#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fqa n THR 1009N 0.00 1.10 -0.00 0.58 -2.24 -1.26 -4.90 114.28 107.55 3fqa n THR 1009Ca 0.00 -2.45 -0.10 0.00 -2.27 0.00 0.00 64.05 59.24 3fqa n THR 1009Cb 0.00 0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 3fqa n THR 1009CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3fqa h ILE 1010N 5.09 0.38 -0.34 2.28 1.08 -1.99 -1.45 117.51 122.56 3fqa h ILE 1010Ca -0.09 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.34 3fqa h ILE 1010Cb 1.50 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.61 3fqa h ILE 1010CO 0.21 0.00 0.01 0.11 -0.69 0.00 0.00 178.15 177.79 3fqa h LYS 1011N -0.33 0.53 -0.12 2.37 1.57 -1.92 -1.96 116.57 116.71 3fqa h LYS 1011Ca 0.10 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 3fqa h LYS 1011Cb 0.48 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 3fqa h LYS 1011CO -0.32 0.54 -0.01 0.77 -0.57 0.00 0.00 179.45 179.86 3fqa h SER 1012N 0.51 0.22 -0.97 0.86 0.02 -1.81 -1.49 113.55 110.88 3fqa h SER 1012Ca 0.11 -0.33 0.06 0.00 -0.84 0.00 0.00 61.79 60.79 3fqa h SER 1012Cb 0.31 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.73 3fqa h SER 1012CO 0.01 0.49 0.63 0.44 -1.14 0.00 0.00 176.83 177.26 3fqa h ASP 1013N -0.06 1.01 -0.17 3.07 3.32 -1.05 0.16 116.42 122.70 3fqa h ASP 1013Ca 0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 3fqa h ASP 1013Cb 0.39 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3fqa h ASP 1013CO 0.01 0.66 0.02 -0.08 -1.72 0.00 0.00 179.24 178.12 3fqa h GLU 1014N 1.15 0.28 -0.44 3.56 4.81 -1.24 -1.20 114.58 121.50 3fqa h GLU 1014Ca 0.41 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.43 3fqa h GLU 1014Cb 0.13 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3fqa h GLU 1014CO -0.15 0.47 -0.25 0.82 -0.73 0.00 0.00 179.01 179.18 3fqa h ILE 1015N 0.05 1.27 -0.41 2.32 2.04 -0.76 -2.70 117.51 119.32 3fqa h ILE 1015Ca 0.05 -1.40 -0.12 0.00 1.00 0.00 0.00 64.86 64.39 3fqa h ILE 1015Cb 0.33 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 3fqa h ILE 1015CO 0.01 0.48 -0.22 0.15 0.00 0.00 0.00 178.15 178.56 3fqa h PHE 1016N 0.79 0.94 -0.37 1.37 3.57 -0.68 -0.64 116.94 121.91 3fqa h PHE 1016Ca 0.10 -0.21 0.01 0.00 3.53 0.00 0.00 57.97 61.39 3fqa h PHE 1016Cb 0.81 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 3fqa h PHE 1016CO 0.05 0.96 0.24 0.00 -2.23 0.00 0.00 178.31 177.33 3fqa h ALA 1017N 1.03 0.47 -0.59 2.41 0.00 -1.12 -2.02 119.26 119.45 3fqa h ALA 1017Ca 0.10 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3fqa h ALA 1017Cb 0.74 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3fqa h ALA 1017CO 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.23 3fqa h ALA 1018N 1.14 0.89 -0.33 0.00 0.00 -1.29 -2.95 119.26 116.72 3fqa h ALA 1018Ca 0.14 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.77 3fqa h ALA 1018Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3fqa h ALA 1018CO -0.04 0.66 0.22 0.00 0.00 0.00 0.00 179.25 180.09 3fqa h ALA 1019N 1.05 1.86 0.00 0.00 0.00 -0.61 -2.11 119.26 119.46 3fqa h ALA 1019Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3fqa h ALA 1019Cb 0.54 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3fqa h ALA 1019CO 0.03 0.10 0.00 1.96 0.00 0.00 0.00 179.25 181.34 3fqa h GLN 1020N 0.36 0.00 0.00 0.00 4.20 -1.19 -0.38 115.11 118.11 3fqa h GLN 1020Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3fqa h GLN 1020Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3fqa h GLN 1020CO -0.03 0.00 -1.14 1.63 -0.67 0.00 0.00 178.83 178.62 3fqa n LYS 1021N -2.37 0.37 -0.09 1.46 5.02 -0.80 -4.40 118.16 117.36 3fqa n LYS 1021Ca 0.01 -0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 3fqa n LYS 1021Cb 0.17 -1.61 -0.13 0.00 -0.02 0.00 0.00 35.03 33.44 3fqa n LYS 1021CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fqa n LEU 1022N -2.09 0.71 -4.12 -0.35 4.77 -0.67 -5.02 117.00 110.24 3fqa n LEU 1022Ca 0.01 -0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 3fqa n LEU 1022Cb 0.47 0.14 -0.12 0.00 -2.33 0.00 0.00 43.42 41.57 3fqa n LEU 1022CO 0.41 0.53 -0.44 -0.04 -1.33 0.00 0.00 177.39 176.52 3fqa s MET 1023N -2.42 0.73 -0.22 3.23 -1.94 -0.24 -5.05 119.30 113.40 3fqa s MET 1023Ca -0.13 -0.81 -0.36 0.00 -1.71 0.00 0.00 55.69 52.68 3fqa s MET 1023Cb 0.06 -0.67 -0.12 0.00 2.01 0.00 0.00 34.83 36.11 3fqa s MET 1023CO 0.65 0.15 1.96 -2.30 -0.01 0.00 0.00 175.02 175.47 3fqa n PRO 1024N 1.56 1.58 -0.82 2.03 -0.02 -1.26 0.44 135.00 138.50 3fqa n PRO 1024Ca -0.21 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 3fqa n PRO 1024Cb 0.55 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3fqa n PRO 1024CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fqa n GLY 1025N 5.08 0.43 2.20 -1.23 0.00 -1.26 -2.99 105.19 107.42 3fqa n GLY 1025Ca 0.30 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 3fqa n GLY 1025CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1026N -1.73 0.86 3.13 -0.02 0.00 0.17 -4.79 105.19 102.81 3fqa n GLY 1026Ca 0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 3fqa n GLY 1026CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fqa s VAL 1027N -2.21 0.18 -1.42 1.61 -7.23 -1.16 -4.65 120.40 105.52 3fqa s VAL 1027Ca 0.00 -1.69 0.26 0.00 -1.81 0.00 0.00 61.98 58.74 3fqa s VAL 1027Cb 0.00 -1.56 0.16 0.00 0.56 0.00 0.00 36.38 35.54 3fqa s VAL 1027CO 0.00 -0.84 1.51 -1.20 -0.31 0.00 0.00 175.10 174.26 3fqa n SER 1028N 0.04 0.78 -3.66 4.85 7.64 -1.26 -4.55 113.62 117.46 3fqa n SER 1028Ca -0.13 -0.60 -0.07 0.00 1.01 0.00 0.00 58.87 59.08 3fqa n SER 1028Cb 0.62 0.18 -0.08 0.00 -1.01 0.00 0.00 64.21 63.91 3fqa n SER 1028CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3fqa s SER 1029N -2.72 -0.73 0.18 6.43 0.15 -1.26 -5.09 113.70 110.66 3fqa s SER 1029Ca 0.19 1.25 -0.15 0.00 0.70 0.00 0.00 55.95 57.93 3fqa s SER 1029Cb 0.18 1.36 0.16 0.00 -1.71 0.00 0.00 66.02 66.02 3fqa s SER 1029CO 0.60 -0.22 1.22 -2.65 1.20 0.00 0.00 173.24 173.38 3fqa n PRO 1030N 4.71 -0.20 0.07 5.44 -0.02 -1.26 -1.57 135.00 142.17 3fqa n PRO 1030Ca -0.17 1.21 0.11 0.00 -2.02 0.00 0.00 63.50 62.63 3fqa n PRO 1030Cb 0.54 -1.79 0.59 0.00 -0.02 0.00 0.00 33.50 32.82 3fqa n PRO 1030CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3fqa h VAL 1031N 0.00 0.93 0.00 -1.45 3.04 -1.98 0.11 116.25 116.89 3fqa h VAL 1031Ca 0.26 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.88 3fqa h VAL 1031Cb 0.45 0.72 0.00 0.00 -2.01 0.00 0.00 31.29 30.46 3fqa h VAL 1031CO -0.78 0.03 0.00 0.54 -1.01 0.00 0.00 177.57 176.36 3fqa n ARG 1032N -4.47 0.04 0.26 4.17 1.74 -0.61 -3.10 116.66 114.69 3fqa n ARG 1032Ca 0.04 0.49 0.10 0.00 -0.77 0.00 0.00 57.85 57.71 3fqa n ARG 1032Cb 0.28 -1.63 0.70 0.00 -1.02 0.00 0.00 32.46 30.79 3fqa n ARG 1032CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3fqa h ALA 1033N 2.08 1.91 -0.02 7.54 0.00 -0.92 -3.44 119.26 126.41 3fqa h ALA 1033Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3fqa h ALA 1033Cb 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3fqa h ALA 1033CO 0.00 -0.02 -0.01 1.19 0.00 0.00 0.00 179.25 180.41 3fqa n PHE 1034N -4.38 0.00 -0.20 0.00 3.01 -1.18 -4.59 117.46 110.12 3fqa n PHE 1034Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 3fqa n PHE 1034Cb 0.10 -1.40 0.09 0.00 -0.01 0.00 0.00 39.48 38.26 3fqa n PHE 1034CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3fqa h LYS 1035N 0.31 0.09 -0.41 -1.08 1.79 -1.89 0.47 116.57 115.84 3fqa h LYS 1035Ca -0.01 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3fqa h LYS 1035Cb 0.69 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 3fqa h LYS 1035CO 0.01 0.06 0.00 -1.13 -1.08 0.00 0.00 179.45 177.31 3fqa n SER 1036N -5.30 1.44 0.00 0.86 3.41 -1.26 -3.86 113.62 108.91 3fqa n SER 1036Ca 0.08 -2.08 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 3fqa n SER 1036Cb 0.34 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 3fqa n SER 1036CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3fqa n VAL 1037N 0.11 0.13 0.00 -3.33 0.24 -0.56 -4.71 118.33 110.21 3fqa n VAL 1037Ca 0.07 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3fqa n VAL 1037Cb 0.27 1.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 3fqa n VAL 1037CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fqa n GLY 1038N -0.07 4.25 0.00 7.63 0.00 -1.00 -4.79 105.19 111.22 3fqa n GLY 1038Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3fqa n GLY 1038CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1039N 0.00 0.64 3.11 -0.02 0.00 0.05 -4.96 105.19 104.00 3fqa n GLY 1039Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3fqa n GLY 1039CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fqa s GLN 1040N -0.84 3.11 0.64 1.61 -0.21 -1.26 -4.89 119.66 117.82 3fqa s GLN 1040Ca 0.00 -3.10 -0.17 0.00 0.02 0.00 0.00 55.36 52.11 3fqa s GLN 1040Cb 0.00 -3.91 -0.01 0.00 1.00 0.00 0.00 33.01 30.09 3fqa s GLN 1040CO 0.00 -1.25 1.20 -2.14 -2.12 0.00 0.00 175.29 170.98 3fqa s PRO 1041N -1.03 2.74 -0.08 2.91 0.02 -1.26 -5.02 135.00 133.27 3fqa s PRO 1041Ca 0.25 1.76 -0.03 0.00 0.02 0.00 0.00 61.00 63.00 3fqa s PRO 1041Cb -0.10 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 3fqa s PRO 1041CO -0.10 -1.37 0.04 0.96 -0.33 0.00 0.00 177.00 176.19 3fqa s ILE 1042N -1.77 4.63 -0.29 2.83 -4.36 -1.26 -4.69 121.20 116.29 3fqa s ILE 1042Ca 0.76 -0.17 -0.17 0.00 -0.26 0.00 0.00 60.65 60.81 3fqa s ILE 1042Cb -0.29 -2.99 -0.03 0.00 1.25 0.00 0.00 42.46 40.41 3fqa s ILE 1042CO 0.37 0.58 0.45 -0.69 0.24 0.00 0.00 174.94 175.89 3fqa s VAL 1043N -0.96 5.10 0.49 8.37 1.01 -1.26 -5.06 120.40 128.10 3fqa s VAL 1043Ca 0.15 0.60 -0.20 0.00 0.00 0.00 0.00 61.98 62.53 3fqa s VAL 1043Cb -0.12 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.38 3fqa s VAL 1043CO 0.04 0.04 1.04 -0.36 0.00 0.00 0.00 175.10 175.86 3fqa s PHE 1044N 2.22 2.99 -0.09 5.22 2.99 -1.26 -1.97 117.98 128.07 3fqa s PHE 1044Ca 0.18 1.57 0.00 0.00 0.00 0.00 0.00 56.93 58.68 3fqa s PHE 1044Cb -0.16 -3.07 -0.06 0.00 0.00 0.00 0.00 43.02 39.73 3fqa s PHE 1044CO 0.10 -0.86 -0.09 -3.47 -0.00 0.00 0.00 175.22 170.90 3fqa n ASP 1045N -1.01 2.97 -3.53 1.36 -0.08 -0.24 -4.75 116.55 111.27 3fqa n ASP 1045Ca 0.09 -0.03 -0.11 0.00 -1.51 0.00 0.00 54.79 53.24 3fqa n ASP 1045Cb 0.52 -0.16 -0.02 0.00 2.34 0.00 0.00 41.12 43.80 3fqa n ASP 1045CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3fqa s ARG 1046N -2.18 1.36 0.03 -0.67 1.70 -1.23 -5.03 118.95 112.93 3fqa s ARG 1046Ca -0.13 -0.58 0.01 0.00 -0.47 0.00 0.00 55.73 54.57 3fqa s ARG 1046Cb 0.03 0.58 -0.02 0.00 -0.57 0.00 0.00 34.95 34.97 3fqa s ARG 1046CO 0.21 -0.60 -0.05 0.14 -1.08 0.00 0.00 175.30 173.92 3fqa s VAL 1047N -3.74 0.28 -0.28 4.99 -7.23 -1.26 -0.92 120.40 112.24 3fqa s VAL 1047Ca 0.04 -0.98 -0.19 0.00 -1.81 0.00 0.00 61.98 59.04 3fqa s VAL 1047Cb -0.02 -0.40 0.09 0.00 0.56 0.00 0.00 36.38 36.61 3fqa s VAL 1047CO -0.08 -0.45 0.78 -0.75 -0.31 0.00 0.00 175.10 174.29 3fqa s LYS 1048N -1.51 0.66 5.52 4.82 2.20 -0.57 -4.48 119.74 126.39 3fqa s LYS 1048Ca -0.14 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 3fqa s LYS 1048Cb -0.10 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 36.42 3fqa s LYS 1048CO -0.00 -0.12 0.00 -0.25 -0.36 0.00 0.00 175.35 174.62 3fqa n ASP 1049N 3.60 0.00 -0.89 1.43 8.00 -0.44 -1.04 116.55 127.21 3fqa n ASP 1049Ca -0.18 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.41 3fqa n ASP 1049Cb 0.57 0.00 0.19 0.00 -0.02 0.00 0.00 41.12 41.86 3fqa n ASP 1049CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fqa n ALA 1050N 10.66 2.33 -2.55 2.24 0.00 -1.26 -0.20 120.51 131.72 3fqa n ALA 1050Ca 0.00 -1.05 -0.24 0.00 0.00 0.00 0.00 53.44 52.15 3fqa n ALA 1050Cb 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 18.73 3fqa n ALA 1050CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3fqa s TYR 1051N -1.12 2.60 0.02 0.00 1.51 -0.20 -0.59 117.35 119.57 3fqa s TYR 1051Ca 0.31 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 56.01 3fqa s TYR 1051Cb 0.17 -1.44 -0.01 0.00 -0.11 0.00 0.00 41.96 40.57 3fqa s TYR 1051CO 0.23 0.49 -0.05 0.00 -1.11 0.00 0.00 175.55 175.10 3fqa s ALA 1052N -2.46 0.40 -0.04 3.71 0.00 -0.61 -1.51 121.76 121.26 3fqa s ALA 1052Ca 0.35 -0.46 0.07 0.00 0.00 0.00 0.00 51.96 51.91 3fqa s ALA 1052Cb -0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 3fqa s ALA 1052CO 0.20 0.01 -0.25 -1.58 0.00 0.00 0.00 175.76 174.14 3fqa s TRP 1053N -0.78 2.34 0.88 0.00 0.51 -0.09 -0.27 118.94 121.52 3fqa s TRP 1053Ca -0.05 -0.55 -0.11 0.00 -2.12 0.00 0.00 56.10 53.26 3fqa s TRP 1053Cb -0.06 -1.52 0.12 0.00 -0.81 0.00 0.00 33.47 31.20 3fqa s TRP 1053CO -0.00 -0.11 1.09 -0.51 -0.51 0.00 0.00 176.95 176.91 3fqa s ASP 1054N -0.41 3.60 0.00 2.95 1.01 0.29 -1.08 116.67 123.02 3fqa s ASP 1054Ca 0.04 1.52 0.29 0.00 0.71 0.00 0.00 52.55 55.11 3fqa s ASP 1054Cb -0.11 -2.21 1.24 0.00 1.01 0.00 0.00 42.92 42.85 3fqa s ASP 1054CO 0.01 -2.57 1.91 0.55 0.21 0.00 0.00 175.17 175.29 3fqa n VAL 1055N -3.84 0.00 0.87 -1.27 3.14 -0.83 -2.35 118.33 114.05 3fqa n VAL 1055Ca 0.07 -0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.55 3fqa n VAL 1055Cb 0.55 -0.44 0.09 0.00 -1.06 0.00 0.00 33.84 32.98 3fqa n VAL 1055CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3fqa n ASP 1056N -1.45 2.73 0.00 6.55 8.00 -1.26 -4.87 116.55 126.24 3fqa n ASP 1056Ca 0.08 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.72 3fqa n ASP 1056Cb 0.32 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 3fqa n ASP 1056CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fqa n GLY 1057N 1.18 0.69 3.74 0.44 0.00 -0.99 -5.05 105.19 105.19 3fqa n GLY 1057Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3fqa n GLY 1057CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fqa s ASN 1058N -2.84 7.20 -0.08 1.61 0.02 -1.26 -4.70 114.94 114.89 3fqa s ASN 1058Ca 0.00 2.18 -0.03 0.00 -1.02 0.00 0.00 52.86 53.99 3fqa s ASN 1058Cb 0.00 -2.61 -0.04 0.00 0.02 0.00 0.00 41.25 38.62 3fqa s ASN 1058CO 0.00 -0.26 0.05 -0.60 0.02 0.00 0.00 177.10 176.31 3fqa s ARG 1059N -0.57 3.10 0.09 -0.60 3.00 -1.26 0.11 118.95 122.82 3fqa s ARG 1059Ca 0.49 -0.36 0.04 0.00 -1.00 0.00 0.00 55.73 54.91 3fqa s ARG 1059Cb -0.31 -2.90 -0.03 0.00 0.00 0.00 0.00 34.95 31.71 3fqa s ARG 1059CO 0.37 0.71 -0.11 0.71 0.00 0.00 0.00 175.30 176.98 3fqa s TYR 1060N -0.97 1.12 -0.38 5.12 1.51 0.63 -4.71 117.35 119.66 3fqa s TYR 1060Ca 0.15 -0.59 -0.18 0.00 -1.01 0.00 0.00 57.07 55.44 3fqa s TYR 1060Cb -0.12 -0.61 0.01 0.00 -0.11 0.00 0.00 41.96 41.13 3fqa s TYR 1060CO 0.05 0.03 0.52 0.42 -1.11 0.00 0.00 175.55 175.45 3fqa s ILE 1061N -2.10 5.00 -0.11 2.71 1.01 -0.48 -1.57 121.20 125.66 3fqa s ILE 1061Ca 0.04 0.15 -0.28 0.00 0.00 0.00 0.00 60.65 60.56 3fqa s ILE 1061Cb -0.05 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 3fqa s ILE 1061CO 0.01 -0.32 0.92 -0.62 0.00 0.00 0.00 174.94 174.93 3fqa s ASP 1062N 1.82 7.15 -0.10 3.58 3.68 0.24 -1.60 116.67 131.43 3fqa s ASP 1062Ca 0.18 1.40 0.13 0.00 2.13 0.00 0.00 52.55 56.40 3fqa s ASP 1062Cb -0.16 -2.51 0.30 0.00 -1.45 0.00 0.00 42.92 39.10 3fqa s ASP 1062CO 0.14 -0.38 1.20 -1.22 0.13 0.00 0.00 175.17 175.05 3fqa n TYR 1063N 4.85 0.31 -0.07 -5.34 4.01 -0.36 -4.55 117.16 116.01 3fqa n TYR 1063Ca 0.06 -0.80 -0.08 0.00 -0.16 0.00 0.00 57.90 56.92 3fqa n TYR 1063Cb 0.49 -0.16 -0.09 0.00 -0.31 0.00 0.00 39.34 39.28 3fqa n TYR 1063CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3fqa n VAL 1064N -0.76 0.89 -3.90 -0.72 0.31 -1.26 -0.55 118.33 112.34 3fqa n VAL 1064Ca 0.14 -0.46 -0.28 0.00 -0.01 0.00 0.00 64.34 63.72 3fqa n VAL 1064Cb 0.60 -0.84 -0.00 0.00 -0.91 0.00 0.00 33.84 32.69 3fqa n VAL 1064CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fqa n GLY 1065N 2.44 -0.46 3.30 2.92 0.00 -1.26 -0.37 105.19 111.75 3fqa n GLY 1065Ca -0.24 0.24 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3fqa n GLY 1065CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3fqa n THR 1066N -4.39 -0.52 -2.47 2.61 5.66 -1.26 -1.29 114.28 112.62 3fqa n THR 1066Ca -0.24 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.67 3fqa n THR 1066Cb 0.65 -1.11 0.01 0.00 -1.55 0.00 0.00 70.33 68.34 3fqa n THR 1066CO 0.00 0.00 0.00 0.79 -3.05 0.00 0.00 175.07 172.81 3fqa n TRP 1067N -3.55 -0.72 0.00 1.09 7.02 0.50 -4.32 117.44 117.46 3fqa n TRP 1067Ca 0.00 0.16 0.00 0.00 -1.02 0.00 0.00 57.50 56.65 3fqa n TRP 1067Cb 0.52 -2.41 0.00 0.00 -2.42 0.00 0.00 31.31 27.00 3fqa n TRP 1067CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3fqa n GLY 1068N -1.05 3.49 0.33 6.99 0.00 -0.41 -5.00 105.19 109.52 3fqa n GLY 1068Ca -0.06 -1.01 0.05 0.00 0.00 0.00 0.00 46.02 45.00 3fqa n GLY 1068CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fqa h PRO 1069N 0.00 0.80 -2.06 1.61 0.11 -1.74 -3.31 132.00 127.41 3fqa h PRO 1069Ca 0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3fqa h PRO 1069Cb 0.00 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 3fqa h PRO 1069CO 0.00 0.53 -0.09 0.00 -0.21 0.00 0.00 178.00 178.23 3fqa n ALA 1070N -2.37 4.26 0.25 -0.75 0.00 -1.18 -4.52 120.51 116.20 3fqa n ALA 1070Ca 0.16 -0.54 0.09 0.00 0.00 0.00 0.00 53.44 53.15 3fqa n ALA 1070Cb 0.34 -1.56 0.64 0.00 0.00 0.00 0.00 19.45 18.86 3fqa n ALA 1070CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3fqa h ILE 1071N 1.51 0.89 -0.10 0.00 2.10 -1.86 -0.21 117.51 119.84 3fqa h ILE 1071Ca 0.06 -0.41 0.00 0.00 1.08 0.00 0.00 64.86 65.59 3fqa h ILE 1071Cb 0.99 1.23 0.00 0.00 -1.09 0.00 0.00 36.82 37.95 3fqa h ILE 1071CO 0.10 0.11 0.00 0.00 -1.08 0.00 0.00 178.15 177.27 3fqa n GLY 1073N 1.19 2.36 3.78 0.00 0.00 -0.09 -4.31 105.19 108.12 3fqa n GLY 1073Ca 0.17 -1.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 3fqa n GLY 1073CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fqa s HIS 1074N -2.53 2.78 -1.51 1.61 3.76 0.72 -3.86 115.29 116.26 3fqa s HIS 1074Ca 0.00 1.55 -0.04 0.00 -0.15 0.00 0.00 55.06 56.41 3fqa s HIS 1074Cb 0.00 -3.29 0.01 0.00 1.11 0.00 0.00 32.58 30.40 3fqa s HIS 1074CO 0.00 -1.46 0.09 0.00 -0.85 0.00 0.00 174.74 172.52 3fqa n ALA 1075N -0.99 -2.08 -1.70 -1.40 0.00 -1.26 -1.32 120.51 111.75 3fqa n ALA 1075Ca 0.10 -0.44 -0.44 0.00 0.00 0.00 0.00 53.44 52.66 3fqa n ALA 1075Cb 0.50 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 3fqa n ALA 1075CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3fqa n HIS 1076N -4.65 2.55 -0.32 0.00 -0.00 -1.25 -4.78 115.22 106.78 3fqa n HIS 1076Ca -0.30 0.11 0.13 0.00 -0.00 0.00 0.00 57.72 57.66 3fqa n HIS 1076Cb 0.68 -2.63 0.31 0.00 -0.00 0.00 0.00 29.99 28.35 3fqa n HIS 1076CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3fqa h PRO 1077N 6.65 0.50 0.00 1.57 0.11 -1.96 -0.73 132.00 138.13 3fqa h PRO 1077Ca -0.44 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.49 3fqa h PRO 1077Cb 1.22 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3fqa h PRO 1077CO 0.93 0.33 -0.73 0.93 -0.21 0.00 0.00 178.00 179.25 3fqa h GLU 1078N 0.51 0.00 -0.08 1.05 5.08 -1.99 -1.32 114.58 117.84 3fqa h GLU 1078Ca 0.56 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.80 3fqa h GLU 1078Cb 1.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.26 3fqa h GLU 1078CO -0.47 0.73 -0.40 0.28 -1.00 0.00 0.00 179.01 178.15 3fqa h VAL 1079N 0.00 1.41 -0.35 3.13 2.07 -1.69 -2.16 116.25 118.66 3fqa h VAL 1079Ca -0.01 -1.79 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 3fqa h VAL 1079Cb 1.30 2.30 -0.02 0.00 -1.52 0.00 0.00 31.29 33.36 3fqa h VAL 1079CO 0.10 0.52 0.21 0.40 0.02 0.00 0.00 177.57 178.82 3fqa h ILE 1080N -0.06 1.11 -0.72 4.57 1.08 -1.17 -1.10 117.51 121.22 3fqa h ILE 1080Ca -0.03 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.20 3fqa h ILE 1080Cb 1.05 0.65 -0.04 0.00 -3.07 0.00 0.00 36.82 35.42 3fqa h ILE 1080CO 0.08 0.11 0.46 -0.08 -0.69 0.00 0.00 178.15 178.03 3fqa h GLU 1081N 0.45 0.96 -0.22 2.37 4.57 -1.28 -0.54 114.58 120.89 3fqa h GLU 1081Ca 0.12 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.16 3fqa h GLU 1081Cb -0.01 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 3fqa h GLU 1081CO -0.02 0.66 -0.17 0.00 -1.18 0.00 0.00 179.01 178.30 3fqa h ALA 1082N 1.25 1.30 -0.22 2.92 0.00 -1.05 -2.65 119.26 120.81 3fqa h ALA 1082Ca 0.26 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3fqa h ALA 1082Cb -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3fqa h ALA 1082CO -0.05 0.47 -0.52 -0.07 0.00 0.00 0.00 179.25 179.08 3fqa h LEU 1083N 0.35 0.83 -0.61 0.00 3.38 -0.54 -2.19 115.31 116.53 3fqa h LEU 1083Ca 0.06 -0.56 0.01 0.00 0.09 0.00 0.00 57.88 57.48 3fqa h LEU 1083Cb 0.51 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3fqa h LEU 1083CO 0.03 1.24 0.40 0.11 0.09 0.00 0.00 178.44 180.32 3fqa h LYS 1084N 0.45 0.79 -0.25 1.13 1.57 -0.91 -0.94 116.57 118.41 3fqa h LYS 1084Ca -0.00 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3fqa h LYS 1084Cb 1.13 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 3fqa h LYS 1084CO 0.11 0.52 0.02 0.28 -0.57 0.00 0.00 179.45 179.82 3fqa h VAL 1085N 0.81 1.24 -0.58 0.50 2.07 -1.50 -3.26 116.25 115.54 3fqa h VAL 1085Ca 0.23 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 3fqa h VAL 1085Cb -0.07 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 3fqa h VAL 1085CO -0.06 0.26 0.23 0.00 0.02 0.00 0.00 177.57 178.03 3fqa h ALA 1086N 0.84 0.75 0.00 1.67 0.00 -1.07 -2.84 119.26 118.61 3fqa h ALA 1086Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3fqa h ALA 1086Cb 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3fqa h ALA 1086CO 0.01 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.61 3fqa n MET 1087N -4.49 0.07 0.27 0.00 0.00 -0.39 -0.99 117.12 111.60 3fqa n MET 1087Ca 0.03 0.43 0.15 0.00 0.00 0.00 0.00 57.70 58.31 3fqa n MET 1087Cb 0.16 -1.68 0.72 0.00 0.00 0.00 0.00 33.22 32.42 3fqa n MET 1087CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 3fqa h GLU 1088N 0.00 0.00 -0.04 3.17 4.57 -1.57 -1.52 114.58 119.20 3fqa h GLU 1088Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3fqa h GLU 1088Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 3fqa h GLU 1088CO 0.00 0.08 0.00 1.63 -1.18 0.00 0.00 179.01 179.54 3fqa n LYS 1089N -3.30 1.80 0.00 1.92 5.02 -0.16 -5.03 118.16 118.41 3fqa n LYS 1089Ca -0.01 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.12 3fqa n LYS 1089Cb 0.29 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 3fqa n LYS 1089CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fqa n GLY 1090N 1.21 2.81 0.11 0.72 0.00 -0.57 -4.95 105.19 104.52 3fqa n GLY 1090Ca 0.18 -1.68 0.07 0.00 0.00 0.00 0.00 46.02 44.59 3fqa n GLY 1090CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3fqa h THR 1091N 0.00 0.20 -2.85 2.61 1.35 -1.89 -3.42 112.91 108.91 3fqa h THR 1091Ca 0.00 -1.38 -0.13 0.00 -0.55 0.00 0.00 66.41 64.34 3fqa h THR 1091Cb 0.00 1.74 -0.25 0.00 -1.73 0.00 0.00 68.15 67.91 3fqa h THR 1091CO 0.00 0.11 -0.30 -0.55 -0.25 0.00 0.00 175.52 174.54 3fqa s SER 1092N -5.59 -0.38 -0.15 5.36 0.15 -1.26 -4.12 113.70 107.71 3fqa s SER 1092Ca -0.01 0.73 -0.02 0.00 0.70 0.00 0.00 55.95 57.35 3fqa s SER 1092Cb 0.09 0.73 -0.09 0.00 -1.71 0.00 0.00 66.02 65.05 3fqa s SER 1092CO 0.79 -0.13 -0.16 0.49 1.20 0.00 0.00 173.24 175.43 3fqa n PHE 1093N 2.99 0.00 -1.00 3.44 3.72 -1.26 -5.01 117.46 120.34 3fqa n PHE 1093Ca -0.14 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.26 3fqa n PHE 1093Cb 0.57 -0.57 -0.00 0.00 -0.94 0.00 0.00 39.48 38.55 3fqa n PHE 1093CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fqa n GLY 1094N 2.51 0.42 3.38 1.37 0.00 -1.26 -5.00 105.19 106.60 3fqa n GLY 1094Ca -0.28 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 3fqa n GLY 1094CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fqa s ALA 1095N -2.00 -0.25 0.57 4.61 0.00 -1.26 -5.15 121.76 118.28 3fqa s ALA 1095Ca 0.00 -0.70 -0.21 0.00 0.00 0.00 0.00 51.96 51.05 3fqa s ALA 1095Cb 0.00 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 3fqa s ALA 1095CO 0.00 -0.68 1.32 -2.14 0.00 0.00 0.00 175.76 174.26 3fqa s PRO 1096N -3.94 3.01 0.04 0.00 0.02 -1.26 -5.04 135.00 127.82 3fqa s PRO 1096Ca 0.14 2.13 -0.00 0.00 0.02 0.00 0.00 61.00 63.30 3fqa s PRO 1096Cb 0.02 -2.13 -0.03 0.00 0.02 0.00 0.00 34.50 32.38 3fqa s PRO 1096CO -0.01 -1.26 -0.04 0.00 -0.33 0.00 0.00 177.00 175.36 3fqa h ALA 1098N 4.06 1.71 -0.12 0.00 0.00 -1.99 -2.47 119.26 120.44 3fqa h ALA 1098Ca -0.33 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.60 3fqa h ALA 1098Cb 1.18 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3fqa h ALA 1098CO 0.50 0.15 0.12 -0.07 0.00 0.00 0.00 179.25 179.95 3fqa h LEU 1099N 0.78 0.00 -0.58 0.00 3.38 -1.97 -1.11 115.31 115.81 3fqa h LEU 1099Ca 0.35 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.23 3fqa h LEU 1099Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3fqa h LEU 1099CO -0.13 0.00 0.01 -0.33 0.09 0.00 0.00 178.44 178.08 3fqa h GLU 1100N 0.00 1.03 -0.45 1.13 5.08 -1.76 -2.24 114.58 117.37 3fqa h GLU 1100Ca 0.06 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 3fqa h GLU 1100Cb 0.29 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3fqa h GLU 1100CO -0.00 1.01 0.26 -0.91 -1.00 0.00 0.00 179.01 178.37 3fqa h ASN 1101N 0.92 0.56 0.43 1.42 4.21 -1.34 -1.64 115.58 120.14 3fqa h ASN 1101Ca 0.17 -0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.58 3fqa h ASN 1101Cb 0.54 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.60 3fqa h ASN 1101CO 0.03 0.47 -0.21 0.58 -1.29 0.00 0.00 177.43 177.01 3fqa h VAL 1102N 0.60 0.56 -0.73 2.81 2.07 -1.27 -1.46 116.25 118.83 3fqa h VAL 1102Ca 0.16 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.65 3fqa h VAL 1102Cb 0.03 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 3fqa h VAL 1102CO -0.03 0.00 0.34 0.25 0.02 0.00 0.00 177.57 178.15 3fqa h LEU 1103N -0.59 0.97 -0.55 2.57 6.46 -1.41 -1.43 115.31 121.33 3fqa h LEU 1103Ca -0.06 -0.14 0.03 0.00 -0.12 0.00 0.00 57.88 57.59 3fqa h LEU 1103Cb 0.46 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.10 3fqa h LEU 1103CO 0.09 0.84 0.31 0.00 -0.62 0.00 0.00 178.44 179.06 3fqa h ALA 1104N 1.16 0.71 -0.59 1.25 0.00 -1.19 0.46 119.26 121.06 3fqa h ALA 1104Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 3fqa h ALA 1104Cb 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3fqa h ALA 1104CO -0.03 0.00 0.09 1.49 0.00 0.00 0.00 179.25 180.81 3fqa h GLU 1105N 0.61 0.97 -0.72 0.00 4.81 -0.99 -1.41 114.58 117.85 3fqa h GLU 1105Ca 0.23 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 3fqa h GLU 1105Cb 0.07 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 3fqa h GLU 1105CO -0.12 0.92 0.30 0.52 -0.73 0.00 0.00 179.01 179.90 3fqa h MET 1106N 0.87 1.07 -0.40 1.92 2.86 -0.58 -1.96 114.93 118.71 3fqa h MET 1106Ca 0.18 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 3fqa h MET 1106Cb 0.42 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 3fqa h MET 1106CO 0.01 0.86 -0.29 0.28 1.06 0.00 0.00 176.91 178.83 3fqa h VAL 1107N 1.05 1.28 -0.79 -2.22 2.07 -0.67 -2.05 116.25 114.91 3fqa h VAL 1107Ca 0.24 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.28 3fqa h VAL 1107Cb 0.19 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3fqa h VAL 1107CO -0.02 0.49 0.38 0.78 0.02 0.00 0.00 177.57 179.22 3fqa h ASN 1108N 0.73 1.03 -0.08 0.57 2.35 -0.98 -0.55 115.58 118.66 3fqa h ASN 1108Ca 0.08 -0.13 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 3fqa h ASN 1108Cb 0.87 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 3fqa h ASN 1108CO 0.08 0.87 -0.36 0.44 -1.65 0.00 0.00 177.43 176.81 3fqa h ASP 1109N 1.11 0.61 -0.09 5.81 3.32 -1.31 -3.31 116.42 122.57 3fqa h ASP 1109Ca 0.27 -0.26 -0.16 0.00 0.02 0.00 0.00 57.03 56.90 3fqa h ASP 1109Cb 0.11 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.50 3fqa h ASP 1109CO -0.03 0.92 -0.58 0.00 -1.72 0.00 0.00 179.24 177.82 3fqa h ALA 1110N 1.12 0.19 -2.75 3.45 0.00 -0.94 -3.44 119.26 116.89 3fqa h ALA 1110Ca 0.05 -0.54 -0.68 0.00 0.00 0.00 0.00 54.91 53.74 3fqa h ALA 1110Cb 0.86 -0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.44 3fqa h ALA 1110CO 0.07 0.43 -0.50 0.08 0.00 0.00 0.00 179.25 179.34 3fqa s VAL 1111N -3.61 5.07 0.12 0.00 1.01 -0.25 -4.00 120.40 118.74 3fqa s VAL 1111Ca -0.12 -0.31 -0.23 0.00 0.00 0.00 0.00 61.98 61.32 3fqa s VAL 1111Cb 0.06 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 3fqa s VAL 1111CO 0.84 -0.01 1.37 -2.65 0.00 0.00 0.00 175.10 174.65 3fqa n PRO 1112N 5.07 -0.32 0.07 2.72 -0.02 -1.26 -1.56 135.00 139.69 3fqa n PRO 1112Ca -0.13 1.34 0.09 0.00 -2.02 0.00 0.00 63.50 62.79 3fqa n PRO 1112Cb 0.49 -1.98 0.39 0.00 -0.02 0.00 0.00 33.50 32.38 3fqa n PRO 1112CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3fqa n SER 1113N -4.68 0.33 -4.55 2.55 3.41 -1.26 -4.71 113.62 104.71 3fqa n SER 1113Ca 0.01 0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 58.79 3fqa n SER 1113Cb 0.19 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.42 3fqa n SER 1113CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3fqa s ILE 1114N -3.17 4.80 -0.02 -1.33 1.01 -0.60 -3.05 121.20 118.83 3fqa s ILE 1114Ca 0.05 0.46 0.13 0.00 0.00 0.00 0.00 60.65 61.28 3fqa s ILE 1114Cb 0.09 -4.19 -0.19 0.00 0.01 0.00 0.00 42.46 38.18 3fqa s ILE 1114CO 0.30 -0.50 0.27 -0.62 0.00 0.00 0.00 174.94 174.39 3fqa n GLU 1115N 6.31 0.43 -3.75 2.79 1.02 -0.68 -4.59 120.64 122.17 3fqa n GLU 1115Ca 0.00 -0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 56.90 3fqa n GLU 1115Cb 0.48 -1.30 -0.11 0.00 -0.02 0.00 0.00 31.44 30.49 3fqa n GLU 1115CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 3fqa s MET 1116N -2.86 0.34 0.15 3.49 0.00 -1.19 -4.88 119.30 114.35 3fqa s MET 1116Ca -0.05 0.50 0.08 0.00 0.00 0.00 0.00 55.69 56.22 3fqa s MET 1116Cb 0.08 0.09 -0.04 0.00 0.00 0.00 0.00 34.83 34.96 3fqa s MET 1116CO 0.52 -0.08 -0.19 0.08 0.00 0.00 0.00 175.02 175.36 3fqa s VAL 1117N 0.53 1.80 -0.07 10.11 1.01 -1.26 -2.74 120.40 129.79 3fqa s VAL 1117Ca -0.03 -1.85 -0.00 0.00 0.00 0.00 0.00 61.98 60.10 3fqa s VAL 1117Cb -0.05 -1.79 0.03 0.00 0.00 0.00 0.00 36.38 34.57 3fqa s VAL 1117CO -0.03 -0.27 -0.02 -0.60 0.00 0.00 0.00 175.10 174.18 3fqa s ARG 1118N -2.63 0.79 0.12 2.72 6.06 -0.73 -5.01 118.95 120.28 3fqa s ARG 1118Ca 0.14 -0.01 -0.22 0.00 -2.50 0.00 0.00 55.73 53.14 3fqa s ARG 1118Cb -0.07 -1.00 -0.07 0.00 0.06 0.00 0.00 34.95 33.87 3fqa s ARG 1118CO 0.06 -0.23 0.67 -0.06 -2.50 0.00 0.00 175.30 173.25 3fqa s PHE 1119N 1.60 3.85 0.00 5.12 0.40 -1.26 -1.92 117.98 125.77 3fqa s PHE 1119Ca -0.00 1.45 0.00 0.00 -0.60 0.00 0.00 56.93 57.78 3fqa s PHE 1119Cb -0.13 -2.63 0.00 0.00 0.51 0.00 0.00 43.02 40.77 3fqa s PHE 1119CO -0.04 0.55 0.00 1.33 0.70 0.00 0.00 175.22 177.76 3fqa n VAL 1120N 1.62 0.00 0.81 -0.44 0.24 -0.10 -4.62 118.33 115.83 3fqa n VAL 1120Ca -0.08 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.31 3fqa n VAL 1120Cb 0.50 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.88 3fqa n VAL 1120CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3fqa n ASN 1121N -2.05 1.91 -3.70 -1.34 4.13 -1.26 -1.29 115.26 111.66 3fqa n ASN 1121Ca 0.00 -1.45 -0.05 0.00 1.68 0.00 0.00 54.58 54.76 3fqa n ASN 1121Cb 0.00 0.39 -0.01 0.00 -1.54 0.00 0.00 39.78 38.62 3fqa n ASN 1121CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3fqa s SER 1122N -2.01 -0.22 0.34 6.41 1.04 -1.26 -2.53 113.70 115.47 3fqa s SER 1122Ca 0.16 -0.31 0.05 0.00 0.48 0.00 0.00 55.95 56.34 3fqa s SER 1122Cb 0.15 0.46 0.61 0.00 0.10 0.00 0.00 66.02 67.34 3fqa s SER 1122CO 0.42 -0.84 1.85 1.23 0.98 0.00 0.00 173.24 176.88 3fqa h GLY 1123N 2.00 0.46 0.95 7.32 0.00 -1.82 -1.89 103.07 110.10 3fqa h GLY 1123Ca -0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3fqa h GLY 1123CO 0.27 0.28 0.19 -0.84 0.00 0.00 0.00 176.54 176.44 3fqa h THR 1124N 0.41 1.17 -0.61 4.70 2.02 -1.95 -0.30 112.91 118.34 3fqa h THR 1124Ca 0.08 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.72 3fqa h THR 1124Cb 0.42 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 3fqa h THR 1124CO 0.02 0.18 0.15 -0.33 0.37 0.00 0.00 175.52 175.91 3fqa h GLU 1125N 0.49 0.97 -0.19 6.66 5.08 -1.88 -1.55 114.58 124.16 3fqa h GLU 1125Ca 0.13 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 3fqa h GLU 1125Cb 0.11 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3fqa h GLU 1125CO -0.02 0.89 0.10 0.00 -1.00 0.00 0.00 179.01 178.98 3fqa h ALA 1126N 1.04 0.25 -0.38 3.43 0.00 -1.02 -1.07 119.26 121.51 3fqa h ALA 1126Ca 0.19 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3fqa h ALA 1126Cb 0.36 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3fqa h ALA 1126CO 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 179.25 179.01 3fqa h MET 1128N 0.58 0.74 -0.47 0.00 -1.53 -1.08 -1.90 114.93 111.28 3fqa h MET 1128Ca 0.12 -0.22 -0.10 0.00 -3.44 0.00 0.00 59.70 56.06 3fqa h MET 1128Cb 0.42 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.38 3fqa h MET 1128CO 0.02 0.80 -0.09 0.00 0.14 0.00 0.00 176.91 177.78 3fqa h ALA 1129N 0.92 0.64 -0.00 0.39 0.00 -0.86 -2.80 119.26 117.55 3fqa h ALA 1129Ca 0.13 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3fqa h ALA 1129Cb 0.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3fqa h ALA 1129CO 0.02 0.52 -0.27 0.28 0.00 0.00 0.00 179.25 179.80 3fqa h VAL 1130N 0.73 1.20 0.07 0.00 2.07 -0.99 0.02 116.25 119.34 3fqa h VAL 1130Ca 0.12 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 3fqa h VAL 1130Cb 0.63 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3fqa h VAL 1130CO 0.04 0.27 -0.03 -0.07 0.02 0.00 0.00 177.57 177.80 3fqa h LEU 1131N 0.00 -0.08 -1.04 2.57 3.38 -1.21 -0.86 115.31 118.07 3fqa h LEU 1131Ca -0.00 -0.41 0.08 0.00 0.09 0.00 0.00 57.88 57.63 3fqa h LEU 1131Cb 0.49 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.19 3fqa h LEU 1131CO 0.04 0.39 0.63 -0.09 0.09 0.00 0.00 178.44 179.50 3fqa h ARG 1132N -0.56 1.07 -0.54 1.13 2.43 -1.23 -1.60 114.38 115.08 3fqa h ARG 1132Ca -0.01 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.99 3fqa h ARG 1132Cb 0.48 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 3fqa h ARG 1132CO 0.01 0.71 -0.07 1.25 -1.51 0.00 0.00 179.97 180.37 3fqa h LEU 1133N 1.11 0.99 -0.53 3.80 5.85 -0.93 -1.47 115.31 124.13 3fqa h LEU 1133Ca 0.44 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.90 3fqa h LEU 1133Cb 0.25 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 3fqa h LEU 1133CO -0.19 1.09 0.18 0.24 -0.34 0.00 0.00 178.44 179.42 3fqa h MET 1134N 0.87 0.34 -0.22 1.25 2.86 -0.17 -1.31 114.93 118.55 3fqa h MET 1134Ca 0.14 -0.02 -0.11 0.00 -2.06 0.00 0.00 59.70 57.66 3fqa h MET 1134Cb 0.62 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 3fqa h MET 1134CO 0.04 0.23 -0.28 0.00 1.06 0.00 0.00 176.91 177.95 3fqa h ARG 1135N 0.35 0.57 -0.90 1.72 3.08 -1.33 -2.62 114.38 115.25 3fqa h ARG 1135Ca 0.26 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3fqa h ARG 1135Cb 0.30 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 3fqa h ARG 1135CO -0.27 0.93 0.48 0.00 -1.07 0.00 0.00 179.97 180.04 3fqa h ALA 1136N 0.64 1.15 -0.07 0.04 0.00 -1.05 0.26 119.26 120.23 3fqa h ALA 1136Ca 0.03 -0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.60 3fqa h ALA 1136Cb 0.86 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3fqa h ALA 1136CO 0.07 0.67 -0.78 -0.92 0.00 0.00 0.00 179.25 178.29 3fqa h TYR 1137N 1.26 0.62 0.00 0.00 3.20 -1.28 -3.32 116.97 117.46 3fqa h TYR 1137Ca 0.32 -0.29 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 3fqa h TYR 1137Cb 0.04 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 3fqa h TYR 1137CO 0.01 1.07 -1.49 0.25 -1.64 0.00 0.00 178.16 176.35 3fqa n THR 1138N -3.83 0.85 -1.00 1.81 -2.24 -0.99 -4.96 114.28 103.92 3fqa n THR 1138Ca -0.05 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 3fqa n THR 1138Cb 0.74 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 3fqa n THR 1138CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fqa n GLY 1139N 1.35 0.49 3.71 3.38 0.00 0.91 -5.02 105.19 110.00 3fqa n GLY 1139Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 3fqa n GLY 1139CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fqa s ARG 1140N -0.13 2.57 -0.14 1.61 0.52 -1.22 -5.04 118.95 117.12 3fqa s ARG 1140Ca 0.00 -1.09 0.16 0.00 -0.52 0.00 0.00 55.73 54.28 3fqa s ARG 1140Cb 0.00 -2.42 -0.22 0.00 0.52 0.00 0.00 34.95 32.82 3fqa s ARG 1140CO 0.00 0.44 0.13 -0.25 0.02 0.00 0.00 175.30 175.64 3fqa n ASP 1141N -0.42 0.85 -4.77 0.23 8.00 -1.23 -4.40 116.55 114.81 3fqa n ASP 1141Ca -0.09 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.03 3fqa n ASP 1141Cb 0.56 1.11 -0.06 0.00 -0.02 0.00 0.00 41.12 42.71 3fqa n ASP 1141CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3fqa s LYS 1142N -2.59 4.64 0.06 -1.24 1.02 -0.63 -4.87 119.74 116.13 3fqa s LYS 1142Ca -0.08 1.32 0.06 0.00 0.02 0.00 0.00 55.97 57.30 3fqa s LYS 1142Cb 0.06 -3.01 -0.03 0.00 -0.52 0.00 0.00 37.83 34.34 3fqa s LYS 1142CO 0.70 0.40 -0.18 0.42 -0.92 0.00 0.00 175.35 175.77 3fqa s ILE 1143N -1.42 1.42 -0.17 2.17 -1.09 -0.62 -0.39 121.20 121.10 3fqa s ILE 1143Ca 0.45 -1.23 -0.03 0.00 -2.23 0.00 0.00 60.65 57.61 3fqa s ILE 1143Cb -0.21 -1.27 -0.02 0.00 -1.58 0.00 0.00 42.46 39.37 3fqa s ILE 1143CO 0.26 0.02 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.31 3fqa s ILE 1144N -0.96 3.66 0.21 2.92 1.01 -0.76 -0.49 121.20 126.79 3fqa s ILE 1144Ca 0.04 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.30 3fqa s ILE 1144Cb -0.09 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.72 3fqa s ILE 1144CO 0.02 0.48 -0.04 -1.59 0.00 0.00 0.00 174.94 173.81 3fqa s LYS 1145N 0.61 1.26 0.06 2.79 -2.85 -0.06 -1.81 119.74 119.75 3fqa s LYS 1145Ca -0.03 -1.61 0.02 0.00 -1.00 0.00 0.00 55.97 53.35 3fqa s LYS 1145Cb -0.15 -0.64 -0.04 0.00 -2.06 0.00 0.00 37.83 34.94 3fqa s LYS 1145CO 0.03 -0.03 0.08 -0.06 0.10 0.00 0.00 175.35 175.46 3fqa s PHE 1146N -3.37 3.22 0.14 1.78 0.08 -1.26 -2.44 117.98 116.13 3fqa s PHE 1146Ca 0.25 0.11 -0.31 0.00 0.12 0.00 0.00 56.93 57.10 3fqa s PHE 1146Cb 0.04 -1.65 -0.09 0.00 -0.57 0.00 0.00 43.02 40.75 3fqa s PHE 1146CO 0.06 0.53 1.52 -1.21 -0.10 0.00 0.00 175.22 176.02 3fqa s GLU 1147N -2.23 4.25 0.00 0.44 2.02 -0.78 -2.51 118.70 119.89 3fqa s GLU 1147Ca 0.28 2.26 0.00 0.00 0.02 0.00 0.00 54.97 57.53 3fqa s GLU 1147Cb -0.12 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 30.88 3fqa s GLU 1147CO 0.20 -0.57 0.00 0.41 0.02 0.00 0.00 175.26 175.33 3fqa n GLY 1148N 3.70 0.40 3.89 -1.39 0.00 -0.51 -4.42 105.19 106.85 3fqa n GLY 1148Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3fqa n GLY 1148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fqa s TYR 1150N -1.82 1.68 -0.36 0.00 5.04 -1.26 -2.53 117.35 118.10 3fqa s TYR 1150Ca 0.45 -0.77 0.10 0.00 -2.44 0.00 0.00 57.07 54.41 3fqa s TYR 1150Cb -0.11 -1.27 0.45 0.00 0.35 0.00 0.00 41.96 41.38 3fqa s TYR 1150CO 0.24 -0.44 1.10 0.72 -1.34 0.00 0.00 175.55 175.83 3fqa n HIS 1151N 4.35 2.56 0.00 4.97 8.25 -1.26 -5.01 115.22 129.09 3fqa n HIS 1151Ca -0.18 -2.72 0.00 0.00 -0.26 0.00 0.00 57.72 54.56 3fqa n HIS 1151Cb 0.51 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.40 3fqa n HIS 1151CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fqa n GLY 1152N -0.47 -0.93 2.14 -1.41 0.00 -1.26 -4.58 105.19 98.68 3fqa n GLY 1152Ca 0.31 -1.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.45 3fqa n GLY 1152CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3fqa n HIS 1153N -0.81 2.90 -2.20 1.61 1.44 -1.26 -4.74 115.22 112.16 3fqa n HIS 1153Ca 0.00 -1.81 -0.38 0.00 -2.01 0.00 0.00 57.72 53.52 3fqa n HIS 1153Cb 0.00 -0.91 -0.01 0.00 0.12 0.00 0.00 29.99 29.19 3fqa n HIS 1153CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3fqa s ALA 1154N -3.29 3.15 0.18 1.59 0.00 -1.26 -4.87 121.76 117.27 3fqa s ALA 1154Ca 0.56 1.06 -0.25 0.00 0.00 0.00 0.00 51.96 53.33 3fqa s ALA 1154Cb 0.47 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 20.24 3fqa s ALA 1154CO 0.10 -0.66 1.56 -0.44 0.00 0.00 0.00 175.76 176.32 3fqa h ASP 1155N 2.55 -1.56 0.00 0.00 5.19 -1.99 -0.71 116.42 119.90 3fqa h ASP 1155Ca -0.49 0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 3fqa h ASP 1155Cb 1.24 0.73 0.00 0.00 0.18 0.00 0.00 39.33 41.48 3fqa h ASP 1155CO 0.62 -0.31 0.08 0.24 -3.12 0.00 0.00 179.24 176.75 3fqa h MET 1156N -0.16 0.00 0.00 3.56 2.86 -1.92 -1.85 114.93 117.42 3fqa h MET 1156Ca 0.21 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.80 3fqa h MET 1156Cb 0.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 3fqa h MET 1156CO -0.77 0.00 -0.75 0.74 1.06 0.00 0.00 176.91 177.19 3fqa h PHE 1157N 0.00 0.00 0.00 -0.22 0.05 -1.46 -3.40 116.94 111.91 3fqa h PHE 1157Ca 0.00 0.00 -0.19 0.00 3.82 0.00 0.00 57.97 61.60 3fqa h PHE 1157Cb 0.16 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.08 3fqa h PHE 1157CO 0.00 0.17 0.78 1.28 -0.18 0.00 0.00 178.31 180.36 3fqa n LEU 1158N -2.90 3.61 -3.81 1.54 7.99 -0.70 -4.54 117.00 118.20 3fqa n LEU 1158Ca -0.00 -2.30 -0.26 0.00 -0.01 0.00 0.00 56.01 53.44 3fqa n LEU 1158Cb 0.62 -0.90 -0.17 0.00 -0.11 0.00 0.00 43.42 42.86 3fqa n LEU 1158CO 0.39 0.73 -0.40 -0.69 -1.51 0.00 0.00 177.39 175.92 3fqa s VAL 1159N 2.30 0.64 -1.48 4.08 1.01 -1.26 -3.62 120.40 122.07 3fqa s VAL 1159Ca 0.39 -0.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.03 3fqa s VAL 1159Cb 0.16 -0.86 0.08 0.00 0.00 0.00 0.00 36.38 35.76 3fqa s VAL 1159CO -0.01 0.15 0.79 0.29 0.00 0.00 0.00 175.10 176.32 3fqa n LYS 1160N 5.05 -4.69 -2.28 2.72 4.01 -1.26 -4.89 118.16 116.82 3fqa n LYS 1160Ca -0.09 0.58 -0.35 0.00 -0.51 0.00 0.00 58.31 57.94 3fqa n LYS 1160Cb 0.49 -5.41 -0.00 0.00 -0.51 0.00 0.00 35.03 29.60 3fqa n LYS 1160CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3fqa s ALA 1161N -3.17 2.76 0.04 7.82 0.00 -1.26 -1.43 121.76 126.51 3fqa s ALA 1161Ca 0.56 0.83 0.00 0.00 0.00 0.00 0.00 51.96 53.35 3fqa s ALA 1161Cb -0.28 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.48 3fqa s ALA 1161CO 0.69 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.14 3fqa n GLY 1162N 0.19 1.81 7.00 0.00 0.00 -1.05 -3.94 105.19 109.20 3fqa n GLY 1162Ca 0.11 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.35 3fqa n GLY 1162CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fqa n SER 1163N 0.00 0.00 0.05 1.61 2.88 0.48 -2.87 113.62 115.77 3fqa n SER 1163Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3fqa n SER 1163Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 3fqa n SER 1163CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3fqa h GLY 1164N 0.00 -0.43 -0.49 0.46 0.00 -1.93 -1.14 103.07 99.53 3fqa h GLY 1164Ca 0.00 0.34 0.26 0.00 0.00 0.00 0.00 47.33 47.93 3fqa h GLY 1164CO 0.00 -0.22 0.31 -2.08 0.00 0.00 0.00 176.54 174.55 3fqa h VAL 1165N -0.42 0.30 0.17 4.60 2.07 -1.81 0.44 116.25 121.59 3fqa h VAL 1165Ca 0.07 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 3fqa h VAL 1165Cb 0.51 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3fqa h VAL 1165CO -0.26 0.04 -0.08 0.00 0.02 0.00 0.00 177.57 177.29 3fqa h ALA 1166N 1.81 -0.22 -0.70 1.67 0.00 -1.37 0.40 119.26 120.84 3fqa h ALA 1166Ca 0.60 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.43 3fqa h ALA 1166Cb 1.26 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.07 3fqa h ALA 1166CO -0.66 -0.47 0.36 1.15 0.00 0.00 0.00 179.25 179.64 3fqa h THR 1167N -0.53 0.89 -0.06 0.00 2.02 0.37 -0.53 112.91 115.07 3fqa h THR 1167Ca -0.02 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.94 3fqa h THR 1167Cb 0.40 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 3fqa h THR 1167CO 0.04 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.22 3fqa n LEU 1168N -4.83 0.86 -3.83 2.58 4.77 0.13 -4.70 117.00 111.98 3fqa n LEU 1168Ca 0.10 -0.34 -0.29 0.00 -0.03 0.00 0.00 56.01 55.46 3fqa n LEU 1168Cb 0.24 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 3fqa n LEU 1168CO 0.26 0.17 0.15 0.61 -1.33 0.00 0.00 177.39 177.25 3fqa n GLY 1169N 1.01 -0.51 3.88 -0.72 0.00 -0.21 -4.97 105.19 103.68 3fqa n GLY 1169Ca 0.17 0.21 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 3fqa n GLY 1169CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fqa s LEU 1170N -7.30 4.03 0.85 0.99 1.02 0.13 -5.02 118.68 113.37 3fqa s LEU 1170Ca 0.65 0.98 -0.07 0.00 0.02 0.00 0.00 54.13 55.71 3fqa s LEU 1170Cb -0.32 -3.80 0.18 0.00 0.02 0.00 0.00 46.19 42.27 3fqa s LEU 1170CO 0.80 -0.22 1.16 -2.16 0.02 0.00 0.00 176.35 175.95 3fqa s PRO 1171N -3.32 1.05 0.07 1.29 0.04 -1.26 -4.72 135.00 128.15 3fqa s PRO 1171Ca 0.49 -0.94 -0.34 0.00 0.04 0.00 0.00 61.00 60.25 3fqa s PRO 1171Cb -0.11 -2.12 -0.13 0.00 0.04 0.00 0.00 34.50 32.19 3fqa s PRO 1171CO 0.26 -1.98 1.70 0.43 0.04 0.00 0.00 177.00 177.44 3fqa n SER 1172N -3.29 3.28 -4.55 6.66 7.64 -1.26 -4.83 113.62 117.27 3fqa n SER 1172Ca 0.17 1.04 -0.41 0.00 1.01 0.00 0.00 58.87 60.68 3fqa n SER 1172Cb 0.60 -1.42 0.02 0.00 -1.01 0.00 0.00 64.21 62.40 3fqa n SER 1172CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3fqa n SER 1173N 4.68 0.36 -4.52 6.43 2.88 -1.24 -5.02 113.62 117.20 3fqa n SER 1173Ca 0.19 0.95 -0.28 0.00 -1.33 0.00 0.00 58.87 58.40 3fqa n SER 1173Cb 0.30 -1.27 0.13 0.00 -0.75 0.00 0.00 64.21 62.62 3fqa n SER 1173CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 3fqa s PRO 1174N -1.95 1.34 0.00 -1.46 0.02 -1.26 -4.28 135.00 127.41 3fqa s PRO 1174Ca 0.65 -0.32 0.00 0.00 0.02 0.00 0.00 61.00 61.35 3fqa s PRO 1174Cb -0.55 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 31.99 3fqa s PRO 1174CO 0.56 -1.92 0.00 0.41 -0.33 0.00 0.00 177.00 175.72 3fqa n GLY 1175N -3.42 0.59 3.28 0.52 0.00 -1.26 -5.00 105.19 99.89 3fqa n GLY 1175Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3fqa n GLY 1175CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fqa s VAL 1176N -2.50 3.58 0.19 1.61 1.01 -1.26 -5.07 120.40 117.96 3fqa s VAL 1176Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 61.98 60.72 3fqa s VAL 1176Cb 0.00 -2.91 -0.16 0.00 0.00 0.00 0.00 36.38 33.32 3fqa s VAL 1176CO 0.00 0.02 1.08 -2.65 0.00 0.00 0.00 175.10 173.56 3fqa n PRO 1177N 4.78 1.05 -0.15 2.72 -0.02 -1.26 -4.83 135.00 137.30 3fqa n PRO 1177Ca -0.14 0.37 0.09 0.00 -2.02 0.00 0.00 63.50 61.80 3fqa n PRO 1177Cb 0.46 -1.81 0.41 0.00 -0.02 0.00 0.00 33.50 32.55 3fqa n PRO 1177CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3fqa h LYS 1178N 2.94 0.59 -0.33 -0.52 6.56 -1.99 -2.29 116.57 121.53 3fqa h LYS 1178Ca -0.42 -0.04 0.07 0.00 -1.06 0.00 0.00 60.65 59.21 3fqa h LYS 1178Cb 1.35 -0.13 -0.07 0.00 -0.57 0.00 0.00 32.23 32.81 3fqa h LYS 1178CO 0.67 0.39 -0.13 0.87 -2.06 0.00 0.00 179.45 179.20 3fqa h LYS 1179N 0.61 -0.06 -0.26 3.15 1.57 -2.00 -1.48 116.57 118.10 3fqa h LYS 1179Ca 0.31 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.90 3fqa h LYS 1179Cb 0.42 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3fqa h LYS 1179CO -0.11 -0.04 -0.60 1.79 -0.57 0.00 0.00 179.45 179.93 3fqa h THR 1180N -0.06 1.28 0.00 -0.16 1.35 -1.78 -3.17 112.91 110.36 3fqa h THR 1180Ca 0.17 -1.78 -0.05 0.00 -0.55 0.00 0.00 66.41 64.19 3fqa h THR 1180Cb 0.32 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.43 3fqa h THR 1180CO -0.38 0.58 -0.24 0.00 -0.25 0.00 0.00 175.52 175.23 3fqa h THR 1181N 0.64 0.76 0.00 6.82 1.03 -1.32 -2.77 112.91 118.06 3fqa h THR 1181Ca 0.00 -0.98 0.00 0.00 -0.01 0.00 0.00 66.41 65.42 3fqa h THR 1181Cb 1.21 1.61 0.00 0.00 -1.07 0.00 0.00 68.15 69.89 3fqa h THR 1181CO 0.13 0.23 0.00 0.00 -0.01 0.00 0.00 175.52 175.87 3fqa n ALA 1182N -2.31 1.32 0.02 0.00 0.00 -0.57 -1.91 120.51 117.06 3fqa n ALA 1182Ca -0.01 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.57 3fqa n ALA 1182Cb 0.36 -1.18 0.27 0.00 0.00 0.00 0.00 19.45 18.90 3fqa n ALA 1182CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3fqa n ASN 1183N -1.72 3.65 -4.34 0.00 3.02 -1.05 -4.82 115.26 110.00 3fqa n ASN 1183Ca 0.01 -1.99 -0.38 0.00 -0.03 0.00 0.00 54.58 52.19 3fqa n ASN 1183Cb 0.09 -0.37 -0.12 0.00 -0.61 0.00 0.00 39.78 38.78 3fqa n ASN 1183CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fqa s THR 1184N -1.27 4.11 -0.09 3.41 2.01 -0.80 -1.58 115.64 121.42 3fqa s THR 1184Ca 0.44 -0.80 -0.09 0.00 0.31 0.00 0.00 61.69 61.55 3fqa s THR 1184Cb 0.24 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 3fqa s THR 1184CO 0.32 -0.04 0.22 -0.76 -0.69 0.00 0.00 174.62 173.68 3fqa s LEU 1185N 1.50 4.41 0.28 4.42 2.01 0.36 -4.99 118.68 126.67 3fqa s LEU 1185Ca 0.02 0.61 0.10 0.00 0.01 0.00 0.00 54.13 54.88 3fqa s LEU 1185Cb -0.18 -2.23 -0.05 0.00 0.01 0.00 0.00 46.19 43.74 3fqa s LEU 1185CO 0.04 0.38 -0.16 0.42 1.01 0.00 0.00 176.35 178.03 3fqa s THR 1186N -0.99 2.25 0.08 5.49 -4.23 -1.26 -0.88 115.64 116.10 3fqa s THR 1186Ca 0.18 -2.32 -0.23 0.00 -1.18 0.00 0.00 61.69 58.14 3fqa s THR 1186Cb -0.13 -2.33 0.06 0.00 1.34 0.00 0.00 72.50 71.43 3fqa s THR 1186CO 0.07 -0.39 0.55 0.28 -0.54 0.00 0.00 174.62 174.59 3fqa s THR 1187N -2.64 0.02 0.54 3.99 -1.32 -1.02 -4.94 115.64 110.26 3fqa s THR 1187Ca 0.29 -0.17 -0.20 0.00 -1.21 0.00 0.00 61.69 60.40 3fqa s THR 1187Cb -0.02 -1.01 -0.06 0.00 -1.51 0.00 0.00 72.50 69.90 3fqa s THR 1187CO 0.14 -0.10 1.14 -2.84 -2.21 0.00 0.00 174.62 170.75 3fqa s PRO 1188N -2.82 3.35 0.58 7.08 0.02 -1.26 -1.86 135.00 140.10 3fqa s PRO 1188Ca -0.03 1.64 -0.19 0.00 0.02 0.00 0.00 61.00 62.44 3fqa s PRO 1188Cb -0.00 -2.02 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 3fqa s PRO 1188CO -0.05 -0.86 1.20 -0.47 -0.33 0.00 0.00 177.00 176.50 3fqa s TYR 1189N -1.74 2.42 -0.84 6.54 5.04 -1.26 -2.97 117.35 124.53 3fqa s TYR 1189Ca 0.73 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.87 3fqa s TYR 1189Cb -0.25 -3.47 0.00 0.00 0.35 0.00 0.00 41.96 38.59 3fqa s TYR 1189CO 0.28 -2.16 0.00 0.09 -1.34 0.00 0.00 175.55 172.42 3fqa n ASN 1190N -1.53 -4.96 -4.09 4.32 5.03 -1.26 -4.66 115.26 108.11 3fqa n ASN 1190Ca 0.13 0.20 -0.36 0.00 0.87 0.00 0.00 54.58 55.42 3fqa n ASN 1190Cb 0.50 -3.16 -0.10 0.00 -1.02 0.00 0.00 39.78 36.00 3fqa n ASN 1190CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3fqa s ASP 1191N -2.45 5.18 0.14 6.41 -1.08 -1.16 -4.93 116.67 118.79 3fqa s ASP 1191Ca 0.00 -2.81 -0.15 0.00 -0.52 0.00 0.00 52.55 49.06 3fqa s ASP 1191Cb 0.00 -1.84 0.01 0.00 -1.46 0.00 0.00 42.92 39.63 3fqa s ASP 1191CO 0.00 -0.37 1.71 -0.07 0.52 0.00 0.00 175.17 176.96 3fqa h LEU 1192N 7.06 0.58 -0.90 -1.34 3.38 -1.93 -3.05 115.31 119.10 3fqa h LEU 1192Ca -0.03 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 57.89 3fqa h LEU 1192Cb 0.95 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.48 3fqa h LEU 1192CO 0.71 0.56 0.54 -0.33 0.09 0.00 0.00 178.44 180.01 3fqa h GLU 1193N 0.56 0.89 -0.45 1.13 4.39 -1.99 0.25 114.58 119.35 3fqa h GLU 1193Ca 0.15 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 3fqa h GLU 1193Cb 0.15 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 3fqa h GLU 1193CO -0.02 0.59 0.13 0.00 -1.16 0.00 0.00 179.01 178.55 3fqa h ALA 1194N 1.47 1.38 -0.19 3.43 0.00 -1.93 -1.61 119.26 121.80 3fqa h ALA 1194Ca 0.43 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3fqa h ALA 1194Cb 0.34 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3fqa h ALA 1194CO -0.23 0.45 -0.21 0.28 0.00 0.00 0.00 179.25 179.54 3fqa h VAL 1195N 0.66 1.34 -0.70 0.00 2.07 -0.92 -2.55 116.25 116.15 3fqa h VAL 1195Ca 0.15 -1.39 0.04 0.00 0.82 0.00 0.00 66.70 66.33 3fqa h VAL 1195Cb 0.22 1.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3fqa h VAL 1195CO -0.01 0.42 0.43 0.11 0.02 0.00 0.00 177.57 178.54 3fqa h LYS 1196N 0.13 0.80 -0.94 1.57 1.57 -0.88 -2.15 116.57 116.67 3fqa h LYS 1196Ca 0.03 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 3fqa h LYS 1196Cb 0.76 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.83 3fqa h LYS 1196CO 0.05 0.53 0.61 0.00 -0.57 0.00 0.00 179.45 180.07 3fqa h ALA 1197N 1.32 1.25 -0.53 3.86 0.00 -1.24 -1.00 119.26 122.91 3fqa h ALA 1197Ca 0.29 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3fqa h ALA 1197Cb 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3fqa h ALA 1197CO -0.13 0.47 0.21 -0.07 0.00 0.00 0.00 179.25 179.74 3fqa h LEU 1198N 1.17 0.70 0.02 0.00 3.38 -0.96 -0.12 115.31 119.51 3fqa h LEU 1198Ca 0.38 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 3fqa h LEU 1198Cb 0.02 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3fqa h LEU 1198CO -0.13 0.63 -0.01 -0.26 0.09 0.00 0.00 178.44 178.76 3fqa h PHE 1199N 0.76 -0.03 -0.87 1.13 -1.00 -1.10 -2.16 116.94 113.66 3fqa h PHE 1199Ca 0.18 -0.00 0.16 0.00 2.81 0.00 0.00 57.97 61.12 3fqa h PHE 1199Cb 0.15 0.01 -0.07 0.00 3.61 0.00 0.00 35.95 39.65 3fqa h PHE 1199CO 0.01 0.59 0.57 0.00 -1.61 0.00 0.00 178.31 177.86 3fqa h ALA 1200N 0.25 1.97 0.00 2.45 0.00 -1.06 0.76 119.26 123.63 3fqa h ALA 1200Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3fqa h ALA 1200Cb 0.63 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3fqa h ALA 1200CO 0.01 -0.22 -0.23 -1.91 0.00 0.00 0.00 179.25 176.89 3fqa n GLU 1201N -4.54 0.23 -2.90 0.00 2.13 -0.07 -4.21 120.64 111.28 3fqa n GLU 1201Ca 0.18 0.14 -0.19 0.00 0.66 0.00 0.00 57.16 57.95 3fqa n GLU 1201Cb 0.54 -1.72 -0.01 0.00 0.27 0.00 0.00 31.44 30.52 3fqa n GLU 1201CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3fqa n ASN 1202N -2.10 2.27 -4.63 4.31 3.02 0.22 -5.07 115.26 113.29 3fqa n ASN 1202Ca 0.05 -3.17 -0.49 0.00 -0.03 0.00 0.00 54.58 50.95 3fqa n ASN 1202Cb 0.42 -0.56 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 3fqa n ASN 1202CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3fqa n PRO 1203N -0.02 1.66 -2.37 3.52 -0.04 -0.96 -2.38 135.00 134.41 3fqa n PRO 1203Ca 0.24 0.60 -0.19 0.00 -0.04 0.00 0.00 63.50 64.10 3fqa n PRO 1203Cb 0.65 -2.29 -0.01 0.00 -0.04 0.00 0.00 33.50 31.81 3fqa n PRO 1203CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fqa n GLY 1204N 2.84 -0.43 0.00 0.55 0.00 -1.26 -4.86 105.19 102.04 3fqa n GLY 1204Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3fqa n GLY 1204CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fqa n GLU 1205N -2.86 2.91 -3.13 1.61 1.02 -1.00 -4.95 120.64 114.24 3fqa n GLU 1205Ca -0.23 -0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.48 3fqa n GLU 1205Cb 0.67 -0.25 -0.07 0.00 -0.02 0.00 0.00 31.44 31.77 3fqa n GLU 1205CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3fqa s ILE 1206N -0.42 4.92 0.17 -3.67 -1.09 -1.26 -1.61 121.20 118.24 3fqa s ILE 1206Ca 0.00 0.56 -0.08 0.00 -2.23 0.00 0.00 60.65 58.90 3fqa s ILE 1206Cb 0.00 -4.05 -0.01 0.00 -1.58 0.00 0.00 42.46 36.82 3fqa s ILE 1206CO 0.00 -0.28 1.54 0.00 -1.23 0.00 0.00 174.94 174.97 3fqa h ALA 1207N 8.44 0.70 0.00 9.38 0.00 -0.97 -3.43 119.26 133.38 3fqa h ALA 1207Ca -0.27 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3fqa h ALA 1207Cb 1.11 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3fqa h ALA 1207CO 0.82 0.67 0.00 0.41 0.00 0.00 0.00 179.25 181.15 3fqa n GLY 1208N -0.03 -1.82 3.28 0.00 0.00 -1.25 -0.48 105.19 104.88 3fqa n GLY 1208Ca -0.01 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 3fqa n GLY 1208CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fqa s VAL 1209N -2.43 2.16 -0.04 1.61 1.01 0.24 -1.82 120.40 121.14 3fqa s VAL 1209Ca 0.00 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.01 3fqa s VAL 1209Cb 0.00 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 3fqa s VAL 1209CO 0.00 0.57 -0.22 -0.51 0.00 0.00 0.00 175.10 174.94 3fqa s ILE 1210N -0.16 1.75 0.24 2.22 2.07 -0.75 -0.24 121.20 126.34 3fqa s ILE 1210Ca -0.04 -0.91 -0.21 0.00 -1.41 0.00 0.00 60.65 58.08 3fqa s ILE 1210Cb -0.14 -1.48 0.03 0.00 0.13 0.00 0.00 42.46 41.00 3fqa s ILE 1210CO 0.04 0.49 0.68 -1.48 -1.91 0.00 0.00 174.94 172.76 3fqa s LEU 1211N -0.20 -0.33 -0.39 8.50 2.34 -0.89 -4.30 118.68 123.41 3fqa s LEU 1211Ca -0.00 -0.44 -0.23 0.00 0.06 0.00 0.00 54.13 53.52 3fqa s LEU 1211Cb -0.11 2.66 0.01 0.00 -0.56 0.00 0.00 46.19 48.19 3fqa s LEU 1211CO 0.02 -1.23 0.78 -1.61 -1.06 0.00 0.00 176.35 173.25 3fqa s GLU 1212N -3.87 3.64 0.42 1.48 2.02 -1.26 -1.23 118.70 119.90 3fqa s GLU 1212Ca 0.08 0.18 0.23 0.00 0.02 0.00 0.00 54.97 55.48 3fqa s GLU 1212Cb -0.04 -3.85 1.23 0.00 0.10 0.00 0.00 34.13 31.57 3fqa s GLU 1212CO 0.01 -0.93 1.73 -1.35 0.02 0.00 0.00 175.26 174.74 3fqa h PRO 1213N 8.64 0.26 -3.54 0.39 0.11 -1.94 -3.30 132.00 132.63 3fqa h PRO 1213Ca -0.25 -0.02 -0.37 0.00 0.11 0.00 0.00 66.00 65.47 3fqa h PRO 1213Cb 1.09 -0.06 -0.37 0.00 0.11 0.00 0.00 31.00 31.77 3fqa h PRO 1213CO 0.93 0.17 -0.75 0.42 -0.21 0.00 0.00 178.00 178.56 3fqa s ILE 1214N -5.39 0.10 0.30 4.15 1.01 -1.26 -4.42 121.20 115.68 3fqa s ILE 1214Ca -0.08 0.24 -0.29 0.00 0.00 0.00 0.00 60.65 60.52 3fqa s ILE 1214Cb 0.26 -0.28 -0.09 0.00 0.01 0.00 0.00 42.46 42.36 3fqa s ILE 1214CO 0.81 0.18 1.09 -0.69 0.00 0.00 0.00 174.94 176.33 3fqa s VAL 1215N 1.73 3.51 0.00 2.92 1.01 -0.17 -4.88 120.40 124.51 3fqa s VAL 1215Ca -0.00 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.44 3fqa s VAL 1215Cb -0.13 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3fqa s VAL 1215CO -0.03 0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3fqa n GLY 1216N 1.08 0.56 1.36 4.51 0.00 -1.24 -1.94 105.19 109.52 3fqa n GLY 1216Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3fqa n GLY 1216CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fqa n ASN 1217N -0.38 3.99 -2.41 1.61 3.02 -1.26 -1.68 115.26 118.15 3fqa n ASN 1217Ca 0.00 -2.24 -0.01 0.00 -0.03 0.00 0.00 54.58 52.31 3fqa n ASN 1217Cb 0.00 -0.50 0.06 0.00 -0.61 0.00 0.00 39.78 38.72 3fqa n ASN 1217CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3fqa n SER 1218N 1.17 0.31 0.00 6.41 3.41 -1.03 0.18 113.62 124.07 3fqa n SER 1218Ca 0.23 -2.08 0.00 0.00 -0.26 0.00 0.00 58.87 56.76 3fqa n SER 1218Cb 0.71 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 3fqa n SER 1218CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fqa n GLY 1219N -0.68 -0.04 3.61 5.00 0.00 -0.76 -4.84 105.19 107.49 3fqa n GLY 1219Ca -0.04 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 3fqa n GLY 1219CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3fqa s PHE 1220N -1.44 3.13 -0.07 1.61 5.36 -1.26 -3.59 117.98 121.72 3fqa s PHE 1220Ca 0.00 0.89 0.00 0.00 -0.96 0.00 0.00 56.93 56.87 3fqa s PHE 1220Cb 0.00 -3.56 0.02 0.00 -0.34 0.00 0.00 43.02 39.14 3fqa s PHE 1220CO 0.00 -0.75 -0.05 0.42 -1.46 0.00 0.00 175.22 173.38 3fqa s ILE 1221N 3.40 0.71 0.11 3.12 1.01 -0.82 -4.85 121.20 123.88 3fqa s ILE 1221Ca 0.39 -0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.81 3fqa s ILE 1221Cb -0.12 -0.74 -0.05 0.00 0.01 0.00 0.00 42.46 41.55 3fqa s ILE 1221CO 0.16 0.29 0.36 -0.69 0.00 0.00 0.00 174.94 175.06 3fqa s VAL 1222N 1.28 5.17 0.34 2.92 1.01 -1.26 -1.00 120.40 128.85 3fqa s VAL 1222Ca -0.05 0.15 -0.27 0.00 0.00 0.00 0.00 61.98 61.81 3fqa s VAL 1222Cb -0.14 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 32.53 3fqa s VAL 1222CO -0.02 0.15 1.08 -2.16 0.00 0.00 0.00 175.10 174.15 3fqa s PRO 1223N -2.34 4.41 0.87 2.72 0.04 -1.26 -4.98 135.00 134.46 3fqa s PRO 1223Ca 0.37 1.68 -0.11 0.00 0.04 0.00 0.00 61.00 62.98 3fqa s PRO 1223Cb -0.13 -2.89 0.12 0.00 0.04 0.00 0.00 34.50 31.64 3fqa s PRO 1223CO 0.22 0.04 1.10 -0.51 0.04 0.00 0.00 177.00 177.88 3fqa s ASP 1224N -1.18 3.56 0.25 6.66 1.01 -1.26 -4.91 116.67 120.81 3fqa s ASP 1224Ca 0.51 1.75 -0.31 0.00 0.71 0.00 0.00 52.55 55.20 3fqa s ASP 1224Cb -0.28 -2.38 -0.13 0.00 1.01 0.00 0.00 42.92 41.14 3fqa s ASP 1224CO 0.35 -2.62 1.49 0.00 0.21 0.00 0.00 175.17 174.60 3fqa n ALA 1225N -3.89 1.68 -0.67 5.23 0.00 -1.26 -1.86 120.51 119.74 3fqa n ALA 1225Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.92 3fqa n ALA 1225Cb 0.54 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.63 3fqa n ALA 1225CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fqa n GLY 1226N 2.30 1.01 0.08 0.00 0.00 -1.26 -4.90 105.19 102.42 3fqa n GLY 1226Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 3fqa n GLY 1226CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3fqa h PHE 1227N 0.00 -0.07 -0.34 1.61 3.57 -1.72 0.97 116.94 120.95 3fqa h PHE 1227Ca 0.00 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 3fqa h PHE 1227Cb 0.00 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3fqa h PHE 1227CO 0.00 0.35 0.08 -0.07 -2.23 0.00 0.00 178.31 176.44 3fqa h LEU 1228N -0.51 0.53 -0.94 0.59 3.38 -1.91 -1.65 115.31 114.79 3fqa h LEU 1228Ca -0.01 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.75 3fqa h LEU 1228Cb 0.45 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 3fqa h LEU 1228CO 0.01 0.63 0.62 -0.33 0.09 0.00 0.00 178.44 179.46 3fqa h GLU 1229N 0.40 1.20 -0.32 1.13 3.07 -1.94 -1.44 114.58 116.68 3fqa h GLU 1229Ca 0.11 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 3fqa h GLU 1229Cb 0.31 -0.27 -0.02 0.00 -0.84 0.00 0.00 28.75 27.94 3fqa h GLU 1229CO 0.00 0.79 0.21 0.78 -1.40 0.00 0.00 179.01 179.39 3fqa h GLY 1230N 1.23 0.45 1.32 -3.84 0.00 -0.43 -1.61 103.07 100.19 3fqa h GLY 1230Ca 0.36 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.50 3fqa h GLY 1230CO -0.10 0.17 0.27 1.41 0.00 0.00 0.00 176.54 178.29 3fqa h LEU 1231N 0.43 0.79 -0.45 3.11 3.38 -0.88 -1.28 115.31 120.41 3fqa h LEU 1231Ca 0.12 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3fqa h LEU 1231Cb -0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3fqa h LEU 1231CO -0.02 0.69 0.21 -0.09 0.09 0.00 0.00 178.44 179.32 3fqa h ARG 1232N 0.87 0.65 -0.14 1.13 1.12 -0.80 -2.22 114.38 114.99 3fqa h ARG 1232Ca 0.21 -0.10 -0.03 0.00 -1.11 0.00 0.00 59.98 58.96 3fqa h ARG 1232Cb 0.12 -0.12 -0.00 0.00 -0.01 0.00 0.00 29.97 29.96 3fqa h ARG 1232CO -0.02 0.56 -0.02 1.49 -3.11 0.00 0.00 179.97 178.87 3fqa h GLU 1233N 0.58 0.26 -0.34 0.20 4.81 -0.81 -2.70 114.58 116.58 3fqa h GLU 1233Ca 0.15 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3fqa h GLU 1233Cb 0.13 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3fqa h GLU 1233CO -0.02 0.52 -0.14 -0.84 -0.73 0.00 0.00 179.01 177.80 3fqa h ILE 1234N -0.03 1.25 -0.54 2.32 3.07 -1.24 -1.46 117.51 120.88 3fqa h ILE 1234Ca 0.04 -1.12 -0.09 0.00 1.55 0.00 0.00 64.86 65.23 3fqa h ILE 1234Cb 0.42 1.14 -0.02 0.00 -0.27 0.00 0.00 36.82 38.09 3fqa h ILE 1234CO 0.01 0.37 -0.03 0.71 -1.05 0.00 0.00 178.15 178.16 3fqa h THR 1235N 0.54 1.27 -0.61 0.16 1.35 -1.42 -2.62 112.91 111.58 3fqa h THR 1235Ca 0.09 -1.16 -0.04 0.00 -0.55 0.00 0.00 66.41 64.75 3fqa h THR 1235Cb 0.56 0.93 -0.03 0.00 -1.73 0.00 0.00 68.15 67.89 3fqa h THR 1235CO 0.04 0.41 0.21 -0.07 -0.25 0.00 0.00 175.52 175.86 3fqa h LEU 1236N 0.85 0.87 -1.85 3.87 3.38 -1.27 0.36 115.31 121.51 3fqa h LEU 1236Ca 0.15 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.98 3fqa h LEU 1236Cb 0.58 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3fqa h LEU 1236CO 0.03 0.83 0.22 -0.08 0.09 0.00 0.00 178.44 179.53 3fqa h GLU 1237N 0.86 0.18 -0.29 1.13 4.81 -1.02 -2.30 114.58 117.96 3fqa h GLU 1237Ca 0.20 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3fqa h GLU 1237Cb 0.25 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.59 3fqa h GLU 1237CO -0.01 0.12 0.00 0.72 -0.73 0.00 0.00 179.01 179.11 3fqa n HIS 1238N -4.48 0.85 -3.55 0.92 8.25 -1.01 -4.96 115.22 111.23 3fqa n HIS 1238Ca 0.04 -0.79 -0.26 0.00 -0.26 0.00 0.00 57.72 56.45 3fqa n HIS 1238Cb 0.26 -0.25 0.04 0.00 1.12 0.00 0.00 29.99 31.16 3fqa n HIS 1238CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3fqa n ASP 1239N -0.25 -5.45 -4.80 0.41 8.00 -0.79 -4.97 116.55 108.70 3fqa n ASP 1239Ca 0.19 -0.55 -0.22 0.00 0.71 0.00 0.00 54.79 54.92 3fqa n ASP 1239Cb 0.79 -4.35 -0.05 0.00 -0.02 0.00 0.00 41.12 37.49 3fqa n ASP 1239CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fqa s ALA 1240N -3.23 3.53 0.14 2.24 0.00 0.12 -4.98 121.76 119.58 3fqa s ALA 1240Ca 0.53 -1.46 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 3fqa s ALA 1240Cb -0.25 -1.22 -0.06 0.00 0.00 0.00 0.00 23.12 21.58 3fqa s ALA 1240CO 0.66 0.25 0.48 -0.51 0.00 0.00 0.00 175.76 176.63 3fqa s LEU 1241N -3.82 4.29 -0.26 0.00 1.02 0.36 -4.21 118.68 116.06 3fqa s LEU 1241Ca 0.33 0.89 -0.06 0.00 0.02 0.00 0.00 54.13 55.31 3fqa s LEU 1241Cb -0.08 -3.28 -0.00 0.00 0.02 0.00 0.00 46.19 42.85 3fqa s LEU 1241CO 0.24 0.08 0.03 -0.22 0.02 0.00 0.00 176.35 176.50 3fqa s LEU 1242N -2.23 3.43 -0.16 1.79 2.96 -1.26 -0.59 118.68 122.61 3fqa s LEU 1242Ca 0.39 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 3fqa s LEU 1242Cb -0.13 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.72 3fqa s LEU 1242CO 0.20 -0.10 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.29 3fqa s VAL 1243N 1.51 2.61 -0.25 1.68 1.01 0.67 -0.50 120.40 127.12 3fqa s VAL 1243Ca 0.04 -0.78 -0.11 0.00 0.00 0.00 0.00 61.98 61.13 3fqa s VAL 1243Cb -0.16 -2.11 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 3fqa s VAL 1243CO 0.01 0.51 0.18 -0.36 0.00 0.00 0.00 175.10 175.43 3fqa s PHE 1244N 0.95 3.29 -0.67 5.22 0.40 -0.68 -2.11 117.98 124.38 3fqa s PHE 1244Ca -0.03 0.20 -0.20 0.00 -0.60 0.00 0.00 56.93 56.31 3fqa s PHE 1244Cb -0.15 -2.31 0.10 0.00 0.51 0.00 0.00 43.02 41.18 3fqa s PHE 1244CO -0.02 -0.01 0.83 0.34 0.70 0.00 0.00 175.22 177.06 3fqa s ASP 1245N 1.27 6.27 -0.42 1.36 -1.08 -0.36 -1.58 116.67 122.12 3fqa s ASP 1245Ca 0.08 -1.47 0.05 0.00 -0.52 0.00 0.00 52.55 50.69 3fqa s ASP 1245Cb -0.14 -2.34 0.55 0.00 -1.46 0.00 0.00 42.92 39.53 3fqa s ASP 1245CO 0.07 -1.17 1.72 -0.62 0.52 0.00 0.00 175.17 175.68 3fqa n GLU 1246N 6.59 2.29 -0.36 4.34 1.02 -0.45 -4.26 120.64 129.82 3fqa n GLU 1246Ca -0.02 -3.23 0.01 0.00 -0.02 0.00 0.00 57.16 53.90 3fqa n GLU 1246Cb 0.44 -2.08 0.16 0.00 -0.02 0.00 0.00 31.44 29.94 3fqa n GLU 1246CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fqa h VAL 1247N 1.10 1.12 0.05 2.62 2.07 -1.83 0.62 116.25 122.01 3fqa h VAL 1247Ca 0.46 -0.41 -0.32 0.00 0.82 0.00 0.00 66.70 67.26 3fqa h VAL 1247Cb 1.95 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3fqa h VAL 1247CO 0.91 0.22 -1.75 -0.38 0.02 0.00 0.00 177.57 176.59 3fqa n ILE 1248N -4.49 1.64 0.13 4.57 5.41 -1.26 -3.94 119.36 121.41 3fqa n ILE 1248Ca 0.14 -0.35 -0.02 0.00 1.00 0.00 0.00 62.75 63.52 3fqa n ILE 1248Cb 0.15 -1.86 0.14 0.00 -0.71 0.00 0.00 39.64 37.36 3fqa n ILE 1248CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 3fqa h THR 1249N -0.48 1.46 -2.21 1.39 1.35 -1.84 -3.41 112.91 109.16 3fqa h THR 1249Ca -0.42 -2.25 -0.59 0.00 -0.55 0.00 0.00 66.41 62.60 3fqa h THR 1249Cb 1.68 2.22 0.06 0.00 -1.73 0.00 0.00 68.15 70.37 3fqa h THR 1249CO -0.09 0.64 0.78 0.61 -0.25 0.00 0.00 175.52 177.21 3fqa n GLY 1250N 0.38 1.09 3.47 5.82 0.00 0.22 -1.29 105.19 114.87 3fqa n GLY 1250Ca -0.01 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.68 3fqa n GLY 1250CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3fqa n PHE 1251N 3.49 0.00 -0.06 1.61 3.01 -1.11 -4.75 117.46 119.65 3fqa n PHE 1251Ca 0.17 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.50 3fqa n PHE 1251Cb 0.28 -1.21 -0.04 0.00 -0.01 0.00 0.00 39.48 38.50 3fqa n PHE 1251CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3fqa n ARG 1252N -1.48 0.32 0.09 -1.08 0.63 -0.41 -4.62 116.66 110.11 3fqa n ARG 1252Ca 0.00 0.14 0.01 0.00 -0.92 0.00 0.00 57.85 57.08 3fqa n ARG 1252Cb 0.10 -1.05 0.34 0.00 0.45 0.00 0.00 32.46 32.30 3fqa n ARG 1252CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 3fqa h ILE 1253N -0.57 1.20 -1.91 5.15 1.08 -1.65 -3.37 117.51 117.44 3fqa h ILE 1253Ca -0.26 -0.90 0.21 0.00 -0.39 0.00 0.00 64.86 63.51 3fqa h ILE 1253Cb 1.07 1.23 -0.14 0.00 -3.07 0.00 0.00 36.82 35.91 3fqa h ILE 1253CO -0.16 0.28 0.64 0.00 -0.69 0.00 0.00 178.15 178.23 3fqa s ALA 1254N -4.68 -1.94 0.36 1.87 0.00 -1.26 -4.71 121.76 111.40 3fqa s ALA 1254Ca -0.06 0.91 0.06 0.00 0.00 0.00 0.00 51.96 52.88 3fqa s ALA 1254Cb 0.15 0.31 0.74 0.00 0.00 0.00 0.00 23.12 24.32 3fqa s ALA 1254CO 0.75 -0.81 1.94 -0.92 0.00 0.00 0.00 175.76 176.72 3fqa h TYR 1255N 2.00 0.79 -0.64 0.00 3.20 -1.89 0.14 116.97 120.57 3fqa h TYR 1255Ca -0.21 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.68 3fqa h TYR 1255Cb 1.21 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.22 3fqa h TYR 1255CO 0.30 0.40 0.00 0.41 -1.64 0.00 0.00 178.16 177.63 3fqa n GLY 1256N -1.44 2.56 7.00 1.82 0.00 -1.26 -4.09 105.19 109.79 3fqa n GLY 1256Ca 0.12 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3fqa n GLY 1256CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1257N 1.18 -1.40 0.32 -0.02 0.00 0.02 -3.15 105.19 102.14 3fqa n GLY 1257Ca 0.25 -1.25 -0.06 0.00 0.00 0.00 0.00 46.02 44.96 3fqa n GLY 1257CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fqa h VAL 1258N 0.00 1.26 -0.61 1.61 2.07 -1.87 -2.08 116.25 116.63 3fqa h VAL 1258Ca 0.00 -0.94 0.09 0.00 0.82 0.00 0.00 66.70 66.67 3fqa h VAL 1258Cb 0.00 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 3fqa h VAL 1258CO 0.00 0.36 0.41 0.06 0.02 0.00 0.00 177.57 178.42 3fqa h GLN 1259N 1.02 0.45 0.01 1.57 3.07 -1.78 0.16 115.11 119.62 3fqa h GLN 1259Ca 0.22 -0.03 -0.04 0.00 0.09 0.00 0.00 58.65 58.89 3fqa h GLN 1259Cb 0.35 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 27.81 3fqa h GLN 1259CO 0.00 0.30 -0.17 1.49 0.09 0.00 0.00 178.83 180.54 3fqa h GLU 1260N 0.47 0.09 -0.31 0.06 4.81 -1.43 -2.46 114.58 115.81 3fqa h GLU 1260Ca 0.28 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 3fqa h GLU 1260Cb 0.48 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 3fqa h GLU 1260CO -0.08 0.93 0.19 -0.22 -0.73 0.00 0.00 179.01 179.11 3fqa h LYS 1261N -0.69 0.38 -0.43 1.92 1.63 -0.84 -3.12 116.57 115.43 3fqa h LYS 1261Ca -0.02 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 3fqa h LYS 1261Cb 1.00 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.55 3fqa h LYS 1261CO 0.03 0.25 0.00 1.19 -3.45 0.00 0.00 179.45 177.48 3fqa n PHE 1262N -4.89 0.56 -1.39 1.91 0.99 0.52 -4.99 117.46 110.16 3fqa n PHE 1262Ca -0.01 -0.28 -0.13 0.00 -0.00 0.00 0.00 57.45 57.03 3fqa n PHE 1262Cb 0.04 0.00 -0.06 0.00 -1.00 0.00 0.00 39.48 38.46 3fqa n PHE 1262CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fqa n GLY 1263N 1.46 1.39 3.39 1.37 0.00 -0.95 -5.01 105.19 106.84 3fqa n GLY 1263Ca 0.19 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 3fqa n GLY 1263CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fqa s VAL 1264N -2.41 3.55 -0.35 1.61 1.01 -1.07 -5.03 120.40 117.71 3fqa s VAL 1264Ca 0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 3fqa s VAL 1264Cb 0.00 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 3fqa s VAL 1264CO 0.00 0.46 0.23 -0.89 0.00 0.00 0.00 175.10 174.90 3fqa s THR 1265N 0.91 5.08 1.01 3.92 2.01 -1.26 -4.44 115.64 122.88 3fqa s THR 1265Ca -0.01 -0.39 -0.17 0.00 0.31 0.00 0.00 61.69 61.44 3fqa s THR 1265Cb -0.15 -3.66 0.24 0.00 0.01 0.00 0.00 72.50 68.94 3fqa s THR 1265CO 0.01 -0.06 1.25 -0.81 -0.69 0.00 0.00 174.62 174.31 3fqa n PRO 1266N 5.08 -1.70 -0.04 4.92 -0.04 -1.26 -5.01 135.00 136.95 3fqa n PRO 1266Ca -0.13 -1.94 -0.05 0.00 -0.04 0.00 0.00 63.50 61.35 3fqa n PRO 1266Cb 0.49 -1.40 -0.14 0.00 -0.04 0.00 0.00 33.50 32.41 3fqa n PRO 1266CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3fqa n ASP 1267N -4.07 0.35 -3.78 3.54 10.43 0.34 -4.72 116.55 118.65 3fqa n ASP 1267Ca 0.16 0.16 -0.13 0.00 2.57 0.00 0.00 54.79 57.55 3fqa n ASP 1267Cb 0.57 0.75 -0.10 0.00 1.84 0.00 0.00 41.12 44.18 3fqa n ASP 1267CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3fqa s LEU 1268N -5.53 0.97 0.00 0.64 1.02 -1.20 -1.84 118.68 112.74 3fqa s LEU 1268Ca -0.07 0.28 -0.03 0.00 0.02 0.00 0.00 54.13 54.33 3fqa s LEU 1268Cb 0.08 1.05 -0.01 0.00 0.02 0.00 0.00 46.19 47.34 3fqa s LEU 1268CO 0.84 -0.27 0.05 0.42 0.02 0.00 0.00 176.35 177.40 3fqa s THR 1269N -0.63 0.07 -0.02 5.49 -4.23 -0.07 -1.68 115.64 114.57 3fqa s THR 1269Ca -0.07 -0.60 0.01 0.00 -1.18 0.00 0.00 61.69 59.85 3fqa s THR 1269Cb -0.04 -0.27 -0.03 0.00 1.34 0.00 0.00 72.50 73.49 3fqa s THR 1269CO 0.02 -0.33 -0.02 0.42 -0.54 0.00 0.00 174.62 174.17 3fqa s THR 1270N -1.04 4.05 0.19 3.99 -4.23 -0.62 -2.10 115.64 115.89 3fqa s THR 1270Ca -0.11 -0.55 0.06 0.00 -1.18 0.00 0.00 61.69 59.91 3fqa s THR 1270Cb -0.07 -2.77 -0.05 0.00 1.34 0.00 0.00 72.50 70.96 3fqa s THR 1270CO 0.00 0.44 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.65 3fqa s LEU 1271N -1.33 2.52 0.00 4.79 1.43 0.94 -1.34 118.68 125.69 3fqa s LEU 1271Ca 0.17 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.23 3fqa s LEU 1271Cb -0.11 -0.54 0.00 0.00 0.03 0.00 0.00 46.19 45.57 3fqa s LEU 1271CO 0.07 -0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.01 3fqa n GLY 1272N -0.33 1.71 6.81 -3.19 0.00 -1.25 -1.56 105.19 107.37 3fqa n GLY 1272Ca -0.08 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3fqa n GLY 1272CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fqa n LYS 1273N 0.00 0.00 -0.34 1.61 5.02 -1.25 -2.18 118.16 121.02 3fqa n LYS 1273Ca 0.00 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.51 3fqa n LYS 1273Cb 0.00 0.00 0.46 0.00 -0.02 0.00 0.00 35.03 35.47 3fqa n LYS 1273CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3fqa h ILE 1274N 0.00 0.44 0.00 -0.18 2.04 -1.79 0.25 117.51 118.27 3fqa h ILE 1274Ca 0.00 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3fqa h ILE 1274Cb 0.00 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.05 3fqa h ILE 1274CO 0.00 0.08 0.00 -0.29 0.00 0.00 0.00 178.15 177.94 3fqa h ILE 1275N 0.43 0.00 -0.01 -0.67 2.10 -1.78 -0.15 117.51 117.43 3fqa h ILE 1275Ca 0.67 -0.05 0.00 0.00 1.08 0.00 0.00 64.86 66.56 3fqa h ILE 1275Cb 1.51 0.80 0.00 0.00 -1.09 0.00 0.00 36.82 38.03 3fqa h ILE 1275CO -0.47 0.00 -0.65 0.61 -1.08 0.00 0.00 178.15 176.56 3fqa n GLY 1276N -1.02 -0.63 2.44 8.18 0.00 0.88 -3.81 105.19 111.23 3fqa n GLY 1276Ca -0.02 -0.55 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 3fqa n GLY 1276CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1277N 1.45 1.49 0.00 -0.02 0.00 -0.07 -1.43 105.19 106.60 3fqa n GLY 1277Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3fqa n GLY 1277CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1278N -0.18 2.06 3.97 -0.02 0.00 -1.26 -4.94 105.19 104.82 3fqa n GLY 1278Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 3fqa n GLY 1278CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fqa s LEU 1279N 0.00 3.94 -0.28 0.99 1.02 -0.52 -5.03 118.68 118.80 3fqa s LEU 1279Ca 0.00 0.07 -0.29 0.00 0.02 0.00 0.00 54.13 53.93 3fqa s LEU 1279Cb 0.00 -2.96 -0.03 0.00 0.02 0.00 0.00 46.19 43.23 3fqa s LEU 1279CO 0.00 -0.43 1.80 -2.84 0.02 0.00 0.00 176.35 174.90 3fqa s PRO 1280N -4.27 3.45 -0.08 1.29 0.02 -1.26 -4.51 135.00 129.64 3fqa s PRO 1280Ca 0.43 1.58 -0.15 0.00 0.02 0.00 0.00 61.00 62.88 3fqa s PRO 1280Cb -0.10 -4.18 0.03 0.00 0.02 0.00 0.00 34.50 30.28 3fqa s PRO 1280CO 0.33 -1.72 0.38 0.08 -0.33 0.00 0.00 177.00 175.74 3fqa s VAL 1281N 6.55 0.03 0.21 3.83 1.01 -1.05 -4.77 120.40 126.20 3fqa s VAL 1281Ca 0.80 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.52 3fqa s VAL 1281Cb -0.25 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 3fqa s VAL 1281CO 0.33 -0.11 0.26 -0.83 0.00 0.00 0.00 175.10 174.75 3fqa s GLY 1282N -0.56 1.05 -0.08 4.51 0.00 -0.41 -3.84 107.32 107.99 3fqa s GLY 1282Ca -0.07 -1.35 -0.30 0.00 0.00 0.00 0.00 44.72 43.00 3fqa s GLY 1282CO 0.03 -1.09 0.86 0.00 0.00 0.00 0.00 173.10 172.89 3fqa s ALA 1283N -4.09 -1.84 -0.08 3.20 0.00 -0.60 -0.93 121.76 117.41 3fqa s ALA 1283Ca 0.31 1.33 -0.06 0.00 0.00 0.00 0.00 51.96 53.54 3fqa s ALA 1283Cb 0.04 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.00 3fqa s ALA 1283CO 0.10 -0.43 0.21 1.52 0.00 0.00 0.00 175.76 177.16 3fqa s TYR 1284N -1.68 -0.24 0.34 0.00 -0.85 -0.81 -0.04 117.35 114.07 3fqa s TYR 1284Ca -0.03 0.59 -0.18 0.00 -0.52 0.00 0.00 57.07 56.93 3fqa s TYR 1284Cb -0.00 0.06 0.05 0.00 0.38 0.00 0.00 41.96 42.44 3fqa s TYR 1284CO 0.01 -0.14 0.79 0.20 -1.52 0.00 0.00 175.55 174.90 3fqa s GLY 1285N 0.42 0.22 0.00 5.49 0.00 -0.89 -1.77 107.32 110.79 3fqa s GLY 1285Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.10 3fqa s GLY 1285CO -0.02 -0.07 0.00 0.61 0.00 0.00 0.00 173.10 173.62 3fqa n GLY 1286N -0.52 -0.65 3.66 0.20 0.00 -1.11 -0.89 105.19 105.88 3fqa n GLY 1286Ca -0.07 -0.53 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 3fqa n GLY 1286CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fqa n LYS 1287N 0.00 1.94 -0.23 1.61 5.02 -0.77 -1.69 118.16 124.04 3fqa n LYS 1287Ca 0.00 0.69 0.01 0.00 -2.02 0.00 0.00 58.31 56.99 3fqa n LYS 1287Cb 0.00 -2.29 0.13 0.00 -0.02 0.00 0.00 35.03 32.86 3fqa n LYS 1287CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3fqa h ARG 1288N 3.55 0.51 -0.03 1.97 2.43 -1.90 -1.55 114.38 119.36 3fqa h ARG 1288Ca -0.45 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.70 3fqa h ARG 1288Cb 1.29 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3fqa h ARG 1288CO 0.71 0.34 0.04 0.93 -1.51 0.00 0.00 179.97 180.47 3fqa h GLU 1289N 0.53 0.00 0.10 0.20 3.07 -2.01 -1.77 114.58 114.69 3fqa h GLU 1289Ca 0.35 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 58.96 3fqa h GLU 1289Cb 0.40 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 3fqa h GLU 1289CO -0.29 0.00 -1.27 0.82 -1.40 0.00 0.00 179.01 176.87 3fqa h ILE 1290N 0.00 1.09 0.00 3.13 2.04 -1.66 -3.35 117.51 118.76 3fqa h ILE 1290Ca 0.02 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.50 3fqa h ILE 1290Cb 0.09 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 3fqa h ILE 1290CO -0.00 0.66 0.00 0.24 0.00 0.00 0.00 178.15 179.05 3fqa h MET 1291N -0.43 0.00 0.00 2.37 2.86 -0.93 -2.48 114.93 116.33 3fqa h MET 1291Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 3fqa h MET 1291Cb 1.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.31 3fqa h MET 1291CO 0.03 0.00 0.00 1.04 1.06 0.00 0.00 176.91 179.04 3fqa n GLN 1292N -2.90 0.13 0.06 1.72 1.13 -0.71 -1.92 117.38 114.89 3fqa n GLN 1292Ca -0.02 0.47 0.13 0.00 -1.94 0.00 0.00 57.00 55.64 3fqa n GLN 1292Cb 0.12 -1.81 0.37 0.00 0.11 0.00 0.00 30.24 29.04 3fqa n GLN 1292CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3fqa n LEU 1293N -2.07 0.57 -4.71 1.08 4.32 -0.93 -2.18 117.00 113.08 3fqa n LEU 1293Ca 0.01 0.40 -0.42 0.00 -0.02 0.00 0.00 56.01 55.98 3fqa n LEU 1293Cb 0.14 -0.32 -0.03 0.00 -1.62 0.00 0.00 43.42 41.60 3fqa n LEU 1293CO 0.14 -0.07 0.91 -0.69 -1.22 0.00 0.00 177.39 176.46 3fqa s VAL 1294N -3.08 3.91 0.61 4.08 1.01 -0.81 -0.42 120.40 125.69 3fqa s VAL 1294Ca 0.10 1.37 -0.19 0.00 0.00 0.00 0.00 61.98 63.27 3fqa s VAL 1294Cb 0.15 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 3fqa s VAL 1294CO 0.63 0.11 1.26 0.00 0.00 0.00 0.00 175.10 177.10 3fqa s ALA 1295N 1.05 2.52 -2.07 5.51 0.00 -0.06 -0.87 121.76 127.83 3fqa s ALA 1295Ca 0.60 1.13 0.31 0.00 0.00 0.00 0.00 51.96 54.00 3fqa s ALA 1295Cb -0.31 -3.51 1.70 0.00 0.00 0.00 0.00 23.12 21.01 3fqa s ALA 1295CO 0.29 -1.36 2.12 -0.35 0.00 0.00 0.00 175.76 176.46 3fqa n PRO 1296N -1.63 1.10 -0.03 0.00 -0.04 -1.26 -4.78 135.00 128.36 3fqa n PRO 1296Ca 0.14 -0.20 -0.15 0.00 -0.04 0.00 0.00 63.50 63.25 3fqa n PRO 1296Cb 0.48 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.41 3fqa n PRO 1296CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fqa h ALA 1297N 4.04 0.43 -4.24 0.55 0.00 -1.55 -3.47 119.26 115.02 3fqa h ALA 1297Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 3fqa h ALA 1297Cb 0.12 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3fqa h ALA 1297CO 0.00 0.69 -0.17 0.41 0.00 0.00 0.00 179.25 180.19 3fqa n GLY 1298N 0.53 3.92 0.20 0.00 0.00 -0.05 -4.87 105.19 104.93 3fqa n GLY 1298Ca -0.06 -2.17 0.10 0.00 0.00 0.00 0.00 46.02 43.89 3fqa n GLY 1298CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fqa h PRO 1299N 0.00 0.00 -6.40 1.61 0.13 -1.75 -3.17 132.00 122.43 3fqa h PRO 1299Ca -0.13 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.43 3fqa h PRO 1299Cb 0.44 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.52 3fqa h PRO 1299CO 0.22 0.17 1.15 1.41 -0.23 0.00 0.00 178.00 180.73 3fqa s MET 1300N -3.23 3.40 0.12 0.86 1.75 0.44 -4.80 119.30 117.83 3fqa s MET 1300Ca 0.05 0.98 -0.30 0.00 -1.25 0.00 0.00 55.69 55.17 3fqa s MET 1300Cb 0.07 -4.12 -0.06 0.00 2.84 0.00 0.00 34.83 33.56 3fqa s MET 1300CO 0.68 -1.79 0.94 -0.47 -0.65 0.00 0.00 175.02 173.73 3fqa s TYR 1301N 6.20 3.83 -0.30 4.11 5.04 -1.26 -0.88 117.35 134.09 3fqa s TYR 1301Ca 0.66 1.79 -0.12 0.00 -2.44 0.00 0.00 57.07 56.96 3fqa s TYR 1301Cb -0.16 -3.03 0.14 0.00 0.35 0.00 0.00 41.96 39.27 3fqa s TYR 1301CO 0.31 0.25 0.77 -1.14 -1.34 0.00 0.00 175.55 174.40 3fqa s GLN 1302N -0.18 0.49 0.37 4.97 -0.44 -1.26 -4.97 119.66 118.64 3fqa s GLN 1302Ca 0.45 1.20 0.04 0.00 -2.50 0.00 0.00 55.36 54.55 3fqa s GLN 1302Cb -0.23 0.69 -0.05 0.00 -1.64 0.00 0.00 33.01 31.77 3fqa s GLN 1302CO 0.30 -0.16 0.07 0.00 0.50 0.00 0.00 175.29 175.99 3fqa s ALA 1303N 2.66 2.71 -0.30 1.58 0.00 -1.26 -4.85 121.76 122.30 3fqa s ALA 1303Ca -0.05 -1.71 -0.09 0.00 0.00 0.00 0.00 51.96 50.11 3fqa s ALA 1303Cb -0.10 0.60 0.18 0.00 0.00 0.00 0.00 23.12 23.81 3fqa s ALA 1303CO -0.18 -0.28 0.87 0.20 0.00 0.00 0.00 175.76 176.36 3fqa s GLY 1304N -3.57 -0.57 0.12 0.00 0.00 -1.26 -5.04 107.32 97.01 3fqa s GLY 1304Ca 0.30 2.47 -0.28 0.00 0.00 0.00 0.00 44.72 47.21 3fqa s GLY 1304CO 0.14 3.56 1.61 -0.84 0.00 0.00 0.00 173.10 177.57 3fqa h THR 1305N 5.61 0.27 -0.37 0.90 2.02 -2.01 -2.68 112.91 116.64 3fqa h THR 1305Ca -0.17 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3fqa h THR 1305Cb 1.16 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 3fqa h THR 1305CO 0.06 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.13 3fqa n LEU 1306N -5.42 2.15 -4.74 2.58 4.32 -1.26 -4.70 117.00 109.94 3fqa n LEU 1306Ca -0.05 -1.05 -0.42 0.00 -0.02 0.00 0.00 56.01 54.47 3fqa n LEU 1306Cb 0.34 -0.25 -0.02 0.00 -1.62 0.00 0.00 43.42 41.87 3fqa n LEU 1306CO 0.18 0.52 1.21 -0.44 -1.22 0.00 0.00 177.39 177.65 3fqa s SER 1307N -1.10 6.50 -0.98 -1.43 0.01 -1.01 -2.42 113.70 113.27 3fqa s SER 1307Ca 0.29 2.79 0.00 0.00 1.31 0.00 0.00 55.95 60.33 3fqa s SER 1307Cb 0.15 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.76 3fqa s SER 1307CO 0.20 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.63 3fqa n GLY 1308N 2.68 0.12 3.77 3.44 0.00 -1.26 -4.98 105.19 108.96 3fqa n GLY 1308Ca 0.10 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.30 3fqa n GLY 1308CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fqa s ASN 1309N -2.56 6.60 0.45 1.61 2.20 -1.02 -4.82 114.94 117.40 3fqa s ASN 1309Ca 0.00 2.26 0.23 0.00 -0.94 0.00 0.00 52.86 54.42 3fqa s ASN 1309Cb 0.00 -2.61 1.23 0.00 -2.00 0.00 0.00 41.25 37.87 3fqa s ASN 1309CO 0.00 -0.62 1.81 1.55 -2.94 0.00 0.00 177.10 176.91 3fqa h PRO 1310N 2.63 0.27 -0.21 3.55 0.13 -1.91 -2.08 132.00 134.38 3fqa h PRO 1310Ca -0.49 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.54 3fqa h PRO 1310Cb 1.23 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 3fqa h PRO 1310CO 0.63 0.18 -0.22 -0.07 -0.23 0.00 0.00 178.00 178.28 3fqa h LEU 1311N 0.28 0.55 -0.45 1.56 3.38 -1.87 -0.94 115.31 117.83 3fqa h LEU 1311Ca 0.54 -0.48 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3fqa h LEU 1311Cb 1.58 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.16 3fqa h LEU 1311CO -0.18 0.92 0.08 0.00 0.09 0.00 0.00 178.44 179.36 3fqa h ALA 1312N 0.65 0.59 -0.22 1.53 0.00 -1.81 -1.67 119.26 118.33 3fqa h ALA 1312Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3fqa h ALA 1312Cb 0.77 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3fqa h ALA 1312CO 0.05 0.30 0.14 0.52 0.00 0.00 0.00 179.25 180.27 3fqa h MET 1313N 0.60 0.29 -0.57 0.00 2.86 -1.38 -0.59 114.93 116.14 3fqa h MET 1313Ca 0.14 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.80 3fqa h MET 1313Cb 0.37 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.91 3fqa h MET 1313CO 0.01 0.21 0.30 1.15 1.06 0.00 0.00 176.91 179.64 3fqa h THR 1314N 0.29 0.97 -0.60 2.22 2.02 -1.02 -0.21 112.91 116.58 3fqa h THR 1314Ca 0.08 -0.20 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 3fqa h THR 1314Cb -0.02 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 3fqa h THR 1314CO -0.02 0.11 0.03 0.00 0.37 0.00 0.00 175.52 176.00 3fqa h ALA 1315N 1.30 0.91 -0.18 6.16 0.00 -1.00 -2.16 119.26 124.28 3fqa h ALA 1315Ca 0.25 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3fqa h ALA 1315Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3fqa h ALA 1315CO -0.16 0.65 -0.00 0.78 0.00 0.00 0.00 179.25 180.52 3fqa h GLY 1316N 1.01 0.34 0.62 0.00 0.00 -0.59 -1.70 103.07 102.76 3fqa h GLY 1316Ca 0.18 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.29 3fqa h GLY 1316CO 0.02 0.23 -0.06 -2.22 0.00 0.00 0.00 176.54 174.52 3fqa h ILE 1317N 0.07 0.79 -0.85 2.60 2.04 -0.98 -0.58 117.51 120.59 3fqa h ILE 1317Ca 0.05 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 3fqa h ILE 1317Cb 0.39 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 3fqa h ILE 1317CO 0.01 0.00 0.46 0.50 0.00 0.00 0.00 178.15 179.11 3fqa h LYS 1318N -0.03 1.19 -0.48 2.37 3.11 -1.38 -1.67 116.57 119.67 3fqa h LYS 1318Ca 0.09 -0.14 -0.06 0.00 -2.81 0.00 0.00 60.65 57.72 3fqa h LYS 1318Cb 0.16 -0.23 -0.02 0.00 -1.00 0.00 0.00 32.23 31.14 3fqa h LYS 1318CO -0.19 0.88 0.06 1.15 -2.81 0.00 0.00 179.45 178.54 3fqa h THR 1319N 1.19 1.25 -0.28 1.00 2.02 -0.82 -2.40 112.91 114.87 3fqa h THR 1319Ca 0.30 -0.95 -0.10 0.00 0.77 0.00 0.00 66.41 66.42 3fqa h THR 1319Cb 0.04 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3fqa h THR 1319CO -0.05 0.34 -0.25 -0.07 0.37 0.00 0.00 175.52 175.86 3fqa h LEU 1320N 0.68 0.55 -0.76 2.58 4.07 -0.84 -2.42 115.31 119.17 3fqa h LEU 1320Ca 0.15 -0.19 -0.07 0.00 0.08 0.00 0.00 57.88 57.84 3fqa h LEU 1320Cb 0.42 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 3fqa h LEU 1320CO 0.01 0.79 0.12 -0.33 -1.08 0.00 0.00 178.44 177.95 3fqa h GLU 1321N 0.48 1.06 -0.66 1.13 5.08 -1.14 -1.76 114.58 118.78 3fqa h GLU 1321Ca 0.07 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 3fqa h GLU 1321Cb 0.69 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 3fqa h GLU 1321CO 0.05 0.96 0.17 -0.07 -1.00 0.00 0.00 179.01 179.13 3fqa h LEU 1322N 1.00 0.97 -1.21 1.33 3.38 -1.21 -2.62 115.31 116.94 3fqa h LEU 1322Ca 0.20 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3fqa h LEU 1322Cb 0.41 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3fqa h LEU 1322CO 0.01 0.92 -0.14 -0.07 0.09 0.00 0.00 178.44 179.25 3fqa h LEU 1323N 0.98 0.00 -0.01 1.67 3.38 -1.02 -2.78 115.31 117.53 3fqa h LEU 1323Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3fqa h LEU 1323Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3fqa h LEU 1323CO -0.00 0.14 0.00 -1.14 0.09 0.00 0.00 178.44 177.53 3fqa n ARG 1324N -3.29 0.01 -1.46 1.13 0.63 -0.70 -4.76 116.66 108.23 3fqa n ARG 1324Ca 0.00 0.10 -0.33 0.00 -0.92 0.00 0.00 57.85 56.70 3fqa n ARG 1324Cb 0.39 -1.52 0.08 0.00 0.45 0.00 0.00 32.46 31.86 3fqa n ARG 1324CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 3fqa s GLN 1325N -3.01 2.29 0.34 -0.14 -1.52 -1.05 -4.96 119.66 111.60 3fqa s GLN 1325Ca 0.11 1.52 -0.29 0.00 -1.95 0.00 0.00 55.36 54.76 3fqa s GLN 1325Cb 0.15 -1.88 -0.11 0.00 -0.22 0.00 0.00 33.01 30.96 3fqa s GLN 1325CO 0.44 -1.67 1.47 -2.14 -0.25 0.00 0.00 175.29 173.13 3fqa s PRO 1326N -4.18 4.18 0.00 2.91 0.02 -1.26 -3.32 135.00 133.35 3fqa s PRO 1326Ca 0.69 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.18 3fqa s PRO 1326Cb -0.24 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.27 3fqa s PRO 1326CO 0.46 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 177.07 3fqa n GLY 1327N 1.08 0.44 0.45 0.52 0.00 -1.26 -4.95 105.19 101.47 3fqa n GLY 1327Ca 0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 3fqa n GLY 1327CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3fqa h THR 1328N 0.00 0.00 0.00 2.61 2.02 -1.85 -1.47 112.91 114.22 3fqa h THR 1328Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 3fqa h THR 1328Cb 0.22 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 3fqa h THR 1328CO 0.00 0.00 -0.44 1.88 0.37 0.00 0.00 175.52 177.33 3fqa h TYR 1329N -0.99 0.00 -0.31 3.16 -1.99 -1.87 -2.74 116.97 112.23 3fqa h TYR 1329Ca -0.08 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.63 3fqa h TYR 1329Cb 0.81 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.53 3fqa h TYR 1329CO -0.14 0.44 0.10 0.93 -0.00 0.00 0.00 178.16 179.49 3fqa h GLU 1330N 0.00 0.48 -0.54 4.88 3.07 -1.96 -1.43 114.58 119.07 3fqa h GLU 1330Ca -0.00 -0.10 0.01 0.00 -0.50 0.00 0.00 59.36 58.76 3fqa h GLU 1330Cb 0.89 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.70 3fqa h GLU 1330CO 0.06 0.52 0.36 -0.92 -1.40 0.00 0.00 179.01 177.62 3fqa h TYR 1331N 0.34 0.68 -0.44 4.33 3.20 -1.14 -1.06 116.97 122.88 3fqa h TYR 1331Ca 0.10 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 3fqa h TYR 1331Cb 0.24 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 3fqa h TYR 1331CO 0.01 0.42 0.27 -0.07 -1.64 0.00 0.00 178.16 177.14 3fqa h LEU 1332N 0.73 0.53 -0.54 2.82 3.38 -1.31 -1.90 115.31 119.02 3fqa h LEU 1332Ca 0.20 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3fqa h LEU 1332Cb -0.08 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3fqa h LEU 1332CO -0.05 0.43 0.20 -0.78 0.09 0.00 0.00 178.44 178.34 3fqa h ASP 1333N 0.59 0.76 0.57 -0.43 -0.00 -1.04 -2.06 116.42 114.81 3fqa h ASP 1333Ca 0.16 -0.18 -0.02 0.00 -0.00 0.00 0.00 57.03 56.98 3fqa h ASP 1333Cb -0.00 -0.20 -0.00 0.00 -0.00 0.00 0.00 39.33 39.13 3fqa h ASP 1333CO -0.03 0.73 -0.33 -0.61 -0.00 0.00 0.00 179.24 179.01 3fqa h GLN 1334N 0.74 -0.82 0.00 0.28 4.15 -0.92 -1.39 115.11 117.15 3fqa h GLN 1334Ca 0.18 0.06 -0.07 0.00 0.77 0.00 0.00 58.65 59.59 3fqa h GLN 1334Cb 0.22 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 3fqa h GLN 1334CO -0.01 -0.54 -0.32 -0.84 -1.93 0.00 0.00 178.83 175.18 3fqa h ILE 1335N -0.85 0.87 0.07 2.39 3.07 -1.39 -2.73 117.51 118.94 3fqa h ILE 1335Ca -0.07 -1.27 -0.26 0.00 1.55 0.00 0.00 64.86 64.81 3fqa h ILE 1335Cb 0.68 1.77 0.01 0.00 -0.27 0.00 0.00 36.82 39.00 3fqa h ILE 1335CO 0.09 0.31 -1.10 0.74 -1.05 0.00 0.00 178.15 177.14 3fqa h THR 1336N 0.00 1.41 -0.52 0.16 2.02 -1.27 -2.19 112.91 112.52 3fqa h THR 1336Ca -0.00 -2.65 -0.09 0.00 0.77 0.00 0.00 66.41 64.44 3fqa h THR 1336Cb 0.74 2.65 -0.02 0.00 -1.74 0.00 0.00 68.15 69.78 3fqa h THR 1336CO 0.04 0.79 -0.04 0.50 0.37 0.00 0.00 175.52 177.17 3fqa h LYS 1337N 0.19 0.94 -0.86 6.66 3.64 -1.21 0.20 116.57 126.13 3fqa h LYS 1337Ca -0.12 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 58.93 3fqa h LYS 1337Cb 1.77 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 33.48 3fqa h LYS 1337CO 0.19 0.98 0.51 -0.09 -2.27 0.00 0.00 179.45 178.77 3fqa h ARG 1338N 0.81 1.17 -0.01 1.90 2.43 -1.48 0.11 114.38 119.31 3fqa h ARG 1338Ca 0.14 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3fqa h ARG 1338Cb 0.59 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 3fqa h ARG 1338CO 0.04 0.82 -0.01 1.25 -1.51 0.00 0.00 179.97 180.56 3fqa h LEU 1339N 1.18 0.02 0.64 3.80 6.46 -0.96 -2.45 115.31 124.00 3fqa h LEU 1339Ca 0.31 -0.50 -0.03 0.00 -0.12 0.00 0.00 57.88 57.54 3fqa h LEU 1339Cb -0.03 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 39.89 3fqa h LEU 1339CO -0.06 0.52 -0.37 -1.28 -0.62 0.00 0.00 178.44 176.63 3fqa h SER 1340N -0.48 -0.92 -0.69 1.25 0.87 -0.33 -1.28 113.55 111.98 3fqa h SER 1340Ca 0.00 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.67 3fqa h SER 1340Cb 0.51 0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 62.67 3fqa h SER 1340CO 0.00 -0.59 0.38 0.44 -0.53 0.00 0.00 176.83 176.54 3fqa h ASP 1341N -0.95 0.56 -0.69 6.23 3.32 -0.91 -1.79 116.42 122.20 3fqa h ASP 1341Ca -0.08 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.05 3fqa h ASP 1341Cb 0.76 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.18 3fqa h ASP 1341CO 0.10 0.35 0.41 1.23 -1.72 0.00 0.00 179.24 179.61 3fqa h GLY 1342N 0.70 1.00 1.01 2.75 0.00 -1.28 0.12 103.07 107.37 3fqa h GLY 1342Ca 0.32 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 3fqa h GLY 1342CO -0.20 0.21 0.26 1.41 0.00 0.00 0.00 176.54 178.22 3fqa h LEU 1343N 0.77 0.88 -0.90 3.11 4.07 -0.54 -1.64 115.31 121.05 3fqa h LEU 1343Ca 0.29 -0.17 -0.11 0.00 0.08 0.00 0.00 57.88 57.98 3fqa h LEU 1343Cb 0.12 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.61 3fqa h LEU 1343CO -0.15 0.81 -0.53 -0.07 -1.08 0.00 0.00 178.44 177.42 3fqa h LEU 1344N 0.90 0.00 -0.24 1.67 3.38 -0.71 -1.98 115.31 118.34 3fqa h LEU 1344Ca 0.21 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.01 3fqa h LEU 1344Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3fqa h LEU 1344CO -0.02 0.53 -0.53 0.00 0.09 0.00 0.00 178.44 178.51 3fqa h ALA 1345N 1.47 0.38 -0.17 1.53 0.00 -0.51 -2.85 119.26 119.12 3fqa h ALA 1345Ca -0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.30 3fqa h ALA 1345Cb 0.97 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3fqa h ALA 1345CO 0.07 0.58 -0.33 0.82 0.00 0.00 0.00 179.25 180.39 3fqa h ILE 1346N 0.51 1.28 -0.42 0.00 2.04 -1.15 -0.59 117.51 119.18 3fqa h ILE 1346Ca 0.00 -1.37 -0.13 0.00 1.00 0.00 0.00 64.86 64.36 3fqa h ILE 1346Cb 1.14 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 3fqa h ILE 1346CO 0.12 0.42 -0.25 0.00 0.00 0.00 0.00 178.15 178.44 3fqa h ALA 1347N 1.35 0.77 0.14 1.87 0.00 -1.36 -1.50 119.26 120.54 3fqa h ALA 1347Ca 0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 3fqa h ALA 1347Cb 0.73 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3fqa h ALA 1347CO 0.06 0.65 -0.07 0.37 0.00 0.00 0.00 179.25 180.26 3fqa h GLN 1348N 0.74 -0.18 -0.47 0.00 4.15 -1.25 0.56 115.11 118.67 3fqa h GLN 1348Ca 0.09 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.61 3fqa h GLN 1348Cb 0.79 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.50 3fqa h GLN 1348CO 0.07 0.18 0.32 1.49 -1.93 0.00 0.00 178.83 178.95 3fqa h GLU 1349N -0.58 0.24 -0.05 1.69 4.81 -1.07 -0.86 114.58 118.77 3fqa h GLU 1349Ca -0.02 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3fqa h GLU 1349Cb 0.44 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.77 3fqa h GLU 1349CO 0.03 0.16 0.00 0.25 -0.73 0.00 0.00 179.01 178.72 3fqa n THR 1350N -4.46 0.04 -1.10 0.32 -2.24 -0.57 -4.97 114.28 101.30 3fqa n THR 1350Ca 0.07 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3fqa n THR 1350Cb 0.36 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 3fqa n THR 1350CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fqa n GLY 1351N 1.26 0.50 3.58 3.38 0.00 -0.33 -4.96 105.19 108.63 3fqa n GLY 1351Ca 0.17 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 3fqa n GLY 1351CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fqa s HIS 1352N -2.00 3.12 0.03 1.61 3.76 0.19 -5.00 115.29 116.99 3fqa s HIS 1352Ca 0.00 -0.07 -0.30 0.00 -0.15 0.00 0.00 55.06 54.54 3fqa s HIS 1352Cb 0.00 -1.94 -0.06 0.00 1.11 0.00 0.00 32.58 31.69 3fqa s HIS 1352CO 0.00 0.15 1.44 0.00 -0.85 0.00 0.00 174.74 175.48 3fqa s ALA 1353N 0.02 3.60 0.18 -1.40 0.00 -1.26 -4.15 121.76 118.75 3fqa s ALA 1353Ca 0.02 0.97 -0.23 0.00 0.00 0.00 0.00 51.96 52.72 3fqa s ALA 1353Cb -0.13 -3.60 0.06 0.00 0.00 0.00 0.00 23.12 19.45 3fqa s ALA 1353CO 0.02 -0.90 0.62 0.00 0.00 0.00 0.00 175.76 175.50 3fqa s ALA 1354N 2.24 -1.52 0.23 0.00 0.00 -1.21 -2.33 121.76 119.16 3fqa s ALA 1354Ca 0.65 0.34 -0.16 0.00 0.00 0.00 0.00 51.96 52.79 3fqa s ALA 1354Cb -0.33 0.88 0.01 0.00 0.00 0.00 0.00 23.12 23.68 3fqa s ALA 1354CO 0.28 -0.82 0.53 0.00 0.00 0.00 0.00 175.76 175.75 3fqa n GLY 1356N -0.37 -0.57 0.00 0.00 0.00 -1.26 -0.24 105.19 102.75 3fqa n GLY 1356Ca -0.06 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.22 3fqa n GLY 1356CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqa n GLY 1357N 0.00 -2.06 3.50 -0.02 0.00 -1.00 -4.98 105.19 100.64 3fqa n GLY 1357Ca 0.00 -1.21 -0.14 0.00 0.00 0.00 0.00 46.02 44.68 3fqa n GLY 1357CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3fqa s GLN 1358N -1.81 0.99 -0.07 1.61 1.03 -1.26 -1.07 119.66 119.07 3fqa s GLN 1358Ca 0.00 -0.02 -0.02 0.00 0.04 0.00 0.00 55.36 55.36 3fqa s GLN 1358Cb 0.00 0.46 0.03 0.00 0.03 0.00 0.00 33.01 33.54 3fqa s GLN 1358CO 0.00 -0.36 0.05 0.08 -2.54 0.00 0.00 175.29 172.52 3fqa s VAL 1359N -2.07 0.02 0.00 3.63 1.01 -0.71 -5.01 120.40 117.28 3fqa s VAL 1359Ca -0.04 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.18 3fqa s VAL 1359Cb -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 36.05 3fqa s VAL 1359CO 0.00 0.12 0.00 -0.24 0.00 0.00 0.00 175.10 174.98 3fqa n SER 1360N 5.25 0.00 -1.91 3.32 2.88 -1.26 -2.39 113.62 119.51 3fqa n SER 1360Ca -0.05 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.32 3fqa n SER 1360Cb 0.50 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.00 3fqa n SER 1360CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fqa n GLY 1361N 0.00 4.18 2.81 0.46 0.00 -1.26 -4.25 105.19 107.13 3fqa n GLY 1361Ca 0.00 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 3fqa n GLY 1361CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3fqa s MET 1362N -1.93 0.47 0.19 1.61 -2.45 -1.00 -2.45 119.30 113.74 3fqa s MET 1362Ca 0.33 0.07 0.00 0.00 -1.25 0.00 0.00 55.69 54.84 3fqa s MET 1362Cb 0.26 -0.69 -0.04 0.00 1.25 0.00 0.00 34.83 35.61 3fqa s MET 1362CO -0.00 -0.18 0.07 -0.59 1.05 0.00 0.00 175.02 175.37 3fqa s PHE 1363N 1.32 1.21 0.04 4.11 -0.12 -0.97 -1.74 117.98 121.82 3fqa s PHE 1363Ca -0.05 -1.21 -0.03 0.00 -0.05 0.00 0.00 56.93 55.59 3fqa s PHE 1363Cb -0.13 -0.67 -0.02 0.00 -0.63 0.00 0.00 43.02 41.57 3fqa s PHE 1363CO -0.02 -0.43 0.03 0.20 -0.05 0.00 0.00 175.22 174.96 3fqa s GLY 1364N -3.18 0.26 -0.22 1.99 0.00 -0.23 -0.45 107.32 105.49 3fqa s GLY 1364Ca 0.32 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 44.27 3fqa s GLY 1364CO 0.08 -0.83 0.39 -0.12 0.00 0.00 0.00 173.10 172.62 3fqa s PHE 1365N -2.63 -0.80 -0.03 1.90 5.36 -1.26 -2.36 117.98 118.15 3fqa s PHE 1365Ca -0.05 1.18 0.05 0.00 -0.96 0.00 0.00 56.93 57.14 3fqa s PHE 1365Cb -0.01 0.16 -0.03 0.00 -0.34 0.00 0.00 43.02 42.80 3fqa s PHE 1365CO -0.05 -0.59 -0.15 -0.06 -1.46 0.00 0.00 175.22 172.91 3fqa s PHE 1366N 2.58 2.66 -1.27 10.12 0.40 0.67 -4.99 117.98 128.15 3fqa s PHE 1366Ca 0.05 -0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.08 3fqa s PHE 1366Cb -0.14 -1.59 0.15 0.00 0.51 0.00 0.00 43.02 41.96 3fqa s PHE 1366CO -0.14 0.19 1.73 1.19 0.70 0.00 0.00 175.22 178.90 3fqa n PHE 1367N 2.13 3.89 -3.58 0.36 0.99 -1.26 -1.79 117.46 118.19 3fqa n PHE 1367Ca -0.17 -3.02 -0.09 0.00 -0.00 0.00 0.00 57.45 54.17 3fqa n PHE 1367Cb 0.52 -2.14 -0.05 0.00 -1.00 0.00 0.00 39.48 36.81 3fqa n PHE 1367CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.76 176.68 3fqa s THR 1368N 1.37 0.00 0.28 4.37 -1.32 -0.99 -1.44 115.64 117.92 3fqa s THR 1368Ca 0.43 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 61.07 3fqa s THR 1368Cb 0.05 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.14 3fqa s THR 1368CO 0.00 0.00 1.78 1.05 -2.21 0.00 0.00 174.62 175.24 3fqa h GLU 1369N 2.45 0.00 0.00 7.08 4.11 -1.83 -2.72 114.58 123.67 3fqa h GLU 1369Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.26 3fqa h GLU 1369Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3fqa h GLU 1369CO 0.30 0.40 0.00 0.41 0.07 0.00 0.00 179.01 180.18 3fqa n GLY 1370N -0.09 1.77 3.70 1.06 0.00 -1.26 -4.65 105.19 105.72 3fqa n GLY 1370Ca -0.01 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 3fqa n GLY 1370CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fqa s PRO 1371N 0.00 1.14 -0.30 1.61 0.02 -1.26 -5.13 135.00 131.08 3fqa s PRO 1371Ca 0.00 0.90 -0.10 0.00 0.02 0.00 0.00 61.00 61.82 3fqa s PRO 1371Cb 0.00 -1.79 -0.02 0.00 0.02 0.00 0.00 34.50 32.72 3fqa s PRO 1371CO 0.00 -2.34 0.15 0.08 -0.33 0.00 0.00 177.00 174.56 3fqa s VAL 1372N -2.88 4.71 -0.11 3.83 1.01 -1.26 -4.91 120.40 120.80 3fqa s VAL 1372Ca 0.64 -0.30 0.09 0.00 0.00 0.00 0.00 61.98 62.40 3fqa s VAL 1372Cb -0.19 -3.36 -0.12 0.00 0.00 0.00 0.00 36.38 32.71 3fqa s VAL 1372CO 0.57 0.11 0.23 1.41 0.00 0.00 0.00 175.10 177.43 3fqa n HIS 1373N 5.00 0.00 -3.94 5.22 8.25 -1.26 -4.78 115.22 123.71 3fqa n HIS 1373Ca -0.14 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.20 3fqa n HIS 1373Cb 0.50 -0.15 -0.00 0.00 1.12 0.00 0.00 29.99 31.46 3fqa n HIS 1373CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3fqa n ASN 1374N -1.65 -1.79 -0.33 0.41 6.94 -1.26 -4.48 115.26 113.10 3fqa n ASN 1374Ca -0.01 -2.76 -0.04 0.00 -0.02 0.00 0.00 54.58 51.75 3fqa n ASN 1374Cb 0.20 3.13 0.09 0.00 -2.36 0.00 0.00 39.78 40.83 3fqa n ASN 1374CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 3fqa h TYR 1375N 2.00 1.20 -0.70 -2.53 3.20 -1.89 -1.94 116.97 116.32 3fqa h TYR 1375Ca -0.30 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.57 3fqa h TYR 1375Cb 1.21 -0.39 -0.04 0.00 1.54 0.00 0.00 36.73 39.05 3fqa h TYR 1375CO 0.00 0.82 0.45 1.49 -1.64 0.00 0.00 178.16 179.28 3fqa h GLU 1376N 1.24 0.87 -0.02 1.82 4.81 -1.96 -1.39 114.58 119.94 3fqa h GLU 1376Ca 0.32 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 3fqa h GLU 1376Cb -0.00 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.18 3fqa h GLU 1376CO -0.05 0.58 0.01 -0.44 -0.73 0.00 0.00 179.01 178.37 3fqa h ASP 1377N 0.90 0.03 -0.95 1.04 3.32 -1.85 -2.77 116.42 116.14 3fqa h ASP 1377Ca 0.27 -0.15 0.23 0.00 0.02 0.00 0.00 57.03 57.40 3fqa h ASP 1377Cb -0.03 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.44 3fqa h ASP 1377CO -0.09 0.17 0.63 0.00 -1.72 0.00 0.00 179.24 178.23 3fqa h ALA 1378N 0.86 2.29 0.00 3.45 0.00 -0.79 -0.34 119.26 124.74 3fqa h ALA 1378Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fqa h ALA 1378Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3fqa h ALA 1378CO -0.00 -0.60 0.00 1.63 0.00 0.00 0.00 179.25 180.28 3fqa n LYS 1379N -4.51 0.18 0.00 0.00 5.02 -0.58 -2.39 118.16 115.89 3fqa n LYS 1379Ca 0.21 0.15 0.14 0.00 -2.02 0.00 0.00 58.31 56.79 3fqa n LYS 1379Cb 0.78 -1.50 0.64 0.00 -0.02 0.00 0.00 35.03 34.93 3fqa n LYS 1379CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3fqa n LYS 1380N -1.33 0.41 -1.78 1.97 5.02 -0.14 -4.89 118.16 117.44 3fqa n LYS 1380Ca 0.07 -0.09 -0.38 0.00 -2.02 0.00 0.00 58.31 55.89 3fqa n LYS 1380Cb 0.14 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.69 3fqa n LYS 1380CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3fqa s SER 1381N -2.64 5.31 -0.92 4.39 0.01 -1.01 -4.86 113.70 113.98 3fqa s SER 1381Ca 0.25 2.79 -0.24 0.00 1.31 0.00 0.00 55.95 60.06 3fqa s SER 1381Cb 0.20 -2.64 0.05 0.00 0.21 0.00 0.00 66.02 63.84 3fqa s SER 1381CO 0.50 -1.55 1.34 -0.62 0.41 0.00 0.00 173.24 173.32 3fqa s ASP 1382N -0.91 6.41 0.40 2.44 3.68 -0.52 -4.86 116.67 123.32 3fqa s ASP 1382Ca 0.71 -1.23 0.07 0.00 2.13 0.00 0.00 52.55 54.23 3fqa s ASP 1382Cb -0.41 -2.54 0.83 0.00 -1.45 0.00 0.00 42.92 39.35 3fqa s ASP 1382CO 0.49 -1.54 2.01 -0.07 0.13 0.00 0.00 175.17 176.19 3fqa h LEU 1383N 12.52 0.41 -0.74 -1.34 4.07 -1.90 -2.11 115.31 126.22 3fqa h LEU 1383Ca 0.05 -0.03 -0.11 0.00 0.08 0.00 0.00 57.88 57.86 3fqa h LEU 1383Cb 1.03 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.65 3fqa h LEU 1383CO 1.34 0.36 -0.24 1.56 -1.08 0.00 0.00 178.44 180.38 3fqa h GLN 1384N 0.47 0.70 -0.39 1.13 4.20 -1.94 -1.11 115.11 118.18 3fqa h GLN 1384Ca 0.12 -0.28 -0.16 0.00 0.06 0.00 0.00 58.65 58.39 3fqa h GLN 1384Cb 0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 3fqa h GLN 1384CO -0.02 0.88 -0.38 -0.22 -0.67 0.00 0.00 178.83 178.42 3fqa h LYS 1385N 0.61 0.93 -0.91 1.46 3.64 -1.87 -2.55 116.57 117.88 3fqa h LYS 1385Ca 0.08 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3fqa h LYS 1385Cb 0.73 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 3fqa h LYS 1385CO 0.06 1.14 0.59 0.35 -2.27 0.00 0.00 179.45 179.31 3fqa h PHE 1386N 0.76 1.16 -0.32 1.91 3.57 -1.12 0.99 116.94 123.89 3fqa h PHE 1386Ca 0.06 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.61 3fqa h PHE 1386Cb 0.97 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 3fqa h PHE 1386CO 0.06 0.74 0.14 1.03 -2.23 0.00 0.00 178.31 178.05 3fqa h SER 1387N 1.24 0.19 -0.30 0.41 0.87 -0.98 0.32 113.55 115.29 3fqa h SER 1387Ca 0.33 0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.77 3fqa h SER 1387Cb -0.12 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 3fqa h SER 1387CO -0.07 0.14 -0.33 0.03 -0.53 0.00 0.00 176.83 176.07 3fqa h ARG 1388N 0.30 0.83 -0.12 2.24 3.08 -1.04 -2.07 114.38 117.60 3fqa h ARG 1388Ca 0.14 -0.40 0.00 0.00 0.07 0.00 0.00 59.98 59.79 3fqa h ARG 1388Cb 0.08 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3fqa h ARG 1388CO -0.12 1.04 0.07 0.35 -1.07 0.00 0.00 179.97 180.24 3fqa h PHE 1389N 0.69 0.13 -0.29 3.04 3.57 -0.32 -0.35 116.94 123.41 3fqa h PHE 1389Ca 0.07 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3fqa h PHE 1389Cb 0.89 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.56 3fqa h PHE 1389CO 0.05 0.08 0.14 1.25 -2.23 0.00 0.00 178.31 177.60 3fqa h HIS 1390N 0.14 0.26 -0.50 0.41 2.76 -0.27 -0.45 115.15 117.50 3fqa h HIS 1390Ca 0.04 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.19 3fqa h HIS 1390Cb -0.01 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 3fqa h HIS 1390CO -0.08 0.14 0.18 -0.09 -1.30 0.00 0.00 177.93 176.79 3fqa h ARG 1391N 0.29 0.75 -0.82 5.26 9.65 -1.23 -1.60 114.38 126.68 3fqa h ARG 1391Ca 0.12 -0.14 -0.00 0.00 -1.10 0.00 0.00 59.98 58.86 3fqa h ARG 1391Cb 0.05 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 3fqa h ARG 1391CO -0.09 0.68 0.51 0.78 2.80 0.00 0.00 179.97 184.65 3fqa h GLY 1392N 0.66 1.18 1.13 2.80 0.00 -0.77 -1.27 103.07 106.80 3fqa h GLY 1392Ca 0.16 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 3fqa h GLY 1392CO -0.01 0.46 -0.06 -0.33 0.00 0.00 0.00 176.54 176.60 3fqa h MET 1393N 1.12 1.03 -0.75 4.80 2.86 -0.90 -2.40 114.93 120.69 3fqa h MET 1393Ca 0.30 -0.35 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3fqa h MET 1393Cb -0.07 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.47 3fqa h MET 1393CO -0.06 1.04 0.50 1.25 1.06 0.00 0.00 176.91 180.70 3fqa h LEU 1394N 0.92 0.86 -1.58 1.22 5.85 -0.81 -0.14 115.31 121.64 3fqa h LEU 1394Ca 0.15 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3fqa h LEU 1394Cb 0.62 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 3fqa h LEU 1394CO 0.04 0.62 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.38 3fqa h GLU 1395N 1.02 0.00 -0.29 1.25 5.08 -1.04 -1.98 114.58 118.62 3fqa h GLU 1395Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 3fqa h GLU 1395Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3fqa h GLU 1395CO -0.06 0.05 0.00 0.94 -1.00 0.00 0.00 179.01 178.94 3fqa n GLN 1396N -3.19 2.09 -0.82 2.33 -0.06 -0.33 -4.94 117.38 112.46 3fqa n GLN 1396Ca -0.00 -1.65 0.00 0.00 -2.00 0.00 0.00 57.00 53.35 3fqa n GLN 1396Cb 0.30 -1.44 0.00 0.00 -4.06 0.00 0.00 30.24 25.04 3fqa n GLN 1396CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3fqa n GLY 1397N 1.30 0.69 3.20 1.69 0.00 -0.74 -4.99 105.19 106.33 3fqa n GLY 1397Ca 0.17 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 3fqa n GLY 1397CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fqa s ILE 1398N -2.00 2.34 -0.36 -0.61 -1.09 -0.21 -1.39 121.20 117.87 3fqa s ILE 1398Ca 0.00 -0.87 -0.12 0.00 -2.23 0.00 0.00 60.65 57.43 3fqa s ILE 1398Cb 0.00 -1.97 0.01 0.00 -1.58 0.00 0.00 42.46 38.92 3fqa s ILE 1398CO 0.00 0.53 0.22 -0.47 -1.23 0.00 0.00 174.94 173.99 3fqa s TYR 1399N 0.96 3.22 0.26 3.97 5.04 -0.63 -2.99 117.35 127.19 3fqa s TYR 1399Ca -0.03 -0.62 0.10 0.00 -2.44 0.00 0.00 57.07 54.08 3fqa s TYR 1399Cb -0.15 -2.47 -0.04 0.00 0.35 0.00 0.00 41.96 39.65 3fqa s TYR 1399CO -0.04 -0.53 -0.05 -0.51 -1.34 0.00 0.00 175.55 173.09 3fqa s LEU 1400N 1.64 3.07 0.18 6.97 1.43 -1.26 -1.22 118.68 129.48 3fqa s LEU 1400Ca 0.04 -0.70 -0.33 0.00 -1.03 0.00 0.00 54.13 52.11 3fqa s LEU 1400Cb -0.18 -1.61 -0.13 0.00 0.03 0.00 0.00 46.19 44.30 3fqa s LEU 1400CO 0.08 0.02 1.60 0.00 0.23 0.00 0.00 176.35 178.28 3fqa n ALA 1401N -0.76 1.69 -0.67 4.21 0.00 -1.26 -4.81 120.51 118.90 3fqa n ALA 1401Ca -0.07 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.73 3fqa n ALA 1401Cb 0.59 -2.39 -0.11 0.00 0.00 0.00 0.00 19.45 17.54 3fqa n ALA 1401CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3fqa n PRO 1402N 3.45 1.35 -3.63 0.00 -0.04 -1.26 -4.72 135.00 130.16 3fqa n PRO 1402Ca 0.16 -0.64 -0.09 0.00 -0.04 0.00 0.00 63.50 62.89 3fqa n PRO 1402Cb 0.30 -1.79 -0.07 0.00 -0.04 0.00 0.00 33.50 31.91 3fqa n PRO 1402CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3fqa s SER 1403N 2.27 -0.39 0.42 3.54 0.15 -1.26 -4.72 113.70 113.71 3fqa s SER 1403Ca 0.43 0.69 0.28 0.00 0.70 0.00 0.00 55.95 58.04 3fqa s SER 1403Cb 0.21 0.67 0.90 0.00 -1.71 0.00 0.00 66.02 66.09 3fqa s SER 1403CO 0.00 -0.18 1.79 -0.61 1.20 0.00 0.00 173.24 175.44 3fqa h GLN 1404N 3.71 0.00 -0.93 5.44 5.75 -1.95 -3.22 115.11 123.90 3fqa h GLN 1404Ca -0.26 0.00 -0.44 0.00 -0.15 0.00 0.00 58.65 57.81 3fqa h GLN 1404Cb 1.17 0.00 -0.26 0.00 1.07 0.00 0.00 27.48 29.47 3fqa h GLN 1404CO 0.16 0.00 0.55 1.19 -2.65 0.00 0.00 178.83 178.08 3fqa n PHE 1405N -2.84 2.91 -4.55 3.99 3.01 -1.26 -4.36 117.46 114.37 3fqa n PHE 1405Ca 0.03 -1.67 -0.25 0.00 1.01 0.00 0.00 57.45 56.57 3fqa n PHE 1405Cb 0.38 -0.88 -0.17 0.00 -0.01 0.00 0.00 39.48 38.81 3fqa n PHE 1405CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3fqa s GLU 1406N -3.21 1.69 0.66 -1.08 0.41 -1.22 -1.83 118.70 114.13 3fqa s GLU 1406Ca 0.56 -0.40 -0.15 0.00 -0.41 0.00 0.00 54.97 54.57 3fqa s GLU 1406Cb 0.47 -1.41 0.00 0.00 -1.78 0.00 0.00 34.13 31.41 3fqa s GLU 1406CO 0.12 0.01 1.11 0.00 -0.49 0.00 0.00 175.26 176.01 3fqa s ALA 1407N 0.72 2.47 0.34 5.21 0.00 -0.67 -4.76 121.76 125.06 3fqa s ALA 1407Ca -0.14 0.53 0.04 0.00 0.00 0.00 0.00 51.96 52.39 3fqa s ALA 1407Cb -0.16 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3fqa s ALA 1407CO 0.03 -1.29 0.50 0.20 0.00 0.00 0.00 175.76 175.20 3fqa s GLY 1408N -2.63 1.46 0.05 0.00 0.00 0.40 -4.91 107.32 101.69 3fqa s GLY 1408Ca 0.67 -1.24 0.04 0.00 0.00 0.00 0.00 44.72 44.18 3fqa s GLY 1408CO 0.42 -1.17 -0.12 -1.36 0.00 0.00 0.00 173.10 170.88 3fqa s PHE 1409N -2.23 1.00 0.26 1.90 0.40 0.28 -2.30 117.98 117.30 3fqa s PHE 1409Ca 0.42 -0.42 0.11 0.00 -0.60 0.00 0.00 56.93 56.44 3fqa s PHE 1409Cb -0.09 -0.58 -0.05 0.00 0.51 0.00 0.00 43.02 42.80 3fqa s PHE 1409CO 0.33 0.00 -0.17 0.99 0.70 0.00 0.00 175.22 177.07 3fqa s THR 1410N -1.13 2.63 0.21 0.64 2.01 -1.03 -4.31 115.64 114.66 3fqa s THR 1410Ca -0.03 -2.24 0.02 0.00 0.31 0.00 0.00 61.69 59.74 3fqa s THR 1410Cb -0.09 -2.36 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 3fqa s THR 1410CO 0.01 -0.34 0.04 -0.94 -0.69 0.00 0.00 174.62 172.70 3fqa s SER 1411N -3.36 1.20 0.20 3.53 1.04 -1.26 -4.77 113.70 110.27 3fqa s SER 1411Ca 0.28 -1.25 0.20 0.00 0.48 0.00 0.00 55.95 55.66 3fqa s SER 1411Cb -0.06 0.14 0.88 0.00 0.10 0.00 0.00 66.02 67.08 3fqa s SER 1411CO 0.15 -0.63 1.62 0.18 0.98 0.00 0.00 173.24 175.54 3fqa n LEU 1412N -0.33 0.49 0.07 2.42 4.77 0.54 -2.09 117.00 122.86 3fqa n LEU 1412Ca -0.04 0.63 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 3fqa n LEU 1412Cb 0.64 -0.58 0.14 0.00 -2.33 0.00 0.00 43.42 41.29 3fqa n LEU 1412CO 0.35 -0.53 0.30 0.00 -1.33 0.00 0.00 177.39 176.18 3fqa h ALA 1413N 2.28 0.57 -2.62 -1.18 0.00 -1.80 -3.46 119.26 113.05 3fqa h ALA 1413Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 3fqa h ALA 1413Cb 0.29 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.11 3fqa h ALA 1413CO 0.00 0.00 0.67 -1.01 0.00 0.00 0.00 179.25 178.91 3fqa s HIS 1414N -3.20 3.26 0.38 0.00 3.76 -0.89 -4.47 115.29 114.14 3fqa s HIS 1414Ca 0.05 1.13 0.07 0.00 -0.15 0.00 0.00 55.06 56.17 3fqa s HIS 1414Cb 0.13 -3.62 -0.01 0.00 1.11 0.00 0.00 32.58 30.19 3fqa s HIS 1414CO 0.73 -2.02 0.43 0.95 -0.85 0.00 0.00 174.74 173.99 3fqa s THR 1415N 0.50 3.30 0.32 1.30 -4.23 -1.26 -4.95 115.64 110.62 3fqa s THR 1415Ca 0.59 -1.17 0.02 0.00 -1.18 0.00 0.00 61.69 59.96 3fqa s THR 1415Cb -0.36 -3.14 0.28 0.00 1.34 0.00 0.00 72.50 70.62 3fqa s THR 1415CO 0.35 -0.08 1.93 -0.08 -0.54 0.00 0.00 174.62 176.20 3fqa h GLU 1416N 0.94 0.90 -0.27 3.99 4.57 -2.00 -1.30 114.58 121.42 3fqa h GLU 1416Ca -0.43 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 57.58 3fqa h GLU 1416Cb 1.26 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 3fqa h GLU 1416CO 0.53 0.60 -0.32 0.93 -1.18 0.00 0.00 179.01 179.57 3fqa h GLU 1417N 0.93 0.57 -0.72 1.92 5.08 -1.99 -1.67 114.58 118.71 3fqa h GLU 1417Ca 0.36 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 3fqa h GLU 1417Cb 0.21 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 3fqa h GLU 1417CO -0.13 0.82 0.20 -0.44 -1.00 0.00 0.00 179.01 178.46 3fqa h ASP 1418N 0.49 1.07 0.01 1.42 3.32 -1.64 -0.82 116.42 120.26 3fqa h ASP 1418Ca 0.06 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 3fqa h ASP 1418Cb 0.79 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.06 3fqa h ASP 1418CO 0.06 1.01 -0.00 0.40 -1.72 0.00 0.00 179.24 178.99 3fqa h ILE 1419N 1.08 1.09 -0.70 0.35 1.08 -1.13 -1.89 117.51 117.38 3fqa h ILE 1419Ca 0.23 -0.29 0.04 0.00 -0.39 0.00 0.00 64.86 64.44 3fqa h ILE 1419Cb 0.34 1.29 -0.05 0.00 -3.07 0.00 0.00 36.82 35.33 3fqa h ILE 1419CO -0.00 0.08 0.43 0.44 -0.69 0.00 0.00 178.15 178.41 3fqa h ASP 1420N -0.14 0.70 0.11 1.72 3.32 -1.09 -0.99 116.42 120.04 3fqa h ASP 1420Ca -0.00 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 3fqa h ASP 1420Cb 0.13 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 3fqa h ASP 1420CO 0.00 0.48 -0.12 0.00 -1.72 0.00 0.00 179.24 177.88 3fqa h ALA 1421N 1.31 1.78 -0.05 3.45 0.00 -1.00 -0.42 119.26 124.34 3fqa h ALA 1421Ca 0.29 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 3fqa h ALA 1421Cb 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3fqa h ALA 1421CO -0.12 0.17 -0.83 1.15 0.00 0.00 0.00 179.25 179.61 3fqa h THR 1422N 0.02 1.38 -0.32 0.00 2.02 -0.38 -2.14 112.91 113.49 3fqa h THR 1422Ca 0.00 -2.26 -0.14 0.00 0.77 0.00 0.00 66.41 64.79 3fqa h THR 1422Cb 0.22 2.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.86 3fqa h THR 1422CO 0.02 0.68 -0.35 -0.07 0.37 0.00 0.00 175.52 176.17 3fqa h LEU 1423N 0.28 0.86 -1.02 2.58 3.38 -0.56 -1.00 115.31 119.83 3fqa h LEU 1423Ca -0.05 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3fqa h LEU 1423Cb 1.43 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 3fqa h LEU 1423CO 0.15 1.16 0.58 0.00 0.09 0.00 0.00 178.44 180.42 3fqa h ALA 1424N 0.72 1.27 -0.15 1.53 0.00 -1.07 -0.93 119.26 120.64 3fqa h ALA 1424Ca 0.05 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3fqa h ALA 1424Cb 0.93 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3fqa h ALA 1424CO 0.08 0.64 -0.47 0.00 0.00 0.00 0.00 179.25 179.51 3fqa h ALA 1425N 1.37 0.91 -0.12 0.00 0.00 -1.22 -2.71 119.26 117.48 3fqa h ALA 1425Ca 0.34 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 3fqa h ALA 1425Cb -0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3fqa h ALA 1425CO -0.07 0.65 -0.46 0.00 0.00 0.00 0.00 179.25 179.37 3fqa h ALA 1426N 1.18 0.99 -0.14 0.00 0.00 -0.24 -1.75 119.26 119.29 3fqa h ALA 1426Ca 0.02 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 3fqa h ALA 1426Cb 0.95 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 3fqa h ALA 1426CO 0.08 0.64 -0.05 -0.09 0.00 0.00 0.00 179.25 179.83 3fqa h ARG 1427N 0.24 0.29 -0.39 0.00 2.43 -1.07 0.18 114.38 116.05 3fqa h ARG 1427Ca 0.01 -0.12 0.06 0.00 -0.81 0.00 0.00 59.98 59.13 3fqa h ARG 1427Cb 0.92 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.40 3fqa h ARG 1427CO 0.08 0.59 0.10 1.15 -1.51 0.00 0.00 179.97 180.37 3fqa h THR 1428N -0.03 0.82 0.39 0.20 2.02 -1.37 -0.57 112.91 114.37 3fqa h THR 1428Ca 0.03 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 3fqa h THR 1428Cb 0.49 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 3fqa h THR 1428CO 0.02 0.04 -0.19 0.58 0.37 0.00 0.00 175.52 176.34 3fqa h VAL 1429N 0.23 0.58 0.00 3.16 2.07 -1.23 -3.22 116.25 117.83 3fqa h VAL 1429Ca 0.19 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 3fqa h VAL 1429Cb 0.21 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3fqa h VAL 1429CO -0.23 0.08 -0.16 0.24 0.02 0.00 0.00 177.57 177.52 3fqa h MET 1430N -0.80 0.00 0.00 1.57 2.07 -0.89 -1.64 114.93 115.24 3fqa h MET 1430Ca -0.05 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.56 3fqa h MET 1430Cb 0.53 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.26 3fqa h MET 1430CO 0.09 0.16 -0.07 0.77 1.07 0.00 0.00 176.91 178.93 3fqa h SER 1431N 0.00 0.00 0.00 1.22 0.02 -1.11 -3.37 113.55 110.31 3fqa h SER 1431Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fqa h SER 1431Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 3fqa h SER 1431CO 0.02 0.07 0.00 0.00 -1.14 0.00 0.00 176.83 175.78 3fqa n ALA 1432N -2.51 0.00 -0.06 3.77 0.00 -0.62 -5.11 120.51 115.97 3fqa n ALA 1432Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3fqa n ALA 1432Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 3fqa n ALA 1432CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78