#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hpa s GLU 1002N 0.00 0.35 0.08 -1.58 2.12 0.30 -4.88 118.70 115.08 2hpa s GLU 1002Ca 0.00 0.33 -0.34 0.00 0.36 0.00 0.00 54.97 55.31 2hpa s GLU 1002Cb 0.00 -0.53 -0.14 0.00 0.26 0.00 0.00 34.13 33.73 2hpa s GLU 1002CO 0.00 -0.78 1.65 -0.11 -0.54 0.00 0.00 175.26 175.47 2hpa n LEU 1003N 5.35 3.06 -0.05 2.70 7.94 -1.26 0.03 117.00 134.77 2hpa n LEU 1003Ca -0.03 1.06 -0.07 0.00 -1.11 0.00 0.00 56.01 55.86 2hpa n LEU 1003Cb 0.49 -1.39 -0.05 0.00 0.53 0.00 0.00 43.42 43.01 2hpa n LEU 1003CO 0.04 -0.29 -0.82 0.29 -1.11 0.00 0.00 177.39 175.50 2hpa n LYS 1004N 4.27 0.25 -3.88 1.96 4.76 0.13 -4.88 118.16 120.77 2hpa n LYS 1004Ca 0.19 0.06 -0.10 0.00 -2.87 0.00 0.00 58.31 55.58 2hpa n LYS 1004Cb 0.28 -1.18 -0.09 0.00 -1.84 0.00 0.00 35.03 32.19 2hpa n LYS 1004CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 2hpa s PHE 1005N -2.20 0.09 -0.19 2.13 5.36 -1.05 -4.65 117.98 117.48 2hpa s PHE 1005Ca -0.13 -0.31 -0.15 0.00 -0.96 0.00 0.00 56.93 55.38 2hpa s PHE 1005Cb 0.03 -0.07 0.05 0.00 -0.34 0.00 0.00 43.02 42.70 2hpa s PHE 1005CO 0.23 -0.38 0.48 0.54 -1.46 0.00 0.00 175.22 174.63 2hpa s VAL 1006N -2.28 -0.01 -0.05 3.12 0.11 0.13 -0.44 120.40 120.98 2hpa s VAL 1006Ca -0.07 0.02 0.06 0.00 -2.93 0.00 0.00 61.98 59.05 2hpa s VAL 1006Cb -0.03 -0.68 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 2hpa s VAL 1006CO -0.03 0.01 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.64 2hpa s THR 1007N 0.65 1.85 -0.15 5.04 2.01 -1.15 -2.05 115.64 121.84 2hpa s THR 1007Ca -0.03 -0.95 -0.00 0.00 0.31 0.00 0.00 61.69 61.01 2hpa s THR 1007Cb -0.05 -1.58 0.04 0.00 0.01 0.00 0.00 72.50 70.92 2hpa s THR 1007CO -0.04 0.52 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.59 2hpa s LEU 1008N -0.09 1.54 -0.32 4.42 1.43 -0.86 -1.41 118.68 123.39 2hpa s LEU 1008Ca -0.04 -0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 52.44 2hpa s LEU 1008Cb -0.13 -0.91 0.04 0.00 0.03 0.00 0.00 46.19 45.22 2hpa s LEU 1008CO 0.03 -0.17 0.05 0.68 0.23 0.00 0.00 176.35 177.17 2hpa s VAL 1009N 1.64 3.36 0.32 -1.59 -7.23 -1.19 -0.57 120.40 115.15 2hpa s VAL 1009Ca 0.02 -1.26 0.09 0.00 -1.81 0.00 0.00 61.98 59.02 2hpa s VAL 1009Cb -0.15 -2.91 -0.05 0.00 0.56 0.00 0.00 36.38 33.83 2hpa s VAL 1009CO -0.08 -0.13 0.00 0.72 -0.31 0.00 0.00 175.10 175.30 2hpa s PHE 1010N 1.32 2.56 -0.03 2.82 -0.12 -0.45 -2.52 117.98 121.57 2hpa s PHE 1010Ca -0.04 -0.39 -0.08 0.00 -0.05 0.00 0.00 56.93 56.37 2hpa s PHE 1010Cb -0.20 -1.42 -0.05 0.00 -0.63 0.00 0.00 43.02 40.73 2hpa s PHE 1010CO 0.01 0.51 0.26 0.50 -0.05 0.00 0.00 175.22 176.45 2hpa s ARG 1011N -3.70 3.61 0.97 1.99 3.52 -0.54 -0.90 118.95 123.89 2hpa s ARG 1011Ca 0.34 0.01 -0.13 0.00 -0.13 0.00 0.00 55.73 55.82 2hpa s ARG 1011Cb -0.01 -3.13 0.08 0.00 -1.56 0.00 0.00 34.95 30.32 2hpa s ARG 1011CO 0.19 0.69 0.55 -2.39 -0.81 0.00 0.00 175.30 173.54 2hpa n HIS 1012N 1.49 -0.95 -0.72 5.12 1.44 -0.77 -1.95 115.22 118.89 2hpa n HIS 1012Ca -0.14 0.24 -0.06 0.00 -2.01 0.00 0.00 57.72 55.75 2hpa n HIS 1012Cb 0.53 -1.81 0.05 0.00 0.12 0.00 0.00 29.99 28.89 2hpa n HIS 1012CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2hpa n GLY 1013N 1.26 -2.29 3.57 -1.39 0.00 -1.26 -1.98 105.19 103.10 2hpa n GLY 1013Ca 0.07 -1.50 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 2hpa n GLY 1013CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hpa n ASP 1014N -3.37 0.06 -3.51 1.61 2.03 -1.26 -4.77 116.55 107.34 2hpa n ASP 1014Ca 0.03 0.71 -0.11 0.00 0.52 0.00 0.00 54.79 55.94 2hpa n ASP 1014Cb 0.13 -1.33 -0.03 0.00 -0.72 0.00 0.00 41.12 39.16 2hpa n ASP 1014CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2hpa s ARG 1015N -2.86 1.18 0.87 -0.67 1.70 -1.26 -2.75 118.95 115.16 2hpa s ARG 1015Ca 0.73 -0.56 -0.11 0.00 -0.47 0.00 0.00 55.73 55.32 2hpa s ARG 1015Cb -0.38 0.54 0.11 0.00 -0.57 0.00 0.00 34.95 34.65 2hpa s ARG 1015CO 0.51 -0.49 1.11 -1.54 -1.08 0.00 0.00 175.30 173.80 2hpa s SER 1016N -2.74 3.53 0.62 -2.89 1.04 -0.70 -4.88 113.70 107.66 2hpa s SER 1016Ca 0.02 1.93 -0.18 0.00 0.48 0.00 0.00 55.95 58.19 2hpa s SER 1016Cb 0.00 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.59 2hpa s SER 1016CO -0.12 -2.67 1.06 -2.65 0.98 0.00 0.00 173.24 169.84 2hpa n PRO 1017N -3.94 0.96 0.03 4.02 -0.02 -1.26 -3.52 135.00 131.27 2hpa n PRO 1017Ca 0.10 0.37 -0.11 0.00 -2.02 0.00 0.00 63.50 61.84 2hpa n PRO 1017Cb 0.53 -2.28 -0.13 0.00 -0.02 0.00 0.00 33.50 31.60 2hpa n PRO 1017CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 2hpa h ILE 1018N 0.49 1.18 -4.11 4.25 -0.00 -1.92 -1.11 117.51 116.30 2hpa h ILE 1018Ca -0.49 -2.93 -0.29 0.00 -0.00 0.00 0.00 64.86 61.15 2hpa h ILE 1018Cb 1.36 2.64 -0.07 0.00 -0.00 0.00 0.00 36.82 40.74 2hpa h ILE 1018CO 0.51 0.74 -0.17 -0.62 -0.00 0.00 0.00 178.15 178.62 2hpa s ASP 1019N -6.55 1.00 0.25 2.16 2.15 -1.26 -4.60 116.67 109.83 2hpa s ASP 1019Ca -0.05 -1.53 -0.18 0.00 0.43 0.00 0.00 52.55 51.23 2hpa s ASP 1019Cb 0.08 0.69 0.02 0.00 -0.30 0.00 0.00 42.92 43.41 2hpa s ASP 1019CO 0.83 -1.34 0.61 0.28 -0.17 0.00 0.00 175.17 175.38 2hpa s THR 1020N -2.90 0.00 0.22 1.71 -1.32 -1.26 -4.48 115.64 107.61 2hpa s THR 1020Ca 0.30 -1.06 -0.17 0.00 -1.21 0.00 0.00 61.69 59.55 2hpa s THR 1020Cb -0.01 -1.97 -0.08 0.00 -1.51 0.00 0.00 72.50 68.94 2hpa s THR 1020CO 0.21 -0.02 0.68 0.72 -2.21 0.00 0.00 174.62 174.01 2hpa s PHE 1021N -3.94 3.58 0.59 9.09 -0.71 0.37 -4.88 117.98 122.09 2hpa s PHE 1021Ca 0.14 1.27 0.30 0.00 -1.04 0.00 0.00 56.93 57.60 2hpa s PHE 1021Cb -0.04 -2.54 1.38 0.00 -1.21 0.00 0.00 43.02 40.61 2hpa s PHE 1021CO 0.05 0.31 1.75 -1.00 -1.34 0.00 0.00 175.22 175.00 2hpa h PRO 1022N 3.22 0.00 0.00 1.99 0.13 -1.87 -0.72 132.00 134.74 2hpa h PRO 1022Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2hpa h PRO 1022Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2hpa h PRO 1022CO 0.65 0.00 -0.47 2.41 -0.23 0.00 0.00 178.00 180.37 2hpa n THR 1023N -3.68 0.04 -2.18 1.56 -1.04 -0.74 -4.84 114.28 103.40 2hpa n THR 1023Ca 0.14 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.69 2hpa n THR 1023Cb 0.95 0.13 -0.02 0.00 -1.82 0.00 0.00 70.33 69.56 2hpa n THR 1023CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2hpa s ASP 1024N -3.15 6.30 0.55 8.00 2.15 -0.28 -4.85 116.67 125.40 2hpa s ASP 1024Ca 0.11 1.32 0.37 0.00 0.43 0.00 0.00 52.55 54.77 2hpa s ASP 1024Cb 0.17 -2.53 1.80 0.00 -0.30 0.00 0.00 42.92 42.06 2hpa s ASP 1024CO 0.69 -1.37 2.10 1.55 -0.17 0.00 0.00 175.17 177.97 2hpa h PRO 1025N 10.99 0.00 -4.99 4.34 0.13 -1.88 -3.35 132.00 137.24 2hpa h PRO 1025Ca -0.31 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.10 2hpa h PRO 1025Cb 1.14 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.14 2hpa h PRO 1025CO 1.03 0.00 1.87 -0.89 -0.23 0.00 0.00 178.00 179.78 2hpa n ILE 1026N -2.91 4.09 -2.06 -3.56 5.41 -1.26 -4.99 119.36 114.09 2hpa n ILE 1026Ca -0.01 -4.35 -0.28 0.00 1.00 0.00 0.00 62.75 59.11 2hpa n ILE 1026Cb 0.16 -2.42 0.13 0.00 -0.71 0.00 0.00 39.64 36.80 2hpa n ILE 1026CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2hpa s LYS 1027N 2.56 1.35 0.40 0.38 1.02 -1.26 -4.89 119.74 119.30 2hpa s LYS 1027Ca 0.47 -0.35 0.23 0.00 0.02 0.00 0.00 55.97 56.34 2hpa s LYS 1027Cb 0.02 -1.99 1.28 0.00 -0.52 0.00 0.00 37.83 36.62 2hpa s LYS 1027CO 0.03 -1.89 1.65 1.49 -0.92 0.00 0.00 175.35 175.70 2hpa h GLU 1028N -1.18 0.18 0.00 1.68 4.81 -1.95 0.14 114.58 118.26 2hpa h GLU 1028Ca -0.44 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2hpa h GLU 1028Cb 1.28 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2hpa h GLU 1028CO 0.49 0.12 0.00 0.66 -0.73 0.00 0.00 179.01 179.55 2hpa h SER 1029N 0.19 0.00 1.04 1.04 4.64 -1.98 -2.34 113.55 116.14 2hpa h SER 1029Ca 0.77 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.99 2hpa h SER 1029Cb 2.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.22 2hpa h SER 1029CO -0.48 0.00 -0.46 0.28 -0.87 0.00 0.00 176.83 175.30 2hpa h SER 1030N 0.00 0.00 -3.64 4.97 0.02 -1.07 -3.42 113.55 110.41 2hpa h SER 1030Ca 0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 2hpa h SER 1030Cb 0.11 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.51 2hpa h SER 1030CO 0.00 0.46 -0.11 0.26 -1.14 0.00 0.00 176.83 176.30 2hpa s TRP 1031N -3.36 3.24 0.50 3.45 0.52 -0.88 -4.98 118.94 117.42 2hpa s TRP 1031Ca 0.01 0.44 0.38 0.00 0.02 0.00 0.00 56.10 56.95 2hpa s TRP 1031Cb 0.10 -2.71 1.55 0.00 -1.15 0.00 0.00 33.47 31.26 2hpa s TRP 1031CO 0.71 -0.33 1.64 -1.00 0.02 0.00 0.00 176.95 177.99 2hpa h PRO 1032N 8.18 0.05 0.00 4.98 0.13 -1.84 0.33 132.00 143.83 2hpa h PRO 1032Ca -0.30 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2hpa h PRO 1032Cb 1.14 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2hpa h PRO 1032CO 0.70 0.03 -0.02 1.04 -0.23 0.00 0.00 178.00 179.53 2hpa n GLN 1033N -4.33 2.20 0.00 0.86 3.00 -1.26 -5.11 117.38 112.73 2hpa n GLN 1033Ca 0.38 -1.51 0.00 0.00 -0.01 0.00 0.00 57.00 55.86 2hpa n GLN 1033Cb 1.61 -0.99 0.00 0.00 0.00 0.00 0.00 30.24 30.86 2hpa n GLN 1033CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2hpa n GLY 1034N -0.56 -1.95 3.84 1.08 0.00 0.10 -4.83 105.19 102.88 2hpa n GLY 1034Ca 0.02 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 2hpa n GLY 1034CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hpa s PHE 1035N 0.00 3.44 -1.47 1.61 0.08 -1.26 -4.10 117.98 116.27 2hpa s PHE 1035Ca 0.00 1.44 -0.01 0.00 0.12 0.00 0.00 56.93 58.48 2hpa s PHE 1035Cb 0.00 -2.80 0.00 0.00 -0.57 0.00 0.00 43.02 39.65 2hpa s PHE 1035CO 0.00 -0.50 0.17 0.41 -0.10 0.00 0.00 175.22 175.20 2hpa n GLY 1036N -1.73 -0.36 3.17 4.36 0.00 -0.42 -4.95 105.19 105.26 2hpa n GLY 1036Ca 0.07 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 2hpa n GLY 1036CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2hpa s GLN 1037N -5.10 2.58 0.13 1.61 2.00 -1.26 -4.41 119.66 115.21 2hpa s GLN 1037Ca 0.08 -0.75 -0.31 0.00 -2.00 0.00 0.00 55.36 52.38 2hpa s GLN 1037Cb -0.04 -2.01 -0.10 0.00 0.80 0.00 0.00 33.01 31.66 2hpa s GLN 1037CO 0.10 0.17 1.69 -1.17 -0.50 0.00 0.00 175.29 175.58 2hpa s LEU 1038N 0.35 4.38 0.00 3.68 2.96 -1.26 -1.73 118.68 127.06 2hpa s LEU 1038Ca -0.15 2.65 -0.05 0.00 -0.22 0.00 0.00 54.13 56.35 2hpa s LEU 1038Cb -0.17 -3.58 0.14 0.00 0.50 0.00 0.00 46.19 43.09 2hpa s LEU 1038CO 0.07 -0.92 0.92 0.35 -1.32 0.00 0.00 176.35 175.45 2hpa n THR 1039N 4.43 0.00 -0.10 3.68 -2.24 -1.11 -4.94 114.28 114.00 2hpa n THR 1039Ca 0.16 -1.09 -0.12 0.00 -2.27 0.00 0.00 64.05 60.73 2hpa n THR 1039Cb 0.39 -1.23 0.01 0.00 -2.10 0.00 0.00 70.33 67.39 2hpa n THR 1039CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2hpa h GLN 1040N 0.00 0.87 -0.16 -0.78 1.08 -1.95 -2.59 115.11 111.58 2hpa h GLN 1040Ca -0.30 -0.45 0.03 0.00 -1.45 0.00 0.00 58.65 56.48 2hpa h GLN 1040Cb 0.98 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.40 2hpa h GLN 1040CO 0.27 1.09 -0.03 1.25 -0.95 0.00 0.00 178.83 180.46 2hpa h LEU 1041N 0.72 -0.13 -2.39 1.46 5.85 -1.94 0.74 115.31 119.62 2hpa h LEU 1041Ca 0.06 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2hpa h LEU 1041Cb 0.95 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 2hpa h LEU 1041CO 0.09 -0.04 -0.03 1.23 -0.34 0.00 0.00 178.44 179.34 2hpa h GLY 1042N 0.01 0.00 0.22 3.75 0.00 -1.67 0.31 103.07 105.69 2hpa h GLY 1042Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2hpa h GLY 1042CO -0.16 0.00 -0.01 -0.33 0.00 0.00 0.00 176.54 176.05 2hpa h MET 1043N 0.00 -0.02 -0.67 4.80 2.86 -0.58 -2.76 114.93 118.55 2hpa h MET 1043Ca -0.00 0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.77 2hpa h MET 1043Cb 0.15 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.72 2hpa h MET 1043CO 0.00 0.70 0.21 0.93 1.06 0.00 0.00 176.91 179.82 2hpa h GLU 1044N -0.80 0.34 -0.87 1.72 5.08 0.61 0.42 114.58 121.08 2hpa h GLU 1044Ca -0.00 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.46 2hpa h GLU 1044Cb 0.74 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 2hpa h GLU 1044CO 0.00 0.22 0.56 1.96 -1.00 0.00 0.00 179.01 180.76 2hpa h GLN 1045N 0.35 0.72 0.00 2.33 4.20 -0.48 0.86 115.11 123.09 2hpa h GLN 1045Ca 0.36 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.03 2hpa h GLN 1045Cb 0.54 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2hpa h GLN 1045CO -0.40 0.48 -0.74 0.45 -0.67 0.00 0.00 178.83 177.94 2hpa h HIS 1046N 0.74 0.00 -0.11 2.96 3.86 -0.81 -2.43 115.15 119.37 2hpa h HIS 1046Ca 0.42 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.44 2hpa h HIS 1046Cb 0.59 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.05 2hpa h HIS 1046CO -0.00 0.00 -0.71 -0.92 0.86 0.00 0.00 177.93 177.15 2hpa h TYR 1047N 0.00 0.69 -0.19 2.45 3.20 0.11 -0.61 116.97 122.62 2hpa h TYR 1047Ca 0.00 -0.30 -0.07 0.00 3.14 0.00 0.00 58.73 61.51 2hpa h TYR 1047Cb 0.96 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.12 2hpa h TYR 1047CO 0.00 1.07 -0.14 1.49 -1.64 0.00 0.00 178.16 178.94 2hpa h GLU 1048N 0.36 0.43 -0.55 1.82 4.22 -1.01 -2.01 114.58 117.85 2hpa h GLU 1048Ca -0.03 -0.21 0.04 0.00 0.08 0.00 0.00 59.36 59.25 2hpa h GLU 1048Cb 1.30 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.50 2hpa h GLU 1048CO 0.13 0.76 0.29 1.25 -2.18 0.00 0.00 179.01 179.26 2hpa h LEU 1049N 0.11 0.43 -0.89 1.64 6.46 -1.26 -1.58 115.31 120.22 2hpa h LEU 1049Ca 0.04 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 2hpa h LEU 1049Cb 0.66 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.48 2hpa h LEU 1049CO 0.04 0.30 0.47 1.23 -0.62 0.00 0.00 178.44 179.86 2hpa h GLY 1050N 0.56 1.34 1.31 3.75 0.00 -1.01 -2.16 103.07 106.87 2hpa h GLY 1050Ca 0.24 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 2hpa h GLY 1050CO -0.15 0.60 0.17 0.83 0.00 0.00 0.00 176.54 177.98 2hpa h GLU 1051N 1.25 0.87 -0.04 4.80 5.08 -0.54 -1.70 114.58 124.30 2hpa h GLU 1051Ca 0.31 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2hpa h GLU 1051Cb 0.05 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2hpa h GLU 1051CO -0.05 0.76 0.01 -0.92 -1.00 0.00 0.00 179.01 177.81 2hpa h TYR 1052N 0.84 0.07 0.00 4.33 3.20 -1.13 -2.13 116.97 122.15 2hpa h TYR 1052Ca 0.19 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 2hpa h TYR 1052Cb 0.26 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 2hpa h TYR 1052CO 0.02 0.29 -0.10 0.82 -1.64 0.00 0.00 178.16 177.54 2hpa h ILE 1053N -0.17 0.93 0.45 1.81 1.08 -1.21 0.12 117.51 120.51 2hpa h ILE 1053Ca 0.01 -0.36 -0.02 0.00 -0.39 0.00 0.00 64.86 64.10 2hpa h ILE 1053Cb 0.25 1.20 0.00 0.00 -3.07 0.00 0.00 36.82 35.21 2hpa h ILE 1053CO 0.00 0.10 -0.22 -0.09 -0.69 0.00 0.00 178.15 177.25 2hpa h ARG 1054N 0.00 -0.58 0.34 2.37 2.43 -1.02 -2.44 114.38 115.48 2hpa h ARG 1054Ca -0.00 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2hpa h ARG 1054Cb 0.19 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2hpa h ARG 1054CO 0.01 -0.28 -0.49 0.87 -1.51 0.00 0.00 179.97 178.57 2hpa h LYS 1055N -0.85 -0.84 -1.11 0.20 1.57 -0.82 0.18 116.57 114.90 2hpa h LYS 1055Ca -0.06 0.06 0.31 0.00 -1.87 0.00 0.00 60.65 59.08 2hpa h LYS 1055Cb 0.56 0.19 -0.08 0.00 0.08 0.00 0.00 32.23 32.98 2hpa h LYS 1055CO 0.10 -0.56 0.74 -0.09 -0.57 0.00 0.00 179.45 179.07 2hpa h ARG 1056N -0.87 0.25 -0.21 3.15 2.43 -0.84 0.92 114.38 119.22 2hpa h ARG 1056Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2hpa h ARG 1056Cb 0.80 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 2hpa h ARG 1056CO -0.15 0.16 0.00 0.66 -1.51 0.00 0.00 179.97 179.14 2hpa n TYR 1057N -4.51 0.75 -0.41 2.20 4.01 -0.92 -4.73 117.16 113.55 2hpa n TYR 1057Ca 0.27 -0.90 0.39 0.00 -0.16 0.00 0.00 57.90 57.50 2hpa n TYR 1057Cb 1.04 -0.28 0.72 0.00 -0.31 0.00 0.00 39.34 40.50 2hpa n TYR 1057CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2hpa h ARG 1058N 1.43 0.00 0.00 -0.72 2.43 0.20 0.14 114.38 117.85 2hpa h ARG 1058Ca 0.00 0.00 -0.38 0.00 -0.81 0.00 0.00 59.98 58.79 2hpa h ARG 1058Cb 1.35 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.83 2hpa h ARG 1058CO 0.18 0.00 -2.43 1.63 -1.51 0.00 0.00 179.97 177.83 2hpa n LYS 1059N -3.85 0.66 0.41 0.20 5.02 -1.26 -4.52 118.16 114.83 2hpa n LYS 1059Ca 0.31 0.11 -0.19 0.00 -2.02 0.00 0.00 58.31 56.52 2hpa n LYS 1059Cb 1.54 -1.51 -0.09 0.00 -0.02 0.00 0.00 35.03 34.95 2hpa n LYS 1059CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2hpa h PHE 1060N 0.00 -0.94 -3.77 2.13 3.57 -1.09 -3.34 116.94 113.50 2hpa h PHE 1060Ca -0.56 -0.02 -0.78 0.00 3.53 0.00 0.00 57.97 60.14 2hpa h PHE 1060Cb 1.96 0.31 -0.27 0.00 2.79 0.00 0.00 35.95 40.74 2hpa h PHE 1060CO 0.02 -0.58 0.03 -0.51 -2.23 0.00 0.00 178.31 175.04 2hpa s LEU 1061N -10.01 6.56 -0.67 0.59 1.43 -0.67 -4.93 118.68 110.97 2hpa s LEU 1061Ca -0.18 -2.69 -0.02 0.00 -1.03 0.00 0.00 54.13 50.21 2hpa s LEU 1061Cb 0.03 -2.16 0.45 0.00 0.03 0.00 0.00 46.19 44.53 2hpa s LEU 1061CO 0.61 -0.55 2.03 -0.46 0.23 0.00 0.00 176.35 178.21 2hpa n ASN 1062N 3.94 7.70 -3.55 2.29 0.23 -1.26 -4.77 115.26 119.85 2hpa n ASN 1062Ca 0.12 -3.79 -0.07 0.00 -0.53 0.00 0.00 54.58 50.31 2hpa n ASN 1062Cb 0.46 -0.98 -0.08 0.00 -2.08 0.00 0.00 39.78 37.10 2hpa n ASN 1062CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2hpa s GLU 1063N -3.84 0.38 -0.88 -3.83 8.01 -1.26 -5.08 118.70 112.20 2hpa s GLU 1063Ca 0.65 0.97 -0.24 0.00 0.01 0.00 0.00 54.97 56.36 2hpa s GLU 1063Cb 0.51 0.23 -0.18 0.00 -4.31 0.00 0.00 34.13 30.37 2hpa s GLU 1063CO -0.02 -0.36 2.22 -1.13 0.01 0.00 0.00 175.26 175.97 2hpa n SER 1064N 5.39 1.21 -1.54 -0.19 3.41 -1.26 -4.34 113.62 116.30 2hpa n SER 1064Ca -0.07 -1.80 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 2hpa n SER 1064Cb 0.50 -1.56 0.00 0.00 -0.26 0.00 0.00 64.21 62.88 2hpa n SER 1064CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hpa n TYR 1065N 17.65 -3.86 -3.44 7.33 9.36 -1.26 -4.91 117.16 138.03 2hpa n TYR 1065Ca 0.44 2.08 -0.16 0.00 3.32 0.00 0.00 57.90 63.58 2hpa n TYR 1065Cb 0.43 -3.27 -0.11 0.00 -0.63 0.00 0.00 39.34 35.76 2hpa n TYR 1065CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2hpa s LYS 1066N -2.21 0.26 0.57 2.98 1.02 -1.26 -5.04 119.74 116.06 2hpa s LYS 1066Ca 0.00 0.17 0.39 0.00 0.02 0.00 0.00 55.97 56.55 2hpa s LYS 1066Cb 0.00 -0.92 1.49 0.00 -0.52 0.00 0.00 37.83 37.88 2hpa s LYS 1066CO 0.00 -0.75 1.64 1.12 -0.92 0.00 0.00 175.35 176.44 2hpa h HIS 1067N 8.27 0.00 0.00 3.18 2.07 -1.98 0.53 115.15 127.23 2hpa h HIS 1067Ca -0.17 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.35 2hpa h HIS 1067Cb 1.13 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.11 2hpa h HIS 1067CO 0.17 0.00 0.00 -0.85 -3.07 0.00 0.00 177.93 174.18 2hpa n GLU 1068N -3.87 0.73 0.00 5.12 0.00 -1.26 -3.54 120.64 117.82 2hpa n GLU 1068Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.46 2hpa n GLU 1068Cb 1.49 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 31.43 2hpa n GLU 1068CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2hpa n GLN 1069N -1.05 1.51 -4.37 3.44 6.02 0.18 -4.35 117.38 118.75 2hpa n GLN 1069Ca 0.18 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.91 2hpa n GLN 1069Cb 0.11 -0.91 -0.13 0.00 1.02 0.00 0.00 30.24 30.33 2hpa n GLN 1069CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2hpa s VAL 1070N -1.69 1.89 -0.15 5.09 1.01 -1.05 -0.50 120.40 125.00 2hpa s VAL 1070Ca 0.00 -1.57 -0.09 0.00 0.00 0.00 0.00 61.98 60.32 2hpa s VAL 1070Cb 0.00 -1.69 0.05 0.00 0.00 0.00 0.00 36.38 34.74 2hpa s VAL 1070CO 0.00 0.02 0.38 -0.47 0.00 0.00 0.00 175.10 175.03 2hpa s TYR 1071N -1.09 -0.53 -0.04 5.22 6.14 -0.67 -4.72 117.35 121.66 2hpa s TYR 1071Ca 0.09 1.16 0.05 0.00 0.64 0.00 0.00 57.07 59.01 2hpa s TYR 1071Cb -0.10 0.21 -0.01 0.00 0.42 0.00 0.00 41.96 42.48 2hpa s TYR 1071CO 0.04 -0.30 -0.20 0.42 0.64 0.00 0.00 175.55 176.16 2hpa s ILE 1072N 1.18 1.61 -0.02 3.14 1.09 -1.26 -0.05 121.20 126.89 2hpa s ILE 1072Ca -0.08 -0.83 0.02 0.00 -1.10 0.00 0.00 60.65 58.66 2hpa s ILE 1072Cb -0.08 -1.36 0.00 0.00 -1.06 0.00 0.00 42.46 39.96 2hpa s ILE 1072CO -0.10 0.46 -0.06 -0.60 -0.10 0.00 0.00 174.94 174.53 2hpa s ARG 1073N -0.12 0.65 0.14 2.79 3.52 -0.19 -1.35 118.95 124.40 2hpa s ARG 1073Ca -0.01 -0.21 0.03 0.00 -0.13 0.00 0.00 55.73 55.41 2hpa s ARG 1073Cb -0.11 -0.64 -0.04 0.00 -1.56 0.00 0.00 34.95 32.59 2hpa s ARG 1073CO 0.02 0.08 -0.08 0.45 -0.81 0.00 0.00 175.30 174.96 2hpa s SER 1074N 0.16 1.57 0.53 -2.12 0.15 0.13 -0.40 113.70 113.72 2hpa s SER 1074Ca -0.02 -1.03 -0.18 0.00 0.70 0.00 0.00 55.95 55.42 2hpa s SER 1074Cb -0.06 0.03 -0.07 0.00 -1.71 0.00 0.00 66.02 64.21 2hpa s SER 1074CO -0.00 -0.40 1.03 0.42 1.20 0.00 0.00 173.24 175.49 2hpa s THR 1075N -3.44 3.98 -1.36 6.45 -4.23 -1.19 -4.22 115.64 111.64 2hpa s THR 1075Ca 0.17 1.07 -0.13 0.00 -1.18 0.00 0.00 61.69 61.61 2hpa s THR 1075Cb 0.04 -3.49 -0.03 0.00 1.34 0.00 0.00 72.50 70.36 2hpa s THR 1075CO -0.00 -0.43 2.37 -0.67 -0.54 0.00 0.00 174.62 175.35 2hpa n ASP 1076N -1.45 5.09 -3.72 3.99 2.03 -1.24 -4.26 116.55 116.98 2hpa n ASP 1076Ca 0.08 -2.70 -0.19 0.00 0.52 0.00 0.00 54.79 52.51 2hpa n ASP 1076Cb 0.53 -1.50 -0.17 0.00 -0.72 0.00 0.00 41.12 39.26 2hpa n ASP 1076CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2hpa s VAL 1077N 3.21 -0.04 0.24 5.18 1.01 -1.26 -4.72 120.40 124.02 2hpa s VAL 1077Ca 0.54 0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.76 2hpa s VAL 1077Cb 0.15 -0.17 0.37 0.00 0.00 0.00 0.00 36.38 36.73 2hpa s VAL 1077CO -0.05 0.16 1.34 0.47 0.00 0.00 0.00 175.10 177.02 2hpa n ASP 1078N 4.87 -0.34 -0.37 3.32 9.92 -1.26 -0.52 116.55 132.17 2hpa n ASP 1078Ca -0.12 1.48 0.00 0.00 -0.53 0.00 0.00 54.79 55.62 2hpa n ASP 1078Cb 0.50 -0.43 0.14 0.00 -0.64 0.00 0.00 41.12 40.69 2hpa n ASP 1078CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 2hpa h ARG 1079N 0.00 1.21 0.00 -1.24 0.11 -1.95 0.56 114.38 113.07 2hpa h ARG 1079Ca 0.40 -0.07 -0.14 0.00 0.10 0.00 0.00 59.98 60.26 2hpa h ARG 1079Cb 0.61 -0.27 -0.02 0.00 1.11 0.00 0.00 29.97 31.40 2hpa h ARG 1079CO -0.88 0.80 -0.75 1.79 0.10 0.00 0.00 179.97 181.03 2hpa h THR 1080N 1.25 1.02 0.05 0.08 1.35 -1.09 -2.20 112.91 113.36 2hpa h THR 1080Ca 0.40 -2.48 -0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2hpa h THR 1080Cb 0.02 2.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2hpa h THR 1080CO -0.13 0.58 -0.02 -0.07 -0.25 0.00 0.00 175.52 175.62 2hpa h LEU 1081N 0.00 -0.06 -1.63 3.87 -0.00 -0.19 -2.66 115.31 114.65 2hpa h LEU 1081Ca -0.03 -0.55 -0.03 0.00 -0.00 0.00 0.00 57.88 57.28 2hpa h LEU 1081Cb 1.51 0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 42.18 2hpa h LEU 1081CO 0.08 0.55 -0.06 0.24 -0.00 0.00 0.00 178.44 179.24 2hpa h MET 1082N -0.70 0.16 -0.01 1.13 2.86 0.01 -1.27 114.93 117.10 2hpa h MET 1082Ca -0.01 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2hpa h MET 1082Cb 0.60 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 2hpa h MET 1082CO 0.01 0.24 0.01 0.77 1.06 0.00 0.00 176.91 178.99 2hpa h SER 1083N 0.15 0.02 -0.22 1.22 0.02 -1.39 -0.78 113.55 112.58 2hpa h SER 1083Ca 0.04 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2hpa h SER 1083Cb 0.22 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 2hpa h SER 1083CO 0.01 0.15 0.13 0.00 -1.14 0.00 0.00 176.83 175.98 2hpa h ALA 1084N 0.86 0.28 -0.70 3.77 0.00 -1.04 -0.89 119.26 121.53 2hpa h ALA 1084Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2hpa h ALA 1084Cb 0.14 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2hpa h ALA 1084CO -0.00 -0.21 0.41 0.52 0.00 0.00 0.00 179.25 179.97 2hpa h MET 1085N 0.26 0.74 -0.39 0.00 2.86 -1.11 0.11 114.93 117.41 2hpa h MET 1085Ca 0.08 -0.04 -0.15 0.00 -2.06 0.00 0.00 59.70 57.52 2hpa h MET 1085Cb 0.03 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2hpa h MET 1085CO -0.01 0.49 -0.36 1.15 1.06 0.00 0.00 176.91 179.24 2hpa h THR 1086N 0.77 1.27 0.26 2.22 2.02 -0.88 -2.30 112.91 116.27 2hpa h THR 1086Ca 0.31 -1.53 -0.01 0.00 0.77 0.00 0.00 66.41 65.94 2hpa h THR 1086Cb 0.14 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 2hpa h THR 1086CO -0.16 0.51 -0.13 -1.13 0.37 0.00 0.00 175.52 174.98 2hpa h ASN 1087N 0.75 -0.31 0.28 4.18 -0.73 -0.73 -2.47 115.58 116.55 2hpa h ASN 1087Ca 0.07 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.24 2hpa h ASN 1087Cb 0.94 0.08 -0.00 0.00 0.27 0.00 0.00 38.32 39.61 2hpa h ASN 1087CO 0.09 -0.22 -0.04 -0.07 -0.37 0.00 0.00 177.43 176.82 2hpa h LEU 1088N -0.35 0.00 -1.66 0.34 3.38 -0.68 -1.95 115.31 114.39 2hpa h LEU 1088Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2hpa h LEU 1088Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2hpa h LEU 1088CO 0.05 0.04 -0.15 0.00 0.09 0.00 0.00 178.44 178.48 2hpa h ALA 1089N 1.96 1.16 0.00 1.53 0.00 -0.92 -1.32 119.26 121.66 2hpa h ALA 1089Ca -0.00 -0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.45 2hpa h ALA 1089Cb 0.20 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 2hpa h ALA 1089CO 0.01 0.18 -2.06 0.00 0.00 0.00 0.00 179.25 177.38 2hpa n ALA 1090N -2.24 1.54 0.08 0.00 0.00 -0.75 -4.33 120.51 114.81 2hpa n ALA 1090Ca -0.01 -1.05 -0.20 0.00 0.00 0.00 0.00 53.44 52.17 2hpa n ALA 1090Cb 0.30 -0.50 -0.11 0.00 0.00 0.00 0.00 19.45 19.14 2hpa n ALA 1090CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2hpa h LEU 1091N 0.00 0.80 -6.04 0.00 6.46 -1.35 -3.39 115.31 111.80 2hpa h LEU 1091Ca -0.41 -0.72 -0.59 0.00 -0.12 0.00 0.00 57.88 56.04 2hpa h LEU 1091Cb 2.10 -0.25 -0.41 0.00 -0.73 0.00 0.00 40.66 41.37 2hpa h LEU 1091CO 0.05 1.53 -0.72 0.49 -0.62 0.00 0.00 178.44 179.17 2hpa n PHE 1092N -3.77 2.83 -2.34 1.25 3.72 -0.51 -4.82 117.46 113.81 2hpa n PHE 1092Ca -0.12 -4.01 -0.38 0.00 -0.05 0.00 0.00 57.45 52.89 2hpa n PHE 1092Cb 0.95 -0.51 -0.02 0.00 -0.94 0.00 0.00 39.48 38.96 2hpa n PHE 1092CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2hpa s PRO 1093N -2.36 4.11 -0.00 -1.08 0.02 -1.26 -4.72 135.00 129.70 2hpa s PRO 1093Ca 0.40 1.79 -0.30 0.00 0.02 0.00 0.00 61.00 62.91 2hpa s PRO 1093Cb 0.18 -2.69 -0.08 0.00 0.02 0.00 0.00 34.50 31.92 2hpa s PRO 1093CO -0.05 -0.26 1.96 -2.14 -0.33 0.00 0.00 177.00 176.19 2hpa s PRO 1094N -2.27 4.03 -0.21 5.54 0.02 -1.26 -4.87 135.00 135.99 2hpa s PRO 1094Ca 0.56 2.50 -0.04 0.00 0.02 0.00 0.00 61.00 64.04 2hpa s PRO 1094Cb -0.30 -4.17 -0.01 0.00 0.02 0.00 0.00 34.50 30.05 2hpa s PRO 1094CO 0.37 -1.07 -0.05 -1.21 -0.33 0.00 0.00 177.00 174.71 2hpa s GLU 1095N 4.63 3.41 6.46 5.54 0.41 -1.26 -4.57 118.70 133.31 2hpa s GLU 1095Ca 0.88 -0.62 0.00 0.00 -0.41 0.00 0.00 54.97 54.82 2hpa s GLU 1095Cb -0.40 -2.97 0.00 0.00 -1.78 0.00 0.00 34.13 28.98 2hpa s GLU 1095CO 0.40 -0.11 0.00 0.41 -0.49 0.00 0.00 175.26 175.46 2hpa n GLY 1096N 4.54 3.92 0.34 -1.39 0.00 -1.26 -1.88 105.19 109.46 2hpa n GLY 1096Ca -0.18 0.17 0.18 0.00 0.00 0.00 0.00 46.02 46.19 2hpa n GLY 1096CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2hpa h VAL 1097N 0.00 0.17 0.00 1.61 3.04 -2.03 -0.67 116.25 118.37 2hpa h VAL 1097Ca 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.67 2hpa h VAL 1097Cb 0.00 0.83 -0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2hpa h VAL 1097CO 0.00 0.00 -0.09 -1.28 -1.01 0.00 0.00 177.57 175.19 2hpa h SER 1098N 0.00 0.00 -2.63 3.17 0.87 -1.72 -3.40 113.55 109.84 2hpa h SER 1098Ca 0.03 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.05 2hpa h SER 1098Cb 0.41 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.30 2hpa h SER 1098CO -0.00 0.09 1.07 -0.63 -0.53 0.00 0.00 176.83 176.84 2hpa s ILE 1099N -4.24 3.78 -0.11 2.23 1.01 -0.26 -4.72 121.20 118.88 2hpa s ILE 1099Ca -0.03 0.57 0.16 0.00 0.00 0.00 0.00 60.65 61.35 2hpa s ILE 1099Cb 0.13 -4.69 -0.11 0.00 0.01 0.00 0.00 42.46 37.80 2hpa s ILE 1099CO 0.57 -1.51 0.94 4.11 0.00 0.00 0.00 174.94 179.05 2hpa h TRP 1100N 10.52 0.00 -3.36 3.97 5.08 -1.86 -3.43 115.95 126.87 2hpa h TRP 1100Ca -0.27 0.00 -0.56 0.00 1.08 0.00 0.00 58.89 59.14 2hpa h TRP 1100Cb 1.07 0.00 -0.38 0.00 -3.00 0.00 0.00 29.16 26.85 2hpa h TRP 1100CO 1.08 0.61 -0.79 1.21 -1.28 0.00 0.00 178.44 179.26 2hpa s ASN 1101N -5.95 2.96 0.37 0.11 3.84 -1.26 -5.01 114.94 110.01 2hpa s ASN 1101Ca -0.02 -0.73 0.27 0.00 0.21 0.00 0.00 52.86 52.59 2hpa s ASN 1101Cb 0.08 -0.96 0.87 0.00 -0.55 0.00 0.00 41.25 40.70 2hpa s ASN 1101CO 0.80 -0.19 1.77 1.55 -2.79 0.00 0.00 177.10 178.25 2hpa h PRO 1102N 8.09 0.00 -0.05 0.43 0.13 -1.98 -3.09 132.00 135.53 2hpa h PRO 1102Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2hpa h PRO 1102Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2hpa h PRO 1102CO 0.41 0.00 0.00 -0.89 -0.23 0.00 0.00 178.00 177.29 2hpa n ILE 1103N -2.69 0.02 -3.51 -3.56 -0.00 -1.26 -4.71 119.36 103.65 2hpa n ILE 1103Ca 0.03 -0.51 -0.26 0.00 -0.00 0.00 0.00 62.75 62.01 2hpa n ILE 1103Cb 0.38 1.47 -0.14 0.00 -0.00 0.00 0.00 39.64 41.35 2hpa n ILE 1103CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 2hpa s LEU 1104N -1.98 0.33 -1.35 1.39 2.96 -1.17 -5.05 118.68 113.81 2hpa s LEU 1104Ca 0.29 -1.09 -0.16 0.00 -0.22 0.00 0.00 54.13 52.94 2hpa s LEU 1104Cb 0.20 -0.13 0.07 0.00 0.50 0.00 0.00 46.19 46.83 2hpa s LEU 1104CO 0.30 -0.42 1.91 0.18 -1.32 0.00 0.00 176.35 177.00 2hpa n LEU 1105N 5.27 5.75 -3.69 -0.68 4.77 -1.26 -4.48 117.00 122.67 2hpa n LEU 1105Ca -0.05 -4.06 -0.14 0.00 -0.03 0.00 0.00 56.01 51.72 2hpa n LEU 1105Cb 0.44 -1.70 -0.08 0.00 -2.33 0.00 0.00 43.42 39.75 2hpa n LEU 1105CO 0.04 0.59 0.16 0.86 -1.33 0.00 0.00 177.39 177.71 2hpa s TRP 1106N 3.55 -0.40 -0.00 -1.77 -0.00 -1.26 -4.56 118.94 114.49 2hpa s TRP 1106Ca 0.50 0.79 0.00 0.00 -0.00 0.00 0.00 56.10 57.40 2hpa s TRP 1106Cb 0.08 0.20 0.00 0.00 -0.00 0.00 0.00 33.47 33.74 2hpa s TRP 1106CO 0.01 -0.40 -0.01 1.14 -0.00 0.00 0.00 176.95 177.69 2hpa s GLN 1107N -0.78 0.11 0.06 5.86 -2.07 -1.26 -4.78 119.66 116.81 2hpa s GLN 1107Ca -0.09 -0.03 -0.31 0.00 -1.82 0.00 0.00 55.36 53.12 2hpa s GLN 1107Cb -0.03 -0.14 -0.07 0.00 -1.09 0.00 0.00 33.01 31.68 2hpa s GLN 1107CO 0.04 0.01 1.52 -1.25 -1.32 0.00 0.00 175.29 174.29 2hpa s PRO 1108N 0.10 4.25 -0.10 9.60 0.04 -1.26 -5.00 135.00 142.63 2hpa s PRO 1108Ca -0.01 2.17 0.02 0.00 0.04 0.00 0.00 61.00 63.22 2hpa s PRO 1108Cb -0.02 -3.48 0.01 0.00 0.04 0.00 0.00 34.50 31.05 2hpa s PRO 1108CO -0.00 -0.62 -0.14 0.42 0.04 0.00 0.00 177.00 176.70 2hpa s ILE 1109N 2.14 1.40 0.18 0.56 1.01 -1.26 -5.11 121.20 120.11 2hpa s ILE 1109Ca 0.69 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 2hpa s ILE 1109Cb -0.37 -1.28 -0.08 0.00 0.01 0.00 0.00 42.46 40.74 2hpa s ILE 1109CO 0.30 0.42 1.23 -2.16 0.00 0.00 0.00 174.94 174.73 2hpa s PRO 1110N 0.94 4.46 -0.23 2.79 0.04 -1.26 -4.99 135.00 136.74 2hpa s PRO 1110Ca -0.08 1.92 -0.03 0.00 0.04 0.00 0.00 61.00 62.85 2hpa s PRO 1110Cb -0.15 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.16 2hpa s PRO 1110CO -0.00 -0.15 -0.05 0.08 0.04 0.00 0.00 177.00 176.91 2hpa s VAL 1111N 0.09 3.12 0.20 -0.36 1.01 -1.26 -4.41 120.40 118.79 2hpa s VAL 1111Ca 0.54 -0.75 -0.17 0.00 0.00 0.00 0.00 61.98 61.60 2hpa s VAL 1111Cb -0.33 -2.49 -0.08 0.00 0.00 0.00 0.00 36.38 33.47 2hpa s VAL 1111CO 0.36 0.31 0.66 -1.00 0.00 0.00 0.00 175.10 175.43 2hpa s HIS 1112N 1.41 3.62 0.32 5.22 3.76 -0.46 -4.88 115.29 124.27 2hpa s HIS 1112Ca 0.03 1.25 -0.06 0.00 -0.15 0.00 0.00 55.06 56.13 2hpa s HIS 1112Cb -0.15 -2.52 0.00 0.00 1.11 0.00 0.00 32.58 31.02 2hpa s HIS 1112CO -0.04 0.36 0.49 -0.08 -0.85 0.00 0.00 174.74 174.62 2hpa s THR 1113N -1.52 0.00 0.05 1.30 -1.32 -1.26 0.21 115.64 113.09 2hpa s THR 1113Ca 0.42 -1.52 -0.14 0.00 -1.21 0.00 0.00 61.69 59.24 2hpa s THR 1113Cb -0.16 -2.55 0.02 0.00 -1.51 0.00 0.00 72.50 68.30 2hpa s THR 1113CO 0.20 0.00 0.30 -0.69 -2.21 0.00 0.00 174.62 172.22 2hpa s VAL 1114N -3.27 0.08 0.21 5.08 1.01 -1.26 -5.01 120.40 117.24 2hpa s VAL 1114Ca 0.28 -0.69 -0.32 0.00 0.00 0.00 0.00 61.98 61.25 2hpa s VAL 1114Cb -0.01 -0.95 -0.14 0.00 0.00 0.00 0.00 36.38 35.29 2hpa s VAL 1114CO 0.16 -0.38 1.47 -2.65 0.00 0.00 0.00 175.10 173.70 2hpa n PRO 1115N 0.56 2.04 -0.16 2.72 -0.02 -1.26 -3.73 135.00 135.15 2hpa n PRO 1115Ca -0.18 0.73 -0.03 0.00 -2.02 0.00 0.00 63.50 62.00 2hpa n PRO 1115Cb 0.60 -2.43 0.03 0.00 -0.02 0.00 0.00 33.50 31.68 2hpa n PRO 1115CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2hpa h LEU 1116N 4.84 -0.49 -2.16 2.45 3.38 -1.97 0.81 115.31 122.16 2hpa h LEU 1116Ca -0.45 0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.68 2hpa h LEU 1116Cb 1.27 0.32 -0.00 0.00 0.09 0.00 0.00 40.66 42.34 2hpa h LEU 1116CO 0.80 -0.17 0.28 0.77 0.09 0.00 0.00 178.44 180.21 2hpa h SER 1117N -0.01 0.00 0.00 -0.43 4.64 -1.99 -1.04 113.55 114.73 2hpa h SER 1117Ca 0.24 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2hpa h SER 1117Cb 0.38 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2hpa h SER 1117CO -0.52 0.00 -0.05 -0.62 -0.87 0.00 0.00 176.83 174.77 2hpa n GLU 1118N -2.99 1.31 -2.85 4.77 1.02 0.26 -5.00 120.64 117.17 2hpa n GLU 1118Ca -0.02 -2.66 -0.43 0.00 -0.02 0.00 0.00 57.16 54.04 2hpa n GLU 1118Cb 0.34 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.21 2hpa n GLU 1118CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2hpa s ASP 1119N -2.92 6.50 -0.58 1.62 -1.08 -0.09 -4.74 116.67 115.38 2hpa s ASP 1119Ca 0.33 0.12 0.02 0.00 -0.52 0.00 0.00 52.55 52.50 2hpa s ASP 1119Cb 0.29 -2.44 0.41 0.00 -1.46 0.00 0.00 42.92 39.72 2hpa s ASP 1119CO 0.02 -1.00 1.62 1.67 0.52 0.00 0.00 175.17 177.99 2hpa n GLN 1120N 7.04 3.09 0.15 4.34 -0.06 -1.26 -4.59 117.38 126.09 2hpa n GLN 1120Ca 0.05 -3.86 0.00 0.00 -2.00 0.00 0.00 57.00 51.19 2hpa n GLN 1120Cb 0.48 -2.27 0.00 0.00 -4.06 0.00 0.00 30.24 24.39 2hpa n GLN 1120CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2hpa n LEU 1121N -0.65 -2.25 -0.05 1.69 7.94 -1.26 -4.93 117.00 117.49 2hpa n LEU 1121Ca 0.50 0.56 -0.11 0.00 -1.11 0.00 0.00 56.01 55.85 2hpa n LEU 1121Cb 0.60 2.24 -0.14 0.00 0.53 0.00 0.00 43.42 46.64 2hpa n LEU 1121CO 0.51 -0.13 -0.83 0.18 -1.11 0.00 0.00 177.39 176.01 2hpa n LEU 1122N -3.17 1.01 -3.54 -1.96 4.77 -1.26 -4.60 117.00 108.26 2hpa n LEU 1122Ca 0.00 0.21 -0.40 0.00 -0.03 0.00 0.00 56.01 55.80 2hpa n LEU 1122Cb 0.00 0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 2hpa n LEU 1122CO 0.00 0.53 2.84 0.00 -1.33 0.00 0.00 177.39 179.43 2hpa n TYR 1123N -3.03 2.85 -2.63 -1.77 9.36 -1.26 -4.62 117.16 116.06 2hpa n TYR 1123Ca -0.26 -2.83 -0.31 0.00 3.32 0.00 0.00 57.90 57.82 2hpa n TYR 1123Cb 1.08 -2.39 -0.03 0.00 -0.63 0.00 0.00 39.34 37.37 2hpa n TYR 1123CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 2hpa s LEU 1124N 1.29 3.71 0.26 2.98 1.02 -1.26 -4.29 118.68 122.39 2hpa s LEU 1124Ca 0.55 1.28 -0.22 0.00 0.02 0.00 0.00 54.13 55.76 2hpa s LEU 1124Cb 0.15 -4.20 -0.09 0.00 0.02 0.00 0.00 46.19 42.07 2hpa s LEU 1124CO -0.06 -0.50 0.80 -2.16 0.02 0.00 0.00 176.35 174.46 2hpa s PRO 1125N -4.05 4.36 -0.21 1.29 0.04 -1.26 -4.54 135.00 130.63 2hpa s PRO 1125Ca 0.54 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.31 2hpa s PRO 1125Cb -0.10 -2.83 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 2hpa s PRO 1125CO 0.33 0.34 1.52 -0.06 0.04 0.00 0.00 177.00 179.18 2hpa s PHE 1126N -1.57 2.29 -0.22 0.56 0.08 -1.26 -4.91 117.98 112.94 2hpa s PHE 1126Ca 0.46 0.62 0.21 0.00 0.12 0.00 0.00 56.93 58.34 2hpa s PHE 1126Cb -0.17 -3.90 -0.00 0.00 -0.57 0.00 0.00 43.02 38.38 2hpa s PHE 1126CO 0.22 -2.67 1.05 0.00 -0.10 0.00 0.00 175.22 173.72 2hpa h ARG 1127N 10.00 0.00 -1.00 0.44 2.47 -1.97 -3.36 114.38 120.97 2hpa h ARG 1127Ca -0.32 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.30 2hpa h ARG 1127Cb 1.14 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 29.40 2hpa h ARG 1127CO 1.00 0.08 0.13 0.27 0.56 0.00 0.00 179.97 182.01 2hpa n ASN 1128N -2.78 3.12 -4.17 7.04 6.94 -1.26 -4.69 115.26 119.46 2hpa n ASN 1128Ca -0.02 -2.33 -0.35 0.00 -0.02 0.00 0.00 54.58 51.86 2hpa n ASN 1128Cb 0.62 -0.57 -0.13 0.00 -2.36 0.00 0.00 39.78 37.34 2hpa n ASN 1128CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2hpa h PRO 1130N 8.00 -0.61 -0.97 0.00 0.11 -1.83 -2.42 132.00 134.27 2hpa h PRO 1130Ca -0.20 0.04 0.20 0.00 0.11 0.00 0.00 66.00 66.15 2hpa h PRO 1130Cb 1.06 0.14 -0.09 0.00 0.11 0.00 0.00 31.00 32.22 2hpa h PRO 1130CO 0.55 -0.41 0.61 -0.09 -0.21 0.00 0.00 178.00 178.46 2hpa h ARG 1131N -0.63 0.61 -0.34 1.05 9.65 -0.70 0.24 114.38 124.26 2hpa h ARG 1131Ca -0.06 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.68 2hpa h ARG 1131Cb 0.49 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 2hpa h ARG 1131CO 0.09 0.40 -0.19 0.35 2.80 0.00 0.00 179.97 183.42 2hpa h PHE 1132N 0.62 0.84 0.00 2.20 3.57 -1.76 0.32 116.94 122.74 2hpa h PHE 1132Ca 0.54 -0.22 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 2hpa h PHE 1132Cb 1.02 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.57 2hpa h PHE 1132CO -0.00 0.94 -0.10 1.96 -2.23 0.00 0.00 178.31 178.88 2hpa h GLN 1133N 0.50 0.00 0.03 1.11 1.08 -0.41 -0.26 115.11 117.15 2hpa h GLN 1133Ca 0.07 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2hpa h GLN 1133Cb 0.74 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 2hpa h GLN 1133CO 0.06 0.10 -0.01 1.49 -0.95 0.00 0.00 178.83 179.51 2hpa h GLU 1134N 0.00 -0.03 -0.83 1.46 4.81 0.63 -2.47 114.58 118.13 2hpa h GLU 1134Ca -0.00 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.38 2hpa h GLU 1134Cb 0.19 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.52 2hpa h GLU 1134CO 0.01 0.48 0.54 -0.07 -0.73 0.00 0.00 179.01 179.25 2hpa h LEU 1135N -0.57 0.54 0.38 1.64 3.38 0.73 -0.78 115.31 120.63 2hpa h LEU 1135Ca -0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2hpa h LEU 1135Cb 0.53 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2hpa h LEU 1135CO 0.01 0.28 -0.18 -0.33 0.09 0.00 0.00 178.44 178.30 2hpa h GLU 1136N 0.57 -0.50 -0.65 1.13 5.08 -0.98 -0.27 114.58 118.98 2hpa h GLU 1136Ca 0.41 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.95 2hpa h GLU 1136Cb 0.77 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 30.03 2hpa h GLU 1136CO -0.17 -0.22 0.02 0.77 -1.00 0.00 0.00 179.01 178.41 2hpa h SER 1137N -0.72 -0.26 0.43 1.42 0.02 -0.78 0.11 113.55 113.76 2hpa h SER 1137Ca -0.05 0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2hpa h SER 1137Cb 0.50 0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.31 2hpa h SER 1137CO 0.09 -0.12 -0.25 -0.33 -1.14 0.00 0.00 176.83 175.08 2hpa h GLU 1138N 0.13 -0.62 -0.89 3.45 5.08 -1.05 -2.65 114.58 118.03 2hpa h GLU 1138Ca 0.35 0.04 0.24 0.00 -1.00 0.00 0.00 59.36 58.99 2hpa h GLU 1138Cb 0.57 0.14 -0.15 0.00 0.50 0.00 0.00 28.75 29.81 2hpa h GLU 1138CO -0.55 -0.41 0.20 1.15 -1.00 0.00 0.00 179.01 178.39 2hpa h THR 1139N -0.64 0.25 -0.54 1.13 2.02 0.97 0.68 112.91 116.77 2hpa h THR 1139Ca -0.05 -0.05 0.07 0.00 0.77 0.00 0.00 66.41 67.15 2hpa h THR 1139Cb 0.52 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 66.96 2hpa h THR 1139CO 0.06 0.03 0.23 -0.07 0.37 0.00 0.00 175.52 176.13 2hpa h LEU 1140N 0.16 0.27 0.00 2.58 -0.00 -0.60 -0.01 115.31 117.71 2hpa h LEU 1140Ca 0.56 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 58.50 2hpa h LEU 1140Cb 1.16 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.83 2hpa h LEU 1140CO -0.71 0.18 0.00 0.29 -0.00 0.00 0.00 178.44 178.21 2hpa n LYS 1141N -4.95 0.22 -2.27 1.13 5.02 0.22 -4.53 118.16 113.00 2hpa n LYS 1141Ca 0.06 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.98 2hpa n LYS 1141Cb 0.20 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.68 2hpa n LYS 1141CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2hpa s SER 1142N -2.76 6.98 0.13 4.39 1.04 -0.02 -4.92 113.70 118.54 2hpa s SER 1142Ca 0.20 2.48 -0.18 0.00 0.48 0.00 0.00 55.95 58.93 2hpa s SER 1142Cb 0.18 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.63 2hpa s SER 1142CO 0.45 -0.39 1.79 1.05 0.98 0.00 0.00 173.24 177.11 2hpa h GLU 1143N 3.94 0.34 -0.63 4.02 4.11 -1.88 0.02 114.58 124.50 2hpa h GLU 1143Ca -0.47 -0.02 0.13 0.00 0.07 0.00 0.00 59.36 59.07 2hpa h GLU 1143Cb 1.22 -0.08 -0.10 0.00 0.50 0.00 0.00 28.75 30.29 2hpa h GLU 1143CO 0.68 0.23 0.06 1.49 0.07 0.00 0.00 179.01 181.54 2hpa h GLU 1144N 0.35 0.17 -0.23 1.06 4.57 -1.91 0.86 114.58 119.45 2hpa h GLU 1144Ca 0.10 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 2hpa h GLU 1144Cb -0.03 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 2hpa h GLU 1144CO -0.03 0.11 0.00 0.35 -1.18 0.00 0.00 179.01 178.26 2hpa h PHE 1145N 0.17 0.44 -0.51 0.92 3.57 -1.72 -2.86 116.94 116.95 2hpa h PHE 1145Ca 0.34 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.77 2hpa h PHE 1145Cb 0.55 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 2hpa h PHE 1145CO -0.32 0.58 0.34 1.96 -2.23 0.00 0.00 178.31 178.63 2hpa h GLN 1146N 0.18 0.66 -0.23 1.11 1.08 0.75 -0.73 115.11 117.92 2hpa h GLN 1146Ca 0.07 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2hpa h GLN 1146Cb 0.40 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 2hpa h GLN 1146CO 0.01 0.43 0.13 -0.22 -0.95 0.00 0.00 178.83 178.24 2hpa h LYS 1147N 0.68 0.32 -0.28 1.46 3.11 0.83 0.26 116.57 122.95 2hpa h LYS 1147Ca 0.19 -0.03 -0.15 0.00 -2.81 0.00 0.00 60.65 57.85 2hpa h LYS 1147Cb -0.05 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.11 2hpa h LYS 1147CO -0.04 0.27 -0.42 0.00 -2.81 0.00 0.00 179.45 176.45 2hpa h ARG 1148N 0.28 0.69 0.00 1.90 3.08 -1.22 -3.09 114.38 116.01 2hpa h ARG 1148Ca 0.08 -0.37 -0.06 0.00 0.07 0.00 0.00 59.98 59.71 2hpa h ARG 1148Cb 0.04 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2hpa h ARG 1148CO -0.01 0.98 -0.27 1.25 -1.07 0.00 0.00 179.97 180.85 2hpa h LEU 1149N 0.56 0.00 -0.20 3.04 5.85 -0.70 -3.36 115.31 120.50 2hpa h LEU 1149Ca 0.04 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.81 2hpa h LEU 1149Cb 0.96 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 2hpa h LEU 1149CO 0.09 0.27 -0.17 -0.74 -0.34 0.00 0.00 178.44 177.55 2hpa h HIS 1150N 0.00 -0.43 0.00 1.25 2.76 -0.40 -2.56 115.15 115.77 2hpa h HIS 1150Ca -0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2hpa h HIS 1150Cb 0.99 0.22 0.00 0.00 1.55 0.00 0.00 27.41 30.17 2hpa h HIS 1150CO 0.00 -0.24 0.30 -2.30 -1.30 0.00 0.00 177.93 174.39 2hpa n PRO 1151N -5.32 0.08 -0.01 5.26 -0.02 -1.26 -1.57 135.00 132.17 2hpa n PRO 1151Ca -0.02 0.55 0.08 0.00 -2.02 0.00 0.00 63.50 62.09 2hpa n PRO 1151Cb 0.24 -2.07 -0.12 0.00 -0.02 0.00 0.00 33.50 31.52 2hpa n PRO 1151CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2hpa n TYR 1152N -2.00 0.00 -0.15 6.00 4.01 -0.97 -4.74 117.16 119.31 2hpa n TYR 1152Ca -0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.77 2hpa n TYR 1152Cb 0.32 -0.33 0.08 0.00 -0.31 0.00 0.00 39.34 39.11 2hpa n TYR 1152CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2hpa n LYS 1153N -1.98 -0.04 -0.05 -0.72 4.01 -0.61 0.22 118.16 118.99 2hpa n LYS 1153Ca -0.02 0.65 -0.13 0.00 -0.51 0.00 0.00 58.31 58.30 2hpa n LYS 1153Cb 0.40 -0.99 -0.07 0.00 -0.51 0.00 0.00 35.03 33.86 2hpa n LYS 1153CO 0.00 0.00 0.00 0.22 -1.11 0.00 0.00 177.40 176.51 2hpa h ASP 1154N 0.00 0.32 0.15 4.39 3.58 -1.85 -2.02 116.42 120.99 2hpa h ASP 1154Ca 0.22 -0.45 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2hpa h ASP 1154Cb 0.38 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2hpa h ASP 1154CO -0.42 0.71 -0.15 0.15 -2.88 0.00 0.00 179.24 176.64 2hpa h PHE 1155N -0.06 -0.40 -0.29 0.28 3.57 -0.55 -1.19 116.94 118.30 2hpa h PHE 1155Ca 0.03 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.59 2hpa h PHE 1155Cb 0.61 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 39.42 2hpa h PHE 1155CO 0.08 -0.23 -0.33 0.82 -2.23 0.00 0.00 178.31 176.42 2hpa h ILE 1156N -0.33 0.25 -0.97 1.41 2.04 -1.16 0.29 117.51 119.04 2hpa h ILE 1156Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 2hpa h ILE 1156Cb 0.32 0.25 -0.08 0.00 -0.74 0.00 0.00 36.82 36.57 2hpa h ILE 1156CO -0.04 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.73 2hpa h ALA 1157N 0.62 1.58 -0.18 1.87 0.00 -1.06 -1.91 119.26 120.17 2hpa h ALA 1157Ca 0.14 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2hpa h ALA 1157Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2hpa h ALA 1157CO -0.46 0.18 -0.33 1.15 0.00 0.00 0.00 179.25 179.79 2hpa h THR 1158N 0.94 1.34 -0.58 0.00 2.02 -0.02 -3.24 112.91 113.38 2hpa h THR 1158Ca 0.48 -1.56 0.11 0.00 0.77 0.00 0.00 66.41 66.21 2hpa h THR 1158Cb 0.50 1.90 -0.09 0.00 -1.74 0.00 0.00 68.15 68.72 2hpa h THR 1158CO -0.24 0.48 0.06 0.25 0.37 0.00 0.00 175.52 176.44 2hpa h LEU 1159N 0.19 -0.12 -0.95 2.58 7.12 0.26 -1.95 115.31 122.44 2hpa h LEU 1159Ca 0.01 0.12 0.20 0.00 0.13 0.00 0.00 57.88 58.35 2hpa h LEU 1159Cb 0.92 0.20 -0.11 0.00 -0.53 0.00 0.00 40.66 41.13 2hpa h LEU 1159CO 0.07 -0.05 0.52 1.23 -0.13 0.00 0.00 178.44 180.08 2hpa h GLY 1160N 0.18 1.68 1.84 3.75 0.00 -1.40 0.58 103.07 109.70 2hpa h GLY 1160Ca 0.30 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 2hpa h GLY 1160CO -0.44 -0.16 -0.42 0.50 0.00 0.00 0.00 176.54 176.01 2hpa h LYS 1161N 0.59 0.18 0.06 4.80 1.79 -1.45 -1.41 116.57 121.14 2hpa h LYS 1161Ca 0.57 -0.09 -0.15 0.00 -2.18 0.00 0.00 60.65 58.80 2hpa h LYS 1161Cb 0.98 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.63 2hpa h LYS 1161CO -0.44 0.58 -0.74 -0.07 -1.08 0.00 0.00 179.45 177.69 2hpa h LEU 1162N 0.15 0.21 -0.54 2.94 3.38 -0.70 -3.37 115.31 117.38 2hpa h LEU 1162Ca 0.01 -0.88 -0.16 0.00 0.09 0.00 0.00 57.88 56.95 2hpa h LEU 1162Cb 0.82 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2hpa h LEU 1162CO 0.06 1.33 -0.55 0.77 0.09 0.00 0.00 178.44 180.14 2hpa h SER 1163N -0.67 0.58 0.00 -0.43 4.64 -0.05 -3.43 113.55 114.18 2hpa h SER 1163Ca -0.16 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2hpa h SER 1163Cb 1.40 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2hpa h SER 1163CO 0.02 1.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.60 2hpa n GLY 1164N 0.24 3.01 3.50 -0.77 0.00 -0.53 -1.78 105.19 108.86 2hpa n GLY 1164Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2hpa n GLY 1164CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2hpa s LEU 1165N 0.00 3.21 -0.08 0.99 2.34 -1.21 -4.89 118.68 119.03 2hpa s LEU 1165Ca 0.00 -0.13 -0.02 0.00 0.06 0.00 0.00 54.13 54.04 2hpa s LEU 1165Cb 0.00 -1.76 -0.03 0.00 -0.56 0.00 0.00 46.19 43.83 2hpa s LEU 1165CO 0.00 0.19 0.03 -1.00 -1.06 0.00 0.00 176.35 174.52 2hpa s HIS 1166N 0.21 3.23 0.00 3.48 3.76 -1.26 -4.20 115.29 120.51 2hpa s HIS 1166Ca -0.03 0.24 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 2hpa s HIS 1166Cb -0.14 -1.80 0.00 0.00 1.11 0.00 0.00 32.58 31.75 2hpa s HIS 1166CO 0.03 0.52 0.00 0.41 -0.85 0.00 0.00 174.74 174.85 2hpa n GLY 1167N 1.95 2.09 0.00 -2.22 0.00 -1.26 -4.98 105.19 100.77 2hpa n GLY 1167Ca -0.18 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2hpa n GLY 1167CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2hpa n GLN 1168N 0.00 0.00 -1.82 1.61 7.27 -1.26 -4.62 117.38 118.56 2hpa n GLN 1168Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.64 2hpa n GLN 1168Cb 0.00 -1.39 -0.03 0.00 2.41 0.00 0.00 30.24 31.24 2hpa n GLN 1168CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2hpa s ASP 1169N -1.96 6.14 0.56 1.69 2.15 -1.26 -4.83 116.67 119.16 2hpa s ASP 1169Ca 0.00 2.06 0.32 0.00 0.43 0.00 0.00 52.55 55.36 2hpa s ASP 1169Cb 0.00 -2.53 1.67 0.00 -0.30 0.00 0.00 42.92 41.76 2hpa s ASP 1169CO 0.00 -1.39 2.14 -0.07 -0.17 0.00 0.00 175.17 175.68 2hpa h LEU 1170N 12.30 0.00 -0.66 -1.34 3.38 -1.93 -0.80 115.31 126.26 2hpa h LEU 1170Ca -0.41 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.41 2hpa h LEU 1170Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2hpa h LEU 1170CO 0.97 0.07 -0.60 0.15 0.09 0.00 0.00 178.44 179.12 2hpa h PHE 1171N 0.00 0.30 0.52 1.13 3.04 -1.92 0.34 116.94 120.35 2hpa h PHE 1171Ca -0.00 -0.11 -0.03 0.00 3.98 0.00 0.00 57.97 61.81 2hpa h PHE 1171Cb 0.27 -0.05 0.01 0.00 2.56 0.00 0.00 35.95 38.73 2hpa h PHE 1171CO 0.00 0.77 -0.25 0.78 -2.02 0.00 0.00 178.31 177.59 2hpa h GLY 1172N 1.48 -0.73 -0.31 2.40 0.00 -1.50 -0.24 103.07 104.16 2hpa h GLY 1172Ca -0.01 0.27 0.24 0.00 0.00 0.00 0.00 47.33 47.83 2hpa h GLY 1172CO 0.09 -0.27 0.36 -2.22 0.00 0.00 0.00 176.54 174.51 2hpa h ILE 1173N -1.04 0.41 0.23 2.60 1.08 -1.20 0.30 117.51 119.88 2hpa h ILE 1173Ca -0.07 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 64.27 2hpa h ILE 1173Cb 0.62 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.41 2hpa h ILE 1173CO 0.12 0.06 -0.11 -0.25 -0.69 0.00 0.00 178.15 177.28 2hpa h TRP 1174N 0.33 -0.28 -0.58 1.37 7.01 -0.84 0.71 115.95 123.67 2hpa h TRP 1174Ca 0.57 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.50 2hpa h TRP 1174Cb 1.14 0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 28.27 2hpa h TRP 1174CO -0.16 -0.17 0.11 0.66 -2.79 0.00 0.00 178.44 176.08 2hpa h SER 1175N -0.50 0.90 0.70 2.65 4.64 -0.75 0.11 113.55 121.30 2hpa h SER 1175Ca -0.03 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2hpa h SER 1175Cb 0.23 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2hpa h SER 1175CO 0.05 0.92 -0.49 0.29 -0.87 0.00 0.00 176.83 176.73 2hpa n LYS 1176N -4.34 0.11 0.00 4.77 5.02 0.10 -4.27 118.16 119.55 2hpa n LYS 1176Ca 0.03 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2hpa n LYS 1176Cb 0.26 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2hpa n LYS 1176CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2hpa n VAL 1177N -1.74 0.00 0.32 -0.18 3.14 -1.01 -0.47 118.33 118.39 2hpa n VAL 1177Ca 0.05 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.30 2hpa n VAL 1177Cb 0.38 -0.22 -0.06 0.00 -1.06 0.00 0.00 33.84 32.88 2hpa n VAL 1177CO 0.00 0.00 0.00 0.22 -6.46 0.00 0.00 176.83 170.59 2hpa h TYR 1178N 0.00 -0.78 -0.73 1.45 3.20 -0.58 -2.61 116.97 116.92 2hpa h TYR 1178Ca 0.00 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.00 2hpa h TYR 1178Cb 0.05 0.26 -0.10 0.00 1.54 0.00 0.00 36.73 38.48 2hpa h TYR 1178CO 0.00 -0.49 0.23 0.22 -1.64 0.00 0.00 178.16 176.49 2hpa h ASP 1179N -1.13 0.14 -0.46 -2.11 3.58 -1.01 -0.10 116.42 115.33 2hpa h ASP 1179Ca -0.09 0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 2hpa h ASP 1179Cb 0.65 0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 2hpa h ASP 1179CO 0.14 0.03 0.26 -0.65 -2.88 0.00 0.00 179.24 176.15 2hpa h PRO 1180N 0.35 0.64 -0.70 0.28 0.11 -1.74 -0.23 132.00 130.71 2hpa h PRO 1180Ca 0.41 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.41 2hpa h PRO 1180Cb 0.66 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.61 2hpa h PRO 1180CO -0.45 0.49 0.27 -0.07 -0.21 0.00 0.00 178.00 178.04 2hpa h LEU 1181N 0.61 0.95 0.36 2.35 3.38 -0.92 -2.22 115.31 119.83 2hpa h LEU 1181Ca 0.16 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2hpa h LEU 1181Cb 0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.54 2hpa h LEU 1181CO -0.03 0.85 -0.17 0.22 0.09 0.00 0.00 178.44 179.40 2hpa h TYR 1182N 1.01 -0.44 -0.68 1.13 3.20 -0.53 -0.46 116.97 120.20 2hpa h TYR 1182Ca 0.23 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.20 2hpa h TYR 1182Cb 0.20 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.58 2hpa h TYR 1182CO 0.02 -0.20 0.45 0.00 -1.64 0.00 0.00 178.16 176.79 2hpa h GLU 1184N 0.48 0.44 -0.36 0.00 5.08 -1.11 -2.44 114.58 116.68 2hpa h GLU 1184Ca 0.32 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2hpa h GLU 1184Cb 0.60 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2hpa h GLU 1184CO -0.10 0.89 0.19 0.66 -1.00 0.00 0.00 179.01 179.65 2hpa h SER 1185N 0.05 0.45 -0.90 1.42 4.64 0.06 0.15 113.55 119.43 2hpa h SER 1185Ca 0.01 -0.09 0.16 0.00 -0.47 0.00 0.00 61.79 61.39 2hpa h SER 1185Cb 0.87 -0.11 -0.10 0.00 -0.31 0.00 0.00 62.40 62.75 2hpa h SER 1185CO 0.06 0.41 0.49 0.58 -0.87 0.00 0.00 176.83 177.51 2hpa h VAL 1186N 0.45 0.73 -0.49 0.95 2.07 -0.95 0.40 116.25 119.41 2hpa h VAL 1186Ca 0.13 -0.23 -0.18 0.00 0.82 0.00 0.00 66.70 67.23 2hpa h VAL 1186Cb 0.06 -0.01 -0.11 0.00 -1.52 0.00 0.00 31.29 29.71 2hpa h VAL 1186CO -0.02 0.12 0.23 1.41 0.02 0.00 0.00 177.57 179.34 2hpa n HIS 1187N -4.83 1.60 -3.76 1.57 8.25 -0.57 -4.88 115.22 112.61 2hpa n HIS 1187Ca 0.19 -0.95 -0.22 0.00 -0.26 0.00 0.00 57.72 56.47 2hpa n HIS 1187Cb 0.47 -0.54 0.02 0.00 1.12 0.00 0.00 29.99 31.06 2hpa n HIS 1187CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2hpa n ASN 1188N -0.14 -1.03 -4.90 0.41 3.02 0.14 -4.98 115.26 107.78 2hpa n ASN 1188Ca 0.28 -0.87 -0.27 0.00 -0.03 0.00 0.00 54.58 53.69 2hpa n ASN 1188Cb 1.05 -3.80 -0.04 0.00 -0.61 0.00 0.00 39.78 36.38 2hpa n ASN 1188CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2hpa s PHE 1189N -3.74 3.41 -0.54 3.10 0.08 0.44 -5.01 117.98 115.72 2hpa s PHE 1189Ca 0.01 0.10 -0.22 0.00 0.12 0.00 0.00 56.93 56.94 2hpa s PHE 1189Cb -0.00 -1.64 0.05 0.00 -0.57 0.00 0.00 43.02 40.85 2hpa s PHE 1189CO 0.83 0.53 0.84 0.99 -0.10 0.00 0.00 175.22 178.31 2hpa s THR 1190N -1.70 4.55 0.84 0.64 2.01 -1.26 -4.45 115.64 116.27 2hpa s THR 1190Ca 0.34 0.01 -0.11 0.00 0.31 0.00 0.00 61.69 62.24 2hpa s THR 1190Cb -0.11 -4.46 0.10 0.00 0.01 0.00 0.00 72.50 68.04 2hpa s THR 1190CO 0.27 -1.02 1.10 -0.76 -0.69 0.00 0.00 174.62 173.52 2hpa s LEU 1191N 3.52 2.76 0.72 4.42 1.02 -1.26 -4.97 118.68 124.88 2hpa s LEU 1191Ca 0.25 1.84 -0.14 0.00 0.02 0.00 0.00 54.13 56.10 2hpa s LEU 1191Cb -0.15 -4.38 0.03 0.00 0.02 0.00 0.00 46.19 41.72 2hpa s LEU 1191CO 0.17 -2.49 1.14 -2.16 0.02 0.00 0.00 176.35 173.03 2hpa s PRO 1192N -4.83 2.39 0.28 1.29 0.04 -1.26 -4.89 135.00 128.02 2hpa s PRO 1192Ca 0.63 1.49 0.01 0.00 0.04 0.00 0.00 61.00 63.17 2hpa s PRO 1192Cb -0.19 -1.89 0.68 0.00 0.04 0.00 0.00 34.50 33.14 2hpa s PRO 1192CO 0.57 -1.59 1.65 0.66 0.04 0.00 0.00 177.00 178.33 2hpa h SER 1193N -0.36 -0.02 0.41 6.66 4.64 -2.04 0.12 113.55 122.96 2hpa h SER 1193Ca -0.46 0.19 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 2hpa h SER 1193Cb 1.26 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.61 2hpa h SER 1193CO 0.51 -0.15 -0.20 4.11 -0.87 0.00 0.00 176.83 180.23 2hpa h TRP 1194N 0.21 0.00 0.00 4.77 5.08 -2.01 -3.34 115.95 120.66 2hpa h TRP 1194Ca 0.54 0.00 -0.62 0.00 1.08 0.00 0.00 58.89 59.89 2hpa h TRP 1194Cb 1.06 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 27.24 2hpa h TRP 1194CO -0.28 0.20 2.91 0.00 -1.28 0.00 0.00 178.44 179.99 2hpa n ALA 1195N -2.34 5.06 -1.94 0.11 0.00 0.03 -4.75 120.51 116.67 2hpa n ALA 1195Ca -0.02 -3.27 -0.27 0.00 0.00 0.00 0.00 53.44 49.89 2hpa n ALA 1195Cb 0.30 -3.43 0.11 0.00 0.00 0.00 0.00 19.45 16.43 2hpa n ALA 1195CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2hpa s THR 1196N 3.61 2.15 0.16 0.00 -4.23 -1.26 -4.77 115.64 111.31 2hpa s THR 1196Ca 0.53 -0.25 -0.17 0.00 -1.18 0.00 0.00 61.69 60.62 2hpa s THR 1196Cb 0.14 -2.90 0.08 0.00 1.34 0.00 0.00 72.50 71.16 2hpa s THR 1196CO -0.01 0.00 1.67 -0.08 -0.54 0.00 0.00 174.62 175.66 2hpa h GLU 1197N -0.91 0.00 -0.31 3.99 4.22 -1.96 0.14 114.58 119.76 2hpa h GLU 1197Ca -0.43 -0.00 0.04 0.00 0.08 0.00 0.00 59.36 59.06 2hpa h GLU 1197Cb 1.28 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 2hpa h GLU 1197CO 0.50 0.00 0.06 0.22 -2.18 0.00 0.00 179.01 177.61 2hpa h ASP 1198N 0.00 0.01 -0.51 1.04 1.82 -1.96 0.13 116.42 116.95 2hpa h ASP 1198Ca 0.18 0.05 0.07 0.00 -0.39 0.00 0.00 57.03 56.94 2hpa h ASP 1198Cb 0.28 0.07 -0.06 0.00 0.68 0.00 0.00 39.33 40.30 2hpa h ASP 1198CO -0.39 0.04 0.20 0.74 -1.61 0.00 0.00 179.24 178.22 2hpa h THR 1199N 0.17 0.84 -0.02 2.25 2.02 -1.40 0.11 112.91 116.87 2hpa h THR 1199Ca 0.14 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.19 2hpa h THR 1199Cb 0.16 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2hpa h THR 1199CO -0.19 0.07 0.01 0.24 0.37 0.00 0.00 175.52 176.02 2hpa h MET 1200N 0.38 0.03 -0.70 6.66 2.86 -0.33 0.22 114.93 124.06 2hpa h MET 1200Ca 0.25 -0.00 0.10 0.00 -2.06 0.00 0.00 59.70 57.99 2hpa h MET 1200Cb 0.25 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.83 2hpa h MET 1200CO -0.24 0.08 0.32 1.15 1.06 0.00 0.00 176.91 179.28 2hpa h THR 1201N -0.02 0.79 -0.39 2.22 2.02 0.21 0.45 112.91 118.19 2hpa h THR 1201Ca 0.01 -0.18 -0.07 0.00 0.77 0.00 0.00 66.41 66.94 2hpa h THR 1201Cb 0.05 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2hpa h THR 1201CO -0.00 0.10 -0.03 0.11 0.37 0.00 0.00 175.52 176.06 2hpa h LYS 1202N 0.53 0.72 -0.72 6.66 1.79 -0.47 -1.91 116.57 123.18 2hpa h LYS 1202Ca 0.36 -0.25 -0.04 0.00 -2.18 0.00 0.00 60.65 58.55 2hpa h LYS 1202Cb 0.43 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.99 2hpa h LYS 1202CO -0.31 0.83 0.31 -0.07 -1.08 0.00 0.00 179.45 179.13 2hpa h LEU 1203N 0.54 0.95 -0.43 2.94 3.38 0.77 -0.70 115.31 122.75 2hpa h LEU 1203Ca 0.11 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2hpa h LEU 1203Cb 0.52 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2hpa h LEU 1203CO 0.03 0.83 0.09 -0.09 0.09 0.00 0.00 178.44 179.39 2hpa h ARG 1204N 1.03 0.71 -0.91 1.13 2.43 0.01 0.05 114.38 118.83 2hpa h ARG 1204Ca 0.24 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2hpa h ARG 1204Cb 0.16 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 2hpa h ARG 1204CO -0.02 0.73 0.50 0.93 -1.51 0.00 0.00 179.97 180.60 2hpa h GLU 1205N 0.57 1.27 -0.56 0.20 5.08 -0.84 0.30 114.58 120.60 2hpa h GLU 1205Ca 0.13 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2hpa h GLU 1205Cb 0.35 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2hpa h GLU 1205CO 0.01 0.92 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.87 2hpa h LEU 1206N 1.27 0.98 -0.91 1.33 3.38 -0.83 0.22 115.31 120.75 2hpa h LEU 1206Ca 0.32 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2hpa h LEU 1206Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2hpa h LEU 1206CO -0.05 1.05 0.06 0.28 0.09 0.00 0.00 178.44 179.87 2hpa h SER 1207N 0.88 0.82 -0.14 -0.43 0.02 -0.01 0.66 113.55 115.35 2hpa h SER 1207Ca 0.16 -0.18 -0.16 0.00 -0.84 0.00 0.00 61.79 60.77 2hpa h SER 1207Cb 0.55 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 2hpa h SER 1207CO 0.03 0.85 -0.47 -0.33 -1.14 0.00 0.00 176.83 175.76 2hpa h GLU 1208N 0.82 0.70 -0.45 3.45 5.08 -0.06 -2.17 114.58 121.95 2hpa h GLU 1208Ca 0.17 -0.40 -0.09 0.00 -1.00 0.00 0.00 59.36 58.03 2hpa h GLU 1208Cb 0.40 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2hpa h GLU 1208CO 0.01 1.02 -0.10 1.25 -1.00 0.00 0.00 179.01 180.19 2hpa h LEU 1209N 0.56 0.79 -0.01 1.33 5.85 0.03 -2.36 115.31 121.50 2hpa h LEU 1209Ca 0.03 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2hpa h LEU 1209Cb 1.03 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2hpa h LEU 1209CO 0.10 0.92 -0.04 -1.28 -0.34 0.00 0.00 178.44 177.80 2hpa h SER 1210N 0.73 -0.11 -0.35 1.25 0.87 -0.59 0.36 113.55 115.72 2hpa h SER 1210Ca 0.12 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 2hpa h SER 1210Cb 0.59 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.57 2hpa h SER 1210CO 0.04 -0.06 0.15 0.25 -0.53 0.00 0.00 176.83 176.68 2hpa h LEU 1211N -0.06 0.21 -0.15 2.23 5.85 -1.24 0.04 115.31 122.19 2hpa h LEU 1211Ca 0.02 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2hpa h LEU 1211Cb 0.09 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2hpa h LEU 1211CO -0.05 0.16 0.10 -0.07 -0.34 0.00 0.00 178.44 178.24 2hpa h LEU 1212N 0.32 0.18 -2.04 2.25 3.38 -0.90 -1.66 115.31 116.83 2hpa h LEU 1212Ca 0.15 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2hpa h LEU 1212Cb 0.09 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2hpa h LEU 1212CO -0.12 0.15 -0.09 0.77 0.09 0.00 0.00 178.44 179.24 2hpa h SER 1213N 0.19 0.00 -0.20 -0.43 4.64 0.01 0.62 113.55 118.37 2hpa h SER 1213Ca 0.05 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 2hpa h SER 1213Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2hpa h SER 1213CO -0.01 0.09 -0.11 0.25 -0.87 0.00 0.00 176.83 176.18 2hpa h LEU 1214N 0.00 0.45 -0.79 5.97 6.46 -0.03 -3.35 115.31 124.02 2hpa h LEU 1214Ca -0.00 -0.42 0.00 0.00 -0.12 0.00 0.00 57.88 57.34 2hpa h LEU 1214Cb 0.25 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.05 2hpa h LEU 1214CO 0.01 0.78 -0.32 -1.22 -0.62 0.00 0.00 178.44 177.07 2hpa n TYR 1215N -4.54 0.00 -1.06 1.25 4.01 -1.03 -4.94 117.16 110.86 2hpa n TYR 1215Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2hpa n TYR 1215Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 2hpa n TYR 1215CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hpa n GLY 1216N 1.08 3.65 2.15 2.72 0.00 0.21 -4.61 105.19 110.39 2hpa n GLY 1216Ca 0.06 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.40 2hpa n GLY 1216CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2hpa n ILE 1217N 0.00 -0.06 0.00 -0.61 -5.35 -1.26 -4.39 119.36 107.69 2hpa n ILE 1217Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2hpa n ILE 1217Cb 0.00 -1.45 0.00 0.00 -1.74 0.00 0.00 39.64 36.45 2hpa n ILE 1217CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 2hpa n HIS 1218N -2.11 0.00 -3.33 4.28 -0.00 -1.26 -4.58 115.22 108.22 2hpa n HIS 1218Ca -0.15 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.33 2hpa n HIS 1218Cb 0.49 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.49 2hpa n HIS 1218CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2hpa n LYS 1219N 0.00 -4.11 -0.16 1.57 5.02 -1.26 -4.89 118.16 114.33 2hpa n LYS 1219Ca 0.00 0.62 -0.06 0.00 -2.02 0.00 0.00 58.31 56.84 2hpa n LYS 1219Cb 0.00 -5.39 -0.00 0.00 -0.02 0.00 0.00 35.03 29.61 2hpa n LYS 1219CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 2hpa h GLN 1220N -1.23 -0.20 -0.84 1.97 4.15 -1.86 -2.55 115.11 114.56 2hpa h GLN 1220Ca -0.48 0.01 0.19 0.00 0.77 0.00 0.00 58.65 59.14 2hpa h GLN 1220Cb 1.32 0.04 -0.11 0.00 0.21 0.00 0.00 27.48 28.94 2hpa h GLN 1220CO 0.56 -0.13 0.34 0.87 -1.93 0.00 0.00 178.83 178.53 2hpa h LYS 1221N -0.20 0.39 0.03 1.69 1.79 -1.90 0.29 116.57 118.67 2hpa h LYS 1221Ca 0.20 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.65 2hpa h LYS 1221Cb 0.54 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2hpa h LYS 1221CO -0.61 0.26 -0.02 1.49 -1.08 0.00 0.00 179.45 179.49 2hpa h GLU 1222N 0.41 -0.04 -1.00 3.15 4.81 -1.82 -1.86 114.58 118.21 2hpa h GLU 1222Ca 0.49 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.85 2hpa h GLU 1222Cb 0.87 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.17 2hpa h GLU 1222CO -0.49 0.29 0.63 0.87 -0.73 0.00 0.00 179.01 179.59 2hpa h LYS 1223N -0.39 0.96 -0.84 1.92 1.57 -1.03 -0.72 116.57 118.04 2hpa h LYS 1223Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2hpa h LYS 1223Cb 0.36 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 2hpa h LYS 1223CO 0.01 0.63 0.54 0.77 -0.57 0.00 0.00 179.45 180.83 2hpa h SER 1224N 0.99 0.98 0.84 0.86 0.02 -0.16 0.42 113.55 117.49 2hpa h SER 1224Ca 0.50 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.39 2hpa h SER 1224Cb 0.50 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 2hpa h SER 1224CO -0.27 0.73 -0.10 0.03 -1.14 0.00 0.00 176.83 176.08 2hpa h ARG 1225N 1.14 0.00 -0.09 3.45 3.08 -0.30 0.47 114.38 122.13 2hpa h ARG 1225Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2hpa h ARG 1225Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.95 2hpa h ARG 1225CO -0.06 0.10 0.00 1.28 -1.07 0.00 0.00 179.97 180.21 2hpa n LEU 1226N -3.27 2.78 0.00 3.04 4.77 -0.43 -3.92 117.00 119.97 2hpa n LEU 1226Ca -0.00 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 2hpa n LEU 1226Cb 0.33 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2hpa n LEU 1226CO 0.29 0.51 0.00 0.00 -1.33 0.00 0.00 177.39 176.86 2hpa n GLN 1227N 1.15 0.00 -0.45 3.23 1.13 0.01 -4.73 117.38 117.72 2hpa n GLN 1227Ca 0.13 0.00 0.40 0.00 -1.94 0.00 0.00 57.00 55.59 2hpa n GLN 1227Cb 0.51 0.00 0.75 0.00 0.11 0.00 0.00 30.24 31.61 2hpa n GLN 1227CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2hpa h GLY 1228N 0.00 0.20 0.57 1.08 0.00 -1.66 0.15 103.07 103.41 2hpa h GLY 1228Ca 0.00 -0.02 0.20 0.00 0.00 0.00 0.00 47.33 47.50 2hpa h GLY 1228CO 0.00 -0.04 0.52 -1.33 0.00 0.00 0.00 176.54 175.68 2hpa h GLY 1229N 0.03 0.18 1.18 4.60 0.00 -0.24 0.66 103.07 109.50 2hpa h GLY 1229Ca 0.70 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.93 2hpa h GLY 1229CO -0.06 0.01 0.15 -2.08 0.00 0.00 0.00 176.54 174.55 2hpa h VAL 1230N 0.09 1.25 0.01 4.60 2.07 -0.89 -0.41 116.25 122.97 2hpa h VAL 1230Ca 0.35 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 2hpa h VAL 1230Cb 1.27 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 2hpa h VAL 1230CO -0.04 0.35 -0.17 0.25 0.02 0.00 0.00 177.57 177.98 2hpa h LEU 1231N 0.97 0.14 -0.75 2.57 6.46 -1.09 -2.78 115.31 120.81 2hpa h LEU 1231Ca 0.20 -0.83 0.17 0.00 -0.12 0.00 0.00 57.88 57.31 2hpa h LEU 1231Cb 0.35 -0.04 -0.13 0.00 -0.73 0.00 0.00 40.66 40.11 2hpa h LEU 1231CO 0.00 0.95 0.01 0.58 -0.62 0.00 0.00 178.44 179.36 2hpa h VAL 1232N -0.66 0.35 -0.50 1.05 2.07 -1.05 0.26 116.25 117.78 2hpa h VAL 1232Ca -0.02 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2hpa h VAL 1232Cb 0.98 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2hpa h VAL 1232CO 0.03 0.02 0.29 -1.13 0.02 0.00 0.00 177.57 176.81 2hpa h ASN 1233N 0.11 0.60 0.43 0.57 -0.00 -1.15 0.27 115.58 116.42 2hpa h ASN 1233Ca 0.41 -0.06 -0.01 0.00 -0.00 0.00 0.00 56.30 56.64 2hpa h ASN 1233Cb 0.72 -0.15 -0.02 0.00 -0.00 0.00 0.00 38.32 38.87 2hpa h ASN 1233CO -0.66 0.49 -0.46 -0.08 -0.00 0.00 0.00 177.43 176.73 2hpa h GLU 1234N 0.66 -0.87 -0.22 6.67 4.57 -0.33 -2.01 114.58 123.06 2hpa h GLU 1234Ca 0.18 0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.46 2hpa h GLU 1234Cb 0.00 0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.75 2hpa h GLU 1234CO -0.03 -0.58 -0.06 0.82 -1.18 0.00 0.00 179.01 177.98 2hpa h ILE 1235N -0.90 0.78 -0.62 2.32 2.04 -0.56 -1.27 117.51 119.29 2hpa h ILE 1235Ca -0.04 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.90 2hpa h ILE 1235Cb 0.80 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 2hpa h ILE 1235CO -0.08 0.00 0.27 0.25 0.00 0.00 0.00 178.15 178.59 2hpa h LEU 1236N -0.00 0.31 -0.73 1.44 6.46 -0.94 -1.04 115.31 120.81 2hpa h LEU 1236Ca 0.10 0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.94 2hpa h LEU 1236Cb 0.16 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 2hpa h LEU 1236CO -0.22 0.19 0.48 0.78 -0.62 0.00 0.00 178.44 179.04 2hpa h ASN 1237N 0.47 0.82 -0.97 1.25 -0.26 -0.56 0.17 115.58 116.51 2hpa h ASN 1237Ca 0.31 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.03 2hpa h ASN 1237Cb 0.34 -0.20 -0.05 0.00 -1.06 0.00 0.00 38.32 37.35 2hpa h ASN 1237CO -0.27 0.59 0.61 0.45 -1.06 0.00 0.00 177.43 177.75 2hpa h HIS 1238N 0.97 1.24 0.41 1.19 3.86 -0.49 -1.56 115.15 120.78 2hpa h HIS 1238Ca 0.27 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.47 2hpa h HIS 1238Cb -0.10 -0.41 0.00 0.00 1.06 0.00 0.00 27.41 27.96 2hpa h HIS 1238CO -0.02 0.80 -0.20 0.52 0.86 0.00 0.00 177.93 179.89 2hpa h MET 1239N 1.32 -0.54 -0.39 2.45 2.86 0.22 0.13 114.93 120.98 2hpa h MET 1239Ca 0.35 0.04 0.07 0.00 -2.06 0.00 0.00 59.70 58.10 2hpa h MET 1239Cb -0.10 0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.62 2hpa h MET 1239CO -0.07 -0.35 0.01 0.87 1.06 0.00 0.00 176.91 178.43 2hpa h LYS 1240N -0.56 0.11 -0.80 1.72 1.79 -0.56 0.17 116.57 118.43 2hpa h LYS 1240Ca -0.06 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 2hpa h LYS 1240Cb 0.43 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.02 2hpa h LYS 1240CO 0.09 0.07 0.37 0.00 -1.08 0.00 0.00 179.45 178.91 2hpa h ARG 1241N 0.12 1.16 0.00 3.15 3.08 -1.10 0.20 114.38 120.99 2hpa h ARG 1241Ca 0.19 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2hpa h ARG 1241Cb 0.27 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2hpa h ARG 1241CO -0.31 0.90 0.04 0.00 -1.07 0.00 0.00 179.97 179.53 2hpa h ALA 1242N 1.26 1.03 0.00 0.04 0.00 0.12 0.20 119.26 121.91 2hpa h ALA 1242Ca 0.27 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.97 2hpa h ALA 1242Cb 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2hpa h ALA 1242CO -0.03 -0.03 -1.62 2.41 0.00 0.00 0.00 179.25 179.98 2hpa n THR 1243N -2.60 1.25 -0.09 0.00 -1.04 0.61 -4.46 114.28 107.94 2hpa n THR 1243Ca -0.02 -0.73 -0.08 0.00 -2.04 0.00 0.00 64.05 61.18 2hpa n THR 1243Cb 0.08 -0.74 -0.16 0.00 -1.82 0.00 0.00 70.33 67.69 2hpa n THR 1243CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hpa n GLN 1244N -2.88 0.72 -4.00 -2.82 6.02 0.10 -4.92 117.38 109.59 2hpa n GLN 1244Ca -0.14 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.49 2hpa n GLN 1244Cb 0.91 -1.51 -0.15 0.00 1.02 0.00 0.00 30.24 30.51 2hpa n GLN 1244CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 2hpa s ILE 1245N -2.58 2.69 0.81 5.09 -5.25 0.46 -5.10 121.20 117.32 2hpa s ILE 1245Ca -0.10 -0.96 -0.11 0.00 -0.99 0.00 0.00 60.65 58.49 2hpa s ILE 1245Cb 0.07 -2.30 0.07 0.00 2.95 0.00 0.00 42.46 43.26 2hpa s ILE 1245CO 0.83 0.31 1.09 -2.16 -1.79 0.00 0.00 174.94 173.22 2hpa s PRO 1246N 1.33 2.02 -1.23 0.37 0.04 -1.26 -3.43 135.00 132.83 2hpa s PRO 1246Ca 0.02 0.77 0.00 0.00 0.04 0.00 0.00 61.00 61.82 2hpa s PRO 1246Cb -0.15 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.49 2hpa s PRO 1246CO -0.07 -1.70 0.00 0.43 0.04 0.00 0.00 177.00 175.70 2hpa n SER 1247N -3.51 -4.29 -4.55 6.66 7.64 -1.26 -5.01 113.62 109.30 2hpa n SER 1247Ca 0.07 0.10 -0.26 0.00 1.01 0.00 0.00 58.87 59.79 2hpa n SER 1247Cb 0.55 -3.30 0.12 0.00 -1.01 0.00 0.00 64.21 60.57 2hpa n SER 1247CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2hpa s TYR 1248N -2.61 1.93 0.30 1.43 5.04 -1.22 -4.97 117.35 117.24 2hpa s TYR 1248Ca 0.00 0.11 -0.29 0.00 -2.44 0.00 0.00 57.07 54.44 2hpa s TYR 1248Cb 0.00 -3.43 -0.11 0.00 0.35 0.00 0.00 41.96 38.77 2hpa s TYR 1248CO 0.00 -1.95 1.48 0.15 -1.34 0.00 0.00 175.55 173.88 2hpa s LYS 1249N -5.42 4.20 -0.04 4.97 -0.14 -1.26 -4.75 119.74 117.30 2hpa s LYS 1249Ca 0.67 2.43 -0.12 0.00 -1.36 0.00 0.00 55.97 57.59 2hpa s LYS 1249Cb -0.06 -3.05 -0.31 0.00 -1.68 0.00 0.00 37.83 32.73 2hpa s LYS 1249CO 0.47 -0.47 0.71 0.87 -0.76 0.00 0.00 175.35 176.17 2hpa h LYS 1250N 4.30 0.41 -4.13 1.68 1.57 -1.06 -3.45 116.57 115.88 2hpa h LYS 1250Ca -0.48 -0.70 -0.33 0.00 -1.87 0.00 0.00 60.65 57.27 2hpa h LYS 1250Cb 1.22 0.26 -0.30 0.00 0.08 0.00 0.00 32.23 33.50 2hpa h LYS 1250CO 0.73 1.33 -0.75 -1.17 -0.57 0.00 0.00 179.45 179.03 2hpa s LEU 1251N -7.38 1.80 -0.12 2.94 2.96 -0.86 0.17 118.68 118.19 2hpa s LEU 1251Ca -0.15 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 53.68 2hpa s LEU 1251Cb 0.05 -0.26 0.02 0.00 0.50 0.00 0.00 46.19 46.50 2hpa s LEU 1251CO 0.86 0.02 -0.11 -0.63 -1.32 0.00 0.00 176.35 175.17 2hpa s ILE 1252N 0.18 1.25 -0.11 6.68 1.01 -0.87 -1.66 121.20 127.69 2hpa s ILE 1252Ca -0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 2hpa s ILE 1252Cb -0.05 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 2hpa s ILE 1252CO -0.00 0.40 -0.00 -0.04 0.00 0.00 0.00 174.94 175.30 2hpa s MET 1253N 1.41 3.19 -0.33 2.79 -1.94 0.92 -2.03 119.30 123.31 2hpa s MET 1253Ca 0.01 -0.42 0.02 0.00 -1.71 0.00 0.00 55.69 53.59 2hpa s MET 1253Cb -0.13 -2.85 0.10 0.00 2.01 0.00 0.00 34.83 33.96 2hpa s MET 1253CO -0.06 0.59 0.06 0.71 -0.01 0.00 0.00 175.02 176.30 2hpa s TYR 1254N -0.56 3.05 -0.04 -0.03 2.02 0.27 -1.02 117.35 121.03 2hpa s TYR 1254Ca 0.09 -2.55 -0.30 0.00 -0.37 0.00 0.00 57.07 53.95 2hpa s TYR 1254Cb -0.12 -2.48 -0.02 0.00 -0.40 0.00 0.00 41.96 38.94 2hpa s TYR 1254CO 0.02 -0.92 0.99 0.45 -1.57 0.00 0.00 175.55 174.52 2hpa s SER 1255N 1.15 7.32 0.00 2.29 0.15 0.46 -1.34 113.70 123.73 2hpa s SER 1255Ca 0.10 1.61 0.00 0.00 0.70 0.00 0.00 55.95 58.36 2hpa s SER 1255Cb -0.18 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2hpa s SER 1255CO -0.14 -0.33 0.00 0.00 1.20 0.00 0.00 173.24 173.97 2hpa n ALA 1256N 4.33 0.00 -2.62 5.45 0.00 -0.08 -3.16 120.51 124.44 2hpa n ALA 1256Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.23 2hpa n ALA 1256Cb 0.50 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 2hpa n ALA 1256CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2hpa s HIS 1257N -0.49 2.42 0.47 0.00 3.76 -1.26 -1.84 115.29 118.36 2hpa s HIS 1257Ca 0.00 -0.72 0.29 0.00 -0.15 0.00 0.00 55.06 54.49 2hpa s HIS 1257Cb 0.00 -1.72 1.62 0.00 1.11 0.00 0.00 32.58 33.59 2hpa s HIS 1257CO 0.00 0.39 2.14 0.38 -0.85 0.00 0.00 174.74 176.81 2hpa h ASP 1258N 1.77 0.00 1.59 1.40 3.04 -1.91 0.39 116.42 122.70 2hpa h ASP 1258Ca -0.44 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 2hpa h ASP 1258Cb 1.25 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.54 2hpa h ASP 1258CO 0.79 0.07 -0.10 0.71 -2.04 0.00 0.00 179.24 178.68 2hpa h THR 1259N 0.00 0.00 0.03 1.15 1.35 -1.96 -2.22 112.91 111.26 2hpa h THR 1259Ca -0.00 -0.69 -0.04 0.00 -0.55 0.00 0.00 66.41 65.13 2hpa h THR 1259Cb 0.22 1.63 0.01 0.00 -1.73 0.00 0.00 68.15 68.28 2hpa h THR 1259CO 0.01 0.00 -0.19 0.74 -0.25 0.00 0.00 175.52 175.83 2hpa h THR 1260N 0.00 1.71 0.75 6.82 2.02 -1.18 0.07 112.91 123.11 2hpa h THR 1260Ca 0.00 -2.33 -0.04 0.00 0.77 0.00 0.00 66.41 64.81 2hpa h THR 1260Cb 0.84 3.29 0.01 0.00 -1.74 0.00 0.00 68.15 70.55 2hpa h THR 1260CO 0.00 0.62 -0.36 0.58 0.37 0.00 0.00 175.52 176.73 2hpa h VAL 1261N -0.82 0.00 -0.74 3.16 2.07 -1.48 -0.36 116.25 118.09 2hpa h VAL 1261Ca -0.03 -0.03 0.16 0.00 0.82 0.00 0.00 66.70 67.62 2hpa h VAL 1261Cb 1.13 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.78 2hpa h VAL 1261CO 0.04 0.00 0.16 0.77 0.02 0.00 0.00 177.57 178.55 2hpa h SER 1262N -1.04 -0.03 -0.94 0.57 4.64 -1.55 0.97 113.55 116.17 2hpa h SER 1262Ca -0.10 0.15 0.01 0.00 -0.47 0.00 0.00 61.79 61.38 2hpa h SER 1262Cb 0.77 0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 63.03 2hpa h SER 1262CO 0.17 -0.06 0.61 1.23 -0.87 0.00 0.00 176.83 177.91 2hpa h GLY 1263N 0.24 1.34 0.60 -0.77 0.00 -0.79 0.13 103.07 103.82 2hpa h GLY 1263Ca 0.42 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 2hpa h GLY 1263CO -0.53 0.51 -0.04 -2.00 0.00 0.00 0.00 176.54 174.47 2hpa h LEU 1264N 1.29 -0.09 -1.25 3.11 5.85 0.76 -2.53 115.31 122.44 2hpa h LEU 1264Ca 0.34 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2hpa h LEU 1264Cb -0.12 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2hpa h LEU 1264CO -0.07 0.31 0.39 1.56 -0.34 0.00 0.00 178.44 180.29 2hpa h GLN 1265N -0.51 0.90 -0.66 1.25 4.20 -0.53 -1.03 115.11 118.73 2hpa h GLN 1265Ca -0.01 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 2hpa h GLN 1265Cb 0.43 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2hpa h GLN 1265CO 0.02 0.64 0.25 0.52 -0.67 0.00 0.00 178.83 179.59 2hpa h MET 1266N 0.92 0.98 0.00 1.46 2.86 -0.70 0.33 114.93 120.77 2hpa h MET 1266Ca 0.24 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 2hpa h MET 1266Cb -0.02 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 2hpa h MET 1266CO -0.04 0.81 -0.39 0.00 1.06 0.00 0.00 176.91 178.34 2hpa h ALA 1267N 1.32 0.99 -0.01 6.32 0.00 -0.78 -2.48 119.26 124.63 2hpa h ALA 1267Ca 0.22 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2hpa h ALA 1267Cb 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2hpa h ALA 1267CO -0.02 0.49 -0.32 1.28 0.00 0.00 0.00 179.25 180.69 2hpa n LEU 1268N -3.55 0.87 -3.47 0.00 4.77 -0.44 -4.93 117.00 110.24 2hpa n LEU 1268Ca -0.00 -0.18 -0.21 0.00 -0.03 0.00 0.00 56.01 55.58 2hpa n LEU 1268Cb 0.52 -0.16 0.08 0.00 -2.33 0.00 0.00 43.42 41.53 2hpa n LEU 1268CO 0.37 0.17 0.20 0.47 -1.33 0.00 0.00 177.39 177.28 2hpa n ASP 1269N -0.88 -5.05 -0.34 -1.43 8.00 0.10 -4.55 116.55 112.41 2hpa n ASP 1269Ca 0.10 -0.55 0.05 0.00 0.71 0.00 0.00 54.79 55.11 2hpa n ASP 1269Cb 0.34 -4.95 0.07 0.00 -0.02 0.00 0.00 41.12 36.57 2hpa n ASP 1269CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2hpa n VAL 1270N -4.69 0.93 -2.59 2.53 0.24 -0.31 -4.46 118.33 109.98 2hpa n VAL 1270Ca -0.08 -1.16 -0.41 0.00 -2.04 0.00 0.00 64.34 60.65 2hpa n VAL 1270Cb 0.59 0.16 -0.04 0.00 -1.47 0.00 0.00 33.84 33.08 2hpa n VAL 1270CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2hpa s TYR 1271N -1.41 3.63 -2.36 6.34 5.04 -1.22 -4.92 117.35 122.45 2hpa s TYR 1271Ca 0.17 1.60 0.29 0.00 -2.44 0.00 0.00 57.07 56.69 2hpa s TYR 1271Cb 0.15 -3.22 1.26 0.00 0.35 0.00 0.00 41.96 40.50 2hpa s TYR 1271CO 0.01 -0.43 1.86 0.27 -1.34 0.00 0.00 175.55 175.92 2hpa n ASN 1272N 3.12 1.12 0.00 4.32 0.23 -1.26 -4.92 115.26 117.86 2hpa n ASN 1272Ca 0.05 -1.36 0.00 0.00 -0.53 0.00 0.00 54.58 52.73 2hpa n ASN 1272Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 2hpa n ASN 1272CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2hpa n GLY 1273N 1.13 2.65 3.89 4.83 0.00 -1.26 -5.00 105.19 111.42 2hpa n GLY 1273Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2hpa n GLY 1273CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hpa s LEU 1274N 0.00 4.25 -0.00 0.99 1.43 -1.26 -4.85 118.68 119.24 2hpa s LEU 1274Ca 0.00 0.71 -0.30 0.00 -1.03 0.00 0.00 54.13 53.51 2hpa s LEU 1274Cb 0.00 -3.36 -0.06 0.00 0.03 0.00 0.00 46.19 42.80 2hpa s LEU 1274CO 0.00 0.04 1.57 -0.76 0.23 0.00 0.00 176.35 177.42 2hpa s LEU 1275N -2.59 4.33 -0.47 1.79 1.43 -1.26 -4.90 118.68 117.01 2hpa s LEU 1275Ca 0.41 2.26 -0.31 0.00 -1.03 0.00 0.00 54.13 55.47 2hpa s LEU 1275Cb -0.12 -3.55 -0.11 0.00 0.03 0.00 0.00 46.19 42.44 2hpa s LEU 1275CO 0.23 -0.85 2.35 -2.65 0.23 0.00 0.00 176.35 175.66 2hpa n PRO 1276N 6.10 1.03 -0.81 1.29 -0.02 -1.26 -4.90 135.00 136.42 2hpa n PRO 1276Ca 0.15 0.19 -0.32 0.00 -2.02 0.00 0.00 63.50 61.50 2hpa n PRO 1276Cb 0.42 -2.75 0.16 0.00 -0.02 0.00 0.00 33.50 31.31 2hpa n PRO 1276CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2hpa n PRO 1277N 8.59 -0.26 -1.60 0.52 -0.04 -1.26 -4.82 135.00 136.13 2hpa n PRO 1277Ca 0.42 -0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.43 2hpa n PRO 1277Cb 0.33 -2.39 -0.02 0.00 -0.04 0.00 0.00 33.50 31.39 2hpa n PRO 1277CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2hpa n TYR 1278N -3.94 1.42 -0.88 0.54 4.01 -1.26 -1.00 117.16 116.04 2hpa n TYR 1278Ca 0.12 0.67 0.00 0.00 -0.16 0.00 0.00 57.90 58.53 2hpa n TYR 1278Cb 0.52 -2.28 0.00 0.00 -0.31 0.00 0.00 39.34 37.26 2hpa n TYR 1278CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2hpa n ALA 1279N 0.56 0.00 -1.77 -0.72 0.00 -0.82 -4.93 120.51 112.82 2hpa n ALA 1279Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.14 2hpa n ALA 1279Cb 0.31 -0.95 0.01 0.00 0.00 0.00 0.00 19.45 18.82 2hpa n ALA 1279CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2hpa n SER 1280N -0.47 3.68 -3.84 0.00 3.41 -0.17 -4.65 113.62 111.58 2hpa n SER 1280Ca 0.00 1.19 -0.21 0.00 -0.26 0.00 0.00 58.87 59.59 2hpa n SER 1280Cb 0.24 -1.62 -0.17 0.00 -0.26 0.00 0.00 64.21 62.40 2hpa n SER 1280CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hpa s HIS 1282N 1.30 3.18 0.15 0.00 5.04 -1.05 0.25 115.29 124.16 2hpa s HIS 1282Ca -0.05 -1.23 -0.30 0.00 -1.54 0.00 0.00 55.06 51.94 2hpa s HIS 1282Cb -0.13 -3.96 -0.07 0.00 0.04 0.00 0.00 32.58 28.46 2hpa s HIS 1282CO -0.02 -1.20 1.02 -0.51 -2.34 0.00 0.00 174.74 171.69 2hpa s LEU 1283N 2.06 4.50 -0.41 8.88 2.01 -0.65 -3.16 118.68 131.91 2hpa s LEU 1283Ca 0.12 1.92 0.02 0.00 0.01 0.00 0.00 54.13 56.21 2hpa s LEU 1283Cb -0.22 -3.60 0.15 0.00 0.01 0.00 0.00 46.19 42.53 2hpa s LEU 1283CO 0.02 -0.12 0.28 0.28 1.01 0.00 0.00 176.35 177.82 2hpa s THR 1284N -0.16 0.60 0.00 5.49 -1.32 -0.50 0.34 115.64 120.09 2hpa s THR 1284Ca 0.48 -2.34 -0.18 0.00 -1.21 0.00 0.00 61.69 58.43 2hpa s THR 1284Cb -0.26 -1.43 -0.06 0.00 -1.51 0.00 0.00 72.50 69.25 2hpa s THR 1284CO 0.32 -1.06 0.52 -1.61 -2.21 0.00 0.00 174.62 170.57 2hpa s GLU 1285N 0.44 4.18 -0.28 7.08 2.02 0.16 -2.95 118.70 129.35 2hpa s GLU 1285Ca 0.24 0.60 -0.08 0.00 0.02 0.00 0.00 54.97 55.75 2hpa s GLU 1285Cb -0.13 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 2hpa s GLU 1285CO -0.08 0.51 0.10 -1.17 0.02 0.00 0.00 175.26 174.65 2hpa s LEU 1286N -0.59 3.75 0.16 1.80 2.96 0.42 -0.11 118.68 127.07 2hpa s LEU 1286Ca 0.28 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 53.85 2hpa s LEU 1286Cb -0.18 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 2hpa s LEU 1286CO 0.16 -0.11 0.05 -0.31 -1.32 0.00 0.00 176.35 174.81 2hpa s TYR 1287N 1.60 2.99 -0.09 5.38 2.02 0.30 0.19 117.35 129.74 2hpa s TYR 1287Ca 0.05 -0.07 0.03 0.00 -0.37 0.00 0.00 57.07 56.71 2hpa s TYR 1287Cb -0.16 -1.45 -0.01 0.00 -0.40 0.00 0.00 41.96 39.93 2hpa s TYR 1287CO 0.04 0.51 -0.19 0.12 -1.57 0.00 0.00 175.55 174.47 2hpa s PHE 1288N -1.68 2.64 -0.22 2.71 5.36 0.10 -0.74 117.98 126.15 2hpa s PHE 1288Ca 0.29 -0.70 -0.06 0.00 -0.96 0.00 0.00 56.93 55.50 2hpa s PHE 1288Cb -0.10 -1.72 0.11 0.00 -0.34 0.00 0.00 43.02 40.97 2hpa s PHE 1288CO 0.20 -0.21 0.44 -2.00 -1.46 0.00 0.00 175.22 172.20 2hpa s GLU 1289N 0.07 0.36 -1.46 10.12 2.56 0.96 -0.54 118.70 130.77 2hpa s GLU 1289Ca -0.08 0.96 -0.01 0.00 0.00 0.00 0.00 54.97 55.84 2hpa s GLU 1289Cb -0.15 0.21 0.01 0.00 2.00 0.00 0.00 34.13 36.20 2hpa s GLU 1289CO 0.05 -0.35 0.34 1.63 -0.56 0.00 0.00 175.26 176.36 2hpa n LYS 1290N 5.39 -2.70 -0.92 4.30 5.02 -1.26 -0.54 118.16 127.45 2hpa n LYS 1290Ca -0.07 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 2hpa n LYS 1290Cb 0.50 -4.33 0.00 0.00 -0.02 0.00 0.00 35.03 31.18 2hpa n LYS 1290CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hpa n GLY 1291N -2.09 0.90 3.43 0.72 0.00 -1.26 -5.03 105.19 101.86 2hpa n GLY 1291Ca -0.29 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 2hpa n GLY 1291CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hpa s GLU 1292N -0.08 1.55 -0.06 1.61 2.02 0.29 -5.15 118.70 118.89 2hpa s GLU 1292Ca 0.00 -1.60 0.04 0.00 0.02 0.00 0.00 54.97 53.43 2hpa s GLU 1292Cb 0.00 -1.79 -0.02 0.00 0.10 0.00 0.00 34.13 32.42 2hpa s GLU 1292CO 0.00 0.37 -0.17 0.71 0.02 0.00 0.00 175.26 176.19 2hpa s TYR 1293N -1.96 2.64 -0.02 1.61 2.02 -1.26 -0.03 117.35 120.36 2hpa s TYR 1293Ca 0.23 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.60 2hpa s TYR 1293Cb -0.07 -1.65 -0.01 0.00 -0.40 0.00 0.00 41.96 39.83 2hpa s TYR 1293CO 0.11 0.02 -0.14 -0.06 -1.57 0.00 0.00 175.55 173.91 2hpa s PHE 1294N -0.41 1.34 -0.18 2.71 0.08 0.08 -0.25 117.98 121.34 2hpa s PHE 1294Ca 0.04 -0.30 -0.11 0.00 0.12 0.00 0.00 56.93 56.68 2hpa s PHE 1294Cb -0.12 -0.89 -0.05 0.00 -0.57 0.00 0.00 43.02 41.39 2hpa s PHE 1294CO 0.02 -0.07 0.20 0.08 -0.10 0.00 0.00 175.22 175.34 2hpa s VAL 1295N -0.14 5.37 -0.09 -0.44 1.01 0.22 -0.54 120.40 125.79 2hpa s VAL 1295Ca 0.02 0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.35 2hpa s VAL 1295Cb -0.08 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.79 2hpa s VAL 1295CO 0.00 0.43 -0.13 -1.61 0.00 0.00 0.00 175.10 173.79 2hpa s GLU 1296N 0.32 1.94 0.09 2.72 2.02 0.85 -1.71 118.70 124.93 2hpa s GLU 1296Ca 0.12 -0.47 0.08 0.00 0.02 0.00 0.00 54.97 54.71 2hpa s GLU 1296Cb -0.12 -1.66 -0.04 0.00 0.10 0.00 0.00 34.13 32.42 2hpa s GLU 1296CO 0.01 -0.04 -0.15 -1.64 0.02 0.00 0.00 175.26 173.46 2hpa s MET 1297N 0.91 2.00 0.28 1.61 -1.94 -1.26 0.37 119.30 121.27 2hpa s MET 1297Ca -0.09 -1.06 0.04 0.00 -1.71 0.00 0.00 55.69 52.86 2hpa s MET 1297Cb -0.15 -2.21 -0.03 0.00 2.01 0.00 0.00 34.83 34.44 2hpa s MET 1297CO 0.00 0.51 0.21 0.71 -0.01 0.00 0.00 175.02 176.44 2hpa s TYR 1298N -1.12 1.53 -0.22 -0.03 2.02 0.15 -1.81 117.35 117.88 2hpa s TYR 1298Ca 0.18 -1.53 -0.04 0.00 -0.37 0.00 0.00 57.07 55.32 2hpa s TYR 1298Cb -0.11 -0.68 0.09 0.00 -0.40 0.00 0.00 41.96 40.85 2hpa s TYR 1298CO 0.10 -0.74 0.16 -0.47 -1.57 0.00 0.00 175.55 173.02 2hpa s TYR 1299N -3.71 0.03 -1.20 2.71 5.04 -0.08 -1.64 117.35 118.50 2hpa s TYR 1299Ca 0.39 -0.28 -0.16 0.00 -2.44 0.00 0.00 57.07 54.58 2hpa s TYR 1299Cb 0.04 -0.63 0.13 0.00 0.35 0.00 0.00 41.96 41.86 2hpa s TYR 1299CO 0.21 -0.65 1.49 0.50 -1.34 0.00 0.00 175.55 175.76 2hpa s ARG 1300N 2.20 4.00 0.00 4.97 3.52 0.14 -0.64 118.95 133.14 2hpa s ARG 1300Ca 0.06 -2.28 0.20 0.00 -0.13 0.00 0.00 55.73 53.57 2hpa s ARG 1300Cb -0.16 -5.20 0.50 0.00 -1.56 0.00 0.00 34.95 28.54 2hpa s ARG 1300CO -0.19 -1.93 1.42 0.27 -0.81 0.00 0.00 175.30 174.07 2hpa n ASN 1301N 6.64 3.56 -3.65 -2.12 6.94 -1.26 -2.32 115.26 123.06 2hpa n ASN 1301Ca 0.39 -1.98 -0.11 0.00 -0.02 0.00 0.00 54.58 52.86 2hpa n ASN 1301Cb 0.45 -0.36 -0.11 0.00 -2.36 0.00 0.00 39.78 37.40 2hpa n ASN 1301CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2hpa s GLU 1302N -1.12 0.24 0.24 -3.83 2.02 -1.26 -4.83 118.70 110.15 2hpa s GLU 1302Ca 0.40 0.89 -0.05 0.00 0.02 0.00 0.00 54.97 56.23 2hpa s GLU 1302Cb 0.22 0.14 0.38 0.00 0.10 0.00 0.00 34.13 34.96 2hpa s GLU 1302CO 0.29 -0.28 1.80 1.15 0.02 0.00 0.00 175.26 178.24 2hpa h THR 1303N 6.23 0.90 -0.14 3.63 2.02 -1.99 -2.53 112.91 121.03 2hpa h THR 1303Ca -0.15 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 2hpa h THR 1303Cb 1.11 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 2hpa h THR 1303CO 0.13 0.14 0.00 0.00 0.37 0.00 0.00 175.52 176.16 2hpa n GLN 1304N -4.77 1.92 -3.87 6.66 0.00 -1.26 -4.88 117.38 111.17 2hpa n GLN 1304Ca 0.13 -0.75 -0.09 0.00 0.00 0.00 0.00 57.00 56.29 2hpa n GLN 1304Cb 0.27 -1.67 -0.07 0.00 0.00 0.00 0.00 30.24 28.76 2hpa n GLN 1304CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 2hpa s HIS 1305N -1.40 0.17 0.41 2.61 3.76 -0.95 -5.14 115.29 114.75 2hpa s HIS 1305Ca 0.13 -0.61 -0.24 0.00 -0.15 0.00 0.00 55.06 54.19 2hpa s HIS 1305Cb 0.10 -0.08 -0.08 0.00 1.11 0.00 0.00 32.58 33.63 2hpa s HIS 1305CO 0.04 -0.54 1.11 -1.83 -0.85 0.00 0.00 174.74 172.67 2hpa s GLU 1306N -3.86 4.05 0.40 1.40 -1.05 -1.26 -4.80 118.70 113.58 2hpa s GLU 1306Ca 0.05 1.67 -0.26 0.00 -0.15 0.00 0.00 54.97 56.28 2hpa s GLU 1306Cb 0.05 -2.57 -0.10 0.00 -0.44 0.00 0.00 34.13 31.07 2hpa s GLU 1306CO -0.11 -0.28 1.25 -0.35 0.95 0.00 0.00 175.26 176.73 2hpa n PRO 1307N -0.09 1.93 -2.28 -4.83 -0.04 -1.26 -4.89 135.00 123.53 2hpa n PRO 1307Ca 0.05 0.68 -0.43 0.00 -0.04 0.00 0.00 63.50 63.77 2hpa n PRO 1307Cb 0.48 -2.34 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 2hpa n PRO 1307CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2hpa s TYR 1308N -1.18 2.53 0.05 0.54 1.51 0.18 -4.64 117.35 116.35 2hpa s TYR 1308Ca 0.60 0.73 -0.31 0.00 -1.01 0.00 0.00 57.07 57.09 2hpa s TYR 1308Cb -0.53 -3.69 -0.07 0.00 -0.11 0.00 0.00 41.96 37.57 2hpa s TYR 1308CO 0.59 -2.39 1.48 -1.25 -1.11 0.00 0.00 175.55 172.86 2hpa s PRO 1309N 3.80 4.26 0.28 -1.71 0.04 -1.26 -0.90 135.00 139.51 2hpa s PRO 1309Ca 0.61 2.11 0.04 0.00 0.04 0.00 0.00 61.00 63.80 2hpa s PRO 1309Cb -0.25 -3.49 -0.03 0.00 0.04 0.00 0.00 34.50 30.78 2hpa s PRO 1309CO 0.21 -0.59 0.43 -0.51 0.04 0.00 0.00 177.00 176.57 2hpa s LEU 1310N 2.11 4.21 -0.11 -3.56 1.43 -0.75 -4.92 118.68 117.08 2hpa s LEU 1310Ca 0.67 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.92 2hpa s LEU 1310Cb -0.36 -3.00 0.06 0.00 0.03 0.00 0.00 46.19 42.92 2hpa s LEU 1310CO 0.29 -0.16 0.19 -0.32 0.23 0.00 0.00 176.35 176.58 2hpa s MET 1311N -4.10 0.08 -0.29 1.70 -2.45 -1.26 -4.43 119.30 108.55 2hpa s MET 1311Ca 0.36 0.54 -0.28 0.00 -1.25 0.00 0.00 55.69 55.06 2hpa s MET 1311Cb -0.09 -0.38 -0.06 0.00 1.25 0.00 0.00 34.83 35.54 2hpa s MET 1311CO 0.31 -0.36 2.27 -0.11 1.05 0.00 0.00 175.02 178.18 2hpa n LEU 1312N 5.33 2.94 -4.63 4.11 7.94 -1.26 -4.85 117.00 126.58 2hpa n LEU 1312Ca -0.05 0.07 -0.52 0.00 -1.11 0.00 0.00 56.01 54.40 2hpa n LEU 1312Cb 0.50 -1.53 -0.06 0.00 0.53 0.00 0.00 43.42 42.86 2hpa n LEU 1312CO 0.05 -0.88 1.06 -0.81 -1.11 0.00 0.00 177.39 175.70 2hpa n PRO 1313N 8.77 1.38 0.00 1.96 -0.04 -1.26 0.22 135.00 146.03 2hpa n PRO 1313Ca 0.33 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 2hpa n PRO 1313Cb 0.45 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 2hpa n PRO 1313CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hpa n GLY 1314N 3.06 0.72 3.39 0.55 0.00 -1.26 -5.05 105.19 106.60 2hpa n GLY 1314Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 2hpa n GLY 1314CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpa s SER 1316N -3.48 4.14 0.21 0.00 0.01 -1.26 -4.60 113.70 108.72 2hpa s SER 1316Ca 0.32 -0.36 -0.02 0.00 1.31 0.00 0.00 55.95 57.20 2hpa s SER 1316Cb 0.02 0.06 0.19 0.00 0.21 0.00 0.00 66.02 66.50 2hpa s SER 1316CO 0.21 -2.01 1.58 -0.65 0.41 0.00 0.00 173.24 172.77 2hpa h PRO 1317N -0.68 0.59 -3.39 12.44 0.11 -1.92 -3.28 132.00 135.87 2hpa h PRO 1317Ca -0.36 -0.31 -0.77 0.00 0.11 0.00 0.00 66.00 64.67 2hpa h PRO 1317Cb 1.26 0.01 -0.31 0.00 0.11 0.00 0.00 31.00 32.07 2hpa h PRO 1317CO 0.38 0.90 0.29 0.45 -0.21 0.00 0.00 178.00 179.82 2hpa n SER 1318N -4.03 5.16 -4.75 -2.05 2.88 -1.26 -4.38 113.62 105.18 2hpa n SER 1318Ca -0.02 -3.11 -0.41 0.00 -1.33 0.00 0.00 58.87 54.00 2hpa n SER 1318Cb 0.52 -1.25 -0.04 0.00 -0.75 0.00 0.00 64.21 62.70 2hpa n SER 1318CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hpa s PRO 1320N -1.10 4.36 0.20 0.00 0.02 -1.26 0.69 135.00 137.92 2hpa s PRO 1320Ca 0.48 1.77 -0.10 0.00 0.02 0.00 0.00 61.00 63.18 2hpa s PRO 1320Cb -0.34 -3.49 0.27 0.00 0.02 0.00 0.00 34.50 30.96 2hpa s PRO 1320CO 0.42 -0.42 1.23 -0.11 -0.33 0.00 0.00 177.00 177.79 2hpa n LEU 1321N 4.82 -0.40 -0.25 -5.54 7.94 0.65 -0.06 117.00 124.16 2hpa n LEU 1321Ca 0.11 1.37 0.05 0.00 -1.11 0.00 0.00 56.01 56.42 2hpa n LEU 1321Cb 0.46 -0.36 0.18 0.00 0.53 0.00 0.00 43.42 44.22 2hpa n LEU 1321CO 0.56 -1.27 1.01 -0.33 -1.11 0.00 0.00 177.39 176.25 2hpa h GLU 1322N 0.00 0.41 0.05 1.96 3.07 -1.91 0.28 114.58 118.45 2hpa h GLU 1322Ca 0.32 -0.02 -0.23 0.00 -0.50 0.00 0.00 59.36 58.93 2hpa h GLU 1322Cb 0.52 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 2hpa h GLU 1322CO -0.80 0.27 -1.06 -0.09 -1.40 0.00 0.00 179.01 175.93 2hpa h ARG 1323N 0.42 0.19 -0.43 2.33 2.43 -0.85 -2.93 114.38 115.53 2hpa h ARG 1323Ca 0.40 -0.28 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2hpa h ARG 1323Cb 0.61 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.23 2hpa h ARG 1323CO -0.40 1.08 0.25 0.35 -1.51 0.00 0.00 179.97 179.74 2hpa h PHE 1324N 0.07 0.47 0.13 2.20 3.04 -0.22 0.24 116.94 122.88 2hpa h PHE 1324Ca -0.07 0.02 0.02 0.00 3.98 0.00 0.00 57.97 61.91 2hpa h PHE 1324Cb 1.77 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 40.09 2hpa h PHE 1324CO 0.04 0.27 -0.27 0.00 -2.02 0.00 0.00 178.31 176.32 2hpa h ALA 1325N 1.20 -0.48 -0.28 2.41 0.00 -0.45 -0.78 119.26 120.88 2hpa h ALA 1325Ca 0.17 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 2hpa h ALA 1325Cb 0.02 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2hpa h ALA 1325CO -0.09 -0.82 -0.37 1.05 0.00 0.00 0.00 179.25 179.03 2hpa h GLU 1326N -0.50 0.64 -0.16 0.00 4.11 -1.28 -0.61 114.58 116.78 2hpa h GLU 1326Ca 0.03 -0.31 -0.02 0.00 0.07 0.00 0.00 59.36 59.12 2hpa h GLU 1326Cb 0.52 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2hpa h GLU 1326CO -0.15 0.91 0.02 -0.07 0.07 0.00 0.00 179.01 179.79 2hpa h LEU 1327N 0.53 0.26 -0.32 3.06 3.38 -0.34 -2.97 115.31 118.91 2hpa h LEU 1327Ca 0.05 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2hpa h LEU 1327Cb 0.88 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2hpa h LEU 1327CO 0.08 0.47 0.00 0.55 0.09 0.00 0.00 178.44 179.63 2hpa n VAL 1328N -4.77 0.69 -0.19 1.22 3.14 -0.31 -4.13 118.33 113.97 2hpa n VAL 1328Ca -0.05 -0.03 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 2hpa n VAL 1328Cb 0.19 -0.86 0.09 0.00 -1.06 0.00 0.00 33.84 32.21 2hpa n VAL 1328CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2hpa h GLY 1329N 3.46 0.65 0.73 7.55 0.00 -0.93 -2.22 103.07 112.31 2hpa h GLY 1329Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2hpa h GLY 1329CO 0.00 -0.17 0.00 -1.55 0.00 0.00 0.00 176.54 174.82 2hpa n PRO 1330N -5.24 0.31 0.00 4.80 -0.04 -1.26 -2.01 135.00 131.57 2hpa n PRO 1330Ca 0.08 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.60 2hpa n PRO 1330Cb 0.33 -1.37 -0.01 0.00 -0.04 0.00 0.00 33.50 32.42 2hpa n PRO 1330CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2hpa n VAL 1331N -0.87 0.00 -3.61 0.52 3.14 -0.83 -4.87 118.33 111.81 2hpa n VAL 1331Ca 0.05 -0.37 -0.37 0.00 -2.96 0.00 0.00 64.34 60.70 2hpa n VAL 1331Cb 0.02 1.11 -0.09 0.00 -1.06 0.00 0.00 33.84 33.82 2hpa n VAL 1331CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2hpa s ILE 1332N -1.51 5.33 0.65 1.55 1.01 -0.85 -3.35 121.20 124.02 2hpa s ILE 1332Ca 0.08 0.25 -0.16 0.00 0.00 0.00 0.00 60.65 60.82 2hpa s ILE 1332Cb 0.09 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 39.02 2hpa s ILE 1332CO 0.30 0.32 1.14 -2.16 0.00 0.00 0.00 174.94 174.53 2hpa s PRO 1333N 1.20 2.78 -0.01 2.79 0.04 -1.25 -4.95 135.00 135.59 2hpa s PRO 1333Ca 0.09 1.52 0.19 0.00 0.04 0.00 0.00 61.00 62.85 2hpa s PRO 1333Cb -0.14 -1.94 -0.21 0.00 0.04 0.00 0.00 34.50 32.26 2hpa s PRO 1333CO 0.06 -1.29 0.58 1.04 0.04 0.00 0.00 177.00 177.42 2hpa n GLN 1334N -2.24 0.65 -2.70 4.56 1.13 -1.26 -4.75 117.38 112.77 2hpa n GLN 1334Ca 0.11 0.02 -0.04 0.00 -1.94 0.00 0.00 57.00 55.16 2hpa n GLN 1334Cb 0.51 -1.66 0.03 0.00 0.11 0.00 0.00 30.24 29.24 2hpa n GLN 1334CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2hpa n ASP 1335N -2.63 -2.04 -0.36 1.08 -0.08 -1.26 -5.04 116.55 106.23 2hpa n ASP 1335Ca -0.12 -1.63 0.08 0.00 -1.51 0.00 0.00 54.79 51.61 2hpa n ASP 1335Cb 0.79 1.05 0.18 0.00 2.34 0.00 0.00 41.12 45.48 2hpa n ASP 1335CO 0.00 0.00 0.00 -0.25 0.12 0.00 0.00 177.20 177.07 2hpa h TRP 1336N 4.32 -0.40 0.17 -0.67 7.01 -1.90 0.40 115.95 124.88 2hpa h TRP 1336Ca -0.01 0.08 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 2hpa h TRP 1336Cb 1.15 0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 28.53 2hpa h TRP 1336CO -0.03 -0.43 -0.23 1.03 -2.79 0.00 0.00 178.44 175.98 2hpa h SER 1337N 0.00 -0.66 -0.66 2.65 0.87 -1.99 0.35 113.55 114.12 2hpa h SER 1337Ca 0.51 0.06 0.07 0.00 -1.23 0.00 0.00 61.79 61.20 2hpa h SER 1337Cb 0.87 0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 63.02 2hpa h SER 1337CO -1.00 -0.29 0.43 0.71 -0.53 0.00 0.00 176.83 176.16 2hpa h THR 1338N -0.42 0.99 0.00 2.23 1.35 -1.67 0.19 112.91 115.58 2hpa h THR 1338Ca -0.02 -0.22 -0.03 0.00 -0.55 0.00 0.00 66.41 65.59 2hpa h THR 1338Cb 0.38 0.30 -0.00 0.00 -1.73 0.00 0.00 68.15 67.10 2hpa h THR 1338CO -0.06 0.12 -0.13 -0.33 -0.25 0.00 0.00 175.52 174.86 2hpa h GLU 1339N 0.64 0.00 0.00 4.72 5.08 0.54 -2.31 114.58 123.25 2hpa h GLU 1339Ca 0.29 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.57 2hpa h GLU 1339Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2hpa h GLU 1339CO -0.09 0.13 -0.42 0.00 -1.00 0.00 0.00 179.01 177.63 2hpa n MET 1341N -3.17 2.26 0.00 0.00 2.81 -0.87 -0.01 117.12 118.14 2hpa n MET 1341Ca 0.02 0.80 0.00 0.00 -1.81 0.00 0.00 57.70 56.71 2hpa n MET 1341Cb 0.68 -2.57 0.00 0.00 -0.71 0.00 0.00 33.22 30.63 2hpa n MET 1341CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11