#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hc0 s GLN 1002N 0.00 3.33 -0.18 0.54 0.74 -1.26 -5.09 119.66 117.75 2hc0 s GLN 1002Ca 0.00 -0.68 -0.03 0.00 0.05 0.00 0.00 55.36 54.70 2hc0 s GLN 1002Cb 0.00 -3.28 -0.02 0.00 1.10 0.00 0.00 33.01 30.82 2hc0 s GLN 1002CO 0.00 -0.31 -0.07 0.42 -0.55 0.00 0.00 175.29 174.78 2hc0 s ILE 1003N 1.53 3.40 0.70 -2.34 1.01 -1.26 -5.11 121.20 119.14 2hc0 s ILE 1003Ca 0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 2hc0 s ILE 1003Cb -0.16 -2.50 0.07 0.00 0.01 0.00 0.00 42.46 39.88 2hc0 s ILE 1003CO 0.02 0.47 1.00 0.42 0.00 0.00 0.00 174.94 176.85 2hc0 s THR 1004N 0.85 2.30 -0.19 2.92 -4.23 -1.26 -5.03 115.64 111.00 2hc0 s THR 1004Ca -0.02 -0.32 0.15 0.00 -1.18 0.00 0.00 61.69 60.33 2hc0 s THR 1004Cb -0.15 -2.98 0.42 0.00 1.34 0.00 0.00 72.50 71.13 2hc0 s THR 1004CO 0.01 0.00 1.29 0.18 -0.54 0.00 0.00 174.62 175.56 2hc0 n LEU 1005N -2.89 3.15 0.16 4.79 4.77 -1.26 -4.64 117.00 121.08 2hc0 n LEU 1005Ca 0.09 -3.34 0.00 0.00 -0.03 0.00 0.00 56.01 52.73 2hc0 n LEU 1005Cb 0.60 -0.52 0.25 0.00 -2.33 0.00 0.00 43.42 41.43 2hc0 n LEU 1005CO 0.51 0.92 0.60 -0.50 -1.33 0.00 0.00 177.39 177.59 2hc0 h TRP 1006N 0.83 0.00 -1.91 -1.77 4.06 -2.06 -3.43 115.95 111.68 2hc0 h TRP 1006Ca 0.04 -0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.38 2hc0 h TRP 1006Cb 1.24 -0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 29.27 2hc0 h TRP 1006CO 0.45 0.51 -0.66 0.15 -3.56 0.00 0.00 178.44 175.34 2hc0 s LYS 1007N -3.87 1.90 0.48 0.49 -0.14 -1.26 -5.11 119.74 112.23 2hc0 s LYS 1007Ca -0.02 -1.91 -0.23 0.00 -1.36 0.00 0.00 55.97 52.45 2hc0 s LYS 1007Cb 0.13 -1.76 -0.08 0.00 -1.68 0.00 0.00 37.83 34.45 2hc0 s LYS 1007CO 0.75 0.12 1.24 0.54 -0.76 0.00 0.00 175.35 177.24 2hc0 n ARG 1008N -0.85 1.69 -2.11 1.68 1.74 -1.26 -4.84 116.66 112.70 2hc0 n ARG 1008Ca -0.05 0.61 -0.42 0.00 -0.77 0.00 0.00 57.85 57.22 2hc0 n ARG 1008Cb 0.63 -2.39 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 2hc0 n ARG 1008CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2hc0 n PRO 1009N -0.39 3.25 -2.40 5.56 -0.04 -1.26 -4.96 135.00 134.76 2hc0 n PRO 1009Ca 0.09 -3.12 -0.41 0.00 -0.04 0.00 0.00 63.50 60.01 2hc0 n PRO 1009Cb 0.42 -3.12 -0.03 0.00 -0.04 0.00 0.00 33.50 30.72 2hc0 n PRO 1009CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2hc0 s LEU 1010N 1.21 4.43 0.19 1.53 1.02 -1.26 -0.34 118.68 125.46 2hc0 s LEU 1010Ca 0.44 2.15 0.02 0.00 0.02 0.00 0.00 54.13 56.76 2hc0 s LEU 1010Cb 0.11 -3.60 -0.05 0.00 0.02 0.00 0.00 46.19 42.67 2hc0 s LEU 1010CO -0.03 -0.39 0.02 0.68 0.02 0.00 0.00 176.35 176.64 2hc0 s VAL 1011N 0.30 0.67 -0.08 -1.59 -7.23 0.29 -4.94 120.40 107.82 2hc0 s VAL 1011Ca 0.55 -1.99 -0.14 0.00 -1.81 0.00 0.00 61.98 58.59 2hc0 s VAL 1011Cb -0.31 -2.23 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 2hc0 s VAL 1011CO 0.34 -0.38 0.35 -0.89 -0.31 0.00 0.00 175.10 174.21 2hc0 s THR 1012N -3.67 5.20 0.04 5.32 2.01 -1.26 -1.43 115.64 121.85 2hc0 s THR 1012Ca 0.27 0.69 0.06 0.00 0.31 0.00 0.00 61.69 63.02 2hc0 s THR 1012Cb 0.06 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 2hc0 s THR 1012CO 0.06 0.48 -0.14 0.27 -0.69 0.00 0.00 174.62 174.61 2hc0 s ILE 1013N -0.31 3.10 -0.34 1.82 -0.00 -0.05 -3.35 121.20 122.07 2hc0 s ILE 1013Ca 0.21 -1.08 -0.08 0.00 -0.00 0.00 0.00 60.65 59.70 2hc0 s ILE 1013Cb -0.15 -2.34 0.03 0.00 -0.00 0.00 0.00 42.46 40.00 2hc0 s ILE 1013CO 0.09 0.32 0.12 -0.75 -0.00 0.00 0.00 174.94 174.72 2hc0 s LYS 1014N -1.54 2.77 -0.08 0.37 2.20 -0.08 -1.35 119.74 122.04 2hc0 s LYS 1014Ca 0.16 -1.09 -0.05 0.00 -0.36 0.00 0.00 55.97 54.64 2hc0 s LYS 1014Cb -0.11 -3.50 0.03 0.00 -1.51 0.00 0.00 37.83 32.74 2hc0 s LYS 1014CO 0.07 -0.62 0.18 -1.50 -0.36 0.00 0.00 175.35 173.12 2hc0 s ILE 1015N 1.46 -0.02 0.00 5.43 2.07 0.30 -0.93 121.20 129.50 2hc0 s ILE 1015Ca 0.00 0.09 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 2hc0 s ILE 1015Cb -0.19 -0.28 0.00 0.00 0.13 0.00 0.00 42.46 42.12 2hc0 s ILE 1015CO 0.04 0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.71 2hc0 n GLY 1016N 3.66 0.44 1.57 1.50 0.00 -1.26 -1.39 105.19 109.71 2hc0 n GLY 1016Ca -0.20 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 2hc0 n GLY 1016CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hc0 n GLY 1017N 0.00 3.12 3.25 -0.02 0.00 -1.26 -4.90 105.19 105.37 2hc0 n GLY 1017Ca 0.00 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.30 2hc0 n GLY 1017CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2hc0 s GLN 1018N -1.82 1.06 0.02 1.61 -0.21 -0.49 -5.14 119.66 114.70 2hc0 s GLN 1018Ca 0.30 -1.41 -0.22 0.00 0.02 0.00 0.00 55.36 54.06 2hc0 s GLN 1018Cb 0.25 -0.70 -0.06 0.00 1.00 0.00 0.00 33.01 33.50 2hc0 s GLN 1018CO 0.07 0.10 0.66 -0.51 -2.12 0.00 0.00 175.29 173.48 2hc0 s LEU 1019N -3.01 4.44 0.10 2.90 1.02 -1.26 -0.54 118.68 122.33 2hc0 s LEU 1019Ca 0.15 1.28 0.05 0.00 0.02 0.00 0.00 54.13 55.63 2hc0 s LEU 1019Cb 0.01 -3.04 -0.03 0.00 0.02 0.00 0.00 46.19 43.14 2hc0 s LEU 1019CO 0.01 0.09 -0.12 -0.54 0.02 0.00 0.00 176.35 175.81 2hc0 s LYS 1020N -0.25 0.89 -0.01 1.70 -0.14 -0.46 -4.99 119.74 116.48 2hc0 s LYS 1020Ca 0.34 -1.12 -0.01 0.00 -1.36 0.00 0.00 55.97 53.81 2hc0 s LYS 1020Cb -0.19 -0.71 -0.04 0.00 -1.68 0.00 0.00 37.83 35.21 2hc0 s LYS 1020CO 0.20 0.13 0.11 -2.00 -0.76 0.00 0.00 175.35 173.03 2hc0 s GLU 1021N -2.46 3.16 0.09 1.68 2.56 -1.26 -0.87 118.70 121.59 2hc0 s GLU 1021Ca 0.04 -0.44 -0.13 0.00 0.00 0.00 0.00 54.97 54.44 2hc0 s GLU 1021Cb -0.05 -2.92 0.02 0.00 2.00 0.00 0.00 34.13 33.17 2hc0 s GLU 1021CO 0.02 0.65 0.31 0.00 -0.56 0.00 0.00 175.26 175.68 2hc0 s ALA 1022N -1.23 -0.66 0.02 6.30 0.00 -0.51 -4.65 121.76 121.02 2hc0 s ALA 1022Ca 0.24 -0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.78 2hc0 s ALA 1022Cb -0.12 0.51 -0.05 0.00 0.00 0.00 0.00 23.12 23.45 2hc0 s ALA 1022CO 0.15 -0.53 0.73 -0.51 0.00 0.00 0.00 175.76 175.61 2hc0 s LEU 1023N -2.56 4.42 -0.18 0.00 1.43 -0.56 -0.54 118.68 120.68 2hc0 s LEU 1023Ca 0.01 1.36 -0.29 0.00 -1.03 0.00 0.00 54.13 54.18 2hc0 s LEU 1023Cb 0.02 -3.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.05 2hc0 s LEU 1023CO -0.09 -0.00 1.50 -0.63 0.23 0.00 0.00 176.35 177.36 2hc0 s ILE 1024N 0.10 3.87 -0.43 -0.59 1.01 0.54 -0.65 121.20 125.05 2hc0 s ILE 1024Ca 0.38 1.01 0.03 0.00 0.00 0.00 0.00 60.65 62.06 2hc0 s ILE 1024Cb -0.20 -3.78 0.12 0.00 0.01 0.00 0.00 42.46 38.61 2hc0 s ILE 1024CO 0.21 -0.23 0.19 -0.62 0.00 0.00 0.00 174.94 174.49 2hc0 s ASP 1025N 3.32 4.16 0.26 3.58 -1.08 -0.31 -4.74 116.67 121.87 2hc0 s ASP 1025Ca 0.66 -2.54 0.23 0.00 -0.52 0.00 0.00 52.55 50.38 2hc0 s ASP 1025Cb -0.25 -1.35 0.99 0.00 -1.46 0.00 0.00 42.92 40.86 2hc0 s ASP 1025CO 0.25 -0.30 1.70 0.35 0.52 0.00 0.00 175.17 177.70 2hc0 n THR 1026N 3.70 0.85 0.52 1.71 -2.24 -1.26 -2.08 114.28 115.48 2hc0 n THR 1026Ca 0.05 0.28 0.13 0.00 -2.27 0.00 0.00 64.05 62.24 2hc0 n THR 1026Cb 0.36 -1.22 0.43 0.00 -2.10 0.00 0.00 70.33 67.80 2hc0 n THR 1026CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2hc0 h GLY 1027N 2.04 0.00 -7.03 3.38 0.00 -1.93 -3.45 103.07 96.08 2hc0 h GLY 1027Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 2hc0 h GLY 1027CO 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.52 2hc0 s ALA 1028N -3.19 3.50 0.23 3.60 0.00 -0.89 -4.95 121.76 120.06 2hc0 s ALA 1028Ca 0.08 -0.88 -0.08 0.00 0.00 0.00 0.00 51.96 51.08 2hc0 s ALA 1028Cb 0.11 -3.00 0.24 0.00 0.00 0.00 0.00 23.12 20.47 2hc0 s ALA 1028CO 0.54 -1.10 1.88 -0.44 0.00 0.00 0.00 175.76 176.64 2hc0 h ASP 1029N 8.34 0.89 -2.10 0.00 3.32 -1.86 0.30 116.42 125.32 2hc0 h ASP 1029Ca -0.28 -0.01 -0.61 0.00 0.02 0.00 0.00 57.03 56.15 2hc0 h ASP 1029Cb 1.13 -0.20 -0.14 0.00 0.22 0.00 0.00 39.33 40.34 2hc0 h ASP 1029CO 0.76 0.62 -0.73 -1.81 -1.72 0.00 0.00 179.24 176.36 2hc0 s ASP 1030N -5.87 3.65 -0.08 6.45 1.01 -1.26 -2.41 116.67 118.16 2hc0 s ASP 1030Ca -0.13 -1.10 -0.19 0.00 0.71 0.00 0.00 52.55 51.84 2hc0 s ASP 1030Cb 0.17 -0.32 -0.04 0.00 1.01 0.00 0.00 42.92 43.73 2hc0 s ASP 1030CO 0.79 -0.06 0.53 -0.89 0.21 0.00 0.00 175.17 175.75 2hc0 s THR 1031N -2.55 5.11 -0.06 -1.27 2.01 -1.26 -3.65 115.64 113.97 2hc0 s THR 1031Ca 0.31 1.08 -0.00 0.00 0.31 0.00 0.00 61.69 63.39 2hc0 s THR 1031Cb -0.02 -3.87 0.02 0.00 0.01 0.00 0.00 72.50 68.65 2hc0 s THR 1031CO 0.16 0.34 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.71 2hc0 s VAL 1032N 0.44 0.48 0.13 3.82 1.01 -0.26 -1.37 120.40 124.65 2hc0 s VAL 1032Ca 0.29 -0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.34 2hc0 s VAL 1032Cb -0.16 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 2hc0 s VAL 1032CO 0.13 0.25 -0.21 -0.76 0.00 0.00 0.00 175.10 174.50 2hc0 s LEU 1033N 1.43 2.35 1.10 3.92 2.01 0.36 -0.53 118.68 129.32 2hc0 s LEU 1033Ca -0.03 -0.76 -0.12 0.00 0.01 0.00 0.00 54.13 53.23 2hc0 s LEU 1033Cb -0.13 -0.95 0.24 0.00 0.01 0.00 0.00 46.19 45.36 2hc0 s LEU 1033CO -0.03 0.06 1.00 -0.62 1.01 0.00 0.00 176.35 177.77 2hc0 n GLU 1034N 0.76 -1.81 -1.58 1.70 1.02 -1.26 -1.91 120.64 117.56 2hc0 n GLU 1034Ca -0.17 -0.49 -0.54 0.00 -0.02 0.00 0.00 57.16 55.94 2hc0 n GLU 1034Cb 0.55 -2.20 -0.07 0.00 -0.02 0.00 0.00 31.44 29.70 2hc0 n GLU 1034CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2hc0 n GLU 1035N -4.57 0.89 -3.48 3.49 4.07 -1.26 -4.68 120.64 115.11 2hc0 n GLU 1035Ca 0.06 0.32 -0.11 0.00 -0.06 0.00 0.00 57.16 57.36 2hc0 n GLU 1035Cb 0.54 -1.94 -0.02 0.00 -0.06 0.00 0.00 31.44 29.96 2hc0 n GLU 1035CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2hc0 s MET 1036N 0.62 1.33 -0.14 5.31 0.23 -1.26 -5.09 119.30 120.29 2hc0 s MET 1036Ca 0.87 -0.54 -0.29 0.00 -1.03 0.00 0.00 55.69 54.70 2hc0 s MET 1036Cb -1.04 0.59 -0.02 0.00 -1.53 0.00 0.00 34.83 32.83 2hc0 s MET 1036CO 0.51 -0.59 1.38 -0.80 -2.03 0.00 0.00 175.02 173.49 2hc0 s ASN 1037N -2.77 6.84 0.07 -1.18 0.02 -1.26 -5.05 114.94 111.61 2hc0 s ASN 1037Ca 0.02 1.81 0.06 0.00 -1.02 0.00 0.00 52.86 53.73 2hc0 s ASN 1037Cb -0.01 -2.54 -0.03 0.00 0.02 0.00 0.00 41.25 38.69 2hc0 s ASN 1037CO -0.11 -0.84 -0.17 -0.76 0.02 0.00 0.00 177.10 175.25 2hc0 s LEU 1038N 3.74 2.24 0.58 0.60 1.43 -1.26 -4.86 118.68 121.15 2hc0 s LEU 1038Ca 0.60 -0.58 -0.14 0.00 -1.03 0.00 0.00 54.13 52.98 2hc0 s LEU 1038Cb -0.25 -0.70 -0.05 0.00 0.03 0.00 0.00 46.19 45.23 2hc0 s LEU 1038CO 0.19 0.02 1.02 -2.16 0.23 0.00 0.00 176.35 175.65 2hc0 s PRO 1039N -1.57 3.65 0.47 1.29 0.04 -1.26 -4.95 135.00 132.67 2hc0 s PRO 1039Ca 0.02 0.90 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2hc0 s PRO 1039Cb -0.09 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2hc0 s PRO 1039CO 0.02 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 176.95 2hc0 n GLY 1040N -2.02 -1.80 3.96 0.56 0.00 -1.26 -4.95 105.19 99.68 2hc0 n GLY 1040Ca 0.07 -1.83 -0.22 0.00 0.00 0.00 0.00 46.02 44.03 2hc0 n GLY 1040CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hc0 s ARG 1041N 0.00 3.31 0.09 1.61 0.52 -1.26 -5.11 118.95 118.11 2hc0 s ARG 1041Ca 0.00 -0.56 0.02 0.00 -0.52 0.00 0.00 55.73 54.66 2hc0 s ARG 1041Cb 0.00 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.72 2hc0 s ARG 1041CO 0.00 0.08 -0.06 1.67 0.02 0.00 0.00 175.30 177.01 2hc0 s TRP 1042N -2.29 0.85 0.22 -0.53 1.48 -1.26 -4.56 118.94 112.84 2hc0 s TRP 1042Ca 0.42 -0.89 0.08 0.00 -1.06 0.00 0.00 56.10 54.65 2hc0 s TRP 1042Cb -0.10 -0.50 -0.05 0.00 -1.16 0.00 0.00 33.47 31.67 2hc0 s TRP 1042CO 0.34 -0.16 -0.15 -1.59 -4.06 0.00 0.00 176.95 171.33 2hc0 s LYS 1043N -3.67 1.39 0.38 3.25 -2.85 -0.69 -4.93 119.74 112.62 2hc0 s LYS 1043Ca 0.10 -1.62 -0.13 0.00 -1.00 0.00 0.00 55.97 53.32 2hc0 s LYS 1043Cb 0.04 -1.22 -0.08 0.00 -2.06 0.00 0.00 37.83 34.51 2hc0 s LYS 1043CO -0.05 0.21 0.77 -1.25 0.10 0.00 0.00 175.35 175.13 2hc0 s PRO 1044N -3.62 3.89 -0.12 1.78 0.04 -1.26 -0.68 135.00 135.02 2hc0 s PRO 1044Ca 0.24 0.59 -0.18 0.00 0.04 0.00 0.00 61.00 61.68 2hc0 s PRO 1044Cb -0.01 -2.39 0.04 0.00 0.04 0.00 0.00 34.50 32.18 2hc0 s PRO 1044CO 0.08 0.03 0.47 0.21 0.04 0.00 0.00 177.00 177.84 2hc0 s LYS 1045N -3.48 0.66 -0.13 4.56 2.20 -1.14 -4.85 119.74 117.56 2hc0 s LYS 1045Ca 0.53 0.40 -0.04 0.00 -0.36 0.00 0.00 55.97 56.50 2hc0 s LYS 1045Cb -0.10 0.31 -0.03 0.00 -1.51 0.00 0.00 37.83 36.50 2hc0 s LYS 1045CO 0.25 -0.13 0.02 0.42 -0.36 0.00 0.00 175.35 175.55 2hc0 s ILE 1046N -0.34 4.47 0.14 5.43 1.01 -1.26 -0.08 121.20 130.57 2hc0 s ILE 1046Ca -0.05 -0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.47 2hc0 s ILE 1046Cb -0.03 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 2hc0 s ILE 1046CO 0.03 0.54 -0.07 0.27 0.00 0.00 0.00 174.94 175.70 2hc0 s ILE 1047N -0.22 0.96 0.03 2.92 -4.36 0.70 -4.95 121.20 116.28 2hc0 s ILE 1047Ca 0.06 -2.01 0.02 0.00 -0.26 0.00 0.00 60.65 58.45 2hc0 s ILE 1047Cb -0.12 -1.88 -0.02 0.00 1.25 0.00 0.00 42.46 41.69 2hc0 s ILE 1047CO 0.02 -0.71 -0.06 -0.83 0.24 0.00 0.00 174.94 173.59 2hc0 s GLY 1048N -3.14 0.42 0.00 6.27 0.00 -1.26 0.38 107.32 109.98 2hc0 s GLY 1048Ca 0.17 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2hc0 s GLY 1048CO 0.00 -0.74 0.00 0.61 0.00 0.00 0.00 173.10 172.97 2hc0 n GLY 1049N 1.57 4.05 3.79 0.20 0.00 -0.62 -4.99 105.19 109.20 2hc0 n GLY 1049Ca -0.23 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 2hc0 n GLY 1049CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hc0 s ILE 1050N -1.97 3.67 0.00 -0.61 1.01 -1.26 -2.08 121.20 119.97 2hc0 s ILE 1050Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.68 2hc0 s ILE 1050Cb 0.00 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 39.05 2hc0 s ILE 1050CO 0.00 -0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.32 2hc0 n GLY 1051N -0.20 2.05 0.00 6.18 0.00 -1.26 -4.94 105.19 107.03 2hc0 n GLY 1051Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2hc0 n GLY 1051CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hc0 n GLY 1052N 0.00 0.83 3.95 -0.02 0.00 -0.88 -5.12 105.19 103.94 2hc0 n GLY 1052Ca 0.00 -1.83 -0.25 0.00 0.00 0.00 0.00 46.02 43.94 2hc0 n GLY 1052CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hc0 s LEU 1053N 0.00 4.25 0.03 0.99 1.43 -1.26 -1.58 118.68 122.54 2hc0 s LEU 1053Ca 0.00 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2hc0 s LEU 1053Cb 0.00 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 43.16 2hc0 s LEU 1053CO 0.00 -0.07 -0.03 0.27 0.23 0.00 0.00 176.35 176.76 2hc0 s ILE 1054N -1.94 0.15 0.06 -0.59 -4.36 0.16 -4.96 121.20 109.72 2hc0 s ILE 1054Ca 0.36 -1.23 -0.10 0.00 -0.26 0.00 0.00 60.65 59.42 2hc0 s ILE 1054Cb -0.10 -0.71 -0.06 0.00 1.25 0.00 0.00 42.46 42.84 2hc0 s ILE 1054CO 0.30 -0.68 0.39 -0.54 0.24 0.00 0.00 174.94 174.65 2hc0 s LYS 1055N -2.33 3.77 0.28 0.37 3.01 -1.26 -0.22 119.74 123.35 2hc0 s LYS 1055Ca -0.08 0.20 0.02 0.00 -1.01 0.00 0.00 55.97 55.10 2hc0 s LYS 1055Cb -0.04 -3.04 -0.05 0.00 -1.01 0.00 0.00 37.83 33.69 2hc0 s LYS 1055CO -0.04 0.59 0.12 0.14 0.51 0.00 0.00 175.35 176.67 2hc0 s VAL 1056N -1.33 0.49 -0.23 3.17 -7.23 0.89 -4.57 120.40 111.59 2hc0 s VAL 1056Ca 0.31 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.39 2hc0 s VAL 1056Cb -0.14 -2.59 -0.04 0.00 0.56 0.00 0.00 36.38 34.16 2hc0 s VAL 1056CO 0.17 0.00 0.10 -0.13 -0.31 0.00 0.00 175.10 174.93 2hc0 s ARG 1057N -3.97 3.90 -0.37 4.82 0.52 0.19 -2.88 118.95 121.17 2hc0 s ARG 1057Ca 0.37 -0.36 -0.14 0.00 -0.52 0.00 0.00 55.73 55.07 2hc0 s ARG 1057Cb 0.07 -3.38 -0.00 0.00 0.52 0.00 0.00 34.95 32.16 2hc0 s ARG 1057CO 0.15 0.03 0.29 -1.14 0.02 0.00 0.00 175.30 174.64 2hc0 s GLN 1058N 1.08 3.31 -0.17 3.54 0.74 0.15 -0.35 119.66 127.96 2hc0 s GLN 1058Ca 0.05 -0.74 -0.04 0.00 0.05 0.00 0.00 55.36 54.68 2hc0 s GLN 1058Cb -0.14 -3.87 -0.03 0.00 1.10 0.00 0.00 33.01 30.07 2hc0 s GLN 1058CO 0.04 -0.58 -0.02 0.71 -0.55 0.00 0.00 175.29 174.89 2hc0 s TYR 1059N 1.77 3.05 0.31 1.67 1.51 -0.24 -1.70 117.35 123.71 2hc0 s TYR 1059Ca 0.07 -0.31 0.07 0.00 -1.01 0.00 0.00 57.07 55.88 2hc0 s TYR 1059Cb -0.18 -2.01 -0.02 0.00 -0.11 0.00 0.00 41.96 39.64 2hc0 s TYR 1059CO 0.11 -0.08 0.35 -0.51 -1.11 0.00 0.00 175.55 174.31 2hc0 s ASP 1060N 0.55 5.75 -1.34 2.29 1.01 -1.26 -0.90 116.67 122.78 2hc0 s ASP 1060Ca -0.02 -0.25 -0.05 0.00 0.71 0.00 0.00 52.55 52.94 2hc0 s ASP 1060Cb -0.14 -1.29 0.02 0.00 1.01 0.00 0.00 42.92 42.52 2hc0 s ASP 1060CO 0.02 -0.28 0.96 0.00 0.21 0.00 0.00 175.17 176.08 2hc0 n GLN 1061N -1.44 -6.29 -3.52 8.23 6.02 -1.19 -4.91 117.38 114.28 2hc0 n GLN 1061Ca -0.03 0.73 -0.39 0.00 -0.01 0.00 0.00 57.00 57.30 2hc0 n GLN 1061Cb 0.58 -5.61 -0.10 0.00 1.02 0.00 0.00 30.24 26.13 2hc0 n GLN 1061CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2hc0 s ILE 1062N -3.42 5.27 0.29 5.09 -1.09 0.23 -4.82 121.20 122.74 2hc0 s ILE 1062Ca 0.28 0.16 -0.29 0.00 -2.23 0.00 0.00 60.65 58.57 2hc0 s ILE 1062Cb -0.13 -3.63 -0.10 0.00 -1.58 0.00 0.00 42.46 37.02 2hc0 s ILE 1062CO 0.77 0.15 1.23 -2.84 -1.23 0.00 0.00 174.94 173.02 2hc0 s PRO 1063N 1.84 4.47 0.29 2.79 0.02 -1.26 -2.26 135.00 140.88 2hc0 s PRO 1063Ca 0.09 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.16 2hc0 s PRO 1063Cb -0.16 -3.14 -0.05 0.00 0.02 0.00 0.00 34.50 31.17 2hc0 s PRO 1063CO 0.11 -0.05 0.10 0.96 -0.33 0.00 0.00 177.00 177.78 2hc0 s ILE 1064N -0.90 0.66 -0.01 2.83 -5.25 -0.02 -4.38 121.20 114.14 2hc0 s ILE 1064Ca 0.49 -2.00 0.02 0.00 -0.99 0.00 0.00 60.65 58.17 2hc0 s ILE 1064Cb -0.36 -2.63 -0.00 0.00 2.95 0.00 0.00 42.46 42.41 2hc0 s ILE 1064CO 0.46 0.00 -0.06 -0.70 -1.79 0.00 0.00 174.94 172.85 2hc0 s GLU 1065N -3.95 0.49 -0.17 0.37 2.56 -0.10 -2.10 118.70 115.79 2hc0 s GLU 1065Ca 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 54.97 55.12 2hc0 s GLU 1065Cb 0.07 -0.47 0.05 0.00 2.00 0.00 0.00 34.13 35.78 2hc0 s GLU 1065CO 0.15 0.12 -0.02 0.42 -0.56 0.00 0.00 175.26 175.37 2hc0 s ILE 1066N -0.10 0.87 -1.35 -3.70 1.01 0.36 -0.90 121.20 117.40 2hc0 s ILE 1066Ca 0.02 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 60.09 2hc0 s ILE 1066Cb -0.03 -1.15 -0.00 0.00 0.01 0.00 0.00 42.46 41.29 2hc0 s ILE 1066CO -0.00 0.03 0.54 0.00 0.00 0.00 0.00 174.94 175.50 2hc0 n GLY 1068N -1.84 2.30 3.53 0.00 0.00 -1.26 -4.97 105.19 102.96 2hc0 n GLY 1068Ca -0.28 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2hc0 n GLY 1068CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hc0 s HIS 1069N -3.32 3.15 0.32 1.61 4.02 -0.19 -5.09 115.29 115.80 2hc0 s HIS 1069Ca 0.00 -0.18 -0.20 0.00 1.02 0.00 0.00 55.06 55.70 2hc0 s HIS 1069Cb 0.00 -2.18 -0.09 0.00 -1.02 0.00 0.00 32.58 29.28 2hc0 s HIS 1069CO 0.00 -0.14 0.83 0.15 1.02 0.00 0.00 174.74 176.60 2hc0 s LYS 1070N 1.13 4.26 0.36 1.40 -0.14 -1.26 -0.49 119.74 125.00 2hc0 s LYS 1070Ca 0.05 0.98 -0.07 0.00 -1.36 0.00 0.00 55.97 55.57 2hc0 s LYS 1070Cb -0.14 -2.57 0.02 0.00 -1.68 0.00 0.00 37.83 33.46 2hc0 s LYS 1070CO 0.03 0.20 0.59 0.00 -0.76 0.00 0.00 175.35 175.41 2hc0 s ALA 1071N -1.83 0.29 0.01 5.17 0.00 -0.89 -4.75 121.76 119.76 2hc0 s ALA 1071Ca 0.52 -1.28 -0.06 0.00 0.00 0.00 0.00 51.96 51.14 2hc0 s ALA 1071Cb -0.14 0.99 -0.00 0.00 0.00 0.00 0.00 23.12 23.97 2hc0 s ALA 1071CO 0.19 -0.86 0.12 -1.50 0.00 0.00 0.00 175.76 173.71 2hc0 s ILE 1072N -2.75 0.09 -2.45 0.00 2.07 -1.26 -0.84 121.20 116.07 2hc0 s ILE 1072Ca 0.26 -0.77 0.00 0.00 -1.41 0.00 0.00 60.65 58.72 2hc0 s ILE 1072Cb -0.02 -0.48 0.00 0.00 0.13 0.00 0.00 42.46 42.08 2hc0 s ILE 1072CO 0.18 -0.43 0.00 0.61 -1.91 0.00 0.00 174.94 173.39 2hc0 n GLY 1073N 1.35 -1.24 3.76 1.50 0.00 -0.96 -4.92 105.19 104.68 2hc0 n GLY 1073Ca -0.22 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 2hc0 n GLY 1073CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hc0 s THR 1074N -3.00 4.24 -0.07 2.61 2.01 -1.26 -0.60 115.64 119.57 2hc0 s THR 1074Ca 0.00 1.94 0.03 0.00 0.31 0.00 0.00 61.69 63.97 2hc0 s THR 1074Cb 0.00 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.26 2hc0 s THR 1074CO 0.00 0.48 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.56 2hc0 s VAL 1075N -1.00 1.45 -0.13 3.82 1.01 -0.07 -4.54 120.40 120.94 2hc0 s VAL 1075Ca 0.40 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 2hc0 s VAL 1075Cb -0.25 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2hc0 s VAL 1075CO 0.29 0.42 0.07 -0.76 0.00 0.00 0.00 175.10 175.13 2hc0 s LEU 1076N 0.40 3.95 -0.14 3.92 1.43 -0.47 -1.08 118.68 126.70 2hc0 s LEU 1076Ca -0.13 0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.22 2hc0 s LEU 1076Cb -0.15 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 2hc0 s LEU 1076CO 0.05 0.31 -0.16 -0.63 0.23 0.00 0.00 176.35 176.15 2hc0 s ILE 1077N -0.47 2.71 -0.51 -0.59 -1.09 0.53 -0.49 121.20 121.29 2hc0 s ILE 1077Ca 0.10 -0.77 0.00 0.00 -2.23 0.00 0.00 60.65 57.75 2hc0 s ILE 1077Cb -0.12 -2.13 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 2hc0 s ILE 1077CO 0.02 0.53 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 2hc0 n GLY 1078N 3.77 -1.24 3.56 6.18 0.00 -0.80 0.54 105.19 117.20 2hc0 n GLY 1078Ca -0.19 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.74 2hc0 n GLY 1078CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hc0 s PRO 1079N -0.20 2.48 0.04 1.61 0.04 -1.26 -4.14 135.00 133.56 2hc0 s PRO 1079Ca 0.00 -0.31 0.09 0.00 0.04 0.00 0.00 61.00 60.82 2hc0 s PRO 1079Cb 0.00 -5.06 -0.03 0.00 0.04 0.00 0.00 34.50 29.45 2hc0 s PRO 1079CO 0.00 -3.52 -0.25 -0.08 0.04 0.00 0.00 177.00 173.20 2hc0 s THR 1080N 10.53 1.99 -2.18 1.26 -1.32 -1.26 -5.00 115.64 119.65 2hc0 s THR 1080Ca 0.72 -1.32 0.30 0.00 -1.21 0.00 0.00 61.69 60.17 2hc0 s THR 1080Cb -0.07 -1.71 0.68 0.00 -1.51 0.00 0.00 72.50 69.90 2hc0 s THR 1080CO 0.01 0.33 1.95 -0.81 -2.21 0.00 0.00 174.62 173.89 2hc0 n PRO 1081N 1.83 1.27 -3.76 7.08 -0.04 -1.26 -4.68 135.00 135.43 2hc0 n PRO 1081Ca -0.17 -0.48 -0.13 0.00 -0.04 0.00 0.00 63.50 62.68 2hc0 n PRO 1081Cb 0.52 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.37 2hc0 n PRO 1081CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hc0 s ALA 1082N -2.07 -0.55 0.17 0.55 0.00 -1.26 -5.10 121.76 113.50 2hc0 s ALA 1082Ca 0.41 0.79 -0.32 0.00 0.00 0.00 0.00 51.96 52.84 2hc0 s ALA 1082Cb 0.21 -0.48 -0.10 0.00 0.00 0.00 0.00 23.12 22.75 2hc0 s ALA 1082CO 0.37 -0.15 1.58 -0.80 0.00 0.00 0.00 175.76 176.76 2hc0 s ASN 1083N 0.63 6.57 -0.03 0.00 0.01 -1.26 -4.73 114.94 116.12 2hc0 s ASN 1083Ca -0.04 2.64 0.01 0.00 -0.71 0.00 0.00 52.86 54.76 2hc0 s ASN 1083Cb -0.06 -2.59 0.02 0.00 0.41 0.00 0.00 41.25 39.03 2hc0 s ASN 1083CO -0.04 -0.83 -0.05 0.27 -1.51 0.00 0.00 177.10 174.95 2hc0 s ILE 1084N 1.12 0.50 -0.22 0.60 -4.36 0.31 -1.50 121.20 117.64 2hc0 s ILE 1084Ca 0.70 -0.14 -0.16 0.00 -0.26 0.00 0.00 60.65 60.79 2hc0 s ILE 1084Cb -0.44 -0.51 -0.04 0.00 1.25 0.00 0.00 42.46 42.72 2hc0 s ILE 1084CO 0.31 0.20 0.43 -0.63 0.24 0.00 0.00 174.94 175.50 2hc0 s ILE 1085N 0.69 5.16 0.35 8.37 1.01 0.18 -1.11 121.20 135.86 2hc0 s ILE 1085Ca -0.09 0.75 0.04 0.00 0.00 0.00 0.00 60.65 61.35 2hc0 s ILE 1085Cb -0.12 -3.76 0.04 0.00 0.01 0.00 0.00 42.46 38.63 2hc0 s ILE 1085CO 0.00 0.20 0.34 0.61 0.00 0.00 0.00 174.94 176.09 2hc0 n GLY 1086N 4.12 2.55 0.24 6.18 0.00 -1.24 -1.16 105.19 115.87 2hc0 n GLY 1086Ca -0.07 -2.23 0.09 0.00 0.00 0.00 0.00 46.02 43.81 2hc0 n GLY 1086CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2hc0 h ARG 1087N 0.00 0.00 -0.05 1.61 3.08 -0.30 -2.37 114.38 116.35 2hc0 h ARG 1087Ca -0.20 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.86 2hc0 h ARG 1087Cb 0.80 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.85 2hc0 h ARG 1087CO 0.31 0.19 0.04 -2.95 -1.07 0.00 0.00 179.97 176.49 2hc0 h ASN 1088N 0.00 0.00 0.00 7.04 -0.00 -1.74 -1.99 115.58 118.90 2hc0 h ASN 1088Ca -0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.30 56.17 2hc0 h ASN 1088Cb 0.43 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.72 2hc0 h ASN 1088CO 0.02 0.00 -1.88 0.18 -0.00 0.00 0.00 177.43 175.75 2hc0 n LEU 1089N -4.20 0.00 0.05 6.14 4.77 -0.93 -4.43 117.00 118.39 2hc0 n LEU 1089Ca -0.02 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.94 2hc0 n LEU 1089Cb 0.14 0.17 0.24 0.00 -2.33 0.00 0.00 43.42 41.63 2hc0 n LEU 1089CO 0.31 0.17 0.74 -0.07 -1.33 0.00 0.00 177.39 177.21 2hc0 h LEU 1090N 0.00 0.39 -1.04 2.23 3.38 -1.14 -1.86 115.31 117.26 2hc0 h LEU 1090Ca -0.18 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 2hc0 h LEU 1090Cb 1.28 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 2hc0 h LEU 1090CO 0.01 0.65 0.15 0.71 0.09 0.00 0.00 178.44 180.05 2hc0 h THR 1091N 0.34 1.22 0.00 0.22 1.35 -1.59 -1.53 112.91 112.92 2hc0 h THR 1091Ca 0.05 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 2hc0 h THR 1091Cb 0.65 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 2hc0 h THR 1091CO 0.05 0.30 0.00 1.56 -0.25 0.00 0.00 175.52 177.17 2hc0 h GLN 1092N 0.81 0.00 -0.33 4.72 1.08 -1.55 -2.21 115.11 117.62 2hc0 h GLN 1092Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 2hc0 h GLN 1092Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2hc0 h GLN 1092CO -0.00 0.00 0.00 0.44 -0.95 0.00 0.00 178.83 178.32 2hc0 n ILE 1093N -2.49 0.42 -1.17 2.54 -5.35 -1.11 -4.88 119.36 107.32 2hc0 n ILE 1093Ca 0.03 -0.69 -0.01 0.00 -0.27 0.00 0.00 62.75 61.81 2hc0 n ILE 1093Cb 0.31 1.00 -0.01 0.00 -1.74 0.00 0.00 39.64 39.20 2hc0 n ILE 1093CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2hc0 n GLY 1094N 1.47 0.46 3.72 3.28 0.00 -0.83 -5.00 105.19 108.28 2hc0 n GLY 1094Ca 0.19 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 2hc0 n GLY 1094CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hc0 s THR 1096N 0.74 1.29 0.03 0.00 -4.23 -1.26 -4.73 115.64 107.49 2hc0 s THR 1096Ca 0.56 -2.09 -0.11 0.00 -1.18 0.00 0.00 61.69 58.86 2hc0 s THR 1096Cb -0.28 -2.06 -0.06 0.00 1.34 0.00 0.00 72.50 71.45 2hc0 s THR 1096CO 0.30 -0.58 0.38 -0.76 -0.54 0.00 0.00 174.62 173.42 2hc0 s LEU 1097N -3.25 4.40 -0.08 4.79 1.43 -1.26 -5.07 118.68 119.63 2hc0 s LEU 1097Ca 0.22 0.82 -0.05 0.00 -1.03 0.00 0.00 54.13 54.09 2hc0 s LEU 1097Cb 0.03 -2.75 0.04 0.00 0.03 0.00 0.00 46.19 43.53 2hc0 s LEU 1097CO 0.05 0.25 0.20 0.20 0.23 0.00 0.00 176.35 177.27 2hc0 s ASN 1098N -1.45 -0.19 0.00 2.29 -0.87 -1.26 -5.29 114.94 108.16 2hc0 s ASN 1098Ca 0.28 0.41 0.00 0.00 -1.57 0.00 0.00 52.86 51.98 2hc0 s ASN 1098Cb -0.15 0.33 0.00 0.00 -0.02 0.00 0.00 41.25 41.41 2hc0 s ASN 1098CO 0.15 -0.14 0.00 2.22 -2.57 0.00 0.00 177.10 176.77