#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i6c s LEU 1003N 0.00 4.40 0.30 2.61 1.43 -1.26 -4.57 118.68 121.59 2i6c s LEU 1003Ca 0.00 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.30 2i6c s LEU 1003Cb 0.00 -3.16 -0.06 0.00 0.03 0.00 0.00 46.19 43.00 2i6c s LEU 1003CO 0.00 0.16 0.05 -0.94 0.23 0.00 0.00 176.35 175.85 2i6c s SER 1004N -1.50 2.07 0.05 2.29 1.04 -0.45 -4.97 113.70 112.24 2i6c s SER 1004Ca 0.35 -1.35 -0.03 0.00 0.48 0.00 0.00 55.95 55.40 2i6c s SER 1004Cb -0.17 -0.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.90 2i6c s SER 1004CO 0.19 -0.61 0.02 -1.38 0.98 0.00 0.00 173.24 172.44 2i6c s HIS 1005N -3.40 0.40 0.16 5.02 -3.43 -1.26 -0.90 115.29 111.88 2i6c s HIS 1005Ca 0.36 -0.88 -0.24 0.00 -0.80 0.00 0.00 55.06 53.50 2i6c s HIS 1005Cb 0.08 -0.29 0.06 0.00 -1.43 0.00 0.00 32.58 31.00 2i6c s HIS 1005CO 0.14 -0.39 0.73 -0.98 -2.00 0.00 0.00 174.74 172.23 2i6c s ARG 1006N -3.58 1.31 0.45 -0.38 1.70 -0.96 -5.01 118.95 112.47 2i6c s ARG 1006Ca 0.04 -0.59 -0.25 0.00 -0.47 0.00 0.00 55.73 54.46 2i6c s ARG 1006Cb 0.05 0.53 -0.09 0.00 -0.57 0.00 0.00 34.95 34.88 2i6c s ARG 1006CO -0.09 -0.59 1.27 -2.30 -1.08 0.00 0.00 175.30 172.51 2i6c n PRO 1007N -0.39 1.86 -1.78 3.89 -0.02 -1.26 -1.18 135.00 136.13 2i6c n PRO 1007Ca -0.11 0.67 -0.39 0.00 -2.02 0.00 0.00 63.50 61.65 2i6c n PRO 1007Cb 0.62 -2.40 0.04 0.00 -0.02 0.00 0.00 33.50 31.74 2i6c n PRO 1007CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i6c s ALA 1008N -1.23 2.93 0.23 3.55 0.00 -0.34 -4.65 121.76 122.26 2i6c s ALA 1008Ca 0.63 1.38 0.07 0.00 0.00 0.00 0.00 51.96 54.04 2i6c s ALA 1008Cb -0.49 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.00 2i6c s ALA 1008CO 0.56 -1.34 -0.11 -1.21 0.00 0.00 0.00 175.76 173.67 2i6c s GLU 1009N -2.79 1.40 0.44 0.00 2.02 -1.26 -4.97 118.70 113.54 2i6c s GLU 1009Ca 0.69 -1.66 0.09 0.00 0.02 0.00 0.00 54.97 54.11 2i6c s GLU 1009Cb -0.42 -1.10 0.96 0.00 0.10 0.00 0.00 34.13 33.67 2i6c s GLU 1009CO 0.50 0.12 2.08 1.79 0.02 0.00 0.00 175.26 179.77 2i6c h THR 1010N 2.46 1.08 0.00 3.63 1.35 -2.03 -0.48 112.91 118.92 2i6c h THR 1010Ca -0.39 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2i6c h THR 1010Cb 1.22 0.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2i6c h THR 1010CO 0.64 0.08 0.00 1.23 -0.25 0.00 0.00 175.52 177.21 2i6c h GLY 1011N 0.42 0.00 1.56 5.82 0.00 -2.02 -2.31 103.07 106.54 2i6c h GLY 1011Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2i6c h GLY 1011CO -0.03 0.00 -0.34 -0.55 0.00 0.00 0.00 176.54 175.62 2i6c h ASP 1012N 0.00 0.00 -0.47 0.19 3.32 -1.49 -3.40 116.42 114.57 2i6c h ASP 1012Ca 0.00 -0.09 0.03 0.00 0.02 0.00 0.00 57.03 56.99 2i6c h ASP 1012Cb 0.26 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.77 2i6c h ASP 1012CO 0.00 0.05 0.25 -0.07 -1.72 0.00 0.00 179.24 177.74 2i6c h LEU 1013N 0.00 0.37 -0.49 1.55 3.38 -1.48 -1.93 115.31 116.70 2i6c h LEU 1013Ca 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2i6c h LEU 1013Cb 0.78 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2i6c h LEU 1013CO 0.00 0.26 0.27 -0.08 0.09 0.00 0.00 178.44 178.98 2i6c h GLU 1014N 0.49 0.68 -0.11 1.13 4.81 -1.80 0.42 114.58 120.20 2i6c h GLU 1014Ca 0.20 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2i6c h GLU 1014Cb 0.09 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2i6c h GLU 1014CO -0.13 0.53 0.05 1.15 -0.73 0.00 0.00 179.01 179.88 2i6c h THR 1015N 0.65 1.14 -0.65 0.32 2.02 -1.77 -2.65 112.91 111.98 2i6c h THR 1015Ca 0.17 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 66.86 2i6c h THR 1015Cb 0.04 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 2i6c h THR 1015CO -0.03 0.13 0.15 0.58 0.37 0.00 0.00 175.52 176.71 2i6c h VAL 1016N 0.03 1.26 0.00 3.16 2.07 -1.17 -1.75 116.25 119.85 2i6c h VAL 1016Ca 0.04 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.60 2i6c h VAL 1016Cb 0.16 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2i6c h VAL 1016CO -0.00 0.36 0.00 0.00 0.02 0.00 0.00 177.57 177.95 2i6c h ALA 1017N 1.05 1.00 -0.00 1.67 0.00 -0.83 -0.92 119.26 121.24 2i6c h ALA 1017Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2i6c h ALA 1017Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2i6c h ALA 1017CO 0.00 0.00 -0.04 0.41 0.00 0.00 0.00 179.25 179.62 2i6c n GLY 1018N -0.67 -1.23 0.16 0.00 0.00 -0.66 -4.37 105.19 98.41 2i6c n GLY 1018Ca -0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2i6c n GLY 1018CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2i6c h PHE 1019N 0.13 0.53 -2.93 1.61 0.04 -1.18 -3.43 116.94 111.71 2i6c h PHE 1019Ca 0.00 -0.14 -0.53 0.00 2.80 0.00 0.00 57.97 60.10 2i6c h PHE 1019Cb 0.33 -0.12 0.03 0.00 2.20 0.00 0.00 35.95 38.39 2i6c h PHE 1019CO 0.00 0.77 0.79 -2.14 -0.60 0.00 0.00 178.31 177.14 2i6c s PRO 1020N -4.45 4.28 0.03 1.51 0.02 -1.26 -4.61 135.00 130.51 2i6c s PRO 1020Ca -0.14 2.15 0.22 0.00 0.02 0.00 0.00 61.00 63.26 2i6c s PRO 1020Cb 0.06 -3.29 -0.05 0.00 0.02 0.00 0.00 34.50 31.24 2i6c s PRO 1020CO 0.77 -0.51 0.93 1.04 -0.33 0.00 0.00 177.00 178.89 2i6c n GLN 1021N 4.23 0.29 -3.85 5.54 1.13 -1.26 -4.89 117.38 118.58 2i6c n GLN 1021Ca 0.13 -0.03 -0.09 0.00 -1.94 0.00 0.00 57.00 55.07 2i6c n GLN 1021Cb 0.41 -1.57 0.00 0.00 0.11 0.00 0.00 30.24 29.20 2i6c n GLN 1021CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2i6c s ASP 1022N -3.84 -0.03 0.39 1.08 1.47 -1.26 -5.02 116.67 109.45 2i6c s ASP 1022Ca 0.03 -0.98 0.11 0.00 1.18 0.00 0.00 52.55 52.89 2i6c s ASP 1022Cb 0.15 0.79 0.80 0.00 -0.34 0.00 0.00 42.92 44.31 2i6c s ASP 1022CO 0.83 -1.53 1.89 0.03 0.68 0.00 0.00 175.17 177.07 2i6c h ARG 1023N 2.02 0.11 -0.47 2.11 3.08 -1.99 -1.21 114.38 118.02 2i6c h ARG 1023Ca -0.27 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.64 2i6c h ARG 1023Cb 1.25 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 2i6c h ARG 1023CO 0.35 0.34 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.03 2i6c h ASP 1024N 0.10 0.92 -0.06 7.04 3.32 -1.99 -2.35 116.42 123.40 2i6c h ASP 1024Ca 0.02 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.58 2i6c h ASP 1024Cb 0.48 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 2i6c h ASP 1024CO 0.03 1.07 -0.37 -0.33 -1.72 0.00 0.00 179.24 177.93 2i6c h GLU 1025N 0.76 0.56 -0.18 3.56 5.08 -1.74 -2.23 114.58 120.39 2i6c h GLU 1025Ca 0.12 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 58.09 2i6c h GLU 1025Cb 0.67 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2i6c h GLU 1025CO 0.05 0.85 -0.41 1.25 -1.00 0.00 0.00 179.01 179.75 2i6c h LEU 1026N 0.47 0.44 -0.49 1.33 5.85 -1.28 -1.80 115.31 119.84 2i6c h LEU 1026Ca 0.05 -0.19 -0.14 0.00 0.84 0.00 0.00 57.88 58.43 2i6c h LEU 1026Cb 0.85 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2i6c h LEU 1026CO 0.07 0.80 -0.30 0.15 -0.34 0.00 0.00 178.44 178.83 2i6c h PHE 1027N 0.35 1.08 -0.62 1.25 3.57 -1.06 0.12 116.94 121.62 2i6c h PHE 1027Ca 0.03 -0.29 -0.09 0.00 3.53 0.00 0.00 57.97 61.15 2i6c h PHE 1027Cb 0.87 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 2i6c h PHE 1027CO 0.03 1.10 0.04 1.88 -2.23 0.00 0.00 178.31 179.12 2i6c h TYR 1028N 0.77 1.16 0.00 0.41 0.05 -1.38 -2.89 116.97 115.09 2i6c h TYR 1028Ca 0.08 -0.19 -0.07 0.00 0.05 0.00 0.00 58.73 58.61 2i6c h TYR 1028Cb 0.87 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 38.30 2i6c h TYR 1028CO 0.05 1.00 -0.34 0.00 -1.05 0.00 0.00 178.16 177.83 2i6c s TYR 1030N -3.53 -0.20 0.51 0.00 6.14 -0.01 -4.36 117.35 115.90 2i6c s TYR 1030Ca 0.01 -0.00 0.15 0.00 0.64 0.00 0.00 57.07 57.87 2i6c s TYR 1030Cb 0.10 0.04 1.23 0.00 0.42 0.00 0.00 41.96 43.75 2i6c s TYR 1030CO 0.68 -0.14 2.14 -1.35 0.64 0.00 0.00 175.55 177.52 2i6c h PRO 1031N 4.88 0.05 0.00 4.97 0.11 -1.68 -2.00 132.00 138.33 2i6c h PRO 1031Ca -0.04 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2i6c h PRO 1031Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2i6c h PRO 1031CO -0.10 0.03 -0.33 0.87 -0.21 0.00 0.00 178.00 178.26 2i6c h LYS 1032N 0.05 0.00 -7.24 1.05 1.57 -1.90 -3.46 116.57 106.63 2i6c h LYS 1032Ca 0.01 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.27 2i6c h LYS 1032Cb -0.01 0.00 0.19 0.00 0.08 0.00 0.00 32.23 32.50 2i6c h LYS 1032CO -0.00 0.00 0.28 0.00 -0.57 0.00 0.00 179.45 179.15 2i6c s ALA 1033N -3.21 1.63 -0.17 3.86 0.00 -0.75 -5.03 121.76 118.10 2i6c s ALA 1033Ca 0.06 0.71 0.01 0.00 0.00 0.00 0.00 51.96 52.75 2i6c s ALA 1033Cb 0.09 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.76 2i6c s ALA 1033CO 0.69 -2.56 -0.18 0.42 0.00 0.00 0.00 175.76 174.12 2i6c s ILE 1034N -2.42 1.89 0.48 0.00 1.01 -1.26 -4.97 121.20 115.92 2i6c s ILE 1034Ca 0.70 -0.84 -0.23 0.00 0.00 0.00 0.00 60.65 60.28 2i6c s ILE 1034Cb -0.26 -1.72 -0.08 0.00 0.01 0.00 0.00 42.46 40.41 2i6c s ILE 1034CO 0.55 0.51 1.20 1.87 0.00 0.00 0.00 174.94 179.07 2i6c n TRP 1035N 4.62 1.81 -2.31 3.97 -0.00 -1.26 -3.78 117.44 120.49 2i6c n TRP 1035Ca -0.20 0.48 -0.36 0.00 -0.00 0.00 0.00 57.50 57.43 2i6c n TRP 1035Cb 0.50 -2.31 -0.01 0.00 -0.00 0.00 0.00 31.31 29.49 2i6c n TRP 1035CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2i6c s PRO 1036N -2.40 3.70 0.79 5.87 0.04 -1.26 -5.13 135.00 136.61 2i6c s PRO 1036Ca 0.66 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 63.26 2i6c s PRO 1036Cb -0.48 -2.29 0.07 0.00 0.04 0.00 0.00 34.50 31.84 2i6c s PRO 1036CO 0.54 -0.57 1.09 0.12 0.04 0.00 0.00 177.00 178.22 2i6c s PHE 1037N -1.65 2.49 0.13 0.56 5.36 -1.25 -5.05 117.98 118.56 2i6c s PHE 1037Ca 0.66 1.55 -0.16 0.00 -0.96 0.00 0.00 56.93 58.01 2i6c s PHE 1037Cb -0.26 -3.08 0.04 0.00 -0.34 0.00 0.00 43.02 39.39 2i6c s PHE 1037CO 0.31 -1.92 0.41 -1.54 -1.46 0.00 0.00 175.22 171.02 2i6c s SER 1038N -3.35 -0.25 0.38 6.13 1.04 -1.26 -5.02 113.70 111.37 2i6c s SER 1038Ca 0.62 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.81 2i6c s SER 1038Cb -0.18 0.48 0.77 0.00 0.10 0.00 0.00 66.02 67.19 2i6c s SER 1038CO 0.56 -0.86 2.02 -0.37 0.98 0.00 0.00 173.24 175.57 2i6c h VAL 1039N 2.36 1.13 -0.52 5.02 -1.51 -1.93 -1.78 116.25 119.01 2i6c h VAL 1039Ca -0.34 -0.32 -0.06 0.00 -1.23 0.00 0.00 66.70 64.75 2i6c h VAL 1039Cb 1.26 0.53 -0.02 0.00 -2.13 0.00 0.00 31.29 30.93 2i6c h VAL 1039CO 0.46 0.14 0.09 0.00 -1.23 0.00 0.00 177.57 177.03 2i6c h ALA 1040N 1.67 0.69 -0.67 5.19 0.00 -1.97 0.70 119.26 124.87 2i6c h ALA 1040Ca 0.16 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2i6c h ALA 1040Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2i6c h ALA 1040CO -0.03 0.42 0.14 1.96 0.00 0.00 0.00 179.25 181.75 2i6c h GLN 1041N 0.74 1.08 -0.40 0.00 4.20 -1.87 -1.41 115.11 117.45 2i6c h GLN 1041Ca 0.16 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 2i6c h GLN 1041Cb 0.40 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 2i6c h GLN 1041CO 0.01 0.97 0.12 1.25 -0.67 0.00 0.00 178.83 180.51 2i6c h LEU 1042N 1.03 0.59 -1.15 1.46 5.85 -1.04 -1.89 115.31 120.15 2i6c h LEU 1042Ca 0.21 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2i6c h LEU 1042Cb 0.39 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2i6c h LEU 1042CO 0.01 0.64 0.10 0.00 -0.34 0.00 0.00 178.44 178.84 2i6c h ALA 1043N 0.97 1.32 -0.50 1.25 0.00 -0.70 -0.87 119.26 120.73 2i6c h ALA 1043Ca 0.13 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2i6c h ALA 1043Cb 0.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2i6c h ALA 1043CO -0.00 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.64 2i6c h ALA 1044N 1.44 0.90 -0.37 0.00 0.00 -1.04 -1.27 119.26 118.92 2i6c h ALA 1044Ca 0.15 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2i6c h ALA 1044Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2i6c h ALA 1044CO -0.00 0.64 0.16 0.00 0.00 0.00 0.00 179.25 180.05 2i6c h ALA 1045N 1.08 0.48 -0.64 0.00 0.00 -0.75 -2.74 119.26 116.68 2i6c h ALA 1045Ca 0.14 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2i6c h ALA 1045Cb 0.61 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2i6c h ALA 1045CO 0.04 0.06 0.43 0.82 0.00 0.00 0.00 179.25 180.59 2i6c h ILE 1046N 0.45 1.17 0.00 0.00 2.04 -0.87 -2.07 117.51 118.23 2i6c h ILE 1046Ca 0.12 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2i6c h ILE 1046Cb 0.15 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2i6c h ILE 1046CO -0.01 0.16 -0.15 0.00 0.00 0.00 0.00 178.15 178.14 2i6c h ALA 1047N 1.24 1.55 -0.01 1.87 0.00 -1.10 -2.27 119.26 120.54 2i6c h ALA 1047Ca 0.24 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2i6c h ALA 1047Cb -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2i6c h ALA 1047CO -0.05 0.19 -0.27 0.39 0.00 0.00 0.00 179.25 179.51 2i6c n GLU 1048N -4.06 0.78 -3.15 0.00 1.02 -0.82 -4.98 120.64 109.43 2i6c n GLU 1048Ca -0.02 -0.45 -0.14 0.00 -0.02 0.00 0.00 57.16 56.53 2i6c n GLU 1048Cb 0.23 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 2i6c n GLU 1048CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2i6c n ARG 1049N -0.72 1.36 -4.12 3.49 1.74 -0.85 -5.02 116.66 112.54 2i6c n ARG 1049Ca 0.12 -1.59 -0.14 0.00 -0.77 0.00 0.00 57.85 55.47 2i6c n ARG 1049Cb 0.34 0.49 -0.11 0.00 -1.02 0.00 0.00 32.46 32.17 2i6c n ARG 1049CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2i6c s ARG 1050N -2.78 0.68 -0.63 5.56 1.81 -1.08 -4.91 118.95 117.61 2i6c s ARG 1050Ca 0.01 -0.95 0.00 0.00 -1.72 0.00 0.00 55.73 53.07 2i6c s ARG 1050Cb 0.00 -0.42 0.00 0.00 -0.45 0.00 0.00 34.95 34.08 2i6c s ARG 1050CO 0.01 0.07 0.00 0.41 -0.68 0.00 0.00 175.30 175.11 2i6c n GLY 1051N 1.04 0.35 3.65 -3.53 0.00 -1.26 -0.74 105.19 104.70 2i6c n GLY 1051Ca -0.20 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2i6c n GLY 1051CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i6c s SER 1052N -2.77 6.49 -0.01 1.61 0.01 -1.26 -4.36 113.70 113.41 2i6c s SER 1052Ca 0.00 2.22 0.02 0.00 1.31 0.00 0.00 55.95 59.50 2i6c s SER 1052Cb 0.00 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 2i6c s SER 1052CO 0.00 -1.08 -0.08 -0.89 0.41 0.00 0.00 173.24 171.61 2i6c s THR 1053N 4.61 0.60 0.11 1.44 2.01 -0.09 -1.20 115.64 123.11 2i6c s THR 1053Ca 0.78 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.53 2i6c s THR 1053Cb -0.34 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 2i6c s THR 1053CO 0.33 0.17 -0.06 0.68 -0.69 0.00 0.00 174.62 175.05 2i6c s VAL 1054N -0.17 3.60 -0.12 3.82 -7.23 -0.33 -1.51 120.40 118.47 2i6c s VAL 1054Ca 0.03 -1.22 -0.04 0.00 -1.81 0.00 0.00 61.98 58.94 2i6c s VAL 1054Cb -0.03 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 2i6c s VAL 1054CO -0.00 0.08 0.02 0.00 -0.31 0.00 0.00 175.10 174.89 2i6c s ALA 1055N -1.32 3.31 -0.05 1.32 0.00 -0.36 -2.28 121.76 122.39 2i6c s ALA 1055Ca 0.24 -0.78 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2i6c s ALA 1055Cb -0.11 -1.62 -0.00 0.00 0.00 0.00 0.00 23.12 21.38 2i6c s ALA 1055CO 0.16 0.44 -0.17 0.08 0.00 0.00 0.00 175.76 176.27 2i6c s VAL 1056N -0.42 1.43 -0.03 0.00 1.01 -0.08 -0.62 120.40 121.70 2i6c s VAL 1056Ca 0.08 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2i6c s VAL 1056Cb -0.12 -1.24 0.03 0.00 0.00 0.00 0.00 36.38 35.05 2i6c s VAL 1056CO 0.02 0.41 0.05 -2.28 0.00 0.00 0.00 175.10 173.30 2i6c s HIS 1057N 0.09 -0.01 -1.51 5.22 5.04 -0.26 -1.35 115.29 122.50 2i6c s HIS 1057Ca -0.05 0.18 -0.10 0.00 -1.54 0.00 0.00 55.06 53.55 2i6c s HIS 1057Cb -0.12 -0.17 0.07 0.00 0.04 0.00 0.00 32.58 32.40 2i6c s HIS 1057CO 0.02 -0.09 0.79 -3.47 -2.34 0.00 0.00 174.74 169.65 2i6c n ASP 1058N 3.99 -3.03 0.00 9.88 2.03 -1.26 -0.98 116.55 127.18 2i6c n ASP 1058Ca -0.25 -0.88 0.00 0.00 0.52 0.00 0.00 54.79 54.18 2i6c n ASP 1058Cb 0.52 -3.50 0.00 0.00 -0.72 0.00 0.00 41.12 37.42 2i6c n ASP 1058CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2i6c n GLY 1059N -1.66 0.66 3.50 0.27 0.00 -1.26 -5.01 105.19 101.69 2i6c n GLY 1059Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2i6c n GLY 1059CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2i6c s GLN 1060N -0.30 2.94 -0.26 1.61 -1.52 -0.15 -5.07 119.66 116.90 2i6c s GLN 1060Ca 0.00 -0.62 -0.29 0.00 -1.95 0.00 0.00 55.36 52.50 2i6c s GLN 1060Cb 0.00 -2.58 -0.01 0.00 -0.22 0.00 0.00 33.01 30.20 2i6c s GLN 1060CO 0.00 0.50 1.37 0.08 -0.25 0.00 0.00 175.29 176.99 2i6c s VAL 1061N -0.38 4.05 -0.16 1.09 1.01 -1.26 -1.11 120.40 123.64 2i6c s VAL 1061Ca 0.05 1.20 0.07 0.00 0.00 0.00 0.00 61.98 63.30 2i6c s VAL 1061Cb -0.12 -4.02 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 2i6c s VAL 1061CO 0.02 -0.39 0.23 0.18 0.00 0.00 0.00 175.10 175.14 2i6c n LEU 1062N 7.67 0.16 -3.63 3.92 4.77 0.21 -4.86 117.00 125.24 2i6c n LEU 1062Ca 0.16 -0.23 -0.13 0.00 -0.03 0.00 0.00 56.01 55.77 2i6c n LEU 1062Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 2i6c n LEU 1062CO 0.62 0.04 0.20 -0.83 -1.33 0.00 0.00 177.39 176.09 2i6c s GLY 1063N -2.30 -0.33 -0.05 -0.72 0.00 -1.14 -0.73 107.32 102.04 2i6c s GLY 1063Ca -0.00 0.38 -0.04 0.00 0.00 0.00 0.00 44.72 45.05 2i6c s GLY 1063CO 0.30 0.10 0.14 -0.12 0.00 0.00 0.00 173.10 173.52 2i6c s PHE 1064N -2.61 -0.15 0.10 1.90 5.36 -1.26 -1.23 117.98 120.10 2i6c s PHE 1064Ca -0.04 0.40 -0.12 0.00 -0.96 0.00 0.00 56.93 56.20 2i6c s PHE 1064Cb -0.01 0.01 0.02 0.00 -0.34 0.00 0.00 43.02 42.70 2i6c s PHE 1064CO -0.03 -0.10 0.29 0.00 -1.46 0.00 0.00 175.22 173.92 2i6c s ALA 1065N 0.38 -0.56 0.32 11.12 0.00 -0.57 -4.78 121.76 127.68 2i6c s ALA 1065Ca -0.03 -0.34 -0.06 0.00 0.00 0.00 0.00 51.96 51.54 2i6c s ALA 1065Cb -0.04 0.56 0.02 0.00 0.00 0.00 0.00 23.12 23.67 2i6c s ALA 1065CO -0.02 -0.56 0.52 0.27 0.00 0.00 0.00 175.76 175.97 2i6c n ASN 1066N -0.09 -1.47 -4.75 0.00 0.23 -1.04 -0.92 115.26 107.22 2i6c n ASN 1066Ca -0.16 -2.56 -0.36 0.00 -0.53 0.00 0.00 54.58 50.97 2i6c n ASN 1066Cb 0.63 2.61 -0.08 0.00 -2.08 0.00 0.00 39.78 40.86 2i6c n ASN 1066CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 2i6c s PHE 1067N -3.16 3.36 -0.78 -2.53 0.08 0.09 -0.32 117.98 114.71 2i6c s PHE 1067Ca 0.21 0.31 0.21 0.00 0.12 0.00 0.00 56.93 57.78 2i6c s PHE 1067Cb -0.02 -1.91 -0.24 0.00 -0.57 0.00 0.00 43.02 40.27 2i6c s PHE 1067CO 0.15 0.51 0.79 2.48 -0.10 0.00 0.00 175.22 179.06 2i6c n TYR 1068N 2.37 0.00 -4.10 0.36 0.18 -0.47 -2.63 117.16 112.87 2i6c n TYR 1068Ca -0.19 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.45 2i6c n TYR 1068Cb 0.54 -0.10 -0.13 0.00 -0.38 0.00 0.00 39.34 39.27 2i6c n TYR 1068CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 2i6c s GLN 1069N -3.05 0.48 -0.20 -3.48 -0.21 -1.20 -4.98 119.66 107.02 2i6c s GLN 1069Ca 0.05 -0.52 -0.11 0.00 0.02 0.00 0.00 55.36 54.79 2i6c s GLN 1069Cb 0.15 -0.33 0.07 0.00 1.00 0.00 0.00 33.01 33.90 2i6c s GLN 1069CO 0.85 0.07 0.48 1.67 -2.12 0.00 0.00 175.29 176.25 2i6c s TRP 1070N -0.87 -0.73 -0.19 0.91 -2.14 -1.26 -1.27 118.94 113.38 2i6c s TRP 1070Ca -0.05 1.52 -0.05 0.00 2.66 0.00 0.00 56.10 60.18 2i6c s TRP 1070Cb -0.07 0.37 0.07 0.00 -3.10 0.00 0.00 33.47 30.74 2i6c s TRP 1070CO 0.00 -0.40 0.13 -0.65 -2.66 0.00 0.00 176.95 173.38 2i6c s GLN 1071N 1.50 0.11 0.23 3.25 -1.52 -0.06 -5.01 119.66 118.16 2i6c s GLN 1071Ca -0.09 -0.06 -0.32 0.00 -1.95 0.00 0.00 55.36 52.94 2i6c s GLN 1071Cb -0.08 -1.58 -0.13 0.00 -0.22 0.00 0.00 33.01 31.01 2i6c s GLN 1071CO -0.15 -0.71 1.58 1.58 -0.25 0.00 0.00 175.29 177.34 2i6c n HIS 1072N 5.29 2.52 -0.99 0.91 -0.00 -1.26 -1.29 115.22 120.40 2i6c n HIS 1072Ca -0.06 0.25 0.00 0.00 -0.00 0.00 0.00 57.72 57.90 2i6c n HIS 1072Cb 0.48 -2.57 0.00 0.00 -0.00 0.00 0.00 29.99 27.90 2i6c n HIS 1072CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2i6c n GLY 1073N 2.92 0.82 0.00 1.57 0.00 0.91 -4.83 105.19 106.57 2i6c n GLY 1073Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2i6c n GLY 1073CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2i6c n ASP 1074N 0.00 0.00 -3.62 1.61 -0.08 -0.41 -4.50 116.55 109.55 2i6c n ASP 1074Ca 0.00 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.18 2i6c n ASP 1074Cb 0.00 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.43 2i6c n ASP 1074CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 2i6c s PHE 1075N 0.00 -0.28 0.21 -0.67 -0.12 -0.97 -1.20 117.98 114.95 2i6c s PHE 1075Ca 0.00 -0.03 0.09 0.00 -0.05 0.00 0.00 56.93 56.94 2i6c s PHE 1075Cb 0.00 0.44 -0.05 0.00 -0.63 0.00 0.00 43.02 42.78 2i6c s PHE 1075CO 0.00 -0.87 -0.16 0.00 -0.05 0.00 0.00 175.22 174.13 2i6c s ALA 1077N -2.68 1.42 0.15 0.00 0.00 -0.40 -0.74 121.76 119.51 2i6c s ALA 1077Ca 0.22 -0.51 -0.33 0.00 0.00 0.00 0.00 51.96 51.34 2i6c s ALA 1077Cb -0.03 -0.61 -0.13 0.00 0.00 0.00 0.00 23.12 22.36 2i6c s ALA 1077CO 0.08 0.15 1.65 -0.11 0.00 0.00 0.00 175.76 177.53 2i6c n LEU 1078N 3.75 3.38 0.00 0.00 7.94 -0.37 -1.37 117.00 130.33 2i6c n LEU 1078Ca -0.22 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 55.74 2i6c n LEU 1078Cb 0.52 -1.46 0.00 0.00 0.53 0.00 0.00 43.42 43.01 2i6c n LEU 1078CO 0.26 -0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.01 2i6c n GLY 1079N 3.67 0.58 2.17 -3.96 0.00 0.56 -4.41 105.19 103.80 2i6c n GLY 1079Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 2i6c n GLY 1079CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2i6c n ASN 1080N 0.00 -2.13 -3.63 1.61 5.03 -1.26 -4.86 115.26 110.02 2i6c n ASN 1080Ca 0.00 -0.83 -0.13 0.00 0.87 0.00 0.00 54.58 54.49 2i6c n ASN 1080Cb 0.00 -0.64 -0.07 0.00 -1.02 0.00 0.00 39.78 38.05 2i6c n ASN 1080CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2i6c s VAL 1083N -2.12 0.00 0.27 2.41 1.01 -1.26 -2.49 120.40 118.23 2i6c s VAL 1083Ca 0.44 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.12 2i6c s VAL 1083Cb -0.05 -1.00 -0.12 0.00 0.00 0.00 0.00 36.38 35.21 2i6c s VAL 1083CO 0.35 0.00 1.54 0.00 0.00 0.00 0.00 175.10 176.99 2i6c n ALA 1084N 2.99 2.12 -0.25 5.51 0.00 0.09 -4.85 120.51 126.13 2i6c n ALA 1084Ca -0.15 0.39 0.03 0.00 0.00 0.00 0.00 53.44 53.71 2i6c n ALA 1084Cb 0.56 -2.41 0.13 0.00 0.00 0.00 0.00 19.45 17.73 2i6c n ALA 1084CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2i6c h PRO 1085N 4.68 0.07 0.00 0.00 0.11 -1.91 0.26 132.00 135.22 2i6c h PRO 1085Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2i6c h PRO 1085Cb 1.24 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2i6c h PRO 1085CO 0.79 0.05 0.00 0.00 -0.21 0.00 0.00 178.00 178.63 2i6c h ALA 1086N 1.69 1.00 -0.17 -0.75 0.00 -1.98 -2.67 119.26 116.37 2i6c h ALA 1086Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2i6c h ALA 1086Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2i6c h ALA 1086CO -0.66 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.59 2i6c n ALA 1087N -2.05 2.41 -1.77 0.00 0.00 0.06 -5.01 120.51 114.15 2i6c n ALA 1087Ca -0.01 -0.81 -0.38 0.00 0.00 0.00 0.00 53.44 52.24 2i6c n ALA 1087Cb 0.17 -0.59 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 2i6c n ALA 1087CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2i6c s ARG 1088N -1.26 3.94 0.00 0.00 0.52 -1.01 -2.90 118.95 118.24 2i6c s ARG 1088Ca 0.24 1.78 0.00 0.00 -0.52 0.00 0.00 55.73 57.23 2i6c s ARG 1088Cb 0.15 -2.55 0.00 0.00 0.52 0.00 0.00 34.95 33.07 2i6c s ARG 1088CO 0.22 -0.40 0.00 0.41 0.02 0.00 0.00 175.30 175.55 2i6c n GLY 1089N 0.52 0.70 0.59 -3.53 0.00 -1.26 -4.91 105.19 97.30 2i6c n GLY 1089Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2i6c n GLY 1089CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2i6c n LEU 1090N 0.00 2.82 0.00 0.99 4.77 -1.14 -4.97 117.00 119.47 2i6c n LEU 1090Ca 0.00 -1.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.03 2i6c n LEU 1090Cb 0.00 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2i6c n LEU 1090CO 0.00 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 2i6c n GLY 1091N 0.46 0.84 0.10 -0.72 0.00 -1.26 -4.99 105.19 99.62 2i6c n GLY 1091Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2i6c n GLY 1091CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2i6c h VAL 1092N 0.00 1.34 -0.51 1.61 2.07 -1.94 -0.07 116.25 118.75 2i6c h VAL 1092Ca 0.00 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2i6c h VAL 1092Cb 0.00 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2i6c h VAL 1092CO 0.00 0.32 0.21 0.00 0.02 0.00 0.00 177.57 178.11 2i6c h ALA 1093N 0.61 0.67 -0.39 1.67 0.00 -1.94 -0.50 119.26 119.37 2i6c h ALA 1093Ca 0.02 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2i6c h ALA 1093Cb 0.53 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 2i6c h ALA 1093CO 0.02 0.28 -0.14 -0.09 0.00 0.00 0.00 179.25 179.31 2i6c h ARG 1094N 0.69 -0.05 -0.03 0.00 2.43 -1.96 0.57 114.38 116.03 2i6c h ARG 1094Ca 0.17 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2i6c h ARG 1094Cb 0.20 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2i6c h ARG 1094CO -0.01 -0.03 0.02 -0.92 -1.51 0.00 0.00 179.97 177.51 2i6c h TYR 1095N -0.05 0.04 -0.70 2.20 3.20 -0.73 -2.67 116.97 118.26 2i6c h TYR 1095Ca 0.19 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 2i6c h TYR 1095Cb 0.35 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 2i6c h TYR 1095CO -0.38 0.11 0.30 -0.07 -1.64 0.00 0.00 178.16 176.47 2i6c h LEU 1096N -0.04 0.93 -0.91 2.82 3.38 -0.76 -1.75 115.31 118.98 2i6c h LEU 1096Ca 0.01 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2i6c h LEU 1096Cb 0.08 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 2i6c h LEU 1096CO -0.00 0.82 0.59 0.40 0.09 0.00 0.00 178.44 180.34 2i6c h ILE 1097N 1.00 1.18 -0.84 1.22 1.08 -0.78 -2.44 117.51 117.93 2i6c h ILE 1097Ca 0.24 -0.40 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 2i6c h ILE 1097Cb 0.16 -0.10 -0.04 0.00 -3.07 0.00 0.00 36.82 33.78 2i6c h ILE 1097CO -0.02 0.21 0.43 1.23 -0.69 0.00 0.00 178.15 179.31 2i6c h GLY 1098N 1.17 1.28 -1.39 5.37 0.00 -1.06 0.47 103.07 108.91 2i6c h GLY 1098Ca 0.35 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2i6c h GLY 1098CO -0.10 0.58 0.00 -0.62 0.00 0.00 0.00 176.54 176.40 2i6c n VAL 1099N -4.35 0.11 0.00 4.60 0.31 -0.72 -1.75 118.33 116.54 2i6c n VAL 1099Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2i6c n VAL 1099Cb 0.12 -0.34 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 2i6c n VAL 1099CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2i6c n GLU 1101N 0.56 0.00 -0.26 5.55 1.02 0.15 -1.26 120.64 126.40 2i6c n GLU 1101Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 2i6c n GLU 1101Cb 0.10 0.00 0.05 0.00 -0.02 0.00 0.00 31.44 31.57 2i6c n GLU 1101CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2i6c h ASN 1102N 0.00 0.95 -0.58 1.62 2.35 -1.60 -1.13 115.58 117.19 2i6c h ASN 1102Ca 0.00 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.54 2i6c h ASN 1102Cb 0.00 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 2i6c h ASN 1102CO 0.00 0.83 0.09 0.25 -1.65 0.00 0.00 177.43 176.95 2i6c h LEU 1103N 1.01 0.93 -0.53 1.61 5.85 -1.45 0.20 115.31 122.92 2i6c h LEU 1103Ca 0.25 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.76 2i6c h LEU 1103Cb 0.14 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 2i6c h LEU 1103CO -0.03 0.95 0.26 0.00 -0.34 0.00 0.00 178.44 179.28 2i6c h ALA 1104N 1.01 0.68 -0.25 1.25 0.00 -1.78 0.56 119.26 120.74 2i6c h ALA 1104Ca 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2i6c h ALA 1104Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2i6c h ALA 1104CO 0.01 -0.10 0.12 0.00 0.00 0.00 0.00 179.25 179.28 2i6c h ARG 1105N 0.49 0.36 0.14 0.00 3.08 -0.91 -1.49 114.38 116.05 2i6c h ARG 1105Ca 0.24 -0.05 -0.34 0.00 0.07 0.00 0.00 59.98 59.90 2i6c h ARG 1105Cb 0.18 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 2i6c h ARG 1105CO -0.18 0.36 -1.72 0.93 -1.07 0.00 0.00 179.97 178.28 2i6c h GLU 1106N 0.27 0.30 0.05 0.04 5.08 -0.72 -2.55 114.58 117.04 2i6c h GLU 1106Ca 0.09 -0.51 -0.32 0.00 -1.00 0.00 0.00 59.36 57.61 2i6c h GLU 1106Cb 0.12 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 2i6c h GLU 1106CO -0.01 1.18 -1.84 0.94 -1.00 0.00 0.00 179.01 178.27 2i6c n GLN 1107N -3.49 0.69 0.00 2.33 7.27 0.17 -4.54 117.38 119.81 2i6c n GLN 1107Ca -0.23 0.28 0.05 0.00 0.07 0.00 0.00 57.00 57.17 2i6c n GLN 1107Cb 1.06 -1.75 0.02 0.00 2.41 0.00 0.00 30.24 31.98 2i6c n GLN 1107CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2i6c n TYR 1108N -3.22 0.00 -4.05 3.69 4.01 -0.90 -4.98 117.16 111.70 2i6c n TYR 1108Ca -0.23 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.18 2i6c n TYR 1108Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 2i6c n TYR 1108CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2i6c n LYS 1109N 0.18 -4.37 -2.27 -0.72 4.76 -0.78 -0.07 118.16 114.90 2i6c n LYS 1109Ca 0.05 0.49 -0.39 0.00 -2.87 0.00 0.00 58.31 55.58 2i6c n LYS 1109Cb 0.22 -5.26 -0.02 0.00 -1.84 0.00 0.00 35.03 28.13 2i6c n LYS 1109CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i6c s ALA 1110N -3.34 3.32 -1.15 7.82 0.00 -0.63 -3.49 121.76 124.28 2i6c s ALA 1110Ca 0.64 1.05 0.23 0.00 0.00 0.00 0.00 51.96 53.89 2i6c s ALA 1110Cb -0.34 -3.40 0.19 0.00 0.00 0.00 0.00 23.12 19.57 2i6c s ALA 1110CO 0.88 -0.49 1.19 0.54 0.00 0.00 0.00 175.76 177.88 2i6c n ARG 1111N 0.55 0.17 0.00 0.00 3.00 -0.34 -4.59 116.66 115.45 2i6c n ARG 1111Ca 0.02 -0.13 0.00 0.00 -0.01 0.00 0.00 57.85 57.73 2i6c n ARG 1111Cb 0.45 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.41 2i6c n ARG 1111CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2i6c n LEU 1112N -1.30 0.00 -3.63 0.55 7.94 -1.12 -0.81 117.00 118.63 2i6c n LEU 1112Ca 0.06 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.85 2i6c n LEU 1112Cb 0.35 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.23 2i6c n LEU 1112CO 0.37 0.00 0.43 -0.54 -1.11 0.00 0.00 177.39 176.54 2i6c s LYS 1114N 1.01 0.75 -0.07 1.96 1.02 0.09 -2.47 119.74 122.02 2i6c s LYS 1114Ca 0.00 1.04 0.00 0.00 0.02 0.00 0.00 55.97 57.04 2i6c s LYS 1114Cb 0.00 0.28 0.02 0.00 -0.52 0.00 0.00 37.83 37.62 2i6c s LYS 1114CO 0.00 -0.12 -0.05 0.42 -0.92 0.00 0.00 175.35 174.68 2i6c s ILE 1115N 0.88 0.70 -0.04 2.17 1.01 -1.26 -1.23 121.20 123.43 2i6c s ILE 1115Ca -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 60.65 60.44 2i6c s ILE 1115Cb -0.05 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 2i6c s ILE 1115CO -0.08 0.29 0.12 -0.44 0.00 0.00 0.00 174.94 174.84 2i6c s SER 1116N 1.40 6.06 -0.05 3.58 0.01 -1.26 -4.55 113.70 118.89 2i6c s SER 1116Ca -0.03 0.29 -0.02 0.00 1.31 0.00 0.00 55.95 57.51 2i6c s SER 1116Cb -0.13 -1.85 0.04 0.00 0.21 0.00 0.00 66.02 64.28 2i6c s SER 1116CO -0.03 0.31 0.10 0.00 0.41 0.00 0.00 173.24 174.02 2i6c s PHE 1118N 1.16 2.85 0.51 0.00 0.08 -1.26 -0.47 117.98 120.85 2i6c s PHE 1118Ca -0.09 1.54 0.17 0.00 0.12 0.00 0.00 56.93 58.68 2i6c s PHE 1118Cb -0.12 -3.34 1.25 0.00 -0.57 0.00 0.00 43.02 40.24 2i6c s PHE 1118CO -0.05 -1.47 2.10 -2.95 -0.10 0.00 0.00 175.22 172.76 2i6c h ASN 1119N 1.85 0.05 1.01 1.36 -1.07 -1.36 -1.33 115.58 116.10 2i6c h ASN 1119Ca -0.49 -0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.87 2i6c h ASN 1119Cb 1.25 -0.01 0.00 0.00 -2.07 0.00 0.00 38.32 37.49 2i6c h ASN 1119CO 0.59 0.04 0.00 0.00 0.07 0.00 0.00 177.43 178.13 2i6c h ALA 1120N 1.91 1.00 -0.85 4.14 0.00 -1.91 -3.37 119.26 120.18 2i6c h ALA 1120Ca 0.08 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.26 2i6c h ALA 1120Cb 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 2i6c h ALA 1120CO -0.01 0.00 2.17 -1.71 0.00 0.00 0.00 179.25 179.71 2i6c n ASN 1121N -3.06 4.81 -0.34 0.00 5.15 -0.50 -4.76 115.26 116.56 2i6c n ASN 1121Ca 0.01 -3.00 -0.02 0.00 -0.60 0.00 0.00 54.58 50.97 2i6c n ASN 1121Cb 0.30 -1.57 0.11 0.00 -0.53 0.00 0.00 39.78 38.09 2i6c n ASN 1121CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2i6c h ALA 1122N 6.30 1.19 -0.74 5.20 0.00 -1.83 -1.56 119.26 127.82 2i6c h ALA 1122Ca 0.43 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 2i6c h ALA 1122Cb 0.71 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2i6c h ALA 1122CO 1.59 0.51 0.29 0.00 0.00 0.00 0.00 179.25 181.64 2i6c h ALA 1123N 1.36 1.11 0.00 0.00 0.00 -1.96 -0.57 119.26 119.19 2i6c h ALA 1123Ca 0.35 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2i6c h ALA 1123Cb -0.07 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.42 2i6c h ALA 1123CO -0.10 0.63 -0.00 0.78 0.00 0.00 0.00 179.25 180.57 2i6c h GLY 1124N 1.12 -0.00 0.55 0.00 0.00 -1.85 -0.58 103.07 102.30 2i6c h GLY 1124Ca 0.25 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.65 2i6c h GLY 1124CO -0.02 -0.00 0.29 1.41 0.00 0.00 0.00 176.54 178.22 2i6c h LEU 1125N -0.19 0.37 -0.46 3.11 3.38 -0.90 -0.32 115.31 120.31 2i6c h LEU 1125Ca -0.00 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2i6c h LEU 1125Cb 0.19 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2i6c h LEU 1125CO 0.00 0.23 -0.16 -0.07 0.09 0.00 0.00 178.44 178.53 2i6c h LEU 1126N 0.52 0.93 0.06 1.67 3.38 -1.02 -2.33 115.31 118.52 2i6c h LEU 1126Ca 0.29 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2i6c h LEU 1126Cb 0.28 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2i6c h LEU 1126CO -0.24 1.10 -0.03 0.25 0.09 0.00 0.00 178.44 179.61 2i6c h LEU 1127N 0.75 -0.07 -1.54 1.67 5.85 -0.65 -1.50 115.31 119.82 2i6c h LEU 1127Ca 0.11 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.65 2i6c h LEU 1127Cb 0.72 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.74 2i6c h LEU 1127CO 0.05 0.16 0.32 1.88 -0.34 0.00 0.00 178.44 180.51 2i6c h TYR 1128N -0.29 0.58 -0.18 1.25 0.05 -1.11 -0.80 116.97 116.47 2i6c h TYR 1128Ca -0.01 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 2i6c h TYR 1128Cb 0.26 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 2i6c h TYR 1128CO -0.00 0.36 0.09 1.15 -1.05 0.00 0.00 178.16 178.70 2i6c h THR 1129N 0.62 1.13 -0.53 -2.88 2.02 -1.25 -1.21 112.91 110.81 2i6c h THR 1129Ca 0.19 -0.37 0.10 0.00 0.77 0.00 0.00 66.41 67.09 2i6c h THR 1129Cb -0.01 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 2i6c h THR 1129CO -0.04 0.12 0.36 1.56 0.37 0.00 0.00 175.52 177.89 2i6c h GLN 1130N 0.16 0.29 -0.10 6.66 4.20 -0.12 -1.22 115.11 124.99 2i6c h GLN 1130Ca 0.06 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2i6c h GLN 1130Cb 0.12 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.83 2i6c h GLN 1130CO -0.01 0.19 0.00 1.28 -0.67 0.00 0.00 178.83 179.62 2i6c n LEU 1131N -4.46 0.95 0.00 1.46 4.77 -0.44 -4.90 117.00 114.37 2i6c n LEU 1131Ca 0.09 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 2i6c n LEU 1131Cb 0.39 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2i6c n LEU 1131CO 0.35 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 2i6c n GLY 1132N 0.97 0.82 3.78 -0.72 0.00 -0.46 -5.06 105.19 104.52 2i6c n GLY 1132Ca 0.15 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2i6c n GLY 1132CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2i6c s TYR 1133N -2.00 3.62 0.05 1.61 2.02 -0.52 -4.73 117.35 117.41 2i6c s TYR 1133Ca 0.00 1.76 0.08 0.00 -0.37 0.00 0.00 57.07 58.54 2i6c s TYR 1133Cb 0.00 -3.00 -0.03 0.00 -0.40 0.00 0.00 41.96 38.53 2i6c s TYR 1133CO 0.00 -0.00 -0.24 -0.65 -1.57 0.00 0.00 175.55 173.09 2i6c s GLN 1134N -2.03 1.55 0.22 -0.62 -0.21 -0.32 -4.29 119.66 113.97 2i6c s GLN 1134Ca 0.51 -1.05 -0.30 0.00 0.02 0.00 0.00 55.36 54.54 2i6c s GLN 1134Cb -0.21 -1.72 -0.08 0.00 1.00 0.00 0.00 33.01 31.99 2i6c s GLN 1134CO 0.27 0.44 1.07 -1.25 -2.12 0.00 0.00 175.29 173.70 2i6c s PRO 1135N -1.28 4.65 -0.07 2.91 0.04 -1.26 -1.66 135.00 138.32 2i6c s PRO 1135Ca 0.10 1.70 0.01 0.00 0.04 0.00 0.00 61.00 62.85 2i6c s PRO 1135Cb -0.09 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 31.14 2i6c s PRO 1135CO 0.02 0.18 -0.06 0.54 0.04 0.00 0.00 177.00 177.73 2i6c n ARG 1136N 1.90 0.38 -3.75 4.56 5.12 0.81 -4.94 116.66 120.74 2i6c n ARG 1136Ca 0.01 0.04 -0.10 0.00 -1.93 0.00 0.00 57.85 55.87 2i6c n ARG 1136Cb 0.46 -1.15 -0.04 0.00 -1.16 0.00 0.00 32.46 30.57 2i6c n ARG 1136CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2i6c s ALA 1137N -2.15 -0.87 -0.11 7.54 0.00 -1.01 -5.02 121.76 120.15 2i6c s ALA 1137Ca -0.09 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.61 2i6c s ALA 1137Cb 0.02 0.85 0.02 0.00 0.00 0.00 0.00 23.12 24.02 2i6c s ALA 1137CO 0.17 -0.79 -0.13 0.42 0.00 0.00 0.00 175.76 175.43 2i6c s ILE 1138N -3.88 1.36 0.20 0.00 1.01 -1.26 -0.60 121.20 118.03 2i6c s ILE 1138Ca 0.10 -0.54 0.08 0.00 0.00 0.00 0.00 60.65 60.29 2i6c s ILE 1138Cb -0.01 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 2i6c s ILE 1138CO -0.03 0.42 -0.00 0.00 0.00 0.00 0.00 174.94 175.33 2i6c s ALA 1139N 1.22 3.18 -0.05 9.38 0.00 -0.12 -4.92 121.76 130.44 2i6c s ALA 1139Ca -0.02 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.33 2i6c s ALA 1139Cb -0.14 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.01 2i6c s ALA 1139CO -0.04 0.42 0.41 -2.00 0.00 0.00 0.00 175.76 174.54 2i6c s GLU 1140N -3.14 4.08 0.29 0.00 2.12 -1.26 -0.25 118.70 120.53 2i6c s GLU 1140Ca 0.28 0.38 0.02 0.00 0.36 0.00 0.00 54.97 56.02 2i6c s GLU 1140Cb -0.08 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 2i6c s GLU 1140CO 0.19 0.48 0.13 1.03 -0.54 0.00 0.00 175.26 176.56 2i6c s ARG 1141N -0.40 1.53 -0.05 4.30 1.81 -0.43 -4.91 118.95 120.80 2i6c s ARG 1141Ca 0.23 -1.86 0.04 0.00 -1.72 0.00 0.00 55.73 52.42 2i6c s ARG 1141Cb -0.16 -0.18 0.00 0.00 -0.45 0.00 0.00 34.95 34.17 2i6c s ARG 1141CO 0.11 -0.39 -0.16 -1.01 -0.68 0.00 0.00 175.30 173.17 2i6c s HIS 1142N -3.65 1.66 0.85 -0.53 3.76 -1.26 -0.83 115.29 115.28 2i6c s HIS 1142Ca 0.36 -0.54 -0.11 0.00 -0.15 0.00 0.00 55.06 54.63 2i6c s HIS 1142Cb 0.06 -1.15 0.14 0.00 1.11 0.00 0.00 32.58 32.75 2i6c s HIS 1142CO 0.16 -0.22 1.18 0.16 -0.85 0.00 0.00 174.74 175.18 2i6c s ASP 1143N 0.25 3.85 0.58 1.40 1.47 -0.17 -4.88 116.67 119.18 2i6c s ASP 1143Ca -0.08 0.25 0.39 0.00 1.18 0.00 0.00 52.55 54.29 2i6c s ASP 1143Cb -0.13 -0.53 2.02 0.00 -0.34 0.00 0.00 42.92 43.94 2i6c s ASP 1143CO 0.03 -2.25 2.18 -0.65 0.68 0.00 0.00 175.17 175.16 2i6c h PRO 1144N -1.16 0.00 -0.28 2.11 0.11 -1.93 0.46 132.00 131.31 2i6c h PRO 1144Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2i6c h PRO 1144Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2i6c h PRO 1144CO 0.46 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.00 2i6c n ASP 1145N -2.92 1.82 -0.10 -2.05 8.00 -1.26 -4.92 116.55 115.12 2i6c n ASP 1145Ca -0.02 -1.87 -0.01 0.00 0.71 0.00 0.00 54.79 53.59 2i6c n ASP 1145Cb 0.11 -0.18 -0.01 0.00 -0.02 0.00 0.00 41.12 41.02 2i6c n ASP 1145CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i6c n GLY 1146N 1.10 0.49 3.82 0.44 0.00 0.15 -5.02 105.19 106.16 2i6c n GLY 1146Ca 0.14 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2i6c n GLY 1146CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i6c s ARG 1147N -0.99 4.23 -0.07 1.61 0.52 -1.26 -4.77 118.95 118.21 2i6c s ARG 1147Ca 0.00 0.84 -0.25 0.00 -0.52 0.00 0.00 55.73 55.80 2i6c s ARG 1147Cb 0.00 -2.88 -0.03 0.00 0.52 0.00 0.00 34.95 32.56 2i6c s ARG 1147CO 0.00 0.40 0.77 1.03 0.02 0.00 0.00 175.30 177.51 2i6c s ARG 1148N -1.98 4.44 0.27 3.54 0.52 -1.26 -1.00 118.95 123.47 2i6c s ARG 1148Ca 0.43 0.99 0.09 0.00 -0.52 0.00 0.00 55.73 56.71 2i6c s ARG 1148Cb -0.16 -3.47 -0.05 0.00 0.52 0.00 0.00 34.95 31.78 2i6c s ARG 1148CO 0.21 -0.01 -0.13 0.14 0.02 0.00 0.00 175.30 175.53 2i6c s VAL 1149N 1.03 2.01 -0.17 3.52 -7.23 -0.01 -4.96 120.40 114.58 2i6c s VAL 1149Ca 0.40 -2.25 -0.05 0.00 -1.81 0.00 0.00 61.98 58.28 2i6c s VAL 1149Cb -0.18 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.41 2i6c s VAL 1149CO 0.19 -0.40 -0.01 0.00 -0.31 0.00 0.00 175.10 174.57 2i6c s ALA 1150N -2.79 3.09 -0.34 1.32 0.00 -1.26 -1.31 121.76 120.46 2i6c s ALA 1150Ca 0.28 -0.85 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 2i6c s ALA 1150Cb -0.00 -1.68 -0.00 0.00 0.00 0.00 0.00 23.12 21.43 2i6c s ALA 1150CO 0.12 0.12 0.20 -1.17 0.00 0.00 0.00 175.76 175.03 2i6c s LEU 1151N 0.52 4.41 -0.33 0.00 2.96 0.66 -0.81 118.68 126.09 2i6c s LEU 1151Ca -0.01 -0.58 -0.21 0.00 -0.22 0.00 0.00 54.13 53.10 2i6c s LEU 1151Cb -0.14 -2.06 -0.00 0.00 0.50 0.00 0.00 46.19 44.49 2i6c s LEU 1151CO 0.02 -0.25 0.69 -0.63 -1.32 0.00 0.00 176.35 174.86 2i6c s ILE 1152N 1.65 4.86 0.08 6.68 1.09 0.39 -0.94 121.20 135.00 2i6c s ILE 1152Ca 0.05 0.84 -0.05 0.00 -1.10 0.00 0.00 60.65 60.39 2i6c s ILE 1152Cb -0.18 -4.08 -0.05 0.00 -1.06 0.00 0.00 42.46 37.09 2i6c s ILE 1152CO 0.08 -0.26 0.31 -1.10 -0.10 0.00 0.00 174.94 173.87 2i6c s GLN 1153N 2.78 3.59 0.00 2.79 -0.21 0.23 -1.01 119.66 127.84 2i6c s GLN 1153Ca 0.27 -0.12 0.00 0.00 0.02 0.00 0.00 55.36 55.53 2i6c s GLN 1153Cb -0.14 -2.97 0.00 0.00 1.00 0.00 0.00 33.01 30.89 2i6c s GLN 1153CO 0.14 0.56 0.00 -0.40 -2.12 0.00 0.00 175.29 173.47 2i6c n ASP 1155N 0.54 0.00 -3.70 5.90 5.68 -0.67 -0.13 116.55 124.17 2i6c n ASP 1155Ca -0.06 0.00 -0.11 0.00 -0.50 0.00 0.00 54.79 54.11 2i6c n ASP 1155Cb 0.52 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.40 2i6c n ASP 1155CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2i6c s LYS 1156N -2.00 0.49 0.48 0.11 2.20 -1.26 -1.17 119.74 118.59 2i6c s LYS 1156Ca 0.00 0.76 -0.22 0.00 -0.36 0.00 0.00 55.97 56.15 2i6c s LYS 1156Cb 0.00 0.12 -0.07 0.00 -1.51 0.00 0.00 37.83 36.37 2i6c s LYS 1156CO 0.00 -0.11 1.17 -1.25 -0.36 0.00 0.00 175.35 174.80 2i6c s PRO 1157N 0.90 3.64 -0.12 4.03 0.04 -1.26 -4.38 135.00 137.84 2i6c s PRO 1157Ca -0.05 1.77 0.02 0.00 0.04 0.00 0.00 61.00 62.78 2i6c s PRO 1157Cb -0.06 -2.32 0.01 0.00 0.04 0.00 0.00 34.50 32.17 2i6c s PRO 1157CO -0.07 -0.65 -0.19 -0.51 0.04 0.00 0.00 177.00 175.62 2i6c s LEU 1158N -3.20 1.92 0.55 -3.56 1.43 0.01 -4.90 118.68 110.94 2i6c s LEU 1158Ca 0.66 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2i6c s LEU 1158Cb -0.28 -1.27 0.03 0.00 0.03 0.00 0.00 46.19 44.70 2i6c s LEU 1158CO 0.34 0.05 0.78 -1.61 0.23 0.00 0.00 176.35 176.15 2i6c s GLU 1159N 0.86 2.57 0.00 1.70 2.02 -1.26 -4.34 118.70 120.25 2i6c s GLU 1159Ca -0.08 -0.72 0.00 0.00 0.02 0.00 0.00 54.97 54.19 2i6c s GLU 1159Cb -0.15 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.60 2i6c s GLU 1159CO -0.01 -0.71 0.47 -2.30 0.02 0.00 0.00 175.26 172.73