#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1d n PRO 1011N 0.00 0.11 -3.65 0.00 -0.04 -1.26 -4.71 135.00 125.45 1y1d n PRO 1011Ca 0.00 0.13 -0.20 0.00 -0.04 0.00 0.00 63.50 63.40 1y1d n PRO 1011Cb 0.00 -1.64 -0.17 0.00 -0.04 0.00 0.00 33.50 31.65 1y1d n PRO 1011CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1y1d s LEU 1012N -3.67 0.09 0.04 1.53 2.96 -1.26 -0.38 118.68 117.99 1y1d s LEU 1012Ca 0.11 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.13 1y1d s LEU 1012Cb 0.15 0.00 -0.02 0.00 0.50 0.00 0.00 46.19 46.82 1y1d s LEU 1012CO 0.52 -0.27 -0.16 -0.32 -1.32 0.00 0.00 176.35 174.80 1y1d s MET 1013N 2.21 1.06 -0.07 1.98 -2.45 -0.36 -4.43 119.30 117.24 1y1d s MET 1013Ca 0.04 -0.83 0.04 0.00 -1.25 0.00 0.00 55.69 53.69 1y1d s MET 1013Cb -0.13 -1.11 0.00 0.00 1.25 0.00 0.00 34.83 34.84 1y1d s MET 1013CO -0.05 0.28 -0.20 0.08 1.05 0.00 0.00 175.02 176.17 1y1d s VAL 1014N -0.86 1.73 -0.06 10.11 1.01 -1.00 -1.00 120.40 130.33 1y1d s VAL 1014Ca 0.03 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1y1d s VAL 1014Cb -0.08 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 1y1d s VAL 1014CO 0.02 0.49 -0.19 -0.75 0.00 0.00 0.00 175.10 174.67 1y1d s LYS 1015N 0.25 2.06 -0.05 2.72 2.47 0.04 -0.39 119.74 126.85 1y1d s LYS 1015Ca -0.12 -0.67 0.02 0.00 -1.56 0.00 0.00 55.97 53.65 1y1d s LYS 1015Cb -0.15 -1.73 0.01 0.00 -1.46 0.00 0.00 37.83 34.50 1y1d s LYS 1015CO 0.05 0.23 -0.09 0.08 0.16 0.00 0.00 175.35 175.78 1y1d s VAL 1016N 0.13 0.86 0.11 4.02 1.01 -0.03 -0.87 120.40 125.62 1y1d s VAL 1016Ca -0.07 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.66 1y1d s VAL 1016Cb -0.13 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1y1d s VAL 1016CO 0.04 0.28 -0.24 -0.76 0.00 0.00 0.00 175.10 174.42 1y1d s LEU 1017N 0.57 2.30 -0.32 3.92 1.43 -0.13 -1.41 118.68 125.05 1y1d s LEU 1017Ca -0.10 -0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 52.21 1y1d s LEU 1017Cb -0.13 -1.03 0.01 0.00 0.03 0.00 0.00 46.19 45.06 1y1d s LEU 1017CO 0.02 0.12 0.12 -0.62 0.23 0.00 0.00 176.35 176.22 1y1d s ASP 1018N -1.93 5.37 0.00 2.29 -1.08 0.53 -1.03 116.67 120.81 1y1d s ASP 1018Ca 0.10 -0.73 0.29 0.00 -0.52 0.00 0.00 52.55 51.69 1y1d s ASP 1018Cb -0.10 -1.94 1.21 0.00 -1.46 0.00 0.00 42.92 40.63 1y1d s ASP 1018CO 0.05 -0.23 1.88 0.00 0.52 0.00 0.00 175.17 177.39 1y1d n ALA 1019N 4.92 2.61 0.03 3.66 0.00 -0.23 -1.56 120.51 129.94 1y1d n ALA 1019Ca -0.14 -0.17 -0.22 0.00 0.00 0.00 0.00 53.44 52.91 1y1d n ALA 1019Cb 0.48 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.38 1y1d n ALA 1019CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1y1d h VAL 1020N 0.10 0.93 0.00 0.00 2.07 -1.95 -3.39 116.25 114.01 1y1d h VAL 1020Ca 0.00 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.09 1y1d h VAL 1020Cb 0.42 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 1y1d h VAL 1020CO 0.00 0.79 -1.38 0.54 0.02 0.00 0.00 177.57 177.54 1y1d n ARG 1021N -3.73 0.62 -2.81 1.57 1.74 -1.24 -5.00 116.66 107.81 1y1d n ARG 1021Ca -0.26 -0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.72 1y1d n ARG 1021Cb 0.99 -1.71 0.05 0.00 -1.02 0.00 0.00 32.46 30.78 1y1d n ARG 1021CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y1d n GLY 1022N 1.21 -0.12 3.40 -0.13 0.00 -0.60 -5.05 105.19 103.91 1y1d n GLY 1022Ca -0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1y1d n GLY 1022CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y1d s SER 1023N -3.71 -0.11 0.66 1.61 1.04 -1.12 -5.02 113.70 107.05 1y1d s SER 1023Ca 0.06 -0.62 -0.18 0.00 0.48 0.00 0.00 55.95 55.69 1y1d s SER 1023Cb -0.01 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 1y1d s SER 1023CO 0.45 -0.94 1.29 -2.16 0.98 0.00 0.00 173.24 172.85 1y1d s PRO 1024N -3.90 2.46 -0.45 4.02 0.04 -1.26 -0.35 135.00 135.56 1y1d s PRO 1024Ca 0.11 2.05 -0.19 0.00 0.04 0.00 0.00 61.00 63.01 1y1d s PRO 1024Cb 0.01 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.75 1y1d s PRO 1024CO -0.04 -1.66 0.54 0.00 0.04 0.00 0.00 177.00 175.88 1y1d s ALA 1025N -1.45 3.40 0.05 8.56 0.00 -0.50 -4.56 121.76 127.26 1y1d s ALA 1025Ca 0.82 -1.51 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 1y1d s ALA 1025Cb -0.37 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 1y1d s ALA 1025CO 0.41 -1.75 0.27 0.42 0.00 0.00 0.00 175.76 175.11 1y1d s ILE 1026N 2.42 5.30 -1.40 0.00 1.01 -1.26 -4.38 121.20 122.88 1y1d s ILE 1026Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.76 1y1d s ILE 1026Cb -0.17 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.71 1y1d s ILE 1026CO 0.14 0.23 0.32 -3.20 0.00 0.00 0.00 174.94 172.43 1y1d n ASN 1027N 0.65 -5.36 -4.68 3.58 5.15 -0.63 -4.95 115.26 109.03 1y1d n ASN 1027Ca -0.08 -0.16 -0.40 0.00 -0.60 0.00 0.00 54.58 53.35 1y1d n ASN 1027Cb 0.52 -4.29 -0.05 0.00 -0.53 0.00 0.00 39.78 35.42 1y1d n ASN 1027CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1y1d s VAL 1028N -3.01 5.03 0.27 3.44 1.01 -1.26 -4.77 120.40 121.11 1y1d s VAL 1028Ca 0.16 1.24 -0.30 0.00 0.00 0.00 0.00 61.98 63.09 1y1d s VAL 1028Cb -0.07 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 32.25 1y1d s VAL 1028CO 0.20 0.15 1.07 0.00 0.00 0.00 0.00 175.10 176.52 1y1d s ALA 1029N 1.59 3.39 -0.04 5.51 0.00 -1.26 -1.37 121.76 129.58 1y1d s ALA 1029Ca 0.31 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1y1d s ALA 1029Cb -0.16 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 19.67 1y1d s ALA 1029CO 0.12 -0.10 -0.02 0.08 0.00 0.00 0.00 175.76 175.84 1y1d s VAL 1030N -1.11 0.38 -0.07 0.00 1.01 -0.04 -0.89 120.40 119.67 1y1d s VAL 1030Ca 0.44 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.47 1y1d s VAL 1030Cb -0.31 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.61 1y1d s VAL 1030CO 0.39 0.20 -0.25 -1.00 0.00 0.00 0.00 175.10 174.44 1y1d s HIS 1031N 1.11 2.47 -0.07 5.22 3.76 -0.31 -1.45 115.29 126.02 1y1d s HIS 1031Ca -0.08 -0.78 0.02 0.00 -0.15 0.00 0.00 55.06 54.07 1y1d s HIS 1031Cb -0.14 -1.62 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 1y1d s HIS 1031CO -0.01 -0.25 -0.13 0.08 -0.85 0.00 0.00 174.74 173.58 1y1d s VAL 1032N -0.07 3.20 0.15 -0.90 1.01 0.12 -0.36 120.40 123.55 1y1d s VAL 1032Ca -0.07 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1y1d s VAL 1032Cb -0.15 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1y1d s VAL 1032CO 0.05 0.58 -0.15 -0.36 0.00 0.00 0.00 175.10 175.22 1y1d s PHE 1033N -0.58 1.55 -0.04 5.22 0.40 0.32 -0.83 117.98 124.02 1y1d s PHE 1033Ca 0.08 -0.55 0.05 0.00 -0.60 0.00 0.00 56.93 55.91 1y1d s PHE 1033Cb -0.11 -0.78 -0.00 0.00 0.51 0.00 0.00 43.02 42.63 1y1d s PHE 1033CO 0.01 0.22 -0.18 0.50 0.70 0.00 0.00 175.22 176.47 1y1d s ARG 1034N -2.92 1.88 0.01 0.44 3.52 0.17 -0.62 118.95 121.43 1y1d s ARG 1034Ca 0.13 -0.65 -0.30 0.00 -0.13 0.00 0.00 55.73 54.78 1y1d s ARG 1034Cb -0.04 -1.64 -0.06 0.00 -1.56 0.00 0.00 34.95 31.65 1y1d s ARG 1034CO 0.04 0.27 1.53 0.21 -0.81 0.00 0.00 175.30 176.54 1y1d s LYS 1035N -0.01 4.23 0.68 5.12 2.47 -0.01 -0.97 119.74 131.26 1y1d s LYS 1035Ca -0.03 2.12 -0.09 0.00 -1.56 0.00 0.00 55.97 56.41 1y1d s LYS 1035Cb -0.12 -3.67 0.03 0.00 -1.46 0.00 0.00 37.83 32.62 1y1d s LYS 1035CO 0.02 -0.68 1.03 0.00 0.16 0.00 0.00 175.35 175.88 1y1d s ALA 1036N 2.83 3.05 0.57 3.13 0.00 0.57 -4.72 121.76 127.17 1y1d s ALA 1036Ca 0.69 -0.63 0.28 0.00 0.00 0.00 0.00 51.96 52.30 1y1d s ALA 1036Cb -0.34 -2.79 1.48 0.00 0.00 0.00 0.00 23.12 21.47 1y1d s ALA 1036CO 0.28 -1.14 1.95 0.00 0.00 0.00 0.00 175.76 176.86 1y1d h ALA 1037N -0.54 2.31 -0.06 0.00 0.00 -1.95 0.29 119.26 119.31 1y1d h ALA 1037Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1y1d h ALA 1037Cb 1.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1y1d h ALA 1037CO 0.62 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.78 1y1d n ASP 1038N -3.99 1.72 0.00 0.00 5.68 -1.26 -4.94 116.55 113.76 1y1d n ASP 1038Ca 0.09 -1.60 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 1y1d n ASP 1038Cb 0.64 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1y1d n ASP 1038CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1y1d n ASP 1039N 0.35 -1.99 -4.95 -1.12 8.00 0.10 -5.06 116.55 111.88 1y1d n ASP 1039Ca 0.18 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.44 1y1d n ASP 1039Cb 0.38 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 1y1d n ASP 1039CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1y1d s THR 1040N -2.09 5.15 -0.45 -3.53 -4.23 -1.26 -4.80 115.64 104.43 1y1d s THR 1040Ca 0.00 -0.57 -0.24 0.00 -1.18 0.00 0.00 61.69 59.69 1y1d s THR 1040Cb 0.00 -3.85 0.02 0.00 1.34 0.00 0.00 72.50 70.02 1y1d s THR 1040CO 0.00 -0.46 0.86 0.26 -0.54 0.00 0.00 174.62 174.74 1y1d s TRP 1041N -2.18 2.97 -0.08 3.99 0.52 -1.26 -0.32 118.94 122.57 1y1d s TRP 1041Ca 0.38 0.33 -0.15 0.00 0.02 0.00 0.00 56.10 56.68 1y1d s TRP 1041Cb -0.10 -3.79 -0.05 0.00 -1.15 0.00 0.00 33.47 28.38 1y1d s TRP 1041CO 0.33 -1.02 0.39 -2.00 0.02 0.00 0.00 176.95 174.68 1y1d s GLU 1042N 3.51 4.12 0.29 4.98 2.12 -0.14 -4.88 118.70 128.70 1y1d s GLU 1042Ca 0.34 0.32 -0.30 0.00 0.36 0.00 0.00 54.97 55.69 1y1d s GLU 1042Cb -0.11 -3.34 -0.13 0.00 0.26 0.00 0.00 34.13 30.81 1y1d s GLU 1042CO 0.24 0.42 1.34 -2.30 -0.54 0.00 0.00 175.26 174.41 1y1d n PRO 1043N 2.84 2.06 0.00 4.30 -0.02 -1.26 -0.66 135.00 142.26 1y1d n PRO 1043Ca -0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1y1d n PRO 1043Cb 0.52 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1y1d n PRO 1043CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1y1d n PHE 1044N 1.12 0.00 -3.55 6.00 7.35 -0.01 -4.75 117.46 123.62 1y1d n PHE 1044Ca 0.08 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.70 1y1d n PHE 1044Cb 0.34 0.04 -0.02 0.00 0.35 0.00 0.00 39.48 40.19 1y1d n PHE 1044CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1y1d s ALA 1045N -1.83 -1.79 0.22 3.13 0.00 -1.04 -5.00 121.76 115.45 1y1d s ALA 1045Ca 0.00 0.83 -0.17 0.00 0.00 0.00 0.00 51.96 52.62 1y1d s ALA 1045Cb 0.00 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.61 1y1d s ALA 1045CO 0.00 -0.76 0.53 -1.54 0.00 0.00 0.00 175.76 173.99 1y1d s SER 1046N -2.58 -0.22 0.00 0.00 1.04 -1.26 0.14 113.70 110.82 1y1d s SER 1046Ca 0.06 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1y1d s SER 1046Cb -0.01 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1y1d s SER 1046CO -0.07 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.66 1y1d n GLY 1047N -0.36 0.47 3.06 7.32 0.00 -0.53 -4.96 105.19 110.19 1y1d n GLY 1047Ca -0.07 -0.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 1y1d n GLY 1047CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y1d s LYS 1048N -1.92 0.58 0.56 1.61 1.02 -1.26 -0.86 119.74 119.46 1y1d s LYS 1048Ca 0.00 -0.66 -0.19 0.00 0.02 0.00 0.00 55.97 55.14 1y1d s LYS 1048Cb 0.00 -0.45 -0.05 0.00 -0.52 0.00 0.00 37.83 36.81 1y1d s LYS 1048CO 0.00 0.10 1.12 0.95 -0.92 0.00 0.00 175.35 176.60 1y1d s THR 1049N -1.05 3.20 0.49 2.17 -4.23 -0.47 -4.74 115.64 111.01 1y1d s THR 1049Ca -0.05 0.72 -0.05 0.00 -1.18 0.00 0.00 61.69 61.12 1y1d s THR 1049Cb -0.08 -3.27 0.11 0.00 1.34 0.00 0.00 72.50 70.60 1y1d s THR 1049CO 0.01 -0.19 0.67 -1.54 -0.54 0.00 0.00 174.62 173.03 1y1d n SER 1050N -1.46 0.37 0.31 3.99 3.41 -0.37 -1.60 113.62 118.28 1y1d n SER 1050Ca 0.11 -1.44 0.21 0.00 -0.26 0.00 0.00 58.87 57.49 1y1d n SER 1050Cb 0.51 -0.48 1.09 0.00 -0.26 0.00 0.00 64.21 65.06 1y1d n SER 1050CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1y1d h GLU 1051N 0.00 0.00 -0.02 4.33 9.09 -1.94 0.26 114.58 126.31 1y1d h GLU 1051Ca -0.22 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.19 1y1d h GLU 1051Cb 0.68 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.78 1y1d h GLU 1051CO 0.19 0.00 -0.05 -1.13 0.05 0.00 0.00 179.01 178.06 1y1d n SER 1052N -2.99 1.61 0.00 3.06 3.41 -1.26 -4.81 113.62 112.64 1y1d n SER 1052Ca -0.02 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.12 1y1d n SER 1052Cb 0.10 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1y1d n SER 1052CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y1d n GLY 1053N 1.23 0.56 3.76 5.00 0.00 0.08 -4.79 105.19 111.03 1y1d n GLY 1053Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1y1d n GLY 1053CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y1d s GLU 1054N -0.02 2.86 -0.20 1.61 2.02 -1.26 -0.85 118.70 122.87 1y1d s GLU 1054Ca 0.00 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.33 1y1d s GLU 1054Cb 0.00 -2.72 0.05 0.00 0.10 0.00 0.00 34.13 31.56 1y1d s GLU 1054CO 0.00 0.58 -0.07 -1.17 0.02 0.00 0.00 175.26 174.63 1y1d s LEU 1055N -2.20 2.11 0.32 1.80 2.96 0.48 -1.24 118.68 122.91 1y1d s LEU 1055Ca 0.27 -0.90 0.09 0.00 -0.22 0.00 0.00 54.13 53.36 1y1d s LEU 1055Cb -0.12 -1.09 -0.04 0.00 0.50 0.00 0.00 46.19 45.44 1y1d s LEU 1055CO 0.19 -0.19 0.08 -1.00 -1.32 0.00 0.00 176.35 174.11 1y1d s HIS 1056N 1.49 2.68 -0.11 5.38 3.76 -1.26 -2.39 115.29 124.84 1y1d s HIS 1056Ca -0.02 -0.35 0.00 0.00 -0.15 0.00 0.00 55.06 54.54 1y1d s HIS 1056Cb -0.17 -1.50 0.00 0.00 1.11 0.00 0.00 32.58 32.02 1y1d s HIS 1056CO -0.07 0.44 0.00 0.41 -0.85 0.00 0.00 174.74 174.66 1y1d n GLY 1057N -1.05 0.48 0.32 -2.22 0.00 -1.26 -4.93 105.19 96.53 1y1d n GLY 1057Ca -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.23 1y1d n GLY 1057CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1y1d h LEU 1058N 0.00 0.78 0.00 0.99 3.38 -1.87 -3.47 115.31 115.13 1y1d h LEU 1058Ca -0.02 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 1y1d h LEU 1058Cb 0.09 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1y1d h LEU 1058CO 0.03 0.67 0.04 1.07 0.09 0.00 0.00 178.44 180.34 1y1d n THR 1059N -4.35 0.00 -4.43 0.22 5.66 -1.26 -4.80 114.28 105.32 1y1d n THR 1059Ca 0.06 -1.35 -0.21 0.00 -3.05 0.00 0.00 64.05 59.49 1y1d n THR 1059Cb 0.13 0.99 -0.10 0.00 -1.55 0.00 0.00 70.33 69.80 1y1d n THR 1059CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1y1d s THR 1060N -2.51 1.73 0.35 1.09 -4.23 -1.26 -4.62 115.64 106.19 1y1d s THR 1060Ca 0.22 -2.15 0.04 0.00 -1.18 0.00 0.00 61.69 58.62 1y1d s THR 1060Cb -0.03 -2.42 0.28 0.00 1.34 0.00 0.00 72.50 71.67 1y1d s THR 1060CO 0.16 -0.32 1.97 -0.08 -0.54 0.00 0.00 174.62 175.81 1y1d h GLU 1061N 2.28 0.78 -0.31 3.99 4.81 -1.99 -1.23 114.58 122.91 1y1d h GLU 1061Ca -0.40 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.76 1y1d h GLU 1061Cb 1.23 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1y1d h GLU 1061CO 0.67 0.52 0.10 1.49 -0.73 0.00 0.00 179.01 181.05 1y1d h GLU 1062N 0.80 0.48 0.00 1.92 4.81 -2.04 -3.19 114.58 117.38 1y1d h GLU 1062Ca 0.29 -0.10 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 1y1d h GLU 1062Cb 0.14 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1y1d h GLU 1062CO -0.09 0.53 -0.61 0.93 -0.73 0.00 0.00 179.01 179.04 1y1d h GLU 1063N 0.35 0.00 -4.08 1.92 5.08 -1.90 -3.39 114.58 112.56 1y1d h GLU 1063Ca 0.10 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.73 1y1d h GLU 1063Cb 0.25 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.38 1y1d h GLU 1063CO -0.00 0.61 2.23 0.34 -1.00 0.00 0.00 179.01 181.18 1y1d n PHE 1064N -3.33 3.61 -2.10 4.33 7.35 -0.49 -4.96 117.46 121.87 1y1d n PHE 1064Ca 0.01 -2.94 -0.28 0.00 -0.76 0.00 0.00 57.45 53.48 1y1d n PHE 1064Cb 0.74 -2.22 0.18 0.00 0.35 0.00 0.00 39.48 38.53 1y1d n PHE 1064CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1y1d s VAL 1065N 1.70 2.01 0.49 -2.13 -7.23 -1.26 -4.94 120.40 109.05 1y1d s VAL 1065Ca 0.43 -0.15 -0.24 0.00 -1.81 0.00 0.00 61.98 60.22 1y1d s VAL 1065Cb 0.08 -2.87 -0.07 0.00 0.56 0.00 0.00 36.38 34.09 1y1d s VAL 1065CO -0.01 0.00 1.36 1.21 -0.31 0.00 0.00 175.10 177.35 1y1d n GLU 1066N -3.59 1.92 -3.66 4.82 0.00 -1.26 -4.80 120.64 114.07 1y1d n GLU 1066Ca 0.16 0.69 0.00 0.00 0.00 0.00 0.00 57.16 58.01 1y1d n GLU 1066Cb 0.60 -2.56 0.00 0.00 0.00 0.00 0.00 31.44 29.48 1y1d n GLU 1066CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1y1d n GLY 1067N 0.71 -2.23 3.67 8.31 0.00 -1.09 -5.01 105.19 109.56 1y1d n GLY 1067Ca 0.08 -1.21 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 1y1d n GLY 1067CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1d s ILE 1068N -2.08 5.35 0.11 -0.61 1.01 -1.26 -1.17 121.20 122.55 1y1d s ILE 1068Ca 0.00 0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.96 1y1d s ILE 1068Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 1y1d s ILE 1068CO 0.00 0.35 -0.17 -0.31 0.00 0.00 0.00 174.94 174.81 1y1d s TYR 1069N 1.00 2.56 -0.11 3.97 1.51 -0.11 -0.83 117.35 125.34 1y1d s TYR 1069Ca 0.09 -0.25 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1y1d s TYR 1069Cb -0.13 -1.37 0.01 0.00 -0.11 0.00 0.00 41.96 40.36 1y1d s TYR 1069CO 0.04 0.38 -0.17 0.21 -1.11 0.00 0.00 175.55 174.90 1y1d s LYS 1070N -2.06 2.38 -0.32 -0.62 2.20 0.21 -1.52 119.74 120.02 1y1d s LYS 1070Ca 0.18 -0.63 -0.08 0.00 -0.36 0.00 0.00 55.97 55.08 1y1d s LYS 1070Cb -0.11 -1.98 0.02 0.00 -1.51 0.00 0.00 37.83 34.25 1y1d s LYS 1070CO 0.10 -0.03 0.12 0.08 -0.36 0.00 0.00 175.35 175.26 1y1d s VAL 1071N 0.88 4.15 -0.24 4.02 1.01 0.16 -0.52 120.40 129.86 1y1d s VAL 1071Ca -0.08 -0.76 -0.07 0.00 0.00 0.00 0.00 61.98 61.06 1y1d s VAL 1071Cb -0.15 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 1y1d s VAL 1071CO -0.00 -0.03 0.07 -0.70 0.00 0.00 0.00 175.10 174.43 1y1d s GLU 1072N 1.51 3.67 -0.21 2.72 2.12 0.51 -0.74 118.70 128.27 1y1d s GLU 1072Ca 0.02 -0.47 -0.06 0.00 0.36 0.00 0.00 54.97 54.81 1y1d s GLU 1072Cb -0.18 -3.30 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 1y1d s GLU 1072CO 0.04 -0.15 0.04 0.42 -0.54 0.00 0.00 175.26 175.07 1y1d s ILE 1073N 1.52 4.28 -1.32 -3.70 1.01 0.99 -1.17 121.20 122.81 1y1d s ILE 1073Ca 0.06 -0.20 -0.13 0.00 0.00 0.00 0.00 60.65 60.38 1y1d s ILE 1073Cb -0.15 -2.96 0.11 0.00 0.01 0.00 0.00 42.46 39.48 1y1d s ILE 1073CO 0.03 0.40 1.87 0.47 0.00 0.00 0.00 174.94 177.72 1y1d n ASP 1074N 4.33 4.73 0.10 3.58 8.00 -0.07 -1.30 116.55 135.92 1y1d n ASP 1074Ca -0.17 -2.97 -0.04 0.00 0.71 0.00 0.00 54.79 52.32 1y1d n ASP 1074Cb 0.52 -1.60 0.16 0.00 -0.02 0.00 0.00 41.12 40.18 1y1d n ASP 1074CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1y1d h THR 1075N 4.30 1.38 -0.27 -3.53 1.35 -1.87 -3.13 112.91 111.14 1y1d h THR 1075Ca 0.44 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 1y1d h THR 1075Cb 0.72 1.96 -0.01 0.00 -1.73 0.00 0.00 68.15 69.09 1y1d h THR 1075CO 1.60 0.56 0.17 0.50 -0.25 0.00 0.00 175.52 178.10 1y1d h LYS 1076N 0.14 0.37 -0.81 4.72 3.64 -1.72 -1.78 116.57 121.12 1y1d h LYS 1076Ca -0.00 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1y1d h LYS 1076Cb 1.04 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.74 1y1d h LYS 1076CO 0.08 0.26 0.44 0.77 -2.27 0.00 0.00 179.45 178.74 1y1d h SER 1077N 0.36 1.02 -0.05 4.20 0.02 -1.84 -1.06 113.55 116.19 1y1d h SER 1077Ca 0.10 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1y1d h SER 1077Cb -0.01 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.21 1y1d h SER 1077CO -0.02 0.83 -0.29 0.22 -1.14 0.00 0.00 176.83 176.43 1y1d h TYR 1078N 1.13 -0.80 -0.32 3.45 3.20 -1.39 -2.95 116.97 119.29 1y1d h TYR 1078Ca 0.29 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 62.06 1y1d h TYR 1078Cb 0.04 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 1y1d h TYR 1078CO 0.00 -0.38 -0.33 -1.49 -1.64 0.00 0.00 178.16 174.33 1y1d h TRP 1079N -0.41 0.83 -0.66 -3.82 -0.00 -1.03 -3.11 115.95 107.75 1y1d h TRP 1079Ca 0.08 -0.22 -0.04 0.00 -0.00 0.00 0.00 58.89 58.71 1y1d h TRP 1079Cb 0.52 -0.19 -0.03 0.00 -0.00 0.00 0.00 29.16 29.47 1y1d h TRP 1079CO -0.35 0.94 0.27 0.87 -0.00 0.00 0.00 178.44 180.17 1y1d h LYS 1080N 0.60 0.96 0.00 0.49 1.57 -1.02 -0.95 116.57 118.22 1y1d h LYS 1080Ca 0.07 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1y1d h LYS 1080Cb 0.84 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1y1d h LYS 1080CO 0.07 0.78 0.00 0.00 -0.57 0.00 0.00 179.45 179.73 1y1d h ALA 1081N 1.35 1.00 -0.07 3.86 0.00 -1.45 -1.36 119.26 122.59 1y1d h ALA 1081Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1y1d h ALA 1081Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1y1d h ALA 1081CO -0.02 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.51 1y1d n LEU 1082N -2.92 1.91 0.00 0.00 4.32 -0.45 -4.94 117.00 114.93 1y1d n LEU 1082Ca -0.00 -0.69 0.00 0.00 -0.02 0.00 0.00 56.01 55.30 1y1d n LEU 1082Cb 0.22 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1y1d n LEU 1082CO 0.23 0.34 0.00 0.61 -1.22 0.00 0.00 177.39 177.36 1y1d n GLY 1083N 1.22 0.66 3.45 -0.72 0.00 -0.51 -5.06 105.19 104.22 1y1d n GLY 1083Ca 0.18 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1y1d n GLY 1083CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1d s ILE 1084N -2.00 3.31 -0.52 -0.61 1.01 -0.66 -5.01 121.20 116.72 1y1d s ILE 1084Ca 0.00 -0.59 -0.18 0.00 0.00 0.00 0.00 60.65 59.88 1y1d s ILE 1084Cb 0.00 -2.38 0.08 0.00 0.01 0.00 0.00 42.46 40.17 1y1d s ILE 1084CO 0.00 0.54 0.56 -0.44 0.00 0.00 0.00 174.94 175.60 1y1d s SER 1085N -0.03 6.19 0.68 3.58 0.01 -1.26 -2.77 113.70 120.09 1y1d s SER 1085Ca -0.02 -1.26 -0.05 0.00 1.31 0.00 0.00 55.95 55.94 1y1d s SER 1085Cb -0.14 -2.25 0.06 0.00 0.21 0.00 0.00 66.02 63.90 1y1d s SER 1085CO 0.04 -0.87 0.97 -2.16 0.41 0.00 0.00 173.24 171.63 1y1d s PRO 1086N 2.23 2.20 -0.11 12.44 0.04 -1.26 -5.02 135.00 145.53 1y1d s PRO 1086Ca 0.10 -0.41 -0.27 0.00 0.04 0.00 0.00 61.00 60.45 1y1d s PRO 1086Cb -0.23 -2.24 -0.25 0.00 0.04 0.00 0.00 34.50 31.82 1y1d s PRO 1086CO 0.08 -1.17 0.88 0.35 0.04 0.00 0.00 177.00 177.18 1y1d h PHE 1087N -0.48 0.09 -3.70 0.56 3.57 -1.58 -3.47 116.94 111.93 1y1d h PHE 1087Ca -0.44 -0.06 -0.50 0.00 3.53 0.00 0.00 57.97 60.51 1y1d h PHE 1087Cb 1.31 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 1y1d h PHE 1087CO 0.28 0.96 0.08 -1.01 -2.23 0.00 0.00 178.31 176.39 1y1d s HIS 1088N -2.61 3.39 0.09 0.41 3.76 -1.26 -4.99 115.29 114.09 1y1d s HIS 1088Ca -0.18 1.20 -0.14 0.00 -0.15 0.00 0.00 55.06 55.80 1y1d s HIS 1088Cb -0.02 -2.52 -0.14 0.00 1.11 0.00 0.00 32.58 31.01 1y1d s HIS 1088CO 0.71 0.12 1.32 0.93 -0.85 0.00 0.00 174.74 176.97 1y1d h GLU 1089N 2.34 0.75 -2.70 1.40 4.39 -1.98 -3.37 114.58 115.41 1y1d h GLU 1089Ca -0.48 -0.56 0.10 0.00 0.34 0.00 0.00 59.36 58.75 1y1d h GLU 1089Cb 1.18 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 1y1d h GLU 1089CO 0.66 1.18 0.42 -3.38 -1.16 0.00 0.00 179.01 176.73 1y1d s HIS 1090N -3.86 0.02 -0.14 4.33 -3.43 -1.26 -3.24 115.29 107.71 1y1d s HIS 1090Ca -0.11 -0.50 -0.01 0.00 -0.80 0.00 0.00 55.06 53.64 1y1d s HIS 1090Cb 0.08 0.74 -0.02 0.00 -1.43 0.00 0.00 32.58 31.95 1y1d s HIS 1090CO 0.88 -1.16 -0.10 0.00 -2.00 0.00 0.00 174.74 172.36 1y1d s ALA 1091N -2.63 2.73 -0.09 -1.38 0.00 -0.42 -4.88 121.76 115.08 1y1d s ALA 1091Ca 0.17 -0.89 0.04 0.00 0.00 0.00 0.00 51.96 51.28 1y1d s ALA 1091Cb -0.04 -1.33 -0.00 0.00 0.00 0.00 0.00 23.12 21.76 1y1d s ALA 1091CO 0.07 0.20 -0.23 -1.21 0.00 0.00 0.00 175.76 174.59 1y1d s GLU 1092N 0.42 2.91 -0.20 0.00 2.02 -1.26 -0.01 118.70 122.58 1y1d s GLU 1092Ca -0.08 -0.85 0.01 0.00 0.02 0.00 0.00 54.97 54.07 1y1d s GLU 1092Cb -0.15 -2.23 0.03 0.00 0.10 0.00 0.00 34.13 31.88 1y1d s GLU 1092CO 0.04 0.19 -0.16 0.08 0.02 0.00 0.00 175.26 175.44 1y1d s VAL 1093N 0.30 2.00 -0.14 2.63 1.01 0.08 -4.96 120.40 121.32 1y1d s VAL 1093Ca -0.17 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 60.70 1y1d s VAL 1093Cb -0.17 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1y1d s VAL 1093CO 0.08 0.33 -0.19 -0.69 0.00 0.00 0.00 175.10 174.63 1y1d s VAL 1094N 1.27 2.39 0.01 2.92 1.01 -1.26 -0.66 120.40 126.07 1y1d s VAL 1094Ca 0.00 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 60.93 1y1d s VAL 1094Cb -0.15 -1.98 0.03 0.00 0.00 0.00 0.00 36.38 34.28 1y1d s VAL 1094CO -0.10 0.53 0.40 0.72 0.00 0.00 0.00 175.10 176.65 1y1d s PHE 1095N 0.72 -0.27 0.11 5.22 -0.71 -0.57 -5.00 117.98 117.48 1y1d s PHE 1095Ca -0.08 0.34 -0.29 0.00 -1.04 0.00 0.00 56.93 55.86 1y1d s PHE 1095Cb -0.16 0.18 -0.06 0.00 -1.21 0.00 0.00 43.02 41.78 1y1d s PHE 1095CO 0.01 -0.50 0.94 0.99 -1.34 0.00 0.00 175.22 175.32 1y1d s THR 1096N -1.86 4.51 0.06 -4.49 2.01 -1.26 -0.93 115.64 113.68 1y1d s THR 1096Ca -0.09 2.02 0.08 0.00 0.31 0.00 0.00 61.69 64.01 1y1d s THR 1096Cb -0.02 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 1y1d s THR 1096CO 0.02 0.33 -0.23 0.00 -0.69 0.00 0.00 174.62 174.05 1y1d s ALA 1097N -0.06 1.94 -1.75 7.40 0.00 -0.31 -4.85 121.76 124.13 1y1d s ALA 1097Ca 0.46 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1y1d s ALA 1097Cb -0.23 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.52 1y1d s ALA 1097CO 0.29 0.44 0.00 0.09 0.00 0.00 0.00 175.76 176.58 1y1d n ASN 1098N 1.67 -5.32 -0.08 0.00 3.02 -1.26 -2.66 115.26 110.63 1y1d n ASN 1098Ca -0.17 0.18 0.14 0.00 -0.03 0.00 0.00 54.58 54.70 1y1d n ASN 1098Cb 0.53 -4.41 0.64 0.00 -0.61 0.00 0.00 39.78 35.93 1y1d n ASN 1098CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1y1d n ASP 1099N -1.32 0.34 -1.41 6.41 5.75 -1.26 -2.74 116.55 122.33 1y1d n ASP 1099Ca -0.21 -0.43 -0.07 0.00 -0.01 0.00 0.00 54.79 54.07 1y1d n ASP 1099Cb 0.64 -0.13 0.11 0.00 -1.03 0.00 0.00 41.12 40.71 1y1d n ASP 1099CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1y1d n SER 1100N -1.07 3.02 0.00 -1.12 7.64 -1.26 -5.09 113.62 115.74 1y1d n SER 1100Ca 0.14 -3.59 0.00 0.00 1.01 0.00 0.00 58.87 56.43 1y1d n SER 1100Cb 0.27 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1y1d n SER 1100CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y1d n GLY 1101N -0.80 1.29 3.74 0.23 0.00 -1.11 -5.00 105.19 103.54 1y1d n GLY 1101Ca 0.28 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 1y1d n GLY 1101CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y1d s PRO 1102N -2.01 4.19 0.21 1.61 0.04 -1.26 -4.27 135.00 133.51 1y1d s PRO 1102Ca 0.00 2.44 0.03 0.00 0.04 0.00 0.00 61.00 63.51 1y1d s PRO 1102Cb 0.00 -3.07 -0.05 0.00 0.04 0.00 0.00 34.50 31.42 1y1d s PRO 1102CO 0.00 -0.55 -0.01 1.03 0.04 0.00 0.00 177.00 177.52 1y1d s ARG 1103N -0.22 1.27 -0.16 4.56 1.81 -1.26 -4.65 118.95 120.29 1y1d s ARG 1103Ca 0.63 -1.63 -0.05 0.00 -1.72 0.00 0.00 55.73 52.95 1y1d s ARG 1103Cb -0.45 -0.53 -0.04 0.00 -0.45 0.00 0.00 34.95 33.49 1y1d s ARG 1103CO 0.44 -0.10 0.02 1.03 -0.68 0.00 0.00 175.30 176.01 1y1d s ARG 1104N -3.87 3.77 -0.12 3.54 0.52 -0.20 -4.85 118.95 117.73 1y1d s ARG 1104Ca 0.27 -0.41 0.03 0.00 -0.52 0.00 0.00 55.73 55.10 1y1d s ARG 1104Cb 0.06 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.46 1y1d s ARG 1104CO 0.07 0.31 -0.21 0.71 0.02 0.00 0.00 175.30 176.20 1y1d s TYR 1105N 0.22 2.64 -0.20 -0.53 1.51 0.48 -1.34 117.35 120.13 1y1d s TYR 1105Ca 0.01 -1.12 -0.04 0.00 -1.01 0.00 0.00 57.07 54.92 1y1d s TYR 1105Cb -0.13 -1.78 -0.02 0.00 -0.11 0.00 0.00 41.96 39.93 1y1d s TYR 1105CO 0.01 -0.48 -0.04 0.99 -1.11 0.00 0.00 175.55 174.93 1y1d s THR 1106N 0.56 3.57 -0.26 -0.71 2.01 -0.17 -1.22 115.64 119.41 1y1d s THR 1106Ca -0.13 -0.44 -0.08 0.00 0.31 0.00 0.00 61.69 61.36 1y1d s THR 1106Cb -0.17 -2.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 1y1d s THR 1106CO 0.04 0.44 0.08 -0.63 -0.69 0.00 0.00 174.62 173.86 1y1d s ILE 1107N 1.15 4.30 -0.02 1.82 -1.09 -0.17 -1.35 121.20 125.84 1y1d s ILE 1107Ca 0.02 -0.26 0.05 0.00 -2.23 0.00 0.00 60.65 58.23 1y1d s ILE 1107Cb -0.15 -3.05 -0.03 0.00 -1.58 0.00 0.00 42.46 37.65 1y1d s ILE 1107CO -0.00 0.28 -0.15 0.00 -1.23 0.00 0.00 174.94 173.84 1y1d s ALA 1108N 1.60 2.66 -0.04 9.38 0.00 -0.60 -0.78 121.76 133.99 1y1d s ALA 1108Ca 0.06 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.98 1y1d s ALA 1108Cb -0.16 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 22.08 1y1d s ALA 1108CO 0.04 0.57 -0.06 0.00 0.00 0.00 0.00 175.76 176.31 1y1d s ALA 1109N -0.81 0.69 -0.23 0.00 0.00 -0.05 -1.70 121.76 119.65 1y1d s ALA 1109Ca 0.13 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.90 1y1d s ALA 1109Cb -0.11 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1y1d s ALA 1109CO 0.03 0.04 0.01 -1.17 0.00 0.00 0.00 175.76 174.67 1y1d s LEU 1110N 0.63 3.18 -0.12 0.00 2.96 0.12 -0.95 118.68 124.49 1y1d s LEU 1110Ca -0.09 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1y1d s LEU 1110Cb -0.12 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 1y1d s LEU 1110CO 0.00 -0.01 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.23 1y1d s LEU 1111N 1.47 3.37 0.20 -0.68 1.43 -0.20 -1.64 118.68 122.62 1y1d s LEU 1111Ca 0.05 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 1y1d s LEU 1111Cb -0.15 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 1y1d s LEU 1111CO 0.00 0.26 -0.06 -0.44 0.23 0.00 0.00 176.35 176.34 1y1d s SER 1112N -0.16 1.93 0.28 2.29 0.01 -0.12 -1.07 113.70 116.87 1y1d s SER 1112Ca 0.04 -1.11 0.02 0.00 1.31 0.00 0.00 55.95 56.21 1y1d s SER 1112Cb -0.13 -0.02 0.63 0.00 0.21 0.00 0.00 66.02 66.72 1y1d s SER 1112CO 0.02 -0.40 1.77 -0.65 0.41 0.00 0.00 173.24 174.39 1y1d h PRO 1113N 2.60 0.67 -0.17 12.44 0.11 -1.99 -2.97 132.00 142.68 1y1d h PRO 1113Ca -0.38 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1y1d h PRO 1113Cb 1.21 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1y1d h PRO 1113CO 0.64 0.44 0.00 0.66 -0.21 0.00 0.00 178.00 179.53 1y1d n TYR 1114N -4.82 0.50 -3.54 0.65 4.02 -1.26 -1.37 117.16 111.34 1y1d n TYR 1114Ca 0.20 -0.82 -0.16 0.00 -0.01 0.00 0.00 57.90 57.12 1y1d n TYR 1114Cb 0.50 -0.20 -0.06 0.00 -0.02 0.00 0.00 39.34 39.57 1y1d n TYR 1114CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1y1d s SER 1115N -1.96 -0.56 0.05 7.72 0.15 -1.12 -4.95 113.70 113.02 1y1d s SER 1115Ca 0.32 0.46 -0.08 0.00 0.70 0.00 0.00 55.95 57.35 1y1d s SER 1115Cb 0.25 0.52 -0.00 0.00 -1.71 0.00 0.00 66.02 65.08 1y1d s SER 1115CO 0.07 -0.66 0.16 -0.72 1.20 0.00 0.00 173.24 173.29 1y1d s TYR 1116N -1.79 0.13 -0.01 3.44 -0.85 -1.26 -0.94 117.35 116.06 1y1d s TYR 1116Ca -0.08 -0.43 0.06 0.00 -0.52 0.00 0.00 57.07 56.10 1y1d s TYR 1116Cb -0.01 -0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.24 1y1d s TYR 1116CO 0.04 -0.44 -0.20 -1.12 -1.52 0.00 0.00 175.55 172.31 1y1d s SER 1117N -2.32 2.31 0.02 -0.18 0.01 -0.65 -4.98 113.70 107.92 1y1d s SER 1117Ca -0.02 -0.37 0.02 0.00 1.31 0.00 0.00 55.95 56.89 1y1d s SER 1117Cb 0.01 -0.25 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 1y1d s SER 1117CO -0.06 0.23 -0.07 0.28 0.41 0.00 0.00 173.24 174.03 1y1d s THR 1118N -0.50 0.55 0.11 1.44 -1.32 -1.26 -0.71 115.64 113.96 1y1d s THR 1118Ca 0.07 -0.68 -0.01 0.00 -1.21 0.00 0.00 61.69 59.87 1y1d s THR 1118Cb -0.08 -0.54 -0.04 0.00 -1.51 0.00 0.00 72.50 70.34 1y1d s THR 1118CO -0.00 -0.10 0.05 0.28 -2.21 0.00 0.00 174.62 172.63 1y1d s THR 1119N -0.74 0.12 -0.01 5.08 -1.32 -0.69 -5.00 115.64 113.09 1y1d s THR 1119Ca -0.03 -1.87 0.04 0.00 -1.21 0.00 0.00 61.69 58.62 1y1d s THR 1119Cb -0.06 -1.93 -0.01 0.00 -1.51 0.00 0.00 72.50 68.99 1y1d s THR 1119CO 0.00 -0.57 -0.13 0.00 -2.21 0.00 0.00 174.62 171.71 1y1d s ALA 1120N -4.02 1.10 -0.16 11.08 0.00 -1.26 -1.56 121.76 126.94 1y1d s ALA 1120Ca 0.20 -0.57 -0.00 0.00 0.00 0.00 0.00 51.96 51.59 1y1d s ALA 1120Cb 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 23.12 22.91 1y1d s ALA 1120CO -0.01 0.27 -0.14 0.08 0.00 0.00 0.00 175.76 175.96 1y1d s VAL 1121N -0.32 2.78 -0.15 0.00 1.01 -0.46 -4.98 120.40 118.28 1y1d s VAL 1121Ca 0.05 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1y1d s VAL 1121Cb -0.05 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1y1d s VAL 1121CO -0.00 0.51 -0.16 -0.69 0.00 0.00 0.00 175.10 174.75 1y1d s VAL 1122N 0.84 1.72 0.28 2.92 1.01 -1.26 -1.00 120.40 124.91 1y1d s VAL 1122Ca -0.04 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.30 1y1d s VAL 1122Cb -0.15 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.59 1y1d s VAL 1122CO -0.00 0.48 -0.14 0.42 0.00 0.00 0.00 175.10 175.86 1y1d s THR 1123N 1.35 2.10 -0.22 3.92 -4.23 -0.45 -4.97 115.64 113.14 1y1d s THR 1123Ca 0.03 -2.27 -0.00 0.00 -1.18 0.00 0.00 61.69 58.28 1y1d s THR 1123Cb -0.13 -2.34 0.03 0.00 1.34 0.00 0.00 72.50 71.39 1y1d s THR 1123CO -0.10 -0.39 -0.12 0.21 -0.54 0.00 0.00 174.62 173.68 1y1d s ASN 1124N -3.47 3.86 0.00 3.99 3.04 -1.26 -1.03 114.94 120.06 1y1d s ASN 1124Ca 0.29 -0.81 0.29 0.00 0.04 0.00 0.00 52.86 52.66 1y1d s ASN 1124Cb -0.01 -1.58 1.19 0.00 -1.54 0.00 0.00 41.25 39.32 1y1d s ASN 1124CO 0.13 -0.07 1.83 -0.81 -3.04 0.00 0.00 177.10 175.13