#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0p s LEU 1003N 0.00 4.36 0.14 0.99 2.96 -1.26 -3.12 118.68 122.75 1x0p s LEU 1003Ca 0.00 1.46 0.02 0.00 -0.22 0.00 0.00 54.13 55.38 1x0p s LEU 1003Cb 0.00 -3.34 -0.04 0.00 0.50 0.00 0.00 46.19 43.30 1x0p s LEU 1003CO 0.00 -0.17 -0.02 -1.00 -1.32 0.00 0.00 176.35 173.84 1x0p s HIS 1004N 0.77 1.07 -0.06 5.38 3.76 0.35 -1.35 115.29 125.21 1x0p s HIS 1004Ca 0.45 -0.99 0.02 0.00 -0.15 0.00 0.00 55.06 54.39 1x0p s HIS 1004Cb -0.20 -0.61 0.01 0.00 1.11 0.00 0.00 32.58 32.90 1x0p s HIS 1004CO 0.24 -0.20 -0.12 0.50 -0.85 0.00 0.00 174.74 174.31 1x0p s ARG 1005N -3.89 1.69 -0.07 1.40 3.52 -0.15 -1.37 118.95 120.08 1x0p s ARG 1005Ca 0.19 -0.41 0.01 0.00 -0.13 0.00 0.00 55.73 55.39 1x0p s ARG 1005Cb 0.06 -1.40 -0.03 0.00 -1.56 0.00 0.00 34.95 32.02 1x0p s ARG 1005CO 0.00 0.03 -0.08 -1.17 -0.81 0.00 0.00 175.30 173.27 1x0p s LEU 1006N 0.66 3.09 -0.03 -0.88 2.96 0.81 -2.47 118.68 122.82 1x0p s LEU 1006Ca -0.14 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.72 1x0p s LEU 1006Cb -0.16 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.87 1x0p s LEU 1006CO 0.04 0.34 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.70 1x0p s ILE 1007N -0.70 0.75 0.16 6.68 1.01 -0.09 -0.82 121.20 128.19 1x0p s ILE 1007Ca 0.11 -0.31 -0.14 0.00 0.00 0.00 0.00 60.65 60.30 1x0p s ILE 1007Cb -0.11 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.69 1x0p s ILE 1007CO 0.01 0.25 0.40 -0.72 0.00 0.00 0.00 174.94 174.88 1x0p s TYR 1008N 0.39 0.03 0.17 3.97 -0.85 -0.75 -0.28 117.35 120.02 1x0p s TYR 1008Ca -0.06 -0.38 0.04 0.00 -0.52 0.00 0.00 57.07 56.15 1x0p s TYR 1008Cb -0.10 0.20 -0.05 0.00 0.38 0.00 0.00 41.96 42.39 1x0p s TYR 1008CO 0.01 -0.78 -0.08 -0.48 -1.52 0.00 0.00 175.55 172.69 1x0p s LEU 1009N -2.88 2.46 0.28 -3.49 0.05 -0.14 -1.63 118.68 113.34 1x0p s LEU 1009Ca 0.10 -1.06 -0.19 0.00 0.05 0.00 0.00 54.13 53.03 1x0p s LEU 1009Cb 0.01 -0.35 0.02 0.00 -2.05 0.00 0.00 46.19 43.83 1x0p s LEU 1009CO -0.05 -0.36 0.69 -0.94 -0.55 0.00 0.00 176.35 175.14 1x0p s SER 1010N -3.20 -0.21 -0.18 1.48 1.04 -0.23 -0.39 113.70 112.00 1x0p s SER 1010Ca 0.19 -0.70 -0.05 0.00 0.48 0.00 0.00 55.95 55.88 1x0p s SER 1010Cb 0.03 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.84 1x0p s SER 1010CO 0.03 -1.34 0.00 0.00 0.98 0.00 0.00 173.24 172.91 1x0p s ALA 1012N 0.69 3.34 0.16 0.00 0.00 -0.65 -0.39 121.76 124.90 1x0p s ALA 1012Ca -0.00 1.31 -0.26 0.00 0.00 0.00 0.00 51.96 53.02 1x0p s ALA 1012Cb -0.14 -3.51 -0.08 0.00 0.00 0.00 0.00 23.12 19.39 1x0p s ALA 1012CO 0.02 -0.87 0.79 0.99 0.00 0.00 0.00 175.76 176.68 1x0p s THR 1013N -1.22 4.38 0.15 0.00 2.01 0.12 -4.80 115.64 116.28 1x0p s THR 1013Ca 0.56 1.72 -0.34 0.00 0.31 0.00 0.00 61.69 63.93 1x0p s THR 1013Cb -0.40 -4.15 -0.15 0.00 0.01 0.00 0.00 72.50 67.81 1x0p s THR 1013CO 0.52 0.51 1.35 0.47 -0.69 0.00 0.00 174.62 176.78 1x0p n ASP 1014N 1.70 2.00 0.00 3.53 9.92 -1.26 -2.23 116.55 130.21 1x0p n ASP 1014Ca -0.05 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.33 1x0p n ASP 1014Cb 0.49 -1.28 0.00 0.00 -0.64 0.00 0.00 41.12 39.69 1x0p n ASP 1014CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1x0p n GLY 1015N 2.50 0.66 3.65 0.44 0.00 -1.26 -5.05 105.19 106.13 1x0p n GLY 1015Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1x0p n GLY 1015CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x0p n LEU 1016N 0.00 3.74 -4.87 0.99 7.94 -0.95 -4.96 117.00 118.90 1x0p n LEU 1016Ca 0.00 0.78 -0.21 0.00 -1.11 0.00 0.00 56.01 55.48 1x0p n LEU 1016Cb 0.00 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 42.44 1x0p n LEU 1016CO 0.00 -0.05 -0.02 -0.94 -1.11 0.00 0.00 177.39 175.26 1x0p s SER 1017N 5.13 5.13 0.17 1.96 1.04 -1.26 -5.00 113.70 120.88 1x0p s SER 1017Ca 0.93 -0.66 -0.14 0.00 0.48 0.00 0.00 55.95 56.55 1x0p s SER 1017Cb -0.51 -0.69 0.06 0.00 0.10 0.00 0.00 66.02 64.98 1x0p s SER 1017CO 0.44 -0.56 1.84 1.88 0.98 0.00 0.00 173.24 177.82 1x0p h TYR 1018N 1.09 0.65 0.00 5.02 0.05 -2.00 -0.96 116.97 120.82 1x0p h TYR 1018Ca -0.42 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.35 1x0p h TYR 1018Cb 1.26 -0.22 -0.00 0.00 1.01 0.00 0.00 36.73 38.78 1x0p h TYR 1018CO 0.52 0.41 -0.10 -1.00 -1.05 0.00 0.00 178.16 176.94 1x0p h PRO 1019N 0.70 0.00 -0.16 4.88 0.13 -1.99 -1.68 132.00 133.88 1x0p h PRO 1019Ca 0.19 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.29 1x0p h PRO 1019Cb -0.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.05 1x0p h PRO 1019CO -0.04 0.10 -0.01 -0.44 -0.23 0.00 0.00 178.00 177.38 1x0p h ASP 1020N 0.00 0.29 -0.65 1.44 3.32 -1.58 0.24 116.42 119.47 1x0p h ASP 1020Ca -0.00 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.72 1x0p h ASP 1020Cb 0.32 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1x0p h ASP 1020CO 0.01 0.55 0.41 -0.07 -1.72 0.00 0.00 179.24 178.41 1x0p h LEU 1021N 0.03 0.77 -0.59 1.55 3.38 -0.74 -0.51 115.31 119.20 1x0p h LEU 1021Ca 0.04 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1x0p h LEU 1021Cb 0.40 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1x0p h LEU 1021CO 0.01 0.59 0.17 0.03 0.09 0.00 0.00 178.44 179.33 1x0p h ARG 1022N 0.88 0.93 0.01 1.13 3.08 -1.25 -1.37 114.38 117.80 1x0p h ARG 1022Ca 0.24 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1x0p h ARG 1022Cb -0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1x0p h ARG 1022CO -0.05 0.84 -0.03 0.22 -1.07 0.00 0.00 179.97 179.89 1x0p h ASP 1023N 0.84 -0.07 -0.22 7.04 -0.00 -0.49 0.17 116.42 123.69 1x0p h ASP 1023Ca 0.19 0.01 0.05 0.00 -0.00 0.00 0.00 57.03 57.28 1x0p h ASP 1023Cb 0.31 0.03 -0.05 0.00 -0.00 0.00 0.00 39.33 39.62 1x0p h ASP 1023CO -0.00 -0.04 -0.13 0.40 -0.00 0.00 0.00 179.24 179.47 1x0p h ILE 1024N -0.05 0.61 -0.41 2.25 2.04 -0.91 -0.81 117.51 120.23 1x0p h ILE 1024Ca 0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1x0p h ILE 1024Cb 0.06 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1x0p h ILE 1024CO -0.02 0.00 0.19 0.24 0.00 0.00 0.00 178.15 178.56 1x0p h MET 1025N -0.11 0.60 -0.23 2.37 2.86 -1.01 0.10 114.93 119.51 1x0p h MET 1025Ca 0.12 -0.09 0.05 0.00 -2.06 0.00 0.00 59.70 57.71 1x0p h MET 1025Cb 0.30 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 1x0p h MET 1025CO -0.29 0.53 -0.05 0.00 1.06 0.00 0.00 176.91 178.16 1x0p h ALA 1026N 1.04 0.15 -0.40 6.32 0.00 -0.22 0.42 119.26 126.57 1x0p h ALA 1026Ca 0.14 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1x0p h ALA 1026Cb 0.14 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1x0p h ALA 1026CO -0.02 -0.47 0.03 0.87 0.00 0.00 0.00 179.25 179.66 1x0p h LYS 1027N 0.00 0.69 0.05 0.00 6.56 -1.02 -2.92 116.57 119.92 1x0p h LYS 1027Ca 0.11 -0.21 0.01 0.00 -1.06 0.00 0.00 60.65 59.50 1x0p h LYS 1027Cb 0.17 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.75 1x0p h LYS 1027CO -0.23 0.76 -0.07 0.77 -2.06 0.00 0.00 179.45 178.62 1x0p h SER 1028N 0.53 -0.20 -0.40 0.86 0.02 -0.39 -0.83 113.55 113.14 1x0p h SER 1028Ca 0.12 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.15 1x0p h SER 1028Cb 0.43 0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.00 1x0p h SER 1028CO 0.02 -0.11 0.11 -0.33 -1.14 0.00 0.00 176.83 175.38 1x0p h GLU 1029N -0.15 0.25 0.15 3.45 5.08 -0.95 0.13 114.58 122.53 1x0p h GLU 1029Ca 0.01 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1x0p h GLU 1029Cb 0.16 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1x0p h GLU 1029CO -0.04 0.17 -0.07 0.28 -1.00 0.00 0.00 179.01 178.35 1x0p h VAL 1030N 0.26 0.91 -0.39 3.13 2.07 -1.36 -1.44 116.25 119.43 1x0p h VAL 1030Ca 0.19 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 1x0p h VAL 1030Cb 0.20 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1x0p h VAL 1030CO -0.22 0.06 0.04 0.78 0.02 0.00 0.00 177.57 178.25 1x0p h ASN 1031N -0.31 0.64 -0.33 0.57 2.35 -0.98 -2.54 115.58 115.00 1x0p h ASN 1031Ca -0.02 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.43 1x0p h ASN 1031Cb 0.24 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1x0p h ASN 1031CO 0.03 0.76 0.14 0.78 -1.65 0.00 0.00 177.43 177.49 1x0p h ASN 1032N 0.50 0.44 -0.56 5.81 2.35 -0.76 0.17 115.58 123.54 1x0p h ASN 1032Ca 0.12 -0.15 0.09 0.00 -0.55 0.00 0.00 56.30 55.81 1x0p h ASN 1032Cb 0.41 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 38.59 1x0p h ASN 1032CO 0.01 0.48 0.15 0.25 -1.65 0.00 0.00 177.43 176.67 1x0p h LEU 1033N 0.38 0.07 -0.63 1.61 5.85 -1.22 0.22 115.31 121.59 1x0p h LEU 1033Ca 0.11 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1x0p h LEU 1033Cb 0.17 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1x0p h LEU 1033CO -0.01 0.06 0.35 -0.09 -0.34 0.00 0.00 178.44 178.41 1x0p h ARG 1034N 0.30 0.87 -0.01 1.25 2.43 -1.01 -2.95 114.38 115.24 1x0p h ARG 1034Ca 0.28 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1x0p h ARG 1034Cb 0.38 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1x0p h ARG 1034CO -0.34 0.65 0.00 -0.25 -1.51 0.00 0.00 179.97 178.52 1x0p n ASP 1035N -4.56 0.96 -0.33 -3.80 8.00 0.56 -4.90 116.55 112.48 1x0p n ASP 1035Ca 0.04 -1.33 -0.04 0.00 0.71 0.00 0.00 54.79 54.17 1x0p n ASP 1035Cb 0.08 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.16 1x0p n ASP 1035CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 1036N 1.11 0.64 3.90 0.44 0.00 0.54 -4.75 105.19 107.06 1x0p n GLY 1036Ca 0.21 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 1x0p n GLY 1036CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0p s ILE 1037N -2.16 5.33 0.24 -0.61 1.01 0.07 -4.63 121.20 120.46 1x0p s ILE 1037Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.61 1x0p s ILE 1037Cb 0.00 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 1x0p s ILE 1037CO 0.00 0.25 0.10 0.42 0.00 0.00 0.00 174.94 175.71 1x0p s THR 1038N -1.41 0.45 -4.97 2.92 -4.23 -0.65 -4.17 115.64 103.58 1x0p s THR 1038Ca 0.31 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 1x0p s THR 1038Cb -0.13 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1x0p s THR 1038CO 0.21 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.85 1x0p n GLY 1039N -0.40 -1.13 3.06 3.99 0.00 -0.62 -0.79 105.19 109.30 1x0p n GLY 1039Ca -0.00 -1.20 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 1x0p n GLY 1039CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 1040N -1.99 0.48 -0.11 1.61 -1.94 -0.96 -2.50 119.30 113.89 1x0p s MET 1040Ca 0.00 -0.69 0.01 0.00 -1.71 0.00 0.00 55.69 53.30 1x0p s MET 1040Cb 0.00 0.18 0.02 0.00 2.01 0.00 0.00 34.83 37.04 1x0p s MET 1040CO 0.00 -0.10 -0.14 -1.17 -0.01 0.00 0.00 175.02 173.60 1x0p s LEU 1041N -1.86 1.66 -0.16 -0.03 0.20 0.21 -1.82 118.68 116.89 1x0p s LEU 1041Ca -0.09 -0.41 -0.03 0.00 0.69 0.00 0.00 54.13 54.29 1x0p s LEU 1041Cb -0.04 -1.06 -0.02 0.00 -0.43 0.00 0.00 46.19 44.64 1x0p s LEU 1041CO -0.03 -0.01 -0.06 0.00 -0.29 0.00 0.00 176.35 175.97 1x0p s TYR 1043N 0.45 1.78 -0.16 0.00 5.04 -0.11 -1.11 117.35 123.23 1x0p s TYR 1043Ca -0.05 -0.90 -0.29 0.00 -2.44 0.00 0.00 57.07 53.39 1x0p s TYR 1043Cb -0.15 -1.36 0.11 0.00 0.35 0.00 0.00 41.96 40.91 1x0p s TYR 1043CO 0.03 -0.54 0.92 0.20 -1.34 0.00 0.00 175.55 174.82 1x0p s GLY 1044N 1.42 -0.33 -1.55 8.97 0.00 -0.55 -1.74 107.32 113.54 1x0p s GLY 1044Ca 0.01 1.97 -0.11 0.00 0.00 0.00 0.00 44.72 46.59 1x0p s GLY 1044CO -0.07 1.17 0.75 -2.01 0.00 0.00 0.00 173.10 172.94 1x0p n ASN 1045N 1.08 -2.84 -0.77 1.64 5.15 -1.26 0.23 115.26 118.49 1x0p n ASN 1045Ca -0.13 -0.92 -0.10 0.00 -0.60 0.00 0.00 54.58 52.83 1x0p n ASN 1045Cb 0.57 -3.29 -0.04 0.00 -0.53 0.00 0.00 39.78 36.49 1x0p n ASN 1045CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x0p n GLY 1046N -1.65 1.03 3.37 8.20 0.00 -1.26 -4.98 105.19 109.91 1x0p n GLY 1046Ca -0.06 -0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 1x0p n GLY 1046CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 1047N -2.70 1.53 -0.09 1.61 -1.94 0.14 -1.64 119.30 116.22 1x0p s MET 1047Ca 0.00 -1.27 0.02 0.00 -1.71 0.00 0.00 55.69 52.73 1x0p s MET 1047Cb 0.00 -1.92 -0.02 0.00 2.01 0.00 0.00 34.83 34.90 1x0p s MET 1047CO 0.00 0.47 -0.12 -0.06 -0.01 0.00 0.00 175.02 175.30 1x0p s PHE 1048N -0.97 2.79 -0.10 -0.03 2.99 0.23 -1.48 117.98 121.41 1x0p s PHE 1048Ca 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 56.93 56.73 1x0p s PHE 1048Cb -0.10 -1.73 0.03 0.00 0.00 0.00 0.00 43.02 41.22 1x0p s PHE 1048CO 0.05 0.05 0.01 -1.17 -0.00 0.00 0.00 175.22 174.16 1x0p s LEU 1049N -0.30 0.69 0.05 -0.37 2.96 -0.27 -1.07 118.68 120.38 1x0p s LEU 1049Ca 0.03 -0.24 0.04 0.00 -0.22 0.00 0.00 54.13 53.73 1x0p s LEU 1049Cb -0.13 -0.47 -0.03 0.00 0.50 0.00 0.00 46.19 46.07 1x0p s LEU 1049CO 0.03 -0.22 -0.11 -1.58 -1.32 0.00 0.00 176.35 173.15 1x0p s GLN 1050N 1.95 0.67 -0.03 1.98 0.74 -0.64 0.14 119.66 124.47 1x0p s GLN 1050Ca 0.04 -0.82 0.03 0.00 0.05 0.00 0.00 55.36 54.66 1x0p s GLN 1050Cb -0.13 -0.56 -0.00 0.00 1.10 0.00 0.00 33.01 33.41 1x0p s GLN 1050CO -0.06 0.12 -0.13 -0.08 -0.55 0.00 0.00 175.29 174.59 1x0p s THR 1051N -1.26 1.06 -0.05 -0.34 -1.32 -0.76 -1.81 115.64 111.17 1x0p s THR 1051Ca -0.05 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 59.93 1x0p s THR 1051Cb -0.10 -0.92 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 1x0p s THR 1051CO 0.01 0.32 -0.14 -0.76 -2.21 0.00 0.00 174.62 171.84 1x0p s LEU 1052N 0.06 1.79 -0.03 9.08 1.02 0.00 -2.28 118.68 128.32 1x0p s LEU 1052Ca -0.02 -0.30 0.07 0.00 0.02 0.00 0.00 54.13 53.90 1x0p s LEU 1052Cb -0.09 -0.84 -0.02 0.00 0.02 0.00 0.00 46.19 45.27 1x0p s LEU 1052CO 0.01 0.09 -0.25 -1.61 0.02 0.00 0.00 176.35 174.61 1x0p s GLU 1053N 0.30 2.21 0.00 1.70 2.02 0.03 -0.13 118.70 124.84 1x0p s GLU 1053Ca -0.08 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.02 1x0p s GLU 1053Cb -0.13 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.08 1x0p s GLU 1053CO 0.02 0.48 0.00 0.41 0.02 0.00 0.00 175.26 176.19 1x0p n GLY 1054N 2.65 -0.52 3.77 -1.39 0.00 -0.47 -1.64 105.19 107.60 1x0p n GLY 1054Ca -0.16 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1x0p n GLY 1054CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x0p s ASP 1055N -4.00 5.73 0.16 1.61 -1.08 -1.26 -0.49 116.67 117.34 1x0p s ASP 1055Ca 0.00 2.18 -0.15 0.00 -0.52 0.00 0.00 52.55 54.06 1x0p s ASP 1055Cb 0.00 -2.58 0.05 0.00 -1.46 0.00 0.00 42.92 38.93 1x0p s ASP 1055CO 0.00 -1.22 1.82 -0.09 0.52 0.00 0.00 175.17 176.20 1x0p h ARG 1056N 1.21 0.58 -0.28 4.34 2.43 -1.91 -0.60 114.38 120.15 1x0p h ARG 1056Ca -0.50 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 58.54 1x0p h ARG 1056Cb 1.26 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1x0p h ARG 1056CO 0.57 0.39 -0.19 0.37 -1.51 0.00 0.00 179.97 179.59 1x0p h GLN 1057N 0.60 0.63 -0.22 0.20 4.15 -1.93 -2.64 115.11 115.90 1x0p h GLN 1057Ca 0.17 -0.30 -0.05 0.00 0.77 0.00 0.00 58.65 59.25 1x0p h GLN 1057Cb -0.04 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1x0p h GLN 1057CO -0.05 0.89 -0.06 0.87 -1.93 0.00 0.00 178.83 178.55 1x0p h LYS 1058N 0.36 0.42 -0.66 1.69 1.79 -1.91 -1.74 116.57 116.52 1x0p h LYS 1058Ca 0.06 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1x0p h LYS 1058Cb 0.73 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.33 1x0p h LYS 1058CO 0.05 0.66 0.38 0.28 -1.08 0.00 0.00 179.45 179.74 1x0p h VAL 1059N 0.15 1.20 -0.60 0.50 2.07 -1.18 -1.18 116.25 117.21 1x0p h VAL 1059Ca 0.05 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1x0p h VAL 1059Cb 0.51 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1x0p h VAL 1059CO 0.02 0.21 0.30 0.28 0.02 0.00 0.00 177.57 178.40 1x0p h SER 1060N 0.90 0.78 -0.72 0.57 0.02 -1.43 -1.58 113.55 112.09 1x0p h SER 1060Ca 0.23 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1x0p h SER 1060Cb 0.01 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 1x0p h SER 1060CO -0.04 0.68 0.44 -0.33 -1.14 0.00 0.00 176.83 176.44 1x0p h GLU 1061N 0.82 0.97 -0.49 3.45 5.08 -0.95 -1.22 114.58 122.23 1x0p h GLU 1061Ca 0.21 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1x0p h GLU 1061Cb 0.10 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1x0p h GLU 1061CO -0.03 0.69 0.13 1.15 -1.00 0.00 0.00 179.01 179.95 1x0p h THR 1062N 0.98 1.24 -0.73 1.13 2.02 -0.94 -1.54 112.91 115.07 1x0p h THR 1062Ca 0.26 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.62 1x0p h THR 1062Cb -0.04 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 1x0p h THR 1062CO -0.05 0.29 0.45 0.22 0.37 0.00 0.00 175.52 176.80 1x0p h TYR 1063N 0.67 0.95 -0.60 3.16 3.20 -0.93 0.25 116.97 123.67 1x0p h TYR 1063Ca 0.16 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 1x0p h TYR 1063Cb 0.31 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 1x0p h TYR 1063CO 0.02 0.63 0.37 0.00 -1.64 0.00 0.00 178.16 177.55 1x0p h ALA 1064N 1.24 1.53 -0.17 1.82 0.00 -0.91 0.36 119.26 123.13 1x0p h ALA 1064Ca 0.26 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1x0p h ALA 1064Cb -0.05 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1x0p h ALA 1064CO -0.05 0.42 -0.36 -0.09 0.00 0.00 0.00 179.25 179.17 1x0p h ARG 1065N 0.82 0.53 -0.94 0.00 2.43 -0.43 -3.14 114.38 113.65 1x0p h ARG 1065Ca 0.22 -0.35 0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1x0p h ARG 1065Cb -0.05 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 1x0p h ARG 1065CO -0.04 0.97 0.61 0.82 -1.51 0.00 0.00 179.97 180.81 1x0p h ILE 1066N 0.18 1.03 0.00 1.20 2.04 0.37 -0.96 117.51 121.38 1x0p h ILE 1066Ca 0.00 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1x0p h ILE 1066Cb 0.96 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1x0p h ILE 1066CO 0.08 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.60 1x0p n LEU 1067N -4.52 0.21 -0.02 1.44 4.77 0.03 -1.82 117.00 117.09 1x0p n LEU 1067Ca 0.15 0.57 0.11 0.00 -0.03 0.00 0.00 56.01 56.81 1x0p n LEU 1067Cb 0.24 -0.56 0.13 0.00 -2.33 0.00 0.00 43.42 40.89 1x0p n LEU 1067CO 0.32 -0.47 0.29 0.29 -1.33 0.00 0.00 177.39 176.48 1x0p n LYS 1068N -1.75 0.06 -2.38 3.23 5.02 -0.36 -4.88 118.16 117.10 1x0p n LYS 1068Ca 0.02 -0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.83 1x0p n LYS 1068Cb 0.12 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.61 1x0p n LYS 1068CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1x0p s ASP 1069N -2.97 6.60 0.00 4.39 -1.08 -0.76 -4.89 116.67 117.97 1x0p s ASP 1069Ca 0.11 1.20 0.13 0.00 -0.52 0.00 0.00 52.55 53.47 1x0p s ASP 1069Cb 0.17 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.74 1x0p s ASP 1069CO 0.75 -1.14 1.31 -0.81 0.52 0.00 0.00 175.17 175.80 1x0p n PRO 1070N 7.44 0.19 0.00 4.34 -0.04 -1.26 -2.83 135.00 142.84 1x0p n PRO 1070Ca 0.15 0.16 0.09 0.00 -0.04 0.00 0.00 63.50 63.86 1x0p n PRO 1070Cb 0.47 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.83 1x0p n PRO 1070CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x0p n ARG 1071N -1.27 0.04 -4.04 0.54 1.74 -1.26 -4.73 116.66 107.68 1x0p n ARG 1071Ca 0.06 0.17 -0.10 0.00 -0.77 0.00 0.00 57.85 57.22 1x0p n ARG 1071Cb 0.10 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 29.97 1x0p n ARG 1071CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1x0p s HIS 1072N -2.94 0.55 0.34 -1.55 -3.43 -1.13 -0.70 115.29 106.43 1x0p s HIS 1072Ca 0.10 -0.87 -0.14 0.00 -0.80 0.00 0.00 55.06 53.35 1x0p s HIS 1072Cb 0.12 0.01 0.03 0.00 -1.43 0.00 0.00 32.58 31.31 1x0p s HIS 1072CO 0.33 -0.90 0.68 -3.38 -2.00 0.00 0.00 174.74 169.47 1x0p s HIS 1073N -4.05 0.26 -1.31 0.38 -3.43 0.47 -4.81 115.29 102.81 1x0p s HIS 1073Ca 0.26 -0.78 -0.00 0.00 -0.80 0.00 0.00 55.06 53.74 1x0p s HIS 1073Cb 0.01 0.57 -0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1x0p s HIS 1073CO 0.09 -1.36 0.67 0.43 -2.00 0.00 0.00 174.74 172.57 1x0p n SER 1074N -1.11 -1.12 -4.78 7.38 7.64 -1.26 -0.74 113.62 119.62 1x0p n SER 1074Ca -0.05 -0.84 -0.37 0.00 1.01 0.00 0.00 58.87 58.62 1x0p n SER 1074Cb 0.60 -3.96 -0.03 0.00 -1.01 0.00 0.00 64.21 59.82 1x0p n SER 1074CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x0p s ALA 1075N -3.70 3.03 -0.03 -0.43 0.00 -1.26 -4.24 121.76 115.14 1x0p s ALA 1075Ca 0.01 0.79 -0.01 0.00 0.00 0.00 0.00 51.96 52.76 1x0p s ALA 1075Cb -0.00 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.83 1x0p s ALA 1075CO 0.82 -0.40 0.04 -1.21 0.00 0.00 0.00 175.76 175.01 1x0p s GLU 1076N -2.61 -0.02 0.20 0.00 2.02 0.47 -4.98 118.70 113.79 1x0p s GLU 1076Ca 0.61 0.23 -0.30 0.00 0.02 0.00 0.00 54.97 55.53 1x0p s GLU 1076Cb -0.24 -0.35 -0.08 0.00 0.10 0.00 0.00 34.13 33.55 1x0p s GLU 1076CO 0.30 -0.21 1.23 0.42 0.02 0.00 0.00 175.26 177.02 1x0p s ILE 1077N 1.40 3.41 -0.23 -1.63 1.01 -1.26 -0.96 121.20 122.94 1x0p s ILE 1077Ca -0.05 1.21 -0.01 0.00 0.00 0.00 0.00 60.65 61.80 1x0p s ILE 1077Cb -0.13 -3.77 -0.14 0.00 0.01 0.00 0.00 42.46 38.43 1x0p s ILE 1077CO -0.03 0.20 -0.22 0.52 0.00 0.00 0.00 174.94 175.41 1x0p n VAL 1078N 2.36 1.30 -3.52 2.92 0.31 0.61 -4.91 118.33 117.41 1x0p n VAL 1078Ca 0.04 -0.46 -0.12 0.00 -0.01 0.00 0.00 64.34 63.79 1x0p n VAL 1078Cb 0.44 -1.40 -0.04 0.00 -0.91 0.00 0.00 33.84 31.93 1x0p n VAL 1078CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1x0p s GLU 1079N -2.45 0.88 -0.29 5.55 2.12 -0.64 -4.59 118.70 119.27 1x0p s GLU 1079Ca -0.31 -0.07 -0.01 0.00 0.36 0.00 0.00 54.97 54.93 1x0p s GLU 1079Cb 0.09 0.41 0.18 0.00 0.26 0.00 0.00 34.13 35.07 1x0p s GLU 1079CO 0.50 -0.33 0.57 0.12 -0.54 0.00 0.00 175.26 175.58 1x0p s PHE 1080N -2.21 -1.49 0.17 5.30 5.36 -1.25 -0.91 117.98 122.94 1x0p s PHE 1080Ca -0.01 1.59 -0.14 0.00 -0.96 0.00 0.00 56.93 57.42 1x0p s PHE 1080Cb -0.01 0.49 0.01 0.00 -0.34 0.00 0.00 43.02 43.18 1x0p s PHE 1080CO -0.02 -0.85 0.40 -1.59 -1.46 0.00 0.00 175.22 171.70 1x0p s LYS 1081N 2.81 1.23 0.34 10.12 -2.85 -1.03 -5.00 119.74 125.37 1x0p s LYS 1081Ca 0.20 -0.96 -0.25 0.00 -1.00 0.00 0.00 55.97 53.96 1x0p s LYS 1081Cb -0.15 0.45 -0.10 0.00 -2.06 0.00 0.00 37.83 35.97 1x0p s LYS 1081CO -0.20 -0.49 0.95 0.00 0.10 0.00 0.00 175.35 175.71 1x0p s ALA 1082N -3.90 3.18 0.08 0.59 0.00 -1.26 -0.98 121.76 119.48 1x0p s ALA 1082Ca 0.11 0.52 0.06 0.00 0.00 0.00 0.00 51.96 52.65 1x0p s ALA 1082Cb 0.01 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 1x0p s ALA 1082CO -0.04 0.14 -0.15 0.96 0.00 0.00 0.00 175.76 176.67 1x0p s ILE 1083N -1.69 1.23 0.08 0.00 -4.36 -0.46 -4.87 121.20 111.13 1x0p s ILE 1083Ca 0.52 -1.41 -0.06 0.00 -0.26 0.00 0.00 60.65 59.44 1x0p s ILE 1083Cb -0.18 -1.22 -0.27 0.00 1.25 0.00 0.00 42.46 42.05 1x0p s ILE 1083CO 0.23 -0.24 1.16 -0.33 0.24 0.00 0.00 174.94 176.01 1x0p h GLU 1084N 4.13 0.34 -3.55 0.37 4.39 -1.98 -3.41 114.58 114.86 1x0p h GLU 1084Ca -0.41 -0.51 -0.12 0.00 0.34 0.00 0.00 59.36 58.65 1x0p h GLU 1084Cb 1.19 0.18 -0.18 0.00 -0.10 0.00 0.00 28.75 29.84 1x0p h GLU 1084CO 0.42 1.22 -0.42 -1.83 -1.16 0.00 0.00 179.01 177.24 1x0p s GLU 1085N -2.80 0.64 0.45 2.33 -1.05 -1.26 -5.06 118.70 111.96 1x0p s GLU 1085Ca -0.05 -0.58 -0.21 0.00 -0.15 0.00 0.00 54.97 53.99 1x0p s GLU 1085Cb 0.07 0.26 -0.10 0.00 -0.44 0.00 0.00 34.13 33.93 1x0p s GLU 1085CO 0.89 -0.18 0.99 1.03 0.95 0.00 0.00 175.26 178.94 1x0p s ARG 1086N -2.27 4.05 -0.20 -4.83 0.52 -1.26 -4.97 118.95 110.00 1x0p s ARG 1086Ca -0.07 1.22 -0.02 0.00 -0.52 0.00 0.00 55.73 56.34 1x0p s ARG 1086Cb -0.03 -2.15 -0.12 0.00 0.52 0.00 0.00 34.95 33.18 1x0p s ARG 1086CO -0.02 -0.20 -0.20 2.41 0.02 0.00 0.00 175.30 177.31 1x0p n THR 1087N -0.77 1.12 -2.51 0.02 -1.04 -1.26 -4.71 114.28 105.13 1x0p n THR 1087Ca 0.08 -0.39 -0.42 0.00 -2.04 0.00 0.00 64.05 61.28 1x0p n THR 1087Cb 0.53 -1.35 0.01 0.00 -1.82 0.00 0.00 70.33 67.70 1x0p n THR 1087CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1x0p n PHE 1088N -3.31 2.64 -0.03 -1.42 3.01 -1.26 -4.77 117.46 112.32 1x0p n PHE 1088Ca -0.36 -2.70 -0.15 0.00 1.01 0.00 0.00 57.45 55.25 1x0p n PHE 1088Cb 0.84 -1.65 -0.12 0.00 -0.01 0.00 0.00 39.48 38.55 1x0p n PHE 1088CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1x0p h ILE 1089N 3.35 1.56 -0.91 4.37 2.04 -1.96 -3.31 117.51 122.66 1x0p h ILE 1089Ca 0.39 -1.95 0.25 0.00 1.00 0.00 0.00 64.86 64.55 1x0p h ILE 1089Cb 0.55 2.80 -0.14 0.00 -0.74 0.00 0.00 36.82 39.29 1x0p h ILE 1089CO 1.48 0.53 0.34 0.78 0.00 0.00 0.00 178.15 181.28 1x0p h ASN 1090N -0.55 0.18 -4.24 1.72 2.35 -1.96 -3.44 115.58 109.64 1x0p h ASN 1090Ca -0.03 0.19 -0.63 0.00 -0.55 0.00 0.00 56.30 55.28 1x0p h ASN 1090Cb 0.98 0.21 -0.25 0.00 0.05 0.00 0.00 38.32 39.31 1x0p h ASN 1090CO 0.04 -0.11 -0.86 0.26 -1.65 0.00 0.00 177.43 175.11 1x0p s TRP 1091N -5.87 2.04 0.35 1.19 0.51 -1.26 -4.98 118.94 110.91 1x0p s TRP 1091Ca -0.12 -0.39 0.04 0.00 -2.12 0.00 0.00 56.10 53.51 1x0p s TRP 1091Cb 0.27 -1.20 0.64 0.00 -0.81 0.00 0.00 33.47 32.37 1x0p s TRP 1091CO 0.78 0.14 1.92 0.77 -0.51 0.00 0.00 176.95 180.05 1x0p h SER 1092N 4.65 0.53 -0.88 2.95 0.02 -1.83 -1.66 113.55 117.35 1x0p h SER 1092Ca -0.45 -0.07 0.21 0.00 -0.84 0.00 0.00 61.79 60.63 1x0p h SER 1092Cb 1.16 -0.14 -0.27 0.00 0.14 0.00 0.00 62.40 63.29 1x0p h SER 1092CO 0.43 0.53 0.41 -0.32 -1.14 0.00 0.00 176.83 176.74 1x0p s MET 1093N -5.17 0.17 -0.13 3.45 -2.45 -1.25 -3.19 119.30 110.74 1x0p s MET 1093Ca -0.08 0.41 0.02 0.00 -1.25 0.00 0.00 55.69 54.78 1x0p s MET 1093Cb 0.16 0.21 -0.00 0.00 1.25 0.00 0.00 34.83 36.45 1x0p s MET 1093CO 0.76 -0.05 -0.18 0.50 1.05 0.00 0.00 175.02 177.10 1x0p s ARG 1094N 2.07 3.20 -0.21 4.11 6.06 -1.04 -4.81 118.95 128.33 1x0p s ARG 1094Ca -0.02 -0.78 -0.15 0.00 -2.50 0.00 0.00 55.73 52.27 1x0p s ARG 1094Cb -0.03 -2.50 -0.04 0.00 0.06 0.00 0.00 34.95 32.44 1x0p s ARG 1094CO -0.16 0.14 0.38 -1.17 -2.50 0.00 0.00 175.30 171.99 1x0p s LEU 1095N 0.49 4.15 -0.19 -0.88 2.96 -1.26 0.68 118.68 124.62 1x0p s LEU 1095Ca -0.12 0.48 0.01 0.00 -0.22 0.00 0.00 54.13 54.27 1x0p s LEU 1095Cb -0.16 -2.48 0.02 0.00 0.50 0.00 0.00 46.19 44.07 1x0p s LEU 1095CO 0.05 -0.07 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.15 1x0p s VAL 1096N 1.32 2.24 -0.37 1.68 1.01 0.14 -4.95 120.40 121.47 1x0p s VAL 1096Ca 0.18 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 61.06 1x0p s VAL 1096Cb -0.15 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1x0p s VAL 1096CO 0.08 0.46 0.27 -1.10 0.00 0.00 0.00 175.10 174.81 1x0p s GLN 1097N 1.29 3.24 0.43 2.72 -0.21 -1.26 -0.94 119.66 124.93 1x0p s GLN 1097Ca 0.04 -0.83 0.12 0.00 0.02 0.00 0.00 55.36 54.71 1x0p s GLN 1097Cb -0.14 -3.89 0.98 0.00 1.00 0.00 0.00 33.01 30.96 1x0p s GLN 1097CO -0.11 -0.59 2.00 -0.07 -2.12 0.00 0.00 175.29 174.40 1x0p h LEU 1098N 8.56 0.40 -1.20 2.90 3.38 -1.75 -1.33 115.31 126.27 1x0p h LEU 1098Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1x0p h LEU 1098Cb 1.14 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1x0p h LEU 1098CO 0.68 0.25 0.00 1.23 0.09 0.00 0.00 178.44 180.69 1x0p h GLY 1099N 0.45 0.00 0.22 0.83 0.00 -1.93 -2.36 103.07 100.27 1x0p h GLY 1099Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1x0p h GLY 1099CO -0.07 0.00 -1.25 1.18 0.00 0.00 0.00 176.54 176.40 1x0p n GLU 1100N -2.33 0.26 -1.69 4.80 1.02 -0.50 -4.96 120.64 117.24 1x0p n GLU 1100Ca 0.00 -0.05 -0.29 0.00 -0.02 0.00 0.00 57.16 56.80 1x0p n GLU 1100Cb 0.13 -1.54 0.11 0.00 -0.02 0.00 0.00 31.44 30.12 1x0p n GLU 1100CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1x0p s MET 1101N -3.20 1.65 0.11 3.49 -1.94 -0.89 -4.98 119.30 113.55 1x0p s MET 1101Ca 0.03 0.27 -0.31 0.00 -1.71 0.00 0.00 55.69 53.97 1x0p s MET 1101Cb 0.15 -1.90 -0.09 0.00 2.01 0.00 0.00 34.83 35.00 1x0p s MET 1101CO 0.85 -1.85 1.65 0.34 -0.01 0.00 0.00 175.02 176.01 1x0p s ASP 1102N -4.23 6.56 0.19 3.03 2.15 -1.26 -4.90 116.67 118.20 1x0p s ASP 1102Ca 0.62 2.59 -0.14 0.00 0.43 0.00 0.00 52.55 56.05 1x0p s ASP 1102Cb -0.13 -2.58 0.19 0.00 -0.30 0.00 0.00 42.92 40.10 1x0p s ASP 1102CO 0.52 -0.89 1.68 0.77 -0.17 0.00 0.00 175.17 177.08 1x0p h SER 1103N 7.79 -0.21 -0.42 -0.34 4.64 -1.93 -1.44 113.55 121.63 1x0p h SER 1103Ca -0.43 0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1x0p h SER 1103Cb 1.20 0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.49 1x0p h SER 1103CO 0.93 -0.07 0.19 0.44 -0.87 0.00 0.00 176.83 177.44 1x0p h ASP 1104N 0.11 0.57 -0.17 4.97 3.32 -1.99 -0.75 116.42 122.49 1x0p h ASP 1104Ca 0.25 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1x0p h ASP 1104Cb 0.38 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1x0p h ASP 1104CO -0.42 0.56 0.11 0.74 -1.72 0.00 0.00 179.24 178.51 1x0p h THR 1105N 0.54 1.04 -0.30 0.35 2.02 -1.82 -1.92 112.91 112.82 1x0p h THR 1105Ca 0.14 -0.08 -0.11 0.00 0.77 0.00 0.00 66.41 67.14 1x0p h THR 1105Cb 0.16 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1x0p h THR 1105CO -0.01 0.04 -0.24 -0.29 0.37 0.00 0.00 175.52 175.38 1x0p h ILE 1106N 0.23 1.30 -0.62 3.11 6.09 -1.23 -1.84 117.51 124.54 1x0p h ILE 1106Ca 0.06 -1.39 -0.01 0.00 -1.37 0.00 0.00 64.86 62.15 1x0p h ILE 1106Cb -0.02 1.54 -0.03 0.00 0.47 0.00 0.00 36.82 38.77 1x0p h ILE 1106CO -0.02 0.45 0.34 0.08 -3.07 0.00 0.00 178.15 175.93 1x0p h ARG 1107N 0.44 0.86 -0.36 2.19 0.11 -1.07 0.16 114.38 116.70 1x0p h ARG 1107Ca 0.05 -0.09 -0.14 0.00 0.10 0.00 0.00 59.98 59.91 1x0p h ARG 1107Cb 0.80 -0.17 -0.01 0.00 1.11 0.00 0.00 29.97 31.70 1x0p h ARG 1107CO 0.06 0.63 -0.33 0.00 0.10 0.00 0.00 179.97 180.44 1x0p h ARG 1108N 0.87 0.81 -0.34 0.08 3.08 -1.27 -1.31 114.38 116.30 1x0p h ARG 1108Ca 0.22 -0.38 -0.13 0.00 0.07 0.00 0.00 59.98 59.76 1x0p h ARG 1108Cb 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1x0p h ARG 1108CO -0.04 1.01 -0.30 1.25 -1.07 0.00 0.00 179.97 180.83 1x0p h LEU 1109N 0.68 0.85 -1.00 3.04 5.85 -0.62 -0.42 115.31 123.68 1x0p h LEU 1109Ca 0.07 -0.46 -0.06 0.00 0.84 0.00 0.00 57.88 58.27 1x0p h LEU 1109Cb 0.87 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1x0p h LEU 1109CO 0.08 1.13 0.06 -0.09 -0.34 0.00 0.00 178.44 179.27 1x0p h ARG 1110N 0.58 0.78 -0.10 1.25 1.12 -0.62 -2.84 114.38 114.55 1x0p h ARG 1110Ca 0.06 -0.18 -0.09 0.00 -1.11 0.00 0.00 59.98 58.66 1x0p h ARG 1110Cb 0.87 -0.11 0.00 0.00 -0.01 0.00 0.00 29.97 30.73 1x0p h ARG 1110CO 0.08 0.75 -0.28 -0.07 -3.11 0.00 0.00 179.97 177.34 1x0p h LEU 1111N 0.74 0.41 -0.93 3.80 3.38 -1.15 -2.70 115.31 118.87 1x0p h LEU 1111Ca 0.15 -0.60 0.21 0.00 0.09 0.00 0.00 57.88 57.73 1x0p h LEU 1111Cb 0.37 -0.12 -0.12 0.00 0.09 0.00 0.00 40.66 40.88 1x0p h LEU 1111CO 0.01 0.94 0.48 0.50 0.09 0.00 0.00 178.44 180.46 1x0p h LYS 1112N -0.09 0.53 -0.21 1.13 3.64 -0.87 -2.81 116.57 117.87 1x0p h LYS 1112Ca -0.01 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1x0p h LYS 1112Cb 0.89 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 1x0p h LYS 1112CO 0.06 0.35 -0.04 0.66 -2.27 0.00 0.00 179.45 178.21 1x0p n TYR 1113N -4.93 0.74 -3.45 1.91 4.02 -1.09 -5.02 117.16 109.33 1x0p n TYR 1113Ca 0.23 -1.10 -0.12 0.00 -0.01 0.00 0.00 57.90 56.90 1x0p n TYR 1113Cb 0.62 -0.32 -0.02 0.00 -0.02 0.00 0.00 39.34 39.60 1x0p n TYR 1113CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1x0p s SER 1114N -2.33 -0.52 0.00 7.72 1.04 -1.02 -4.77 113.70 113.82 1x0p s SER 1114Ca 0.40 0.08 0.24 0.00 0.48 0.00 0.00 55.95 57.15 1x0p s SER 1114Cb 0.34 0.53 0.48 0.00 0.10 0.00 0.00 66.02 67.48 1x0p s SER 1114CO 0.05 -0.83 1.42 -0.81 0.98 0.00 0.00 173.24 174.05 1x0p n PRO 1115N -0.20 2.18 -2.71 4.02 -0.04 -1.26 -4.55 135.00 132.44 1x0p n PRO 1115Ca -0.15 -1.75 -0.31 0.00 -0.04 0.00 0.00 63.50 61.25 1x0p n PRO 1115Cb 0.63 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.58 1x0p n PRO 1115CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x0p s ALA 1116N -1.84 3.22 -1.45 0.55 0.00 -1.26 -4.98 121.76 116.00 1x0p s ALA 1116Ca 0.33 0.02 0.28 0.00 0.00 0.00 0.00 51.96 52.59 1x0p s ALA 1116Cb 0.21 -2.90 1.11 0.00 0.00 0.00 0.00 23.12 21.54 1x0p s ALA 1116CO 0.31 -0.04 1.80 0.00 0.00 0.00 0.00 175.76 177.83 1x0p n ALA 1117N -1.24 2.81 -2.92 0.00 0.00 -1.26 -4.77 120.51 113.13 1x0p n ALA 1117Ca 0.04 -0.25 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 1x0p n ALA 1117Cb 0.54 -1.32 -0.06 0.00 0.00 0.00 0.00 19.45 18.60 1x0p n ALA 1117CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1x0p s THR 1118N -2.64 0.01 -0.22 0.00 -4.23 -1.26 -5.10 115.64 102.20 1x0p s THR 1118Ca 0.24 -1.50 -0.28 0.00 -1.18 0.00 0.00 61.69 58.96 1x0p s THR 1118Cb 0.19 -2.18 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 1x0p s THR 1118CO 0.52 -0.05 2.03 0.12 -0.54 0.00 0.00 174.62 176.69 1x0p s PHE 1119N -4.03 1.43 -0.41 3.99 5.36 -1.26 -4.90 117.98 118.16 1x0p s PHE 1119Ca 0.24 0.47 0.04 0.00 -0.96 0.00 0.00 56.93 56.71 1x0p s PHE 1119Cb 0.01 -4.02 0.17 0.00 -0.34 0.00 0.00 43.02 38.84 1x0p s PHE 1119CO 0.08 -3.83 0.33 -0.65 -1.46 0.00 0.00 175.22 169.69 1x0p s GLN 1120N 5.83 0.91 0.55 10.12 -0.21 -1.26 -4.82 119.66 130.78 1x0p s GLN 1120Ca 0.91 -2.06 0.27 0.00 0.02 0.00 0.00 55.36 54.50 1x0p s GLN 1120Cb -0.30 -1.47 1.45 0.00 1.00 0.00 0.00 33.01 33.69 1x0p s GLN 1120CO 0.35 -1.36 1.97 -1.00 -2.12 0.00 0.00 175.29 173.13 1x0p h PRO 1121N 5.79 0.00 0.00 2.91 0.13 -1.94 0.50 132.00 139.38 1x0p h PRO 1121Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 1x0p h PRO 1121Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1x0p h PRO 1121CO 0.37 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.68 1x0p n ARG 1122N -4.17 0.11 -0.05 0.86 1.74 -1.26 -1.23 116.66 112.66 1x0p n ARG 1122Ca 0.10 0.48 0.12 0.00 -0.77 0.00 0.00 57.85 57.78 1x0p n ARG 1122Cb 0.64 -1.77 0.21 0.00 -1.02 0.00 0.00 32.46 30.51 1x0p n ARG 1122CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1x0p n SER 1123N -1.98 2.80 -4.62 0.55 3.41 0.17 -4.94 113.62 109.00 1x0p n SER 1123Ca 0.01 -1.91 -0.33 0.00 -0.26 0.00 0.00 58.87 56.38 1x0p n SER 1123Cb 0.11 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 63.90 1x0p n SER 1123CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1x0p s MET 1124N -1.88 2.68 0.94 4.33 -1.94 -0.36 -4.65 119.30 118.42 1x0p s MET 1124Ca 0.32 -0.64 -0.14 0.00 -1.71 0.00 0.00 55.69 53.52 1x0p s MET 1124Cb 0.21 -2.58 0.16 0.00 2.01 0.00 0.00 34.83 34.62 1x0p s MET 1124CO 0.31 0.63 1.18 0.95 -0.01 0.00 0.00 175.02 178.08 1x0p s THR 1125N -0.98 1.95 0.11 2.05 -4.23 -1.26 -4.82 115.64 108.45 1x0p s THR 1125Ca 0.17 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.47 1x0p s THR 1125Cb -0.11 -2.82 -0.09 0.00 1.34 0.00 0.00 72.50 70.81 1x0p s THR 1125CO 0.07 0.00 1.76 0.00 -0.54 0.00 0.00 174.62 175.91 1x0p h ALA 1126N -1.59 0.16 -0.49 3.99 0.00 -1.98 -1.23 119.26 118.12 1x0p h ALA 1126Ca -0.48 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1x0p h ALA 1126Cb 1.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1x0p h ALA 1126CO 0.54 -0.36 0.23 1.49 0.00 0.00 0.00 179.25 181.14 1x0p h GLU 1127N 0.16 0.69 -0.16 0.00 4.57 -1.94 -0.45 114.58 117.44 1x0p h GLU 1127Ca 0.05 -0.08 -0.20 0.00 -1.18 0.00 0.00 59.36 57.94 1x0p h GLU 1127Cb -0.01 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 1x0p h GLU 1127CO -0.02 0.54 -0.71 1.96 -1.18 0.00 0.00 179.01 179.60 1x0p h GLN 1128N 0.69 0.71 -0.20 1.92 4.20 -1.77 -0.88 115.11 119.78 1x0p h GLN 1128Ca 0.17 -0.54 -0.01 0.00 0.06 0.00 0.00 58.65 58.33 1x0p h GLN 1128Cb 0.09 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1x0p h GLN 1128CO -0.02 1.16 0.07 0.00 -0.67 0.00 0.00 178.83 179.37 1x0p h PHE 1130N 0.16 -0.14 -0.12 0.00 3.57 -1.00 -0.52 116.94 118.88 1x0p h PHE 1130Ca 0.06 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 1x0p h PHE 1130Cb 0.19 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1x0p h PHE 1130CO -0.01 -0.09 -0.30 0.00 -2.23 0.00 0.00 178.31 175.68 1x0p h ARG 1131N -0.07 0.23 0.16 1.11 3.08 -1.05 -0.28 114.38 117.56 1x0p h ARG 1131Ca 0.05 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1x0p h ARG 1131Cb 0.14 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1x0p h ARG 1131CO -0.11 0.52 -0.08 0.35 -1.07 0.00 0.00 179.97 179.58 1x0p h PHE 1132N 0.21 -0.20 -0.57 3.04 3.57 -0.61 -1.95 116.94 120.44 1x0p h PHE 1132Ca 0.03 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1x0p h PHE 1132Cb 0.64 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.42 1x0p h PHE 1132CO 0.01 0.06 0.16 -0.07 -2.23 0.00 0.00 178.31 176.24 1x0p h LEU 1133N -0.44 0.80 -0.57 0.59 3.38 -0.96 -2.47 115.31 115.65 1x0p h LEU 1133Ca -0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1x0p h LEU 1133Cb 0.34 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1x0p h LEU 1133CO 0.04 0.77 0.32 0.50 0.09 0.00 0.00 178.44 180.15 1x0p h LYS 1134N 0.84 0.78 -0.58 1.13 3.64 -0.92 0.23 116.57 121.68 1x0p h LYS 1134Ca 0.19 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1x0p h LYS 1134Cb 0.27 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1x0p h LYS 1134CO -0.01 0.59 0.06 0.93 -2.27 0.00 0.00 179.45 178.76 1x0p h GLU 1135N 0.76 0.96 -0.64 1.90 5.08 -1.11 0.23 114.58 121.77 1x0p h GLU 1135Ca 0.20 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1x0p h GLU 1135Cb 0.03 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1x0p h GLU 1135CO -0.03 0.91 0.18 -0.07 -1.00 0.00 0.00 179.01 179.00 1x0p h LEU 1136N 0.90 0.94 -0.14 1.33 3.38 -0.98 -1.84 115.31 118.90 1x0p h LEU 1136Ca 0.18 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1x0p h LEU 1136Cb 0.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1x0p h LEU 1136CO 0.01 0.91 0.09 0.22 0.09 0.00 0.00 178.44 179.76 1x0p h TYR 1137N 0.92 0.18 0.00 1.13 5.03 -0.13 -1.73 116.97 122.37 1x0p h TYR 1137Ca 0.20 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.49 1x0p h TYR 1137Cb 0.32 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.53 1x0p h TYR 1137CO 0.02 0.15 -0.09 -0.44 -1.32 0.00 0.00 178.16 176.48 1x0p h ASP 1138N 0.16 0.00 0.25 -2.11 3.32 -0.70 -2.04 116.42 115.31 1x0p h ASP 1138Ca 0.05 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.83 1x0p h ASP 1138Cb 0.02 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.58 1x0p h ASP 1138CO -0.01 0.09 -1.14 0.24 -1.72 0.00 0.00 179.24 176.70 1x0p h MET 1139N 0.00 0.52 0.00 3.56 2.86 -0.90 -3.51 114.93 117.46 1x0p h MET 1139Ca -0.00 -0.66 0.00 0.00 -2.06 0.00 0.00 59.70 56.98 1x0p h MET 1139Cb 0.25 0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1x0p h MET 1139CO 0.01 1.27 0.00 0.43 1.06 0.00 0.00 176.91 179.69