#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9x h PRO 999 N 0.00 0.79 -0.32 1.61 0.13 -2.10 -3.12 132.00 128.98 2e9x h PRO 999 Ca 0.00 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2e9x h PRO 999 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 2e9x h PRO 999 CO 0.00 1.05 0.00 -2.39 -0.23 0.00 0.00 178.00 176.43 2e9x n HIS 1000N -4.19 0.19 1.59 1.56 1.44 -1.26 -3.59 115.22 110.97 2e9x n HIS 1000Ca -0.03 -0.08 0.15 0.00 -2.01 0.00 0.00 57.72 55.74 2e9x n HIS 1000Cb 0.50 -0.04 0.81 0.00 0.12 0.00 0.00 29.99 31.38 2e9x n HIS 1000CO 0.00 0.00 0.00 -0.12 -2.81 0.00 0.00 176.34 173.41 2e9x n MET 1001N -0.10 0.62 0.28 -1.40 0.00 -1.18 -3.27 117.12 112.07 2e9x n MET 1001Ca 0.04 0.00 0.17 0.00 0.00 0.00 0.00 57.70 57.92 2e9x n MET 1001Cb 0.17 -1.50 0.80 0.00 0.00 0.00 0.00 33.22 32.69 2e9x n MET 1001CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 2e9x h SER 1002N 0.00 0.00 0.68 6.12 0.02 -1.81 -2.85 113.55 115.71 2e9x h SER 1002Ca 0.00 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.69 2e9x h SER 1002Cb 0.18 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 2e9x h SER 1002CO 0.00 0.04 -1.41 -0.08 -1.14 0.00 0.00 176.83 174.24 2e9x h GLU 1003N 0.00 0.03 -0.00 3.45 4.81 -1.88 -3.32 114.58 117.67 2e9x h GLU 1003Ca -0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2e9x h GLU 1003Cb 0.39 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2e9x h GLU 1003CO 0.01 0.78 -0.23 0.00 -0.73 0.00 0.00 179.01 178.83 2e9x n ALA 1004N -2.49 2.97 -3.14 2.92 0.00 -1.10 -4.69 120.51 114.98 2e9x n ALA 1004Ca -0.10 -0.29 -0.44 0.00 0.00 0.00 0.00 53.44 52.60 2e9x n ALA 1004Cb 1.01 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 19.13 2e9x n ALA 1004CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2e9x s TYR 1005N -2.69 3.27 -1.22 0.00 5.04 -1.09 -5.01 117.35 115.64 2e9x s TYR 1005Ca 0.21 -1.21 -0.08 0.00 -2.44 0.00 0.00 57.07 53.55 2e9x s TYR 1005Cb 0.19 -3.43 0.21 0.00 0.35 0.00 0.00 41.96 39.28 2e9x s TYR 1005CO 0.55 -0.91 1.72 1.19 -1.34 0.00 0.00 175.55 176.76 2e9x n PHE 1006N 5.17 2.95 -1.75 4.97 0.99 -1.26 -4.95 117.46 123.58 2e9x n PHE 1006Ca -0.12 -2.80 -0.40 0.00 -0.00 0.00 0.00 57.45 54.13 2e9x n PHE 1006Cb 0.42 -1.77 0.02 0.00 -1.00 0.00 0.00 39.48 37.15 2e9x n PHE 1006CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.76 179.65 2e9x n ARG 1007N 3.25 2.14 -2.11 -1.08 1.85 -1.26 -4.89 116.66 114.54 2e9x n ARG 1007Ca 0.35 0.76 -0.42 0.00 -1.00 0.00 0.00 57.85 57.54 2e9x n ARG 1007Cb 0.36 -2.59 -0.03 0.00 -1.05 0.00 0.00 32.46 29.15 2e9x n ARG 1007CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2e9x s VAL 1008N -1.21 3.41 0.80 8.89 1.01 -1.26 -4.99 120.40 127.05 2e9x s VAL 1008Ca 0.62 0.86 -0.12 0.00 0.00 0.00 0.00 61.98 63.34 2e9x s VAL 1008Cb -0.45 -3.55 0.07 0.00 0.00 0.00 0.00 36.38 32.45 2e9x s VAL 1008CO 0.56 0.01 1.15 -1.61 0.00 0.00 0.00 175.10 175.21 2e9x s GLU 1009N 2.28 2.09 0.41 2.72 2.02 -1.26 -4.50 118.70 122.46 2e9x s GLU 1009Ca 0.67 0.27 -0.23 0.00 0.02 0.00 0.00 54.97 55.70 2e9x s GLU 1009Cb -0.35 -1.95 -0.10 0.00 0.10 0.00 0.00 34.13 31.83 2e9x s GLU 1009CO 0.29 -1.54 1.00 0.45 0.02 0.00 0.00 175.26 175.48 2e9x s SER 1010N -4.39 6.84 0.00 -0.19 0.15 -1.26 -4.60 113.70 110.25 2e9x s SER 1010Ca 0.61 1.87 0.00 0.00 0.70 0.00 0.00 55.95 59.13 2e9x s SER 1010Cb -0.12 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2e9x s SER 1010CO 0.51 -0.43 0.48 0.61 1.20 0.00 0.00 173.24 175.61 2e9x n GLY 1011N -0.04 -0.30 0.21 9.45 0.00 -1.26 -4.82 105.19 108.43 2e9x n GLY 1011Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2e9x n GLY 1011CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e9x h ALA 1012N 0.00 1.04 0.00 4.61 0.00 -1.90 -1.57 119.26 121.44 2e9x h ALA 1012Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2e9x h ALA 1012Cb 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2e9x h ALA 1012CO 0.00 -0.04 -0.01 -0.07 0.00 0.00 0.00 179.25 179.13 2e9x h LEU 1013N 0.00 0.00 0.00 0.00 3.38 -1.87 -3.38 115.31 113.45 2e9x h LEU 1013Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2e9x h LEU 1013Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2e9x h LEU 1013CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2e9x n GLY 1014N 0.73 1.98 0.16 0.83 0.00 -0.59 -4.95 105.19 103.34 2e9x n GLY 1014Ca 0.03 -2.02 -0.05 0.00 0.00 0.00 0.00 46.02 43.97 2e9x n GLY 1014CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2e9x h PRO 1015N 0.00 0.04 -4.98 1.61 0.11 -1.88 -3.45 132.00 123.45 2e9x h PRO 1015Ca 0.00 -0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.79 2e9x h PRO 1015Cb 0.00 -0.01 -0.17 0.00 0.11 0.00 0.00 31.00 30.93 2e9x h PRO 1015CO 0.00 0.03 -0.73 -1.21 -0.21 0.00 0.00 178.00 175.88 2e9x s GLU 1016N -6.20 0.88 0.57 1.05 0.41 -1.26 -5.00 118.70 109.14 2e9x s GLU 1016Ca -0.14 -1.21 -0.08 0.00 -0.41 0.00 0.00 54.97 53.14 2e9x s GLU 1016Cb 0.13 -0.54 -0.03 0.00 -1.78 0.00 0.00 34.13 31.91 2e9x s GLU 1016CO 0.70 0.08 0.92 -1.83 -0.49 0.00 0.00 175.26 174.65 2e9x s GLU 1017N -2.96 3.46 -0.12 1.61 -1.05 -1.26 -4.12 118.70 114.27 2e9x s GLU 1017Ca 0.07 0.43 -0.28 0.00 -0.15 0.00 0.00 54.97 55.04 2e9x s GLU 1017Cb -0.02 -2.22 -0.01 0.00 -0.44 0.00 0.00 34.13 31.44 2e9x s GLU 1017CO -0.00 -0.46 0.96 -0.80 0.95 0.00 0.00 175.26 175.90 2e9x s ASN 1018N -4.17 7.17 0.24 0.83 0.01 -1.26 -4.87 114.94 112.89 2e9x s ASN 1018Ca 0.52 1.44 -0.07 0.00 -0.71 0.00 0.00 52.86 54.04 2e9x s ASN 1018Cb -0.11 -2.53 0.42 0.00 0.41 0.00 0.00 41.25 39.45 2e9x s ASN 1018CO 0.49 -0.42 1.65 0.15 -1.51 0.00 0.00 177.10 177.46 2e9x h PHE 1019N 7.13 0.02 -0.20 2.20 3.57 -1.95 -1.79 116.94 125.92 2e9x h PHE 1019Ca -0.31 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.24 2e9x h PHE 1019Cb 1.15 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2e9x h PHE 1019CO 0.71 -0.20 0.00 1.28 -2.23 0.00 0.00 178.31 177.87 2e9x n LEU 1020N -5.30 2.07 -4.64 0.59 4.77 -1.26 -4.90 117.00 108.34 2e9x n LEU 1020Ca 0.13 -0.86 -0.43 0.00 -0.03 0.00 0.00 56.01 54.82 2e9x n LEU 1020Cb 0.45 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.39 2e9x n LEU 1020CO 0.07 0.43 1.15 -0.55 -1.33 0.00 0.00 177.39 177.16 2e9x s SER 1021N -1.58 6.69 0.24 -1.43 0.15 -0.67 -4.75 113.70 112.34 2e9x s SER 1021Ca 0.34 1.33 -0.06 0.00 0.70 0.00 0.00 55.95 58.26 2e9x s SER 1021Cb 0.19 -2.54 0.24 0.00 -1.71 0.00 0.00 66.02 62.20 2e9x s SER 1021CO 0.28 -1.04 1.85 -0.07 1.20 0.00 0.00 173.24 175.45 2e9x h LEU 1022N 10.76 1.08 -0.88 3.45 3.38 -1.89 -1.95 115.31 129.26 2e9x h LEU 1022Ca -0.27 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 2e9x h LEU 1022Cb 1.10 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 2e9x h LEU 1022CO 1.02 0.89 0.17 -0.78 0.09 0.00 0.00 178.44 179.83 2e9x h ASP 1023N 1.19 0.93 0.13 -0.43 3.58 -1.90 -1.49 116.42 118.43 2e9x h ASP 1023Ca 0.29 -0.18 -0.13 0.00 0.42 0.00 0.00 57.03 57.44 2e9x h ASP 1023Cb 0.07 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.87 2e9x h ASP 1023CO -0.04 0.89 -0.45 0.44 -2.88 0.00 0.00 179.24 177.20 2e9x h ASP 1024N 0.96 0.42 -0.36 2.28 3.32 -1.80 -0.59 116.42 120.65 2e9x h ASP 1024Ca 0.21 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 2e9x h ASP 1024Cb 0.32 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2e9x h ASP 1024CO -0.00 0.82 -0.04 0.40 -1.72 0.00 0.00 179.24 178.69 2e9x h ILE 1025N 0.32 1.25 -0.14 0.35 2.04 -0.93 0.10 117.51 120.50 2e9x h ILE 1025Ca 0.02 -1.05 -0.18 0.00 1.00 0.00 0.00 64.86 64.65 2e9x h ILE 1025Cb 0.92 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2e9x h ILE 1025CO 0.08 0.36 -0.67 -0.07 0.00 0.00 0.00 178.15 177.85 2e9x h LEU 1026N 0.71 0.64 0.09 1.44 3.38 -1.04 -3.10 115.31 117.41 2e9x h LEU 1026Ca 0.13 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2e9x h LEU 1026Cb 0.49 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2e9x h LEU 1026CO 0.03 1.13 -0.04 -0.03 0.09 0.00 0.00 178.44 179.62 2e9x h MET 1027N 0.39 -0.11 0.00 1.13 4.05 -0.64 -2.89 114.93 116.86 2e9x h MET 1027Ca -0.02 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 2e9x h MET 1027Cb 1.25 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.07 2e9x h MET 1027CO 0.12 0.13 0.00 -1.13 0.23 0.00 0.00 176.91 176.27 2e9x n SER 1028N -5.03 0.00 0.03 1.39 3.41 0.30 -1.80 113.62 111.92 2e9x n SER 1028Ca -0.08 -0.86 0.03 0.00 -0.26 0.00 0.00 58.87 57.69 2e9x n SER 1028Cb 0.16 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.03 2e9x n SER 1028CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2e9x n HIS 1029N -0.72 0.82 -1.75 7.33 -0.00 -1.09 -1.57 115.22 118.24 2e9x n HIS 1029Ca 0.06 0.27 -0.42 0.00 -0.00 0.00 0.00 57.72 57.63 2e9x n HIS 1029Cb 0.03 -1.00 -0.00 0.00 -0.00 0.00 0.00 29.99 29.01 2e9x n HIS 1029CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2e9x n GLU 1030N -2.78 2.49 -1.89 1.57 1.02 -0.75 -4.44 120.64 115.87 2e9x n GLU 1030Ca -0.09 0.87 -0.33 0.00 -0.02 0.00 0.00 57.16 57.60 2e9x n GLU 1030Cb 0.78 -2.56 0.03 0.00 -0.02 0.00 0.00 31.44 29.67 2e9x n GLU 1030CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2e9x s LYS 1031N -2.03 3.03 -0.03 3.49 1.02 -1.26 -1.31 119.74 122.65 2e9x s LYS 1031Ca 0.54 1.33 -0.02 0.00 0.02 0.00 0.00 55.97 57.84 2e9x s LYS 1031Cb -0.51 -1.99 0.02 0.00 -0.52 0.00 0.00 37.83 34.84 2e9x s LYS 1031CO 0.63 -1.06 0.07 -1.17 -0.92 0.00 0.00 175.35 172.90 2e9x s LEU 1032N -4.67 1.39 0.04 3.17 2.96 0.19 -4.81 118.68 116.94 2e9x s LEU 1032Ca 0.66 0.13 -0.30 0.00 -0.22 0.00 0.00 54.13 54.40 2e9x s LEU 1032Cb -0.19 0.16 -0.07 0.00 0.50 0.00 0.00 46.19 46.60 2e9x s LEU 1032CO 0.39 -0.07 1.53 -2.84 -1.32 0.00 0.00 176.35 174.04 2e9x s PRO 1033N 0.53 4.24 0.05 0.98 0.02 -1.26 -0.87 135.00 138.68 2e9x s PRO 1033Ca -0.04 2.16 -0.03 0.00 0.02 0.00 0.00 61.00 63.10 2e9x s PRO 1033Cb -0.06 -3.59 -0.02 0.00 0.02 0.00 0.00 34.50 30.85 2e9x s PRO 1033CO -0.02 -0.66 0.03 0.08 -0.33 0.00 0.00 177.00 176.10 2e9x s VAL 1034N 2.53 0.17 -0.10 3.83 1.01 0.21 -1.28 120.40 126.77 2e9x s VAL 1034Ca 0.69 -1.42 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 2e9x s VAL 1034Cb -0.36 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 34.88 2e9x s VAL 1034CO 0.29 -0.78 -0.07 -0.60 0.00 0.00 0.00 175.10 173.94 2e9x s ARG 1035N -3.25 1.36 0.42 2.72 3.52 -0.78 0.17 118.95 123.11 2e9x s ARG 1035Ca 0.01 -0.20 -0.26 0.00 -0.13 0.00 0.00 55.73 55.14 2e9x s ARG 1035Cb 0.03 -1.44 -0.08 0.00 -1.56 0.00 0.00 34.95 31.90 2e9x s ARG 1035CO -0.08 -0.24 1.32 0.95 -0.81 0.00 0.00 175.30 176.45 2e9x s THR 1036N 1.61 2.52 -1.08 4.11 -4.23 -0.89 -1.88 115.64 115.80 2e9x s THR 1036Ca 0.02 0.46 0.12 0.00 -1.18 0.00 0.00 61.69 61.11 2e9x s THR 1036Cb -0.13 -3.27 0.29 0.00 1.34 0.00 0.00 72.50 70.74 2e9x s THR 1036CO -0.06 0.06 1.21 -0.62 -0.54 0.00 0.00 174.62 174.67 2e9x n GLU 1037N 0.02 2.53 -3.49 3.99 -0.58 0.53 0.29 120.64 123.93 2e9x n GLU 1037Ca 0.04 -1.96 -0.13 0.00 -0.42 0.00 0.00 57.16 54.70 2e9x n GLU 1037Cb 0.43 -1.28 -0.03 0.00 -0.57 0.00 0.00 31.44 29.99 2e9x n GLU 1037CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2e9x s THR 1038N -1.00 0.00 0.51 2.62 2.01 -1.25 -4.87 115.64 113.66 2e9x s THR 1038Ca 0.23 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 62.05 2e9x s THR 1038Cb 0.13 -1.00 -0.07 0.00 0.01 0.00 0.00 72.50 71.56 2e9x s THR 1038CO 0.17 0.00 1.03 0.00 -0.69 0.00 0.00 174.62 175.13 2e9x s ALA 1039N -2.59 2.87 -0.38 7.40 0.00 -1.26 -4.37 121.76 123.43 2e9x s ALA 1039Ca -0.02 0.49 0.02 0.00 0.00 0.00 0.00 51.96 52.46 2e9x s ALA 1039Cb -0.01 -3.23 0.11 0.00 0.00 0.00 0.00 23.12 20.00 2e9x s ALA 1039CO -0.04 -0.40 0.14 -1.64 0.00 0.00 0.00 175.76 173.82 2e9x s MET 1040N -3.53 1.32 0.33 0.00 -1.94 -0.61 -4.92 119.30 109.95 2e9x s MET 1040Ca 0.65 -1.81 -0.28 0.00 -1.71 0.00 0.00 55.69 52.53 2e9x s MET 1040Cb -0.15 -2.72 -0.12 0.00 2.01 0.00 0.00 34.83 33.85 2e9x s MET 1040CO 0.25 -1.03 1.30 -2.30 -0.01 0.00 0.00 175.02 173.23 2e9x n PRO 1041N 4.07 2.11 -3.59 2.03 -0.02 -1.26 -0.52 135.00 137.82 2e9x n PRO 1041Ca 0.03 0.74 -0.23 0.00 -2.02 0.00 0.00 63.50 62.03 2e9x n PRO 1041Cb 0.39 -2.33 0.08 0.00 -0.02 0.00 0.00 33.50 31.61 2e9x n PRO 1041CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2e9x n ARG 1042N 0.76 -7.36 0.00 -0.52 1.74 0.89 -4.80 116.66 107.36 2e9x n ARG 1042Ca 0.06 0.81 0.00 0.00 -0.77 0.00 0.00 57.85 57.94 2e9x n ARG 1042Cb 0.35 -5.83 0.00 0.00 -1.02 0.00 0.00 32.46 25.97 2e9x n ARG 1042CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2e9x n LEU 1043N -4.76 0.00 0.29 0.55 4.77 -1.11 -4.84 117.00 111.91 2e9x n LEU 1043Ca -0.07 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.09 2e9x n LEU 1043Cb 0.59 0.00 0.90 0.00 -2.33 0.00 0.00 43.42 42.58 2e9x n LEU 1043CO 0.65 0.00 1.15 1.23 -1.33 0.00 0.00 177.39 179.09 2e9x h GLY 1044N 0.00 0.00 2.00 -0.72 0.00 -1.35 -0.99 103.07 102.01 2e9x h GLY 1044Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2e9x h GLY 1044CO 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.52 2e9x h ALA 1045N 1.56 1.54 -0.00 3.60 0.00 -1.89 -0.75 119.26 123.32 2e9x h ALA 1045Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2e9x h ALA 1045Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2e9x h ALA 1045CO -0.00 0.02 -0.34 1.19 0.00 0.00 0.00 179.25 180.12 2e9x n PHE 1046N -3.89 0.00 0.03 0.00 3.72 -0.37 -5.26 117.46 111.68 2e9x n PHE 1046Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2e9x n PHE 1046Cb 0.10 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 2e9x n PHE 1046CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2e9x n PHE 1047N -1.02 -0.49 -0.39 1.38 3.01 -0.29 -5.18 117.46 114.47 2e9x n PHE 1047Ca 0.10 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.64 2e9x n PHE 1047Cb 0.34 0.52 0.00 0.00 -0.01 0.00 0.00 39.48 40.33 2e9x n PHE 1047CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2e9x n ASP 1057N -2.68 0.00 -2.21 4.37 8.00 -1.26 -5.07 116.55 117.71 2e9x n ASP 1057Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 2e9x n ASP 1057Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 2e9x n ASP 1057CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2e9x n ASN 1058N 0.10 -5.81 -4.23 -2.24 2.85 -1.26 -0.08 115.26 104.60 2e9x n ASN 1058Ca 0.00 0.09 -0.29 0.00 -0.11 0.00 0.00 54.58 54.27 2e9x n ASN 1058Cb 0.00 -4.88 0.21 0.00 1.24 0.00 0.00 39.78 36.35 2e9x n ASN 1058CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2e9x s ALA 1059N -2.98 0.74 -0.29 5.20 0.00 -1.26 -1.37 121.76 121.80 2e9x s ALA 1059Ca 0.00 -0.68 -0.08 0.00 0.00 0.00 0.00 51.96 51.20 2e9x s ALA 1059Cb 0.00 -2.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 2e9x s ALA 1059CO 0.00 -3.26 0.10 0.08 0.00 0.00 0.00 175.76 172.68 2e9x s VAL 1060N -2.99 4.28 0.67 0.00 1.01 0.32 -3.98 120.40 119.70 2e9x s VAL 1060Ca 0.68 -0.47 -0.17 0.00 0.00 0.00 0.00 61.98 62.02 2e9x s VAL 1060Cb -0.14 -3.15 -0.07 0.00 0.00 0.00 0.00 36.38 33.02 2e9x s VAL 1060CO 0.57 0.13 0.38 -2.65 0.00 0.00 0.00 175.10 173.53 2e9x n PRO 1061N 4.92 0.31 -1.96 2.72 -0.02 -1.26 -1.57 135.00 138.15 2e9x n PRO 1061Ca -0.15 0.13 -0.30 0.00 -2.02 0.00 0.00 63.50 61.16 2e9x n PRO 1061Cb 0.49 -1.65 0.01 0.00 -0.02 0.00 0.00 33.50 32.33 2e9x n PRO 1061CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2e9x s GLN 1062N -2.33 3.49 -0.25 -0.52 -2.07 -1.26 -3.65 119.66 113.06 2e9x s GLN 1062Ca 0.64 0.64 0.00 0.00 -1.82 0.00 0.00 55.36 54.82 2e9x s GLN 1062Cb -0.38 -2.11 0.00 0.00 -1.09 0.00 0.00 33.01 29.43 2e9x s GLN 1062CO 0.59 -0.59 0.00 0.41 -1.32 0.00 0.00 175.29 174.38 2e9x n GLY 1063N -2.73 0.44 3.76 2.60 0.00 0.14 -4.95 105.19 104.46 2e9x n GLY 1063Ca 0.06 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 2e9x n GLY 1063CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e9x s SER 1064N -2.18 7.20 -0.38 1.61 0.01 -1.24 -4.71 113.70 114.01 2e9x s SER 1064Ca 0.00 2.22 -0.22 0.00 1.31 0.00 0.00 55.95 59.26 2e9x s SER 1064Cb 0.00 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.62 2e9x s SER 1064CO 0.00 -0.18 0.74 -0.54 0.41 0.00 0.00 173.24 173.66 2e9x s LYS 1065N -1.60 3.64 0.16 12.44 1.02 -1.26 -2.09 119.74 132.06 2e9x s LYS 1065Ca 0.46 0.13 0.07 0.00 0.02 0.00 0.00 55.97 56.66 2e9x s LYS 1065Cb -0.30 -3.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.13 2e9x s LYS 1065CO 0.39 -0.88 -0.16 -0.51 -0.92 0.00 0.00 175.35 173.27 2e9x s LEU 1066N 3.02 2.45 -0.36 3.17 1.43 0.13 -4.98 118.68 123.54 2e9x s LEU 1066Ca 0.29 -0.88 -0.03 0.00 -1.03 0.00 0.00 54.13 52.48 2e9x s LEU 1066Cb -0.13 -0.69 0.08 0.00 0.03 0.00 0.00 46.19 45.48 2e9x s LEU 1066CO 0.18 -0.11 0.11 -1.61 0.23 0.00 0.00 176.35 175.15 2e9x s GLU 1067N -2.97 2.21 0.05 1.70 2.02 -1.26 0.67 118.70 121.13 2e9x s GLU 1067Ca 0.15 -1.55 0.05 0.00 0.02 0.00 0.00 54.97 53.65 2e9x s GLU 1067Cb -0.04 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2e9x s GLU 1067CO 0.05 -0.86 -0.09 -0.51 0.02 0.00 0.00 175.26 173.87 2e9x s LEU 1068N 1.20 3.04 0.61 1.80 1.43 -0.05 -4.73 118.68 121.98 2e9x s LEU 1068Ca 0.02 -0.29 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 2e9x s LEU 1068Cb -0.21 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 2e9x s LEU 1068CO -0.02 0.23 1.31 -2.16 0.23 0.00 0.00 176.35 175.93 2e9x s PRO 1069N -1.78 2.81 0.33 1.29 0.04 -1.26 0.54 135.00 136.96 2e9x s PRO 1069Ca 0.19 2.10 0.08 0.00 0.04 0.00 0.00 61.00 63.41 2e9x s PRO 1069Cb -0.11 -2.00 0.80 0.00 0.04 0.00 0.00 34.50 33.23 2e9x s PRO 1069CO 0.10 -1.41 1.80 1.25 0.04 0.00 0.00 177.00 178.79 2e9x h LEU 1070N 0.91 0.71 -0.63 -3.56 5.85 -0.87 -1.65 115.31 116.06 2e9x h LEU 1070Ca -0.51 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.22 2e9x h LEU 1070Cb 1.32 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 2e9x h LEU 1070CO 0.55 0.28 0.13 4.11 -0.34 0.00 0.00 178.44 183.16 2e9x h TRP 1071N 0.71 1.08 -0.08 1.25 5.08 -1.60 -0.18 115.95 122.21 2e9x h TRP 1071Ca 0.54 -0.14 -0.03 0.00 1.08 0.00 0.00 58.89 60.34 2e9x h TRP 1071Cb 0.92 -0.30 -0.00 0.00 -3.00 0.00 0.00 29.16 26.77 2e9x h TRP 1071CO -0.00 0.91 -0.06 1.25 -1.28 0.00 0.00 178.44 179.25 2e9x h LEU 1072N 0.94 0.20 -0.66 0.11 5.85 -1.70 -1.94 115.31 118.11 2e9x h LEU 1072Ca 0.19 -0.46 0.11 0.00 0.84 0.00 0.00 57.88 58.56 2e9x h LEU 1072Cb 0.39 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.29 2e9x h LEU 1072CO 0.01 0.61 0.25 0.00 -0.34 0.00 0.00 178.44 178.98 2e9x h ALA 1073N 0.59 0.87 -0.12 1.25 0.00 -1.22 -0.90 119.26 119.73 2e9x h ALA 1073Ca 0.02 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2e9x h ALA 1073Cb 0.55 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2e9x h ALA 1073CO 0.02 -0.19 0.02 0.87 0.00 0.00 0.00 179.25 179.97 2e9x h LYS 1074N 0.43 0.07 -0.82 0.00 1.57 -0.94 -2.16 116.57 114.72 2e9x h LYS 1074Ca 0.34 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.17 2e9x h LYS 1074Cb 0.44 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 2e9x h LYS 1074CO -0.33 0.04 0.51 0.78 -0.57 0.00 0.00 179.45 179.88 2e9x h GLY 1075N 0.07 1.22 0.74 3.86 0.00 -0.40 -2.61 103.07 105.94 2e9x h GLY 1075Ca 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2e9x h GLY 1075CO -0.08 0.28 -0.12 1.04 0.00 0.00 0.00 176.54 177.66 2e9x n LEU 1076N -4.63 0.58 -4.89 3.11 4.77 -0.48 -4.92 117.00 110.55 2e9x n LEU 1076Ca 0.11 -0.06 -0.29 0.00 -0.03 0.00 0.00 56.01 55.74 2e9x n LEU 1076Cb 0.14 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 2e9x n LEU 1076CO 0.32 0.11 0.37 0.12 -1.33 0.00 0.00 177.39 176.97 2e9x s PHE 1077N -2.43 3.49 -0.02 -1.77 5.36 -0.82 -4.03 117.98 117.76 2e9x s PHE 1077Ca 0.30 0.87 -0.29 0.00 -0.96 0.00 0.00 56.93 56.85 2e9x s PHE 1077Cb 0.20 -2.31 0.09 0.00 -0.34 0.00 0.00 43.02 40.66 2e9x s PHE 1077CO 0.47 -0.05 0.76 0.16 -1.46 0.00 0.00 175.22 175.09 2e9x s ASP 1078N -3.35 -0.54 0.36 6.13 1.47 -1.26 -5.01 116.67 114.47 2e9x s ASP 1078Ca 0.48 0.40 0.19 0.00 1.18 0.00 0.00 52.55 54.80 2e9x s ASP 1078Cb -0.10 0.48 1.27 0.00 -0.34 0.00 0.00 42.92 44.23 2e9x s ASP 1078CO 0.33 -0.63 1.59 0.78 0.68 0.00 0.00 175.17 177.92 2e9x h ASN 1079N 2.56 0.26 -3.92 2.11 -0.26 -1.96 -3.40 115.58 110.97 2e9x h ASN 1079Ca -0.26 0.26 -0.50 0.00 -0.56 0.00 0.00 56.30 55.24 2e9x h ASN 1079Cb 1.19 0.28 0.04 0.00 -1.06 0.00 0.00 38.32 38.78 2e9x h ASN 1079CO 0.36 -0.40 0.24 -0.54 -1.06 0.00 0.00 177.43 176.03 2e9x s LYS 1080N -5.58 3.59 -0.03 0.81 1.02 -1.26 -4.95 119.74 113.34 2e9x s LYS 1080Ca -0.09 0.46 0.00 0.00 0.02 0.00 0.00 55.97 56.36 2e9x s LYS 1080Cb 0.33 -2.25 0.05 0.00 -0.52 0.00 0.00 37.83 35.44 2e9x s LYS 1080CO 0.78 -0.34 1.06 0.54 -0.92 0.00 0.00 175.35 176.47 2e9x n ARG 1081N -2.38 1.10 -0.13 1.68 1.74 -1.26 -4.60 116.66 112.81 2e9x n ARG 1081Ca 0.03 -0.23 -0.08 0.00 -0.77 0.00 0.00 57.85 56.80 2e9x n ARG 1081Cb 0.55 -1.10 -0.06 0.00 -1.02 0.00 0.00 32.46 30.83 2e9x n ARG 1081CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2e9x h ARG 1082N 0.08 -0.17 0.00 5.56 3.08 -1.92 -3.37 114.38 117.63 2e9x h ARG 1082Ca 0.05 0.01 -0.32 0.00 0.07 0.00 0.00 59.98 59.79 2e9x h ARG 1082Cb 1.13 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 31.17 2e9x h ARG 1082CO 0.08 -0.12 -2.12 -0.89 -1.07 0.00 0.00 179.97 175.85 2e9x n ILE 1083N -4.32 1.11 -4.20 2.04 5.41 -1.26 -4.39 119.36 113.75 2e9x n ILE 1083Ca -0.01 -0.34 -0.13 0.00 1.00 0.00 0.00 62.75 63.26 2e9x n ILE 1083Cb 0.19 -1.53 -0.10 0.00 -0.71 0.00 0.00 39.64 37.49 2e9x n ILE 1083CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2e9x s LEU 1084N -6.69 2.48 -0.14 1.39 1.02 -1.26 -0.35 118.68 115.13 2e9x s LEU 1084Ca -0.27 -0.93 0.01 0.00 0.02 0.00 0.00 54.13 52.95 2e9x s LEU 1084Cb 0.09 -0.26 0.02 0.00 0.02 0.00 0.00 46.19 46.07 2e9x s LEU 1084CO 0.40 -0.34 -0.14 -0.94 0.02 0.00 0.00 176.35 175.35 2e9x s SER 1085N -2.86 2.59 0.02 2.29 1.04 -0.79 -4.58 113.70 111.42 2e9x s SER 1085Ca 0.11 -0.46 -0.14 0.00 0.48 0.00 0.00 55.95 55.94 2e9x s SER 1085Cb 0.01 -1.13 -0.06 0.00 0.10 0.00 0.00 66.02 64.94 2e9x s SER 1085CO -0.01 -0.04 0.42 -0.69 0.98 0.00 0.00 173.24 173.90 2e9x s VAL 1086N 1.39 5.01 -0.08 5.02 1.01 -1.26 -1.87 120.40 129.62 2e9x s VAL 1086Ca 0.02 0.80 0.01 0.00 0.00 0.00 0.00 61.98 62.81 2e9x s VAL 1086Cb -0.13 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2e9x s VAL 1086CO -0.08 0.52 -0.09 -0.70 0.00 0.00 0.00 175.10 174.74 2e9x s GLU 1087N -1.25 2.91 0.10 2.72 2.12 -0.40 -5.02 118.70 119.87 2e9x s GLU 1087Ca 0.26 -0.59 -0.30 0.00 0.36 0.00 0.00 54.97 54.69 2e9x s GLU 1087Cb -0.16 -2.59 -0.06 0.00 0.26 0.00 0.00 34.13 31.57 2e9x s GLU 1087CO 0.15 0.54 1.13 -0.51 -0.54 0.00 0.00 175.26 176.03 2e9x s LEU 1088N -0.48 4.41 0.63 2.70 1.43 -1.26 -4.26 118.68 121.85 2e9x s LEU 1088Ca 0.07 2.00 -0.19 0.00 -1.03 0.00 0.00 54.13 54.98 2e9x s LEU 1088Cb -0.12 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.49 2e9x s LEU 1088CO 0.02 -0.35 1.31 -2.84 0.23 0.00 0.00 176.35 174.72 2e9x s PRO 1089N 0.53 2.66 0.37 1.29 0.02 -1.26 -4.85 135.00 133.76 2e9x s PRO 1089Ca 0.54 2.11 0.12 0.00 0.02 0.00 0.00 61.00 63.79 2e9x s PRO 1089Cb -0.28 -1.92 0.91 0.00 0.02 0.00 0.00 34.50 33.22 2e9x s PRO 1089CO 0.31 -1.53 1.84 -0.22 -0.33 0.00 0.00 177.00 177.07 2e9x h LYS 1090N 0.72 0.58 -0.04 5.54 1.63 -1.98 -1.09 116.57 121.94 2e9x h LYS 1090Ca -0.51 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.27 2e9x h LYS 1090Cb 1.33 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.83 2e9x h LYS 1090CO 0.54 0.38 0.07 0.82 -3.45 0.00 0.00 179.45 177.81 2e9x h ILE 1091N 0.60 0.27 -0.41 2.00 2.04 -1.98 -1.25 117.51 118.77 2e9x h ILE 1091Ca 0.50 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.36 2e9x h ILE 1091Cb 0.97 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 2e9x h ILE 1091CO -0.24 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.69 2e9x n TYR 1092N -3.47 0.54 -2.26 1.37 4.02 -0.42 -4.51 117.16 112.44 2e9x n TYR 1092Ca -0.02 -0.38 -0.25 0.00 -0.01 0.00 0.00 57.90 57.23 2e9x n TYR 1092Cb 0.15 -0.01 0.07 0.00 -0.02 0.00 0.00 39.34 39.53 2e9x n TYR 1092CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 2e9x s GLN 1093N -1.10 2.12 0.30 -0.72 -0.21 -0.47 -4.83 119.66 114.75 2e9x s GLN 1093Ca 0.32 -0.37 0.05 0.00 0.02 0.00 0.00 55.36 55.38 2e9x s GLN 1093Cb 0.18 -2.20 0.74 0.00 1.00 0.00 0.00 33.01 32.73 2e9x s GLN 1093CO 0.24 -1.25 1.73 1.49 -2.12 0.00 0.00 175.29 175.38 2e9x h GLU 1094N -0.57 0.55 0.49 2.91 4.81 -1.95 -1.99 114.58 118.83 2e9x h GLU 1094Ca -0.44 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 2e9x h GLU 1094Cb 1.31 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2e9x h GLU 1094CO 0.57 0.37 -0.42 0.78 -0.73 0.00 0.00 179.01 179.58 2e9x h GLY 1095N 0.57 -1.18 1.45 1.92 0.00 -1.94 -1.81 103.07 102.08 2e9x h GLY 1095Ca 0.57 0.53 -0.02 0.00 0.00 0.00 0.00 47.33 48.41 2e9x h GLY 1095CO -0.45 -0.37 0.24 1.49 0.00 0.00 0.00 176.54 177.45 2e9x h TRP 1096N -0.89 0.71 0.00 5.60 4.06 -1.72 -2.13 115.95 121.59 2e9x h TRP 1096Ca -0.06 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.83 2e9x h TRP 1096Cb 0.75 -0.23 -0.00 0.00 -1.00 0.00 0.00 29.16 28.68 2e9x h TRP 1096CO -0.18 0.53 -0.15 0.07 -3.56 0.00 0.00 178.44 175.15 2e9x h ARG 1097N 0.72 0.00 -0.02 0.49 0.11 -1.28 0.66 114.38 115.06 2e9x h ARG 1097Ca 0.18 0.00 -0.26 0.00 0.10 0.00 0.00 59.98 60.00 2e9x h ARG 1097Cb 0.09 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.19 2e9x h ARG 1097CO -0.02 0.15 -0.99 1.15 0.10 0.00 0.00 179.97 180.36 2e9x h THR 1098N 0.00 1.29 -0.64 0.08 2.02 -0.80 -1.72 112.91 113.13 2e9x h THR 1098Ca -0.00 -2.20 -0.06 0.00 0.77 0.00 0.00 66.41 64.91 2e9x h THR 1098Cb 0.74 2.35 -0.03 0.00 -1.74 0.00 0.00 68.15 69.47 2e9x h THR 1098CO 0.02 0.68 0.15 0.58 0.37 0.00 0.00 175.52 177.32 2e9x h VAL 1099N 0.38 1.25 -0.67 3.16 2.07 -1.03 -1.99 116.25 119.43 2e9x h VAL 1099Ca -0.12 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.42 2e9x h VAL 1099Cb 1.64 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 2e9x h VAL 1099CO 0.20 0.35 0.23 -0.26 0.02 0.00 0.00 177.57 178.11 2e9x h PHE 1100N 0.97 1.03 -0.02 1.57 -1.00 -0.84 -2.49 116.94 116.16 2e9x h PHE 1100Ca 0.20 -0.08 -0.00 0.00 2.81 0.00 0.00 57.97 60.90 2e9x h PHE 1100Cb 0.35 -0.31 -0.00 0.00 3.61 0.00 0.00 35.95 39.61 2e9x h PHE 1100CO 0.02 0.81 -0.01 1.03 -1.61 0.00 0.00 178.31 178.56 2e9x h SER 1101N 0.98 0.02 -0.03 2.17 0.87 -0.56 -1.20 113.55 115.79 2e9x h SER 1101Ca 0.22 -0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.63 2e9x h SER 1101Cb 0.25 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2e9x h SER 1101CO -0.01 0.04 -0.49 0.00 -0.53 0.00 0.00 176.83 175.83 2e9x h ALA 1102N 1.97 0.73 -0.39 6.23 0.00 -1.07 -3.43 119.26 123.31 2e9x h ALA 1102Ca 0.01 -0.48 0.11 0.00 0.00 0.00 0.00 54.91 54.54 2e9x h ALA 1102Cb 0.03 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 17.55 2e9x h ALA 1102CO 0.00 0.67 -0.16 0.34 0.00 0.00 0.00 179.25 180.10 2e9x s ASP 1103N -6.89 -0.61 0.51 0.00 2.15 -0.97 -5.04 116.67 105.82 2e9x s ASP 1103Ca -0.08 -0.22 0.27 0.00 0.43 0.00 0.00 52.55 52.96 2e9x s ASP 1103Cb 0.12 0.91 1.37 0.00 -0.30 0.00 0.00 42.92 45.02 2e9x s ASP 1103CO 0.84 -0.08 1.90 -0.65 -0.17 0.00 0.00 175.17 177.01 2e9x h PRO 1104N 6.14 0.10 0.00 4.34 0.11 -1.51 -1.42 132.00 139.75 2e9x h PRO 1104Ca -0.03 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2e9x h PRO 1104Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2e9x h PRO 1104CO -0.04 0.06 0.00 -0.91 -0.21 0.00 0.00 178.00 176.90 2e9x h ASN 1105N 0.10 0.00 1.51 -2.05 -0.26 -1.87 -3.20 115.58 109.81 2e9x h ASN 1105Ca 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.15 2e9x h ASN 1105Cb 1.47 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.73 2e9x h ASN 1105CO -0.05 0.00 0.00 1.62 -1.06 0.00 0.00 177.43 177.94 2e9x h VAL 1106N 0.00 0.00 -3.39 2.81 3.04 -1.64 -3.46 116.25 113.61 2e9x h VAL 1106Ca 0.00 -0.59 -0.55 0.00 -1.01 0.00 0.00 66.70 64.55 2e9x h VAL 1106Cb 0.60 1.57 -0.04 0.00 -2.01 0.00 0.00 31.29 31.40 2e9x h VAL 1106CO 0.00 0.00 0.08 -0.69 -1.01 0.00 0.00 177.57 175.95 2e9x s VAL 1107N -3.18 4.56 -0.76 1.51 1.01 -1.21 -5.02 120.40 117.30 2e9x s VAL 1107Ca 0.08 1.48 -0.20 0.00 0.00 0.00 0.00 61.98 63.34 2e9x s VAL 1107Cb 0.10 -4.03 0.10 0.00 0.00 0.00 0.00 36.38 32.55 2e9x s VAL 1107CO 0.59 0.53 0.98 -0.62 0.00 0.00 0.00 175.10 176.58 2e9x s ASP 1108N -1.05 6.38 0.00 3.32 -1.08 -1.26 -4.88 116.67 118.10 2e9x s ASP 1108Ca 0.33 -1.54 0.25 0.00 -0.52 0.00 0.00 52.55 51.06 2e9x s ASP 1108Cb -0.21 -2.39 1.39 0.00 -1.46 0.00 0.00 42.92 40.25 2e9x s ASP 1108CO 0.23 -1.21 1.84 0.18 0.52 0.00 0.00 175.17 176.73 2e9x n LEU 1109N 6.91 0.00 -0.05 -1.34 4.77 -0.07 -1.93 117.00 125.30 2e9x n LEU 1109Ca 0.07 0.12 -0.18 0.00 -0.03 0.00 0.00 56.01 56.00 2e9x n LEU 1109Cb 0.46 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 41.30 2e9x n LEU 1109CO 0.57 -0.02 0.03 -0.74 -1.33 0.00 0.00 177.39 175.89 2e9x h HIS 1110N 0.00 0.13 -0.56 -1.77 2.76 -1.66 -1.33 115.15 112.72 2e9x h HIS 1110Ca 0.00 -0.10 -0.08 0.00 -2.20 0.00 0.00 60.37 57.99 2e9x h HIS 1110Cb 0.10 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.03 2e9x h HIS 1110CO 0.00 1.23 0.02 0.87 -1.30 0.00 0.00 177.93 178.75 2e9x h LYS 1111N -0.82 0.94 -0.11 5.26 1.57 -1.81 -2.32 116.57 119.28 2e9x h LYS 1111Ca -0.14 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2e9x h LYS 1111Cb 1.26 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2e9x h LYS 1111CO -0.02 0.92 0.00 -1.33 -0.57 0.00 0.00 179.45 178.45 2e9x n MET 1112N -4.20 1.83 0.00 3.15 2.81 -0.81 -4.80 117.12 115.11 2e9x n MET 1112Ca 0.03 -1.23 0.00 0.00 -1.81 0.00 0.00 57.70 54.69 2e9x n MET 1112Cb 0.32 -1.45 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 2e9x n MET 1112CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2e9x n GLY 1113N 1.20 0.82 0.01 3.03 0.00 -0.50 -4.69 105.19 105.07 2e9x n GLY 1113Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2e9x n GLY 1113CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2e9x n PRO 1114N 0.00 0.03 -2.86 1.61 -0.02 -1.20 -4.76 135.00 127.80 2e9x n PRO 1114Ca 0.00 0.13 -0.35 0.00 -2.02 0.00 0.00 63.50 61.26 2e9x n PRO 1114Cb 0.00 -1.54 -0.01 0.00 -0.02 0.00 0.00 33.50 31.92 2e9x n PRO 1114CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2e9x n HIS 1115N -1.60 3.26 0.08 6.00 8.25 -1.26 0.31 115.22 130.26 2e9x n HIS 1115Ca 0.05 -3.23 -0.12 0.00 -0.26 0.00 0.00 57.72 54.17 2e9x n HIS 1115Cb 0.28 -0.89 -0.05 0.00 1.12 0.00 0.00 29.99 30.45 2e9x n HIS 1115CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2e9x h PHE 1116N 3.91 -0.35 -0.21 4.41 3.57 -1.83 0.09 116.94 126.51 2e9x h PHE 1116Ca 0.32 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.73 2e9x h PHE 1116Cb 0.45 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 2e9x h PHE 1116CO 1.06 -0.21 -0.24 1.88 -2.23 0.00 0.00 178.31 178.57 2e9x h TYR 1117N -0.26 0.66 0.04 0.41 -1.99 -1.96 -2.07 116.97 111.80 2e9x h TYR 1117Ca 0.03 -0.21 -0.00 0.00 2.00 0.00 0.00 58.73 60.55 2e9x h TYR 1117Cb 0.29 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.88 2e9x h TYR 1117CO -0.17 0.90 -0.02 0.78 -0.00 0.00 0.00 178.16 179.66 2e9x h GLY 1118N 0.23 -0.05 0.91 3.88 0.00 -1.82 -0.50 103.07 105.71 2e9x h GLY 1118Ca 0.03 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2e9x h GLY 1118CO 0.06 -0.02 0.07 -2.75 0.00 0.00 0.00 176.54 173.90 2e9x h PHE 1119N -0.20 0.22 -0.42 5.60 3.57 -1.07 -2.20 116.94 122.45 2e9x h PHE 1119Ca -0.01 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.50 2e9x h PHE 1119Cb 0.18 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2e9x h PHE 1119CO -0.03 0.26 0.28 0.78 -2.23 0.00 0.00 178.31 177.37 2e9x h GLY 1120N 0.12 0.54 1.39 2.40 0.00 -1.33 -0.32 103.07 105.88 2e9x h GLY 1120Ca 0.05 -0.19 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 2e9x h GLY 1120CO -0.01 0.18 -0.41 0.23 0.00 0.00 0.00 176.54 176.53 2e9x h SER 1121N 0.49 0.71 1.28 0.19 0.87 -0.78 -2.93 113.55 113.38 2e9x h SER 1121Ca 0.16 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 2e9x h SER 1121Cb 0.05 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2e9x h SER 1121CO -0.04 1.03 -0.13 0.00 -0.53 0.00 0.00 176.83 177.16 2e9x n GLN 1122N -4.03 0.23 0.25 2.24 1.13 -0.75 -3.14 117.38 113.31 2e9x n GLN 1122Ca -0.02 0.16 0.14 0.00 -1.94 0.00 0.00 57.00 55.34 2e9x n GLN 1122Cb 0.53 -1.74 0.62 0.00 0.11 0.00 0.00 30.24 29.76 2e9x n GLN 1122CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2e9x h LEU 1123N 0.00 0.00 -0.04 1.08 5.85 -0.88 -2.83 115.31 118.48 2e9x h LEU 1123Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2e9x h LEU 1123Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2e9x h LEU 1123CO 0.00 0.11 0.00 0.18 -0.34 0.00 0.00 178.44 178.39 2e9x n LEU 1124N -3.29 0.03 0.00 2.25 4.77 -1.19 -2.78 117.00 116.79 2e9x n LEU 1124Ca -0.00 0.51 0.12 0.00 -0.03 0.00 0.00 56.01 56.61 2e9x n LEU 1124Cb 0.34 -0.51 0.57 0.00 -2.33 0.00 0.00 43.42 41.50 2e9x n LEU 1124CO 0.30 -0.34 0.89 1.41 -1.33 0.00 0.00 177.39 178.32 2e9x n HIS 1125N -1.53 0.00 -0.62 -1.77 8.25 -1.07 -3.12 115.22 115.37 2e9x n HIS 1125Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.48 2e9x n HIS 1125Cb 0.12 -0.36 0.29 0.00 1.12 0.00 0.00 29.99 31.15 2e9x n HIS 1125CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2e9x n PHE 1126N -1.36 1.91 -3.68 4.41 3.01 -1.12 -4.94 117.46 115.68 2e9x n PHE 1126Ca 0.09 -0.84 -0.21 0.00 1.01 0.00 0.00 57.45 57.50 2e9x n PHE 1126Cb 0.22 -0.54 -0.03 0.00 -0.01 0.00 0.00 39.48 39.13 2e9x n PHE 1126CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2e9x n ASP 1127N 0.17 -0.53 -4.79 4.37 5.75 -1.18 -4.88 116.55 115.46 2e9x n ASP 1127Ca 0.29 -0.73 -0.35 0.00 -0.01 0.00 0.00 54.79 53.99 2e9x n ASP 1127Cb 1.14 -0.90 -0.02 0.00 -1.03 0.00 0.00 41.12 40.31 2e9x n ASP 1127CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2e9x s SER 1128N -3.93 6.18 0.52 -1.12 0.15 -1.26 -4.92 113.70 109.32 2e9x s SER 1128Ca 0.11 2.06 0.22 0.00 0.70 0.00 0.00 55.95 59.03 2e9x s SER 1128Cb -0.06 -2.57 1.40 0.00 -1.71 0.00 0.00 66.02 63.08 2e9x s SER 1128CO 0.56 -0.89 2.13 -0.65 1.20 0.00 0.00 173.24 175.59 2e9x h PRO 1129N 1.62 0.00 -0.27 5.44 0.11 -2.01 -1.82 132.00 135.06 2e9x h PRO 1129Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2e9x h PRO 1129Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2e9x h PRO 1129CO 0.59 0.07 0.00 0.39 -0.21 0.00 0.00 178.00 178.84 2e9x n GLU 1130N -4.12 1.62 -0.25 1.05 1.02 -1.26 -4.45 120.64 114.25 2e9x n GLU 1130Ca -0.03 -0.97 0.05 0.00 -0.02 0.00 0.00 57.16 56.20 2e9x n GLU 1130Cb 0.15 -1.21 0.18 0.00 -0.02 0.00 0.00 31.44 30.54 2e9x n GLU 1130CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2e9x h ASN 1131N 1.58 0.14 -0.58 1.62 4.21 -1.70 0.97 115.58 121.82 2e9x h ASN 1131Ca 0.00 0.13 -0.03 0.00 1.21 0.00 0.00 56.30 57.61 2e9x h ASN 1131Cb 0.36 0.14 -0.03 0.00 -1.12 0.00 0.00 38.32 37.68 2e9x h ASN 1131CO 0.00 0.03 0.27 0.00 -1.29 0.00 0.00 177.43 176.44 2e9x h ALA 1132N 1.58 1.33 -0.10 -0.83 0.00 -1.85 0.10 119.26 119.49 2e9x h ALA 1132Ca 0.41 -0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.95 2e9x h ALA 1132Cb 0.67 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2e9x h ALA 1132CO -0.46 0.51 -0.85 -0.44 0.00 0.00 0.00 179.25 178.02 2e9x h ASP 1133N 0.87 0.85 0.02 0.00 3.45 -1.39 -2.05 116.42 118.17 2e9x h ASP 1133Ca 0.21 -0.60 -0.00 0.00 0.43 0.00 0.00 57.03 57.07 2e9x h ASP 1133Cb 0.13 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 38.64 2e9x h ASP 1133CO -0.02 1.39 -0.01 0.40 -1.57 0.00 0.00 179.24 179.43 2e9x h ILE 1134N 0.45 1.07 -0.19 0.35 2.04 -0.58 -1.30 117.51 119.34 2e9x h ILE 1134Ca -0.07 -0.27 0.03 0.00 1.00 0.00 0.00 64.86 65.55 2e9x h ILE 1134Cb 1.48 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 2e9x h ILE 1134CO 0.17 0.07 0.00 -1.28 0.00 0.00 0.00 178.15 177.11 2e9x h SER 1135N -0.14 -0.07 -0.74 1.72 0.87 -1.00 -1.15 113.55 113.03 2e9x h SER 1135Ca -0.00 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2e9x h SER 1135Cb 0.13 0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 2e9x h SER 1135CO 0.00 -0.01 0.38 -0.61 -0.53 0.00 0.00 176.83 176.06 2e9x h GLN 1136N 0.06 1.07 -0.43 2.24 -0.00 -1.35 -2.59 115.11 114.11 2e9x h GLN 1136Ca 0.09 -0.14 -0.06 0.00 -0.00 0.00 0.00 58.65 58.55 2e9x h GLN 1136Cb 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 27.48 27.37 2e9x h GLN 1136CO -0.15 0.81 0.05 1.03 0.00 0.00 0.00 178.83 180.57 2e9x h SER 1137N 1.07 0.71 -0.47 -0.69 0.87 -0.69 -1.06 113.55 113.28 2e9x h SER 1137Ca 0.26 -0.27 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2e9x h SER 1137Cb 0.08 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 2e9x h SER 1137CO -0.04 0.80 0.31 -0.07 -0.53 0.00 0.00 176.83 177.31 2e9x h LEU 1138N 0.58 0.54 -0.12 2.23 3.38 -1.02 -0.97 115.31 119.94 2e9x h LEU 1138Ca 0.13 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2e9x h LEU 1138Cb 0.41 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2e9x h LEU 1138CO 0.01 0.39 0.04 0.25 0.09 0.00 0.00 178.44 179.23 2e9x h LEU 1139N 0.64 0.17 -1.29 1.67 5.85 -1.34 -2.41 115.31 118.59 2e9x h LEU 1139Ca 0.17 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 2e9x h LEU 1139Cb -0.07 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 2e9x h LEU 1139CO -0.04 0.31 -0.35 1.56 -0.34 0.00 0.00 178.44 179.58 2e9x h GLN 1140N 0.02 0.00 -0.29 1.25 1.08 -1.09 -1.53 115.11 114.55 2e9x h GLN 1140Ca 0.04 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 2e9x h GLN 1140Cb 0.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 2e9x h GLN 1140CO -0.00 0.35 -0.05 1.15 -0.95 0.00 0.00 178.83 179.32 2e9x h THR 1141N 0.00 1.28 -0.40 -0.54 2.02 -1.05 -1.34 112.91 112.88 2e9x h THR 1141Ca -0.00 -1.06 -0.03 0.00 0.77 0.00 0.00 66.41 66.08 2e9x h THR 1141Cb 0.63 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2e9x h THR 1141CO 0.05 0.34 0.13 0.15 0.37 0.00 0.00 175.52 176.55 2e9x h PHE 1142N 0.31 0.64 -0.60 3.16 3.57 -1.13 -2.41 116.94 120.49 2e9x h PHE 1142Ca 0.07 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2e9x h PHE 1142Cb 0.52 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2e9x h PHE 1142CO 0.05 0.60 0.34 0.82 -2.23 0.00 0.00 178.31 177.89 2e9x h ILE 1143N 0.50 1.17 0.00 1.41 2.04 -1.23 -1.09 117.51 120.31 2e9x h ILE 1143Ca 0.13 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2e9x h ILE 1143Cb 0.26 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2e9x h ILE 1143CO -0.00 0.19 0.00 1.23 0.00 0.00 0.00 178.15 179.56 2e9x h GLY 1144N 0.87 0.00 -0.85 5.37 0.00 -0.86 -3.19 103.07 104.40 2e9x h GLY 1144Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2e9x h GLY 1144CO -0.04 0.00 -0.16 0.54 0.00 0.00 0.00 176.54 176.89 2e9x n ARG 1145N -2.82 1.47 -0.03 4.80 1.74 -0.93 -4.55 116.66 116.34 2e9x n ARG 1145Ca 0.03 -1.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.02 2e9x n ARG 1145Cb 0.42 -1.23 -0.03 0.00 -1.02 0.00 0.00 32.46 30.60 2e9x n ARG 1145CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2e9x h PHE 1146N 2.09 -0.20 -0.49 -1.55 3.57 -1.20 -2.33 116.94 116.83 2e9x h PHE 1146Ca 0.00 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 2e9x h PHE 1146Cb 0.52 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2e9x h PHE 1146CO 0.00 -0.13 0.29 -0.09 -2.23 0.00 0.00 178.31 176.15 2e9x h ARG 1147N -0.07 0.66 -0.92 1.11 9.65 -1.83 -0.45 114.38 122.54 2e9x h ARG 1147Ca 0.09 -0.06 0.03 0.00 -1.10 0.00 0.00 59.98 58.94 2e9x h ARG 1147Cb 0.21 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 28.60 2e9x h ARG 1147CO -0.21 0.49 0.60 -0.09 2.80 0.00 0.00 179.97 183.56 2e9x h ARG 1148N 0.65 1.13 -0.37 0.20 9.65 -1.84 0.13 114.38 123.94 2e9x h ARG 1148Ca 0.17 -0.07 -0.16 0.00 -1.10 0.00 0.00 59.98 58.83 2e9x h ARG 1148Cb -0.00 -0.26 -0.01 0.00 -1.39 0.00 0.00 29.97 28.32 2e9x h ARG 1148CO -0.03 0.75 -0.39 0.82 2.80 0.00 0.00 179.97 183.92 2e9x h ILE 1149N 1.17 1.27 -0.25 1.20 2.04 -0.84 -1.82 117.51 120.28 2e9x h ILE 1149Ca 0.36 -1.57 -0.15 0.00 1.00 0.00 0.00 64.86 64.50 2e9x h ILE 1149Cb -0.01 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 2e9x h ILE 1149CO -0.10 0.52 -0.45 -0.03 0.00 0.00 0.00 178.15 178.09 2e9x h MET 1150N 0.73 0.75 0.21 2.37 4.05 -0.58 -1.07 114.93 121.38 2e9x h MET 1150Ca 0.06 -0.47 -0.01 0.00 -0.28 0.00 0.00 59.70 59.00 2e9x h MET 1150Cb 0.99 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.84 2e9x h MET 1150CO 0.10 1.09 -0.10 -0.44 0.23 0.00 0.00 176.91 177.79 2e9x h ASP 1151N 0.48 -0.24 -0.01 1.39 3.32 -0.76 -2.01 116.42 118.60 2e9x h ASP 1151Ca 0.02 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2e9x h ASP 1151Cb 1.05 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.66 2e9x h ASP 1151CO 0.10 -0.16 0.00 0.28 -1.72 0.00 0.00 179.24 177.74 2e9x h SER 1152N -0.29 0.01 0.00 6.45 0.02 -1.36 -0.74 113.55 117.63 2e9x h SER 1152Ca -0.03 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 2e9x h SER 1152Cb 0.22 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 2e9x h SER 1152CO 0.05 0.20 -0.00 0.77 -1.14 0.00 0.00 176.83 176.70 2e9x h SER 1153N -0.18 0.00 -0.68 3.07 4.64 -1.22 -0.53 113.55 118.66 2e9x h SER 1153Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2e9x h SER 1153Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2e9x h SER 1153CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2e9x n GLN 1154N -4.32 3.55 -4.21 4.77 6.02 -0.76 -3.30 117.38 119.13 2e9x n GLN 1154Ca -0.03 -2.86 -0.30 0.00 -0.01 0.00 0.00 57.00 53.80 2e9x n GLN 1154Cb 0.09 -1.84 -0.07 0.00 1.02 0.00 0.00 30.24 29.44 2e9x n GLN 1154CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2e9x n ASN 1155N 1.26 0.45 0.19 1.08 5.15 -0.21 -4.85 115.26 118.33 2e9x n ASN 1155Ca 0.26 -1.19 0.03 0.00 -0.60 0.00 0.00 54.58 53.07 2e9x n ASN 1155Cb 0.84 -2.05 0.37 0.00 -0.53 0.00 0.00 39.78 38.41 2e9x n ASN 1155CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2e9x h ALA 1156N 0.81 1.36 -0.06 5.20 0.00 -1.43 -3.26 119.26 121.88 2e9x h ALA 1156Ca -0.65 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 53.93 2e9x h ALA 1156Cb 1.39 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2e9x h ALA 1156CO 0.69 0.46 0.00 0.66 0.00 0.00 0.00 179.25 181.06 2e9x n TYR 1157N -4.06 0.11 -2.96 0.00 0.53 -1.26 -4.99 117.16 104.54 2e9x n TYR 1157Ca -0.02 -0.59 -0.22 0.00 -1.02 0.00 0.00 57.90 56.05 2e9x n TYR 1157Cb 0.41 -0.07 0.03 0.00 -1.03 0.00 0.00 39.34 38.67 2e9x n TYR 1157CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2e9x n ASN 1158N -0.50 -5.96 -4.87 7.72 3.02 -1.23 -4.98 115.26 108.46 2e9x n ASN 1158Ca 0.05 -0.25 -0.34 0.00 -0.03 0.00 0.00 54.58 54.01 2e9x n ASN 1158Cb 0.36 -4.84 -0.05 0.00 -0.61 0.00 0.00 39.78 34.64 2e9x n ASN 1158CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2e9x s GLU 1159N -5.63 3.78 0.09 3.52 2.02 -1.26 -5.04 118.70 116.19 2e9x s GLU 1159Ca 0.27 0.21 -0.31 0.00 0.02 0.00 0.00 54.97 55.16 2e9x s GLU 1159Cb -0.12 -2.87 -0.07 0.00 0.10 0.00 0.00 34.13 31.17 2e9x s GLU 1159CO 0.33 0.47 1.36 0.34 0.02 0.00 0.00 175.26 177.78 2e9x s ASP 1160N -2.02 6.87 0.00 -0.19 2.15 -1.26 -4.90 116.67 117.32 2e9x s ASP 1160Ca 0.39 2.25 0.26 0.00 0.43 0.00 0.00 52.55 55.88 2e9x s ASP 1160Cb -0.13 -2.58 0.68 0.00 -0.30 0.00 0.00 42.92 40.59 2e9x s ASP 1160CO 0.20 -0.63 1.52 0.35 -0.17 0.00 0.00 175.17 176.45 2e9x n THR 1161N 4.03 0.00 -0.17 1.71 -2.24 -1.26 -4.39 114.28 111.96 2e9x n THR 1161Ca 0.11 -0.07 -0.01 0.00 -2.27 0.00 0.00 64.05 61.81 2e9x n THR 1161Cb 0.43 0.30 0.08 0.00 -2.10 0.00 0.00 70.33 69.04 2e9x n THR 1161CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2e9x h SER 1162N 0.66 -0.05 0.04 3.42 0.87 -2.00 -0.83 113.55 115.66 2e9x h SER 1162Ca 0.00 0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.59 2e9x h SER 1162Cb 0.50 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2e9x h SER 1162CO 0.00 0.00 -0.20 0.00 -0.53 0.00 0.00 176.83 176.10 2e9x h ALA 1163N 1.43 1.35 -0.04 6.23 0.00 -2.01 -2.77 119.26 123.44 2e9x h ALA 1163Ca 0.27 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2e9x h ALA 1163Cb 0.38 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2e9x h ALA 1163CO -0.37 0.44 -0.49 1.25 0.00 0.00 0.00 179.25 180.08 2e9x h LEU 1164N 0.27 0.51 -1.28 0.00 5.85 -1.64 -3.29 115.31 115.73 2e9x h LEU 1164Ca 0.05 -0.70 0.05 0.00 0.84 0.00 0.00 57.88 58.11 2e9x h LEU 1164Cb 0.51 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2e9x h LEU 1164CO 0.03 1.14 0.51 0.58 -0.34 0.00 0.00 178.44 180.36 2e9x h VAL 1165N -0.08 1.08 0.00 1.05 2.07 -1.12 -1.04 116.25 118.21 2e9x h VAL 1165Ca -0.05 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2e9x h VAL 1165Cb 1.17 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2e9x h VAL 1165CO 0.10 0.16 -0.04 0.00 0.02 0.00 0.00 177.57 177.82 2e9x h ALA 1166N 1.56 1.06 -0.04 1.67 0.00 -1.56 -2.53 119.26 119.43 2e9x h ALA 1166Ca 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2e9x h ALA 1166Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2e9x h ALA 1166CO -0.10 0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.73 2e9x n ARG 1167N -3.22 2.24 -3.23 0.00 1.74 -0.42 -4.52 116.66 109.25 2e9x n ARG 1167Ca -0.01 -1.90 -0.35 0.00 -0.77 0.00 0.00 57.85 54.82 2e9x n ARG 1167Cb 0.23 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 30.16 2e9x n ARG 1167CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2e9x s LEU 1168N -1.93 4.29 0.69 0.55 1.43 -0.95 -0.89 118.68 121.87 2e9x s LEU 1168Ca 0.28 1.23 -0.10 0.00 -1.03 0.00 0.00 54.13 54.50 2e9x s LEU 1168Cb 0.20 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.90 2e9x s LEU 1168CO 0.29 0.02 1.06 1.51 0.23 0.00 0.00 176.35 179.46 2e9x s ASP 1169N -1.81 5.42 0.26 2.29 -4.77 -1.26 -3.91 116.67 112.90 2e9x s ASP 1169Ca 0.43 1.02 -0.02 0.00 -3.30 0.00 0.00 52.55 50.68 2e9x s ASP 1169Cb -0.15 -1.84 0.56 0.00 -1.09 0.00 0.00 42.92 40.40 2e9x s ASP 1169CO 0.20 -1.32 1.68 -0.33 0.70 0.00 0.00 175.17 176.10 2e9x h GLU 1170N -0.58 0.28 -0.58 2.11 4.39 -0.45 0.80 114.58 120.56 2e9x h GLU 1170Ca -0.45 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.14 2e9x h GLU 1170Cb 1.26 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 2e9x h GLU 1170CO 0.63 0.19 0.01 1.98 -1.16 0.00 0.00 179.01 180.66 2e9x h MET 1171N 0.29 1.01 -0.44 2.33 4.05 -1.93 -2.16 114.93 118.08 2e9x h MET 1171Ca 0.47 -0.32 -0.08 0.00 -0.28 0.00 0.00 59.70 59.49 2e9x h MET 1171Cb 0.85 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.54 2e9x h MET 1171CO -0.54 1.00 -0.06 0.93 0.23 0.00 0.00 176.91 178.47 2e9x h GLU 1172N 0.90 0.76 -0.78 0.39 5.08 -1.50 -1.49 114.58 117.93 2e9x h GLU 1172Ca 0.16 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2e9x h GLU 1172Cb 0.54 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 2e9x h GLU 1172CO 0.03 0.81 0.34 0.00 -1.00 0.00 0.00 179.01 179.18 2e9x h ARG 1173N 0.70 1.15 -0.41 2.33 3.08 -0.68 0.25 114.38 120.78 2e9x h ARG 1173Ca 0.13 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 2e9x h ARG 1173Cb 0.51 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2e9x h ARG 1173CO 0.03 0.91 0.11 0.78 -1.07 0.00 0.00 179.97 180.73 2e9x h GLY 1174N 1.15 0.70 1.00 0.04 0.00 -0.86 0.44 103.07 105.55 2e9x h GLY 1174Ca 0.27 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 2e9x h GLY 1174CO -0.03 0.40 0.20 -2.00 0.00 0.00 0.00 176.54 175.11 2e9x h LEU 1175N 0.52 0.85 -0.36 3.11 5.85 -0.90 -1.80 115.31 122.59 2e9x h LEU 1175Ca 0.13 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.66 2e9x h LEU 1175Cb 0.29 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2e9x h LEU 1175CO -0.00 0.82 0.23 0.15 -0.34 0.00 0.00 178.44 179.30 2e9x h PHE 1176N 0.83 0.44 -1.01 1.25 3.57 -0.23 -1.84 116.94 119.95 2e9x h PHE 1176Ca 0.19 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.76 2e9x h PHE 1176Cb 0.26 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 2e9x h PHE 1176CO 0.02 0.27 0.65 0.37 -2.23 0.00 0.00 178.31 177.39 2e9x h GLN 1177N 0.47 1.17 -0.52 1.11 4.15 -0.59 -0.71 115.11 120.20 2e9x h GLN 1177Ca 0.14 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 2e9x h GLN 1177Cb -0.04 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.37 2e9x h GLN 1177CO -0.04 0.78 0.07 1.15 -1.93 0.00 0.00 178.83 178.86 2e9x h THR 1178N 1.21 1.25 -0.48 2.39 2.02 -0.80 0.95 112.91 119.46 2e9x h THR 1178Ca 0.42 -0.96 -0.09 0.00 0.77 0.00 0.00 66.41 66.55 2e9x h THR 1178Cb 0.12 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2e9x h THR 1178CO -0.16 0.34 -0.07 1.23 0.37 0.00 0.00 175.52 177.24 2e9x h GLY 1179N 0.74 0.91 0.93 2.16 0.00 -0.73 -1.49 103.07 105.60 2e9x h GLY 1179Ca 0.16 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.73 2e9x h GLY 1179CO 0.01 0.62 -0.15 -1.61 0.00 0.00 0.00 176.54 175.40 2e9x h GLN 1180N 0.77 0.66 -0.12 4.80 4.15 -0.95 -2.07 115.11 122.34 2e9x h GLN 1180Ca 0.14 -0.29 0.00 0.00 0.77 0.00 0.00 58.65 59.27 2e9x h GLN 1180Cb 0.56 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 2e9x h GLN 1180CO 0.03 0.88 0.07 -0.22 -1.93 0.00 0.00 178.83 177.66 2e9x h LYS 1181N 0.42 0.15 -0.81 1.69 3.64 -0.59 0.24 116.57 121.30 2e9x h LYS 1181Ca 0.07 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 2e9x h LYS 1181Cb 0.68 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 2e9x h LYS 1181CO 0.05 0.10 0.38 0.78 -2.27 0.00 0.00 179.45 178.48 2e9x h GLY 1182N 0.15 1.25 0.60 5.01 0.00 -1.26 0.61 103.07 109.43 2e9x h GLY 1182Ca 0.05 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 2e9x h GLY 1182CO -0.02 0.60 -0.09 -2.00 0.00 0.00 0.00 176.54 175.03 2e9x h LEU 1183N 1.15 0.19 -0.23 3.11 7.12 -1.13 -2.85 115.31 122.67 2e9x h LEU 1183Ca 0.28 -0.52 0.04 0.00 0.13 0.00 0.00 57.88 57.81 2e9x h LEU 1183Cb 0.13 -0.05 -0.04 0.00 -0.53 0.00 0.00 40.66 40.16 2e9x h LEU 1183CO -0.03 0.67 -0.03 -1.13 -0.13 0.00 0.00 178.44 177.79 2e9x h ASN 1184N -0.29 -0.16 -0.71 1.25 -1.24 -0.41 -1.29 115.58 112.74 2e9x h ASN 1184Ca 0.01 0.06 0.13 0.00 0.71 0.00 0.00 56.30 57.20 2e9x h ASN 1184Cb 0.63 0.12 -0.09 0.00 0.73 0.00 0.00 38.32 39.71 2e9x h ASN 1184CO 0.02 -0.05 0.28 -0.78 -1.29 0.00 0.00 177.43 175.61 2e9x h ASP 1185N 0.03 0.26 -0.34 1.15 3.58 -0.91 -0.64 116.42 119.55 2e9x h ASP 1185Ca 0.11 0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.63 2e9x h ASP 1185Cb 0.15 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 2e9x h ASP 1185CO -0.21 0.12 0.10 0.15 -2.88 0.00 0.00 179.24 176.52 2e9x h PHE 1186N 0.44 0.56 -0.77 0.28 3.57 -1.14 -1.91 116.94 117.97 2e9x h PHE 1186Ca 0.38 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 2e9x h PHE 1186Cb 0.54 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 2e9x h PHE 1186CO -0.17 0.56 0.36 1.96 -2.23 0.00 0.00 178.31 178.80 2e9x h GLN 1187N 0.40 1.11 -0.51 1.11 4.20 -0.38 -0.30 115.11 120.75 2e9x h GLN 1187Ca 0.11 -0.17 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 2e9x h GLN 1187Cb 0.27 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 2e9x h GLN 1187CO -0.00 0.87 -0.16 0.00 -0.67 0.00 0.00 178.83 178.87 2e9x h TRP 1189N 0.88 0.82 -0.13 0.00 7.01 -0.97 -1.21 115.95 122.35 2e9x h TRP 1189Ca 0.13 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.10 2e9x h TRP 1189Cb 0.73 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 2e9x h TRP 1189CO 0.05 0.51 -0.11 0.93 -2.79 0.00 0.00 178.44 177.03 2e9x h GLU 1190N 0.88 0.21 0.00 2.65 4.39 -0.29 -3.39 114.58 119.02 2e9x h GLU 1190Ca 0.25 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.91 2e9x h GLU 1190Cb -0.06 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 2e9x h GLU 1190CO -0.06 0.33 0.00 1.63 -1.16 0.00 0.00 179.01 179.75 2e9x n LYS 1191N -4.30 0.00 0.00 2.33 5.02 -0.46 -5.09 118.16 115.66 2e9x n LYS 1191Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2e9x n LYS 1191Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2e9x n LYS 1191CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29