#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bs6 s VAL 1002N 0.00 4.88 0.33 0.44 1.01 -1.26 -4.51 120.40 121.30 1bs6 s VAL 1002Ca 0.00 1.49 -0.07 0.00 0.00 0.00 0.00 61.98 63.40 1bs6 s VAL 1002Cb 0.00 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 1bs6 s VAL 1002CO 0.00 -0.02 0.63 -0.76 0.00 0.00 0.00 175.10 174.95 1bs6 s LEU 1003N 2.55 3.97 0.08 3.92 1.43 -1.26 -5.02 118.68 124.34 1bs6 s LEU 1003Ca 0.34 0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 53.99 1bs6 s LEU 1003Cb -0.16 -3.70 -0.05 0.00 0.03 0.00 0.00 46.19 42.31 1bs6 s LEU 1003CO 0.09 -0.28 1.05 -1.58 0.23 0.00 0.00 176.35 175.86 1bs6 s GLN 1004N -3.70 4.58 -0.18 1.70 0.74 -1.26 -4.94 119.66 116.60 1bs6 s GLN 1004Ca 0.46 1.57 -0.18 0.00 0.05 0.00 0.00 55.36 57.27 1bs6 s GLN 1004Cb -0.11 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.59 1bs6 s GLN 1004CO 0.31 0.00 0.47 0.08 -0.55 0.00 0.00 175.29 175.60 1bs6 s VAL 1005N 0.49 5.15 0.43 1.34 1.01 -1.26 -4.45 120.40 123.11 1bs6 s VAL 1005Ca 0.52 0.88 -0.24 0.00 0.00 0.00 0.00 61.98 63.14 1bs6 s VAL 1005Cb -0.25 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.24 1bs6 s VAL 1005CO 0.30 0.23 1.13 -0.76 0.00 0.00 0.00 175.10 176.00 1bs6 s LEU 1006N 1.30 4.08 0.25 3.92 1.43 -0.15 -4.98 118.68 124.53 1bs6 s LEU 1006Ca 0.23 2.23 0.10 0.00 -1.03 0.00 0.00 54.13 55.66 1bs6 s LEU 1006Cb -0.15 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 41.83 1bs6 s LEU 1006CO 0.09 -0.75 -0.07 -1.00 0.23 0.00 0.00 176.35 174.85 1bs6 s HIS 1007N -1.56 2.59 0.40 0.29 3.76 -1.26 -4.24 115.29 115.26 1bs6 s HIS 1007Ca 0.61 -0.25 -0.26 0.00 -0.15 0.00 0.00 55.06 55.01 1bs6 s HIS 1007Cb -0.27 -1.17 -0.09 0.00 1.11 0.00 0.00 32.58 32.16 1bs6 s HIS 1007CO 0.33 0.61 1.29 0.96 -0.85 0.00 0.00 174.74 177.08 1bs6 s ILE 1008N -2.19 2.69 -0.50 0.60 -4.36 -0.24 -1.21 121.20 115.98 1bs6 s ILE 1008Ca 0.29 0.62 0.02 0.00 -0.26 0.00 0.00 60.65 61.32 1bs6 s ILE 1008Cb -0.07 -3.37 0.51 0.00 1.25 0.00 0.00 42.46 40.79 1bs6 s ILE 1008CO 0.17 0.09 1.79 -0.81 0.24 0.00 0.00 174.94 176.43 1bs6 n PRO 1009N 0.19 2.62 -1.63 0.37 -0.04 -1.26 -4.84 135.00 130.40 1bs6 n PRO 1009Ca 0.03 -3.36 -0.47 0.00 -0.04 0.00 0.00 63.50 59.67 1bs6 n PRO 1009Cb 0.44 -2.20 -0.04 0.00 -0.04 0.00 0.00 33.50 31.67 1bs6 n PRO 1009CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bs6 n ASP 1010N -0.97 2.27 0.25 3.54 -0.08 -0.35 -4.86 116.55 116.36 1bs6 n ASP 1010Ca 0.55 1.13 0.15 0.00 -1.51 0.00 0.00 54.79 55.11 1bs6 n ASP 1010Cb 0.99 -1.34 0.44 0.00 2.34 0.00 0.00 41.12 43.55 1bs6 n ASP 1010CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1bs6 h GLU 1011N 4.24 0.00 0.00 -0.67 5.08 -2.01 -2.73 114.58 118.50 1bs6 h GLU 1011Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1bs6 h GLU 1011Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1bs6 h GLU 1011CO 0.76 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 179.31 1bs6 n ARG 1012N -3.10 0.07 0.13 2.33 1.74 -1.26 -2.58 116.66 113.99 1bs6 n ARG 1012Ca 0.02 0.14 0.12 0.00 -0.77 0.00 0.00 57.85 57.36 1bs6 n ARG 1012Cb 0.41 -1.59 0.49 0.00 -1.02 0.00 0.00 32.46 30.75 1bs6 n ARG 1012CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1bs6 n LEU 1013N -1.72 0.68 -1.10 0.55 4.32 -1.03 -3.08 117.00 115.62 1bs6 n LEU 1013Ca 0.05 0.66 0.08 0.00 -0.02 0.00 0.00 56.01 56.79 1bs6 n LEU 1013Cb 0.31 -0.56 0.26 0.00 -1.62 0.00 0.00 43.42 41.81 1bs6 n LEU 1013CO 0.24 -0.54 0.73 0.54 -1.22 0.00 0.00 177.39 177.14 1bs6 n ARG 1014N -2.24 3.20 -3.00 3.23 5.12 -1.06 -4.43 116.66 117.47 1bs6 n ARG 1014Ca 0.02 -2.58 -0.36 0.00 -1.93 0.00 0.00 57.85 53.01 1bs6 n ARG 1014Cb 0.24 -1.65 -0.06 0.00 -1.16 0.00 0.00 32.46 29.83 1bs6 n ARG 1014CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1bs6 s LYS 1015N -1.71 4.32 -0.21 5.56 1.02 -1.18 -4.52 119.74 123.02 1bs6 s LYS 1015Ca 0.40 0.99 -0.18 0.00 0.02 0.00 0.00 55.97 57.20 1bs6 s LYS 1015Cb 0.26 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.77 1bs6 s LYS 1015CO 0.19 0.31 0.50 0.08 -0.92 0.00 0.00 175.35 175.51 1bs6 s VAL 1016N -1.64 5.11 0.48 3.17 1.01 -1.26 -3.61 120.40 123.66 1bs6 s VAL 1016Ca 0.47 0.91 -0.20 0.00 0.00 0.00 0.00 61.98 63.16 1bs6 s VAL 1016Cb -0.16 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 1bs6 s VAL 1016CO 0.21 0.17 1.02 0.00 0.00 0.00 0.00 175.10 176.50 1bs6 s ALA 1017N 1.75 2.90 0.17 5.51 0.00 0.06 -4.95 121.76 127.19 1bs6 s ALA 1017Ca 0.23 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.72 1bs6 s ALA 1017Cb -0.15 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 1bs6 s ALA 1017CO 0.09 -0.26 0.38 0.15 0.00 0.00 0.00 175.76 176.13 1bs6 s LYS 1018N -3.27 3.57 0.66 0.00 1.02 -0.70 -4.79 119.74 116.24 1bs6 s LYS 1018Ca 0.66 -0.20 -0.16 0.00 0.02 0.00 0.00 55.97 56.30 1bs6 s LYS 1018Cb -0.15 -2.84 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 1bs6 s LYS 1018CO 0.20 0.44 1.14 -1.25 -0.92 0.00 0.00 175.35 174.95 1bs6 s PRO 1019N -2.94 2.69 -0.03 -1.68 0.04 -1.26 -1.15 135.00 130.67 1bs6 s PRO 1019Ca 0.40 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 1bs6 s PRO 1019Cb -0.12 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1bs6 s PRO 1019CO 0.27 -1.36 1.34 0.08 0.04 0.00 0.00 177.00 177.36 1bs6 s VAL 1020N -2.14 3.91 -0.05 -0.36 1.01 -1.26 -4.76 120.40 116.74 1bs6 s VAL 1020Ca 0.70 1.26 -0.24 0.00 0.00 0.00 0.00 61.98 63.70 1bs6 s VAL 1020Cb -0.24 -3.81 -0.24 0.00 0.00 0.00 0.00 36.38 32.09 1bs6 s VAL 1020CO 0.40 -0.01 1.00 -0.08 0.00 0.00 0.00 175.10 176.42 1bs6 h GLU 1021N 7.77 0.19 -3.44 2.72 4.81 -2.01 -3.46 114.58 121.15 1bs6 h GLU 1021Ca -0.36 -0.21 -0.30 0.00 -0.13 0.00 0.00 59.36 58.35 1bs6 h GLU 1021Cb 1.17 0.06 -0.35 0.00 0.63 0.00 0.00 28.75 30.27 1bs6 h GLU 1021CO 0.90 0.96 -0.71 -2.00 -0.73 0.00 0.00 179.01 177.43 1bs6 s GLU 1022N -3.01 -0.03 -0.58 1.92 2.12 -1.26 -5.10 118.70 112.76 1bs6 s GLU 1022Ca -0.16 0.25 -0.23 0.00 0.36 0.00 0.00 54.97 55.19 1bs6 s GLU 1022Cb 0.01 -0.28 0.05 0.00 0.26 0.00 0.00 34.13 34.17 1bs6 s GLU 1022CO 0.75 -0.20 0.92 0.08 -0.54 0.00 0.00 175.26 176.28 1bs6 s VAL 1023N 1.29 4.41 0.00 3.70 1.01 -1.26 -4.81 120.40 124.74 1bs6 s VAL 1023Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1bs6 s VAL 1023Cb -0.13 -4.56 0.00 0.00 0.00 0.00 0.00 36.38 31.69 1bs6 s VAL 1023CO -0.03 -1.19 0.00 -0.46 0.00 0.00 0.00 175.10 173.41 1bs6 n ASN 1024N 7.44 0.58 0.24 3.32 0.23 -1.26 -4.81 115.26 120.99 1bs6 n ASN 1024Ca -0.01 -0.80 0.08 0.00 -0.53 0.00 0.00 54.58 53.33 1bs6 n ASN 1024Cb 0.47 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.75 1bs6 n ASN 1024CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1bs6 h ALA 1025N 1.00 1.49 -0.44 -2.53 0.00 -1.98 0.19 119.26 117.00 1bs6 h ALA 1025Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1bs6 h ALA 1025Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1bs6 h ALA 1025CO 0.00 0.22 -0.01 1.49 0.00 0.00 0.00 179.25 180.95 1bs6 h GLU 1026N 0.00 0.78 0.00 0.00 4.81 -1.96 -2.32 114.58 115.88 1bs6 h GLU 1026Ca -0.00 -0.25 -0.11 0.00 -0.13 0.00 0.00 59.36 58.87 1bs6 h GLU 1026Cb 0.37 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1bs6 h GLU 1026CO 0.02 0.85 -0.51 0.82 -0.73 0.00 0.00 179.01 179.47 1bs6 h ILE 1027N 0.62 1.34 0.00 2.32 1.08 -1.34 -2.49 117.51 119.03 1bs6 h ILE 1027Ca 0.12 -1.75 -0.14 0.00 -0.39 0.00 0.00 64.86 62.69 1bs6 h ILE 1027Cb 0.51 1.95 -0.02 0.00 -3.07 0.00 0.00 36.82 36.19 1bs6 h ILE 1027CO 0.02 0.50 -0.68 1.56 -0.69 0.00 0.00 178.15 178.86 1bs6 h GLN 1028N 0.00 0.00 -0.31 2.37 4.20 -0.74 -2.32 115.11 118.32 1bs6 h GLN 1028Ca -0.01 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.57 1bs6 h GLN 1028Cb 0.91 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 1bs6 h GLN 1028CO 0.07 0.68 -0.33 -0.09 -0.67 0.00 0.00 178.83 178.49 1bs6 h ARG 1029N 0.00 0.76 -0.18 1.46 2.43 -1.21 -1.94 114.38 115.70 1bs6 h ARG 1029Ca -0.01 -0.41 0.04 0.00 -0.81 0.00 0.00 59.98 58.79 1bs6 h ARG 1029Cb 1.44 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.97 1bs6 h ARG 1029CO 0.09 1.04 -0.05 0.82 -1.51 0.00 0.00 179.97 180.36 1bs6 h ILE 1030N 0.52 0.80 -0.30 1.20 2.04 -1.34 -0.25 117.51 120.18 1bs6 h ILE 1030Ca 0.04 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.97 1bs6 h ILE 1030Cb 0.91 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.73 1bs6 h ILE 1030CO 0.08 0.00 -0.12 0.58 0.00 0.00 0.00 178.15 178.69 1bs6 h VAL 1031N -0.01 0.60 -0.07 1.67 2.07 -1.37 0.10 116.25 119.24 1bs6 h VAL 1031Ca 0.09 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.51 1bs6 h VAL 1031Cb 0.15 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1bs6 h VAL 1031CO -0.20 0.00 -0.44 0.44 0.02 0.00 0.00 177.57 177.40 1bs6 h ASP 1032N -0.07 0.16 0.06 0.57 3.32 -1.13 -1.00 116.42 118.33 1bs6 h ASP 1032Ca 0.15 -0.07 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 1bs6 h ASP 1032Cb 0.30 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1bs6 h ASP 1032CO -0.35 0.58 -0.55 0.44 -1.72 0.00 0.00 179.24 177.64 1bs6 h ASP 1033N 0.13 0.58 -0.22 6.45 3.32 -0.07 -2.22 116.42 124.37 1bs6 h ASP 1033Ca 0.01 -0.31 -0.14 0.00 0.02 0.00 0.00 57.03 56.62 1bs6 h ASP 1033Cb 0.82 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1bs6 h ASP 1033CO 0.06 1.01 -0.34 0.24 -1.72 0.00 0.00 179.24 178.49 1bs6 h MET 1034N 0.40 0.74 -0.37 3.56 2.86 0.16 -0.24 114.93 122.04 1bs6 h MET 1034Ca 0.01 -0.36 -0.03 0.00 -2.06 0.00 0.00 59.70 57.26 1bs6 h MET 1034Cb 1.08 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 1bs6 h MET 1034CO 0.10 0.97 0.10 0.74 1.06 0.00 0.00 176.91 179.88 1bs6 h PHE 1035N 0.62 0.61 -0.56 -0.22 0.04 -1.13 0.66 116.94 116.95 1bs6 h PHE 1035Ca 0.06 -0.07 0.07 0.00 2.80 0.00 0.00 57.97 60.84 1bs6 h PHE 1035Cb 0.87 -0.17 -0.06 0.00 2.20 0.00 0.00 35.95 38.79 1bs6 h PHE 1035CO 0.04 0.60 0.24 0.93 -0.60 0.00 0.00 178.31 179.53 1bs6 h GLU 1036N 0.45 0.44 -0.37 1.51 5.08 -1.28 -0.44 114.58 119.96 1bs6 h GLU 1036Ca 0.12 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1bs6 h GLU 1036Cb 0.29 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1bs6 h GLU 1036CO -0.00 0.29 -0.02 1.15 -1.00 0.00 0.00 179.01 179.42 1bs6 h THR 1037N 0.45 1.27 0.05 1.13 2.02 -0.86 -1.17 112.91 115.79 1bs6 h THR 1037Ca 0.27 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1bs6 h THR 1037Cb 0.27 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1bs6 h THR 1037CO -0.24 0.35 -0.02 -0.03 0.37 0.00 0.00 175.52 175.94 1bs6 h MET 1038N 0.48 -0.06 -0.42 6.66 1.85 -0.57 -1.82 114.93 121.05 1bs6 h MET 1038Ca 0.10 0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 59.16 1bs6 h MET 1038Cb 0.50 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.53 1bs6 h MET 1038CO 0.02 -0.03 0.10 1.88 -0.40 0.00 0.00 176.91 178.48 1bs6 h TYR 1039N -0.07 0.63 -0.29 1.39 0.05 -1.04 -1.39 116.97 116.26 1bs6 h TYR 1039Ca -0.01 -0.05 -0.09 0.00 0.05 0.00 0.00 58.73 58.64 1bs6 h TYR 1039Cb 0.06 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.59 1bs6 h TYR 1039CO -0.07 0.55 -0.20 0.00 -1.05 0.00 0.00 178.16 177.39 1bs6 h ALA 1040N 1.50 1.12 -0.11 3.88 0.00 -0.88 -2.82 119.26 121.96 1bs6 h ALA 1040Ca 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1bs6 h ALA 1040Cb 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1bs6 h ALA 1040CO -0.00 0.55 0.00 0.39 0.00 0.00 0.00 179.25 180.19 1bs6 n GLU 1041N -4.15 1.97 -3.38 0.00 -0.58 -0.71 -4.96 120.64 108.83 1bs6 n GLU 1041Ca 0.00 -1.43 -0.17 0.00 -0.42 0.00 0.00 57.16 55.14 1bs6 n GLU 1041Cb 0.38 -1.46 0.07 0.00 -0.57 0.00 0.00 31.44 29.86 1bs6 n GLU 1041CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1bs6 n GLU 1042N 0.70 -4.29 -4.04 3.49 1.02 -0.81 -5.03 120.64 111.68 1bs6 n GLU 1042Ca 0.17 0.82 -0.26 0.00 -0.02 0.00 0.00 57.16 57.88 1bs6 n GLU 1042Cb 0.45 -5.72 -0.05 0.00 -0.02 0.00 0.00 31.44 26.10 1bs6 n GLU 1042CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1bs6 s GLY 1043N -3.89 2.40 0.00 0.62 0.00 -0.59 -5.04 107.32 100.83 1bs6 s GLY 1043Ca 0.23 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.34 1bs6 s GLY 1043CO 0.75 -1.93 0.16 0.29 0.00 0.00 0.00 173.10 172.37 1bs6 n ILE 1044N -1.46 0.00 -3.64 0.90 -5.35 -1.26 -4.66 119.36 103.89 1bs6 n ILE 1044Ca -0.03 -0.49 -0.13 0.00 -0.27 0.00 0.00 62.75 61.83 1bs6 n ILE 1044Cb 0.64 1.01 -0.06 0.00 -1.74 0.00 0.00 39.64 39.49 1bs6 n ILE 1044CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1bs6 s GLY 1045N -0.66 -0.32 -0.20 3.28 0.00 -1.26 -0.50 107.32 107.66 1bs6 s GLY 1045Ca 0.00 0.43 -0.15 0.00 0.00 0.00 0.00 44.72 45.00 1bs6 s GLY 1045CO 0.00 0.16 0.50 -2.27 0.00 0.00 0.00 173.10 171.49 1bs6 s LEU 1046N -1.93 -0.10 0.02 0.66 2.96 -0.15 -4.97 118.68 115.17 1bs6 s LEU 1046Ca -0.06 1.05 0.03 0.00 -0.22 0.00 0.00 54.13 54.93 1bs6 s LEU 1046Cb -0.01 1.72 -0.03 0.00 0.50 0.00 0.00 46.19 48.36 1bs6 s LEU 1046CO -0.01 -0.19 -0.05 0.00 -1.32 0.00 0.00 176.35 174.78 1bs6 s ALA 1047N 0.71 3.08 0.37 5.97 0.00 -1.26 -1.23 121.76 129.40 1bs6 s ALA 1047Ca -0.04 -1.03 0.16 0.00 0.00 0.00 0.00 51.96 51.06 1bs6 s ALA 1047Cb -0.05 -1.15 1.06 0.00 0.00 0.00 0.00 23.12 22.98 1bs6 s ALA 1047CO -0.05 0.63 1.72 0.00 0.00 0.00 0.00 175.76 178.06 1bs6 h ALA 1048N 4.35 2.10 0.00 0.00 0.00 -1.36 -1.58 119.26 122.78 1bs6 h ALA 1048Ca -0.48 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1bs6 h ALA 1048Cb 1.17 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1bs6 h ALA 1048CO 0.55 -0.58 0.00 1.79 0.00 0.00 0.00 179.25 181.00 1bs6 h THR 1049N 0.41 0.00 0.00 0.00 1.35 -1.70 0.53 112.91 113.50 1bs6 h THR 1049Ca 0.66 -0.31 -0.05 0.00 -0.55 0.00 0.00 66.41 66.15 1bs6 h THR 1049Cb 1.55 1.28 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 1bs6 h THR 1049CO -0.42 0.00 -0.27 1.56 -0.25 0.00 0.00 175.52 176.14 1bs6 h GLN 1050N 0.00 0.00 -0.73 4.72 4.20 -1.57 -1.94 115.11 119.79 1bs6 h GLN 1050Ca 0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.47 1bs6 h GLN 1050Cb 0.32 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.96 1bs6 h GLN 1050CO 0.00 0.26 0.28 1.33 -0.67 0.00 0.00 178.83 180.03 1bs6 n VAL 1051N -3.16 2.93 -2.54 -0.54 0.24 0.13 -0.97 118.33 114.41 1bs6 n VAL 1051Ca 0.03 -1.74 -0.21 0.00 -2.04 0.00 0.00 64.34 60.38 1bs6 n VAL 1051Cb 0.64 -0.36 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1bs6 n VAL 1051CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1bs6 n ASP 1052N -0.33 -5.86 -4.16 -1.34 2.03 -0.73 -4.90 116.55 101.26 1bs6 n ASP 1052Ca 0.42 -0.09 -0.34 0.00 0.52 0.00 0.00 54.79 55.31 1bs6 n ASP 1052Cb 1.39 -4.83 -0.15 0.00 -0.72 0.00 0.00 41.12 36.81 1bs6 n ASP 1052CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1bs6 s ILE 1053N -3.05 2.58 -1.02 5.18 1.01 -0.91 -5.00 121.20 119.98 1bs6 s ILE 1053Ca 0.07 -1.12 -0.02 0.00 0.00 0.00 0.00 60.65 59.58 1bs6 s ILE 1053Cb -0.03 -2.30 0.32 0.00 0.01 0.00 0.00 42.46 40.45 1bs6 s ILE 1053CO 0.09 0.22 1.69 1.41 0.00 0.00 0.00 174.94 178.35 1bs6 n HIS 1054N 4.61 2.67 -4.23 3.97 8.25 -1.26 -2.19 115.22 127.04 1bs6 n HIS 1054Ca -0.17 -2.63 -0.14 0.00 -0.26 0.00 0.00 57.72 54.52 1bs6 n HIS 1054Cb 0.47 -1.18 -0.10 0.00 1.12 0.00 0.00 29.99 30.29 1bs6 n HIS 1054CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1bs6 s GLN 1055N -3.85 1.00 -1.35 -0.41 -0.21 -1.26 -1.71 119.66 111.87 1bs6 s GLN 1055Ca 0.37 -1.40 -0.16 0.00 0.02 0.00 0.00 55.36 54.19 1bs6 s GLN 1055Cb 0.15 -0.54 0.07 0.00 1.00 0.00 0.00 33.01 33.68 1bs6 s GLN 1055CO -0.06 0.06 1.88 0.54 -2.12 0.00 0.00 175.29 175.60 1bs6 n ARG 1056N -0.08 3.11 -4.70 2.91 1.74 -0.30 -4.52 116.66 114.81 1bs6 n ARG 1056Ca -0.11 -3.09 -0.25 0.00 -0.77 0.00 0.00 57.85 53.62 1bs6 n ARG 1056Cb 0.60 -3.40 -0.16 0.00 -1.02 0.00 0.00 32.46 28.47 1bs6 n ARG 1056CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bs6 s ILE 1057N 3.72 1.28 -0.02 0.55 1.01 -1.26 -0.97 121.20 125.52 1bs6 s ILE 1057Ca 0.51 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.61 1bs6 s ILE 1057Cb 0.07 -1.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 1bs6 s ILE 1057CO 0.02 0.38 -0.13 -0.63 0.00 0.00 0.00 174.94 174.58 1bs6 s ILE 1058N 0.46 1.07 0.03 2.92 1.01 -0.05 -1.15 121.20 125.48 1bs6 s ILE 1058Ca -0.12 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.04 1bs6 s ILE 1058Cb -0.15 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 1bs6 s ILE 1058CO 0.04 0.31 -0.15 0.68 0.00 0.00 0.00 174.94 175.82 1bs6 s VAL 1059N -0.12 3.02 -0.05 2.92 -7.23 -0.36 -0.75 120.40 117.83 1bs6 s VAL 1059Ca 0.01 -1.06 -0.04 0.00 -1.81 0.00 0.00 61.98 59.08 1bs6 s VAL 1059Cb -0.07 -2.28 0.02 0.00 0.56 0.00 0.00 36.38 34.61 1bs6 s VAL 1059CO 0.00 0.36 0.13 -0.63 -0.31 0.00 0.00 175.10 174.65 1bs6 s ILE 1060N -0.93 -0.01 -0.30 -0.62 1.01 -0.06 -0.97 121.20 119.31 1bs6 s ILE 1060Ca 0.15 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.81 1bs6 s ILE 1060Cb -0.11 -0.19 0.11 0.00 0.01 0.00 0.00 42.46 42.28 1bs6 s ILE 1060CO 0.06 0.01 0.17 -0.62 0.00 0.00 0.00 174.94 174.56 1bs6 s ASP 1061N 0.28 3.20 0.00 3.58 -1.08 0.34 -0.52 116.67 122.48 1bs6 s ASP 1061Ca -0.02 -1.42 0.26 0.00 -0.52 0.00 0.00 52.55 50.85 1bs6 s ASP 1061Cb -0.03 -0.26 0.69 0.00 -1.46 0.00 0.00 42.92 41.86 1bs6 s ASP 1061CO -0.01 -0.41 1.53 1.33 0.52 0.00 0.00 175.17 178.13 1bs6 n VAL 1062N 5.00 0.00 -1.75 1.11 0.24 -1.26 -4.57 118.33 117.10 1bs6 n VAL 1062Ca -0.02 -0.23 -0.38 0.00 -2.04 0.00 0.00 64.34 61.68 1bs6 n VAL 1062Cb 0.41 0.67 0.06 0.00 -1.47 0.00 0.00 33.84 33.51 1bs6 n VAL 1062CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1bs6 s SER 1063N -2.27 4.90 0.14 -1.34 1.04 -1.26 -4.91 113.70 110.00 1bs6 s SER 1063Ca 0.29 2.70 0.26 0.00 0.48 0.00 0.00 55.95 59.68 1bs6 s SER 1063Cb 0.20 -2.63 0.82 0.00 0.10 0.00 0.00 66.02 64.51 1bs6 s SER 1063CO 0.44 -1.82 1.73 -0.62 0.98 0.00 0.00 173.24 173.95 1bs6 n GLU 1064N -1.50 0.20 0.00 4.02 4.71 -1.26 -2.23 120.64 124.58 1bs6 n GLU 1064Ca 0.13 0.14 0.11 0.00 -0.01 0.00 0.00 57.16 57.54 1bs6 n GLU 1064Cb 0.47 -1.71 0.07 0.00 -1.01 0.00 0.00 31.44 29.25 1bs6 n GLU 1064CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1bs6 n ASN 1065N -2.04 2.69 -3.60 1.62 3.02 -1.26 -4.99 115.26 110.69 1bs6 n ASN 1065Ca 0.06 -1.84 -0.21 0.00 -0.03 0.00 0.00 54.58 52.55 1bs6 n ASN 1065Cb 0.41 0.14 0.06 0.00 -0.61 0.00 0.00 39.78 39.78 1bs6 n ASN 1065CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bs6 n ARG 1066N 0.94 -6.35 -1.05 3.52 5.12 -0.95 -4.88 116.66 113.01 1bs6 n ARG 1066Ca 0.12 0.75 0.01 0.00 -1.93 0.00 0.00 57.85 56.81 1bs6 n ARG 1066Cb 0.55 -5.65 0.00 0.00 -1.16 0.00 0.00 32.46 26.21 1bs6 n ARG 1066CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1bs6 n ASP 1067N -3.05 0.41 -3.64 0.55 5.68 -1.26 -5.03 116.55 110.21 1bs6 n ASP 1067Ca -0.18 -1.94 -0.29 0.00 -0.50 0.00 0.00 54.79 51.88 1bs6 n ASP 1067Cb 0.63 -0.19 -0.13 0.00 -1.14 0.00 0.00 41.12 40.28 1bs6 n ASP 1067CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1bs6 s GLU 1068N 0.00 0.88 -0.08 0.11 2.12 -1.26 -5.12 118.70 115.36 1bs6 s GLU 1068Ca 0.17 -1.50 -0.15 0.00 0.36 0.00 0.00 54.97 53.85 1bs6 s GLU 1068Cb 0.20 -1.90 -0.05 0.00 0.26 0.00 0.00 34.13 32.63 1bs6 s GLU 1068CO -0.09 -1.12 0.39 1.03 -0.54 0.00 0.00 175.26 174.93 1bs6 s ARG 1069N 0.98 4.10 -0.09 4.30 0.52 -1.26 -4.48 118.95 123.01 1bs6 s ARG 1069Ca 0.15 0.32 0.02 0.00 -0.52 0.00 0.00 55.73 55.71 1bs6 s ARG 1069Cb -0.22 -3.33 0.01 0.00 0.52 0.00 0.00 34.95 31.94 1bs6 s ARG 1069CO -0.08 0.44 -0.16 -1.17 0.02 0.00 0.00 175.30 174.35 1bs6 s LEU 1070N -0.24 1.75 -0.13 2.53 2.96 0.32 -5.01 118.68 120.87 1bs6 s LEU 1070Ca 0.22 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1bs6 s LEU 1070Cb -0.15 -1.05 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 1bs6 s LEU 1070CO 0.10 0.04 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.36 1bs6 s VAL 1071N 0.78 3.14 -0.21 1.68 1.01 -1.26 -0.88 120.40 124.66 1bs6 s VAL 1071Ca -0.11 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1bs6 s VAL 1071Cb -0.16 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.92 1bs6 s VAL 1071CO 0.02 0.52 -0.14 -0.76 0.00 0.00 0.00 175.10 174.75 1bs6 s LEU 1072N 0.33 2.66 -0.12 3.92 1.43 0.07 -4.55 118.68 122.43 1bs6 s LEU 1072Ca -0.10 -0.78 0.01 0.00 -1.03 0.00 0.00 54.13 52.23 1bs6 s LEU 1072Cb -0.16 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 1bs6 s LEU 1072CO 0.05 -0.06 -0.16 -0.63 0.23 0.00 0.00 176.35 175.78 1bs6 s ILE 1073N 1.29 2.81 -1.35 -0.59 1.01 -0.27 -0.87 121.20 123.22 1bs6 s ILE 1073Ca 0.02 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 59.85 1bs6 s ILE 1073Cb -0.15 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.17 1bs6 s ILE 1073CO -0.09 0.54 0.49 0.59 0.00 0.00 0.00 174.94 176.47 1bs6 n ASN 1074N 3.44 -1.44 -4.76 3.58 3.02 -0.14 -0.75 115.26 118.21 1bs6 n ASN 1074Ca -0.18 -1.03 -0.37 0.00 -0.03 0.00 0.00 54.58 52.96 1bs6 n ASN 1074Cb 0.53 -3.01 0.01 0.00 -0.61 0.00 0.00 39.78 36.69 1bs6 n ASN 1074CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1bs6 s PRO 1075N -6.50 3.51 -0.09 3.52 0.04 -1.26 -4.60 135.00 129.62 1bs6 s PRO 1075Ca 0.12 1.92 -0.00 0.00 0.04 0.00 0.00 61.00 63.08 1bs6 s PRO 1075Cb -0.05 -2.32 0.02 0.00 0.04 0.00 0.00 34.50 32.19 1bs6 s PRO 1075CO 0.89 -0.80 -0.06 -2.00 0.04 0.00 0.00 177.00 175.07 1bs6 s GLU 1076N -2.81 1.21 -0.36 4.56 2.56 0.82 -4.99 118.70 119.70 1bs6 s GLU 1076Ca 0.67 -0.16 -0.29 0.00 0.00 0.00 0.00 54.97 55.19 1bs6 s GLU 1076Cb -0.32 -1.30 0.02 0.00 2.00 0.00 0.00 34.13 34.53 1bs6 s GLU 1076CO 0.39 -0.21 1.13 -1.17 -0.56 0.00 0.00 175.26 174.84 1bs6 s LEU 1077N 1.52 3.85 -0.08 2.70 2.96 -1.26 -1.59 118.68 126.77 1bs6 s LEU 1077Ca -0.00 0.93 -0.09 0.00 -0.22 0.00 0.00 54.13 54.75 1bs6 s LEU 1077Cb -0.13 -3.54 -0.29 0.00 0.50 0.00 0.00 46.19 42.73 1bs6 s LEU 1077CO -0.05 -1.01 0.54 -0.07 -1.32 0.00 0.00 176.35 174.44 1bs6 h LEU 1078N 10.51 0.52 -7.00 -0.68 3.38 -0.78 -3.49 115.31 117.77 1bs6 h LEU 1078Ca -0.22 -0.93 0.04 0.00 0.09 0.00 0.00 57.88 56.86 1bs6 h LEU 1078Cb 1.07 -0.17 -0.16 0.00 0.09 0.00 0.00 40.66 41.49 1bs6 h LEU 1078CO 1.06 1.81 0.37 -1.83 0.09 0.00 0.00 178.44 179.94 1bs6 s GLU 1079N -2.57 0.97 0.06 1.13 -1.05 -1.05 -4.99 118.70 111.19 1bs6 s GLU 1079Ca -0.19 -0.22 -0.05 0.00 -0.15 0.00 0.00 54.97 54.36 1bs6 s GLU 1079Cb 0.06 0.45 -0.02 0.00 -0.44 0.00 0.00 34.13 34.18 1bs6 s GLU 1079CO 0.82 -0.40 0.09 -1.59 0.95 0.00 0.00 175.26 175.13 1bs6 s LYS 1080N -2.81 0.68 0.07 -4.83 -2.85 -1.26 -0.36 119.74 108.38 1bs6 s LYS 1080Ca 0.01 -0.96 -0.26 0.00 -1.00 0.00 0.00 55.97 53.76 1bs6 s LYS 1080Cb -0.01 0.26 0.07 0.00 -2.06 0.00 0.00 37.83 36.10 1bs6 s LYS 1080CO -0.06 -0.18 0.64 -1.54 0.10 0.00 0.00 175.35 174.30 1bs6 s SER 1081N -2.61 -0.61 0.00 0.03 1.04 -0.18 -4.97 113.70 106.41 1bs6 s SER 1081Ca 0.02 0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.76 1bs6 s SER 1081Cb 0.04 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1bs6 s SER 1081CO -0.08 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1bs6 n GLY 1082N 0.17 -2.73 3.30 7.32 0.00 -1.26 -0.91 105.19 111.08 1bs6 n GLY 1082Ca -0.18 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 1bs6 n GLY 1082CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bs6 s GLU 1083N -0.93 0.44 0.06 1.61 1.03 -1.26 -3.45 118.70 116.20 1bs6 s GLU 1083Ca 0.00 0.73 0.01 0.00 0.03 0.00 0.00 54.97 55.74 1bs6 s GLU 1083Cb 0.00 0.07 -0.00 0.00 -0.80 0.00 0.00 34.13 33.40 1bs6 s GLU 1083CO 0.00 -0.12 0.04 0.25 -1.33 0.00 0.00 175.26 174.10 1bs6 n THR 1084N 3.77 0.00 -3.62 1.83 -2.24 0.42 -4.63 114.28 109.80 1bs6 n THR 1084Ca -0.20 -0.43 -0.06 0.00 -2.27 0.00 0.00 64.05 61.08 1bs6 n THR 1084Cb 0.56 0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.93 1bs6 n THR 1084CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1bs6 s GLY 1085N -1.43 -0.00 0.34 3.38 0.00 -1.26 -1.43 107.32 106.91 1bs6 s GLY 1085Ca 0.06 2.75 0.03 0.00 0.00 0.00 0.00 44.72 47.56 1bs6 s GLY 1085CO 0.04 1.48 0.09 -0.26 0.00 0.00 0.00 173.10 174.45 1bs6 s ILE 1086N -0.46 0.88 -0.60 0.90 -4.36 -1.26 -4.96 121.20 111.34 1bs6 s ILE 1086Ca 0.04 -2.00 -0.28 0.00 -0.26 0.00 0.00 60.65 58.15 1bs6 s ILE 1086Cb -0.03 -2.63 0.03 0.00 1.25 0.00 0.00 42.46 41.08 1bs6 s ILE 1086CO -0.07 0.00 1.19 -1.61 0.24 0.00 0.00 174.94 174.69 1bs6 s GLU 1087N -3.87 3.47 0.08 0.37 2.02 -1.26 -3.27 118.70 116.23 1bs6 s GLU 1087Ca 0.33 0.16 -0.18 0.00 0.02 0.00 0.00 54.97 55.30 1bs6 s GLU 1087Cb 0.07 -4.04 -0.07 0.00 0.10 0.00 0.00 34.13 30.19 1bs6 s GLU 1087CO 0.15 -1.73 0.55 -1.21 0.02 0.00 0.00 175.26 173.05 1bs6 s GLU 1088N 4.99 4.14 0.41 1.61 2.02 -0.17 -4.77 118.70 126.94 1bs6 s GLU 1088Ca 0.41 0.67 0.07 0.00 0.02 0.00 0.00 54.97 56.15 1bs6 s GLU 1088Cb -0.08 -3.18 -0.06 0.00 0.10 0.00 0.00 34.13 30.91 1bs6 s GLU 1088CO 0.24 0.62 0.13 0.20 0.02 0.00 0.00 175.26 176.46 1bs6 s GLY 1089N -1.21 2.40 -0.16 -1.39 0.00 -1.26 -2.09 107.32 103.61 1bs6 s GLY 1089Ca 0.30 -2.15 -0.08 0.00 0.00 0.00 0.00 44.72 42.79 1bs6 s GLY 1089CO 0.19 -1.98 0.38 0.00 0.00 0.00 0.00 173.10 171.69 1bs6 h LEU 1091N 7.42 0.02 -0.06 0.00 3.38 -1.96 -1.79 115.31 122.32 1bs6 h LEU 1091Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1bs6 h LEU 1091Cb 1.16 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1bs6 h LEU 1091CO 0.26 0.01 -0.09 -1.20 0.09 0.00 0.00 178.44 177.52 1bs6 n SER 1092N -4.44 0.18 -3.56 -0.43 7.64 -1.26 -4.16 113.62 107.59 1bs6 n SER 1092Ca 0.06 -0.05 -0.27 0.00 1.01 0.00 0.00 58.87 59.62 1bs6 n SER 1092Cb 0.43 -0.24 -0.09 0.00 -1.01 0.00 0.00 64.21 63.29 1bs6 n SER 1092CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1bs6 n ILE 1093N -1.30 1.34 -1.92 0.44 5.41 -0.67 -1.08 119.36 121.58 1bs6 n ILE 1093Ca 0.11 -4.76 -0.42 0.00 1.00 0.00 0.00 62.75 58.68 1bs6 n ILE 1093Cb 0.30 -2.07 -0.03 0.00 -0.71 0.00 0.00 39.64 37.13 1bs6 n ILE 1093CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1bs6 s PRO 1094N -1.70 4.17 0.00 0.38 0.04 -1.26 -2.86 135.00 133.79 1bs6 s PRO 1094Ca 0.33 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1bs6 s PRO 1094Cb 0.07 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1bs6 s PRO 1094CO -0.10 -0.86 0.00 0.39 0.04 0.00 0.00 177.00 176.47 1bs6 n GLU 1095N 7.03 -0.01 -3.95 4.56 1.02 -1.26 -4.84 120.64 123.19 1bs6 n GLU 1095Ca 0.18 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.97 1bs6 n GLU 1095Cb 0.42 -2.71 -0.09 0.00 -0.02 0.00 0.00 31.44 29.04 1bs6 n GLU 1095CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1bs6 s GLN 1096N -0.10 3.90 0.02 3.49 -1.52 -1.13 -5.10 119.66 119.22 1bs6 s GLN 1096Ca 0.00 -0.29 0.06 0.00 -1.95 0.00 0.00 55.36 53.18 1bs6 s GLN 1096Cb 0.00 -3.23 -0.02 0.00 -0.22 0.00 0.00 33.01 29.54 1bs6 s GLN 1096CO 0.00 0.37 -0.19 1.03 -0.25 0.00 0.00 175.29 176.25 1bs6 s ARG 1097N 0.12 1.37 -0.03 2.91 0.52 -1.26 -4.45 118.95 118.14 1bs6 s ARG 1097Ca 0.06 -0.83 -0.15 0.00 -0.52 0.00 0.00 55.73 54.29 1bs6 s ARG 1097Cb -0.12 -1.42 0.03 0.00 0.52 0.00 0.00 34.95 33.96 1bs6 s ARG 1097CO 0.00 0.37 0.32 0.00 0.02 0.00 0.00 175.30 176.02 1bs6 s ALA 1098N -0.69 -0.82 -0.01 2.13 0.00 -0.89 -4.86 121.76 116.62 1bs6 s ALA 1098Ca 0.07 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 1bs6 s ALA 1098Cb -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 1bs6 s ALA 1098CO 0.01 -0.25 0.97 -1.17 0.00 0.00 0.00 175.76 175.32 1bs6 s LEU 1099N -1.17 4.36 0.07 0.00 0.20 -1.25 -1.00 118.68 119.89 1bs6 s LEU 1099Ca -0.12 1.64 0.08 0.00 0.69 0.00 0.00 54.13 56.42 1bs6 s LEU 1099Cb -0.05 -3.56 -0.03 0.00 -0.43 0.00 0.00 46.19 42.13 1bs6 s LEU 1099CO 0.04 -0.26 -0.20 0.68 -0.29 0.00 0.00 176.35 176.32 1bs6 s VAL 1100N 1.04 1.64 0.16 1.68 -7.23 -1.20 -4.96 120.40 111.52 1bs6 s VAL 1100Ca 0.51 -1.35 -0.31 0.00 -1.81 0.00 0.00 61.98 59.02 1bs6 s VAL 1100Cb -0.21 -1.47 -0.08 0.00 0.56 0.00 0.00 36.38 35.18 1bs6 s VAL 1100CO 0.27 0.05 1.37 -2.84 -0.31 0.00 0.00 175.10 173.65 1bs6 s PRO 1101N -1.54 4.34 0.09 4.82 0.02 -1.26 -4.33 135.00 137.14 1bs6 s PRO 1101Ca 0.06 2.09 -0.01 0.00 0.02 0.00 0.00 61.00 63.17 1bs6 s PRO 1101Cb -0.09 -3.21 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1bs6 s PRO 1101CO 0.03 -0.37 0.01 1.03 -0.33 0.00 0.00 177.00 177.37 1bs6 s ARG 1102N 0.52 0.78 0.39 5.54 1.81 -0.52 -4.99 118.95 122.48 1bs6 s ARG 1102Ca 0.61 -1.33 -0.25 0.00 -1.72 0.00 0.00 55.73 53.04 1bs6 s ARG 1102Cb -0.37 0.21 -0.09 0.00 -0.45 0.00 0.00 34.95 34.25 1bs6 s ARG 1102CO 0.34 -0.18 1.08 0.00 -0.68 0.00 0.00 175.30 175.86 1bs6 s ALA 1103N -3.98 3.12 0.04 2.13 0.00 -1.26 -0.44 121.76 121.38 1bs6 s ALA 1103Ca 0.16 0.78 -0.08 0.00 0.00 0.00 0.00 51.96 52.82 1bs6 s ALA 1103Cb 0.08 -3.30 -0.31 0.00 0.00 0.00 0.00 23.12 19.59 1bs6 s ALA 1103CO -0.04 -0.29 1.00 1.49 0.00 0.00 0.00 175.76 177.92 1bs6 h GLU 1104N 2.63 0.35 -6.13 0.00 4.81 -1.39 -3.42 114.58 111.44 1bs6 h GLU 1104Ca -0.48 -0.61 -0.56 0.00 -0.13 0.00 0.00 59.36 57.59 1bs6 h GLU 1104Cb 1.22 0.23 -0.20 0.00 0.63 0.00 0.00 28.75 30.63 1bs6 h GLU 1104CO 0.63 1.27 -0.81 0.15 -0.73 0.00 0.00 179.01 179.52 1bs6 s LYS 1105N -2.63 1.25 -0.20 1.92 1.02 -0.08 -3.59 119.74 117.44 1bs6 s LYS 1105Ca -0.07 -1.33 -0.14 0.00 0.02 0.00 0.00 55.97 54.45 1bs6 s LYS 1105Cb 0.06 -1.43 0.06 0.00 -0.52 0.00 0.00 37.83 36.00 1bs6 s LYS 1105CO 0.89 0.31 0.50 0.08 -0.92 0.00 0.00 175.35 176.21 1bs6 s VAL 1106N -1.64 -0.01 -0.15 3.17 1.01 -0.87 -1.01 120.40 120.91 1bs6 s VAL 1106Ca 0.13 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.16 1bs6 s VAL 1106Cb -0.08 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.60 1bs6 s VAL 1106CO 0.06 0.02 -0.20 -0.75 0.00 0.00 0.00 175.10 174.23 1bs6 s LYS 1107N 0.99 3.07 0.31 2.72 2.47 0.52 -0.08 119.74 129.73 1bs6 s LYS 1107Ca -0.06 -0.82 0.08 0.00 -1.56 0.00 0.00 55.97 53.61 1bs6 s LYS 1107Cb -0.06 -2.50 -0.06 0.00 -1.46 0.00 0.00 37.83 33.76 1bs6 s LYS 1107CO -0.09 -0.02 -0.09 0.96 0.16 0.00 0.00 175.35 176.28 1bs6 s ILE 1108N 0.84 1.98 -0.05 5.43 -4.36 0.52 -0.01 121.20 125.55 1bs6 s ILE 1108Ca -0.06 -2.18 0.03 0.00 -0.26 0.00 0.00 60.65 58.18 1bs6 s ILE 1108Cb -0.15 -2.52 0.00 0.00 1.25 0.00 0.00 42.46 41.04 1bs6 s ILE 1108CO -0.02 -0.27 -0.15 -0.60 0.24 0.00 0.00 174.94 174.14 1bs6 s ARG 1109N -3.66 1.72 0.36 0.37 3.52 -0.62 -0.92 118.95 119.73 1bs6 s ARG 1109Ca 0.31 -0.53 -0.08 0.00 -0.13 0.00 0.00 55.73 55.30 1bs6 s ARG 1109Cb 0.02 -1.47 0.02 0.00 -1.56 0.00 0.00 34.95 31.97 1bs6 s ARG 1109CO 0.14 0.16 0.60 0.00 -0.81 0.00 0.00 175.30 175.39 1bs6 s ALA 1110N 0.24 0.18 0.02 6.12 0.00 -0.64 -0.13 121.76 127.55 1bs6 s ALA 1110Ca -0.07 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.68 1bs6 s ALA 1110Cb -0.13 0.97 -0.04 0.00 0.00 0.00 0.00 23.12 23.93 1bs6 s ALA 1110CO 0.03 -0.87 0.03 -0.51 0.00 0.00 0.00 175.76 174.44 1bs6 s LEU 1111N -3.17 3.64 0.00 0.00 1.43 0.07 -0.53 118.68 120.12 1bs6 s LEU 1111Ca 0.25 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 1bs6 s LEU 1111Cb -0.02 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 44.04 1bs6 s LEU 1111CO 0.17 0.25 0.00 -0.90 0.23 0.00 0.00 176.35 176.10 1bs6 n ASP 1112N 1.14 0.00 0.24 2.29 5.68 -0.70 -1.12 116.55 124.09 1bs6 n ASP 1112Ca -0.13 -0.95 0.17 0.00 -0.50 0.00 0.00 54.79 53.38 1bs6 n ASP 1112Cb 0.52 0.00 0.84 0.00 -1.14 0.00 0.00 41.12 41.34 1bs6 n ASP 1112CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1bs6 h ARG 1113N 0.00 0.00 -0.55 0.11 2.43 -1.90 0.66 114.38 115.13 1bs6 h ARG 1113Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1bs6 h ARG 1113Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1bs6 h ARG 1113CO 0.00 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.21 1bs6 n ASP 1114N -2.69 3.91 -1.23 -3.80 8.00 -1.26 -4.87 116.55 114.61 1bs6 n ASP 1114Ca -0.01 -2.23 -0.15 0.00 0.71 0.00 0.00 54.79 53.10 1bs6 n ASP 1114Cb 0.11 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.12 40.71 1bs6 n ASP 1114CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bs6 n GLY 1115N 0.95 1.28 3.72 0.44 0.00 0.22 -5.00 105.19 106.80 1bs6 n GLY 1115Ca 0.21 -0.31 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 1bs6 n GLY 1115CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bs6 s LYS 1116N -3.48 4.28 0.37 1.61 -0.14 -1.26 -4.79 119.74 116.34 1bs6 s LYS 1116Ca 0.00 0.27 -0.27 0.00 -1.36 0.00 0.00 55.97 54.62 1bs6 s LYS 1116Cb 0.00 -3.45 -0.09 0.00 -1.68 0.00 0.00 37.83 32.61 1bs6 s LYS 1116CO 0.00 0.16 1.21 -1.25 -0.76 0.00 0.00 175.35 174.70 1bs6 s PRO 1117N 0.67 4.19 0.06 -1.68 0.04 -1.26 -1.72 135.00 135.31 1bs6 s PRO 1117Ca 0.21 1.96 -0.04 0.00 0.04 0.00 0.00 61.00 63.17 1bs6 s PRO 1117Cb -0.14 -2.85 -0.02 0.00 0.04 0.00 0.00 34.50 31.53 1bs6 s PRO 1117CO 0.07 -0.24 0.06 -0.59 0.04 0.00 0.00 177.00 176.35 1bs6 s PHE 1118N -1.30 0.37 0.09 0.56 -0.71 0.31 -4.92 117.98 112.39 1bs6 s PHE 1118Ca 0.53 -0.86 0.06 0.00 -1.04 0.00 0.00 56.93 55.62 1bs6 s PHE 1118Cb -0.34 -0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.18 1bs6 s PHE 1118CO 0.43 -0.44 -0.05 -1.21 -1.34 0.00 0.00 175.22 172.61 1bs6 s GLU 1119N -3.86 2.33 -0.17 1.99 2.02 -1.26 -1.63 118.70 118.13 1bs6 s GLU 1119Ca 0.06 -0.93 -0.04 0.00 0.02 0.00 0.00 54.97 54.08 1bs6 s GLU 1119Cb 0.06 -2.42 0.08 0.00 0.10 0.00 0.00 34.13 31.96 1bs6 s GLU 1119CO -0.10 0.53 0.25 -1.17 0.02 0.00 0.00 175.26 174.78 1bs6 s LEU 1120N -2.22 -0.24 -0.16 1.80 2.96 -0.10 -5.00 118.68 115.72 1bs6 s LEU 1120Ca 0.23 0.22 -0.15 0.00 -0.22 0.00 0.00 54.13 54.21 1bs6 s LEU 1120Cb -0.11 0.58 -0.04 0.00 0.50 0.00 0.00 46.19 47.11 1bs6 s LEU 1120CO 0.15 -0.28 0.36 -1.83 -1.32 0.00 0.00 176.35 173.43 1bs6 s GLU 1121N 2.38 4.26 0.06 1.98 -1.05 -1.26 -0.35 118.70 124.71 1bs6 s GLU 1121Ca 0.05 0.20 0.04 0.00 -0.15 0.00 0.00 54.97 55.11 1bs6 s GLU 1121Cb -0.14 -3.46 -0.03 0.00 -0.44 0.00 0.00 34.13 30.07 1bs6 s GLU 1121CO -0.10 0.15 -0.13 0.00 0.95 0.00 0.00 175.26 176.13 1bs6 s ALA 1122N 0.71 1.03 0.05 -0.84 0.00 0.88 -4.99 121.76 118.60 1bs6 s ALA 1122Ca 0.19 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1bs6 s ALA 1122Cb -0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 1bs6 s ALA 1122CO 0.06 0.14 0.05 -0.40 0.00 0.00 0.00 175.76 175.61 1bs6 n ASP 1123N 1.48 -0.12 0.00 0.00 5.68 -1.26 -2.04 116.55 120.29 1bs6 n ASP 1123Ca -0.21 -1.35 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 1bs6 n ASP 1123Cb 0.54 0.28 0.00 0.00 -1.14 0.00 0.00 41.12 40.80 1bs6 n ASP 1123CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bs6 n GLY 1124N -0.10 1.34 0.32 6.12 0.00 -1.24 -2.58 105.19 109.05 1bs6 n GLY 1124Ca 0.01 -0.60 0.06 0.00 0.00 0.00 0.00 46.02 45.49 1bs6 n GLY 1124CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bs6 h LEU 1125N 0.00 0.65 -0.16 0.99 6.46 -2.00 -2.66 115.31 118.59 1bs6 h LEU 1125Ca 0.00 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.85 1bs6 h LEU 1125Cb 0.00 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1bs6 h LEU 1125CO 0.00 0.32 0.05 0.25 -0.62 0.00 0.00 178.44 178.44 1bs6 h LEU 1126N 0.74 0.05 -0.59 2.25 6.46 -1.93 -1.30 115.31 120.99 1bs6 h LEU 1126Ca 0.45 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 58.29 1bs6 h LEU 1126Cb 0.55 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.45 1bs6 h LEU 1126CO -0.31 0.06 0.31 0.00 -0.62 0.00 0.00 178.44 177.88 1bs6 h ALA 1127N 1.10 0.78 -0.73 1.25 0.00 -1.21 -1.50 119.26 118.95 1bs6 h ALA 1127Ca 0.07 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1bs6 h ALA 1127Cb 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1bs6 h ALA 1127CO -0.08 -0.02 0.35 0.82 0.00 0.00 0.00 179.25 180.32 1bs6 h ILE 1128N 0.59 1.24 -0.25 0.00 2.04 -1.29 -2.82 117.51 117.02 1bs6 h ILE 1128Ca 0.26 -0.68 -0.16 0.00 1.00 0.00 0.00 64.86 65.28 1bs6 h ILE 1128Cb 0.17 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1bs6 h ILE 1128CO -0.17 0.28 -0.48 0.00 0.00 0.00 0.00 178.15 177.78 1bs6 h ILE 1130N 0.52 0.84 -0.15 0.00 2.04 -1.32 -1.20 117.51 118.23 1bs6 h ILE 1130Ca 0.01 -0.25 -0.21 0.00 1.00 0.00 0.00 64.86 65.41 1bs6 h ILE 1130Cb 1.09 0.06 0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1bs6 h ILE 1130CO 0.11 0.13 -0.75 1.56 0.00 0.00 0.00 178.15 179.20 1bs6 h GLN 1131N 0.72 0.73 -0.78 2.37 4.20 -1.18 0.01 115.11 121.18 1bs6 h GLN 1131Ca 0.42 -0.58 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1bs6 h GLN 1131Cb 0.47 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.33 1bs6 h GLN 1131CO -0.29 1.19 0.45 1.25 -0.67 0.00 0.00 178.83 180.76 1bs6 h HIS 1132N 0.51 1.03 0.09 2.96 2.76 -0.86 -2.23 115.15 119.41 1bs6 h HIS 1132Ca -0.04 -0.01 -0.26 0.00 -2.20 0.00 0.00 60.37 57.86 1bs6 h HIS 1132Cb 1.36 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.98 1bs6 h HIS 1132CO 0.08 0.70 -1.24 0.93 -1.30 0.00 0.00 177.93 177.10 1bs6 h GLU 1133N 1.07 0.20 0.00 5.26 4.39 -0.90 -3.16 114.58 121.44 1bs6 h GLU 1133Ca 0.28 -0.34 -0.11 0.00 0.34 0.00 0.00 59.36 59.53 1bs6 h GLU 1133Cb -0.01 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1bs6 h GLU 1133CO -0.05 1.14 -0.50 0.52 -1.16 0.00 0.00 179.01 178.96 1bs6 h MET 1134N 0.05 0.00 -0.27 2.33 2.86 -0.88 -2.33 114.93 116.70 1bs6 h MET 1134Ca -0.12 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.55 1bs6 h MET 1134Cb 1.93 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.56 1bs6 h MET 1134CO 0.18 0.50 0.08 -0.44 1.06 0.00 0.00 176.91 178.30 1bs6 h ASP 1135N 0.00 0.08 -1.07 1.22 3.32 -1.44 -2.39 116.42 116.14 1bs6 h ASP 1135Ca -0.01 0.03 0.29 0.00 0.02 0.00 0.00 57.03 57.37 1bs6 h ASP 1135Cb 0.92 0.03 -0.11 0.00 0.22 0.00 0.00 39.33 40.39 1bs6 h ASP 1135CO 0.07 0.08 0.67 0.45 -1.72 0.00 0.00 179.24 178.78 1bs6 h HIS 1136N 0.20 0.74 0.00 4.55 3.86 -1.38 -0.52 115.15 122.60 1bs6 h HIS 1136Ca 0.12 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1bs6 h HIS 1136Cb 0.10 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.36 1bs6 h HIS 1136CO -0.14 -0.01 0.00 -0.07 0.86 0.00 0.00 177.93 178.57 1bs6 h LEU 1137N 0.38 0.00 -3.21 2.43 3.38 -1.42 0.11 115.31 116.98 1bs6 h LEU 1137Ca 0.66 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.63 1bs6 h LEU 1137Cb 1.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.38 1bs6 h LEU 1137CO -0.39 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.47 1bs6 n VAL 1138N -2.66 2.15 -1.39 1.22 0.24 -0.61 -0.76 118.33 116.51 1bs6 n VAL 1138Ca 0.03 -1.83 -0.05 0.00 -2.04 0.00 0.00 64.34 60.45 1bs6 n VAL 1138Cb 0.38 -0.19 -0.02 0.00 -1.47 0.00 0.00 33.84 32.54 1bs6 n VAL 1138CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bs6 n GLY 1139N -0.49 0.62 3.87 7.63 0.00 0.40 -4.72 105.19 112.50 1bs6 n GLY 1139Ca 0.20 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 45.07 1bs6 n GLY 1139CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bs6 s LYS 1140N -2.91 3.41 0.28 1.61 1.02 -0.30 -4.58 119.74 118.27 1bs6 s LYS 1140Ca 0.00 -0.16 0.09 0.00 0.02 0.00 0.00 55.97 55.93 1bs6 s LYS 1140Cb 0.00 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1bs6 s LYS 1140CO 0.00 0.77 0.00 -0.51 -0.92 0.00 0.00 175.35 174.69 1bs6 s LEU 1141N -1.08 3.16 0.46 3.17 1.43 -1.26 -3.28 118.68 121.28 1bs6 s LEU 1141Ca 0.16 -0.70 0.23 0.00 -1.03 0.00 0.00 54.13 52.78 1bs6 s LEU 1141Cb -0.12 -1.66 1.11 0.00 0.03 0.00 0.00 46.19 45.55 1bs6 s LEU 1141CO 0.05 -0.04 1.94 2.19 0.23 0.00 0.00 176.35 180.71 1bs6 h PHE 1142N 1.87 0.00 0.00 0.29 -5.15 -1.99 -1.77 116.94 110.19 1bs6 h PHE 1142Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1bs6 h PHE 1142Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.42 1bs6 h PHE 1142CO 0.69 0.22 0.00 0.00 -2.00 0.00 0.00 178.31 177.21 1bs6 h MET 1143N 0.00 0.00 0.00 6.09 -0.00 -1.98 -2.12 114.93 116.92 1bs6 h MET 1143Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1bs6 h MET 1143Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.14 1bs6 h MET 1143CO 0.03 0.00 0.00 -0.44 -0.00 0.00 0.00 176.91 176.50 1bs6 h ASP 1144N 0.00 0.00 0.62 -0.10 3.32 -1.73 -2.21 116.42 116.32 1bs6 h ASP 1144Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bs6 h ASP 1144Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1bs6 h ASP 1144CO 0.00 0.00 -0.39 -1.22 -1.72 0.00 0.00 179.24 175.91 1bs6 n TYR 1145N -2.78 0.01 -2.66 4.55 4.01 -0.80 -4.96 117.16 114.54 1bs6 n TYR 1145Ca 0.00 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.53 1bs6 n TYR 1145Cb 0.22 -0.31 0.05 0.00 -0.31 0.00 0.00 39.34 38.99 1bs6 n TYR 1145CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1bs6 s LEU 1146N -3.02 3.24 0.66 7.72 1.43 -0.83 -5.03 118.68 122.85 1bs6 s LEU 1146Ca 0.12 -0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 1bs6 s LEU 1146Cb 0.18 -2.68 0.00 0.00 0.03 0.00 0.00 46.19 43.71 1bs6 s LEU 1146CO 0.66 -1.23 1.11 -0.94 0.23 0.00 0.00 176.35 176.18 1bs6 s SER 1147N -4.48 5.11 0.51 2.29 1.04 -1.26 -4.82 113.70 112.09 1bs6 s SER 1147Ca 0.59 1.99 0.32 0.00 0.48 0.00 0.00 55.95 59.33 1bs6 s SER 1147Cb -0.09 -2.55 1.45 0.00 0.10 0.00 0.00 66.02 64.92 1bs6 s SER 1147CO 0.39 -1.63 1.81 -0.65 0.98 0.00 0.00 173.24 174.14 1bs6 h PRO 1148N 0.01 0.08 0.02 4.02 0.11 -1.97 -0.51 132.00 133.76 1bs6 h PRO 1148Ca -0.47 -0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.39 1bs6 h PRO 1148Cb 1.25 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1bs6 h PRO 1148CO 0.54 0.05 -1.27 1.25 -0.21 0.00 0.00 178.00 178.36 1bs6 h LEU 1149N 0.08 0.08 0.01 2.35 5.85 -1.99 -1.10 115.31 120.59 1bs6 h LEU 1149Ca 0.55 -0.11 -0.27 0.00 0.84 0.00 0.00 57.88 58.90 1bs6 h LEU 1149Cb 2.04 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 43.06 1bs6 h LEU 1149CO -0.07 1.09 -1.13 0.11 -0.34 0.00 0.00 178.44 178.10 1bs6 h LYS 1150N 0.01 0.52 -0.69 1.25 1.79 -1.56 -2.92 116.57 114.98 1bs6 h LYS 1150Ca -0.12 -0.65 -0.07 0.00 -2.18 0.00 0.00 60.65 57.63 1bs6 h LYS 1150Cb 1.88 0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 32.71 1bs6 h LYS 1150CO 0.13 1.27 0.16 1.96 -1.08 0.00 0.00 179.45 181.88 1bs6 h GLN 1151N 0.25 1.10 -0.33 3.15 4.20 -0.97 0.15 115.11 122.67 1bs6 h GLN 1151Ca -0.14 -0.26 -0.14 0.00 0.06 0.00 0.00 58.65 58.17 1bs6 h GLN 1151Cb 1.79 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 29.42 1bs6 h GLN 1151CO 0.21 0.97 -0.33 0.37 -0.67 0.00 0.00 178.83 179.37 1bs6 h GLN 1152N 1.04 0.80 -0.84 1.46 -0.00 -1.31 0.16 115.11 116.43 1bs6 h GLN 1152Ca 0.22 -0.43 0.01 0.00 -0.00 0.00 0.00 58.65 58.45 1bs6 h GLN 1152Cb 0.38 0.02 -0.04 0.00 0.00 0.00 0.00 27.48 27.83 1bs6 h GLN 1152CO 0.00 1.06 0.55 0.00 0.00 0.00 0.00 178.83 180.45 1bs6 h ARG 1153N 0.58 1.09 -0.26 1.69 3.08 -1.34 -1.41 114.38 117.81 1bs6 h ARG 1153Ca 0.05 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1bs6 h ARG 1153Cb 0.92 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1bs6 h ARG 1153CO 0.08 0.72 -0.02 0.82 -1.07 0.00 0.00 179.97 180.50 1bs6 h ILE 1154N 1.12 1.27 0.00 2.04 2.04 -0.37 -3.12 117.51 120.50 1bs6 h ILE 1154Ca 0.31 -0.97 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1bs6 h ILE 1154Cb -0.11 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1bs6 h ILE 1154CO -0.07 0.30 -0.13 -0.09 0.00 0.00 0.00 178.15 178.16 1bs6 h ARG 1155N 0.23 0.00 0.49 2.37 9.65 -0.43 -2.77 114.38 123.92 1bs6 h ARG 1155Ca 0.07 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 1bs6 h ARG 1155Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 1bs6 h ARG 1155CO 0.02 0.13 -0.24 1.96 2.80 0.00 0.00 179.97 184.64 1bs6 h GLN 1156N 0.00 -0.64 -0.69 0.20 1.08 -1.22 -3.34 115.11 110.50 1bs6 h GLN 1156Ca -0.00 0.04 0.15 0.00 -1.45 0.00 0.00 58.65 57.39 1bs6 h GLN 1156Cb 0.35 0.15 -0.12 0.00 -0.05 0.00 0.00 27.48 27.81 1bs6 h GLN 1156CO 0.02 -0.43 0.01 0.87 -0.95 0.00 0.00 178.83 178.35 1bs6 h LYS 1157N -0.89 0.12 -0.57 1.46 1.79 -1.44 -2.28 116.57 114.76 1bs6 h LYS 1157Ca -0.07 -0.01 -0.10 0.00 -2.18 0.00 0.00 60.65 58.29 1bs6 h LYS 1157Cb 0.51 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 1bs6 h LYS 1157CO 0.11 0.08 -0.04 0.28 -1.08 0.00 0.00 179.45 178.80 1bs6 h VAL 1158N 0.12 1.26 -0.59 0.50 2.07 -1.65 -0.88 116.25 117.09 1bs6 h VAL 1158Ca 0.37 -1.18 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 1bs6 h VAL 1158Cb 0.63 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1bs6 h VAL 1158CO -0.60 0.42 0.12 -0.33 0.02 0.00 0.00 177.57 177.21 1bs6 h GLU 1159N 0.92 0.97 0.07 1.57 5.08 -1.52 -0.99 114.58 120.67 1bs6 h GLU 1159Ca 0.16 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1bs6 h GLU 1159Cb 0.59 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1bs6 h GLU 1159CO 0.04 0.90 -0.17 -0.22 -1.00 0.00 0.00 179.01 178.56 1bs6 h LYS 1160N 0.87 -0.30 -0.22 2.33 3.64 -1.35 0.35 116.57 121.89 1bs6 h LYS 1160Ca 0.18 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 1bs6 h LYS 1160Cb 0.38 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.20 1bs6 h LYS 1160CO 0.01 -0.20 -0.36 1.25 -2.27 0.00 0.00 179.45 177.87 1bs6 h LEU 1161N -0.31 -1.16 -1.40 5.20 6.46 -0.76 1.26 115.31 124.60 1bs6 h LEU 1161Ca 0.03 0.17 -0.04 0.00 -0.12 0.00 0.00 57.88 57.92 1bs6 h LEU 1161Cb 0.34 0.50 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1bs6 h LEU 1161CO -0.11 -0.37 -0.19 0.44 -0.62 0.00 0.00 178.44 177.58 1bs6 h ASP 1162N -0.38 0.00 0.29 1.25 3.32 -1.09 -2.45 116.42 117.34 1bs6 h ASP 1162Ca 0.11 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1bs6 h ASP 1162Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1bs6 h ASP 1162CO -0.43 0.19 -0.14 -0.09 -1.72 0.00 0.00 179.24 177.05 1bs6 h ARG 1163N 0.00 -0.37 -1.64 3.56 2.43 0.31 -2.95 114.38 115.73 1bs6 h ARG 1163Ca -0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1bs6 h ARG 1163Cb 0.60 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1bs6 h ARG 1163CO 0.03 -0.25 0.00 1.28 -1.51 0.00 0.00 179.97 179.52 1bs6 n LEU 1164N -3.44 1.40 -0.31 3.80 7.99 0.40 -0.39 117.00 126.45 1bs6 n LEU 1164Ca -0.05 -0.68 0.00 0.00 -0.01 0.00 0.00 56.01 55.27 1bs6 n LEU 1164Cb 0.15 -0.25 0.00 0.00 -0.11 0.00 0.00 43.42 43.22 1bs6 n LEU 1164CO 0.11 0.24 0.26 0.29 -1.51 0.00 0.00 177.39 176.78 1bs6 n LYS 1165N 0.93 0.04 -0.54 3.23 5.02 -0.95 -4.95 118.16 120.94 1bs6 n LYS 1165Ca 0.00 -0.85 -0.06 0.00 -2.02 0.00 0.00 58.31 55.39 1bs6 n LYS 1165Cb 0.21 -0.52 0.13 0.00 -0.02 0.00 0.00 35.03 34.84 1bs6 n LYS 1165CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bs6 n ALA 1166N -0.02 3.70 -2.63 7.82 0.00 0.48 -4.89 120.51 124.97 1bs6 n ALA 1166Ca 0.00 -1.24 -0.43 0.00 0.00 0.00 0.00 53.44 51.78 1bs6 n ALA 1166Cb 0.62 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 1bs6 n ALA 1166CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1bs6 s ARG 1167N -1.72 4.00 0.00 0.00 1.81 -1.26 -5.12 118.95 116.66 1bs6 s ARG 1167Ca 0.28 0.90 0.13 0.00 -1.72 0.00 0.00 55.73 55.31 1bs6 s ARG 1167Cb 0.22 -3.75 0.78 0.00 -0.45 0.00 0.00 34.95 31.75 1bs6 s ARG 1167CO 0.06 -0.89 1.20 0.00 -0.68 0.00 0.00 175.30 175.00