3.90 5.82 0.00 -1.11 -5.04 105.19 110.74 1fwt n GLY 1118Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1fwt n GLY 1118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fwt s ARG 1119N -0.40 3.05 0.58 1.61 1.81 -1.26 -4.91 118.95 119.43 1fwt s ARG 1119Ca 0.00 0.28 -0.17 0.00 -1.72 0.00 0.00 55.73 54.12 1fwt s ARG 1119Cb 0.00 -2.17 -0.04 0.00 -0.45 0.00 0.00 34.95 32.29 1fwt s ARG 1119CO 0.00 -0.75 1.09 0.00 -0.68 0.00 0.00 175.30 174.96 1fwt s ALA 1120N -3.12 2.68 -0.06 2.13 0.00 -0.98 -4.76 121.76 117.65 1fwt s ALA 1120Ca 0.55 0.58 0.03 0.00 0.00 0.00 0.00 51.96 53.12 1fwt s ALA 1120Cb -0.11 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1fwt s ALA 1120CO 0.49 -0.84 -0.14 0.08 0.00 0.00 0.00 175.76 175.34 1fwt s VAL 1121N -2.17 1.28 -0.19 0.00 1.01 -0.48 -0.44 120.40 119.41 1fwt s VAL 1121Ca 0.67 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.08 1fwt s VAL 1121Cb -0.19 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1fwt s VAL 1121CO 0.33 0.38 -0.17 0.21 0.00 0.00 0.00 175.10 175.85 1fwt s ASN 1122N 0.47 3.41 -0.22 3.32 2.47 -0.23 -0.84 114.94 123.32 1fwt s ASN 1122Ca -0.12 -0.63 -0.07 0.00 0.42 0.00 0.00 52.86 52.45 1fwt s ASN 1122Cb -0.15 -1.53 -0.03 0.00 -1.45 0.00 0.00 41.25 38.09 1fwt s ASN 1122CO 0.04 -0.01 0.06 -0.69 -3.72 0.00 0.00 177.10 172.77 1fwt s VAL 1123N 1.32 4.42 -0.03 -5.21 1.01 -0.08 -0.52 120.40 121.31 1fwt s VAL 1123Ca 0.05 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 1fwt s VAL 1123Cb -0.14 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1fwt s VAL 1123CO -0.11 0.39 1.22 -0.54 0.00 0.00 0.00 175.10 176.06 1fwt s LYS 1124N 1.14 4.36 0.00 2.72 -0.14 -0.64 -0.52 119.74 126.66 1fwt s LYS 1124Ca 0.04 1.72 -0.30 0.00 -1.36 0.00 0.00 55.97 56.07 1fwt s LYS 1124Cb -0.14 -3.52 -0.06 0.00 -1.68 0.00 0.00 37.83 32.43 1fwt s LYS 1124CO 0.03 -0.42 1.47 0.21 -0.76 0.00 0.00 175.35 175.87 1fwt s LYS 1125N 2.02 4.25 0.50 1.68 2.20 0.05 -4.06 119.74 126.39 1fwt s LYS 1125Ca 0.57 2.05 -0.23 0.00 -0.36 0.00 0.00 55.97 58.00 1fwt s LYS 1125Cb -0.26 -3.62 -0.07 0.00 -1.51 0.00 0.00 37.83 32.37 1fwt s LYS 1125CO 0.24 -0.64 1.23 0.41 -0.36 0.00 0.00 175.35 176.23 1fwt n GLY 1126N 3.76 0.41 0.08 5.54 0.00 -1.24 -4.60 105.19 109.13 1fwt n GLY 1126Ca 0.14 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.29 1fwt n GLY 1126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fwt n GLN 1127N -0.55 0.09 0.00 1.61 3.00 -1.26 -1.40 117.38 118.87 1fwt n GLN 1127Ca 0.10 0.49 0.09 0.00 -0.01 0.00 0.00 57.00 57.67 1fwt n GLN 1127Cb 0.43 -1.73 -0.10 0.00 0.00 0.00 0.00 30.24 28.84 1fwt n GLN 1127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1fwt n PHE 1128N -1.90 0.00 -3.24 1.08 -1.74 -1.26 -1.53 117.46 108.87 1fwt n PHE 1128Ca 0.01 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.51 1fwt n PHE 1128Cb 0.09 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.03 1fwt n PHE 1128CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1fwt s LEU 1129N -2.86 4.51 0.38 5.98 2.96 -0.49 -5.06 118.68 124.10 1fwt s LEU 1129Ca 0.09 1.29 -0.12 0.00 -0.22 0.00 0.00 54.13 55.17 1fwt s LEU 1129Cb 0.15 -3.01 -0.07 0.00 0.50 0.00 0.00 46.19 43.76 1fwt s LEU 1129CO 0.78 0.24 0.77 0.00 -1.32 0.00 0.00 176.35 176.81 1fwt s ALA 1130N -1.17 3.33 0.23 5.97 0.00 -1.26 -4.88 121.76 123.98 1fwt s ALA 1130Ca 0.31 -0.10 -0.06 0.00 0.00 0.00 0.00 51.96 52.11 1fwt s ALA 1130Cb -0.19 -2.74 0.39 0.00 0.00 0.00 0.00 23.12 20.57 1fwt s ALA 1130CO 0.20 0.10 1.74 -1.35 0.00 0.00 0.00 175.76 176.46 1fwt h PRO 1131N 1.60 0.46 0.00 0.00 0.11 -1.98 -0.96 132.00 131.23 1fwt h PRO 1131Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1fwt h PRO 1131Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fwt h PRO 1131CO 0.64 0.30 0.00 0.11 -0.21 0.00 0.00 178.00 178.85 1fwt h TRP 1132N 0.47 0.00 0.00 0.65 0.09 -1.94 -2.69 115.95 112.54 1fwt h TRP 1132Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.36 1fwt h TRP 1132Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.75 1fwt h TRP 1132CO -0.15 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.13 1fwt n ASP 1133N -2.51 0.00 0.06 0.11 8.00 -0.37 -3.01 116.55 118.83 1fwt n ASP 1133Ca 0.02 0.34 0.13 0.00 0.71 0.00 0.00 54.79 55.99 1fwt n ASP 1133Cb 0.26 -0.44 0.49 0.00 -0.02 0.00 0.00 41.12 41.41 1fwt n ASP 1133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1fwt n THR 1134N -1.44 0.41 -0.21 -3.53 -2.24 -1.02 -3.51 114.28 102.75 1fwt n THR 1134Ca 0.07 -0.09 -0.05 0.00 -2.27 0.00 0.00 64.05 61.72 1fwt n THR 1134Cb 0.24 -0.63 0.05 0.00 -2.10 0.00 0.00 70.33 67.89 1fwt n THR 1134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1fwt h LYS 1135N 0.00 0.73 0.00 -0.78 3.64 -1.76 -1.60 116.57 116.81 1fwt h LYS 1135Ca 0.00 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1fwt h LYS 1135Cb 0.57 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1fwt h LYS 1135CO 0.00 0.49 -0.31 -0.91 -2.27 0.00 0.00 179.45 176.45 1fwt h ASN 1136N 0.76 0.00 -0.31 4.20 2.35 -1.82 -1.13 115.58 119.63 1fwt h ASN 1136Ca 0.24 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.93 1fwt h ASN 1136Cb -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1fwt h ASN 1136CO -0.09 0.31 -0.06 0.58 -1.65 0.00 0.00 177.43 176.52 1fwt h VAL 1137N 0.00 1.28 -0.50 2.81 2.07 -1.47 -1.43 116.25 119.00 1fwt h VAL 1137Ca -0.00 -1.09 -0.11 0.00 0.82 0.00 0.00 66.70 66.32 1fwt h VAL 1137Cb 0.71 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1fwt h VAL 1137CO 0.04 0.35 -0.11 0.58 0.02 0.00 0.00 177.57 178.45 1fwt h VAL 1138N 0.37 1.26 -0.58 2.57 2.07 -1.09 -2.47 116.25 118.38 1fwt h VAL 1138Ca 0.08 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.39 1fwt h VAL 1138Cb 0.54 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1fwt h VAL 1138CO 0.03 0.43 0.36 -0.08 0.02 0.00 0.00 177.57 178.33 1fwt h GLU 1139N 0.83 0.70 -0.39 1.57 4.81 -1.00 0.17 114.58 121.27 1fwt h GLU 1139Ca 0.13 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1fwt h GLU 1139Cb 0.64 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1fwt h GLU 1139CO 0.04 0.46 0.23 0.87 -0.73 0.00 0.00 179.01 179.89 1fwt h LYS 1140N 0.72 0.46 -0.41 1.92 1.57 -1.05 -0.16 116.57 119.62 1fwt h LYS 1140Ca 0.23 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1fwt h LYS 1140Cb -0.00 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1fwt h LYS 1140CO -0.09 0.31 0.24 -0.07 -0.57 0.00 0.00 179.45 179.26 1fwt h LEU 1141N 0.48 0.51 -0.84 2.94 3.38 -0.95 -0.00 115.31 120.82 1fwt h LEU 1141Ca 0.15 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1fwt h LEU 1141Cb -0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1fwt h LEU 1141CO -0.06 0.44 0.39 0.11 0.09 0.00 0.00 178.44 179.40 1fwt h LYS 1142N 0.54 1.22 -0.63 1.13 1.57 -0.75 -0.54 116.57 119.12 1fwt h LYS 1142Ca 0.15 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1fwt h LYS 1142Cb 0.03 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 1fwt h LYS 1142CO -0.03 0.95 0.40 0.35 -0.57 0.00 0.00 179.45 180.56 1fwt h PHE 1143N 1.21 0.80 -0.07 -1.35 3.57 -0.58 -1.69 116.94 118.83 1fwt h PHE 1143Ca 0.29 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1fwt h PHE 1143Cb 0.14 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.61 1fwt h PHE 1143CO 0.02 0.52 0.00 0.41 -2.23 0.00 0.00 178.31 177.02 1fwt n GLY 1144N -1.40 -0.46 0.35 2.40 0.00 -0.05 -4.91 105.19 101.11 1fwt n GLY 1144Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1fwt n GLY 1144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwt n GLY 1145N 0.93 0.69 3.71 -0.02 0.00 -0.63 -3.06 105.19 106.81 1fwt n GLY 1145Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1fwt n GLY 1145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwt s ALA 1146N -2.17 3.48 -0.02 4.61 0.00 -0.32 -4.86 121.76 122.47 1fwt s ALA 1146Ca 0.00 0.97 0.16 0.00 0.00 0.00 0.00 51.96 53.09 1fwt s ALA 1146Cb 0.00 -3.48 -0.25 0.00 0.00 0.00 0.00 23.12 19.39 1fwt s ALA 1146CO 0.00 -0.51 0.34 1.63 0.00 0.00 0.00 175.76 177.22 1fwt n LYS 1147N 3.92 0.50 -3.90 0.00 5.02 -1.26 -4.38 118.16 118.06 1fwt n LYS 1147Ca 0.10 -0.14 -0.30 0.00 -2.02 0.00 0.00 58.31 55.95 1fwt n LYS 1147Cb 0.45 -1.38 -0.16 0.00 -0.02 0.00 0.00 35.03 33.92 1fwt n LYS 1147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1fwt s GLU 1148N -3.09 1.42 -0.03 1.97 2.12 -1.26 -5.11 118.70 114.72 1fwt s GLU 1148Ca -0.06 -0.89 0.07 0.00 0.36 0.00 0.00 54.97 54.45 1fwt s GLU 1148Cb 0.10 -2.50 -0.02 0.00 0.26 0.00 0.00 34.13 31.98 1fwt s GLU 1148CO 0.66 -0.61 -0.23 0.42 -0.54 0.00 0.00 175.26 174.95 1fwt s ILE 1149N 1.48 1.84 0.07 -3.70 1.01 -1.26 -1.38 121.20 119.26 1fwt s ILE 1149Ca -0.05 -0.99 0.06 0.00 0.00 0.00 0.00 60.65 59.68 1fwt s ILE 1149Cb -0.19 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 1fwt s ILE 1149CO -0.07 0.52 -0.18 -0.31 0.00 0.00 0.00 174.94 174.91 1fwt s TYR 1150N -0.45 1.53 -0.12 3.97 1.51 -0.02 -2.92 117.35 120.86 1fwt s TYR 1150Ca 0.06 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.75 1fwt s TYR 1150Cb -0.10 -0.88 0.01 0.00 -0.11 0.00 0.00 41.96 40.88 1fwt s TYR 1150CO 0.00 0.10 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.82 1fwt s LEU 1151N -1.50 2.03 -0.20 -1.29 1.43 -0.32 -0.90 118.68 117.93 1fwt s LEU 1151Ca 0.04 -0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 52.53 1fwt s LEU 1151Cb -0.09 -1.36 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 1fwt s LEU 1151CO 0.02 0.10 0.01 -0.89 0.23 0.00 0.00 176.35 175.82 1fwt s THR 1152N 0.67 4.05 -0.20 5.49 2.01 0.32 -1.05 115.64 126.94 1fwt s THR 1152Ca -0.11 -0.28 -0.27 0.00 0.31 0.00 0.00 61.69 61.34 1fwt s THR 1152Cb -0.16 -2.83 -0.00 0.00 0.01 0.00 0.00 72.50 69.51 1fwt s THR 1152CO 0.02 0.43 0.94 -0.70 -0.69 0.00 0.00 174.62 174.61 1fwt s GLU 1153N 0.95 4.28 -0.04 4.92 2.56 0.41 -0.77 118.70 131.01 1fwt s GLU 1153Ca 0.02 1.19 0.16 0.00 0.00 0.00 0.00 54.97 56.33 1fwt s GLU 1153Cb -0.14 -3.61 0.29 0.00 2.00 0.00 0.00 34.13 32.67 1fwt s GLU 1153CO 0.02 -0.47 1.13 2.89 -0.56 0.00 0.00 175.26 178.26 1fwt n ARG 1154N 5.74 0.35 0.00 4.30 -4.01 -1.26 -0.77 116.66 121.01 1fwt n ARG 1154Ca 0.08 -1.96 0.00 0.00 -1.04 0.00 0.00 57.85 54.93 1fwt n ARG 1154Cb 0.47 -0.52 0.00 0.00 -3.04 0.00 0.00 32.46 29.37 1fwt n ARG 1154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1fwt n GLY 1155N -0.06 1.38 3.14 2.89 0.00 -1.26 -3.79 105.19 107.48 1fwt n GLY 1155Ca 0.07 -1.82 -0.19 0.00 0.00 0.00 0.00 46.02 44.07 1fwt n GLY 1155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fwt s THR 1156N -2.97 1.06 0.04 2.61 2.01 0.01 -4.38 115.64 114.03 1fwt s THR 1156Ca 0.00 -1.01 -0.34 0.00 0.31 0.00 0.00 61.69 60.65 1fwt s THR 1156Cb 0.00 -0.98 -0.13 0.00 0.01 0.00 0.00 72.50 71.40 1fwt s THR 1156CO 0.00 -0.03 1.71 0.41 -0.69 0.00 0.00 174.62 176.02 1fwt n THR 1157N 1.85 0.26 -3.58 -0.82 -1.04 -0.58 -1.34 114.28 109.03 1fwt n THR 1157Ca -0.18 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.49 1fwt n THR 1157Cb 0.55 -1.66 -0.12 0.00 -1.82 0.00 0.00 70.33 67.27 1fwt n THR 1157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1fwt s PHE 1158N 2.33 1.35 0.00 -1.42 5.36 -0.69 -4.83 117.98 120.07 1fwt s PHE 1158Ca 0.85 -2.05 0.00 0.00 -0.96 0.00 0.00 56.93 54.78 1fwt s PHE 1158Cb -0.70 -1.38 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1fwt s PHE 1158CO 0.44 -0.80 0.00 0.41 -1.46 0.00 0.00 175.22 173.81 1fwt n GLY 1159N 3.72 -1.10 3.83 13.12 0.00 -1.26 -4.27 105.19 119.22 1fwt n GLY 1159Ca 0.12 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.57 1fwt n GLY 1159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fwt s TYR 1160N 0.00 3.73 -1.43 1.61 2.02 -1.26 -4.29 117.35 117.72 1fwt s TYR 1160Ca 0.00 1.17 -0.11 0.00 -0.37 0.00 0.00 57.07 57.76 1fwt s TYR 1160Cb 0.00 -2.43 0.07 0.00 -0.40 0.00 0.00 41.96 39.20 1fwt s TYR 1160CO 0.00 0.54 0.69 0.09 -1.57 0.00 0.00 175.55 175.29 1fwt n ASN 1161N 1.39 -4.48 -3.66 2.29 3.02 -1.26 -4.96 115.26 107.61 1fwt n ASN 1161Ca -0.09 -0.53 -0.15 0.00 -0.03 0.00 0.00 54.58 53.78 1fwt n ASN 1161Cb 0.51 -3.64 -0.08 0.00 -0.61 0.00 0.00 39.78 35.97 1fwt n ASN 1161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1fwt s ASN 1162N -2.93 -0.41 0.06 6.41 3.04 -1.26 -4.11 114.94 115.74 1fwt s ASN 1162Ca 0.49 0.41 0.06 0.00 0.04 0.00 0.00 52.86 53.86 1fwt s ASN 1162Cb -0.25 0.46 -0.03 0.00 -1.54 0.00 0.00 41.25 39.89 1fwt s ASN 1162CO 0.60 -0.50 -0.16 -0.76 -3.04 0.00 0.00 177.10 173.25 1fwt s LEU 1163N -1.16 2.23 0.08 3.21 1.43 -1.26 -1.70 118.68 121.51 1fwt s LEU 1163Ca -0.12 -0.55 0.08 0.00 -1.03 0.00 0.00 54.13 52.51 1fwt s LEU 1163Cb -0.03 -0.64 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 1fwt s LEU 1163CO 0.06 0.01 -0.20 0.54 0.23 0.00 0.00 176.35 176.99 1fwt s VAL 1164N -1.04 1.63 -0.29 -1.59 0.11 -0.45 -4.86 120.40 113.91 1fwt s VAL 1164Ca 0.01 -1.41 -0.09 0.00 -2.93 0.00 0.00 61.98 57.56 1fwt s VAL 1164Cb -0.09 -1.47 -0.02 0.00 -1.53 0.00 0.00 36.38 33.27 1fwt s VAL 1164CO 0.02 0.00 0.13 -0.69 -3.33 0.00 0.00 175.10 171.24 1fwt s VAL 1165N -1.06 4.61 -0.74 2.04 1.01 -1.26 -0.81 120.40 124.18 1fwt s VAL 1165Ca 0.06 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 1fwt s VAL 1165Cb -0.10 -3.28 0.16 0.00 0.00 0.00 0.00 36.38 33.16 1fwt s VAL 1165CO 0.03 0.16 0.79 -0.62 0.00 0.00 0.00 175.10 175.46 1fwt s ASP 1166N 1.63 6.50 0.00 3.32 -1.08 -1.26 -4.92 116.67 120.86 1fwt s ASP 1166Ca 0.05 -2.09 0.00 0.00 -0.52 0.00 0.00 52.55 49.99 1fwt s ASP 1166Cb -0.16 -2.27 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 1fwt s ASP 1166CO 0.06 -0.86 0.85 0.49 0.52 0.00 0.00 175.17 176.22 1fwt n PHE 1167N 5.33 0.00 0.31 -5.34 3.01 -1.26 -0.76 117.46 118.75 1fwt n PHE 1167Ca 0.06 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.68 1fwt n PHE 1167Cb 0.45 -0.35 0.70 0.00 -0.01 0.00 0.00 39.48 40.27 1fwt n PHE 1167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1fwt h ARG 1168N 0.00 0.00 -0.14 -1.08 3.08 -2.03 -2.77 114.38 111.44 1fwt h ARG 1168Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1fwt h ARG 1168Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1fwt h ARG 1168CO 0.00 0.00 -0.14 0.66 -1.07 0.00 0.00 179.97 179.42 1fwt h SER 1169N 0.00 0.22 0.40 7.04 4.64 -1.37 -3.00 113.55 121.47 1fwt h SER 1169Ca 0.00 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1fwt h SER 1169Cb 0.40 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1fwt h SER 1169CO 0.00 0.38 -0.20 -0.07 -0.87 0.00 0.00 176.83 176.07 1fwt h LEU 1170N 0.22 -0.49 -1.07 5.97 4.07 -1.71 -0.21 115.31 122.08 1fwt h LEU 1170Ca 0.04 0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.94 1fwt h LEU 1170Cb 0.39 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1fwt h LEU 1170CO 0.02 -0.34 -0.38 1.55 -1.08 0.00 0.00 178.44 178.21 1fwt h PRO 1171N -0.56 0.00 0.14 1.13 0.13 -1.74 -2.31 132.00 128.79 1fwt h PRO 1171Ca -0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 1fwt h PRO 1171Cb 0.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 1fwt h PRO 1171CO 0.08 0.38 -0.07 0.82 -0.23 0.00 0.00 178.00 178.98 1fwt h ILE 1172N 0.00 1.02 0.00 -3.56 2.04 -1.37 -3.17 117.51 112.47 1fwt h ILE 1172Ca -0.00 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 1fwt h ILE 1172Cb 0.83 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 1fwt h ILE 1172CO 0.05 0.20 -0.19 0.24 0.00 0.00 0.00 178.15 178.45 1fwt h MET 1173N -0.62 0.00 -0.00 2.37 2.86 -1.06 -2.15 114.93 116.33 1fwt h MET 1173Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1fwt h MET 1173Cb 0.47 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.13 1fwt h MET 1173CO 0.03 0.19 0.03 -0.22 1.06 0.00 0.00 176.91 178.01 1fwt h LYS 1174N 0.00 0.00 0.00 1.72 1.63 -1.38 -1.57 116.57 116.97 1fwt h LYS 1174Ca -0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 1fwt h LYS 1174Cb 0.38 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.01 1fwt h LYS 1174CO 0.02 0.00 -0.07 1.96 -3.45 0.00 0.00 179.45 177.92 1fwt h GLN 1175N 0.00 0.00 0.00 1.90 4.20 -1.45 -3.31 115.11 116.45 1fwt h GLN 1175Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1fwt h GLN 1175Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1fwt h GLN 1175CO -0.00 0.07 0.00 -2.67 -0.67 0.00 0.00 178.83 175.56 1fwt n TRP 1176N -4.22 0.00 -3.65 2.96 2.14 -0.63 -5.11 117.44 108.93 1fwt n TRP 1176Ca -0.03 -0.05 -0.04 0.00 2.07 0.00 0.00 57.50 59.45 1fwt n TRP 1176Cb 0.15 -0.01 -0.01 0.00 -0.81 0.00 0.00 31.31 30.63 1fwt n TRP 1176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1fwt s ALA 1177N -0.10 -1.82 0.36 -1.67 0.00 -0.97 -4.99 121.76 112.57 1fwt s ALA 1177Ca 0.00 0.55 -0.26 0.00 0.00 0.00 0.00 51.96 52.25 1fwt s ALA 1177Cb 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 23.12 23.52 1fwt s ALA 1177CO 0.00 -0.92 1.07 0.15 0.00 0.00 0.00 175.76 176.06 1fwt s LYS 1178N -3.05 4.33 -0.10 0.00 1.02 -1.15 -4.06 119.74 116.72 1fwt s LYS 1178Ca 0.10 1.63 0.00 0.00 0.02 0.00 0.00 55.97 57.72 1fwt s LYS 1178Cb -0.00 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.50 1fwt s LYS 1178CO -0.02 -0.02 -0.09 0.08 -0.92 0.00 0.00 175.35 174.37 1fwt s VAL 1179N -1.47 3.43 -0.05 3.17 1.01 -1.26 -1.17 120.40 124.07 1fwt s VAL 1179Ca 0.53 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 62.02 1fwt s VAL 1179Cb -0.26 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 1fwt s VAL 1179CO 0.33 0.55 -0.23 -0.63 0.00 0.00 0.00 175.10 175.11 1fwt s ILE 1180N -0.18 2.23 -0.24 2.22 -1.09 -0.21 -0.17 121.20 123.75 1fwt s ILE 1180Ca 0.01 -1.02 -0.08 0.00 -2.23 0.00 0.00 60.65 57.33 1fwt s ILE 1180Cb -0.13 -1.81 -0.04 0.00 -1.58 0.00 0.00 42.46 38.91 1fwt s ILE 1180CO 0.03 0.57 0.09 -0.47 -1.23 0.00 0.00 174.94 173.94 1fwt s TYR 1181N -0.38 3.14 -0.70 3.97 5.04 -0.58 -0.44 117.35 127.40 1fwt s TYR 1181Ca 0.03 -0.21 -0.23 0.00 -2.44 0.00 0.00 57.07 54.22 1fwt s TYR 1181Cb -0.12 -2.23 0.06 0.00 0.35 0.00 0.00 41.96 40.02 1fwt s TYR 1181CO 0.02 -0.21 1.06 0.34 -1.34 0.00 0.00 175.55 175.41 1fwt s ASP 1182N 1.39 6.20 0.46 4.32 -1.08 0.05 -0.30 116.67 127.70 1fwt s ASP 1182Ca 0.06 -0.91 0.26 0.00 -0.52 0.00 0.00 52.55 51.43 1fwt s ASP 1182Cb -0.15 -2.46 0.99 0.00 -1.46 0.00 0.00 42.92 39.84 1fwt s ASP 1182CO 0.05 -1.53 1.85 0.00 0.52 0.00 0.00 175.17 176.06 1fwt h ALA 1183N 9.66 1.02 0.04 3.66 0.00 -1.27 -3.17 119.26 129.19 1fwt h ALA 1183Ca -0.26 -0.16 -0.37 0.00 0.00 0.00 0.00 54.91 54.12 1fwt h ALA 1183Cb 1.06 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1fwt h ALA 1183CO 1.21 0.22 -2.27 0.25 0.00 0.00 0.00 179.25 178.65 1fwt n THR 1184N -3.32 1.58 0.15 0.00 -2.24 -1.26 -4.40 114.28 104.79 1fwt n THR 1184Ca 0.00 -0.64 0.03 0.00 -2.27 0.00 0.00 64.05 61.17 1fwt n THR 1184Cb 0.41 -1.41 0.16 0.00 -2.10 0.00 0.00 70.33 67.39 1fwt n THR 1184CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1fwt h HIS 1185N 0.02 0.00 0.00 4.78 3.86 -1.90 -3.21 115.15 118.70 1fwt h HIS 1185Ca -0.51 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.70 1fwt h HIS 1185Cb 1.98 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.45 1fwt h HIS 1185CO 0.04 0.50 0.00 0.77 0.86 0.00 0.00 177.93 180.10 1fwt h SER 1186N 0.00 0.00 -0.04 2.45 0.02 -1.64 -2.31 113.55 112.03 1fwt h SER 1186Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1fwt h SER 1186Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1fwt h SER 1186CO 0.07 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.09 1fwt n VAL 1187N -2.85 0.03 -2.34 2.27 0.24 -1.21 -4.73 118.33 109.74 1fwt n VAL 1187Ca -0.01 -0.52 -0.34 0.00 -2.04 0.00 0.00 64.34 61.44 1fwt n VAL 1187Cb 0.15 1.34 -0.01 0.00 -1.47 0.00 0.00 33.84 33.85 1fwt n VAL 1187CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fwt s GLN 1188N -1.46 3.56 -0.52 7.34 -2.07 -0.87 -2.23 119.66 123.41 1fwt s GLN 1188Ca 0.21 1.38 -0.08 0.00 -1.82 0.00 0.00 55.36 55.05 1fwt s GLN 1188Cb 0.15 -2.06 0.13 0.00 -1.09 0.00 0.00 33.01 30.14 1fwt s GLN 1188CO 0.22 -0.63 0.38 -0.51 -1.32 0.00 0.00 175.29 173.43 1fwt s LEU 1189N -3.83 5.69 -0.18 2.60 1.43 0.93 -4.33 118.68 120.99 1fwt s LEU 1189Ca 0.68 -2.12 -0.39 0.00 -1.03 0.00 0.00 54.13 51.27 1fwt s LEU 1189Cb -0.18 -1.99 -0.15 0.00 0.03 0.00 0.00 46.19 43.90 1fwt s LEU 1189CO 0.26 -0.63 1.70 -2.65 0.23 0.00 0.00 176.35 175.27 1fwt n PRO 1190N 4.61 1.35 -1.42 1.29 -0.02 -1.26 0.73 135.00 140.27 1fwt n PRO 1190Ca -0.03 0.49 -0.15 0.00 -2.02 0.00 0.00 63.50 61.78 1fwt n PRO 1190Cb 0.41 -2.20 -0.07 0.00 -0.02 0.00 0.00 33.50 31.62 1fwt n PRO 1190CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fwt n GLY 1191N 3.97 1.46 0.31 -1.23 0.00 -1.26 -4.20 105.19 104.24 1fwt n GLY 1191Ca 0.24 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.46 1fwt n GLY 1191CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1fwt h GLY 1192N 0.00 0.00 -2.00 -0.02 0.00 -0.89 -2.53 103.07 97.64 1fwt h GLY 1192Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1fwt h GLY 1192CO 0.46 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.04 1fwt n LEU 1193N -3.23 3.62 0.00 3.11 7.99 0.50 -4.74 117.00 124.25 1fwt n LEU 1193Ca -0.02 -2.18 0.00 0.00 -0.01 0.00 0.00 56.01 53.80 1fwt n LEU 1193Cb 0.14 -0.39 0.00 0.00 -0.11 0.00 0.00 43.42 43.06 1fwt n LEU 1193CO 0.23 0.81 0.00 0.61 -1.51 0.00 0.00 177.39 177.53 1fwt n GLY 1194N 0.82 2.02 0.02 -0.72 0.00 -0.95 -4.10 105.19 102.28 1fwt n GLY 1194Ca 0.18 -0.31 0.13 0.00 0.00 0.00 0.00 46.02 46.02 1fwt n GLY 1194CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fwt n ASP 1195N 4.51 0.29 -4.03 1.61 5.75 -1.26 -4.90 116.55 118.52 1fwt n ASP 1195Ca 0.00 0.01 -0.11 0.00 -0.01 0.00 0.00 54.79 54.67 1fwt n ASP 1195Cb 0.00 -0.12 -0.08 0.00 -1.03 0.00 0.00 41.12 39.90 1fwt n ASP 1195CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1fwt s LYS 1196N -2.91 1.40 0.29 0.11 1.02 -1.26 -3.25 119.74 115.13 1fwt s LYS 1196Ca 0.15 -1.51 -0.04 0.00 0.02 0.00 0.00 55.97 54.59 1fwt s LYS 1196Cb 0.19 0.36 -0.05 0.00 -0.52 0.00 0.00 37.83 37.80 1fwt s LYS 1196CO 0.59 -0.52 0.54 -1.12 -0.92 0.00 0.00 175.35 173.92 1fwt s SER 1197N -3.12 6.42 0.00 2.83 0.01 -1.26 -0.37 113.70 118.21 1fwt s SER 1197Ca 0.32 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.24 1fwt s SER 1197Cb 0.04 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 64.14 1fwt s SER 1197CO 0.12 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.19 1fwt n GLY 1198N -1.00 2.28 0.00 3.44 0.00 0.22 -4.56 105.19 105.58 1fwt n GLY 1198Ca -0.02 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.92 1fwt n GLY 1198CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwt n GLY 1199N 5.00 1.12 2.86 -0.02 0.00 -1.26 -0.05 105.19 112.85 1fwt n GLY 1199Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1fwt n GLY 1199CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fwt s MET 1200N -2.00 1.69 0.54 1.61 -1.94 -0.95 -4.88 119.30 113.37 1fwt s MET 1200Ca 0.00 -2.35 0.26 0.00 -1.71 0.00 0.00 55.69 51.89 1fwt s MET 1200Cb 0.00 -2.93 1.42 0.00 2.01 0.00 0.00 34.83 35.33 1fwt s MET 1200CO 0.00 -1.12 2.00 -0.09 -0.01 0.00 0.00 175.02 175.80 1fwt h ARG 1201N 6.64 0.00 0.00 2.03 2.43 -1.89 -1.95 114.38 121.64 1fwt h ARG 1201Ca -0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1fwt h ARG 1201Cb 0.91 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 1fwt h ARG 1201CO 0.60 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 180.11 1fwt h GLU 1202N 0.00 0.00 -0.01 0.20 9.09 -1.93 -2.43 114.58 119.49 1fwt h GLU 1202Ca 0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.65 1fwt h GLU 1202Cb 0.98 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.08 1fwt h GLU 1202CO -0.00 0.00 -0.56 1.19 0.05 0.00 0.00 179.01 179.69 1fwt n PHE 1203N -2.61 0.00 0.13 2.06 3.01 -0.73 -4.54 117.46 114.78 1fwt n PHE 1203Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.32 1fwt n PHE 1203Cb 0.11 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.52 1fwt n PHE 1203CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1fwt h ILE 1204N 1.93 0.59 0.13 4.37 2.04 -1.56 -2.53 117.51 122.48 1fwt h ILE 1204Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1fwt h ILE 1204Cb 0.69 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1fwt h ILE 1204CO 0.00 0.00 -0.06 0.15 0.00 0.00 0.00 178.15 178.24 1fwt h PHE 1205N -0.39 -0.16 -0.79 1.37 -0.00 -1.80 -2.19 116.94 112.99 1fwt h PHE 1205Ca 0.01 -0.00 0.05 0.00 -0.00 0.00 0.00 57.97 58.02 1fwt h PHE 1205Cb 0.37 0.05 -0.06 0.00 -0.00 0.00 0.00 35.95 36.32 1fwt h PHE 1205CO -0.15 0.05 0.48 -1.00 -0.00 0.00 0.00 178.31 177.69 1fwt h PRO 1206N -0.34 0.88 -0.19 6.41 0.13 -1.81 -1.47 132.00 135.61 1fwt h PRO 1206Ca -0.02 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.97 1fwt h PRO 1206Cb 0.27 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.19 1fwt h PRO 1206CO 0.03 0.58 -0.28 -0.07 -0.23 0.00 0.00 178.00 178.03 1fwt h LEU 1207N 0.90 0.37 -0.88 1.56 3.38 -1.43 -1.92 115.31 117.30 1fwt h LEU 1207Ca 0.34 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 1fwt h LEU 1207Cb 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1fwt h LEU 1207CO -0.15 0.65 -0.52 -0.29 0.09 0.00 0.00 178.44 178.21 1fwt h ILE 1208N 0.33 1.37 -0.52 1.22 2.10 -0.92 -0.75 117.51 120.34 1fwt h ILE 1208Ca 0.05 -1.80 -0.06 0.00 1.08 0.00 0.00 64.86 64.12 1fwt h ILE 1208Cb 0.67 1.94 -0.02 0.00 -1.09 0.00 0.00 36.82 38.32 1fwt h ILE 1208CO 0.05 0.52 0.09 0.03 -1.08 0.00 0.00 178.15 177.76 1fwt h ARG 1209N 0.07 0.85 -0.55 2.19 3.08 -0.79 -2.52 114.38 116.70 1fwt h ARG 1209Ca -0.00 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.82 1fwt h ARG 1209Cb 0.95 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.87 1fwt h ARG 1209CO 0.07 0.84 0.35 0.00 -1.07 0.00 0.00 179.97 180.16 1fwt h ALA 1210N 0.98 0.70 -0.39 0.04 0.00 -0.85 -2.06 119.26 117.67 1fwt h ALA 1210Ca 0.16 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1fwt h ALA 1210Cb 0.40 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1fwt h ALA 1210CO 0.01 0.15 0.14 0.00 0.00 0.00 0.00 179.25 179.55 1fwt h ALA 1211N 1.19 0.46 0.00 0.00 0.00 -0.85 -0.50 119.26 119.56 1fwt h ALA 1211Ca 0.20 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1fwt h ALA 1211Cb -0.06 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fwt h ALA 1211CO -0.04 -0.25 -0.39 -0.39 0.00 0.00 0.00 179.25 178.18 1fwt h VAL 1212N 0.30 0.89 -0.25 0.00 -1.51 -1.33 0.16 116.25 114.51 1fwt h VAL 1212Ca 0.18 -1.60 -0.19 0.00 -1.23 0.00 0.00 66.70 63.86 1fwt h VAL 1212Cb 0.16 1.98 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 1fwt h VAL 1212CO -0.18 0.39 -0.58 0.00 -1.23 0.00 0.00 177.57 175.96 1fwt h ALA 1213N 1.61 0.41 -0.18 5.19 0.00 -0.83 -3.08 119.26 122.37 1fwt h ALA 1213Ca -0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 1fwt h ALA 1213Cb 0.95 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1fwt h ALA 1213CO 0.05 0.65 -0.10 0.28 0.00 0.00 0.00 179.25 180.13 1fwt h VAL 1214N 0.60 1.32 0.00 0.00 2.07 -0.96 -3.47 116.25 115.81 1fwt h VAL 1214Ca -0.00 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.35 1fwt h VAL 1214Cb 1.20 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1fwt h VAL 1214CO 0.13 0.35 0.00 0.61 0.02 0.00 0.00 177.57 178.68 1fwt n GLY 1215N 0.03 3.05 3.45 2.17 0.00 0.54 -4.85 105.19 109.57 1fwt n GLY 1215Ca -0.05 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 1fwt n GLY 1215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwt n ASP 1217N -0.94 2.16 0.00 0.00 8.00 0.76 -4.99 116.55 121.53 1fwt n ASP 1217Ca 0.01 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 53.93 1fwt n ASP 1217Cb 0.62 0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.99 1fwt n ASP 1217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fwt n GLY 1218N 1.37 0.55 3.17 0.44 0.00 -1.13 -1.84 105.19 107.76 1fwt n GLY 1218Ca 0.12 -0.93 -0.18 0.00 0.00 0.00 0.00 46.02 45.04 1fwt n GLY 1218CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fwt s VAL 1219N -2.00 1.09 -0.15 1.61 -7.23 0.09 -1.53 120.40 112.28 1fwt s VAL 1219Ca 0.00 -1.38 0.02 0.00 -1.81 0.00 0.00 61.98 58.81 1fwt s VAL 1219Cb 0.00 -1.13 0.01 0.00 0.56 0.00 0.00 36.38 35.82 1fwt s VAL 1219CO 0.00 -0.29 -0.20 0.12 -0.31 0.00 0.00 175.10 174.42 1fwt s PHE 1220N -1.51 2.71 -0.02 2.82 2.19 0.59 -0.53 117.98 124.23 1fwt s PHE 1220Ca -0.00 -1.26 0.00 0.00 0.33 0.00 0.00 56.93 56.00 1fwt s PHE 1220Cb -0.09 -1.85 0.03 0.00 -1.31 0.00 0.00 43.02 39.81 1fwt s PHE 1220CO 0.02 -0.58 0.03 -1.64 1.83 0.00 0.00 175.22 174.88 1fwt s MET 1221N 0.85 0.02 0.00 10.12 -1.94 0.45 -0.81 119.30 127.99 1fwt s MET 1221Ca -0.06 0.17 -0.19 0.00 -1.71 0.00 0.00 55.69 53.91 1fwt s MET 1221Cb -0.15 -0.29 -0.06 0.00 2.01 0.00 0.00 34.83 36.34 1fwt s MET 1221CO -0.02 -0.17 0.54 -1.21 -0.01 0.00 0.00 175.02 174.15 1fwt s GLU 1222N 1.09 4.21 0.01 2.03 2.02 -1.26 -2.86 118.70 123.93 1fwt s GLU 1222Ca -0.09 0.64 0.00 0.00 0.02 0.00 0.00 54.97 55.54 1fwt s GLU 1222Cb -0.13 -3.30 -0.01 0.00 0.10 0.00 0.00 34.13 30.79 1fwt s GLU 1222CO -0.03 0.48 -0.01 -0.08 0.02 0.00 0.00 175.26 175.64 1fwt s THR 1223N -0.52 0.06 -0.03 3.63 -1.32 -0.26 -0.88 115.64 116.32 1fwt s THR 1223Ca 0.28 -0.34 -0.03 0.00 -1.21 0.00 0.00 61.69 60.39 1fwt s THR 1223Cb -0.18 -0.12 0.01 0.00 -1.51 0.00 0.00 72.50 70.70 1fwt s THR 1223CO 0.16 -0.18 0.08 -2.28 -2.21 0.00 0.00 174.62 170.20 1fwt s HIS 1224N -0.54 -0.06 0.29 9.09 5.04 -0.47 -2.63 115.29 126.01 1fwt s HIS 1224Ca -0.06 0.14 0.03 0.00 -1.54 0.00 0.00 55.06 53.63 1fwt s HIS 1224Cb -0.04 0.01 0.67 0.00 0.04 0.00 0.00 32.58 33.26 1fwt s HIS 1224CO -0.00 -0.08 1.75 -1.35 -2.34 0.00 0.00 174.74 172.72 1fwt h PRO 1225N 5.73 0.62 -2.44 2.88 0.11 -1.95 -1.95 132.00 135.02 1fwt h PRO 1225Ca -0.26 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.23 1fwt h PRO 1225Cb 1.20 -0.14 -0.38 0.00 0.11 0.00 0.00 31.00 31.79 1fwt h PRO 1225CO 0.44 0.41 -0.94 -1.21 -0.21 0.00 0.00 178.00 176.50 1fwt s GLU 1226N -5.90 0.88 0.33 1.05 2.02 -1.26 -4.38 118.70 111.44 1fwt s GLU 1226Ca -0.12 -1.98 0.10 0.00 0.02 0.00 0.00 54.97 52.99 1fwt s GLU 1226Cb 0.24 -1.46 0.98 0.00 0.10 0.00 0.00 34.13 33.99 1fwt s GLU 1226CO 0.79 -1.35 1.60 -1.35 0.02 0.00 0.00 175.26 174.98 1fwt h PRO 1227N 5.93 0.09 -0.03 0.39 0.11 -1.86 0.14 132.00 136.77 1fwt h PRO 1227Ca 0.22 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.33 1fwt h PRO 1227Cb 0.92 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 1fwt h PRO 1227CO 0.36 0.06 0.10 1.05 -0.21 0.00 0.00 178.00 179.36 1fwt h GLU 1228N 0.09 0.00 -0.01 1.05 4.11 -1.94 -0.45 114.58 117.44 1fwt h GLU 1228Ca 0.69 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.12 1fwt h GLU 1228Cb 1.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.84 1fwt h GLU 1228CO -0.77 0.00 -0.72 1.63 0.07 0.00 0.00 179.01 179.21 1fwt n LYS 1229N -3.28 0.64 -1.57 1.06 5.02 0.47 -4.99 118.16 115.51 1fwt n LYS 1229Ca -0.02 -0.53 -0.38 0.00 -2.02 0.00 0.00 58.31 55.36 1fwt n LYS 1229Cb 0.17 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.74 1fwt n LYS 1229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fwt n ALA 1230N -0.72 -0.23 1.21 7.82 0.00 -0.18 -4.90 120.51 123.52 1fwt n ALA 1230Ca 0.07 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.62 1fwt n ALA 1230Cb 0.40 -2.03 0.31 0.00 0.00 0.00 0.00 19.45 18.14 1fwt n ALA 1230CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fwt n LEU 1231N -0.45 1.31 -3.70 0.00 4.77 -1.26 -4.60 117.00 113.07 1fwt n LEU 1231Ca 0.13 -0.40 -0.14 0.00 -0.03 0.00 0.00 56.01 55.58 1fwt n LEU 1231Cb 0.48 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.39 1fwt n LEU 1231CO 0.49 0.24 0.19 -0.94 -1.33 0.00 0.00 177.39 176.05 1fwt s SER 1232N -2.44 -0.52 -1.51 -1.43 1.04 -1.26 -4.42 113.70 103.16 1fwt s SER 1232Ca 0.24 0.96 -0.11 0.00 0.48 0.00 0.00 55.95 57.53 1fwt s SER 1232Cb 0.19 0.98 0.08 0.00 0.10 0.00 0.00 66.02 67.37 1fwt s SER 1232CO 0.51 -0.21 0.83 0.47 0.98 0.00 0.00 173.24 175.82 1fwt n ASP 1233N 2.65 -3.37 0.28 7.02 8.00 -1.26 -4.84 116.55 125.03 1fwt n ASP 1233Ca -0.14 -0.86 0.13 0.00 0.71 0.00 0.00 54.79 54.63 1fwt n ASP 1233Cb 0.56 -3.59 0.79 0.00 -0.02 0.00 0.00 41.12 38.86 1fwt n ASP 1233CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fwt h ALA 1234N 0.93 1.50 0.00 2.24 0.00 -1.81 -2.16 119.26 119.95 1fwt h ALA 1234Ca -0.59 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1fwt h ALA 1234Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1fwt h ALA 1234CO 0.67 0.08 -0.35 0.77 0.00 0.00 0.00 179.25 180.42 1fwt h SER 1235N 0.00 0.00 0.00 0.00 0.02 -1.88 -3.38 113.55 108.31 1fwt h SER 1235Ca -0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1fwt h SER 1235Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1fwt h SER 1235CO 0.01 0.03 -0.34 0.35 -1.14 0.00 0.00 176.83 175.74 1fwt n THR 1236N -2.46 0.00 -2.20 -2.27 -2.24 -0.96 -4.02 114.28 100.13 1fwt n THR 1236Ca 0.04 -0.35 -0.41 0.00 -2.27 0.00 0.00 64.05 61.06 1fwt n THR 1236Cb 0.47 0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 1fwt n THR 1236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1fwt s GLN 1237N -1.38 4.41 0.12 -0.78 -0.21 -0.85 -4.82 119.66 116.14 1fwt s GLN 1237Ca 0.00 2.11 -0.29 0.00 0.02 0.00 0.00 55.36 57.20 1fwt s GLN 1237Cb 0.01 -3.13 -0.06 0.00 1.00 0.00 0.00 33.01 30.83 1fwt s GLN 1237CO 0.04 -0.15 0.94 -1.17 -2.12 0.00 0.00 175.29 172.83 1fwt s LEU 1238N -1.21 4.51 0.22 2.90 2.96 -0.06 -4.75 118.68 123.26 1fwt s LEU 1238Ca 0.51 1.77 -0.32 0.00 -0.22 0.00 0.00 54.13 55.88 1fwt s LEU 1238Cb -0.38 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.65 1fwt s LEU 1238CO 0.46 -0.03 1.69 -2.84 -1.32 0.00 0.00 176.35 174.31 1fwt s PRO 1239N -0.15 4.13 0.45 0.98 0.02 -1.26 -1.37 135.00 137.79 1fwt s PRO 1239Ca 0.45 2.59 0.22 0.00 0.02 0.00 0.00 61.00 64.28 1fwt s PRO 1239Cb -0.23 -3.07 1.20 0.00 0.02 0.00 0.00 34.50 32.42 1fwt s PRO 1239CO 0.29 -0.72 1.84 1.25 -0.33 0.00 0.00 177.00 179.34 1fwt h LEU 1240N 6.37 0.31 -1.89 -5.54 5.85 -1.55 0.20 115.31 119.05 1fwt h LEU 1240Ca -0.44 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 1fwt h LEU 1240Cb 1.20 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 1fwt h LEU 1240CO 0.92 0.10 -0.08 0.77 -0.34 0.00 0.00 178.44 179.81 1fwt h SER 1241N 0.29 0.00 0.67 1.25 4.64 -1.88 -2.66 113.55 115.87 1fwt h SER 1241Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1fwt h SER 1241Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1fwt h SER 1241CO -0.16 0.08 -0.41 0.00 -0.87 0.00 0.00 176.83 175.47 1fwt n GLN 1242N -3.36 0.05 0.02 4.77 6.02 0.06 -4.41 117.38 120.52 1fwt n GLN 1242Ca -0.01 0.02 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 1fwt n GLN 1242Cb 0.25 -1.53 -0.04 0.00 1.02 0.00 0.00 30.24 29.94 1fwt n GLN 1242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1fwt h LEU 1243N 0.00 -0.30 -0.43 1.08 5.85 -1.50 -2.47 115.31 117.53 1fwt h LEU 1243Ca 0.00 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1fwt h LEU 1243Cb 0.54 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.66 1fwt h LEU 1243CO 0.00 -0.14 0.09 -0.08 -0.34 0.00 0.00 178.44 177.97 1fwt h GLU 1244N -0.13 0.22 -0.63 1.25 4.81 -1.79 -1.04 114.58 117.27 1fwt h GLU 1244Ca 0.06 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1fwt h GLU 1244Cb 0.22 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 1fwt h GLU 1244CO -0.16 0.14 0.19 0.78 -0.73 0.00 0.00 179.01 179.24 1fwt h GLY 1245N 0.23 1.04 0.89 1.92 0.00 -1.81 -1.11 103.07 104.23 1fwt h GLY 1245Ca 0.21 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1fwt h GLY 1245CO -0.27 0.56 0.06 -2.22 0.00 0.00 0.00 176.54 174.67 1fwt h ILE 1246N 0.94 1.23 -0.45 2.60 1.08 -0.94 -1.72 117.51 120.23 1fwt h ILE 1246Ca 0.21 -0.76 -0.03 0.00 -0.39 0.00 0.00 64.86 63.89 1fwt h ILE 1246Cb 0.28 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 1fwt h ILE 1246CO -0.01 0.25 0.18 0.40 -0.69 0.00 0.00 178.15 178.29 1fwt h ILE 1247N 0.31 1.20 -0.52 -0.67 2.04 -1.01 -1.37 117.51 117.50 1fwt h ILE 1247Ca 0.09 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.35 1fwt h ILE 1247Cb 0.32 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1fwt h ILE 1247CO 0.00 0.23 0.30 -0.08 0.00 0.00 0.00 178.15 178.61 1fwt h GLU 1248N 0.59 0.58 -0.40 2.37 4.57 -1.13 -1.72 114.58 119.45 1fwt h GLU 1248Ca 0.15 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1fwt h GLU 1248Cb 0.19 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.62 1fwt h GLU 1248CO -0.01 0.38 0.22 0.00 -1.18 0.00 0.00 179.01 178.42 1fwt h ALA 1249N 1.24 0.50 -0.04 2.92 0.00 -0.93 -1.73 119.26 121.23 1fwt h ALA 1249Ca 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1fwt h ALA 1249Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1fwt h ALA 1249CO -0.11 -0.12 -0.49 -0.84 0.00 0.00 0.00 179.25 177.69 1fwt h ILE 1250N 0.45 1.35 -0.57 0.00 3.07 -0.95 -1.41 117.51 119.45 1fwt h ILE 1250Ca 0.16 -1.69 -0.11 0.00 1.55 0.00 0.00 64.86 64.77 1fwt h ILE 1250Cb 0.03 1.87 -0.02 0.00 -0.27 0.00 0.00 36.82 38.43 1fwt h ILE 1250CO -0.09 0.49 -0.08 -0.07 -1.05 0.00 0.00 178.15 177.36 1fwt h LEU 1251N 0.07 1.05 -0.31 0.16 3.38 -1.03 0.19 115.31 118.82 1fwt h LEU 1251Ca 0.00 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 1fwt h LEU 1251Cb 0.89 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1fwt h LEU 1251CO 0.07 1.14 0.07 -0.33 0.09 0.00 0.00 178.44 179.48 1fwt h GLU 1252N 0.94 0.50 -0.51 1.13 5.08 -1.01 -1.03 114.58 119.68 1fwt h GLU 1252Ca 0.15 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1fwt h GLU 1252Cb 0.65 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1fwt h GLU 1252CO 0.04 0.57 -0.16 0.82 -1.00 0.00 0.00 179.01 179.29 1fwt h ILE 1253N 0.34 1.27 -0.50 3.13 2.04 -1.13 -2.65 117.51 120.01 1fwt h ILE 1253Ca 0.10 -1.32 0.02 0.00 1.00 0.00 0.00 64.86 64.65 1fwt h ILE 1253Cb 0.30 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1fwt h ILE 1253CO 0.00 0.46 0.31 -0.09 0.00 0.00 0.00 178.15 178.84 1fwt h ARG 1254N 0.88 0.61 0.22 2.37 2.43 -0.50 -0.96 114.38 119.43 1fwt h ARG 1254Ca 0.13 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1fwt h ARG 1254Cb 0.73 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1fwt h ARG 1254CO 0.06 0.41 -0.12 1.49 -1.51 0.00 0.00 179.97 180.29 1fwt h GLU 1255N 0.63 -0.31 -0.16 0.20 4.57 -1.05 0.45 114.58 118.91 1fwt h GLU 1255Ca 0.20 0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.32 1fwt h GLU 1255Cb -0.02 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 1fwt h GLU 1255CO -0.07 -0.20 -0.25 -0.24 -1.18 0.00 0.00 179.01 177.06 1fwt h VAL 1256N -0.32 1.25 0.00 0.32 3.04 -1.37 -3.01 116.25 116.16 1fwt h VAL 1256Ca -0.03 -1.16 -0.20 0.00 -1.01 0.00 0.00 66.70 64.30 1fwt h VAL 1256Cb 0.25 1.41 -0.03 0.00 -2.01 0.00 0.00 31.29 30.91 1fwt h VAL 1256CO 0.04 0.36 -1.10 0.00 -1.01 0.00 0.00 177.57 175.85 1fwt h ALA 1257N 1.47 0.53 -1.00 3.17 0.00 -1.00 -3.39 119.26 119.05 1fwt h ALA 1257Ca 0.04 -0.94 0.34 0.00 0.00 0.00 0.00 54.91 54.35 1fwt h ALA 1257Cb 0.60 0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.28 1fwt h ALA 1257CO 0.04 1.17 0.55 0.66 0.00 0.00 0.00 179.25 181.68 1fwt h SER 1258N 0.00 0.46 0.37 0.00 4.64 0.04 0.87 113.55 119.92 1fwt h SER 1258Ca -0.08 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1fwt h SER 1258Cb 1.73 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.99 1fwt h SER 1258CO 0.10 -0.19 0.00 0.07 -0.87 0.00 0.00 176.83 175.94 1fwt h LYS 1259N 0.26 0.00 -0.02 4.77 2.10 -1.76 -2.19 116.57 119.73 1fwt h LYS 1259Ca 0.75 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.40 1fwt h LYS 1259Cb 1.76 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.09 1fwt h LYS 1259CO -0.64 0.00 -0.18 0.66 -2.00 0.00 0.00 179.45 177.29 1fwt n TYR 1260N -2.35 0.00 -1.76 0.07 4.02 0.30 -4.96 117.16 112.48 1fwt n TYR 1260Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1fwt n TYR 1260Cb 0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.42 1fwt n TYR 1260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1fwt s TYR 1261N -1.98 2.66 0.51 -0.72 4.12 -0.83 -4.95 117.35 116.17 1fwt s TYR 1261Ca 0.21 0.26 -0.20 0.00 0.02 0.00 0.00 57.07 57.36 1fwt s TYR 1261Cb 0.17 -4.12 -0.07 0.00 -1.52 0.00 0.00 41.96 36.42 1fwt s TYR 1261CO 0.37 -4.37 1.10 -1.21 0.02 0.00 0.00 175.55 171.47 1fwt s GLU 1262N 1.75 3.56 -0.10 -0.62 8.01 -1.26 -5.01 118.70 125.02 1fwt s GLU 1262Ca 0.76 1.55 -0.23 0.00 0.01 0.00 0.00 54.97 57.06 1fwt s GLU 1262Cb -0.47 -2.09 -0.03 0.00 -4.31 0.00 0.00 34.13 27.22 1fwt s GLU 1262CO 0.33 -0.67 0.68 0.99 0.01 0.00 0.00 175.26 176.60 1fwt s THR 1263N -1.81 5.04 -2.06 3.63 2.01 -1.26 -5.16 115.64 116.03 1fwt s THR 1263Ca 0.70 1.37 0.32 0.00 0.31 0.00 0.00 61.69 64.38 1fwt s THR 1263Cb -0.22 -4.01 0.87 0.00 0.01 0.00 0.00 72.50 69.14 1fwt s THR 1263CO 0.26 0.22 2.17 2.30 -0.69 0.00 0.00 174.62 178.87