#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p3l s ALA 1012N 0.00 2.89 -0.87 2.89 0.00 -1.26 -5.05 121.76 120.37 1p3l s ALA 1012Ca 0.00 -3.23 -0.32 0.00 0.00 0.00 0.00 51.96 48.41 1p3l s ALA 1012Cb 0.00 -1.98 -0.20 0.00 0.00 0.00 0.00 23.12 20.94 1p3l s ALA 1012CO 0.00 -2.06 2.59 1.63 0.00 0.00 0.00 175.76 177.93 1p3l n LYS 1013N 2.58 0.15 0.00 0.00 5.02 -1.26 -4.50 118.16 120.15 1p3l n LYS 1013Ca 0.19 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1p3l n LYS 1013Cb 0.38 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 1p3l n LYS 1013CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p3l n ALA 1014N 10.78 0.00 -2.58 7.82 0.00 -1.26 -5.14 120.51 130.13 1p3l n ALA 1014Ca 0.61 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.64 1p3l n ALA 1014Cb 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.47 1p3l n ALA 1014CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1p3l s LYS 1015N 0.00 3.79 0.58 0.00 2.47 -1.26 -5.04 119.74 120.28 1p3l s LYS 1015Ca 0.00 0.15 -0.19 0.00 -1.56 0.00 0.00 55.97 54.37 1p3l s LYS 1015Cb 0.00 -3.76 -0.06 0.00 -1.46 0.00 0.00 37.83 32.55 1p3l s LYS 1015CO 0.00 -0.63 0.91 0.25 0.16 0.00 0.00 175.35 176.04 1p3l n THR 1016N 5.46 3.37 -0.23 3.43 -2.24 -1.26 -4.78 114.28 118.04 1p3l n THR 1016Ca -0.02 -0.50 0.11 0.00 -2.27 0.00 0.00 64.05 61.37 1p3l n THR 1016Cb 0.49 -1.08 0.40 0.00 -2.10 0.00 0.00 70.33 68.03 1p3l n THR 1016CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1p3l h ARG 1017N 0.55 0.63 -0.68 -0.78 3.08 -1.98 -1.29 114.38 113.92 1p3l h ARG 1017Ca -0.48 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.52 1p3l h ARG 1017Cb 1.37 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.24 1p3l h ARG 1017CO 0.51 0.42 0.35 0.77 -1.07 0.00 0.00 179.97 180.94 1p3l h SER 1018N 0.65 0.87 -0.16 7.04 0.02 -1.87 -1.02 113.55 119.08 1p3l h SER 1018Ca 0.40 -0.12 -0.10 0.00 -0.84 0.00 0.00 61.79 61.13 1p3l h SER 1018Cb 0.63 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1p3l h SER 1018CO -0.16 0.74 -0.21 0.77 -1.14 0.00 0.00 176.83 176.82 1p3l h SER 1019N 0.93 0.59 -0.76 3.07 4.64 -1.46 0.38 113.55 120.95 1p3l h SER 1019Ca 0.23 -0.20 -0.05 0.00 -0.47 0.00 0.00 61.79 61.31 1p3l h SER 1019Cb 0.08 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 61.98 1p3l h SER 1019CO -0.03 0.81 0.27 0.03 -0.87 0.00 0.00 176.83 177.03 1p3l h ARG 1020N 0.53 1.16 -0.00 4.77 3.08 -0.94 -2.05 114.38 120.93 1p3l h ARG 1020Ca 0.08 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1p3l h ARG 1020Cb 0.65 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1p3l h ARG 1020CO 0.05 0.97 -0.20 0.00 -1.07 0.00 0.00 179.97 179.71 1p3l n ALA 1021N -2.44 2.83 -2.61 0.04 0.00 -0.43 -4.94 120.51 112.96 1p3l n ALA 1021Ca 0.06 -0.20 -0.05 0.00 0.00 0.00 0.00 53.44 53.25 1p3l n ALA 1021Cb 0.21 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.35 1p3l n ALA 1021CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p3l n GLY 1022N 1.49 0.49 3.30 0.00 0.00 1.00 -5.05 105.19 106.42 1p3l n GLY 1022Ca 0.07 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1p3l n GLY 1022CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p3l s LEU 1023N -2.65 2.41 0.03 0.99 1.43 0.72 -5.01 118.68 116.61 1p3l s LEU 1023Ca 0.09 -0.82 0.12 0.00 -1.03 0.00 0.00 54.13 52.49 1p3l s LEU 1023Cb -0.04 -0.75 -0.20 0.00 0.03 0.00 0.00 46.19 45.23 1p3l s LEU 1023CO 0.17 -0.05 0.89 1.56 0.23 0.00 0.00 176.35 179.15 1p3l h GLN 1024N 3.44 0.00 -7.03 1.70 1.08 -1.97 -3.39 115.11 108.93 1p3l h GLN 1024Ca -0.42 0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 56.31 1p3l h GLN 1024Cb 1.20 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.64 1p3l h GLN 1024CO 0.49 0.60 0.38 -0.06 -0.95 0.00 0.00 178.83 179.30 1p3l s PHE 1025N -2.69 3.14 -0.72 2.96 0.40 -1.26 -4.99 117.98 114.83 1p3l s PHE 1025Ca -0.02 1.61 -0.27 0.00 -0.60 0.00 0.00 56.93 57.64 1p3l s PHE 1025Cb 0.09 -3.05 0.02 0.00 0.51 0.00 0.00 43.02 40.59 1p3l s PHE 1025CO 0.82 -0.63 1.37 -1.25 0.70 0.00 0.00 175.22 176.23 1p3l s PRO 1026N -2.97 3.11 0.19 0.24 0.04 -1.26 -4.73 135.00 129.62 1p3l s PRO 1026Ca 0.63 -0.10 -0.10 0.00 0.04 0.00 0.00 61.00 61.47 1p3l s PRO 1026Cb -0.17 -4.21 0.12 0.00 0.04 0.00 0.00 34.50 30.28 1p3l s PRO 1026CO 0.21 -2.23 1.77 0.28 0.04 0.00 0.00 177.00 177.07 1p3l h VAL 1027N 6.17 1.24 -0.46 -0.36 2.07 -1.92 -1.14 116.25 121.84 1p3l h VAL 1027Ca -0.28 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1p3l h VAL 1027Cb 1.07 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1p3l h VAL 1027CO 1.27 0.29 0.29 1.23 0.02 0.00 0.00 177.57 180.67 1p3l h GLY 1028N 1.00 0.66 0.97 2.17 0.00 -1.95 -1.16 103.07 104.76 1p3l h GLY 1028Ca 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1p3l h GLY 1028CO -0.03 0.26 0.24 -0.09 0.00 0.00 0.00 176.54 176.92 1p3l h ARG 1029N 0.62 0.60 -0.96 4.80 2.43 -1.91 -1.17 114.38 118.80 1p3l h ARG 1029Ca 0.17 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1p3l h ARG 1029Cb -0.04 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 1p3l h ARG 1029CO -0.03 0.48 0.60 0.28 -1.51 0.00 0.00 179.97 179.79 1p3l h VAL 1030N 0.56 1.25 -0.13 0.20 2.07 -0.92 0.15 116.25 119.43 1p3l h VAL 1030Ca 0.15 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1p3l h VAL 1030Cb 0.05 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.69 1p3l h VAL 1030CO -0.02 0.26 0.03 -0.74 0.02 0.00 0.00 177.57 177.11 1p3l h HIS 1031N 1.31 0.23 -0.62 1.57 -0.00 -0.99 0.18 115.15 116.82 1p3l h HIS 1031Ca 0.35 -0.03 0.05 0.00 -0.00 0.00 0.00 60.37 60.74 1p3l h HIS 1031Cb -0.10 -0.06 -0.05 0.00 -0.00 0.00 0.00 27.41 27.19 1p3l h HIS 1031CO 0.00 0.37 0.34 -0.09 -0.00 0.00 0.00 177.93 178.56 1p3l h ARG 1032N 0.02 0.62 -0.31 5.26 2.43 -0.66 -1.00 114.38 120.74 1p3l h ARG 1032Ca 0.04 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1p3l h ARG 1032Cb 0.26 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1p3l h ARG 1032CO 0.00 0.41 -0.25 -0.07 -1.51 0.00 0.00 179.97 178.55 1p3l h LEU 1033N 0.64 0.63 -0.63 3.80 3.38 -0.35 -1.23 115.31 121.54 1p3l h LEU 1033Ca 0.27 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1p3l h LEU 1033Cb 0.15 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1p3l h LEU 1033CO -0.17 0.86 0.12 -0.07 0.09 0.00 0.00 178.44 179.28 1p3l h LEU 1034N 0.54 0.99 0.08 1.67 3.38 0.15 -2.84 115.31 119.28 1p3l h LEU 1034Ca 0.07 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1p3l h LEU 1034Cb 0.72 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1p3l h LEU 1034CO 0.06 0.99 -0.04 0.03 0.09 0.00 0.00 178.44 179.56 1p3l h ARG 1035N 0.95 -0.10 0.00 1.13 3.08 -0.92 -3.05 114.38 115.47 1p3l h ARG 1035Ca 0.19 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.25 1p3l h ARG 1035Cb 0.41 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1p3l h ARG 1035CO 0.01 0.17 0.00 1.63 -1.07 0.00 0.00 179.97 180.71 1p3l n LYS 1036N -5.01 0.96 0.00 0.04 5.02 -0.49 -3.05 118.16 115.63 1p3l n LYS 1036Ca -0.08 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.32 1p3l n LYS 1036Cb 0.18 -1.01 0.09 0.00 -0.02 0.00 0.00 35.03 34.27 1p3l n LYS 1036CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p3l n GLY 1037N 0.47 0.81 3.58 0.72 0.00 -1.07 -4.98 105.19 104.71 1p3l n GLY 1037Ca 0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.14 1p3l n GLY 1037CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p3l n ASN 1038N 1.24 -4.66 -0.07 1.61 5.03 -1.17 -4.90 115.26 112.34 1p3l n ASN 1038Ca 0.13 -0.89 -0.05 0.00 0.87 0.00 0.00 54.58 54.63 1p3l n ASN 1038Cb 0.55 -4.00 -0.15 0.00 -1.02 0.00 0.00 39.78 35.16 1p3l n ASN 1038CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1p3l n TYR 1039N -3.96 0.19 -3.82 3.10 4.02 -1.26 -5.04 117.16 110.40 1p3l n TYR 1039Ca -0.14 0.07 -0.06 0.00 -0.01 0.00 0.00 57.90 57.76 1p3l n TYR 1039Cb 0.62 -0.94 -0.01 0.00 -0.02 0.00 0.00 39.34 38.99 1p3l n TYR 1039CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1p3l s ALA 1040N -2.71 -1.35 0.08 -0.72 0.00 -1.26 -5.05 121.76 110.75 1p3l s ALA 1040Ca -0.08 -0.21 -0.17 0.00 0.00 0.00 0.00 51.96 51.49 1p3l s ALA 1040Cb 0.08 0.74 -0.09 0.00 0.00 0.00 0.00 23.12 23.85 1p3l s ALA 1040CO 0.84 -1.04 1.46 0.93 0.00 0.00 0.00 175.76 177.95 1p3l h GLU 1041N 2.00 0.55 -5.51 0.00 4.39 -1.98 -3.46 114.58 110.56 1p3l h GLU 1041Ca -0.23 -0.23 -0.46 0.00 0.34 0.00 0.00 59.36 58.77 1p3l h GLU 1041Cb 1.24 -0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 29.73 1p3l h GLU 1041CO 0.27 0.79 -0.71 1.03 -1.16 0.00 0.00 179.01 179.23 1p3l s ARG 1042N -4.63 1.40 -0.22 2.33 0.52 -1.26 -5.13 118.95 111.97 1p3l s ARG 1042Ca -0.13 -1.66 -0.04 0.00 -0.52 0.00 0.00 55.73 53.38 1p3l s ARG 1042Cb 0.08 -1.10 0.07 0.00 0.52 0.00 0.00 34.95 34.52 1p3l s ARG 1042CO 0.78 0.12 0.08 0.08 0.02 0.00 0.00 175.30 176.38 1p3l s VAL 1043N -3.02 0.19 0.89 3.52 1.01 -1.26 -5.07 120.40 116.67 1p3l s VAL 1043Ca 0.25 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1p3l s VAL 1043Cb 0.01 -0.90 0.08 0.00 0.00 0.00 0.00 36.38 35.57 1p3l s VAL 1043CO 0.09 -0.40 0.84 0.61 0.00 0.00 0.00 175.10 176.24 1p3l n GLY 1044N 5.16 -1.00 0.31 4.51 0.00 -1.26 -4.92 105.19 107.99 1p3l n GLY 1044Ca -0.07 -0.66 -0.03 0.00 0.00 0.00 0.00 46.02 45.26 1p3l n GLY 1044CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p3l h ALA 1045N -1.47 1.22 0.00 4.61 0.00 -2.04 -3.11 119.26 118.46 1p3l h ALA 1045Ca -0.44 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.20 1p3l h ALA 1045Cb 1.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1p3l h ALA 1045CO 0.40 0.55 -0.40 0.78 0.00 0.00 0.00 179.25 180.58 1p3l h GLY 1046N 0.99 0.00 0.47 0.00 0.00 -2.02 -3.36 103.07 99.16 1p3l h GLY 1046Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.57 1p3l h GLY 1046CO -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 176.54 176.45 1p3l h ALA 1047N 1.60 0.12 -0.02 3.60 0.00 -1.91 -0.85 119.26 121.81 1p3l h ALA 1047Ca -0.00 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1p3l h ALA 1047Cb 0.93 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1p3l h ALA 1047CO 0.05 -0.50 -0.33 -1.00 0.00 0.00 0.00 179.25 177.47 1p3l h PRO 1048N -0.04 0.03 0.17 0.00 0.13 -1.75 -0.23 132.00 130.30 1p3l h PRO 1048Ca 0.12 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1p3l h PRO 1048Cb 0.22 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.35 1p3l h PRO 1048CO -0.26 0.36 -0.08 0.28 -0.23 0.00 0.00 178.00 178.06 1p3l h VAL 1049N 0.03 0.94 -0.78 1.56 2.07 -1.56 0.24 116.25 118.75 1p3l h VAL 1049Ca 0.00 -0.58 0.06 0.00 0.82 0.00 0.00 66.70 67.00 1p3l h VAL 1049Cb 0.60 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1p3l h VAL 1049CO 0.04 0.13 0.47 0.22 0.02 0.00 0.00 177.57 178.45 1p3l h TYR 1050N -0.52 0.86 -0.39 1.57 3.20 -1.01 -1.52 116.97 119.16 1p3l h TYR 1050Ca -0.02 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 1p3l h TYR 1050Cb 0.39 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1p3l h TYR 1050CO 0.02 0.43 -0.30 1.25 -1.64 0.00 0.00 178.16 177.92 1p3l h LEU 1051N 0.86 0.94 -0.53 2.82 5.85 -0.88 -1.83 115.31 122.54 1p3l h LEU 1051Ca 0.34 -0.44 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1p3l h LEU 1051Cb 0.17 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1p3l h LEU 1051CO -0.17 1.18 0.24 0.00 -0.34 0.00 0.00 178.44 179.35 1p3l h ALA 1052N 0.79 0.68 -0.94 1.25 0.00 -0.64 -1.54 119.26 118.86 1p3l h ALA 1052Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1p3l h ALA 1052Cb 0.88 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1p3l h ALA 1052CO 0.08 0.26 0.56 0.00 0.00 0.00 0.00 179.25 180.14 1p3l h ALA 1053N 1.08 1.20 -0.61 0.00 0.00 -1.14 0.23 119.26 120.03 1p3l h ALA 1053Ca 0.18 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1p3l h ALA 1053Cb 0.15 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1p3l h ALA 1053CO -0.02 0.67 0.10 0.28 0.00 0.00 0.00 179.25 180.28 1p3l h VAL 1054N 1.30 1.26 -0.50 0.00 2.07 -0.86 -0.90 116.25 118.63 1p3l h VAL 1054Ca 0.34 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1p3l h VAL 1054Cb -0.04 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1p3l h VAL 1054CO -0.06 0.37 0.03 -0.07 0.02 0.00 0.00 177.57 177.86 1p3l h LEU 1055N 0.91 0.84 -0.51 2.57 3.38 -0.83 -1.83 115.31 119.84 1p3l h LEU 1055Ca 0.19 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1p3l h LEU 1055Cb 0.42 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1p3l h LEU 1055CO 0.01 0.92 0.07 -0.08 0.09 0.00 0.00 178.44 179.45 1p3l h GLU 1056N 0.73 0.85 0.17 1.13 4.81 -0.83 -0.53 114.58 120.91 1p3l h GLU 1056Ca 0.15 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1p3l h GLU 1056Cb 0.47 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1p3l h GLU 1056CO 0.02 0.84 -0.12 -0.92 -0.73 0.00 0.00 179.01 178.10 1p3l h TYR 1057N 0.72 -0.31 -0.61 0.92 3.20 -0.97 0.39 116.97 120.31 1p3l h TYR 1057Ca 0.15 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 1p3l h TYR 1057Cb 0.41 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 1p3l h TYR 1057CO 0.03 -0.19 0.35 -0.07 -1.64 0.00 0.00 178.16 176.64 1p3l h LEU 1058N -0.29 0.74 -0.43 2.82 3.38 -1.24 0.60 115.31 120.90 1p3l h LEU 1058Ca -0.01 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1p3l h LEU 1058Cb 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1p3l h LEU 1058CO 0.00 0.59 0.08 0.74 0.09 0.00 0.00 178.44 179.94 1p3l h THR 1059N 0.85 1.24 -0.86 0.22 2.02 -0.70 -2.02 112.91 113.66 1p3l h THR 1059Ca 0.22 -0.87 -0.03 0.00 0.77 0.00 0.00 66.41 66.50 1p3l h THR 1059Cb 0.00 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 1p3l h THR 1059CO -0.04 0.30 0.43 0.00 0.37 0.00 0.00 175.52 176.59 1p3l h ALA 1060N 0.94 1.10 -0.24 6.16 0.00 -0.10 -1.86 119.26 125.26 1p3l h ALA 1060Ca 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1p3l h ALA 1060Cb 0.37 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1p3l h ALA 1060CO 0.01 0.65 0.16 1.49 0.00 0.00 0.00 179.25 181.55 1p3l h GLU 1061N 1.21 0.31 -0.31 0.00 4.57 -0.60 -0.37 114.58 119.39 1p3l h GLU 1061Ca 0.30 -0.02 -0.18 0.00 -1.18 0.00 0.00 59.36 58.28 1p3l h GLU 1061Cb 0.09 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1p3l h GLU 1061CO -0.04 0.21 -0.52 0.82 -1.18 0.00 0.00 179.01 178.29 1p3l h ILE 1062N 0.32 1.27 -0.42 2.32 2.04 -1.25 -2.93 117.51 118.86 1p3l h ILE 1062Ca 0.09 -1.70 -0.10 0.00 1.00 0.00 0.00 64.86 64.15 1p3l h ILE 1062Cb -0.03 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1p3l h ILE 1062CO -0.02 0.56 -0.13 -0.07 0.00 0.00 0.00 178.15 178.49 1p3l h LEU 1063N 0.70 0.76 -0.00 1.44 3.38 -1.21 0.21 115.31 120.58 1p3l h LEU 1063Ca 0.02 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1p3l h LEU 1063Cb 1.13 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 1p3l h LEU 1063CO 0.12 0.90 -0.12 -0.08 0.09 0.00 0.00 178.44 179.35 1p3l h GLU 1064N 0.69 -0.20 -0.07 1.13 4.57 -1.06 0.41 114.58 120.04 1p3l h GLU 1064Ca 0.11 0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.17 1p3l h GLU 1064Cb 0.61 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.23 1p3l h GLU 1064CO 0.04 -0.13 -0.58 -0.07 -1.18 0.00 0.00 179.01 177.08 1p3l h LEU 1065N -0.21 0.26 -0.50 1.64 3.38 -1.31 -2.42 115.31 116.14 1p3l h LEU 1065Ca 0.05 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 1p3l h LEU 1065Cb 0.27 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1p3l h LEU 1065CO -0.12 0.78 -0.56 0.00 0.09 0.00 0.00 178.44 178.63 1p3l h ALA 1066N 1.22 0.68 -0.49 1.53 0.00 -0.28 -1.03 119.26 120.91 1p3l h ALA 1066Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1p3l h ALA 1066Cb 1.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1p3l h ALA 1066CO 0.09 0.69 0.24 0.78 0.00 0.00 0.00 179.25 181.05 1p3l h GLY 1067N 1.06 0.75 1.01 0.00 0.00 -0.08 -0.89 103.07 104.91 1p3l h GLY 1067Ca 0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 1p3l h GLY 1067CO 0.11 0.35 0.23 3.43 0.00 0.00 0.00 176.54 180.66 1p3l h ASN 1068N 0.64 0.90 -0.50 0.19 2.35 -1.26 -0.77 115.58 117.13 1p3l h ASN 1068Ca 0.17 -0.18 0.08 0.00 -0.55 0.00 0.00 56.30 55.81 1p3l h ASN 1068Cb 0.10 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 1p3l h ASN 1068CO -0.02 0.84 0.34 0.00 -1.65 0.00 0.00 177.43 176.94 1p3l h ALA 1069N 1.09 2.01 -0.04 -0.83 0.00 -0.63 -0.64 119.26 120.23 1p3l h ALA 1069Ca 0.21 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1p3l h ALA 1069Cb 0.24 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1p3l h ALA 1069CO -0.01 -0.11 -0.44 0.00 0.00 0.00 0.00 179.25 178.68 1p3l h ALA 1070N 1.74 0.10 -0.42 0.00 0.00 -0.11 -3.22 119.26 117.35 1p3l h ALA 1070Ca 0.23 -0.50 0.07 0.00 0.00 0.00 0.00 54.91 54.70 1p3l h ALA 1070Cb 0.43 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1p3l h ALA 1070CO -0.05 0.26 0.08 -0.09 0.00 0.00 0.00 179.25 179.45 1p3l h ARG 1071N -0.15 0.21 0.00 0.00 2.43 -0.43 0.33 114.38 116.75 1p3l h ARG 1071Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1p3l h ARG 1071Cb 1.13 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1p3l h ARG 1071CO 0.09 0.14 0.10 -0.44 -1.51 0.00 0.00 179.97 178.34 1p3l h ASP 1072N 0.21 0.00 -0.44 -3.80 3.32 -1.19 0.43 116.42 114.95 1p3l h ASP 1072Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1p3l h ASP 1072Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1p3l h ASP 1072CO -0.27 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 177.84 1p3l n ASN 1073N -2.65 3.18 -3.25 6.45 3.02 0.03 -4.97 115.26 117.07 1p3l n ASN 1073Ca -0.02 -1.99 -0.16 0.00 -0.03 0.00 0.00 54.58 52.38 1p3l n ASN 1073Cb 0.15 -0.29 0.08 0.00 -0.61 0.00 0.00 39.78 39.11 1p3l n ASN 1073CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1p3l n LYS 1074N 0.83 -6.20 -4.14 3.52 4.76 0.15 -5.02 118.16 112.06 1p3l n LYS 1074Ca 0.15 0.78 -0.15 0.00 -2.87 0.00 0.00 58.31 56.22 1p3l n LYS 1074Cb 0.48 -5.61 -0.12 0.00 -1.84 0.00 0.00 35.03 27.93 1p3l n LYS 1074CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1p3l s LYS 1075N -5.31 0.59 -0.01 1.97 1.02 -0.73 -5.02 119.74 112.24 1p3l s LYS 1075Ca 0.03 -0.64 0.22 0.00 0.02 0.00 0.00 55.97 55.60 1p3l s LYS 1075Cb -0.01 -0.47 -0.28 0.00 -0.52 0.00 0.00 37.83 36.55 1p3l s LYS 1075CO 0.67 0.10 0.69 0.25 -0.92 0.00 0.00 175.35 176.15 1p3l n THR 1076N 1.87 0.00 -3.77 2.17 -2.24 -1.26 -3.77 114.28 107.28 1p3l n THR 1076Ca -0.20 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 60.96 1p3l n THR 1076Cb 0.55 0.48 -0.13 0.00 -2.10 0.00 0.00 70.33 69.14 1p3l n THR 1076CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1p3l s ARG 1077N -3.27 3.58 0.10 -0.78 3.52 -1.26 -5.04 118.95 115.80 1p3l s ARG 1077Ca -0.00 -0.52 -0.31 0.00 -0.13 0.00 0.00 55.73 54.77 1p3l s ARG 1077Cb 0.15 -3.30 -0.08 0.00 -1.56 0.00 0.00 34.95 30.16 1p3l s ARG 1077CO 0.89 -0.21 1.55 0.42 -0.81 0.00 0.00 175.30 177.14 1p3l s ILE 1078N 1.59 3.05 0.47 4.11 1.01 -1.26 -4.99 121.20 125.18 1p3l s ILE 1078Ca 0.06 0.63 0.03 0.00 0.00 0.00 0.00 60.65 61.37 1p3l s ILE 1078Cb -0.15 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1p3l s ILE 1078CO 0.03 0.02 0.01 0.27 0.00 0.00 0.00 174.94 175.27 1p3l s ILE 1079N 1.91 1.35 0.26 2.92 -4.36 -1.26 -5.00 121.20 117.01 1p3l s ILE 1079Ca 0.70 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 59.07 1p3l s ILE 1079Cb -0.39 -2.42 0.23 0.00 1.25 0.00 0.00 42.46 41.13 1p3l s ILE 1079CO 0.31 0.00 1.79 -0.65 0.24 0.00 0.00 174.94 176.63 1p3l h PRO 1080N 1.51 0.72 -0.68 0.37 0.11 -1.88 -0.71 132.00 131.44 1p3l h PRO 1080Ca -0.43 -0.04 0.13 0.00 0.11 0.00 0.00 66.00 65.76 1p3l h PRO 1080Cb 1.29 -0.16 -0.09 0.00 0.11 0.00 0.00 31.00 32.14 1p3l h PRO 1080CO 0.75 0.48 0.19 -0.09 -0.21 0.00 0.00 178.00 179.12 1p3l h ARG 1081N 0.74 0.31 0.00 1.05 1.12 -1.79 0.20 114.38 116.01 1p3l h ARG 1081Ca 0.44 -0.02 -0.05 0.00 -1.11 0.00 0.00 59.98 59.24 1p3l h ARG 1081Cb 0.50 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.39 1p3l h ARG 1081CO -0.30 0.21 -0.24 0.45 -3.11 0.00 0.00 179.97 176.98 1p3l h HIS 1082N 0.32 0.00 -0.06 2.20 3.86 -1.48 -1.57 115.15 118.42 1p3l h HIS 1082Ca 0.37 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.36 1p3l h HIS 1082Cb 0.56 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.05 1p3l h HIS 1082CO -0.22 0.24 -0.80 -0.07 0.86 0.00 0.00 177.93 177.93 1p3l h LEU 1083N 0.00 0.80 -0.09 2.43 3.38 -0.40 -2.78 115.31 118.66 1p3l h LEU 1083Ca -0.00 -0.70 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 1p3l h LEU 1083Cb 0.61 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1p3l h LEU 1083CO 0.03 1.39 0.05 -0.61 0.09 0.00 0.00 178.44 179.38 1p3l h GLN 1084N 0.29 0.12 -0.99 1.13 5.75 -0.54 -0.93 115.11 119.94 1p3l h GLN 1084Ca -0.08 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.44 1p3l h GLN 1084Cb 1.46 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 29.93 1p3l h GLN 1084CO 0.16 0.16 0.64 -0.07 -2.65 0.00 0.00 178.83 177.07 1p3l h LEU 1085N 0.05 1.08 -0.44 -2.39 3.38 -1.38 0.52 115.31 116.12 1p3l h LEU 1085Ca 0.03 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1p3l h LEU 1085Cb 0.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1p3l h LEU 1085CO -0.00 0.74 -0.03 0.00 0.09 0.00 0.00 178.44 179.24 1p3l h ALA 1086N 1.40 0.60 -0.00 1.53 0.00 -1.27 -2.29 119.26 119.22 1p3l h ALA 1086Ca 0.39 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1p3l h ALA 1086Cb -0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1p3l h ALA 1086CO -0.12 0.42 -0.01 0.28 0.00 0.00 0.00 179.25 179.82 1p3l h VAL 1087N 0.64 1.44 0.00 0.00 2.07 -0.77 -3.14 116.25 116.50 1p3l h VAL 1087Ca 0.12 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1p3l h VAL 1087Cb 0.53 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1p3l h VAL 1087CO 0.03 0.34 0.00 0.54 0.02 0.00 0.00 177.57 178.50 1p3l n ARG 1088N -4.81 0.11 0.00 1.57 5.12 0.14 -2.26 116.66 116.53 1p3l n ARG 1088Ca -0.09 0.27 0.13 0.00 -1.93 0.00 0.00 57.85 56.23 1p3l n ARG 1088Cb 0.28 -1.68 0.27 0.00 -1.16 0.00 0.00 32.46 30.18 1p3l n ARG 1088CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1p3l n ASN 1089N -1.88 2.06 -4.28 0.55 3.02 -0.86 -4.77 115.26 109.10 1p3l n ASN 1089Ca 0.04 -1.60 -0.36 0.00 -0.03 0.00 0.00 54.58 52.63 1p3l n ASN 1089Cb 0.25 0.09 -0.14 0.00 -0.61 0.00 0.00 39.78 39.38 1p3l n ASN 1089CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1p3l s ASP 1090N -2.14 4.67 0.23 6.41 2.15 -0.96 -5.02 116.67 122.02 1p3l s ASP 1090Ca 0.30 -0.73 -0.10 0.00 0.43 0.00 0.00 52.55 52.45 1p3l s ASP 1090Cb 0.20 -1.77 0.35 0.00 -0.30 0.00 0.00 42.92 41.40 1p3l s ASP 1090CO 0.38 -0.14 1.63 -0.08 -0.17 0.00 0.00 175.17 176.79 1p3l h GLU 1091N 8.12 0.05 -0.11 4.34 4.81 -1.86 0.09 114.58 130.03 1p3l h GLU 1091Ca -0.33 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.81 1p3l h GLU 1091Cb 1.12 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1p3l h GLU 1091CO 0.59 0.03 -0.26 0.93 -0.73 0.00 0.00 179.01 179.57 1p3l h GLU 1092N 0.05 0.36 -0.50 1.92 5.08 -1.95 -1.53 114.58 118.02 1p3l h GLU 1092Ca 0.37 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 1p3l h GLU 1092Cb 0.61 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1p3l h GLU 1092CO -0.68 0.86 0.04 -0.07 -1.00 0.00 0.00 179.01 178.16 1p3l h LEU 1093N -0.08 0.77 -1.00 1.33 3.38 -1.79 -0.85 115.31 117.07 1p3l h LEU 1093Ca -0.00 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1p3l h LEU 1093Cb 0.87 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1p3l h LEU 1093CO 0.06 0.81 0.26 -1.13 0.09 0.00 0.00 178.44 178.52 1p3l h ASN 1094N 0.76 0.90 0.10 -0.43 -1.24 -0.84 -0.03 115.58 114.79 1p3l h ASN 1094Ca 0.15 -0.13 -0.00 0.00 0.71 0.00 0.00 56.30 57.03 1p3l h ASN 1094Cb 0.40 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.22 1p3l h ASN 1094CO 0.01 0.81 -0.05 0.50 -1.29 0.00 0.00 177.43 177.41 1p3l h LYS 1095N 0.96 -0.13 -0.95 6.67 3.64 -0.49 -0.61 116.57 125.66 1p3l h LYS 1095Ca 0.22 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.76 1p3l h LYS 1095Cb 0.20 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.97 1p3l h LYS 1095CO -0.02 0.22 0.60 1.25 -2.27 0.00 0.00 179.45 179.24 1p3l h LEU 1096N -0.50 0.74 -3.67 5.20 5.85 -0.98 -1.04 115.31 120.91 1p3l h LEU 1096Ca -0.01 0.05 -0.32 0.00 0.84 0.00 0.00 57.88 58.44 1p3l h LEU 1096Cb 0.41 -0.09 -0.19 0.00 0.37 0.00 0.00 40.66 41.16 1p3l h LEU 1096CO 0.02 0.35 0.28 0.18 -0.34 0.00 0.00 178.44 178.94 1p3l n LEU 1097N -4.62 5.48 0.28 2.25 4.77 -0.04 -4.67 117.00 120.45 1p3l n LEU 1097Ca 0.19 -3.61 0.12 0.00 -0.03 0.00 0.00 56.01 52.69 1p3l n LEU 1097Cb 0.48 -0.73 0.79 0.00 -2.33 0.00 0.00 43.42 41.62 1p3l n LEU 1097CO 0.27 1.09 1.06 1.23 -1.33 0.00 0.00 177.39 179.71 1p3l h GLY 1098N 1.23 0.00 -1.90 -0.72 0.00 0.29 -2.12 103.07 99.85 1p3l h GLY 1098Ca 0.40 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.60 1p3l h GLY 1098CO 0.74 0.00 -0.02 0.54 0.00 0.00 0.00 176.54 177.80 1p3l n ARG 1099N -3.95 2.22 -4.54 4.80 1.74 -1.26 -4.99 116.66 110.68 1p3l n ARG 1099Ca -0.03 -3.04 -0.32 0.00 -0.77 0.00 0.00 57.85 53.69 1p3l n ARG 1099Cb 0.14 -1.83 -0.11 0.00 -1.02 0.00 0.00 32.46 29.63 1p3l n ARG 1099CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p3l s VAL 1100N -3.09 3.38 -0.16 1.55 1.01 -0.80 -5.11 120.40 117.17 1p3l s VAL 1100Ca 0.44 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 1p3l s VAL 1100Cb 0.38 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 1p3l s VAL 1100CO 0.03 0.39 -0.14 -0.89 0.00 0.00 0.00 175.10 174.50 1p3l s THR 1101N -0.96 2.80 -0.33 3.92 2.01 -1.26 -5.05 115.64 116.78 1p3l s THR 1101Ca 0.16 -0.72 -0.14 0.00 0.31 0.00 0.00 61.69 61.30 1p3l s THR 1101Cb -0.11 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 1p3l s THR 1101CO 0.06 0.51 0.30 -0.63 -0.69 0.00 0.00 174.62 174.17 1p3l s ILE 1102N 0.84 5.23 0.41 1.82 1.01 -1.26 -5.04 121.20 124.20 1p3l s ILE 1102Ca -0.04 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.35 1p3l s ILE 1102Cb -0.15 -3.74 -0.10 0.00 0.01 0.00 0.00 42.46 38.48 1p3l s ILE 1102CO -0.00 -0.01 1.47 0.00 0.00 0.00 0.00 174.94 176.40 1p3l s ALA 1103N 1.89 3.44 -1.65 9.38 0.00 -1.26 -2.40 121.76 131.17 1p3l s ALA 1103Ca 0.10 1.54 -0.00 0.00 0.00 0.00 0.00 51.96 53.60 1p3l s ALA 1103Cb -0.17 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1p3l s ALA 1103CO 0.11 -1.13 0.02 1.04 0.00 0.00 0.00 175.76 175.80 1p3l n GLN 1104N 0.19 -1.88 0.02 0.00 1.13 -1.26 -4.84 117.38 110.74 1p3l n GLN 1104Ca 0.03 0.94 0.08 0.00 -1.94 0.00 0.00 57.00 56.11 1p3l n GLN 1104Cb 0.40 -5.60 -0.11 0.00 0.11 0.00 0.00 30.24 25.05 1p3l n GLN 1104CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p3l n GLY 1105N -1.00 -1.17 7.00 1.08 0.00 -1.01 -3.43 105.19 106.66 1p3l n GLY 1105Ca -0.23 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1p3l n GLY 1105CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p3l n GLY 1106N 1.29 -0.09 3.50 -0.02 0.00 -1.26 -4.52 105.19 104.09 1p3l n GLY 1106Ca -0.06 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 1p3l n GLY 1106CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p3l s VAL 1107N 0.00 0.83 0.16 1.61 -7.23 -1.26 -5.03 120.40 109.48 1p3l s VAL 1107Ca 0.00 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.89 1p3l s VAL 1107Cb 0.00 -2.49 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 1p3l s VAL 1107CO 0.00 0.00 0.87 -0.76 -0.31 0.00 0.00 175.10 174.90 1p3l s LEU 1108N -3.58 4.57 -0.00 1.32 1.43 -1.26 -4.97 118.68 116.19 1p3l s LEU 1108Ca 0.27 1.75 -0.30 0.00 -1.03 0.00 0.00 54.13 54.83 1p3l s LEU 1108Cb 0.05 -3.45 -0.07 0.00 0.03 0.00 0.00 46.19 42.74 1p3l s LEU 1108CO 0.14 0.11 1.83 -2.84 0.23 0.00 0.00 176.35 175.82 1p3l s PRO 1109N -0.78 4.16 -0.30 1.29 0.02 -1.26 -4.92 135.00 133.22 1p3l s PRO 1109Ca 0.40 2.42 -0.11 0.00 0.02 0.00 0.00 61.00 63.73 1p3l s PRO 1109Cb -0.24 -4.08 0.15 0.00 0.02 0.00 0.00 34.50 30.35 1p3l s PRO 1109CO 0.29 -0.91 0.80 1.21 -0.33 0.00 0.00 177.00 178.06 1p3l s ASN 1110N 3.95 -0.90 -0.12 2.53 2.47 -1.26 -5.15 114.94 116.46 1p3l s ASN 1110Ca 0.82 1.11 0.01 0.00 0.42 0.00 0.00 52.86 55.22 1p3l s ASN 1110Cb -0.38 1.98 -0.01 0.00 -1.45 0.00 0.00 41.25 41.38 1p3l s ASN 1110CO 0.36 -0.17 -0.16 -0.63 -3.72 0.00 0.00 177.10 172.78 1p3l s ILE 1111N 2.72 2.75 0.02 -5.21 1.01 -1.26 -5.08 121.20 116.15 1p3l s ILE 1111Ca -0.01 -0.77 -0.35 0.00 0.00 0.00 0.00 60.65 59.52 1p3l s ILE 1111Cb -0.10 -2.13 -0.13 0.00 0.01 0.00 0.00 42.46 40.11 1p3l s ILE 1111CO -0.18 0.54 1.70 0.00 0.00 0.00 0.00 174.94 176.99 1p3l n GLN 1112N 3.52 2.03 -0.34 2.79 1.13 -1.26 -4.88 117.38 120.37 1p3l n GLN 1112Ca -0.18 0.74 -0.11 0.00 -1.94 0.00 0.00 57.00 55.51 1p3l n GLN 1112Cb 0.53 -2.52 -0.08 0.00 0.11 0.00 0.00 30.24 28.27 1p3l n GLN 1112CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1p3l h SER 1113N 7.28 -1.99 0.00 1.08 4.64 -1.99 0.62 113.55 123.19 1p3l h SER 1113Ca -0.47 0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1p3l h SER 1113Cb 1.27 0.88 0.00 0.00 -0.31 0.00 0.00 62.40 64.24 1p3l h SER 1113CO 0.91 -0.28 0.08 0.55 -0.87 0.00 0.00 176.83 177.22 1p3l n VAL 1114N -5.31 0.72 0.80 0.95 3.14 -1.26 -0.99 118.33 116.38 1p3l n VAL 1114Ca 0.01 0.27 0.09 0.00 -2.96 0.00 0.00 64.34 61.74 1p3l n VAL 1114Cb 0.30 -1.27 -0.10 0.00 -1.06 0.00 0.00 33.84 31.71 1p3l n VAL 1114CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1p3l n LEU 1115N -1.10 0.80 -4.79 6.55 4.77 0.22 -5.00 117.00 118.44 1p3l n LEU 1115Ca 0.00 -0.47 -0.31 0.00 -0.03 0.00 0.00 56.01 55.20 1p3l n LEU 1115Cb 0.08 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 1p3l n LEU 1115CO 0.00 0.20 0.70 -0.76 -1.33 0.00 0.00 177.39 176.20 1p3l s LEU 1116N -2.93 2.98 0.56 2.23 1.43 -0.16 -4.98 118.68 117.81 1p3l s LEU 1116Ca 0.06 1.66 -0.19 0.00 -1.03 0.00 0.00 54.13 54.63 1p3l s LEU 1116Cb 0.13 -4.41 -0.08 0.00 0.03 0.00 0.00 46.19 41.87 1p3l s LEU 1116CO 0.74 -1.81 0.74 -0.81 0.23 0.00 0.00 176.35 175.44 1p3l n PRO 1117N -3.36 0.74 -0.01 1.29 -0.04 -1.26 -4.89 135.00 127.47 1p3l n PRO 1117Ca 0.08 0.29 0.06 0.00 -0.04 0.00 0.00 63.50 63.88 1p3l n PRO 1117Cb 0.54 -1.90 0.44 0.00 -0.04 0.00 0.00 33.50 32.54 1p3l n PRO 1117CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1p3l h LYS 1118N 0.50 0.50 0.00 0.54 1.57 -1.98 -3.52 116.57 114.17 1p3l h LYS 1118Ca -0.46 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1p3l h LYS 1118Cb 1.38 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1p3l h LYS 1118CO 0.50 0.33 0.00 1.63 -0.57 0.00 0.00 179.45 181.34