#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pdw s SER 1003N 0.00 6.13 0.86 0.00 0.01 -1.26 -5.03 113.70 114.41 1pdw s SER 1003Ca 0.00 1.89 -0.11 0.00 1.31 0.00 0.00 55.95 59.03 1pdw s SER 1003Cb 0.00 -2.55 0.11 0.00 0.21 0.00 0.00 66.02 63.79 1pdw s SER 1003CO 0.00 -0.93 1.09 -0.54 0.41 0.00 0.00 173.24 173.27 1pdw s LYS 1004N -3.56 1.53 0.02 12.44 3.01 -1.26 -4.81 119.74 127.11 1pdw s LYS 1004Ca 0.66 0.83 0.03 0.00 -1.01 0.00 0.00 55.97 56.48 1pdw s LYS 1004Cb -0.16 -1.84 -0.01 0.00 -1.01 0.00 0.00 37.83 34.80 1pdw s LYS 1004CO 0.27 -2.05 -0.09 1.03 0.51 0.00 0.00 175.35 175.02 1pdw s ARG 1005N -4.97 0.63 0.01 1.68 0.52 -1.26 -1.24 118.95 114.32 1pdw s ARG 1005Ca 0.63 -0.50 0.06 0.00 -0.52 0.00 0.00 55.73 55.39 1pdw s ARG 1005Cb -0.17 -0.56 -0.02 0.00 0.52 0.00 0.00 34.95 34.73 1pdw s ARG 1005CO 0.56 0.14 -0.18 0.00 0.02 0.00 0.00 175.30 175.85 1pdw s ALA 1006N -0.66 1.47 -0.24 2.13 0.00 -0.39 -0.75 121.76 123.32 1pdw s ALA 1006Ca -0.01 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 1pdw s ALA 1006Cb -0.06 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1pdw s ALA 1006CO 0.00 0.34 -0.02 -1.17 0.00 0.00 0.00 175.76 174.91 1pdw s LEU 1007N -0.68 3.17 -0.31 0.00 2.96 -0.23 -0.93 118.68 122.67 1pdw s LEU 1007Ca 0.06 -0.58 -0.07 0.00 -0.22 0.00 0.00 54.13 53.32 1pdw s LEU 1007Cb -0.07 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.89 1pdw s LEU 1007CO 0.00 -0.08 0.09 -0.69 -1.32 0.00 0.00 176.35 174.35 1pdw s VAL 1008N 1.44 3.93 -0.48 1.68 1.01 -0.03 -0.18 120.40 127.79 1pdw s VAL 1008Ca 0.04 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 60.98 1pdw s VAL 1008Cb -0.15 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.18 1pdw s VAL 1008CO -0.02 0.01 0.84 -0.63 0.00 0.00 0.00 175.10 175.29 1pdw s ILE 1009N 1.48 4.57 -0.38 2.22 1.01 -1.03 -0.74 121.20 128.32 1pdw s ILE 1009Ca 0.02 0.42 -0.16 0.00 0.00 0.00 0.00 60.65 60.92 1pdw s ILE 1009Cb -0.18 -4.39 0.01 0.00 0.01 0.00 0.00 42.46 37.91 1pdw s ILE 1009CO 0.03 -0.83 0.39 -0.22 0.00 0.00 0.00 174.94 174.30 1pdw s LEU 1010N 3.49 4.70 0.26 2.97 2.96 0.11 -4.44 118.68 128.72 1pdw s LEU 1010Ca 0.31 -0.50 0.10 0.00 -0.22 0.00 0.00 54.13 53.81 1pdw s LEU 1010Cb -0.12 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 1pdw s LEU 1010CO 0.22 -0.45 -0.05 0.00 -1.32 0.00 0.00 176.35 174.74 1pdw s ALA 1011N 2.03 3.05 0.29 5.97 0.00 -1.26 -1.35 121.76 130.48 1pdw s ALA 1011Ca 0.11 -1.67 -0.30 0.00 0.00 0.00 0.00 51.96 50.10 1pdw s ALA 1011Cb -0.17 -0.68 -0.12 0.00 0.00 0.00 0.00 23.12 22.16 1pdw s ALA 1011CO 0.12 0.30 1.62 1.17 0.00 0.00 0.00 175.76 178.97 1pdw n LYS 1012N -0.70 2.74 -0.60 0.00 4.81 -1.26 -1.66 118.16 121.49 1pdw n LYS 1012Ca -0.07 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1pdw n LYS 1012Cb 0.59 -2.77 0.00 0.00 0.02 0.00 0.00 35.03 32.86 1pdw n LYS 1012CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1pdw n GLY 1013N 2.34 0.73 3.77 3.14 0.00 -0.27 -2.37 105.19 112.53 1pdw n GLY 1013Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1pdw n GLY 1013CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pdw s ALA 1014N -2.42 3.11 -0.30 4.61 0.00 -0.66 -2.53 121.76 123.56 1pdw s ALA 1014Ca 0.00 1.11 -0.29 0.00 0.00 0.00 0.00 51.96 52.78 1pdw s ALA 1014Cb 0.00 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1pdw s ALA 1014CO 0.00 -0.79 1.45 -2.00 0.00 0.00 0.00 175.76 174.42 1pdw s GLU 1015N -2.45 3.76 0.00 0.00 -6.30 -0.71 -0.52 118.70 112.48 1pdw s GLU 1015Ca 0.60 1.31 0.00 0.00 -2.50 0.00 0.00 54.97 54.38 1pdw s GLU 1015Cb -0.34 -3.98 0.00 0.00 0.00 0.00 0.00 34.13 29.81 1pdw s GLU 1015CO 0.43 -1.32 0.00 -0.85 0.02 0.00 0.00 175.26 173.54 1pdw n GLU 1016N 7.66 0.00 0.00 4.30 0.00 -1.26 -2.02 120.64 129.32 1pdw n GLU 1016Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.33 1pdw n GLU 1016Cb 0.47 -1.18 0.00 0.00 0.00 0.00 0.00 31.44 30.73 1pdw n GLU 1016CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1pdw n GLU 1018N 0.75 0.00 -0.11 3.44 1.02 -1.26 -0.87 120.64 123.61 1pdw n GLU 1018Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 1pdw n GLU 1018Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 1pdw n GLU 1018CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1pdw n THR 1019N 0.00 1.50 -0.21 2.62 -1.04 -0.86 -4.43 114.28 111.87 1pdw n THR 1019Ca 0.00 -0.07 -0.09 0.00 -2.04 0.00 0.00 64.05 61.85 1pdw n THR 1019Cb 0.00 -2.12 0.02 0.00 -1.82 0.00 0.00 70.33 66.41 1pdw n THR 1019CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1pdw h VAL 1020N -1.00 1.26 0.02 12.58 2.07 -1.29 -2.75 116.25 127.14 1pdw h VAL 1020Ca -0.33 -1.05 0.01 0.00 0.82 0.00 0.00 66.70 66.16 1pdw h VAL 1020Cb 1.21 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1pdw h VAL 1020CO -0.20 0.38 -0.06 0.40 0.02 0.00 0.00 177.57 178.12 1pdw h ILE 1021N 0.91 0.85 -0.69 4.57 2.04 -1.82 0.61 117.51 123.98 1pdw h ILE 1021Ca 0.18 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.00 1pdw h ILE 1021Cb 0.47 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1pdw h ILE 1021CO 0.02 0.00 0.27 -0.65 0.00 0.00 0.00 178.15 177.79 1pdw h PRO 1022N -0.11 1.02 -0.09 2.37 0.11 -1.77 -0.13 132.00 133.41 1pdw h PRO 1022Ca 0.02 -0.18 -0.00 0.00 0.11 0.00 0.00 66.00 65.95 1pdw h PRO 1022Cb 0.13 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.07 1pdw h PRO 1022CO -0.05 0.84 0.04 0.28 -0.21 0.00 0.00 178.00 178.90 1pdw h VAL 1023N 1.00 1.13 0.29 3.15 2.07 -1.16 -3.23 116.25 119.49 1pdw h VAL 1023Ca 0.23 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1pdw h VAL 1023Cb 0.20 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1pdw h VAL 1023CO -0.02 0.11 -0.14 -0.78 0.02 0.00 0.00 177.57 176.76 1pdw h ASP 1024N 0.01 -0.33 0.00 0.57 1.82 -0.69 -1.89 116.42 115.90 1pdw h ASP 1024Ca 0.03 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.57 1pdw h ASP 1024Cb 0.14 0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.23 1pdw h ASP 1024CO -0.00 -0.10 0.00 0.52 -1.61 0.00 0.00 179.24 178.05 1pdw n VAL 1025N -5.19 0.00 0.00 2.25 0.31 -0.08 -1.19 118.33 114.43 1pdw n VAL 1025Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1pdw n VAL 1025Cb 0.22 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 1pdw n VAL 1025CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1pdw n ARG 1027N 0.77 0.00 0.28 5.55 1.74 -0.71 -2.14 116.66 122.15 1pdw n ARG 1027Ca 0.00 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.22 1pdw n ARG 1027Cb 0.00 0.00 0.82 0.00 -1.02 0.00 0.00 32.46 32.26 1pdw n ARG 1027CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pdw h ARG 1028N 0.00 0.00 -0.01 5.56 3.08 -1.41 -0.72 114.38 120.88 1pdw h ARG 1028Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pdw h ARG 1028Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1pdw h ARG 1028CO 0.00 0.07 -0.03 0.00 -1.07 0.00 0.00 179.97 178.94 1pdw n ALA 1029N -2.28 2.65 -0.68 0.04 0.00 -0.91 -4.90 120.51 114.44 1pdw n ALA 1029Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1pdw n ALA 1029Cb 0.17 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1pdw n ALA 1029CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 1030N 1.15 0.65 3.76 0.00 0.00 -0.28 -5.04 105.19 105.43 1pdw n GLY 1030Ca 0.20 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1pdw n GLY 1030CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pdw s ILE 1031N -2.00 4.38 -0.51 -0.61 1.01 -1.26 -4.58 121.20 117.63 1pdw s ILE 1031Ca 0.00 1.80 -0.24 0.00 0.00 0.00 0.00 60.65 62.21 1pdw s ILE 1031Cb 0.00 -4.19 0.03 0.00 0.01 0.00 0.00 42.46 38.32 1pdw s ILE 1031CO 0.00 0.48 0.92 -0.54 0.00 0.00 0.00 174.94 175.79 1pdw s LYS 1032N -0.88 3.41 -0.19 2.79 1.02 -0.37 -4.25 119.74 121.28 1pdw s LYS 1032Ca 0.38 -0.09 -0.09 0.00 0.02 0.00 0.00 55.97 56.19 1pdw s LYS 1032Cb -0.23 -3.99 -0.05 0.00 -0.52 0.00 0.00 37.83 33.04 1pdw s LYS 1032CO 0.27 -1.35 0.10 0.08 -0.92 0.00 0.00 175.35 173.54 1pdw s VAL 1033N 3.81 5.18 -0.23 3.17 1.01 -1.26 -1.26 120.40 130.82 1pdw s VAL 1033Ca 0.33 0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.38 1pdw s VAL 1033Cb -0.12 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.92 1pdw s VAL 1033CO 0.22 0.46 -0.05 -0.89 0.00 0.00 0.00 175.10 174.84 1pdw s THR 1034N 0.25 3.22 -0.43 3.92 2.01 -0.10 -4.97 115.64 119.53 1pdw s THR 1034Ca 0.07 -0.62 -0.18 0.00 0.31 0.00 0.00 61.69 61.26 1pdw s THR 1034Cb -0.12 -2.49 0.02 0.00 0.01 0.00 0.00 72.50 69.92 1pdw s THR 1034CO -0.01 0.38 0.51 -0.69 -0.69 0.00 0.00 174.62 174.12 1pdw s VAL 1035N 1.44 5.00 -0.18 3.82 1.01 -1.26 -0.85 120.40 129.38 1pdw s VAL 1035Ca 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 61.98 61.78 1pdw s VAL 1035Cb -0.15 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 1pdw s VAL 1035CO -0.04 -0.49 0.00 0.00 0.00 0.00 0.00 175.10 174.57 1pdw s ALA 1036N 2.37 3.11 -0.29 5.51 0.00 0.09 0.63 121.76 133.18 1pdw s ALA 1036Ca 0.16 -0.86 -0.28 0.00 0.00 0.00 0.00 51.96 50.98 1pdw s ALA 1036Cb -0.16 -1.72 0.01 0.00 0.00 0.00 0.00 23.12 21.25 1pdw s ALA 1036CO 0.15 0.07 1.00 0.20 0.00 0.00 0.00 175.76 177.18 1pdw s GLY 1037N 0.60 1.64 0.28 0.00 0.00 0.13 0.04 107.32 110.00 1pdw s GLY 1037Ca -0.00 -0.06 0.01 0.00 0.00 0.00 0.00 44.72 44.67 1pdw s GLY 1037CO 0.02 2.12 1.76 -2.00 0.00 0.00 0.00 173.10 175.01 1pdw h LEU 1038N 9.74 0.60 -3.94 0.66 5.85 -1.56 -0.63 115.31 126.02 1pdw h LEU 1038Ca -0.21 0.10 -0.64 0.00 0.84 0.00 0.00 57.88 57.97 1pdw h LEU 1038Cb 1.07 -0.00 -0.27 0.00 0.37 0.00 0.00 40.66 41.82 1pdw h LEU 1038CO 0.98 0.23 0.83 0.00 -0.34 0.00 0.00 178.44 180.14 1pdw n ALA 1039N -2.40 6.21 0.00 1.25 0.00 -1.26 -4.61 120.51 119.70 1pdw n ALA 1039Ca 0.19 -3.28 0.00 0.00 0.00 0.00 0.00 53.44 50.35 1pdw n ALA 1039Cb 0.49 -1.73 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1pdw n ALA 1039CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 1040N -0.78 -1.50 0.18 0.00 0.00 -0.86 -4.62 105.19 97.60 1pdw n GLY 1040Ca 0.59 -2.07 0.12 0.00 0.00 0.00 0.00 46.02 44.66 1pdw n GLY 1040CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pdw n LYS 1041N 0.00 0.55 -1.28 1.61 2.85 -1.26 -3.80 118.16 116.83 1pdw n LYS 1041Ca 0.00 -0.36 -0.34 0.00 -1.05 0.00 0.00 58.31 56.56 1pdw n LYS 1041Cb 0.00 -1.49 0.11 0.00 -0.65 0.00 0.00 35.03 33.00 1pdw n LYS 1041CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1pdw s ASP 1042N -2.69 3.86 0.56 -5.58 1.01 -1.26 -4.42 116.67 108.14 1pdw s ASP 1042Ca 0.18 2.44 -0.20 0.00 0.71 0.00 0.00 52.55 55.68 1pdw s ASP 1042Cb 0.18 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.46 1pdw s ASP 1042CO 0.61 -2.49 1.13 -2.65 0.21 0.00 0.00 175.17 171.98 1pdw n PRO 1043N -2.93 1.26 -4.65 8.23 -0.02 -1.26 -4.53 135.00 131.10 1pdw n PRO 1043Ca 0.14 0.47 -0.33 0.00 -2.02 0.00 0.00 63.50 61.76 1pdw n PRO 1043Cb 0.50 -2.32 -0.13 0.00 -0.02 0.00 0.00 33.50 31.53 1pdw n PRO 1043CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pdw s VAL 1044N -1.39 3.35 -0.34 -1.45 1.01 0.67 -4.92 120.40 117.33 1pdw s VAL 1044Ca 0.73 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.92 1pdw s VAL 1044Cb -0.44 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1pdw s VAL 1044CO 0.49 0.52 0.75 -1.58 0.00 0.00 0.00 175.10 175.28 1pdw s GLN 1045N 0.28 3.81 0.82 2.72 0.74 -1.26 -1.44 119.66 125.33 1pdw s GLN 1045Ca -0.07 0.35 -0.09 0.00 0.05 0.00 0.00 55.36 55.60 1pdw s GLN 1045Cb -0.15 -3.78 0.18 0.00 1.10 0.00 0.00 33.01 30.36 1pdw s GLN 1045CO 0.05 -0.76 1.12 0.00 -0.55 0.00 0.00 175.29 175.14 1pdw h SER 1047N -1.17 0.36 -0.82 0.00 4.64 -0.89 -1.73 113.55 113.94 1pdw h SER 1047Ca -0.36 0.11 -0.50 0.00 -0.47 0.00 0.00 61.79 60.56 1pdw h SER 1047Cb 1.13 0.07 -0.27 0.00 -0.31 0.00 0.00 62.40 63.02 1pdw h SER 1047CO 0.31 0.13 0.37 0.54 -0.87 0.00 0.00 176.83 177.30 1pdw n ARG 1048N -4.97 2.50 -1.02 4.77 3.00 -1.26 -4.93 116.66 114.75 1pdw n ARG 1048Ca 0.16 -3.31 -0.01 0.00 -0.01 0.00 0.00 57.85 54.68 1pdw n ARG 1048Cb 0.45 -2.15 -0.00 0.00 0.00 0.00 0.00 32.46 30.75 1pdw n ARG 1048CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1pdw n ASP 1049N -1.00 -5.28 -4.76 0.55 8.00 -0.65 -4.98 116.55 108.42 1pdw n ASP 1049Ca 0.53 0.02 -0.41 0.00 0.71 0.00 0.00 54.79 55.64 1pdw n ASP 1049Cb 1.08 -2.85 -0.03 0.00 -0.02 0.00 0.00 41.12 39.30 1pdw n ASP 1049CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pdw s VAL 1050N -1.29 3.13 -0.24 2.53 1.01 -1.26 -4.69 120.40 119.59 1pdw s VAL 1050Ca 0.00 1.11 -0.03 0.00 0.00 0.00 0.00 61.98 63.06 1pdw s VAL 1050Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1pdw s VAL 1050CO 0.00 0.25 -0.04 -0.69 0.00 0.00 0.00 175.10 174.63 1pdw s VAL 1051N -1.00 3.27 -0.13 2.92 1.01 -1.26 -1.10 120.40 124.12 1pdw s VAL 1051Ca 0.48 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.78 1pdw s VAL 1051Cb -0.36 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 1pdw s VAL 1051CO 0.46 0.32 -0.12 -0.63 0.00 0.00 0.00 175.10 175.12 1pdw s ILE 1052N 1.43 3.13 -0.33 2.22 1.01 -0.52 -4.87 121.20 123.27 1pdw s ILE 1052Ca 0.04 -0.64 -0.20 0.00 0.00 0.00 0.00 60.65 59.85 1pdw s ILE 1052Cb -0.15 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 40.00 1pdw s ILE 1052CO -0.03 0.53 0.63 0.00 0.00 0.00 0.00 174.94 176.06 1pdw s PRO 1054N 2.64 1.64 0.35 0.00 0.04 -1.26 -4.93 135.00 133.48 1pdw s PRO 1054Ca 0.24 1.10 0.18 0.00 0.04 0.00 0.00 61.00 62.57 1pdw s PRO 1054Cb -0.15 -1.83 0.47 0.00 0.04 0.00 0.00 34.50 33.03 1pdw s PRO 1054CO 0.13 -2.06 1.63 -0.44 0.04 0.00 0.00 177.00 176.31 1pdw h ASP 1055N -1.43 0.00 -5.23 6.66 3.32 -0.19 -3.47 116.42 116.08 1pdw h ASP 1055Ca -0.46 0.00 0.22 0.00 0.02 0.00 0.00 57.03 56.81 1pdw h ASP 1055Cb 1.26 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.69 1pdw h ASP 1055CO 0.51 0.39 0.63 0.00 -1.72 0.00 0.00 179.24 179.05 1pdw s ALA 1056N -3.34 -1.91 0.58 3.45 0.00 -1.02 -4.98 121.76 114.54 1pdw s ALA 1056Ca 0.02 0.62 -0.15 0.00 0.00 0.00 0.00 51.96 52.45 1pdw s ALA 1056Cb 0.09 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 1pdw s ALA 1056CO 0.70 -0.94 1.04 -1.54 0.00 0.00 0.00 175.76 175.02 1pdw s SER 1057N -2.79 5.99 0.35 0.00 1.04 -1.26 -0.69 113.70 116.34 1pdw s SER 1057Ca 0.11 1.71 0.08 0.00 0.48 0.00 0.00 55.95 58.34 1pdw s SER 1057Cb 0.01 -2.52 0.65 0.00 0.10 0.00 0.00 66.02 64.25 1pdw s SER 1057CO -0.02 -1.02 1.83 0.25 0.98 0.00 0.00 173.24 175.25 1pdw h LEU 1058N 0.42 0.23 -0.49 2.42 5.85 -1.36 -0.73 115.31 121.65 1pdw h LEU 1058Ca -0.46 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.24 1pdw h LEU 1058Cb 1.21 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 1pdw h LEU 1058CO 0.59 0.49 0.21 -0.08 -0.34 0.00 0.00 178.44 179.30 1pdw h GLU 1059N 0.21 0.40 0.08 1.25 4.81 -1.86 0.35 114.58 119.82 1pdw h GLU 1059Ca 0.03 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1pdw h GLU 1059Cb 0.56 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1pdw h GLU 1059CO 0.04 0.27 -0.04 -0.44 -0.73 0.00 0.00 179.01 178.11 1pdw h ASP 1060N 0.42 -0.09 -1.10 1.04 3.32 -1.86 -3.28 116.42 114.87 1pdw h ASP 1060Ca 0.22 -0.44 0.30 0.00 0.02 0.00 0.00 57.03 57.13 1pdw h ASP 1060Cb 0.19 0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.67 1pdw h ASP 1060CO -0.19 0.57 0.72 0.00 -1.72 0.00 0.00 179.24 178.62 1pdw h ALA 1061N -0.40 2.44 0.00 3.45 0.00 -1.07 0.22 119.26 123.91 1pdw h ALA 1061Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1pdw h ALA 1061Cb 0.53 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1pdw h ALA 1061CO 0.02 -0.86 0.32 -0.22 0.00 0.00 0.00 179.25 178.51 1pdw h LYS 1062N 0.29 0.00 -0.00 0.00 3.64 -0.35 -0.27 116.57 119.87 1pdw h LYS 1062Ca 0.62 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.00 1pdw h LYS 1062Cb 1.76 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.58 1pdw h LYS 1062CO -0.26 0.00 -0.19 1.63 -2.27 0.00 0.00 179.45 178.36 1pdw n LYS 1063N -2.82 2.82 -1.50 1.90 4.76 0.78 -4.85 118.16 119.24 1pdw n LYS 1063Ca -0.02 -0.40 -0.41 0.00 -2.87 0.00 0.00 58.31 54.62 1pdw n LYS 1063Cb 0.37 -0.96 -0.04 0.00 -1.84 0.00 0.00 35.03 32.56 1pdw n LYS 1063CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1pdw n GLU 1064N -0.50 1.90 -0.83 1.97 -0.58 -0.11 -4.87 120.64 117.61 1pdw n GLU 1064Ca 0.03 -2.18 0.09 0.00 -0.42 0.00 0.00 57.16 54.67 1pdw n GLU 1064Cb 0.14 -3.15 -0.03 0.00 -0.57 0.00 0.00 31.44 27.83 1pdw n GLU 1064CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pdw n GLY 1065N 4.68 -1.08 3.82 0.62 0.00 -1.26 -4.79 105.19 107.18 1pdw n GLY 1065Ca 0.49 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1pdw n GLY 1065CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1pdw s PRO 1066N -2.40 3.52 -0.05 1.61 0.02 -1.26 -5.00 135.00 131.44 1pdw s PRO 1066Ca 0.00 1.06 0.05 0.00 0.02 0.00 0.00 61.00 62.13 1pdw s PRO 1066Cb 0.00 -2.07 -0.02 0.00 0.02 0.00 0.00 34.50 32.43 1pdw s PRO 1066CO 0.00 -0.64 -0.19 0.71 -0.33 0.00 0.00 177.00 176.55 1pdw s TYR 1067N -2.63 2.56 -0.18 6.54 1.51 -1.26 -4.92 117.35 118.97 1pdw s TYR 1067Ca 0.61 -0.35 0.29 0.00 -1.01 0.00 0.00 57.07 56.60 1pdw s TYR 1067Cb -0.13 -1.60 1.22 0.00 -0.11 0.00 0.00 41.96 41.34 1pdw s TYR 1067CO 0.38 0.04 1.85 -0.44 -1.11 0.00 0.00 175.55 176.27 1pdw h ASP 1068N 5.57 0.00 -3.89 2.29 3.32 -1.32 -3.44 116.42 118.95 1pdw h ASP 1068Ca -0.42 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.56 1pdw h ASP 1068Cb 1.15 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.48 1pdw h ASP 1068CO 0.49 0.00 -0.02 0.54 -1.72 0.00 0.00 179.24 178.53 1pdw s VAL 1069N -3.51 -0.00 -0.24 -1.35 0.11 -1.05 -3.12 120.40 111.24 1pdw s VAL 1069Ca 0.02 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.06 1pdw s VAL 1069Cb 0.09 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 34.13 1pdw s VAL 1069CO 0.44 0.00 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.45 1pdw s VAL 1070N 0.40 2.86 -0.19 2.04 1.01 -0.72 -1.06 120.40 124.74 1pdw s VAL 1070Ca -0.01 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.95 1pdw s VAL 1070Cb -0.04 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 1pdw s VAL 1070CO -0.00 0.27 0.11 -0.69 0.00 0.00 0.00 175.10 174.79 1pdw s VAL 1071N 1.35 5.22 -0.34 2.92 1.01 0.75 -0.95 120.40 130.35 1pdw s VAL 1071Ca 0.02 0.12 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1pdw s VAL 1071Cb -0.16 -3.37 0.08 0.00 0.00 0.00 0.00 36.38 32.93 1pdw s VAL 1071CO -0.05 0.46 0.08 -0.76 0.00 0.00 0.00 175.10 174.82 1pdw s LEU 1072N 0.29 4.47 1.04 3.92 1.43 0.15 -2.48 118.68 127.51 1pdw s LEU 1072Ca 0.07 -1.62 -0.12 0.00 -1.03 0.00 0.00 54.13 51.42 1pdw s LEU 1072Cb -0.11 -1.75 0.21 0.00 0.03 0.00 0.00 46.19 44.57 1pdw s LEU 1072CO -0.01 -0.37 1.07 -2.84 0.23 0.00 0.00 176.35 174.42 1pdw s PRO 1073N 1.18 0.05 0.00 1.29 0.02 -1.26 -2.53 135.00 133.75 1pdw s PRO 1073Ca 0.01 0.81 0.00 0.00 0.02 0.00 0.00 61.00 61.84 1pdw s PRO 1073Cb -0.21 -1.67 0.00 0.00 0.02 0.00 0.00 34.50 32.64 1pdw s PRO 1073CO -0.03 -3.06 0.00 0.41 -0.33 0.00 0.00 177.00 173.99 1pdw n GLY 1074N -0.17 1.68 0.08 0.52 0.00 -1.19 -4.09 105.19 102.01 1pdw n GLY 1074Ca 0.05 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1pdw n GLY 1074CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 1075N 5.00 -0.05 0.38 -0.02 0.00 -1.26 -1.74 105.19 107.50 1pdw n GLY 1075Ca 0.00 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 1pdw n GLY 1075CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1pdw h ASN 1076N 0.00 -1.13 -0.30 1.61 2.35 -1.95 0.27 115.58 116.42 1pdw h ASN 1076Ca 0.00 0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1pdw h ASN 1076Cb 0.00 0.44 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 1pdw h ASN 1076CO 0.00 -0.44 0.13 0.25 -1.65 0.00 0.00 177.43 175.72 1pdw h LEU 1077N -0.56 0.41 -0.61 1.61 5.85 -1.86 -0.40 115.31 119.75 1pdw h LEU 1077Ca 0.04 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1pdw h LEU 1077Cb 0.62 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1pdw h LEU 1077CO -0.27 0.44 0.36 1.23 -0.34 0.00 0.00 178.44 179.86 1pdw h GLY 1078N 0.35 0.89 1.03 3.75 0.00 -1.17 0.77 103.07 108.68 1pdw h GLY 1078Ca 0.10 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1pdw h GLY 1078CO -0.01 0.37 0.28 0.00 0.00 0.00 0.00 176.54 177.18 1pdw h ALA 1079N 1.18 0.94 -0.26 3.60 0.00 -0.33 0.01 119.26 124.40 1pdw h ALA 1079Ca 0.22 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pdw h ALA 1079Cb -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1pdw h ALA 1079CO -0.04 0.57 0.16 0.37 0.00 0.00 0.00 179.25 180.31 1pdw h GLN 1080N 1.04 0.35 -0.59 0.00 4.15 -0.46 0.24 115.11 119.83 1pdw h GLN 1080Ca 0.24 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.61 1pdw h GLN 1080Cb 0.22 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.81 1pdw h GLN 1080CO -0.02 0.26 0.27 -0.91 -1.93 0.00 0.00 178.83 176.50 1pdw h ASN 1081N 0.33 0.76 -0.45 -0.69 -0.26 -0.52 -1.12 115.58 113.62 1pdw h ASN 1081Ca 0.09 -0.08 -0.10 0.00 -0.56 0.00 0.00 56.30 55.65 1pdw h ASN 1081Cb -0.00 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.05 1pdw h ASN 1081CO -0.02 0.65 -0.11 -0.07 -1.06 0.00 0.00 177.43 176.83 1pdw h LEU 1082N 0.83 0.88 -1.74 1.61 3.38 -0.42 -2.85 115.31 117.01 1pdw h LEU 1082Ca 0.20 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1pdw h LEU 1082Cb 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1pdw h LEU 1082CO -0.03 1.03 -0.04 0.28 0.09 0.00 0.00 178.44 179.78 1pdw h SER 1083N 0.71 0.10 0.16 -0.43 0.02 0.41 -2.76 113.55 111.75 1pdw h SER 1083Ca 0.11 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1pdw h SER 1083Cb 0.65 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1pdw h SER 1083CO 0.04 0.16 -0.25 -0.62 -1.14 0.00 0.00 176.83 175.03 1pdw n GLU 1084N -4.42 1.04 -2.99 3.45 1.02 -0.52 -4.79 120.64 113.42 1pdw n GLU 1084Ca -0.02 -0.66 -0.40 0.00 -0.02 0.00 0.00 57.16 56.06 1pdw n GLU 1084Cb 0.16 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.05 1pdw n GLU 1084CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1pdw s SER 1085N -2.42 6.92 0.48 1.62 0.15 -1.04 -4.92 113.70 114.49 1pdw s SER 1085Ca 0.25 1.12 0.27 0.00 0.70 0.00 0.00 55.95 58.29 1pdw s SER 1085Cb 0.19 -2.42 0.72 0.00 -1.71 0.00 0.00 66.02 62.80 1pdw s SER 1085CO 0.50 -0.26 1.75 0.00 1.20 0.00 0.00 173.24 176.43 1pdw h ALA 1086N 7.13 1.00 -0.16 5.45 0.00 -1.91 -2.76 119.26 128.01 1pdw h ALA 1086Ca -0.35 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 1pdw h ALA 1086Cb 1.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1pdw h ALA 1086CO 0.79 0.00 -0.68 0.00 0.00 0.00 0.00 179.25 179.36 1pdw h ALA 1087N 2.00 0.51 -0.29 0.00 0.00 -1.95 -2.32 119.26 117.21 1pdw h ALA 1087Ca -0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 54.91 54.23 1pdw h ALA 1087Cb 0.82 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1pdw h ALA 1087CO 0.00 0.71 -0.28 0.28 0.00 0.00 0.00 179.25 179.96 1pdw h VAL 1088N 0.46 1.28 -0.01 0.00 2.07 -1.81 -2.13 116.25 116.11 1pdw h VAL 1088Ca -0.02 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.14 1pdw h VAL 1088Cb 1.27 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 32.40 1pdw h VAL 1088CO 0.13 0.44 0.00 0.50 0.02 0.00 0.00 177.57 178.66 1pdw h LYS 1089N 0.50 0.01 -0.11 1.57 3.64 -1.33 0.44 116.57 121.29 1pdw h LYS 1089Ca 0.07 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1pdw h LYS 1089Cb 0.74 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 1pdw h LYS 1089CO 0.06 0.02 -0.13 1.49 -2.27 0.00 0.00 179.45 178.61 1pdw h GLU 1090N -0.00 -0.16 0.13 1.90 4.81 -1.24 0.11 114.58 120.12 1pdw h GLU 1090Ca 0.00 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1pdw h GLU 1090Cb 0.01 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1pdw h GLU 1090CO -0.00 -0.11 -0.09 0.82 -0.73 0.00 0.00 179.01 178.90 1pdw h ILE 1091N -0.17 0.80 -0.45 2.32 2.04 -1.15 -0.52 117.51 120.38 1pdw h ILE 1091Ca 0.08 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.90 1pdw h ILE 1091Cb 0.29 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1pdw h ILE 1091CO -0.21 0.00 0.12 -0.07 0.00 0.00 0.00 178.15 177.99 1pdw h LEU 1092N -0.22 0.67 -0.65 1.44 3.38 -0.75 -0.62 115.31 118.55 1pdw h LEU 1092Ca -0.01 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1pdw h LEU 1092Cb 0.20 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1pdw h LEU 1092CO -0.00 0.71 0.39 0.11 0.09 0.00 0.00 178.44 179.75 1pdw h LYS 1093N 0.59 0.88 -0.34 1.13 1.79 -0.69 -0.42 116.57 119.51 1pdw h LYS 1093Ca 0.14 -0.08 -0.13 0.00 -2.18 0.00 0.00 60.65 58.40 1pdw h LYS 1093Cb 0.30 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1pdw h LYS 1093CO -0.00 0.63 -0.32 1.49 -1.08 0.00 0.00 179.45 180.17 1pdw h GLU 1094N 0.89 0.73 -0.65 3.15 4.22 -0.94 -2.33 114.58 119.65 1pdw h GLU 1094Ca 0.23 -0.34 -0.09 0.00 0.08 0.00 0.00 59.36 59.25 1pdw h GLU 1094Cb -0.03 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1pdw h GLU 1094CO -0.04 0.95 0.06 0.37 -2.18 0.00 0.00 179.01 178.17 1pdw h GLN 1095N 0.62 1.11 0.69 1.92 5.75 -0.80 -2.69 115.11 121.70 1pdw h GLN 1095Ca 0.07 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.21 1pdw h GLN 1095Cb 0.84 -0.12 0.01 0.00 1.07 0.00 0.00 27.48 29.28 1pdw h GLN 1095CO 0.07 1.04 -0.33 1.49 -2.65 0.00 0.00 178.83 178.45 1pdw h GLU 1096N 1.02 -0.89 0.00 1.69 4.81 -0.90 0.46 114.58 120.77 1pdw h GLU 1096Ca 0.19 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1pdw h GLU 1096Cb 0.50 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1pdw h GLU 1096CO 0.02 -0.56 0.00 0.27 -0.73 0.00 0.00 179.01 178.01 1pdw n ASN 1097N -5.43 0.18 -0.67 1.04 2.04 -0.89 -0.31 115.26 111.22 1pdw n ASN 1097Ca -0.13 0.55 0.13 0.00 -0.44 0.00 0.00 54.58 54.69 1pdw n ASN 1097Cb 0.38 -0.58 0.32 0.00 -2.53 0.00 0.00 39.78 37.37 1pdw n ASN 1097CO 0.00 0.00 0.00 -2.11 -0.44 0.00 0.00 177.26 174.71 1pdw n ARG 1098N -1.70 1.88 -3.08 -3.83 1.85 -1.02 -4.96 116.66 105.81 1pdw n ARG 1098Ca 0.03 -1.34 -0.13 0.00 -1.00 0.00 0.00 57.85 55.40 1pdw n ARG 1098Cb 0.17 -1.47 0.07 0.00 -1.05 0.00 0.00 32.46 30.17 1pdw n ARG 1098CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1pdw n LYS 1099N 0.61 -4.40 -4.10 2.89 4.76 0.58 -5.04 118.16 113.47 1pdw n LYS 1099Ca 0.16 0.69 -0.25 0.00 -2.87 0.00 0.00 58.31 56.04 1pdw n LYS 1099Cb 0.46 -5.14 -0.05 0.00 -1.84 0.00 0.00 35.03 28.46 1pdw n LYS 1099CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1pdw s GLY 1100N -3.89 1.64 0.28 0.72 0.00 0.16 -5.02 107.32 101.21 1pdw s GLY 1100Ca 0.10 -1.27 -0.29 0.00 0.00 0.00 0.00 44.72 43.25 1pdw s GLY 1100CO 0.59 -1.29 1.17 -2.27 0.00 0.00 0.00 173.10 171.30 1pdw s LEU 1101N -3.29 4.50 -0.11 0.66 2.96 -1.18 -4.55 118.68 117.68 1pdw s LEU 1101Ca 0.31 2.39 0.01 0.00 -0.22 0.00 0.00 54.13 56.62 1pdw s LEU 1101Cb -0.09 -3.63 0.02 0.00 0.50 0.00 0.00 46.19 42.98 1pdw s LEU 1101CO 0.24 -0.28 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.22 1pdw s ILE 1102N -1.02 1.34 -0.14 6.68 1.01 0.04 -1.76 121.20 127.36 1pdw s ILE 1102Ca 0.47 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.60 1pdw s ILE 1102Cb -0.34 -1.25 0.01 0.00 0.01 0.00 0.00 42.46 40.89 1pdw s ILE 1102CO 0.44 0.41 -0.19 0.00 0.00 0.00 0.00 174.94 175.60 1pdw s ALA 1103N 1.13 2.09 -0.00 9.38 0.00 -0.12 -0.90 121.76 133.34 1pdw s ALA 1103Ca -0.04 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 50.94 1pdw s ALA 1103Cb -0.14 -1.00 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1pdw s ALA 1103CO -0.03 -0.14 -0.13 0.00 0.00 0.00 0.00 175.76 175.46 1pdw s ALA 1104N 1.01 1.11 0.06 0.00 0.00 -0.24 0.33 121.76 124.03 1pdw s ALA 1104Ca -0.03 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 51.37 1pdw s ALA 1104Cb -0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1pdw s ALA 1104CO -0.05 0.26 -0.13 -1.50 0.00 0.00 0.00 175.76 174.34 1pdw s ILE 1105N -0.39 1.03 0.00 0.00 2.07 -1.05 -1.91 121.20 120.96 1pdw s ILE 1105Ca 0.05 -1.16 0.00 0.00 -1.41 0.00 0.00 60.65 58.13 1pdw s ILE 1105Cb -0.05 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.55 1pdw s ILE 1105CO -0.00 -0.16 0.00 0.00 -1.91 0.00 0.00 174.94 172.87 1pdw n ALA 1107N 8.24 3.54 -0.33 0.00 0.00 -1.26 -1.54 120.51 129.17 1pdw n ALA 1107Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1pdw n ALA 1107Cb 0.00 -0.94 0.14 0.00 0.00 0.00 0.00 19.45 18.64 1pdw n ALA 1107CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pdw h GLY 1108N 4.91 1.33 1.94 0.00 0.00 -0.89 -2.77 103.07 107.59 1pdw h GLY 1108Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1pdw h GLY 1108CO 0.00 0.32 0.03 -2.55 0.00 0.00 0.00 176.54 174.34 1pdw h PRO 1109N 1.07 0.00 0.00 4.80 0.11 -1.77 -1.76 132.00 134.44 1pdw h PRO 1109Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1pdw h PRO 1109Cb 0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1pdw h PRO 1109CO -0.15 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.43 1pdw h THR 1110N 0.00 0.00 0.00 -1.15 1.35 -1.81 -1.15 112.91 110.15 1pdw h THR 1110Ca 0.00 -0.39 -0.11 0.00 -0.55 0.00 0.00 66.41 65.36 1pdw h THR 1110Cb 0.05 1.36 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 1pdw h THR 1110CO 0.00 0.00 -0.50 0.00 -0.25 0.00 0.00 175.52 174.77 1pdw h ALA 1111N 2.02 0.89 -0.21 6.62 0.00 -1.51 -1.97 119.26 125.11 1pdw h ALA 1111Ca 0.00 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1pdw h ALA 1111Cb 0.41 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1pdw h ALA 1111CO 0.00 0.63 -0.40 -0.07 0.00 0.00 0.00 179.25 179.41 1pdw h LEU 1112N 0.00 0.51 0.16 0.00 3.38 -1.36 -1.90 115.31 116.09 1pdw h LEU 1112Ca -0.01 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1pdw h LEU 1112Cb 1.08 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1pdw h LEU 1112CO 0.07 0.85 -0.08 0.25 0.09 0.00 0.00 178.44 179.62 1pdw h LEU 1113N 0.40 -0.18 -2.54 1.67 5.85 -1.35 0.24 115.31 119.38 1pdw h LEU 1113Ca 0.04 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.47 1pdw h LEU 1113Cb 0.88 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 1pdw h LEU 1113CO 0.07 0.23 0.06 0.00 -0.34 0.00 0.00 178.44 178.46 1pdw h ALA 1114N 0.11 1.42 -0.40 1.25 0.00 -1.33 -0.64 119.26 119.67 1pdw h ALA 1114Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pdw h ALA 1114Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1pdw h ALA 1114CO 0.04 -0.08 0.00 0.72 0.00 0.00 0.00 179.25 179.93 1pdw n HIS 1115N -3.56 0.83 -3.91 0.00 8.25 -0.72 -4.99 115.22 111.11 1pdw n HIS 1115Ca -0.02 -0.63 -0.32 0.00 -0.26 0.00 0.00 57.72 56.49 1pdw n HIS 1115Cb 0.15 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1pdw n HIS 1115CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1pdw n GLU 1116N 0.41 -1.78 -4.46 -0.41 1.02 -0.25 -4.94 120.64 110.23 1pdw n GLU 1116Ca 0.18 0.33 -0.34 0.00 -0.02 0.00 0.00 57.16 57.31 1pdw n GLU 1116Cb 0.66 -3.92 -0.12 0.00 -0.02 0.00 0.00 31.44 28.03 1pdw n GLU 1116CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1pdw s ILE 1117N -3.74 3.81 -1.89 -3.67 -1.09 0.71 -4.65 121.20 110.68 1pdw s ILE 1117Ca 0.26 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 1pdw s ILE 1117Cb -0.11 -2.65 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 1pdw s ILE 1117CO 0.90 0.51 0.00 0.61 -1.23 0.00 0.00 174.94 175.74 1pdw n GLY 1118N 3.34 0.24 3.58 6.18 0.00 -1.26 -4.70 105.19 112.57 1pdw n GLY 1118Ca -0.18 -0.02 -0.51 0.00 0.00 0.00 0.00 46.02 45.32 1pdw n GLY 1118CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1pdw n PHE 1119N -3.54 1.40 0.00 1.61 0.99 -1.26 -0.95 117.46 115.71 1pdw n PHE 1119Ca -0.23 0.66 0.00 0.00 -0.00 0.00 0.00 57.45 57.88 1pdw n PHE 1119Cb 0.68 -2.31 0.00 0.00 -1.00 0.00 0.00 39.48 36.86 1pdw n PHE 1119CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pdw n GLY 1120N 2.31 2.00 3.76 1.37 0.00 0.22 -4.98 105.19 109.88 1pdw n GLY 1120Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1pdw n GLY 1120CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pdw s SER 1121N -1.50 4.78 -0.23 1.61 0.01 -0.12 -4.44 113.70 113.80 1pdw s SER 1121Ca 0.00 1.96 -0.21 0.00 1.31 0.00 0.00 55.95 59.01 1pdw s SER 1121Cb 0.00 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 1pdw s SER 1121CO 0.00 -1.85 0.65 -0.75 0.41 0.00 0.00 173.24 171.70 1pdw s LYS 1122N -4.39 4.15 0.11 12.44 2.20 -1.26 -1.46 119.74 131.54 1pdw s LYS 1122Ca 0.65 0.62 0.00 0.00 -0.36 0.00 0.00 55.97 56.88 1pdw s LYS 1122Cb -0.20 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.45 1pdw s LYS 1122CO 0.47 -0.37 -0.01 0.14 -0.36 0.00 0.00 175.35 175.22 1pdw s VAL 1123N 2.34 0.43 0.24 4.02 -7.23 -0.10 -4.41 120.40 115.70 1pdw s VAL 1123Ca 0.28 -1.91 0.05 0.00 -1.81 0.00 0.00 61.98 58.59 1pdw s VAL 1123Cb -0.16 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 1pdw s VAL 1123CO 0.09 -0.73 -0.04 0.28 -0.31 0.00 0.00 175.10 174.39 1pdw s THR 1124N -3.81 1.32 0.28 5.32 -1.32 -1.26 0.05 115.64 116.22 1pdw s THR 1124Ca 0.16 -2.08 -0.07 0.00 -1.21 0.00 0.00 61.69 58.49 1pdw s THR 1124Cb 0.07 -2.32 0.03 0.00 -1.51 0.00 0.00 72.50 68.76 1pdw s THR 1124CO -0.03 -0.37 0.51 0.35 -2.21 0.00 0.00 174.62 172.87 1pdw n THR 1125N -0.46 0.00 -2.29 5.08 -2.24 -1.26 -4.22 114.28 108.88 1pdw n THR 1125Ca -0.06 -0.97 -0.39 0.00 -2.27 0.00 0.00 64.05 60.36 1pdw n THR 1125Cb 0.63 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.61 1pdw n THR 1125CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1pdw s HIS 1126N -3.73 3.14 0.47 4.78 2.46 -0.59 -4.47 115.29 117.34 1pdw s HIS 1126Ca 0.16 1.55 0.27 0.00 0.47 0.00 0.00 55.06 57.51 1pdw s HIS 1126Cb -0.03 -3.43 1.32 0.00 -0.13 0.00 0.00 32.58 30.32 1pdw s HIS 1126CO 0.11 -1.30 1.79 -1.35 -2.47 0.00 0.00 174.74 171.52 1pdw h PRO 1127N 2.93 0.19 0.00 2.88 0.11 -1.92 0.27 132.00 136.46 1pdw h PRO 1127Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1pdw h PRO 1127Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1pdw h PRO 1127CO 0.64 0.13 0.00 1.28 -0.21 0.00 0.00 178.00 179.83 1pdw n LEU 1128N -4.43 0.00 -0.02 2.35 4.77 -1.26 -2.99 117.00 115.42 1pdw n LEU 1128Ca 0.25 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1pdw n LEU 1128Cb 1.05 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1pdw n LEU 1128CO 0.32 -0.00 0.26 0.00 -1.33 0.00 0.00 177.39 176.64 1pdw n ALA 1129N -1.02 2.49 -0.10 -1.18 0.00 0.94 -4.78 120.51 116.88 1pdw n ALA 1129Ca 0.21 -0.50 -0.06 0.00 0.00 0.00 0.00 53.44 53.09 1pdw n ALA 1129Cb 0.10 -0.02 0.01 0.00 0.00 0.00 0.00 19.45 19.55 1pdw n ALA 1129CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1pdw h LYS 1130N 0.12 0.15 -0.37 0.00 3.64 -1.42 -2.96 116.57 115.73 1pdw h LYS 1130Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1pdw h LYS 1130Cb 0.03 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1pdw h LYS 1130CO 0.00 0.10 0.15 -0.44 -2.27 0.00 0.00 179.45 176.99 1pdw h ASP 1131N 0.15 0.51 -0.01 4.20 3.32 -1.86 -3.42 116.42 119.32 1pdw h ASP 1131Ca 0.16 -0.16 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 1pdw h ASP 1131Cb 0.20 -0.13 0.12 0.00 0.22 0.00 0.00 39.33 39.74 1pdw h ASP 1131CO -0.24 0.54 1.16 1.17 -1.72 0.00 0.00 179.24 180.15 1pdw n LYS 1132N -4.67 0.01 0.00 3.56 4.81 -1.12 -4.90 118.16 115.85 1pdw n LYS 1132Ca -0.01 -0.99 0.00 0.00 -0.87 0.00 0.00 58.31 56.45 1pdw n LYS 1132Cb 0.14 -2.52 0.00 0.00 0.02 0.00 0.00 35.03 32.67 1pdw n LYS 1132CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1pdw n ASN 1135N 9.67 0.00 0.00 3.14 5.15 -1.26 -5.08 115.26 126.88 1pdw n ASN 1135Ca 0.42 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.40 1pdw n ASN 1135Cb 0.41 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.66 1pdw n ASN 1135CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1pdw n GLY 1136N 0.27 1.02 2.91 8.20 0.00 -1.26 -4.63 105.19 111.70 1pdw n GLY 1136Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1pdw n GLY 1136CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 1137N -0.98 -0.52 0.15 -0.02 0.00 -1.26 -4.86 105.19 97.70 1pdw n GLY 1137Ca 0.00 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.19 1pdw n GLY 1137CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1pdw n HIS 1138N -4.34 0.07 -3.80 1.61 8.25 -1.26 -4.85 115.22 110.91 1pdw n HIS 1138Ca -0.13 -0.04 -0.10 0.00 -0.26 0.00 0.00 57.72 57.20 1pdw n HIS 1138Cb 0.63 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.69 1pdw n HIS 1138CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1pdw s TYR 1139N -1.93 0.02 -0.20 4.41 2.02 -1.26 0.72 117.35 121.13 1pdw s TYR 1139Ca 0.22 -0.37 -0.07 0.00 -0.37 0.00 0.00 57.07 56.48 1pdw s TYR 1139Cb 0.11 0.28 -0.03 0.00 -0.40 0.00 0.00 41.96 41.91 1pdw s TYR 1139CO 0.17 -0.87 0.05 0.99 -1.57 0.00 0.00 175.55 174.32 1pdw s THR 1140N -3.90 4.46 0.37 -0.71 2.01 -0.53 -4.93 115.64 112.40 1pdw s THR 1140Ca 0.11 -0.14 -0.24 0.00 0.31 0.00 0.00 61.69 61.73 1pdw s THR 1140Cb 0.00 -3.02 -0.10 0.00 0.01 0.00 0.00 72.50 69.39 1pdw s THR 1140CO -0.02 0.42 0.96 -0.47 -0.69 0.00 0.00 174.62 174.83 1pdw s TYR 1141N 0.80 3.51 0.01 4.92 5.04 -1.26 -0.93 117.35 129.44 1pdw s TYR 1141Ca 0.03 1.71 0.03 0.00 -2.44 0.00 0.00 57.07 56.40 1pdw s TYR 1141Cb -0.14 -2.94 -0.01 0.00 0.35 0.00 0.00 41.96 39.22 1pdw s TYR 1141CO 0.02 -0.03 -0.11 0.45 -1.34 0.00 0.00 175.55 174.54 1pdw s SER 1142N -1.77 1.26 0.00 4.32 0.15 0.11 -4.82 113.70 112.95 1pdw s SER 1142Ca 0.55 -0.28 0.24 0.00 0.70 0.00 0.00 55.95 57.17 1pdw s SER 1142Cb -0.16 -0.11 0.54 0.00 -1.71 0.00 0.00 66.02 64.58 1pdw s SER 1142CO 0.21 0.07 1.46 1.21 1.20 0.00 0.00 173.24 177.39 1pdw n GLU 1143N 2.50 2.11 -2.22 5.44 4.07 -1.26 -4.28 120.64 127.00 1pdw n GLU 1143Ca -0.15 -1.63 -0.39 0.00 -0.06 0.00 0.00 57.16 54.93 1pdw n GLU 1143Cb 0.56 -1.47 -0.02 0.00 -0.06 0.00 0.00 31.44 30.46 1pdw n GLU 1143CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 1pdw s ASN 1144N -1.83 6.51 0.35 4.31 0.02 -1.26 -4.92 114.94 118.12 1pdw s ASN 1144Ca 0.33 2.46 0.05 0.00 -1.02 0.00 0.00 52.86 54.68 1pdw s ASN 1144Cb 0.20 -2.62 0.70 0.00 0.02 0.00 0.00 41.25 39.55 1pdw s ASN 1144CO 0.31 -0.70 1.96 0.03 0.02 0.00 0.00 177.10 178.72 1pdw h ARG 1145N 2.75 0.78 -3.91 -0.60 3.08 -1.95 -3.40 114.38 111.14 1pdw h ARG 1145Ca -0.49 -0.05 -0.37 0.00 0.07 0.00 0.00 59.98 59.15 1pdw h ARG 1145Cb 1.24 -0.18 -0.33 0.00 0.08 0.00 0.00 29.97 30.78 1pdw h ARG 1145CO 0.63 0.52 -0.76 0.08 -1.07 0.00 0.00 179.97 179.37 1pdw s VAL 1146N -5.71 0.34 -0.08 2.04 1.01 -1.26 -2.33 120.40 114.41 1pdw s VAL 1146Ca -0.10 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1pdw s VAL 1146Cb 0.19 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 36.20 1pdw s VAL 1146CO 0.78 0.17 -0.07 -0.70 0.00 0.00 0.00 175.10 175.27 1pdw s GLU 1147N 0.82 1.28 -0.24 2.72 2.56 -0.17 -5.01 118.70 120.66 1pdw s GLU 1147Ca -0.09 -0.22 0.02 0.00 0.00 0.00 0.00 54.97 54.68 1pdw s GLU 1147Cb -0.13 -1.26 0.05 0.00 2.00 0.00 0.00 34.13 34.79 1pdw s GLU 1147CO -0.01 -0.14 -0.12 0.21 -0.56 0.00 0.00 175.26 174.65 1pdw s LYS 1148N 1.23 2.29 -0.59 4.30 2.20 -1.26 -0.69 119.74 127.23 1pdw s LYS 1148Ca -0.05 -1.22 -0.01 0.00 -0.36 0.00 0.00 55.97 54.33 1pdw s LYS 1148Cb -0.14 -2.79 0.15 0.00 -1.51 0.00 0.00 37.83 33.54 1pdw s LYS 1148CO -0.02 -0.51 0.39 0.34 -0.36 0.00 0.00 175.35 175.18 1pdw s ASP 1149N 1.17 5.02 1.54 1.43 2.15 0.35 -4.98 116.67 123.35 1pdw s ASP 1149Ca -0.06 -2.86 0.00 0.00 0.43 0.00 0.00 52.55 50.05 1pdw s ASP 1149Cb -0.19 -1.80 0.00 0.00 -0.30 0.00 0.00 42.92 40.63 1pdw s ASP 1149CO -0.06 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.20 1pdw n GLY 1150N 3.43 2.59 1.26 2.66 0.00 -1.26 -2.30 105.19 111.58 1pdw n GLY 1150Ca 0.07 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.87 1pdw n GLY 1150CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pdw n LEU 1151N 0.00 3.67 -4.20 0.99 4.77 -1.26 -4.77 117.00 116.20 1pdw n LEU 1151Ca 0.00 -1.85 -0.35 0.00 -0.03 0.00 0.00 56.01 53.78 1pdw n LEU 1151Cb 0.00 -0.53 -0.14 0.00 -2.33 0.00 0.00 43.42 40.42 1pdw n LEU 1151CO 0.00 0.56 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.60 1pdw s ILE 1152N -1.90 2.97 -0.21 -0.08 -1.09 -0.97 -0.78 121.20 119.14 1pdw s ILE 1152Ca 0.35 -1.11 0.02 0.00 -2.23 0.00 0.00 60.65 57.68 1pdw s ILE 1152Cb 0.24 -2.57 0.04 0.00 -1.58 0.00 0.00 42.46 38.60 1pdw s ILE 1152CO 0.15 0.11 -0.14 -0.22 -1.23 0.00 0.00 174.94 173.60 1pdw s LEU 1153N 1.31 2.60 0.34 2.97 0.20 -0.08 -0.49 118.68 125.53 1pdw s LEU 1153Ca -0.01 -0.97 0.09 0.00 0.69 0.00 0.00 54.13 53.93 1pdw s LEU 1153Cb -0.18 -1.42 -0.05 0.00 -0.43 0.00 0.00 46.19 44.12 1pdw s LEU 1153CO -0.03 -0.11 0.01 0.42 -0.29 0.00 0.00 176.35 176.35 1pdw s THR 1154N 1.27 2.62 0.15 3.68 -4.23 0.14 -1.08 115.64 118.19 1pdw s THR 1154Ca -0.02 -1.97 -0.12 0.00 -1.18 0.00 0.00 61.69 58.40 1pdw s THR 1154Cb -0.16 -2.80 0.01 0.00 1.34 0.00 0.00 72.50 70.89 1pdw s THR 1154CO -0.09 -0.20 0.35 -0.55 -0.54 0.00 0.00 174.62 173.59 1pdw s SER 1155N -3.72 -0.07 -0.09 3.99 0.15 -0.80 -1.00 113.70 112.16 1pdw s SER 1155Ca 0.35 -0.61 -0.20 0.00 0.70 0.00 0.00 55.95 56.18 1pdw s SER 1155Cb -0.00 0.46 -0.17 0.00 -1.71 0.00 0.00 66.02 64.60 1pdw s SER 1155CO 0.19 -0.89 0.71 0.03 1.20 0.00 0.00 173.24 174.48 1pdw h ARG 1156N 2.46 -0.09 0.00 5.44 2.47 -1.68 0.79 114.38 123.77 1pdw h ARG 1156Ca -0.32 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 1pdw h ARG 1156Cb 1.24 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1pdw h ARG 1156CO 0.47 0.46 0.00 0.41 0.56 0.00 0.00 179.97 181.87 1pdw n GLY 1157N 1.13 1.54 0.39 0.04 0.00 -1.26 -2.72 105.19 104.31 1pdw n GLY 1157Ca -0.07 -0.87 0.17 0.00 0.00 0.00 0.00 46.02 45.24 1pdw n GLY 1157CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pdw h PRO 1158N 0.00 0.53 0.00 1.61 0.11 -1.98 0.55 132.00 132.82 1pdw h PRO 1158Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1pdw h PRO 1158Cb 0.00 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 30.99 1pdw h PRO 1158CO 0.00 0.35 0.00 0.41 -0.21 0.00 0.00 178.00 178.55 1pdw n GLY 1159N -1.45 -0.92 0.21 -0.55 0.00 -1.26 -2.78 105.19 98.43 1pdw n GLY 1159Ca 0.21 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1pdw n GLY 1159CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pdw n THR 1160N -1.15 0.00 -0.22 2.61 -2.24 0.16 -4.73 114.28 108.71 1pdw n THR 1160Ca 0.15 -0.49 0.01 0.00 -2.27 0.00 0.00 64.05 61.44 1pdw n THR 1160Cb 0.14 1.11 0.13 0.00 -2.10 0.00 0.00 70.33 69.60 1pdw n THR 1160CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pdw h SER 1161N 1.02 0.21 -0.56 3.42 0.02 -1.33 0.66 113.55 116.99 1pdw h SER 1161Ca 0.00 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 1pdw h SER 1161Cb 0.22 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 1pdw h SER 1161CO 0.00 0.11 0.24 -0.26 -1.14 0.00 0.00 176.83 175.78 1pdw h PHE 1162N 0.40 0.83 -0.18 3.45 -1.00 -1.85 0.48 116.94 119.06 1pdw h PHE 1162Ca 0.33 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 61.04 1pdw h PHE 1162Cb 0.45 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 1pdw h PHE 1162CO -0.18 0.66 0.05 0.93 -1.61 0.00 0.00 178.31 178.17 1pdw h GLU 1163N 0.76 0.29 -0.35 1.51 5.08 -1.65 -0.41 114.58 119.80 1pdw h GLU 1163Ca 0.19 -0.06 0.07 0.00 -1.00 0.00 0.00 59.36 58.55 1pdw h GLU 1163Cb 0.17 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.32 1pdw h GLU 1163CO -0.02 0.41 -0.02 0.35 -1.00 0.00 0.00 179.01 178.72 1pdw h PHE 1164N 0.12 -0.07 -0.34 4.33 3.57 0.67 -0.02 116.94 125.20 1pdw h PHE 1164Ca 0.06 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1pdw h PHE 1164Cb 0.24 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 1pdw h PHE 1164CO 0.00 -0.09 0.09 0.00 -2.23 0.00 0.00 178.31 176.08 1pdw h ALA 1165N 1.32 0.45 0.00 2.41 0.00 0.09 -2.59 119.26 120.93 1pdw h ALA 1165Ca 0.17 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1pdw h ALA 1165Cb 0.24 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1pdw h ALA 1165CO -0.31 0.10 -0.25 -0.07 0.00 0.00 0.00 179.25 178.73 1pdw h LEU 1166N 0.39 0.00 -0.67 0.00 3.38 -0.75 -1.04 115.31 116.62 1pdw h LEU 1166Ca 0.11 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 1pdw h LEU 1166Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1pdw h LEU 1166CO -0.00 0.25 -0.22 0.00 0.09 0.00 0.00 178.44 178.56 1pdw h ALA 1167N 1.75 0.86 -0.27 1.53 0.00 -0.73 -0.34 119.26 122.05 1pdw h ALA 1167Ca -0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 1pdw h ALA 1167Cb 0.45 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1pdw h ALA 1167CO 0.03 0.64 -0.23 0.82 0.00 0.00 0.00 179.25 180.51 1pdw h ILE 1168N 0.70 1.31 -0.48 0.00 2.04 -1.03 -0.97 117.51 119.07 1pdw h ILE 1168Ca 0.10 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.58 1pdw h ILE 1168Cb 0.74 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 1pdw h ILE 1168CO 0.06 0.44 0.30 0.58 0.00 0.00 0.00 178.15 179.52 1pdw h VAL 1169N 0.37 1.14 -0.57 1.67 2.07 -1.03 -0.16 116.25 119.75 1pdw h VAL 1169Ca 0.05 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1pdw h VAL 1169Cb 0.78 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1pdw h VAL 1169CO 0.06 0.14 0.24 -0.08 0.02 0.00 0.00 177.57 177.95 1pdw h GLU 1170N 0.64 0.84 -0.90 1.57 4.81 -1.02 0.43 114.58 120.95 1pdw h GLU 1170Ca 0.17 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1pdw h GLU 1170Cb -0.03 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.16 1pdw h GLU 1170CO -0.03 0.72 0.59 0.00 -0.73 0.00 0.00 179.01 179.56 1pdw h ALA 1171N 1.08 1.40 0.09 2.92 0.00 -0.65 0.29 119.26 124.40 1pdw h ALA 1171Ca 0.19 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 54.73 1pdw h ALA 1171Cb 0.18 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1pdw h ALA 1171CO -0.02 0.53 -1.71 -0.07 0.00 0.00 0.00 179.25 177.98 1pdw h LEU 1172N 1.17 0.31 -1.12 0.00 4.07 -0.68 -3.42 115.31 115.64 1pdw h LEU 1172Ca 0.35 -0.82 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1pdw h LEU 1172Cb -0.05 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 41.59 1pdw h LEU 1172CO -0.09 1.73 -0.13 0.59 -1.08 0.00 0.00 178.44 179.46 1pdw n ASN 1173N -3.81 1.66 0.00 -0.43 3.02 0.15 -5.00 115.26 110.86 1pdw n ASN 1173Ca -0.31 -1.33 0.00 0.00 -0.03 0.00 0.00 54.58 52.91 1pdw n ASN 1173Cb 0.93 0.25 0.00 0.00 -0.61 0.00 0.00 39.78 40.35 1pdw n ASN 1173CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pdw n GLY 1174N 0.84 0.17 0.24 7.41 0.00 0.09 -4.46 105.19 109.48 1pdw n GLY 1174Ca 0.06 -1.71 0.01 0.00 0.00 0.00 0.00 46.02 44.38 1pdw n GLY 1174CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pdw h LYS 1175N 0.00 0.35 -0.84 1.61 1.57 -1.90 -2.68 116.57 114.69 1pdw h LYS 1175Ca 0.00 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1pdw h LYS 1175Cb 0.00 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1pdw h LYS 1175CO 0.00 0.23 0.41 1.49 -0.57 0.00 0.00 179.45 181.01 1pdw h GLU 1176N 0.36 1.20 -0.47 3.15 4.57 -1.97 0.22 114.58 121.64 1pdw h GLU 1176Ca 0.33 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.28 1pdw h GLU 1176Cb 0.45 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.80 1pdw h GLU 1176CO -0.35 0.92 0.07 0.28 -1.18 0.00 0.00 179.01 178.74 1pdw h VAL 1177N 1.19 1.25 -0.88 0.32 2.07 -1.73 0.60 116.25 119.07 1pdw h VAL 1177Ca 0.29 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1pdw h VAL 1177Cb 0.11 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1pdw h VAL 1177CO -0.04 0.33 0.58 0.00 0.02 0.00 0.00 177.57 178.47 1pdw h ALA 1178N 0.95 1.38 -0.45 1.67 0.00 -1.07 -0.22 119.26 121.53 1pdw h ALA 1178Ca 0.14 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1pdw h ALA 1178Cb 0.40 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1pdw h ALA 1178CO 0.01 0.57 -0.11 0.00 0.00 0.00 0.00 179.25 179.72 1pdw h ALA 1179N 1.45 0.61 -0.87 0.00 0.00 -0.15 -1.45 119.26 118.86 1pdw h ALA 1179Ca 0.33 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1pdw h ALA 1179Cb -0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 1pdw h ALA 1179CO -0.07 0.51 0.44 1.96 0.00 0.00 0.00 179.25 182.09 1pdw h GLN 1180N 0.70 1.23 -0.33 0.00 4.20 0.03 -2.78 115.11 118.17 1pdw h GLN 1180Ca 0.11 -0.17 -0.16 0.00 0.06 0.00 0.00 58.65 58.50 1pdw h GLN 1180Cb 0.66 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.20 1pdw h GLN 1180CO 0.05 0.93 -0.41 0.28 -0.67 0.00 0.00 178.83 179.01 1pdw h VAL 1181N 1.23 1.28 -0.39 -0.54 2.07 -0.92 -3.32 116.25 115.66 1pdw h VAL 1181Ca 0.30 -1.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 1pdw h VAL 1181Cb 0.08 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1pdw h VAL 1181CO -0.04 0.52 0.16 0.50 0.02 0.00 0.00 177.57 178.73 1pdw h LYS 1182N 0.63 0.58 -0.64 1.57 3.64 -1.10 -3.35 116.57 117.91 1pdw h LYS 1182Ca 0.04 -0.10 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1pdw h LYS 1182Cb 1.00 -0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.64 1pdw h LYS 1182CO 0.10 0.54 -0.44 0.00 -2.27 0.00 0.00 179.45 177.38 1pdw h ALA 1183N 1.01 -0.49 0.00 5.00 0.00 -1.59 -0.95 119.26 122.24 1pdw h ALA 1183Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pdw h ALA 1183Cb 0.17 1.22 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1pdw h ALA 1183CO -0.01 -0.78 0.03 -1.35 0.00 0.00 0.00 179.25 177.14 1pdw h PRO 1184N -0.08 0.00 0.00 0.00 0.11 -1.77 -3.05 132.00 127.21 1pdw h PRO 1184Ca 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 1pdw h PRO 1184Cb 0.35 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 1pdw h PRO 1184CO -0.65 0.00 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.03 1pdw h LEU 1185N 0.00 0.00 -1.73 2.35 3.38 -1.32 -3.47 115.31 114.52 1pdw h LEU 1185Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1pdw h LEU 1185Cb 0.07 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.93 1pdw h LEU 1185CO 0.00 0.04 -0.54 0.52 0.09 0.00 0.00 178.44 178.55 1pdw n VAL 1186N -3.16 -4.13 -1.99 1.22 0.31 -1.15 -5.04 118.33 104.39 1pdw n VAL 1186Ca 0.00 -0.34 -0.15 0.00 -0.01 0.00 0.00 64.34 63.85 1pdw n VAL 1186Cb 0.33 -4.22 0.09 0.00 -0.91 0.00 0.00 33.84 29.13 1pdw n VAL 1186CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1pdw n LEU 1187N -3.20 0.00 0.00 7.52 4.77 -1.26 -5.19 117.00 119.64 1pdw n LEU 1187Ca -0.20 -1.01 0.01 0.00 -0.03 0.00 0.00 56.01 54.78 1pdw n LEU 1187Cb 0.62 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1pdw n LEU 1187CO 0.43 -0.91 0.28 2.29 -1.33 0.00 0.00 177.39 178.15