#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eke s PRO 106 N 0.00 3.63 0.40 -0.24 0.02 -1.26 -5.02 135.00 132.52 2eke s PRO 106 Ca 0.00 1.63 -0.24 0.00 0.02 0.00 0.00 61.00 62.41 2eke s PRO 106 Cb 0.00 -2.21 -0.10 0.00 0.02 0.00 0.00 34.50 32.22 2eke s PRO 106 CO 0.00 -0.63 1.00 -0.51 -0.33 0.00 0.00 177.00 176.54 2eke s LEU 107 N -3.38 4.12 -0.65 -5.54 1.43 -1.26 -5.01 118.68 108.39 2eke s LEU 107 Ca 0.67 1.91 -0.13 0.00 -1.03 0.00 0.00 54.13 55.56 2eke s LEU 107 Cb -0.24 -4.25 0.17 0.00 0.03 0.00 0.00 46.19 41.89 2eke s LEU 107 CO 0.29 -0.40 0.57 0.54 0.23 0.00 0.00 176.35 177.58 2eke s VAL 108 N -1.78 5.04 0.00 -1.59 0.11 -1.26 -5.05 120.40 115.87 2eke s VAL 108 Ca 0.58 -2.08 -0.30 0.00 -2.93 0.00 0.00 61.98 57.24 2eke s VAL 108 Cb -0.18 -4.20 -0.04 0.00 -1.53 0.00 0.00 36.38 30.43 2eke s VAL 108 CO 0.23 -0.92 1.19 -2.16 -3.33 0.00 0.00 175.10 170.11 2eke s PRO 109 N 0.82 4.40 -0.30 1.54 0.04 -1.26 -5.00 135.00 135.24 2eke s PRO 109 Ca 0.11 1.71 0.02 0.00 0.04 0.00 0.00 61.00 62.87 2eke s PRO 109 Cb -0.21 -3.46 0.07 0.00 0.04 0.00 0.00 34.50 30.95 2eke s PRO 109 CO -0.03 -0.34 -0.03 1.03 0.04 0.00 0.00 177.00 177.67 2eke s ARG 110 N 1.63 2.11 0.49 4.56 3.00 -1.26 -5.11 118.95 124.37 2eke s ARG 110 Ca 0.57 -1.47 0.03 0.00 0.00 0.00 0.00 55.73 54.86 2eke s ARG 110 Cb -0.27 -3.07 -0.02 0.00 0.00 0.00 0.00 34.95 31.60 2eke s ARG 110 CO 0.26 -0.69 0.08 0.20 0.00 0.00 0.00 175.30 175.15 2eke s GLY 111 N 1.14 2.79 -0.06 -3.53 0.00 -1.26 -5.15 107.32 101.26 2eke s GLY 111 Ca -0.03 -0.93 -0.11 0.00 0.00 0.00 0.00 44.72 43.65 2eke s GLY 111 CO -0.05 -2.12 0.26 -0.56 0.00 0.00 0.00 173.10 170.63 2eke s SER 112 N -3.92 -0.20 0.06 1.64 0.01 -1.26 -5.15 113.70 104.88 2eke s SER 112 Ca 0.17 0.26 -0.19 0.00 1.31 0.00 0.00 55.95 57.51 2eke s SER 112 Cb 0.02 0.42 -0.06 0.00 0.21 0.00 0.00 66.02 66.61 2eke s SER 112 CO 0.10 -0.26 0.55 -1.61 0.41 0.00 0.00 173.24 172.43 2eke s GLU 1013N -0.60 4.17 -0.31 12.44 0.41 -1.26 -5.04 118.70 128.51 2eke s GLU 1013Ca -0.07 0.69 -0.18 0.00 -0.41 0.00 0.00 54.97 55.00 2eke s GLU 1013Cb -0.04 -3.24 -0.01 0.00 -1.78 0.00 0.00 34.13 29.05 2eke s GLU 1013CO 0.02 0.63 0.53 0.08 -0.49 0.00 0.00 175.26 176.03 2eke s VAL 1014N -1.04 5.02 0.38 2.63 1.01 -1.26 -5.03 120.40 122.11 2eke s VAL 1014Ca 0.28 0.61 -0.27 0.00 0.00 0.00 0.00 61.98 62.61 2eke s VAL 1014Cb -0.19 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 2eke s VAL 1014CO 0.18 -0.10 1.34 -1.59 0.00 0.00 0.00 175.10 174.93 2eke s LYS 1015N 2.41 4.08 0.36 2.72 0.00 -1.26 -4.93 119.74 123.13 2eke s LYS 1015Ca 0.21 2.26 -0.28 0.00 0.00 0.00 0.00 55.97 58.15 2eke s LYS 1015Cb -0.15 -2.87 -0.11 0.00 0.00 0.00 0.00 37.83 34.69 2eke s LYS 1015CO 0.12 -0.43 1.52 -0.35 0.00 0.00 0.00 175.35 176.20 2eke n PRO 1016N 0.35 2.71 -2.07 1.78 -0.04 -1.26 -4.92 135.00 131.55 2eke n PRO 1016Ca 0.02 0.95 -0.42 0.00 -0.04 0.00 0.00 63.50 64.01 2eke n PRO 1016Cb 0.42 -2.70 -0.03 0.00 -0.04 0.00 0.00 33.50 31.15 2eke n PRO 1016CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2eke s GLU 1017N -1.83 4.21 0.66 0.54 2.12 -1.26 -4.93 118.70 118.21 2eke s GLU 1017Ca 0.55 2.13 -0.18 0.00 0.36 0.00 0.00 54.97 57.83 2eke s GLU 1017Cb -0.47 -3.77 -0.01 0.00 0.26 0.00 0.00 34.13 30.13 2eke s GLU 1017CO 0.61 -0.74 1.27 1.55 -0.54 0.00 0.00 175.26 177.41 2eke n VAL 1018N 5.08 4.78 -3.24 3.70 3.14 -1.26 -4.98 118.33 125.55 2eke n VAL 1018Ca 0.16 -0.49 -0.41 0.00 -2.96 0.00 0.00 64.34 60.64 2eke n VAL 1018Cb 0.43 -1.46 -0.08 0.00 -1.06 0.00 0.00 33.84 31.67 2eke n VAL 1018CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2eke s LYS 1019N -3.38 3.76 0.07 1.45 -0.14 -1.26 -5.02 119.74 115.21 2eke s LYS 1019Ca 0.82 -0.02 -0.31 0.00 -1.36 0.00 0.00 55.97 55.11 2eke s LYS 1019Cb -0.38 -3.76 -0.09 0.00 -1.68 0.00 0.00 37.83 31.92 2eke s LYS 1019CO 0.41 -0.56 1.78 -2.14 -0.76 0.00 0.00 175.35 174.08 2eke s PRO 1020N 2.38 4.16 -0.26 -1.68 0.02 -1.26 -4.85 135.00 133.52 2eke s PRO 1020Ca 0.19 2.47 0.07 0.00 0.02 0.00 0.00 61.00 63.75 2eke s PRO 1020Cb -0.15 -3.76 0.58 0.00 0.02 0.00 0.00 34.50 31.18 2eke s PRO 1020CO 0.12 -0.83 1.57 0.39 -0.33 0.00 0.00 177.00 177.92 2eke n GLU 1021N 6.23 3.05 0.03 5.54 -0.58 -1.26 -4.62 120.64 129.03 2eke n GLU 1021Ca 0.18 -2.36 -0.22 0.00 -0.42 0.00 0.00 57.16 54.33 2eke n GLU 1021Cb 0.40 -2.00 -0.14 0.00 -0.57 0.00 0.00 31.44 29.13 2eke n GLU 1021CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 2eke h THR 1022N 2.00 0.99 -2.01 2.62 1.35 -1.99 -3.47 112.91 112.40 2eke h THR 1022Ca 0.23 -2.44 -0.60 0.00 -0.55 0.00 0.00 66.41 63.05 2eke h THR 1022Cb 2.01 2.73 -0.12 0.00 -1.73 0.00 0.00 68.15 71.04 2eke h THR 1022CO 0.60 0.77 -0.68 -1.00 -0.25 0.00 0.00 175.52 174.96 2eke s HIS 1023N -2.51 2.44 0.07 4.73 3.76 -1.26 -0.37 115.29 122.15 2eke s HIS 1023Ca -0.18 -0.42 -0.04 0.00 -0.15 0.00 0.00 55.06 54.27 2eke s HIS 1023Cb 0.05 -1.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.40 2eke s HIS 1023CO 0.80 0.58 0.05 0.96 -0.85 0.00 0.00 174.74 176.29 2eke s ILE 1024N -2.54 0.18 -0.12 0.60 -4.36 -0.47 -4.86 121.20 109.63 2eke s ILE 1024Ca 0.33 -1.62 -0.05 0.00 -0.26 0.00 0.00 60.65 59.05 2eke s ILE 1024Cb -0.01 -1.52 -0.04 0.00 1.25 0.00 0.00 42.46 42.15 2eke s ILE 1024CO 0.17 -0.83 0.06 0.20 0.24 0.00 0.00 174.94 174.79 2eke s ASN 1025N -2.91 5.73 -0.02 4.36 0.01 -1.26 -1.93 114.94 118.92 2eke s ASN 1025Ca 0.08 0.24 0.05 0.00 -0.71 0.00 0.00 52.86 52.52 2eke s ASN 1025Cb 0.07 -1.81 -0.01 0.00 0.41 0.00 0.00 41.25 39.90 2eke s ASN 1025CO -0.09 0.33 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.90 2eke s LEU 1026N -0.58 2.02 -0.26 0.60 1.43 -0.10 0.11 118.68 121.91 2eke s LEU 1026Ca 0.11 -0.31 -0.09 0.00 -1.03 0.00 0.00 54.13 52.81 2eke s LEU 1026Cb -0.12 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.18 2eke s LEU 1026CO 0.02 0.21 0.12 -0.75 0.23 0.00 0.00 176.35 176.18 2eke s LYS 1027N -0.37 3.81 -0.21 1.70 2.20 -0.49 -1.28 119.74 125.10 2eke s LYS 1027Ca 0.06 -0.40 -0.05 0.00 -0.36 0.00 0.00 55.97 55.22 2eke s LYS 1027Cb -0.07 -3.46 -0.02 0.00 -1.51 0.00 0.00 37.83 32.77 2eke s LYS 1027CO -0.00 -0.15 0.01 0.08 -0.36 0.00 0.00 175.35 174.92 2eke s VAL 1028N 1.59 3.96 0.05 4.02 1.01 0.67 -0.89 120.40 130.81 2eke s VAL 1028Ca 0.06 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 61.79 2eke s VAL 1028Cb -0.15 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 2eke s VAL 1028CO 0.07 0.42 -0.16 -0.55 0.00 0.00 0.00 175.10 174.87 2eke s SER 1029N 1.09 1.92 -0.06 3.32 0.15 -0.57 -0.12 113.70 119.45 2eke s SER 1029Ca 0.02 -0.51 0.08 0.00 0.70 0.00 0.00 55.95 56.24 2eke s SER 1029Cb -0.14 -0.12 0.12 0.00 -1.71 0.00 0.00 66.02 64.17 2eke s SER 1029CO 0.02 0.05 1.04 -0.90 1.20 0.00 0.00 173.24 174.64 2eke n ASP 1030N 1.73 1.93 0.00 5.45 5.68 -1.00 -0.47 116.55 129.86 2eke n ASP 1030Ca -0.18 -2.41 0.00 0.00 -0.50 0.00 0.00 54.79 51.70 2eke n ASP 1030Cb 0.54 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 2eke n ASP 1030CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2eke n GLY 1031N -0.85 3.26 0.03 6.12 0.00 -1.26 -4.75 105.19 107.74 2eke n GLY 1031Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 2eke n GLY 1031CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2eke n SER 1032N 0.06 3.30 -3.87 1.61 3.41 -1.26 -5.03 113.62 111.84 2eke n SER 1032Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2eke n SER 1032Cb 0.00 0.75 -0.14 0.00 -0.26 0.00 0.00 64.21 64.56 2eke n SER 1032CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eke s SER 1033N -3.73 0.00 -0.18 4.04 0.01 -1.26 -5.13 113.70 107.45 2eke s SER 1033Ca -0.03 -0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.22 2eke s SER 1033Cb 0.02 0.04 0.02 0.00 0.21 0.00 0.00 66.02 66.32 2eke s SER 1033CO 0.28 -0.03 -0.18 -1.83 0.41 0.00 0.00 173.24 171.89 2eke s GLU 1034N -0.13 2.79 -0.13 12.44 -1.05 -1.26 -2.38 118.70 128.98 2eke s GLU 1034Ca -0.01 -0.84 0.01 0.00 -0.15 0.00 0.00 54.97 53.98 2eke s GLU 1034Cb -0.01 -2.53 -0.01 0.00 -0.44 0.00 0.00 34.13 31.15 2eke s GLU 1034CO -0.00 -0.25 -0.17 0.42 0.95 0.00 0.00 175.26 176.20 2eke s ILE 1035N 1.31 2.60 0.04 1.83 1.01 0.84 -4.91 121.20 123.92 2eke s ILE 1035Ca 0.04 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.75 2eke s ILE 1035Cb -0.14 -2.07 -0.06 0.00 0.01 0.00 0.00 42.46 40.21 2eke s ILE 1035CO -0.12 0.53 0.41 -0.36 0.00 0.00 0.00 174.94 175.40 2eke s PHE 1036N 0.52 3.65 0.04 3.97 0.40 -1.26 -0.24 117.98 125.07 2eke s PHE 1036Ca -0.11 0.90 0.03 0.00 -0.60 0.00 0.00 56.93 57.15 2eke s PHE 1036Cb -0.16 -2.23 -0.02 0.00 0.51 0.00 0.00 43.02 41.11 2eke s PHE 1036CO 0.04 0.58 -0.10 -0.06 0.70 0.00 0.00 175.22 176.38 2eke s PHE 1037N -1.25 0.85 -0.24 0.36 0.40 -0.40 -4.97 117.98 112.73 2eke s PHE 1037Ca 0.29 -0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 56.18 2eke s PHE 1037Cb -0.15 -0.50 0.02 0.00 0.51 0.00 0.00 43.02 42.90 2eke s PHE 1037CO 0.16 -0.03 -0.08 0.21 0.70 0.00 0.00 175.22 176.18 2eke s LYS 1038N -1.37 2.88 0.11 0.44 2.20 -1.26 -0.93 119.74 121.81 2eke s LYS 1038Ca -0.05 -0.94 0.03 0.00 -0.36 0.00 0.00 55.97 54.64 2eke s LYS 1038Cb -0.09 -2.93 -0.04 0.00 -1.51 0.00 0.00 37.83 33.26 2eke s LYS 1038CO 0.01 -0.37 -0.08 0.96 -0.36 0.00 0.00 175.35 175.52 2eke s ILE 1039N 1.32 0.84 0.27 5.43 -4.36 -0.81 -4.96 121.20 118.93 2eke s ILE 1039Ca 0.01 -1.96 -0.29 0.00 -0.26 0.00 0.00 60.65 58.14 2eke s ILE 1039Cb -0.16 -1.72 -0.09 0.00 1.25 0.00 0.00 42.46 41.73 2eke s ILE 1039CO -0.05 -0.83 1.15 -0.75 0.24 0.00 0.00 174.94 174.70 2eke s LYS 1040N -3.78 4.56 0.60 0.37 2.20 -1.26 -1.36 119.74 121.07 2eke s LYS 1040Ca 0.13 1.89 0.30 0.00 -0.36 0.00 0.00 55.97 57.93 2eke s LYS 1040Cb 0.04 -3.18 1.73 0.00 -1.51 0.00 0.00 37.83 34.91 2eke s LYS 1040CO -0.03 0.08 2.11 0.87 -0.36 0.00 0.00 175.35 178.03 2eke h LYS 1041N 4.05 0.00 -0.58 4.03 1.57 -1.04 -1.87 116.57 122.73 2eke h LYS 1041Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2eke h LYS 1041Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2eke h LYS 1041CO 0.68 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.81 2eke n THR 1042N -3.66 1.70 -3.97 -0.16 -2.24 -1.26 -1.23 114.28 103.44 2eke n THR 1042Ca 0.01 -1.22 -0.36 0.00 -2.27 0.00 0.00 64.05 60.20 2eke n THR 1042Cb 0.30 0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 68.64 2eke n THR 1042CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2eke s THR 1043N -1.75 5.24 0.53 4.28 2.01 -0.70 -4.97 115.64 120.27 2eke s THR 1043Ca 0.47 0.11 -0.22 0.00 0.31 0.00 0.00 61.69 62.35 2eke s THR 1043Cb 0.30 -3.28 -0.06 0.00 0.01 0.00 0.00 72.50 69.47 2eke s THR 1043CO 0.23 0.60 1.38 -2.65 -0.69 0.00 0.00 174.62 173.49 2eke n PRO 1044N 2.16 1.82 0.00 4.92 -0.02 -1.26 -4.06 135.00 138.56 2eke n PRO 1044Ca -0.19 0.66 0.09 0.00 -2.02 0.00 0.00 63.50 62.04 2eke n PRO 1044Cb 0.54 -2.60 0.41 0.00 -0.02 0.00 0.00 33.50 31.84 2eke n PRO 1044CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2eke n LEU 1045N -0.84 0.00 -0.21 2.45 4.77 0.20 -3.97 117.00 119.40 2eke n LEU 1045Ca 0.09 0.46 -0.06 0.00 -0.03 0.00 0.00 56.01 56.47 2eke n LEU 1045Cb 0.44 -0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2eke n LEU 1045CO 0.55 -0.17 0.61 -0.09 -1.33 0.00 0.00 177.39 176.96 2eke h ARG 1046N 0.00 -0.16 -0.65 3.23 2.43 -1.39 -0.03 114.38 117.80 2eke h ARG 1046Ca 0.00 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.24 2eke h ARG 1046Cb 0.29 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 2eke h ARG 1046CO 0.00 -0.11 0.35 0.00 -1.51 0.00 0.00 179.97 178.70 2eke h ARG 1047N -0.17 0.63 -0.21 0.20 3.08 -1.87 -0.37 114.38 115.67 2eke h ARG 1047Ca 0.23 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2eke h ARG 1047Cb 0.56 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2eke h ARG 1047CO -0.70 0.42 0.13 1.25 -1.07 0.00 0.00 179.97 180.00 2eke h LEU 1048N 0.65 0.24 -0.63 3.04 6.46 -1.49 -0.93 115.31 122.65 2eke h LEU 1048Ca 0.30 -0.02 0.03 0.00 -0.12 0.00 0.00 57.88 58.07 2eke h LEU 1048Cb 0.21 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.03 2eke h LEU 1048CO -0.19 0.19 0.38 0.24 -0.62 0.00 0.00 178.44 178.44 2eke h MET 1049N 0.27 0.72 -0.33 1.25 2.86 -0.37 -1.45 114.93 117.90 2eke h MET 1049Ca 0.08 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2eke h MET 1049Cb -0.02 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 2eke h MET 1049CO -0.02 0.48 -0.05 0.93 1.06 0.00 0.00 176.91 179.32 2eke h GLU 1050N 0.75 0.61 -0.55 1.72 5.08 -0.84 -1.52 114.58 119.82 2eke h GLU 1050Ca 0.26 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2eke h GLU 1050Cb 0.05 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2eke h GLU 1050CO -0.11 0.77 0.24 0.00 -1.00 0.00 0.00 179.01 178.91 2eke h ALA 1051N 0.82 1.40 -0.09 3.43 0.00 -0.96 -0.45 119.26 123.40 2eke h ALA 1051Ca 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2eke h ALA 1051Cb 0.53 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2eke h ALA 1051CO 0.03 0.47 -0.06 0.35 0.00 0.00 0.00 179.25 180.03 2eke h PHE 1052N 0.77 0.24 -0.09 0.00 3.57 -1.15 -2.05 116.94 118.23 2eke h PHE 1052Ca 0.19 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.67 2eke h PHE 1052Cb 0.12 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 2eke h PHE 1052CO 0.01 0.59 -0.20 0.00 -2.23 0.00 0.00 178.31 176.48 2eke h ALA 1053N 0.61 -0.18 0.00 2.41 0.00 -0.83 -1.23 119.26 120.04 2eke h ALA 1053Ca 0.02 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2eke h ALA 1053Cb 0.54 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2eke h ALA 1053CO 0.02 -0.67 -0.41 1.57 0.00 0.00 0.00 179.25 179.76 2eke h LYS 1054N -0.27 0.00 -0.27 0.00 2.10 -1.14 -0.61 116.57 116.38 2eke h LYS 1054Ca 0.09 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.65 2eke h LYS 1054Cb 0.39 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.71 2eke h LYS 1054CO -0.25 0.41 -0.21 -0.09 -2.00 0.00 0.00 179.45 177.31 2eke h ARG 1055N 0.00 0.49 -0.01 0.07 9.65 -0.81 -2.37 114.38 121.40 2eke h ARG 1055Ca -0.00 -0.17 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 2eke h ARG 1055Cb 0.81 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 2eke h ARG 1055CO 0.05 0.67 -0.20 1.04 2.80 0.00 0.00 179.97 184.34 2eke n GLN 1056N -4.15 0.83 -2.76 0.20 1.13 -0.51 -4.96 117.38 107.16 2eke n GLN 1056Ca -0.00 -0.44 -0.10 0.00 -1.94 0.00 0.00 57.00 54.52 2eke n GLN 1056Cb 0.38 -1.49 0.05 0.00 0.11 0.00 0.00 30.24 29.29 2eke n GLN 1056CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2eke n GLY 1057N 1.31 -0.10 3.13 1.08 0.00 -0.42 -5.05 105.19 105.14 2eke n GLY 1057Ca 0.13 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 2eke n GLY 1057CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eke s LYS 1058N -4.56 0.65 0.21 1.61 1.02 -0.37 -5.02 119.74 113.29 2eke s LYS 1058Ca 0.07 -0.91 -0.28 0.00 0.02 0.00 0.00 55.97 54.87 2eke s LYS 1058Cb -0.01 0.25 -0.09 0.00 -0.52 0.00 0.00 37.83 37.47 2eke s LYS 1058CO 0.43 -0.17 0.86 -1.21 -0.92 0.00 0.00 175.35 174.35 2eke s GLU 1059N -3.20 4.71 0.17 1.68 0.41 -1.26 -4.07 118.70 117.14 2eke s GLU 1059Ca 0.00 1.32 -0.21 0.00 -0.41 0.00 0.00 54.97 55.68 2eke s GLU 1059Cb 0.02 -3.24 0.10 0.00 -1.78 0.00 0.00 34.13 29.23 2eke s GLU 1059CO -0.07 0.53 1.61 0.52 -0.49 0.00 0.00 175.26 177.35 2eke h MET 1060N 4.17 -0.18 0.00 1.61 2.86 -1.93 0.41 114.93 121.86 2eke h MET 1060Ca -0.46 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 2eke h MET 1060Cb 1.20 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.90 2eke h MET 1060CO 0.67 -0.12 0.00 -0.40 1.06 0.00 0.00 176.91 178.12 2eke n ASP 1061N -5.41 0.21 -0.65 1.22 5.75 -1.26 -1.38 116.55 115.03 2eke n ASP 1061Ca 0.02 0.59 0.13 0.00 -0.01 0.00 0.00 54.79 55.53 2eke n ASP 1061Cb 0.33 -0.62 0.38 0.00 -1.03 0.00 0.00 41.12 40.17 2eke n ASP 1061CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2eke n SER 1062N -1.78 2.03 -4.22 -1.12 3.41 0.13 -4.84 113.62 107.23 2eke n SER 1062Ca 0.00 -1.68 -0.21 0.00 -0.26 0.00 0.00 58.87 56.72 2eke n SER 1062Cb 0.05 -0.01 -0.12 0.00 -0.26 0.00 0.00 64.21 63.86 2eke n SER 1062CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2eke s LEU 1063N -1.96 2.27 -0.05 1.04 1.43 -0.48 -1.67 118.68 119.25 2eke s LEU 1063Ca 0.35 -0.63 0.04 0.00 -1.03 0.00 0.00 54.13 52.86 2eke s LEU 1063Cb 0.21 -0.71 -0.00 0.00 0.03 0.00 0.00 46.19 45.72 2eke s LEU 1063CO 0.32 0.00 -0.19 0.00 0.23 0.00 0.00 176.35 176.71 2eke s ARG 1064N -1.74 2.05 -0.20 1.70 1.70 0.04 -4.78 118.95 117.72 2eke s ARG 1064Ca 0.02 -0.67 -0.05 0.00 -0.47 0.00 0.00 55.73 54.56 2eke s ARG 1064Cb -0.10 -1.73 -0.03 0.00 -0.57 0.00 0.00 34.95 32.53 2eke s ARG 1064CO 0.03 0.24 0.01 -0.06 -1.08 0.00 0.00 175.30 174.44 2eke s PHE 1065N 0.10 3.06 0.00 5.89 0.40 -1.26 -1.02 117.98 125.16 2eke s PHE 1065Ca -0.06 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.93 2eke s PHE 1065Cb -0.13 -2.09 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 2eke s PHE 1065CO 0.03 -0.20 -0.16 -0.51 0.70 0.00 0.00 175.22 175.08 2eke s LEU 1066N 0.97 2.65 -0.25 -0.37 1.43 0.51 -0.03 118.68 123.59 2eke s LEU 1066Ca 0.02 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2eke s LEU 1066Cb -0.14 -1.54 0.06 0.00 0.03 0.00 0.00 46.19 44.59 2eke s LEU 1066CO 0.02 0.29 -0.10 -0.47 0.23 0.00 0.00 176.35 176.32 2eke s TYR 1067N -0.84 3.04 -1.45 0.29 5.04 0.21 -1.01 117.35 122.63 2eke s TYR 1067Ca 0.13 -2.16 -0.09 0.00 -2.44 0.00 0.00 57.07 52.51 2eke s TYR 1067Cb -0.11 -1.85 0.05 0.00 0.35 0.00 0.00 41.96 40.41 2eke s TYR 1067CO 0.03 -0.85 0.91 -0.25 -1.34 0.00 0.00 175.55 174.06 2eke n ASP 1068N 4.50 -3.81 0.00 4.32 8.00 -1.26 -1.63 116.55 126.67 2eke n ASP 1068Ca -0.14 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.59 2eke n ASP 1068Cb 0.43 -4.03 0.00 0.00 -0.02 0.00 0.00 41.12 37.50 2eke n ASP 1068CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2eke n GLY 1069N -1.68 2.47 3.67 0.44 0.00 -1.26 -5.02 105.19 103.81 2eke n GLY 1069Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2eke n GLY 1069CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eke s ILE 1070N -3.05 5.07 0.26 -0.61 -1.09 -0.64 -5.01 121.20 116.12 2eke s ILE 1070Ca 0.00 0.07 -0.30 0.00 -2.23 0.00 0.00 60.65 58.19 2eke s ILE 1070Cb 0.00 -3.31 -0.11 0.00 -1.58 0.00 0.00 42.46 37.47 2eke s ILE 1070CO 0.00 0.44 1.52 -0.60 -1.23 0.00 0.00 174.94 175.07 2eke s ARG 1071N 0.46 4.20 0.03 2.79 3.52 -1.26 -0.62 118.95 128.07 2eke s ARG 1071Ca 0.05 2.42 -0.16 0.00 -0.13 0.00 0.00 55.73 57.92 2eke s ARG 1071Cb -0.12 -3.08 -0.06 0.00 -1.56 0.00 0.00 34.95 30.13 2eke s ARG 1071CO -0.00 -0.53 0.47 0.42 -0.81 0.00 0.00 175.30 174.85 2eke s ILE 1072N 0.10 4.92 -0.25 4.11 1.01 0.95 -4.89 121.20 127.17 2eke s ILE 1072Ca 0.62 0.97 -0.11 0.00 0.00 0.00 0.00 60.65 62.13 2eke s ILE 1072Cb -0.45 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 2eke s ILE 1072CO 0.44 0.56 0.18 -1.10 0.00 0.00 0.00 174.94 175.02 2eke s GLN 1073N -1.12 4.05 0.60 2.79 -0.21 -1.26 -4.71 119.66 119.81 2eke s GLN 1073Ca 0.26 -0.26 0.29 0.00 0.02 0.00 0.00 55.36 55.67 2eke s GLN 1073Cb -0.18 -3.56 1.01 0.00 1.00 0.00 0.00 33.01 31.28 2eke s GLN 1073CO 0.16 0.01 1.34 0.00 -2.12 0.00 0.00 175.29 174.68 2eke h ALA 1074N 7.67 3.04 -0.00 6.09 0.00 -1.97 0.62 119.26 134.71 2eke h ALA 1074Ca -0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2eke h ALA 1074Cb 1.17 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2eke h ALA 1074CO 0.64 -1.79 -0.35 -0.40 0.00 0.00 0.00 179.25 177.35 2eke n ASP 1075N -3.32 0.54 -4.82 0.00 5.75 -1.26 -1.14 116.55 112.31 2eke n ASP 1075Ca 0.25 -0.33 -0.33 0.00 -0.01 0.00 0.00 54.79 54.37 2eke n ASP 1075Cb 1.55 0.10 -0.06 0.00 -1.03 0.00 0.00 41.12 41.69 2eke n ASP 1075CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2eke s GLN 1076N -2.84 4.10 0.26 0.11 -0.21 0.22 -4.72 119.66 116.57 2eke s GLN 1076Ca 0.16 1.16 0.09 0.00 0.02 0.00 0.00 55.36 56.79 2eke s GLN 1076Cb 0.18 -2.16 -0.04 0.00 1.00 0.00 0.00 33.01 32.00 2eke s GLN 1076CO 0.62 -0.15 0.07 0.95 -2.12 0.00 0.00 175.29 174.66 2eke s THR 1077N -2.18 3.82 0.30 -0.19 -4.23 -1.26 -0.63 115.64 111.27 2eke s THR 1077Ca 0.63 -1.72 0.04 0.00 -1.18 0.00 0.00 61.69 59.45 2eke s THR 1077Cb -0.11 -3.05 0.29 0.00 1.34 0.00 0.00 72.50 70.98 2eke s THR 1077CO 0.16 -0.36 1.82 -0.65 -0.54 0.00 0.00 174.62 175.05 2eke h PRO 1078N 1.75 0.87 -0.81 3.99 0.11 -1.70 -0.55 132.00 135.66 2eke h PRO 1078Ca -0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2eke h PRO 1078Cb 1.25 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 2eke h PRO 1078CO 0.60 0.57 0.42 1.49 -0.21 0.00 0.00 178.00 180.88 2eke h GLU 1079N 0.89 1.14 -0.04 1.05 4.81 -1.49 -0.41 114.58 120.53 2eke h GLU 1079Ca 0.51 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.56 2eke h GLU 1079Cb 0.63 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2eke h GLU 1079CO -0.29 0.86 -0.17 -0.44 -0.73 0.00 0.00 179.01 178.24 2eke h ASP 1080N 1.13 0.06 -0.61 1.04 3.32 -1.37 -2.55 116.42 117.44 2eke h ASP 1080Ca 0.28 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2eke h ASP 1080Cb 0.07 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2eke h ASP 1080CO -0.04 0.24 0.00 0.18 -1.72 0.00 0.00 179.24 177.90 2eke n LEU 1081N -4.30 3.67 -3.65 1.55 4.77 -0.87 -4.95 117.00 113.22 2eke n LEU 1081Ca -0.02 -1.77 -0.27 0.00 -0.03 0.00 0.00 56.01 53.92 2eke n LEU 1081Cb 0.25 -0.41 0.03 0.00 -2.33 0.00 0.00 43.42 40.97 2eke n LEU 1081CO 0.37 0.88 0.09 0.47 -1.33 0.00 0.00 177.39 177.87 2eke n ASP 1082N 1.54 -5.08 -4.80 -1.43 8.00 -0.62 -4.95 116.55 109.21 2eke n ASP 1082Ca 0.22 -0.61 -0.33 0.00 0.71 0.00 0.00 54.79 54.79 2eke n ASP 1082Cb 0.60 -4.07 0.00 0.00 -0.02 0.00 0.00 41.12 37.63 2eke n ASP 1082CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2eke s MET 1083N -6.34 3.40 0.24 -1.24 -1.94 -0.26 -5.03 119.30 108.12 2eke s MET 1083Ca 0.56 1.23 0.06 0.00 -1.71 0.00 0.00 55.69 55.84 2eke s MET 1083Cb -0.27 -2.04 -0.05 0.00 2.01 0.00 0.00 34.83 34.47 2eke s MET 1083CO 0.69 -0.75 -0.08 -1.21 -0.01 0.00 0.00 175.02 173.66 2eke s GLU 1084N -3.92 1.40 0.13 2.03 2.02 -1.26 -4.83 118.70 114.27 2eke s GLU 1084Ca 0.64 -1.67 -0.35 0.00 0.02 0.00 0.00 54.97 53.61 2eke s GLU 1084Cb -0.16 -1.01 -0.15 0.00 0.10 0.00 0.00 34.13 32.91 2eke s GLU 1084CO 0.34 0.07 1.45 -3.47 0.02 0.00 0.00 175.26 173.66 2eke n ASP 1085N -0.46 2.34 -0.02 -0.19 2.03 -1.26 -1.49 116.55 117.51 2eke n ASP 1085Ca -0.07 1.10 -0.00 0.00 0.52 0.00 0.00 54.79 56.35 2eke n ASP 1085Cb 0.62 -1.31 -0.00 0.00 -0.72 0.00 0.00 41.12 39.71 2eke n ASP 1085CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2eke n ASN 1086N 2.91 -3.72 -4.59 1.67 3.02 0.31 -4.91 115.26 109.95 2eke n ASN 1086Ca 0.17 0.01 -0.29 0.00 -0.03 0.00 0.00 54.58 54.44 2eke n ASN 1086Cb 0.24 -1.24 0.21 0.00 -0.61 0.00 0.00 39.78 38.38 2eke n ASN 1086CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2eke s ASP 1087N -2.05 1.95 -0.04 6.41 1.01 -0.55 -4.60 116.67 118.79 2eke s ASP 1087Ca 0.00 1.48 0.05 0.00 0.71 0.00 0.00 52.55 54.79 2eke s ASP 1087Cb 0.00 -2.18 -0.02 0.00 1.01 0.00 0.00 42.92 41.72 2eke s ASP 1087CO 0.00 -3.59 -0.18 -0.63 0.21 0.00 0.00 175.17 170.98 2eke s ILE 1088N -2.69 2.78 -0.13 0.77 1.01 -1.26 -1.40 121.20 120.28 2eke s ILE 1088Ca 0.67 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 60.51 2eke s ILE 1088Cb -0.22 -2.06 0.01 0.00 0.01 0.00 0.00 42.46 40.20 2eke s ILE 1088CO 0.61 0.59 -0.21 -0.63 0.00 0.00 0.00 174.94 175.30 2eke s ILE 1089N -0.69 1.96 -0.17 2.92 1.01 -0.07 -4.54 121.20 121.62 2eke s ILE 1089Ca 0.11 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.75 2eke s ILE 1089Cb -0.10 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 2eke s ILE 1089CO 0.00 0.53 0.11 -1.61 0.00 0.00 0.00 174.94 173.97 2eke s GLU 1090N 0.79 3.91 -0.24 2.79 2.02 -0.18 -1.51 118.70 126.29 2eke s GLU 1090Ca -0.08 -0.23 -0.08 0.00 0.02 0.00 0.00 54.97 54.59 2eke s GLU 1090Cb -0.16 -3.29 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2eke s GLU 1090CO -0.01 0.43 0.10 0.00 0.02 0.00 0.00 175.26 175.80 2eke s ALA 1091N -0.02 3.34 0.08 5.21 0.00 0.37 -0.37 121.76 130.38 2eke s ALA 1091Ca 0.09 -1.00 0.08 0.00 0.00 0.00 0.00 51.96 51.12 2eke s ALA 1091Cb -0.12 -2.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.83 2eke s ALA 1091CO 0.00 -0.30 -0.20 -1.01 0.00 0.00 0.00 175.76 174.25 2eke s HIS 1092N 1.28 1.74 0.51 0.00 3.76 -0.19 -4.36 115.29 118.03 2eke s HIS 1092Ca 0.06 -0.41 -0.23 0.00 -0.15 0.00 0.00 55.06 54.33 2eke s HIS 1092Cb -0.14 -0.98 -0.06 0.00 1.11 0.00 0.00 32.58 32.51 2eke s HIS 1092CO 0.05 0.16 1.40 1.03 -0.85 0.00 0.00 174.74 176.53 2eke s ARG 1093N -1.68 3.33 -0.10 1.40 1.81 -1.26 -0.78 118.95 121.67 2eke s ARG 1093Ca 0.06 2.34 -0.26 0.00 -1.72 0.00 0.00 55.73 56.16 2eke s ARG 1093Cb -0.10 -2.41 -0.02 0.00 -0.45 0.00 0.00 34.95 31.97 2eke s ARG 1093CO 0.03 -1.08 0.82 -2.00 -0.68 0.00 0.00 175.30 172.40 2eke s GLU 1094N -2.74 4.40 0.00 3.54 2.12 -0.67 -4.68 118.70 120.67 2eke s GLU 1094Ca 0.68 1.05 0.00 0.00 0.36 0.00 0.00 54.97 57.06 2eke s GLU 1094Cb -0.43 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.46 2eke s GLU 1094CO 0.52 -0.14 0.33 0.00 -0.54 0.00 0.00 175.26 175.43