#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n82 s LEU 1005N 0.00 2.75 0.37 2.46 1.43 -1.26 -4.98 118.68 119.45 1n82 s LEU 1005Ca 0.00 1.97 -0.28 0.00 -1.03 0.00 0.00 54.13 54.79 1n82 s LEU 1005Cb 0.00 -4.43 -0.11 0.00 0.03 0.00 0.00 46.19 41.67 1n82 s LEU 1005CO 0.00 -2.76 1.42 -2.65 0.23 0.00 0.00 176.35 172.59 1n82 n PRO 1006N -4.00 2.49 -2.95 1.29 -0.02 -1.26 -4.97 135.00 125.58 1n82 n PRO 1006Ca 0.10 0.87 -0.41 0.00 -2.02 0.00 0.00 63.50 62.04 1n82 n PRO 1006Cb 0.53 -2.56 -0.04 0.00 -0.02 0.00 0.00 33.50 31.41 1n82 n PRO 1006CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n82 s SER 1007N -0.19 6.95 0.21 2.55 0.15 -1.26 -4.97 113.70 117.13 1n82 s SER 1007Ca 0.54 1.16 -0.10 0.00 0.70 0.00 0.00 55.95 58.25 1n82 s SER 1007Cb -0.51 -2.43 0.27 0.00 -1.71 0.00 0.00 66.02 61.64 1n82 s SER 1007CO 0.63 -0.30 1.72 -0.07 1.20 0.00 0.00 173.24 176.43 1n82 h LEU 1008N 7.81 0.10 -1.87 3.45 3.38 -1.80 0.19 115.31 126.57 1n82 h LEU 1008Ca -0.33 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1n82 h LEU 1008Cb 1.15 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 1n82 h LEU 1008CO 0.80 0.06 0.01 0.08 0.09 0.00 0.00 178.44 179.48 1n82 h ARG 1009N 0.32 0.08 0.06 1.13 0.11 -1.26 -2.04 114.38 112.78 1n82 h ARG 1009Ca 0.30 -0.01 -0.21 0.00 0.10 0.00 0.00 59.98 60.16 1n82 h ARG 1009Cb 0.41 -0.02 0.02 0.00 1.11 0.00 0.00 29.97 31.49 1n82 h ARG 1009CO -0.35 0.09 -0.87 -0.44 0.10 0.00 0.00 179.97 178.50 1n82 h ASP 1010N 0.08 0.66 -0.91 0.08 3.32 -1.32 -1.97 116.42 116.36 1n82 h ASP 1010Ca 0.02 -0.82 0.06 0.00 0.02 0.00 0.00 57.03 56.32 1n82 h ASP 1010Cb 0.05 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.34 1n82 h ASP 1010CO -0.00 1.40 0.59 0.58 -1.72 0.00 0.00 179.24 180.09 1n82 h VAL 1011N -0.00 1.07 -0.58 -1.35 2.07 -0.71 -2.15 116.25 114.60 1n82 h VAL 1011Ca -0.13 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 66.92 1n82 h VAL 1011Cb 1.59 -0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.24 1n82 h VAL 1011CO 0.17 0.19 0.12 0.49 0.02 0.00 0.00 177.57 178.56 1n82 n PHE 1012N -4.49 1.99 -0.06 1.57 3.72 -0.80 -4.69 117.46 114.71 1n82 n PHE 1012Ca 0.14 -1.04 0.06 0.00 -0.05 0.00 0.00 57.45 56.55 1n82 n PHE 1012Cb 0.19 -0.56 0.42 0.00 -0.94 0.00 0.00 39.48 38.59 1n82 n PHE 1012CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1n82 h ALA 1013N 2.77 1.76 -0.09 4.37 0.00 -0.65 0.05 119.26 127.47 1n82 h ALA 1013Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1n82 h ALA 1013Cb 2.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1n82 h ALA 1013CO 0.56 0.18 0.00 0.09 0.00 0.00 0.00 179.25 180.07 1n82 n ASN 1014N -4.47 1.73 -0.01 0.00 5.03 -1.26 -4.51 115.26 111.77 1n82 n ASN 1014Ca 0.06 -1.63 -0.04 0.00 0.87 0.00 0.00 54.58 53.84 1n82 n ASN 1014Cb 0.15 -0.05 -0.01 0.00 -1.02 0.00 0.00 39.78 38.85 1n82 n ASN 1014CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1n82 n ASP 1015N 0.36 0.63 -3.55 6.41 8.00 -0.07 -5.04 116.55 123.28 1n82 n ASP 1015Ca 0.18 0.09 -0.08 0.00 0.71 0.00 0.00 54.79 55.69 1n82 n ASP 1015Cb 0.37 -0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 1n82 n ASP 1015CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1n82 s PHE 1016N -2.10 -0.29 0.80 1.24 -0.12 -0.74 -4.64 117.98 112.13 1n82 s PHE 1016Ca -0.06 0.30 -0.14 0.00 -0.05 0.00 0.00 56.93 56.98 1n82 s PHE 1016Cb 0.02 0.51 0.08 0.00 -0.63 0.00 0.00 43.02 42.99 1n82 s PHE 1016CO 0.08 -0.38 1.22 1.03 -0.05 0.00 0.00 175.22 177.11 1n82 s ARG 1017N -2.28 1.68 -0.16 1.99 0.52 -0.70 -4.58 118.95 115.41 1n82 s ARG 1017Ca 0.04 1.80 0.01 0.00 -0.52 0.00 0.00 55.73 57.06 1n82 s ARG 1017Cb -0.01 -1.78 0.02 0.00 0.52 0.00 0.00 34.95 33.70 1n82 s ARG 1017CO -0.05 -2.19 -0.20 0.42 0.02 0.00 0.00 175.30 173.30 1n82 s ILE 1018N -2.07 2.01 0.41 1.52 -1.09 -1.26 -0.64 121.20 120.08 1n82 s ILE 1018Ca 0.74 -0.92 0.07 0.00 -2.23 0.00 0.00 60.65 58.31 1n82 s ILE 1018Cb -0.30 -1.80 -0.08 0.00 -1.58 0.00 0.00 42.46 38.70 1n82 s ILE 1018CO 0.50 0.53 0.01 -0.83 -1.23 0.00 0.00 174.94 173.93 1n82 s GLY 1019N 1.14 2.52 -0.02 6.18 0.00 0.25 -0.88 107.32 116.51 1n82 s GLY 1019Ca 0.01 -2.24 -0.02 0.00 0.00 0.00 0.00 44.72 42.47 1n82 s GLY 1019CO -0.09 -2.10 0.06 0.00 0.00 0.00 0.00 173.10 170.97 1n82 s ALA 1020N -2.71 -0.14 0.22 3.20 0.00 -0.90 -1.46 121.76 119.97 1n82 s ALA 1020Ca 0.34 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 1n82 s ALA 1020Cb 0.10 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 23.03 1n82 s ALA 1020CO 0.18 -0.03 1.23 0.00 0.00 0.00 0.00 175.76 177.14 1n82 s ALA 1021N 0.05 3.47 0.13 0.00 0.00 -0.63 -1.59 121.76 123.20 1n82 s ALA 1021Ca -0.00 1.03 -0.04 0.00 0.00 0.00 0.00 51.96 52.95 1n82 s ALA 1021Cb -0.01 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1n82 s ALA 1021CO 0.00 -0.43 0.14 0.14 0.00 0.00 0.00 175.76 175.61 1n82 s VAL 1022N -0.27 0.10 0.29 0.00 -7.23 -0.15 -3.97 120.40 109.18 1n82 s VAL 1022Ca 0.52 -1.67 0.02 0.00 -1.81 0.00 0.00 61.98 59.04 1n82 s VAL 1022Cb -0.35 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 1n82 s VAL 1022CO 0.40 -0.46 0.13 0.54 -0.31 0.00 0.00 175.10 175.39 1n82 s ASN 1023N -3.00 1.50 0.53 4.85 6.03 -1.26 -0.97 114.94 122.61 1n82 s ASN 1023Ca 0.19 -1.49 0.21 0.00 -1.03 0.00 0.00 52.86 50.74 1n82 s ASN 1023Cb 0.06 0.28 1.33 0.00 -3.03 0.00 0.00 41.25 39.90 1n82 s ASN 1023CO -0.01 -0.81 2.07 -0.65 -2.03 0.00 0.00 177.10 175.67 1n82 h PRO 1024N 2.25 0.00 -0.18 3.55 0.11 -1.96 -1.06 132.00 134.70 1n82 h PRO 1024Ca -0.36 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.60 1n82 h PRO 1024Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1n82 h PRO 1024CO 0.57 0.00 -0.49 0.28 -0.21 0.00 0.00 178.00 178.15 1n82 h VAL 1025N 0.00 1.32 0.00 3.15 2.07 -2.00 -3.09 116.25 117.70 1n82 h VAL 1025Ca 0.13 -1.73 -0.04 0.00 0.82 0.00 0.00 66.70 65.88 1n82 h VAL 1025Cb 0.51 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1n82 h VAL 1025CO -0.00 0.54 -0.18 0.71 0.02 0.00 0.00 177.57 178.65 1n82 h THR 1026N 0.34 0.38 -0.64 2.57 1.35 -1.84 -0.69 112.91 114.39 1n82 h THR 1026Ca -0.01 -1.18 -0.06 0.00 -0.55 0.00 0.00 66.41 64.61 1n82 h THR 1026Cb 1.11 1.89 -0.03 0.00 -1.73 0.00 0.00 68.15 69.39 1n82 h THR 1026CO 0.11 0.18 0.17 0.40 -0.25 0.00 0.00 175.52 176.13 1n82 h ILE 1027N 0.00 1.24 -0.08 6.82 2.04 -1.23 0.22 117.51 126.52 1n82 h ILE 1027Ca -0.00 -0.88 -0.18 0.00 1.00 0.00 0.00 64.86 64.80 1n82 h ILE 1027Cb 0.88 0.57 0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1n82 h ILE 1027CO 0.02 0.33 -0.67 -0.33 0.00 0.00 0.00 178.15 177.51 1n82 h GLU 1028N 0.95 0.60 0.00 2.37 4.39 -1.36 -1.57 114.58 119.96 1n82 h GLU 1028Ca 0.21 -0.53 -0.09 0.00 0.34 0.00 0.00 59.36 59.29 1n82 h GLU 1028Cb 0.31 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1n82 h GLU 1028CO -0.00 1.15 -0.41 1.98 -1.16 0.00 0.00 179.01 180.57 1n82 h MET 1029N 0.23 0.00 0.00 2.33 4.05 -0.94 -3.24 114.93 117.37 1n82 h MET 1029Ca -0.06 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1n82 h MET 1029Cb 1.32 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1n82 h MET 1029CO 0.14 0.41 -0.16 1.04 0.23 0.00 0.00 176.91 178.57 1n82 n GLN 1030N -3.66 1.37 -0.24 0.39 6.02 0.74 -4.87 117.38 117.13 1n82 n GLN 1030Ca -0.01 -2.80 -0.01 0.00 -0.01 0.00 0.00 57.00 54.18 1n82 n GLN 1030Cb 0.50 -1.53 0.11 0.00 1.02 0.00 0.00 30.24 30.35 1n82 n GLN 1030CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1n82 h LYS 1031N 0.31 0.68 -0.17 -1.09 3.64 -1.31 -1.44 116.57 117.19 1n82 h LYS 1031Ca -0.00 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.18 1n82 h LYS 1031Cb 1.00 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1n82 h LYS 1031CO 0.00 0.45 -0.56 0.37 -2.27 0.00 0.00 179.45 177.44 1n82 h GLN 1032N 0.70 0.51 -0.51 1.90 5.75 -1.88 -0.29 115.11 121.28 1n82 h GLN 1032Ca 0.32 -0.32 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 1n82 h GLN 1032Cb 0.22 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 1n82 h GLN 1032CO -0.20 0.93 0.24 -0.07 -2.65 0.00 0.00 178.83 177.08 1n82 h LEU 1033N 0.39 0.68 0.06 -2.39 3.38 -1.78 0.11 115.31 115.75 1n82 h LEU 1033Ca 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1n82 h LEU 1033Cb 1.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1n82 h LEU 1033CO 0.10 0.62 -0.07 -0.07 0.09 0.00 0.00 178.44 179.12 1n82 h LEU 1034N 0.68 -0.18 -1.19 1.67 3.38 -0.98 -1.38 115.31 117.31 1n82 h LEU 1034Ca 0.18 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.18 1n82 h LEU 1034Cb 0.13 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1n82 h LEU 1034CO -0.02 -0.11 0.55 0.40 0.09 0.00 0.00 178.44 179.35 1n82 h ILE 1035N -0.15 1.19 0.00 1.22 2.04 -0.85 -1.50 117.51 119.47 1n82 h ILE 1035Ca 0.01 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.40 1n82 h ILE 1035Cb 0.15 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1n82 h ILE 1035CO -0.02 0.20 -0.42 0.44 0.00 0.00 0.00 178.15 178.35 1n82 h ASP 1036N 1.10 0.00 0.00 1.72 3.32 -0.51 -3.41 116.42 118.64 1n82 h ASP 1036Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1n82 h ASP 1036Cb -0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1n82 h ASP 1036CO -0.08 0.42 -0.99 1.41 -1.72 0.00 0.00 179.24 178.28 1n82 n HIS 1037N -3.38 0.00 -4.12 4.55 8.25 -0.54 -4.53 115.22 115.43 1n82 n HIS 1037Ca 0.01 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.22 1n82 n HIS 1037Cb 0.60 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.65 1n82 n HIS 1037CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1n82 s VAL 1038N -1.99 4.29 -0.11 1.59 -7.23 -0.61 -0.76 120.40 115.57 1n82 s VAL 1038Ca 0.00 -1.28 0.14 0.00 -1.81 0.00 0.00 61.98 59.03 1n82 s VAL 1038Cb 0.00 -3.22 0.29 0.00 0.56 0.00 0.00 36.38 34.00 1n82 s VAL 1038CO 0.00 -0.19 1.14 -0.46 -0.31 0.00 0.00 175.10 175.28 1n82 n ASN 1039N -0.57 1.54 -3.67 4.85 0.23 -0.06 -4.85 115.26 112.73 1n82 n ASN 1039Ca -0.08 -2.96 -0.15 0.00 -0.53 0.00 0.00 54.58 50.86 1n82 n ASN 1039Cb 0.56 -0.40 -0.08 0.00 -2.08 0.00 0.00 39.78 37.78 1n82 n ASN 1039CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1n82 s SER 1040N -2.50 -0.43 -0.00 0.53 0.15 -1.07 -0.95 113.70 109.44 1n82 s SER 1040Ca 0.28 0.55 0.03 0.00 0.70 0.00 0.00 55.95 57.50 1n82 s SER 1040Cb 0.27 0.59 -0.01 0.00 -1.71 0.00 0.00 66.02 65.16 1n82 s SER 1040CO -0.03 -0.41 -0.08 -0.63 1.20 0.00 0.00 173.24 173.29 1n82 s ILE 1041N -0.80 0.66 -0.03 6.45 -1.09 -0.02 -2.11 121.20 124.26 1n82 s ILE 1041Ca -0.09 -0.42 0.07 0.00 -2.23 0.00 0.00 60.65 57.98 1n82 s ILE 1041Cb -0.03 -0.56 -0.02 0.00 -1.58 0.00 0.00 42.46 40.27 1n82 s ILE 1041CO 0.05 0.14 -0.23 -0.89 -1.23 0.00 0.00 174.94 172.78 1n82 s THR 1042N -0.29 1.83 -0.10 2.92 2.01 -0.62 -1.20 115.64 120.19 1n82 s THR 1042Ca 0.02 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 60.75 1n82 s THR 1042Cb -0.04 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 1n82 s THR 1042CO -0.00 0.52 1.27 0.00 -0.69 0.00 0.00 174.62 175.71 1n82 s ALA 1043N -0.44 3.58 0.26 7.40 0.00 -1.26 -0.97 121.76 130.32 1n82 s ALA 1043Ca 0.06 0.59 -0.04 0.00 0.00 0.00 0.00 51.96 52.57 1n82 s ALA 1043Cb -0.10 -3.58 0.35 0.00 0.00 0.00 0.00 23.12 19.79 1n82 s ALA 1043CO -0.00 -0.98 1.89 1.49 0.00 0.00 0.00 175.76 178.16 1n82 h GLU 1044N 7.90 1.17 0.00 0.00 4.81 -1.39 -3.40 114.58 123.67 1n82 h GLU 1044Ca -0.31 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1n82 h GLU 1044Cb 1.14 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.26 1n82 h GLU 1044CO 0.92 0.77 -0.11 0.09 -0.73 0.00 0.00 179.01 179.96 1n82 n ASN 1045N -4.48 0.55 -0.26 1.04 3.02 -1.26 -4.95 115.26 108.92 1n82 n ASN 1045Ca 0.14 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.77 1n82 n ASN 1045Cb 0.13 0.06 0.38 0.00 -0.61 0.00 0.00 39.78 39.74 1n82 n ASN 1045CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1n82 n HIS 1046N -0.60 0.12 -0.52 3.10 8.25 -1.26 -1.66 115.22 122.66 1n82 n HIS 1046Ca 0.00 -0.06 0.06 0.00 -0.26 0.00 0.00 57.72 57.46 1n82 n HIS 1046Cb 0.05 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.32 1n82 n HIS 1046CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1n82 n MET 1047N -0.22 2.71 -1.73 -0.41 2.81 -1.25 -4.31 117.12 114.72 1n82 n MET 1047Ca 0.13 -2.27 -0.31 0.00 -1.81 0.00 0.00 57.70 53.43 1n82 n MET 1047Cb 0.17 -1.43 0.03 0.00 -0.71 0.00 0.00 33.22 31.28 1n82 n MET 1047CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1n82 s LYS 1048N -1.81 3.24 0.19 0.03 1.02 -0.67 -2.98 119.74 118.77 1n82 s LYS 1048Ca 0.26 0.88 -0.12 0.00 0.02 0.00 0.00 55.97 57.02 1n82 s LYS 1048Cb 0.19 -2.03 0.19 0.00 -0.52 0.00 0.00 37.83 35.66 1n82 s LYS 1048CO 0.09 -0.86 1.77 0.35 -0.92 0.00 0.00 175.35 175.79 1n82 h PHE 1049N -0.47 0.44 0.00 3.18 3.04 -1.70 -0.46 116.94 120.96 1n82 h PHE 1049Ca -0.44 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.53 1n82 h PHE 1049Cb 1.20 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.60 1n82 h PHE 1049CO 0.63 0.18 0.00 1.05 -2.02 0.00 0.00 178.31 178.15 1n82 h GLU 1050N 0.46 0.00 -0.01 1.11 4.11 -1.48 0.12 114.58 118.90 1n82 h GLU 1050Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.68 1n82 h GLU 1050Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1n82 h GLU 1050CO -0.21 0.00 -0.60 0.72 0.07 0.00 0.00 179.01 178.98 1n82 n HIS 1051N -2.82 0.00 -0.06 2.06 8.25 -0.24 -3.83 115.22 118.58 1n82 n HIS 1051Ca -0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 1n82 n HIS 1051Cb 0.19 -0.09 -0.07 0.00 1.12 0.00 0.00 29.99 31.15 1n82 n HIS 1051CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1n82 n LEU 1052N -0.99 1.73 -3.23 2.41 4.77 -0.64 -4.55 117.00 116.50 1n82 n LEU 1052Ca 0.07 -0.04 -0.24 0.00 -0.03 0.00 0.00 56.01 55.77 1n82 n LEU 1052Cb 0.37 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.22 1n82 n LEU 1052CO 0.34 0.53 -0.22 1.67 -1.33 0.00 0.00 177.39 178.38 1n82 n GLN 1053N -2.68 1.11 0.26 3.23 7.27 -0.06 -0.99 117.38 125.52 1n82 n GLN 1053Ca -0.21 -3.54 0.11 0.00 0.07 0.00 0.00 57.00 53.43 1n82 n GLN 1053Cb 0.79 -1.45 0.70 0.00 2.41 0.00 0.00 30.24 32.69 1n82 n GLN 1053CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 1n82 h PRO 1054N 3.99 0.00 -4.82 3.69 0.13 -1.65 -3.42 132.00 129.92 1n82 h PRO 1054Ca 0.10 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.92 1n82 h PRO 1054Cb 0.83 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.77 1n82 h PRO 1054CO 0.54 0.10 -0.74 -1.21 -0.23 0.00 0.00 178.00 176.47 1n82 s GLU 1055N -4.48 0.70 0.14 0.86 2.02 -1.26 -4.90 118.70 111.78 1n82 s GLU 1055Ca -0.04 -0.96 -0.31 0.00 0.02 0.00 0.00 54.97 53.68 1n82 s GLU 1055Cb 0.15 -0.44 -0.11 0.00 0.10 0.00 0.00 34.13 33.83 1n82 s GLU 1055CO 0.61 0.07 1.81 -2.00 0.02 0.00 0.00 175.26 175.77 1n82 s GLU 1056N -2.18 4.14 0.00 1.61 2.12 -1.26 -1.42 118.70 121.71 1n82 s GLU 1056Ca -0.02 2.59 0.00 0.00 0.36 0.00 0.00 54.97 57.90 1n82 s GLU 1056Cb -0.06 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.83 1n82 s GLU 1056CO 0.00 -0.82 0.00 0.41 -0.54 0.00 0.00 175.26 174.31 1n82 n GLY 1057N 4.18 1.38 3.26 -1.50 0.00 -1.26 -4.99 105.19 106.27 1n82 n GLY 1057Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1n82 n GLY 1057CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n82 s LYS 1058N -0.33 2.61 -0.17 1.61 2.20 -0.50 -5.07 119.74 120.09 1n82 s LYS 1058Ca 0.00 -1.54 -0.11 0.00 -0.36 0.00 0.00 55.97 53.95 1n82 s LYS 1058Cb 0.00 -3.87 -0.05 0.00 -1.51 0.00 0.00 37.83 32.40 1n82 s LYS 1058CO 0.00 -1.04 0.20 -0.06 -0.36 0.00 0.00 175.35 174.09 1n82 s PHE 1059N 1.43 3.46 -0.68 4.03 0.08 -1.26 -3.25 117.98 121.79 1n82 s PHE 1059Ca 0.04 0.47 0.05 0.00 0.12 0.00 0.00 56.93 57.60 1n82 s PHE 1059Cb -0.24 -2.21 0.18 0.00 -0.57 0.00 0.00 43.02 40.17 1n82 s PHE 1059CO 0.02 0.32 0.51 0.25 -0.10 0.00 0.00 175.22 176.21 1n82 n THR 1060N 3.35 1.45 1.79 0.64 -2.24 -0.16 -4.93 114.28 114.18 1n82 n THR 1060Ca -0.15 -4.77 0.12 0.00 -2.27 0.00 0.00 64.05 56.98 1n82 n THR 1060Cb 0.52 -2.13 0.62 0.00 -2.10 0.00 0.00 70.33 67.23 1n82 n THR 1060CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1n82 n PHE 1061N 1.93 0.04 -0.14 4.78 3.72 -1.26 -4.48 117.46 122.04 1n82 n PHE 1061Ca 0.22 -0.02 -0.08 0.00 -0.05 0.00 0.00 57.45 57.52 1n82 n PHE 1061Cb 0.37 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.91 1n82 n PHE 1061CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1n82 h GLN 1062N 0.71 0.58 -0.28 -1.08 7.50 -1.92 0.16 115.11 120.78 1n82 h GLN 1062Ca 0.00 -0.04 -0.16 0.00 0.50 0.00 0.00 58.65 58.95 1n82 h GLN 1062Cb 0.15 -0.13 -0.00 0.00 0.05 0.00 0.00 27.48 27.55 1n82 h GLN 1062CO 0.00 0.40 -0.44 0.93 -1.50 0.00 0.00 178.83 178.23 1n82 h GLU 1063N 0.59 0.80 -0.83 1.46 4.39 -1.92 -2.31 114.58 116.76 1n82 h GLU 1063Ca 0.16 -0.48 0.01 0.00 0.34 0.00 0.00 59.36 59.39 1n82 h GLU 1063Cb -0.04 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.61 1n82 h GLU 1063CO -0.03 1.11 0.54 0.00 -1.16 0.00 0.00 179.01 179.47 1n82 h ALA 1064N 0.68 1.05 -0.73 3.43 0.00 -1.68 -1.84 119.26 120.16 1n82 h ALA 1064Ca 0.03 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1n82 h ALA 1064Cb 1.03 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1n82 h ALA 1064CO 0.10 0.47 0.44 -0.44 0.00 0.00 0.00 179.25 179.83 1n82 h ASP 1065N 1.13 0.69 -0.75 0.00 3.32 -0.55 -0.28 116.42 119.98 1n82 h ASP 1065Ca 0.30 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.34 1n82 h ASP 1065Cb -0.11 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1n82 h ASP 1065CO -0.06 0.45 0.36 0.03 -1.72 0.00 0.00 179.24 178.30 1n82 h ARG 1066N 0.82 1.08 -0.41 3.56 3.08 -0.97 0.16 114.38 121.70 1n82 h ARG 1066Ca 0.32 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 60.11 1n82 h ARG 1066Cb 0.13 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1n82 h ARG 1066CO -0.16 0.84 -0.14 0.82 -1.07 0.00 0.00 179.97 180.26 1n82 h ILE 1067N 1.05 1.28 -0.59 2.04 2.04 -0.68 -1.64 117.51 121.01 1n82 h ILE 1067Ca 0.26 -1.26 -0.07 0.00 1.00 0.00 0.00 64.86 64.78 1n82 h ILE 1067Cb 0.11 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1n82 h ILE 1067CO -0.03 0.42 0.10 0.58 0.00 0.00 0.00 178.15 179.22 1n82 h VAL 1068N 0.63 1.26 -0.62 1.67 2.07 -0.85 -1.86 116.25 118.54 1n82 h VAL 1068Ca 0.10 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1n82 h VAL 1068Cb 0.69 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1n82 h VAL 1068CO 0.05 0.36 0.30 0.44 0.02 0.00 0.00 177.57 178.74 1n82 h ASP 1069N 0.88 0.82 -0.18 0.57 3.32 -0.59 0.10 116.42 121.34 1n82 h ASP 1069Ca 0.18 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 57.14 1n82 h ASP 1069Cb 0.42 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1n82 h ASP 1069CO 0.01 0.72 -0.05 0.15 -1.72 0.00 0.00 179.24 178.35 1n82 h PHE 1070N 0.86 -0.11 -0.01 4.55 3.57 -1.12 0.22 116.94 124.90 1n82 h PHE 1070Ca 0.21 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1n82 h PHE 1070Cb 0.12 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1n82 h PHE 1070CO 0.00 -0.08 -0.02 0.00 -2.23 0.00 0.00 178.31 175.98 1n82 h ALA 1071N 1.17 -0.00 -0.01 2.41 0.00 -0.98 -2.40 119.26 119.44 1n82 h ALA 1071Ca 0.09 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1n82 h ALA 1071Cb 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1n82 h ALA 1071CO -0.19 -0.51 -0.32 0.00 0.00 0.00 0.00 179.25 178.23 1n82 n SER 1073N -4.15 0.65 -0.35 0.00 3.41 0.05 -3.06 113.62 110.17 1n82 n SER 1073Ca -0.02 0.64 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 1n82 n SER 1073Cb 0.37 -0.78 0.15 0.00 -0.26 0.00 0.00 64.21 63.69 1n82 n SER 1073CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1n82 n HIS 1074N -2.19 0.00 -3.26 7.33 -0.00 -0.54 -4.99 115.22 111.58 1n82 n HIS 1074Ca 0.03 -1.10 -0.23 0.00 -0.00 0.00 0.00 57.72 56.42 1n82 n HIS 1074Cb 0.27 -0.18 0.05 0.00 -0.00 0.00 0.00 29.99 30.13 1n82 n HIS 1074CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.34 179.23 1n82 n ARG 1075N -1.15 -5.97 -4.22 -0.41 -4.01 -0.91 -4.97 116.66 95.02 1n82 n ARG 1075Ca 0.16 0.87 -0.35 0.00 -1.04 0.00 0.00 57.85 57.48 1n82 n ARG 1075Cb 0.68 -5.80 -0.09 0.00 -3.04 0.00 0.00 32.46 24.22 1n82 n ARG 1075CO 0.00 0.00 0.00 -1.64 -3.04 0.00 0.00 177.63 172.95 1n82 s MET 1076N -5.95 3.28 0.94 2.89 1.00 -0.21 -4.89 119.30 116.36 1n82 s MET 1076Ca 0.42 -0.35 -0.12 0.00 0.00 0.00 0.00 55.69 55.64 1n82 s MET 1076Cb -0.19 -2.95 0.16 0.00 0.00 0.00 0.00 34.83 31.85 1n82 s MET 1076CO 0.52 0.62 1.10 0.00 0.00 0.00 0.00 175.02 177.25 1n82 s ALA 1077N -0.63 1.33 -0.05 3.03 0.00 -0.12 -4.28 121.76 121.04 1n82 s ALA 1077Ca 0.11 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 51.78 1n82 s ALA 1077Cb -0.12 -3.12 0.01 0.00 0.00 0.00 0.00 23.12 19.90 1n82 s ALA 1077CO 0.02 -2.55 -0.09 0.08 0.00 0.00 0.00 175.76 173.23 1n82 s VAL 1078N -3.03 0.85 -0.20 0.00 1.01 -1.26 -0.84 120.40 116.94 1n82 s VAL 1078Ca 0.64 -0.34 -0.14 0.00 0.00 0.00 0.00 61.98 62.15 1n82 s VAL 1078Cb -0.17 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1n82 s VAL 1078CO 0.56 0.29 0.30 -0.13 0.00 0.00 0.00 175.10 176.12 1n82 s ARG 1079N 0.62 4.18 -0.05 2.72 0.52 -0.34 -2.50 118.95 124.10 1n82 s ARG 1079Ca -0.11 0.04 -0.29 0.00 -0.52 0.00 0.00 55.73 54.85 1n82 s ARG 1079Cb -0.14 -3.50 -0.02 0.00 0.52 0.00 0.00 34.95 31.81 1n82 s ARG 1079CO 0.02 0.09 0.95 0.20 0.02 0.00 0.00 175.30 176.58 1n82 s GLY 1080N 0.84 2.66 -0.09 -3.53 0.00 0.33 -4.23 107.32 103.30 1n82 s GLY 1080Ca 0.15 0.42 -0.03 0.00 0.00 0.00 0.00 44.72 45.26 1n82 s GLY 1080CO 0.05 1.71 0.08 -1.58 0.00 0.00 0.00 173.10 173.36 1n82 s HIS 1081N 1.36 0.09 -0.02 1.90 5.04 -1.26 -0.53 115.29 121.88 1n82 s HIS 1081Ca 0.49 0.06 -0.16 0.00 -1.54 0.00 0.00 55.06 53.91 1n82 s HIS 1081Cb -0.20 -0.55 0.03 0.00 0.04 0.00 0.00 32.58 31.90 1n82 s HIS 1081CO 0.23 -0.32 0.33 -0.08 -2.34 0.00 0.00 174.74 172.56 1n82 s THR 1082N 2.17 0.05 -0.16 0.89 -1.32 -1.16 -3.39 115.64 112.73 1n82 s THR 1082Ca 0.04 -0.45 -0.19 0.00 -1.21 0.00 0.00 61.69 59.88 1n82 s THR 1082Cb -0.14 -0.63 -0.16 0.00 -1.51 0.00 0.00 72.50 70.06 1n82 s THR 1082CO -0.06 -0.25 0.33 -0.07 -2.21 0.00 0.00 174.62 172.37 1n82 h LEU 1083N 3.83 0.00 -7.64 9.08 3.38 -1.44 -3.36 115.31 119.16 1n82 h LEU 1083Ca -0.29 -0.54 -0.61 0.00 0.09 0.00 0.00 57.88 56.53 1n82 h LEU 1083Cb 1.17 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.54 1n82 h LEU 1083CO 0.40 1.04 -0.79 -0.69 0.09 0.00 0.00 178.44 178.50 1n82 s VAL 1084N -2.16 1.53 -0.05 1.22 1.01 -0.05 -4.69 120.40 117.21 1n82 s VAL 1084Ca -0.19 -1.21 -0.07 0.00 0.00 0.00 0.00 61.98 60.52 1n82 s VAL 1084Cb 0.01 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.62 1n82 s VAL 1084CO 0.48 -0.09 0.17 0.86 0.00 0.00 0.00 175.10 176.52 1n82 s TRP 1085N 1.40 -0.13 0.21 5.22 -0.00 -1.26 -1.56 118.94 122.82 1n82 s TRP 1085Ca -0.06 0.30 0.27 0.00 -0.00 0.00 0.00 56.10 56.61 1n82 s TRP 1085Cb -0.19 0.03 1.16 0.00 -0.00 0.00 0.00 33.47 34.48 1n82 s TRP 1085CO -0.06 -0.16 1.93 1.12 -0.00 0.00 0.00 176.95 179.77 1n82 h HIS 1086N 5.33 0.00 -2.86 5.86 2.07 -1.91 -3.43 115.15 120.22 1n82 h HIS 1086Ca -0.27 0.00 -0.47 0.00 -2.85 0.00 0.00 60.37 56.78 1n82 h HIS 1086Cb 1.20 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.20 1n82 h HIS 1086CO 0.46 0.16 -0.11 -0.80 -3.07 0.00 0.00 177.93 174.57 1n82 s ASN 1087N -6.07 6.06 -1.61 3.10 0.01 -1.26 -4.48 114.94 110.69 1n82 s ASN 1087Ca -0.00 0.42 -0.16 0.00 -0.71 0.00 0.00 52.86 52.41 1n82 s ASN 1087Cb 0.11 -1.80 0.12 0.00 0.41 0.00 0.00 41.25 40.08 1n82 s ASN 1087CO 0.60 -0.53 0.90 0.00 -1.51 0.00 0.00 177.10 176.57 1n82 n GLN 1088N -1.98 -4.55 -4.51 -0.60 6.02 -1.26 -4.88 117.38 105.62 1n82 n GLN 1088Ca -0.01 0.50 -0.33 0.00 -0.01 0.00 0.00 57.00 57.15 1n82 n GLN 1088Cb 0.57 -5.33 -0.16 0.00 1.02 0.00 0.00 30.24 26.34 1n82 n GLN 1088CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1n82 s THR 1089N -3.30 2.41 0.69 5.09 2.01 -1.26 -1.26 115.64 120.03 1n82 s THR 1089Ca 0.69 -0.85 -0.15 0.00 0.31 0.00 0.00 61.69 61.69 1n82 s THR 1089Cb -0.36 -2.00 0.02 0.00 0.01 0.00 0.00 72.50 70.16 1n82 s THR 1089CO 0.87 0.53 1.16 -2.84 -0.69 0.00 0.00 174.62 173.64 1n82 s PRO 1090N 0.89 2.48 0.52 4.92 0.02 -1.26 -4.91 135.00 137.66 1n82 s PRO 1090Ca -0.04 1.57 0.17 0.00 0.02 0.00 0.00 61.00 62.72 1n82 s PRO 1090Cb -0.15 -1.89 1.27 0.00 0.02 0.00 0.00 34.50 33.75 1n82 s PRO 1090CO -0.02 -1.54 2.12 -0.44 -0.33 0.00 0.00 177.00 176.79 1n82 h ASP 1091N -0.12 0.03 -0.36 2.53 3.32 -2.00 -2.70 116.42 117.12 1n82 h ASP 1091Ca -0.47 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 56.64 1n82 h ASP 1091Cb 1.27 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 1n82 h ASP 1091CO 0.52 0.02 0.24 4.11 -1.72 0.00 0.00 179.24 182.41 1n82 h TRP 1092N 0.03 0.23 -0.89 4.55 5.08 -1.91 -2.46 115.95 120.58 1n82 h TRP 1092Ca 0.06 0.01 0.12 0.00 1.08 0.00 0.00 58.89 60.15 1n82 h TRP 1092Cb 0.19 -0.08 -0.07 0.00 -3.00 0.00 0.00 29.16 26.20 1n82 h TRP 1092CO -0.00 0.13 0.57 0.28 -1.28 0.00 0.00 178.44 178.14 1n82 h VAL 1093N 0.23 0.90 -0.19 0.12 2.07 -1.85 -2.15 116.25 115.38 1n82 h VAL 1093Ca 0.16 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1n82 h VAL 1093Cb 0.33 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1n82 h VAL 1093CO -0.03 0.14 0.00 0.49 0.02 0.00 0.00 177.57 178.19 1n82 n PHE 1094N -4.55 0.22 -4.27 1.57 3.72 -0.93 -4.87 117.46 108.35 1n82 n PHE 1094Ca 0.16 -0.12 -0.27 0.00 -0.05 0.00 0.00 57.45 57.17 1n82 n PHE 1094Cb 0.39 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.83 1n82 n PHE 1094CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1n82 s GLN 1095N -1.71 2.09 0.23 -1.08 -0.21 -0.81 -1.06 119.66 117.11 1n82 s GLN 1095Ca 0.32 -1.20 -0.00 0.00 0.02 0.00 0.00 55.36 54.49 1n82 s GLN 1095Cb 0.21 -2.20 0.05 0.00 1.00 0.00 0.00 33.01 32.06 1n82 s GLN 1095CO 0.30 0.45 0.31 -0.40 -2.12 0.00 0.00 175.29 173.83 1n82 n ASP 1096N 0.19 0.40 0.28 5.90 5.68 0.68 -4.69 116.55 124.99 1n82 n ASP 1096Ca -0.11 -1.34 0.18 0.00 -0.50 0.00 0.00 54.79 53.01 1n82 n ASP 1096Cb 0.55 -0.20 0.72 0.00 -1.14 0.00 0.00 41.12 41.04 1n82 n ASP 1096CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1n82 h GLY 1097N -0.19 0.00 -2.98 6.12 0.00 -1.98 -2.52 103.07 101.52 1n82 h GLY 1097Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1n82 h GLY 1097CO 0.11 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.26 1n82 n GLN 1098N -3.07 3.38 -0.35 4.80 -0.00 -1.26 -4.93 117.38 115.95 1n82 n GLN 1098Ca 0.00 -2.83 0.00 0.00 -0.00 0.00 0.00 57.00 54.17 1n82 n GLN 1098Cb 0.29 -1.78 0.00 0.00 -0.00 0.00 0.00 30.24 28.75 1n82 n GLN 1098CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n82 n GLY 1099N 1.37 1.86 3.80 2.61 0.00 -0.95 -5.04 105.19 108.84 1n82 n GLY 1099Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 1n82 n GLY 1099CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1n82 s HIS 1100N -3.20 2.94 0.32 1.61 3.76 -1.26 -4.69 115.29 114.76 1n82 s HIS 1100Ca 0.00 1.47 -0.29 0.00 -0.15 0.00 0.00 55.06 56.09 1n82 s HIS 1100Cb 0.00 -2.95 -0.10 0.00 1.11 0.00 0.00 32.58 30.64 1n82 s HIS 1100CO 0.00 -1.39 1.35 -0.06 -0.85 0.00 0.00 174.74 173.79 1n82 s PHE 1101N -2.92 3.01 0.87 1.40 0.08 -1.26 -0.23 117.98 118.93 1n82 s PHE 1101Ca 0.60 1.32 -0.12 0.00 0.12 0.00 0.00 56.93 58.85 1n82 s PHE 1101Cb -0.15 -3.74 0.11 0.00 -0.57 0.00 0.00 43.02 38.68 1n82 s PHE 1101CO 0.53 -2.11 1.11 0.14 -0.10 0.00 0.00 175.22 174.79 1n82 s VAL 1102N -0.89 2.56 0.87 -0.44 -7.23 -0.22 -4.73 120.40 110.31 1n82 s VAL 1102Ca 0.51 0.18 -0.12 0.00 -1.81 0.00 0.00 61.98 60.75 1n82 s VAL 1102Cb -0.41 -2.85 0.11 0.00 0.56 0.00 0.00 36.38 33.79 1n82 s VAL 1102CO 0.52 -0.24 1.10 -0.94 -0.31 0.00 0.00 175.10 175.23 1n82 s SER 1103N -3.80 3.78 0.15 4.85 1.04 -1.26 -4.86 113.70 113.59 1n82 s SER 1103Ca 0.63 1.36 -0.20 0.00 0.48 0.00 0.00 55.95 58.21 1n82 s SER 1103Cb -0.16 -2.05 0.04 0.00 0.10 0.00 0.00 66.02 63.96 1n82 s SER 1103CO 0.55 -2.43 1.65 -0.09 0.98 0.00 0.00 173.24 173.90 1n82 h ARG 1104N -1.41 -0.14 -0.74 4.02 2.43 -1.91 -1.05 114.38 115.58 1n82 h ARG 1104Ca -0.49 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.65 1n82 h ARG 1104Cb 1.29 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.83 1n82 h ARG 1104CO 0.57 -0.09 0.33 -0.44 -1.51 0.00 0.00 179.97 178.83 1n82 h ASP 1105N -0.14 1.00 -0.61 -3.80 3.32 -1.94 0.15 116.42 114.40 1n82 h ASP 1105Ca 0.14 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 1n82 h ASP 1105Cb 0.36 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1n82 h ASP 1105CO -0.35 0.88 0.02 0.58 -1.72 0.00 0.00 179.24 178.65 1n82 h VAL 1106N 1.06 1.26 -0.66 -1.35 2.07 -1.88 -1.11 116.25 115.64 1n82 h VAL 1106Ca 0.25 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.57 1n82 h VAL 1106Cb 0.17 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1n82 h VAL 1106CO -0.03 0.41 0.10 0.25 0.02 0.00 0.00 177.57 178.33 1n82 h LEU 1107N 0.98 1.04 -0.79 2.57 5.85 -0.79 -1.54 115.31 122.63 1n82 h LEU 1107Ca 0.18 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1n82 h LEU 1107Cb 0.53 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1n82 h LEU 1107CO 0.03 1.03 0.31 -0.07 -0.34 0.00 0.00 178.44 179.40 1n82 h LEU 1108N 1.02 1.09 -0.81 2.25 3.38 -0.77 0.63 115.31 122.10 1n82 h LEU 1108Ca 0.20 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1n82 h LEU 1108Cb 0.44 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1n82 h LEU 1108CO 0.01 0.97 0.52 -0.33 0.09 0.00 0.00 178.44 179.70 1n82 h GLU 1109N 1.15 0.98 -0.45 1.13 5.08 -0.76 0.99 114.58 122.68 1n82 h GLU 1109Ca 0.26 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.43 1n82 h GLU 1109Cb 0.23 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1n82 h GLU 1109CO -0.02 0.65 -0.23 0.00 -1.00 0.00 0.00 179.01 178.41 1n82 h ARG 1110N 1.01 0.96 -0.16 2.33 3.08 -0.79 -0.37 114.38 120.43 1n82 h ARG 1110Ca 0.33 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1n82 h ARG 1110Cb 0.02 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1n82 h ARG 1110CO -0.12 1.09 0.08 1.98 -1.07 0.00 0.00 179.97 181.93 1n82 h MET 1111N 0.80 0.24 -0.65 0.04 4.05 -0.54 -1.26 114.93 117.60 1n82 h MET 1111Ca 0.10 -0.04 0.01 0.00 -0.28 0.00 0.00 59.70 59.49 1n82 h MET 1111Cb 0.81 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.53 1n82 h MET 1111CO 0.07 0.28 0.43 -0.22 0.23 0.00 0.00 176.91 177.70 1n82 h LYS 1112N 0.14 0.86 -0.32 0.39 3.64 -0.69 -1.26 116.57 119.32 1n82 h LYS 1112Ca 0.06 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1n82 h LYS 1112Cb 0.12 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1n82 h LYS 1112CO -0.01 0.57 0.14 0.00 -2.27 0.00 0.00 179.45 177.89 1n82 h HIS 1114N 0.37 -0.35 -0.48 0.00 -0.00 -1.13 -1.07 115.15 112.50 1n82 h HIS 1114Ca 0.11 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.48 1n82 h HIS 1114Cb 0.14 0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.64 1n82 h HIS 1114CO -0.01 -0.21 0.31 0.82 -0.00 0.00 0.00 177.93 178.84 1n82 h ILE 1115N -0.38 1.11 -0.43 6.26 2.04 -1.15 -0.66 117.51 124.31 1n82 h ILE 1115Ca -0.04 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 1n82 h ILE 1115Cb 0.29 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1n82 h ILE 1115CO 0.06 0.12 0.26 -1.28 0.00 0.00 0.00 178.15 177.30 1n82 h SER 1116N 0.63 0.53 -0.43 1.72 0.87 -0.85 0.14 113.55 116.16 1n82 h SER 1116Ca 0.18 -0.06 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 1n82 h SER 1116Cb -0.06 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1n82 h SER 1116CO -0.04 0.44 -0.04 0.74 -0.53 0.00 0.00 176.83 177.39 1n82 h THR 1117N 0.57 1.27 0.11 2.23 2.02 -0.86 -0.69 112.91 117.56 1n82 h THR 1117Ca 0.16 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 1n82 h THR 1117Cb 0.01 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1n82 h THR 1117CO -0.03 0.38 -0.05 0.58 0.37 0.00 0.00 175.52 176.77 1n82 h VAL 1118N 0.63 1.09 -0.68 3.16 2.07 -1.01 -2.52 116.25 118.99 1n82 h VAL 1118Ca 0.12 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 1n82 h VAL 1118Cb 0.55 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1n82 h VAL 1118CO 0.03 0.25 0.26 0.58 0.02 0.00 0.00 177.57 178.71 1n82 h VAL 1119N -0.69 1.24 -0.31 2.57 2.07 -0.77 -2.62 116.25 117.74 1n82 h VAL 1119Ca -0.02 -0.78 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1n82 h VAL 1119Cb 0.52 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1n82 h VAL 1119CO 0.03 0.31 0.03 0.03 0.02 0.00 0.00 177.57 177.99 1n82 h ARG 1120N 0.97 0.46 -0.83 1.57 3.08 -1.17 -2.02 114.38 116.44 1n82 h ARG 1120Ca 0.23 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.21 1n82 h ARG 1120Cb 0.23 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 1n82 h ARG 1120CO -0.02 0.46 0.55 -0.09 -1.07 0.00 0.00 179.97 179.81 1n82 h ARG 1121N 0.45 1.08 -0.42 0.04 2.43 -1.05 -2.97 114.38 113.93 1n82 h ARG 1121Ca 0.10 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1n82 h ARG 1121Cb 0.25 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1n82 h ARG 1121CO 0.00 0.71 0.00 0.66 -1.51 0.00 0.00 179.97 179.84 1n82 n TYR 1122N -4.42 0.55 -1.65 2.20 4.01 -1.03 -4.98 117.16 111.85 1n82 n TYR 1122Ca 0.10 -0.33 -0.45 0.00 -0.16 0.00 0.00 57.90 57.05 1n82 n TYR 1122Cb 0.04 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.04 1n82 n TYR 1122CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1n82 n LYS 1123N 1.24 1.83 0.00 -0.72 4.81 -0.79 -0.45 118.16 124.08 1n82 n LYS 1123Ca 0.18 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1n82 n LYS 1123Cb 0.54 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 33.35 1n82 n LYS 1123CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n82 n GLY 1124N 1.91 2.48 0.01 3.14 0.00 -1.26 -4.76 105.19 106.71 1n82 n GLY 1124Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1n82 n GLY 1124CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n82 n LYS 1125N -2.00 3.04 -3.83 1.61 5.02 0.41 -4.97 118.16 117.43 1n82 n LYS 1125Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1n82 n LYS 1125Cb 0.00 -1.06 -0.12 0.00 -0.02 0.00 0.00 35.03 33.83 1n82 n LYS 1125CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1n82 s ILE 1126N -2.06 4.43 -0.61 -0.18 1.01 -0.51 -4.21 121.20 119.07 1n82 s ILE 1126Ca -0.02 -0.14 0.23 0.00 0.00 0.00 0.00 60.65 60.73 1n82 s ILE 1126Cb 0.01 -3.06 -0.09 0.00 0.01 0.00 0.00 42.46 39.33 1n82 s ILE 1126CO 0.10 0.36 1.06 0.00 0.00 0.00 0.00 174.94 176.46 1n82 n TYR 1127N 4.62 0.30 -3.86 3.97 4.11 -1.04 -4.81 117.16 120.46 1n82 n TYR 1127Ca -0.16 0.09 -0.09 0.00 -0.00 0.00 0.00 57.90 57.74 1n82 n TYR 1127Cb 0.52 -0.46 -0.07 0.00 -0.00 0.00 0.00 39.34 39.32 1n82 n TYR 1127CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1n82 s TRP 1129N -3.88 0.39 -0.79 0.00 0.52 -0.25 -0.51 118.94 114.42 1n82 s TRP 1129Ca 0.07 -0.05 -0.26 0.00 0.02 0.00 0.00 56.10 55.88 1n82 s TRP 1129Cb 0.04 -0.38 0.02 0.00 -1.15 0.00 0.00 33.47 32.00 1n82 s TRP 1129CO -0.09 -0.09 1.51 -0.51 0.02 0.00 0.00 176.95 177.79 1n82 s ASP 1130N 0.59 5.94 -0.09 2.95 1.01 0.31 -0.26 116.67 127.13 1n82 s ASP 1130Ca -0.06 -0.54 -0.26 0.00 0.71 0.00 0.00 52.55 52.40 1n82 s ASP 1130Cb -0.09 -2.56 -0.26 0.00 1.01 0.00 0.00 42.92 41.02 1n82 s ASP 1130CO -0.01 -1.97 0.91 0.58 0.21 0.00 0.00 175.17 174.89 1n82 h VAL 1131N 6.52 1.64 -3.46 -1.27 2.07 -1.54 -1.99 116.25 118.21 1n82 h VAL 1131Ca -0.13 -2.15 -0.68 0.00 0.82 0.00 0.00 66.70 64.56 1n82 h VAL 1131Cb 1.06 3.06 -0.31 0.00 -1.52 0.00 0.00 31.29 33.58 1n82 h VAL 1131CO 1.29 0.58 -0.86 -0.63 0.02 0.00 0.00 177.57 177.97 1n82 s ILE 1132N -2.71 2.27 -0.15 4.57 -1.09 -1.20 -0.87 121.20 122.02 1n82 s ILE 1132Ca -0.17 -0.95 -0.00 0.00 -2.23 0.00 0.00 60.65 57.30 1n82 s ILE 1132Cb -0.01 -1.88 -0.01 0.00 -1.58 0.00 0.00 42.46 38.99 1n82 s ILE 1132CO 0.73 0.56 -0.13 0.21 -1.23 0.00 0.00 174.94 175.07 1n82 s ASN 1133N 0.23 3.89 -1.35 3.58 2.47 -0.60 -1.82 114.94 121.34 1n82 s ASN 1133Ca -0.14 -0.39 -0.05 0.00 0.42 0.00 0.00 52.86 52.69 1n82 s ASN 1133Cb -0.17 -1.60 0.02 0.00 -1.45 0.00 0.00 41.25 38.05 1n82 s ASN 1133CO 0.07 0.12 0.96 -0.62 -3.72 0.00 0.00 177.10 173.91 1n82 n GLU 1134N 3.83 -6.25 0.20 0.43 1.02 -0.07 -4.49 120.64 115.31 1n82 n GLU 1134Ca -0.18 0.72 0.11 0.00 -0.02 0.00 0.00 57.16 57.79 1n82 n GLU 1134Cb 0.52 -5.60 0.14 0.00 -0.02 0.00 0.00 31.44 26.48 1n82 n GLU 1134CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n82 h ALA 1135N 0.94 0.93 -2.56 0.62 0.00 -1.89 -3.46 119.26 113.83 1n82 h ALA 1135Ca -0.59 -0.07 -0.49 0.00 0.00 0.00 0.00 54.91 53.77 1n82 h ALA 1135Cb 1.36 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1n82 h ALA 1135CO 0.57 0.09 0.29 0.08 0.00 0.00 0.00 179.25 180.28 1n82 s VAL 1136N -3.18 4.25 0.62 0.00 1.01 -1.26 -1.11 120.40 120.72 1n82 s VAL 1136Ca 0.06 1.79 -0.16 0.00 0.00 0.00 0.00 61.98 63.67 1n82 s VAL 1136Cb 0.06 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 1n82 s VAL 1136CO 0.69 0.28 1.10 0.00 0.00 0.00 0.00 175.10 177.17 1n82 s ALA 1137N -1.45 2.58 0.10 5.51 0.00 -0.55 -4.46 121.76 123.48 1n82 s ALA 1137Ca 0.45 0.59 -0.33 0.00 0.00 0.00 0.00 51.96 52.67 1n82 s ALA 1137Cb -0.20 -3.31 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 1n82 s ALA 1137CO 0.25 -1.05 1.59 -0.44 0.00 0.00 0.00 175.76 176.11 1n82 h ASP 1138N 0.41 -1.19 -2.88 0.00 3.32 -1.92 -3.48 116.42 110.68 1n82 h ASP 1138Ca -0.48 0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.55 1n82 h ASP 1138Cb 1.24 0.41 -0.03 0.00 0.22 0.00 0.00 39.33 41.17 1n82 h ASP 1138CO 0.55 -0.56 -0.12 -0.62 -1.72 0.00 0.00 179.24 176.78 1n82 n GLU 1139N -5.50 0.39 -0.66 3.56 -0.58 -1.26 -4.91 120.64 111.68 1n82 n GLU 1139Ca -0.10 -0.88 0.09 0.00 -0.42 0.00 0.00 57.16 55.85 1n82 n GLU 1139Cb 0.40 0.63 -0.03 0.00 -0.57 0.00 0.00 31.44 31.88 1n82 n GLU 1139CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n82 n GLY 1140N 0.47 -1.83 0.02 0.62 0.00 -1.26 -4.55 105.19 98.65 1n82 n GLY 1140Ca 0.01 -1.35 0.11 0.00 0.00 0.00 0.00 46.02 44.79 1n82 n GLY 1140CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n82 n ASP 1141N -2.81 0.65 -4.75 1.61 4.64 -1.26 -4.90 116.55 109.73 1n82 n ASP 1141Ca -0.00 -0.37 -0.41 0.00 -1.38 0.00 0.00 54.79 52.62 1n82 n ASP 1141Cb 0.30 0.60 -0.03 0.00 -1.04 0.00 0.00 41.12 40.96 1n82 n ASP 1141CO 0.00 0.00 0.00 -1.83 -0.82 0.00 0.00 177.20 174.55 1n82 s GLU 1142N -3.08 4.36 -0.00 -0.67 -1.05 -1.26 -4.93 118.70 112.07 1n82 s GLU 1142Ca 0.07 2.15 -0.23 0.00 -0.15 0.00 0.00 54.97 56.81 1n82 s GLU 1142Cb 0.16 -3.14 -0.19 0.00 -0.44 0.00 0.00 34.13 30.53 1n82 s GLU 1142CO 0.77 -0.25 1.24 1.25 0.95 0.00 0.00 175.26 179.23 1n82 h LEU 1143N 4.60 0.21 -9.54 1.83 5.85 -1.93 -3.41 115.31 112.91 1n82 h LEU 1143Ca -0.46 -0.55 -0.66 0.00 0.84 0.00 0.00 57.88 57.04 1n82 h LEU 1143Cb 1.22 -0.06 -0.10 0.00 0.37 0.00 0.00 40.66 42.09 1n82 h LEU 1143CO 0.73 0.72 -0.56 -0.76 -0.34 0.00 0.00 178.44 178.23 1n82 s LEU 1144N -9.01 3.94 0.54 2.25 1.43 -1.26 -1.48 118.68 115.09 1n82 s LEU 1144Ca -0.15 0.21 -0.19 0.00 -1.03 0.00 0.00 54.13 52.97 1n82 s LEU 1144Cb 0.03 -2.18 -0.06 0.00 0.03 0.00 0.00 46.19 44.00 1n82 s LEU 1144CO 0.72 0.31 1.07 0.00 0.23 0.00 0.00 176.35 178.68 1n82 s ARG 1145N -1.50 3.50 0.56 1.70 1.70 -0.27 -4.53 118.95 120.11 1n82 s ARG 1145Ca 0.20 1.38 -0.19 0.00 -0.47 0.00 0.00 55.73 56.65 1n82 s ARG 1145Cb -0.12 -2.05 -0.05 0.00 -0.57 0.00 0.00 34.95 32.16 1n82 s ARG 1145CO 0.11 -0.68 1.16 -1.25 -1.08 0.00 0.00 175.30 173.56 1n82 s PRO 1146N -3.52 3.24 0.14 3.89 0.04 -1.26 -4.95 135.00 132.58 1n82 s PRO 1146Ca 0.68 1.71 -0.24 0.00 0.04 0.00 0.00 61.00 63.18 1n82 s PRO 1146Cb -0.18 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.42 1n82 s PRO 1146CO 0.27 -0.96 0.73 -1.54 0.04 0.00 0.00 177.00 175.54 1n82 s SER 1147N -1.67 -0.42 0.31 6.66 1.04 -1.26 -5.02 113.70 113.34 1n82 s SER 1147Ca 0.74 -0.16 0.03 0.00 0.48 0.00 0.00 55.95 57.04 1n82 s SER 1147Cb -0.27 0.56 0.50 0.00 0.10 0.00 0.00 66.02 66.91 1n82 s SER 1147CO 0.30 -0.95 1.80 0.11 0.98 0.00 0.00 173.24 175.47 1n82 h LYS 1148N 2.00 0.53 -0.08 4.02 1.57 -1.95 0.18 116.57 122.83 1n82 h LYS 1148Ca -0.27 -0.15 0.02 0.00 -1.87 0.00 0.00 60.65 58.37 1n82 h LYS 1148Cb 1.27 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1n82 h LYS 1148CO 0.32 0.64 -0.01 -1.49 -0.57 0.00 0.00 179.45 178.33 1n82 h TRP 1149N 0.49 -0.03 -0.36 -1.35 4.06 -1.95 -1.58 115.95 115.23 1n82 h TRP 1149Ca 0.09 0.01 -0.16 0.00 2.06 0.00 0.00 58.89 60.89 1n82 h TRP 1149Cb 0.48 0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 1n82 h TRP 1149CO 0.02 -0.03 -0.38 -0.09 -3.56 0.00 0.00 178.44 174.40 1n82 h ARG 1150N 0.01 0.90 -0.35 0.49 2.43 -1.74 -2.06 114.38 114.07 1n82 h ARG 1150Ca 0.04 -0.48 0.02 0.00 -0.81 0.00 0.00 59.98 58.75 1n82 h ARG 1150Cb 0.05 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1n82 h ARG 1150CO -0.08 1.13 0.20 0.37 -1.51 0.00 0.00 179.97 180.08 1n82 h GLN 1151N 0.70 0.39 0.23 0.20 4.15 -0.49 -0.64 115.11 119.65 1n82 h GLN 1151Ca 0.05 -0.02 -0.30 0.00 0.77 0.00 0.00 58.65 59.15 1n82 h GLN 1151Cb 0.97 -0.09 0.04 0.00 0.21 0.00 0.00 27.48 28.61 1n82 h GLN 1151CO 0.09 0.26 -1.32 0.82 -1.93 0.00 0.00 178.83 176.75 1n82 h ILE 1152N 0.40 1.34 0.12 2.39 2.04 -1.29 -3.39 117.51 119.11 1n82 h ILE 1152Ca 0.14 -2.66 -0.27 0.00 1.00 0.00 0.00 64.86 63.07 1n82 h ILE 1152Cb 0.02 3.09 -0.00 0.00 -0.74 0.00 0.00 36.82 39.19 1n82 h ILE 1152CO -0.08 0.79 -1.36 0.40 0.00 0.00 0.00 178.15 177.90 1n82 h ILE 1153N 0.02 1.07 0.00 -0.67 2.04 -1.41 -3.28 117.51 115.28 1n82 h ILE 1153Ca -0.23 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.22 1n82 h ILE 1153Cb 2.05 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 40.88 1n82 h ILE 1153CO 0.25 0.70 0.00 0.61 0.00 0.00 0.00 178.15 179.71 1n82 n GLY 1154N 1.73 0.85 0.00 5.37 0.00 -0.25 -4.79 105.19 108.11 1n82 n GLY 1154Ca -0.24 -2.25 0.07 0.00 0.00 0.00 0.00 46.02 43.60 1n82 n GLY 1154CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n82 n ASP 1155N 0.00 0.00 -0.51 1.61 8.00 -1.26 -1.69 116.55 122.70 1n82 n ASP 1155Ca 0.00 0.40 0.03 0.00 0.71 0.00 0.00 54.79 55.93 1n82 n ASP 1155Cb 0.00 -0.45 0.09 0.00 -0.02 0.00 0.00 41.12 40.74 1n82 n ASP 1155CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1n82 n ASP 1156N -1.45 1.41 0.10 -2.24 5.75 -1.26 -4.08 116.55 114.78 1n82 n ASP 1156Ca 0.04 -2.07 0.05 0.00 -0.01 0.00 0.00 54.79 52.81 1n82 n ASP 1156Cb 0.16 -0.25 0.50 0.00 -1.03 0.00 0.00 41.12 40.50 1n82 n ASP 1156CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 1n82 h PHE 1157N 1.13 0.31 -0.15 2.11 -0.00 -1.65 -1.93 116.94 116.76 1n82 h PHE 1157Ca 0.00 0.01 -0.09 0.00 -0.00 0.00 0.00 57.97 57.89 1n82 h PHE 1157Cb 0.45 -0.11 -0.00 0.00 -0.00 0.00 0.00 35.95 36.29 1n82 h PHE 1157CO 0.18 0.21 -0.25 0.52 -0.00 0.00 0.00 178.31 178.97 1n82 h MET 1158N 0.34 0.44 -0.59 6.09 2.86 -1.86 -1.80 114.93 120.41 1n82 h MET 1158Ca 0.09 -0.27 0.12 0.00 -2.06 0.00 0.00 59.70 57.58 1n82 h MET 1158Cb -0.02 0.03 -0.09 0.00 0.06 0.00 0.00 31.60 31.57 1n82 h MET 1158CO -0.02 0.86 0.07 1.49 1.06 0.00 0.00 176.91 180.37 1n82 h GLU 1159N 0.06 0.18 -0.63 1.72 4.81 -1.72 -1.54 114.58 117.47 1n82 h GLU 1159Ca 0.01 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1n82 h GLU 1159Cb 0.83 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1n82 h GLU 1159CO 0.06 0.12 0.11 1.96 -0.73 0.00 0.00 179.01 180.53 1n82 h GLN 1160N 0.19 1.04 -0.55 1.92 1.08 -1.25 -1.40 115.11 116.13 1n82 h GLN 1160Ca 0.31 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1n82 h GLN 1160Cb 0.48 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1n82 h GLN 1160CO -0.45 0.96 0.35 0.00 -0.95 0.00 0.00 178.83 178.74 1n82 h ALA 1161N 1.03 0.70 -0.48 3.87 0.00 -0.71 0.60 119.26 124.27 1n82 h ALA 1161Ca 0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1n82 h ALA 1161Cb 0.42 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1n82 h ALA 1161CO 0.01 0.15 0.15 0.74 0.00 0.00 0.00 179.25 180.31 1n82 h PHE 1162N 0.74 0.78 -0.54 0.00 0.04 -1.13 -0.85 116.94 115.98 1n82 h PHE 1162Ca 0.20 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.85 1n82 h PHE 1162Cb -0.06 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 37.84 1n82 h PHE 1162CO -0.03 0.68 0.15 -0.07 -0.60 0.00 0.00 178.31 178.44 1n82 h LEU 1163N 0.64 0.75 -0.39 1.54 3.38 -0.90 -1.08 115.31 119.25 1n82 h LEU 1163Ca 0.16 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 1n82 h LEU 1163Cb 0.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1n82 h LEU 1163CO -0.00 0.72 -0.35 1.88 0.09 0.00 0.00 178.44 180.78 1n82 h TYR 1164N 0.78 1.11 -0.54 1.13 0.05 -0.63 -1.45 116.97 117.43 1n82 h TYR 1164Ca 0.18 -0.32 -0.09 0.00 0.05 0.00 0.00 58.73 58.54 1n82 h TYR 1164Cb 0.26 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 1n82 h TYR 1164CO 0.01 1.15 -0.01 0.00 -1.05 0.00 0.00 178.16 178.26 1n82 h ALA 1165N 0.78 0.72 -0.41 3.88 0.00 -0.96 -2.17 119.26 121.10 1n82 h ALA 1165Ca 0.07 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1n82 h ALA 1165Cb 0.94 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1n82 h ALA 1165CO 0.09 0.56 0.26 -0.92 0.00 0.00 0.00 179.25 179.24 1n82 h TYR 1166N 0.83 0.49 -0.86 0.00 3.20 -1.13 -1.22 116.97 118.28 1n82 h TYR 1166Ca 0.15 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 1n82 h TYR 1166Cb 0.55 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 1n82 h TYR 1166CO 0.04 0.30 0.53 0.93 -1.64 0.00 0.00 178.16 178.32 1n82 h GLU 1167N 0.53 1.16 -0.16 1.82 5.08 -1.13 -0.65 114.58 121.24 1n82 h GLU 1167Ca 0.16 -0.10 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 1n82 h GLU 1167Cb -0.03 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 1n82 h GLU 1167CO -0.05 0.81 -0.53 0.00 -1.00 0.00 0.00 179.01 178.23 1n82 h ALA 1168N 1.40 0.79 -1.74 3.43 0.00 -0.95 -3.40 119.26 118.79 1n82 h ALA 1168Ca 0.31 -0.50 -0.30 0.00 0.00 0.00 0.00 54.91 54.42 1n82 h ALA 1168Cb -0.06 -0.09 -0.28 0.00 0.00 0.00 0.00 17.79 17.35 1n82 h ALA 1168CO -0.06 0.68 -0.63 0.34 0.00 0.00 0.00 179.25 179.58 1n82 s ASP 1169N -6.90 0.56 0.00 0.00 2.15 -0.50 -4.62 116.67 107.36 1n82 s ASP 1169Ca -0.06 -1.39 0.06 0.00 0.43 0.00 0.00 52.55 51.59 1n82 s ASP 1169Cb 0.12 0.88 0.30 0.00 -0.30 0.00 0.00 42.92 43.92 1n82 s ASP 1169CO 0.82 -0.24 1.13 -0.81 -0.17 0.00 0.00 175.17 175.91 1n82 n PRO 1170N 4.29 0.05 0.00 4.34 -0.04 -0.29 -1.90 135.00 141.44 1n82 n PRO 1170Ca 0.11 0.31 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 1n82 n PRO 1170Cb 0.48 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.47 1n82 n PRO 1170CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1n82 n ASP 1171N -1.40 1.20 -4.80 3.54 8.00 -1.26 -4.96 116.55 116.87 1n82 n ASP 1171Ca 0.02 -1.00 -0.35 0.00 0.71 0.00 0.00 54.79 54.18 1n82 n ASP 1171Cb 0.06 0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.74 1n82 n ASP 1171CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n82 s ALA 1172N -2.80 3.01 -0.17 2.24 0.00 -0.80 -4.99 121.76 118.25 1n82 s ALA 1172Ca 0.13 0.56 -0.25 0.00 0.00 0.00 0.00 51.96 52.40 1n82 s ALA 1172Cb 0.17 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1n82 s ALA 1172CO 0.72 -0.10 0.80 -0.51 0.00 0.00 0.00 175.76 176.67 1n82 s LEU 1173N -3.02 4.18 -0.21 0.00 1.43 -0.49 -4.98 118.68 115.58 1n82 s LEU 1173Ca 0.61 1.13 -0.06 0.00 -1.03 0.00 0.00 54.13 54.78 1n82 s LEU 1173Cb -0.16 -3.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.85 1n82 s LEU 1173CO 0.20 -0.37 0.03 -0.76 0.23 0.00 0.00 176.35 175.69 1n82 s LEU 1174N 2.04 3.43 0.03 1.79 1.43 -1.26 -1.09 118.68 125.05 1n82 s LEU 1174Ca 0.37 -0.14 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 1n82 s LEU 1174Cb -0.17 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 1n82 s LEU 1174CO 0.12 0.06 -0.09 -0.36 0.23 0.00 0.00 176.35 176.32 1n82 s PHE 1175N 1.05 2.81 -0.24 0.29 0.40 0.63 -0.64 117.98 122.29 1n82 s PHE 1175Ca 0.03 -0.10 -0.17 0.00 -0.60 0.00 0.00 56.93 56.09 1n82 s PHE 1175Cb -0.14 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.80 1n82 s PHE 1175CO 0.02 0.37 0.47 -0.47 0.70 0.00 0.00 175.22 176.31 1n82 s TYR 1176N -1.04 3.31 -0.06 0.36 5.04 -0.92 -1.39 117.35 122.66 1n82 s TYR 1176Ca 0.18 0.63 0.04 0.00 -2.44 0.00 0.00 57.07 55.48 1n82 s TYR 1176Cb -0.11 -2.64 -0.02 0.00 0.35 0.00 0.00 41.96 39.54 1n82 s TYR 1176CO 0.09 -0.17 -0.18 1.21 -1.34 0.00 0.00 175.55 175.15 1n82 s ASN 1177N 1.36 3.65 0.15 4.32 2.47 -0.76 -0.80 114.94 125.33 1n82 s ASN 1177Ca 0.20 -0.34 -0.22 0.00 0.42 0.00 0.00 52.86 52.93 1n82 s ASN 1177Cb -0.15 -0.92 0.06 0.00 -1.45 0.00 0.00 41.25 38.79 1n82 s ASN 1177CO 0.09 0.28 0.57 -0.62 -3.72 0.00 0.00 177.10 173.70 1n82 s ASP 1178N -0.37 -0.51 0.44 -4.21 -1.08 -0.56 -0.89 116.67 109.49 1n82 s ASP 1178Ca 0.03 -0.04 0.08 0.00 -0.52 0.00 0.00 52.55 52.10 1n82 s ASP 1178Cb -0.12 0.58 -0.00 0.00 -1.46 0.00 0.00 42.92 41.91 1n82 s ASP 1178CO 0.02 -0.94 0.43 -0.72 0.52 0.00 0.00 175.17 174.48 1n82 s TYR 1179N -3.71 2.49 -1.30 -5.34 1.13 -1.26 -0.94 117.35 108.43 1n82 s TYR 1179Ca 0.01 -0.54 -0.07 0.00 -1.41 0.00 0.00 57.07 55.06 1n82 s TYR 1179Cb -0.00 -2.17 0.04 0.00 -1.10 0.00 0.00 41.96 38.73 1n82 s TYR 1179CO -0.12 -0.27 0.42 0.09 -2.51 0.00 0.00 175.55 173.15 1n82 n ASN 1180N -1.66 -4.27 0.05 -0.18 3.02 -1.26 -4.85 115.26 106.10 1n82 n ASN 1180Ca 0.04 -0.26 0.10 0.00 -0.03 0.00 0.00 54.58 54.44 1n82 n ASN 1180Cb 0.62 -3.52 0.42 0.00 -0.61 0.00 0.00 39.78 36.69 1n82 n ASN 1180CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1n82 n GLU 1181N -3.62 0.08 0.00 3.52 0.00 -1.26 -2.63 120.64 116.73 1n82 n GLU 1181Ca -0.06 0.25 0.06 0.00 0.00 0.00 0.00 57.16 57.40 1n82 n GLU 1181Cb 0.57 -1.63 0.04 0.00 0.00 0.00 0.00 31.44 30.42 1n82 n GLU 1181CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1n82 s PHE 1183N -1.09 2.73 0.25 0.00 0.08 -1.08 -4.75 117.98 114.12 1n82 s PHE 1183Ca 0.13 0.72 -0.06 0.00 0.12 0.00 0.00 56.93 57.83 1n82 s PHE 1183Cb 0.10 -3.71 0.45 0.00 -0.57 0.00 0.00 43.02 39.29 1n82 s PHE 1183CO 0.18 -2.70 1.64 -1.35 -0.10 0.00 0.00 175.22 172.89 1n82 h PRO 1184N 8.05 0.13 -0.15 0.24 0.11 -1.91 0.66 132.00 139.11 1n82 h PRO 1184Ca -0.38 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1n82 h PRO 1184Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1n82 h PRO 1184CO 0.91 0.08 0.06 1.49 -0.21 0.00 0.00 178.00 180.34 1n82 h GLU 1185N 0.13 0.23 -0.30 1.05 4.81 -1.96 0.03 114.58 118.57 1n82 h GLU 1185Ca 0.42 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.47 1n82 h GLU 1185Cb 0.74 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1n82 h GLU 1185CO -0.64 0.31 -0.37 -0.22 -0.73 0.00 0.00 179.01 177.36 1n82 h LYS 1186N 0.10 0.69 -0.77 1.92 3.64 -1.62 -2.54 116.57 117.98 1n82 h LYS 1186Ca 0.05 -0.34 0.05 0.00 -1.27 0.00 0.00 60.65 59.14 1n82 h LYS 1186Cb 0.16 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 1n82 h LYS 1186CO -0.00 0.95 0.48 -0.09 -2.27 0.00 0.00 179.45 178.51 1n82 h ARG 1187N 0.57 0.87 -0.04 1.90 2.43 0.54 -1.55 114.38 119.10 1n82 h ARG 1187Ca 0.05 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 1n82 h ARG 1187Cb 0.90 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1n82 h ARG 1187CO 0.08 0.58 -0.52 0.93 -1.51 0.00 0.00 179.97 179.53 1n82 h GLU 1188N 0.90 0.12 -0.49 0.20 4.39 -0.59 -0.51 114.58 118.61 1n82 h GLU 1188Ca 0.33 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.86 1n82 h GLU 1188Cb 0.10 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1n82 h GLU 1188CO -0.15 0.61 -0.09 0.87 -1.16 0.00 0.00 179.01 179.10 1n82 h LYS 1189N 0.09 0.87 -0.30 2.33 1.57 -1.09 -0.14 116.57 119.91 1n82 h LYS 1189Ca 0.00 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 1n82 h LYS 1189Cb 0.95 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 1n82 h LYS 1189CO 0.07 0.93 -0.15 0.82 -0.57 0.00 0.00 179.45 180.55 1n82 h ILE 1190N 0.79 1.29 -0.25 1.86 2.04 -0.86 0.13 117.51 122.51 1n82 h ILE 1190Ca 0.13 -1.25 0.04 0.00 1.00 0.00 0.00 64.86 64.78 1n82 h ILE 1190Cb 0.59 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 1n82 h ILE 1190CO 0.04 0.40 0.01 0.15 0.00 0.00 0.00 178.15 178.75 1n82 h PHE 1191N 0.39 0.01 -0.52 1.37 3.57 -1.03 -0.78 116.94 119.96 1n82 h PHE 1191Ca 0.07 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.51 1n82 h PHE 1191Cb 0.67 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 1n82 h PHE 1191CO 0.06 -0.02 0.00 0.00 -2.23 0.00 0.00 178.31 176.12 1n82 h ALA 1192N 1.20 1.03 -0.13 2.41 0.00 -0.62 -0.94 119.26 122.21 1n82 h ALA 1192Ca 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1n82 h ALA 1192Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1n82 h ALA 1192CO -0.19 0.60 0.05 1.25 0.00 0.00 0.00 179.25 180.97 1n82 h LEU 1193N 0.81 0.19 -0.60 0.00 5.85 -0.26 -1.69 115.31 119.60 1n82 h LEU 1193Ca 0.15 -0.17 -0.15 0.00 0.84 0.00 0.00 57.88 58.55 1n82 h LEU 1193Cb 0.48 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1n82 h LEU 1193CO 0.02 0.31 -0.53 0.58 -0.34 0.00 0.00 178.44 178.48 1n82 h VAL 1194N 0.05 1.33 -0.42 1.05 2.07 -0.98 -2.10 116.25 117.26 1n82 h VAL 1194Ca 0.04 -1.79 -0.01 0.00 0.82 0.00 0.00 66.70 65.77 1n82 h VAL 1194Cb 0.18 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1n82 h VAL 1194CO -0.00 0.55 0.23 0.50 0.02 0.00 0.00 177.57 178.86 1n82 h LYS 1195N 0.36 0.58 -0.36 1.57 3.64 -1.11 0.14 116.57 121.38 1n82 h LYS 1195Ca 0.01 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1n82 h LYS 1195Cb 1.05 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.72 1n82 h LYS 1195CO 0.10 0.47 0.13 1.03 -2.27 0.00 0.00 179.45 178.90 1n82 h SER 1196N 0.54 0.15 -0.44 4.20 0.87 -1.16 -0.74 113.55 116.97 1n82 h SER 1196Ca 0.15 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1n82 h SER 1196Cb 0.05 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 1n82 h SER 1196CO -0.02 0.12 0.13 -0.07 -0.53 0.00 0.00 176.83 176.46 1n82 h LEU 1197N 0.29 0.65 -0.24 2.23 3.38 -1.04 -2.71 115.31 117.87 1n82 h LEU 1197Ca 0.16 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1n82 h LEU 1197Cb 0.13 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1n82 h LEU 1197CO -0.16 0.69 0.11 0.03 0.09 0.00 0.00 178.44 179.19 1n82 h ARG 1198N 0.57 0.23 0.00 1.13 2.47 -0.76 -0.90 114.38 117.12 1n82 h ARG 1198Ca 0.14 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.84 1n82 h ARG 1198Cb 0.28 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.55 1n82 h ARG 1198CO -0.00 0.15 -0.04 -0.44 0.56 0.00 0.00 179.97 180.20 1n82 h ASP 1199N 0.23 0.00 0.31 7.04 3.32 -1.12 0.17 116.42 126.37 1n82 h ASP 1199Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1n82 h ASP 1199Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1n82 h ASP 1199CO -0.08 0.04 -0.01 0.29 -1.72 0.00 0.00 179.24 177.76 1n82 n LYS 1200N -3.19 0.71 -0.94 3.56 5.02 -0.78 -4.90 118.16 117.63 1n82 n LYS 1200Ca -0.01 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 1n82 n LYS 1200Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1n82 n LYS 1200CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n82 n GLY 1201N 1.16 0.49 3.75 0.72 0.00 0.05 -5.02 105.19 106.34 1n82 n GLY 1201Ca 0.18 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1n82 n GLY 1201CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n82 s ILE 1202N -2.00 3.44 -1.02 -0.61 -1.09 -0.41 -4.89 121.20 114.61 1n82 s ILE 1202Ca 0.00 1.31 -0.20 0.00 -2.23 0.00 0.00 60.65 59.53 1n82 s ILE 1202Cb 0.00 -3.83 -0.09 0.00 -1.58 0.00 0.00 42.46 36.96 1n82 s ILE 1202CO 0.00 0.26 1.97 -0.81 -1.23 0.00 0.00 174.94 175.13 1n82 n PRO 1203N 1.86 1.92 -3.99 2.79 -0.04 -1.26 -4.53 135.00 131.76 1n82 n PRO 1203Ca 0.02 -2.23 -0.35 0.00 -0.04 0.00 0.00 63.50 60.90 1n82 n PRO 1203Cb 0.44 -3.19 -0.13 0.00 -0.04 0.00 0.00 33.50 30.58 1n82 n PRO 1203CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1n82 s ILE 1204N 5.76 3.92 -0.12 0.52 2.07 -1.26 -4.73 121.20 127.35 1n82 s ILE 1204Ca 0.57 -0.32 0.08 0.00 -1.41 0.00 0.00 60.65 59.58 1n82 s ILE 1204Cb 0.11 -2.79 -0.12 0.00 0.13 0.00 0.00 42.46 39.80 1n82 s ILE 1204CO 0.08 0.41 0.23 1.41 -1.91 0.00 0.00 174.94 175.16 1n82 n HIS 1205N 4.46 0.00 -3.86 3.50 8.25 0.19 -4.91 115.22 122.84 1n82 n HIS 1205Ca -0.17 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.18 1n82 n HIS 1205Cb 0.52 -0.13 -0.09 0.00 1.12 0.00 0.00 29.99 31.40 1n82 n HIS 1205CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1n82 s GLY 1206N -2.58 0.04 -0.10 -1.41 0.00 -0.80 -0.79 107.32 101.68 1n82 s GLY 1206Ca -0.01 -0.15 0.02 0.00 0.00 0.00 0.00 44.72 44.58 1n82 s GLY 1206CO 0.34 -0.30 -0.17 -0.42 0.00 0.00 0.00 173.10 172.54 1n82 s ILE 1207N -1.64 2.69 -0.38 0.90 1.01 0.23 -2.16 121.20 121.86 1n82 s ILE 1207Ca -0.13 -0.81 -0.15 0.00 0.00 0.00 0.00 60.65 59.57 1n82 s ILE 1207Cb -0.06 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.33 1n82 s ILE 1207CO 0.01 0.55 0.30 -0.83 0.00 0.00 0.00 174.94 174.97 1n82 s GLY 1208N 0.08 1.96 -0.52 6.18 0.00 0.02 -1.94 107.32 113.11 1n82 s GLY 1208Ca -0.08 -1.50 -0.20 0.00 0.00 0.00 0.00 44.72 42.94 1n82 s GLY 1208CO 0.05 0.91 0.71 1.06 0.00 0.00 0.00 173.10 175.83 1n82 s MET 1209N 1.80 3.18 0.28 2.90 -1.94 -0.01 -1.49 119.30 124.01 1n82 s MET 1209Ca 0.07 -0.72 -0.02 0.00 -1.71 0.00 0.00 55.69 53.31 1n82 s MET 1209Cb -0.18 -4.08 0.39 0.00 2.01 0.00 0.00 34.83 32.97 1n82 s MET 1209CO 0.11 -1.29 1.87 1.96 -0.01 0.00 0.00 175.02 177.66 1n82 h GLN 1210N 9.07 0.95 -5.58 2.03 4.20 -1.34 -0.40 115.11 124.04 1n82 h GLN 1210Ca -0.27 -0.15 -0.34 0.00 0.06 0.00 0.00 58.65 57.96 1n82 h GLN 1210Cb 1.09 -0.17 0.16 0.00 0.30 0.00 0.00 27.48 28.86 1n82 h GLN 1210CO 0.99 0.76 -0.72 0.00 -0.67 0.00 0.00 178.83 179.20 1n82 n ALA 1211N -2.44 -1.77 -2.78 3.87 0.00 -1.26 -1.07 120.51 115.06 1n82 n ALA 1211Ca 0.06 0.06 -0.43 0.00 0.00 0.00 0.00 53.44 53.14 1n82 n ALA 1211Cb 0.16 -3.18 -0.02 0.00 0.00 0.00 0.00 19.45 16.41 1n82 n ALA 1211CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1n82 s HIS 1212N -3.34 2.92 0.40 0.00 3.76 -1.26 -1.74 115.29 116.03 1n82 s HIS 1212Ca 0.15 -1.26 0.08 0.00 -0.15 0.00 0.00 55.06 53.88 1n82 s HIS 1212Cb -0.07 -4.46 -0.04 0.00 1.11 0.00 0.00 32.58 29.12 1n82 s HIS 1212CO 0.71 -1.66 0.23 -1.58 -0.85 0.00 0.00 174.74 171.58 1n82 s TRP 1213N 3.51 2.66 0.31 1.40 0.51 -0.71 -4.83 118.94 121.79 1n82 s TRP 1213Ca 0.39 -0.52 0.02 0.00 -2.12 0.00 0.00 56.10 53.88 1n82 s TRP 1213Cb -0.02 -1.95 0.02 0.00 -0.81 0.00 0.00 33.47 30.71 1n82 s TRP 1213CO -0.08 0.14 0.18 -1.13 -0.51 0.00 0.00 176.95 175.55 1n82 n SER 1214N -1.30 2.17 0.23 2.95 3.41 -0.68 -0.97 113.62 119.43 1n82 n SER 1214Ca -0.00 -2.12 0.09 0.00 -0.26 0.00 0.00 58.87 56.57 1n82 n SER 1214Cb 0.63 0.02 0.58 0.00 -0.26 0.00 0.00 64.21 65.18 1n82 n SER 1214CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1n82 h LEU 1215N 0.00 0.00 0.00 1.04 3.38 -1.87 -3.33 115.31 114.53 1n82 h LEU 1215Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1n82 h LEU 1215Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1n82 h LEU 1215CO 0.33 0.20 -0.17 0.35 0.09 0.00 0.00 178.44 179.24 1n82 n THR 1216N -3.84 0.00 -4.84 0.22 -2.24 -1.26 -4.91 114.28 97.41 1n82 n THR 1216Ca -0.02 -0.29 -0.26 0.00 -2.27 0.00 0.00 64.05 61.22 1n82 n THR 1216Cb 0.30 0.85 -0.16 0.00 -2.10 0.00 0.00 70.33 69.23 1n82 n THR 1216CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1n82 s ARG 1217N -0.92 1.62 0.91 -0.78 0.52 -1.25 -3.79 118.95 115.27 1n82 s ARG 1217Ca 0.00 -0.62 -0.12 0.00 -0.52 0.00 0.00 55.73 54.47 1n82 s ARG 1217Cb 0.00 -1.47 0.14 0.00 0.52 0.00 0.00 34.95 34.13 1n82 s ARG 1217CO 0.00 0.31 1.11 -1.25 0.02 0.00 0.00 175.30 175.48 1n82 s PRO 1218N -0.17 1.13 0.69 3.54 0.04 -1.26 -1.69 135.00 137.28 1n82 s PRO 1218Ca 0.01 0.54 -0.12 0.00 0.04 0.00 0.00 61.00 61.47 1n82 s PRO 1218Cb -0.09 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.64 1n82 s PRO 1218CO 0.01 -2.25 1.07 -1.54 0.04 0.00 0.00 177.00 174.32 1n82 s SER 1219N -3.71 5.28 0.28 6.66 1.04 -1.25 -4.85 113.70 117.15 1n82 s SER 1219Ca 0.64 1.71 -0.02 0.00 0.48 0.00 0.00 55.95 58.76 1n82 s SER 1219Cb -0.16 -2.51 0.43 0.00 0.10 0.00 0.00 66.02 63.88 1n82 s SER 1219CO 0.56 -1.51 1.91 -0.07 0.98 0.00 0.00 173.24 175.10 1n82 h LEU 1220N -0.55 1.01 -0.80 2.42 3.38 -1.99 0.46 115.31 119.24 1n82 h LEU 1220Ca -0.44 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 1n82 h LEU 1220Cb 1.22 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1n82 h LEU 1220CO 0.56 0.66 0.26 0.44 0.09 0.00 0.00 178.44 180.45 1n82 h ASP 1221N 1.15 1.07 -0.84 -0.43 3.32 -1.99 -0.49 116.42 118.21 1n82 h ASP 1221Ca 0.40 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 1n82 h ASP 1221Cb 0.11 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 1n82 h ASP 1221CO -0.14 0.98 0.44 -0.33 -1.72 0.00 0.00 179.24 178.46 1n82 h GLU 1222N 1.11 1.19 -0.34 3.56 5.08 -1.67 -0.94 114.58 122.58 1n82 h GLU 1222Ca 0.25 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1n82 h GLU 1222Cb 0.27 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1n82 h GLU 1222CO -0.01 0.89 -0.07 0.82 -1.00 0.00 0.00 179.01 179.65 1n82 h ILE 1223N 1.18 1.27 -0.44 3.13 2.04 -0.51 -2.30 117.51 121.89 1n82 h ILE 1223Ca 0.29 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1n82 h ILE 1223Cb 0.07 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1n82 h ILE 1223CO -0.04 0.36 0.28 -0.09 0.00 0.00 0.00 178.15 178.66 1n82 h ARG 1224N 0.44 0.58 -0.73 2.37 2.43 -0.99 -0.73 114.38 117.75 1n82 h ARG 1224Ca 0.09 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1n82 h ARG 1224Cb 0.56 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1n82 h ARG 1224CO 0.03 0.41 0.48 0.00 -1.51 0.00 0.00 179.97 179.38 1n82 h ALA 1225N 1.14 0.94 -0.32 2.80 0.00 -1.09 -0.47 119.26 122.26 1n82 h ALA 1225Ca 0.16 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1n82 h ALA 1225Cb -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1n82 h ALA 1225CO -0.03 0.32 -0.01 0.00 0.00 0.00 0.00 179.25 179.53 1n82 h ALA 1226N 1.28 0.43 -0.43 0.00 0.00 -1.29 0.24 119.26 119.50 1n82 h ALA 1226Ca 0.28 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1n82 h ALA 1226Cb -0.08 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1n82 h ALA 1226CO -0.07 0.19 0.20 0.82 0.00 0.00 0.00 179.25 180.39 1n82 h ILE 1227N 0.36 0.95 -0.32 0.00 2.04 -0.89 -0.92 117.51 118.73 1n82 h ILE 1227Ca 0.09 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1n82 h ILE 1227Cb 0.46 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1n82 h ILE 1227CO 0.02 0.07 0.19 -0.33 0.00 0.00 0.00 178.15 178.10 1n82 h GLU 1228N 0.40 0.43 -0.25 2.37 5.08 -0.77 -0.47 114.58 121.37 1n82 h GLU 1228Ca 0.19 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1n82 h GLU 1228Cb 0.12 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1n82 h GLU 1228CO -0.15 0.34 0.13 -0.09 -1.00 0.00 0.00 179.01 178.24 1n82 h ARG 1229N 0.41 0.35 -0.30 2.33 9.65 -0.21 -1.44 114.38 125.18 1n82 h ARG 1229Ca 0.11 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.85 1n82 h ARG 1229Cb 0.02 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.52 1n82 h ARG 1229CO -0.02 0.33 -0.19 1.88 2.80 0.00 0.00 179.97 184.77 1n82 h TYR 1230N 0.29 0.77 0.00 2.20 0.05 -1.13 -2.88 116.97 116.26 1n82 h TYR 1230Ca 0.09 -0.20 -0.01 0.00 0.05 0.00 0.00 58.73 58.66 1n82 h TYR 1230Cb 0.08 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 37.65 1n82 h TYR 1230CO -0.03 0.91 -0.04 0.00 -1.05 0.00 0.00 178.16 177.95 1n82 h ALA 1231N 0.74 1.82 0.00 3.88 0.00 -0.94 -0.54 119.26 124.22 1n82 h ALA 1231Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n82 h ALA 1231Cb 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1n82 h ALA 1231CO 0.05 0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.22 1n82 n SER 1232N -4.32 0.38 0.18 0.00 3.41 -0.55 -0.70 113.62 112.02 1n82 n SER 1232Ca -0.03 0.61 0.14 0.00 -0.26 0.00 0.00 58.87 59.33 1n82 n SER 1232Cb 0.12 -0.68 0.44 0.00 -0.26 0.00 0.00 64.21 63.83 1n82 n SER 1232CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1n82 h LEU 1233N 0.00 0.00 0.00 1.04 3.38 -1.18 -3.47 115.31 115.08 1n82 h LEU 1233Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1n82 h LEU 1233Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1n82 h LEU 1233CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1n82 n GLY 1234N 0.60 0.70 3.89 0.83 0.00 0.12 -5.06 105.19 106.29 1n82 n GLY 1234Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1n82 n GLY 1234CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n82 s VAL 1235N -2.62 4.43 0.36 1.61 -7.23 -1.26 -5.05 120.40 110.66 1n82 s VAL 1235Ca 0.00 0.44 -0.27 0.00 -1.81 0.00 0.00 61.98 60.34 1n82 s VAL 1235Cb 0.00 -3.74 -0.09 0.00 0.56 0.00 0.00 36.38 33.11 1n82 s VAL 1235CO 0.00 -0.86 1.19 -0.69 -0.31 0.00 0.00 175.10 174.43 1n82 s VAL 1236N -3.02 3.11 -0.13 1.32 1.01 0.03 -4.82 120.40 117.90 1n82 s VAL 1236Ca 0.53 1.00 -0.01 0.00 0.00 0.00 0.00 61.98 63.50 1n82 s VAL 1236Cb -0.11 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 1n82 s VAL 1236CO 0.49 0.15 -0.11 -0.76 0.00 0.00 0.00 175.10 174.87 1n82 s LEU 1237N -2.16 2.83 -0.05 3.92 1.43 -1.14 -0.60 118.68 122.91 1n82 s LEU 1237Ca 0.53 -0.28 0.06 0.00 -1.03 0.00 0.00 54.13 53.41 1n82 s LEU 1237Cb -0.33 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1n82 s LEU 1237CO 0.42 0.17 -0.24 -1.00 0.23 0.00 0.00 176.35 175.93 1n82 s HIS 1238N 0.33 2.44 -0.36 0.29 3.76 -0.82 -1.22 115.29 119.72 1n82 s HIS 1238Ca -0.09 -0.64 -0.25 0.00 -0.15 0.00 0.00 55.06 53.93 1n82 s HIS 1238Cb -0.15 -1.59 0.01 0.00 1.11 0.00 0.00 32.58 31.96 1n82 s HIS 1238CO 0.05 -0.16 0.86 0.42 -0.85 0.00 0.00 174.74 175.05 1n82 s ILE 1239N -0.26 4.67 -0.09 0.60 -1.09 -0.18 -0.83 121.20 124.01 1n82 s ILE 1239Ca -0.00 1.08 0.16 0.00 -2.23 0.00 0.00 60.65 59.66 1n82 s ILE 1239Cb -0.13 -4.26 -0.24 0.00 -1.58 0.00 0.00 42.46 36.25 1n82 s ILE 1239CO 0.03 -0.46 0.23 0.35 -1.23 0.00 0.00 174.94 173.86 1n82 n THR 1240N 5.84 0.55 -2.79 2.92 -2.24 -0.16 0.19 114.28 118.59 1n82 n THR 1240Ca 0.05 -0.55 -0.01 0.00 -2.27 0.00 0.00 64.05 61.27 1n82 n THR 1240Cb 0.48 -0.22 0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1n82 n THR 1240CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n82 n GLU 1241N -2.36 1.61 -1.84 -0.78 1.02 -0.23 -4.54 120.64 113.51 1n82 n GLU 1241Ca -0.15 -3.05 -0.42 0.00 -0.02 0.00 0.00 57.16 53.53 1n82 n GLU 1241Cb 0.75 -1.19 -0.02 0.00 -0.02 0.00 0.00 31.44 30.96 1n82 n GLU 1241CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1n82 s LEU 1242N -3.80 4.36 0.10 -4.62 2.96 0.31 -3.88 118.68 114.10 1n82 s LEU 1242Ca 0.24 2.84 -0.20 0.00 -0.22 0.00 0.00 54.13 56.79 1n82 s LEU 1242Cb 0.36 -3.62 0.05 0.00 0.50 0.00 0.00 46.19 43.47 1n82 s LEU 1242CO -0.05 -0.86 0.49 1.51 -1.32 0.00 0.00 176.35 176.12 1n82 s ASP 1243N 0.59 -0.40 -0.37 3.68 1.47 -0.71 -0.99 116.67 119.94 1n82 s ASP 1243Ca 0.64 -0.03 0.02 0.00 1.18 0.00 0.00 52.55 54.37 1n82 s ASP 1243Cb -0.46 0.51 0.11 0.00 -0.34 0.00 0.00 42.92 42.73 1n82 s ASP 1243CO 0.44 -0.81 0.12 -0.69 0.68 0.00 0.00 175.17 174.90 1n82 s VAL 1244N -3.16 1.82 0.40 2.11 1.01 -0.74 -1.74 120.40 120.10 1n82 s VAL 1244Ca -0.01 -2.25 -0.27 0.00 0.00 0.00 0.00 61.98 59.45 1n82 s VAL 1244Cb 0.00 -2.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.96 1n82 s VAL 1244CO -0.07 -0.69 1.36 -0.55 0.00 0.00 0.00 175.10 175.14 1n82 s SER 1245N 0.86 6.30 0.00 3.32 0.15 -0.14 -4.25 113.70 119.93 1n82 s SER 1245Ca 0.12 2.77 0.25 0.00 0.70 0.00 0.00 55.95 59.80 1n82 s SER 1245Cb -0.20 -2.65 1.35 0.00 -1.71 0.00 0.00 66.02 62.81 1n82 s SER 1245CO -0.11 -0.87 1.84 0.23 1.20 0.00 0.00 173.24 175.53 1n82 n MET 1246N 0.21 0.55 -4.87 5.44 2.81 -1.26 -3.56 117.12 116.44 1n82 n MET 1246Ca 0.03 0.03 -0.26 0.00 -1.81 0.00 0.00 57.70 55.69 1n82 n MET 1246Cb 0.42 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.27 1n82 n MET 1246CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1n82 s PHE 1247N -2.31 1.70 0.67 2.03 0.08 -1.26 -4.96 117.98 113.93 1n82 s PHE 1247Ca 0.30 -0.42 -0.15 0.00 0.12 0.00 0.00 56.93 56.78 1n82 s PHE 1247Cb 0.17 -1.12 0.01 0.00 -0.57 0.00 0.00 43.02 41.50 1n82 s PHE 1247CO 0.33 -0.10 1.15 -1.21 -0.10 0.00 0.00 175.22 175.29 1n82 s GLU 1248N -0.18 2.62 0.17 0.44 0.41 -1.26 -4.80 118.70 116.10 1n82 s GLU 1248Ca 0.01 1.54 -0.12 0.00 -0.41 0.00 0.00 54.97 55.99 1n82 s GLU 1248Cb -0.10 -1.91 0.08 0.00 -1.78 0.00 0.00 34.13 30.42 1n82 s GLU 1248CO 0.01 -1.41 1.77 0.35 -0.49 0.00 0.00 175.26 175.48 1n82 h PHE 1249N 0.04 0.84 0.00 1.61 3.57 -1.99 0.67 116.94 121.68 1n82 h PHE 1249Ca -0.47 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 60.99 1n82 h PHE 1249Cb 1.27 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.74 1n82 h PHE 1249CO 0.52 0.64 0.00 0.72 -2.23 0.00 0.00 178.31 177.95 1n82 n HIS 1250N -4.54 0.00 -2.66 0.41 8.25 -1.26 -4.64 115.22 110.78 1n82 n HIS 1250Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 1n82 n HIS 1250Cb 0.11 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 30.91 1n82 n HIS 1250CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1n82 s ASP 1251N -2.57 6.38 -0.30 0.41 -1.08 0.22 -4.87 116.67 114.86 1n82 s ASP 1251Ca 0.23 -0.10 0.11 0.00 -0.52 0.00 0.00 52.55 52.26 1n82 s ASP 1251Cb 0.16 -2.52 0.68 0.00 -1.46 0.00 0.00 42.92 39.78 1n82 s ASP 1251CO 0.37 -1.44 1.70 -2.11 0.52 0.00 0.00 175.17 174.21 1n82 n ARG 1252N 8.23 3.32 -2.10 4.34 1.85 -1.26 -4.73 116.66 126.31 1n82 n ARG 1252Ca 0.06 -3.06 -0.36 0.00 -1.00 0.00 0.00 57.85 53.49 1n82 n ARG 1252Cb 0.48 -2.10 0.02 0.00 -1.05 0.00 0.00 32.46 29.82 1n82 n ARG 1252CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 1n82 s ARG 1253N -3.01 3.12 -0.02 2.89 1.70 -1.26 -4.95 118.95 117.43 1n82 s ARG 1253Ca 0.52 1.75 0.02 0.00 -0.47 0.00 0.00 55.73 57.55 1n82 s ARG 1253Cb 0.42 -1.96 0.04 0.00 -0.57 0.00 0.00 34.95 32.88 1n82 s ARG 1253CO 0.11 -1.07 0.84 0.25 -1.08 0.00 0.00 175.30 174.35 1n82 n THR 1254N -1.47 0.36 1.19 4.99 -2.24 -1.26 -4.78 114.28 111.07 1n82 n THR 1254Ca 0.13 -0.41 0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1n82 n THR 1254Cb 0.50 0.58 0.40 0.00 -2.10 0.00 0.00 70.33 69.71 1n82 n THR 1254CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1n82 n ASP 1255N -0.24 0.71 -4.64 3.42 5.75 -1.26 -4.88 116.55 115.41 1n82 n ASP 1255Ca 0.02 -0.57 -0.38 0.00 -0.01 0.00 0.00 54.79 53.85 1n82 n ASP 1255Cb 0.57 0.09 -0.09 0.00 -1.03 0.00 0.00 41.12 40.66 1n82 n ASP 1255CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1n82 s LEU 1256N -2.66 4.09 0.00 -2.12 1.02 -1.26 -4.93 118.68 112.82 1n82 s LEU 1256Ca 0.21 0.26 0.24 0.00 0.02 0.00 0.00 54.13 54.85 1n82 s LEU 1256Cb 0.19 -2.31 0.28 0.00 0.02 0.00 0.00 46.19 44.38 1n82 s LEU 1256CO 0.56 -0.06 1.26 0.00 0.02 0.00 0.00 176.35 178.14 1n82 n ALA 1257N 4.71 3.70 -3.23 4.21 0.00 -1.26 -4.73 120.51 123.91 1n82 n ALA 1257Ca -0.11 -0.49 -0.14 0.00 0.00 0.00 0.00 53.44 52.70 1n82 n ALA 1257Cb 0.51 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.94 1n82 n ALA 1257CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n82 s ALA 1258N -2.73 -1.11 0.47 0.00 0.00 -1.26 -5.06 121.76 112.06 1n82 s ALA 1258Ca 0.16 0.46 -0.24 0.00 0.00 0.00 0.00 51.96 52.34 1n82 s ALA 1258Cb 0.18 0.29 -0.07 0.00 0.00 0.00 0.00 23.12 23.51 1n82 s ALA 1258CO 0.66 -0.43 1.28 -1.25 0.00 0.00 0.00 175.76 176.01 1n82 s PRO 1259N -2.20 3.65 0.69 0.00 0.04 -1.26 -5.01 135.00 130.92 1n82 s PRO 1259Ca -0.07 2.06 -0.10 0.00 0.04 0.00 0.00 61.00 62.93 1n82 s PRO 1259Cb -0.01 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 32.05 1n82 s PRO 1259CO -0.00 -0.72 1.07 0.95 0.04 0.00 0.00 177.00 178.33 1n82 s THR 1260N -1.37 3.38 0.30 1.26 -4.23 -1.26 -4.88 115.64 108.83 1n82 s THR 1260Ca 0.63 0.35 -0.02 0.00 -1.18 0.00 0.00 61.69 61.48 1n82 s THR 1260Cb -0.36 -3.43 0.27 0.00 1.34 0.00 0.00 72.50 70.32 1n82 s THR 1260CO 0.44 -0.54 1.96 0.77 -0.54 0.00 0.00 174.62 176.71 1n82 h SER 1261N -0.60 0.95 -0.74 3.99 4.64 -1.99 -0.80 113.55 118.99 1n82 h SER 1261Ca -0.45 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 60.80 1n82 h SER 1261Cb 1.26 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 63.09 1n82 h SER 1261CO 0.63 0.68 0.26 -0.08 -0.87 0.00 0.00 176.83 177.45 1n82 h GLU 1262N 1.12 1.14 0.25 4.77 4.57 -1.99 -0.32 114.58 124.12 1n82 h GLU 1262Ca 0.32 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1n82 h GLU 1262Cb -0.07 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.33 1n82 h GLU 1262CO -0.08 0.95 -0.23 0.52 -1.18 0.00 0.00 179.01 178.99 1n82 h MET 1263N 1.09 -0.49 -0.40 1.92 2.86 -1.83 0.24 114.93 118.33 1n82 h MET 1263Ca 0.24 0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.94 1n82 h MET 1263Cb 0.27 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 1n82 h MET 1263CO -0.01 -0.32 0.20 0.82 1.06 0.00 0.00 176.91 178.66 1n82 h ILE 1264N -0.50 0.99 -0.38 -1.22 1.08 -0.97 0.10 117.51 116.60 1n82 h ILE 1264Ca -0.01 -0.14 -0.15 0.00 -0.39 0.00 0.00 64.86 64.17 1n82 h ILE 1264Cb 0.46 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 1n82 h ILE 1264CO -0.04 0.08 -0.33 -0.33 -0.69 0.00 0.00 178.15 176.84 1n82 h GLU 1265N 0.41 0.90 -0.39 2.37 5.08 -0.96 -1.86 114.58 120.13 1n82 h GLU 1265Ca 0.17 -0.45 -0.11 0.00 -1.00 0.00 0.00 59.36 57.96 1n82 h GLU 1265Cb 0.07 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1n82 h GLU 1265CO -0.11 1.11 -0.19 -0.09 -1.00 0.00 0.00 179.01 178.72 1n82 h ARG 1266N 0.71 0.75 -0.49 2.33 9.65 -0.31 -2.12 114.38 124.90 1n82 h ARG 1266Ca 0.07 -0.28 -0.05 0.00 -1.10 0.00 0.00 59.98 58.62 1n82 h ARG 1266Cb 0.91 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.43 1n82 h ARG 1266CO 0.08 0.88 0.12 0.37 2.80 0.00 0.00 179.97 184.23 1n82 h GLN 1267N 0.66 0.74 -0.13 0.20 4.15 -0.70 -0.09 115.11 119.95 1n82 h GLN 1267Ca 0.10 -0.14 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 1n82 h GLN 1267Cb 0.68 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 1n82 h GLN 1267CO 0.05 0.68 0.07 0.00 -1.93 0.00 0.00 178.83 177.70 1n82 h ALA 1268N 1.41 0.16 -0.65 3.38 0.00 -0.98 0.17 119.26 122.75 1n82 h ALA 1268Ca 0.16 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1n82 h ALA 1268Cb 0.27 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1n82 h ALA 1268CO -0.00 -0.30 0.43 1.49 0.00 0.00 0.00 179.25 180.87 1n82 h GLU 1269N 0.11 0.86 -0.33 0.00 4.81 -1.09 -0.65 114.58 118.28 1n82 h GLU 1269Ca 0.04 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1n82 h GLU 1269Cb 0.07 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 1n82 h GLU 1269CO -0.01 0.57 0.15 -0.09 -0.73 0.00 0.00 179.01 178.90 1n82 h ARG 1270N 0.88 0.31 -0.23 1.92 9.65 -0.75 0.73 114.38 126.90 1n82 h ARG 1270Ca 0.24 -0.02 -0.10 0.00 -1.10 0.00 0.00 59.98 59.00 1n82 h ARG 1270Cb -0.10 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.39 1n82 h ARG 1270CO -0.05 0.21 -0.30 1.88 2.80 0.00 0.00 179.97 184.51 1n82 h TYR 1271N 0.32 0.51 -0.45 2.20 0.05 -0.80 -0.05 116.97 118.76 1n82 h TYR 1271Ca 0.14 -0.12 -0.08 0.00 0.05 0.00 0.00 58.73 58.73 1n82 h TYR 1271Cb 0.07 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 1n82 h TYR 1271CO -0.11 0.71 -0.02 0.78 -1.05 0.00 0.00 178.16 178.46 1n82 h GLY 1272N 1.05 0.88 1.19 3.88 0.00 -0.62 -1.82 103.07 107.64 1n82 h GLY 1272Ca 0.05 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.68 1n82 h GLY 1272CO 0.06 0.61 0.27 1.46 0.00 0.00 0.00 176.54 178.94 1n82 h GLN 1273N 0.66 1.03 -0.23 4.80 4.20 -0.44 -2.01 115.11 123.11 1n82 h GLN 1273Ca 0.12 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 1n82 h GLN 1273Cb 0.53 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1n82 h GLN 1273CO 0.03 0.84 -0.06 0.82 -0.67 0.00 0.00 178.83 179.79 1n82 h ILE 1274N 1.01 1.28 0.00 2.54 2.04 -0.86 -2.20 117.51 121.32 1n82 h ILE 1274Ca 0.23 -1.06 -0.10 0.00 1.00 0.00 0.00 64.86 64.94 1n82 h ILE 1274Cb 0.20 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1n82 h ILE 1274CO -0.02 0.33 -0.47 -0.26 0.00 0.00 0.00 178.15 177.73 1n82 h PHE 1275N 0.19 0.00 -0.37 1.37 0.04 -1.29 -0.18 116.94 116.69 1n82 h PHE 1275Ca 0.06 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 1n82 h PHE 1275Cb 0.52 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.65 1n82 h PHE 1275CO 0.05 0.47 -0.20 0.00 -0.60 0.00 0.00 178.31 178.02 1n82 h ALA 1276N 1.53 0.95 -0.24 2.45 0.00 -1.28 0.19 119.26 122.87 1n82 h ALA 1276Ca -0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 1n82 h ALA 1276Cb 0.87 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1n82 h ALA 1276CO 0.06 0.61 -0.52 1.25 0.00 0.00 0.00 179.25 180.65 1n82 h LEU 1277N 0.63 0.87 -0.41 0.00 5.85 -0.87 -0.70 115.31 120.68 1n82 h LEU 1277Ca 0.09 -0.55 0.02 0.00 0.84 0.00 0.00 57.88 58.28 1n82 h LEU 1277Cb 0.69 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1n82 h LEU 1277CO 0.05 1.26 0.23 -0.26 -0.34 0.00 0.00 178.44 179.39 1n82 h PHE 1278N 0.51 0.43 -0.92 1.25 0.04 -0.89 -1.49 116.94 115.87 1n82 h PHE 1278Ca 0.00 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.80 1n82 h PHE 1278Cb 1.13 -0.14 -0.05 0.00 2.20 0.00 0.00 35.95 39.10 1n82 h PHE 1278CO 0.08 0.25 0.61 -0.22 -0.60 0.00 0.00 178.31 178.42 1n82 h LYS 1279N 0.47 1.19 -0.32 1.51 3.64 -0.90 -0.72 116.57 121.45 1n82 h LYS 1279Ca 0.17 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1n82 h LYS 1279Cb 0.03 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1n82 h LYS 1279CO -0.09 0.79 0.19 1.49 -2.27 0.00 0.00 179.45 179.56 1n82 h GLU 1280N 1.23 0.43 -0.76 1.90 4.81 -0.16 -1.24 114.58 120.79 1n82 h GLU 1280Ca 0.34 -0.03 -0.30 0.00 -0.13 0.00 0.00 59.36 59.24 1n82 h GLU 1280Cb -0.12 -0.09 -0.18 0.00 0.63 0.00 0.00 28.75 28.99 1n82 h GLU 1280CO -0.08 0.30 0.34 0.66 -0.73 0.00 0.00 179.01 179.50 1n82 n TYR 1281N -4.47 2.43 0.09 0.92 4.01 -0.38 -4.60 117.16 115.16 1n82 n TYR 1281Ca 0.02 -1.44 0.20 0.00 -0.16 0.00 0.00 57.90 56.51 1n82 n TYR 1281Cb 0.08 -0.73 0.75 0.00 -0.31 0.00 0.00 39.34 39.13 1n82 n TYR 1281CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 1n82 h ARG 1282N 1.92 0.00 0.00 -0.72 0.11 -0.14 -0.34 114.38 115.20 1n82 h ARG 1282Ca 0.37 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.42 1n82 h ARG 1282Cb 2.39 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 33.47 1n82 h ARG 1282CO 0.79 0.00 -0.13 -0.44 0.10 0.00 0.00 179.97 180.29 1n82 h ASP 1283N 0.00 0.00 0.00 0.08 3.32 -1.84 -3.21 116.42 114.77 1n82 h ASP 1283Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1n82 h ASP 1283Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1n82 h ASP 1283CO -0.00 0.13 -0.34 1.33 -1.72 0.00 0.00 179.24 178.65 1n82 n VAL 1284N -3.70 0.00 -3.97 -1.35 0.24 -0.22 -4.96 118.33 104.36 1n82 n VAL 1284Ca -0.02 -0.36 -0.35 0.00 -2.04 0.00 0.00 64.34 61.57 1n82 n VAL 1284Cb 0.25 0.94 -0.12 0.00 -1.47 0.00 0.00 33.84 33.44 1n82 n VAL 1284CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1n82 s ILE 1285N -1.56 4.26 -0.57 1.34 1.01 -0.70 -2.87 121.20 122.11 1n82 s ILE 1285Ca 0.02 -0.20 0.08 0.00 0.00 0.00 0.00 60.65 60.54 1n82 s ILE 1285Cb 0.04 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1n82 s ILE 1285CO 0.21 0.41 0.46 0.00 0.00 0.00 0.00 174.94 176.01 1n82 n GLN 1286N 4.29 3.27 -3.64 2.79 1.13 -0.36 -4.62 117.38 120.25 1n82 n GLN 1286Ca -0.17 -0.28 -0.14 0.00 -1.94 0.00 0.00 57.00 54.47 1n82 n GLN 1286Cb 0.52 -0.95 -0.07 0.00 0.11 0.00 0.00 30.24 29.84 1n82 n GLN 1286CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1n82 s SER 1287N -1.47 -0.68 -0.23 1.08 1.04 -1.26 -1.72 113.70 110.46 1n82 s SER 1287Ca 0.05 1.24 -0.00 0.00 0.48 0.00 0.00 55.95 57.72 1n82 s SER 1287Cb 0.06 1.25 0.06 0.00 0.10 0.00 0.00 66.02 67.49 1n82 s SER 1287CO 0.27 -0.28 -0.02 -0.69 0.98 0.00 0.00 173.24 173.50 1n82 s VAL 1288N 0.15 1.26 -0.13 5.02 1.01 0.19 -1.01 120.40 126.88 1n82 s VAL 1288Ca -0.01 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 1n82 s VAL 1288Cb -0.04 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1n82 s VAL 1288CO 0.02 -0.17 -0.02 -0.89 0.00 0.00 0.00 175.10 174.04 1n82 s THR 1289N 1.51 4.05 0.21 3.92 2.01 0.13 -0.59 115.64 126.89 1n82 s THR 1289Ca -0.03 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 61.55 1n82 s THR 1289Cb -0.18 -2.75 -0.07 0.00 0.01 0.00 0.00 72.50 69.51 1n82 s THR 1289CO -0.08 0.53 0.53 -0.36 -0.69 0.00 0.00 174.62 174.55 1n82 s PHE 1290N -0.09 3.45 -1.46 4.92 0.40 -0.54 -0.53 117.98 124.14 1n82 s PHE 1290Ca 0.03 0.86 -0.08 0.00 -0.60 0.00 0.00 56.93 57.14 1n82 s PHE 1290Cb -0.13 -2.25 0.03 0.00 0.51 0.00 0.00 43.02 41.18 1n82 s PHE 1290CO 0.02 0.31 2.59 1.87 0.70 0.00 0.00 175.22 180.71 1n82 n TRP 1291N 0.02 2.60 0.00 0.36 -0.00 -0.16 -1.60 117.44 118.66 1n82 n TRP 1291Ca -0.01 -2.95 0.00 0.00 -0.00 0.00 0.00 57.50 54.55 1n82 n TRP 1291Cb 0.52 -2.17 0.00 0.00 -0.00 0.00 0.00 31.31 29.66 1n82 n TRP 1291CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1n82 n GLY 1292N 2.72 0.85 0.00 5.87 0.00 -1.25 -4.68 105.19 108.70 1n82 n GLY 1292Ca 0.67 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1n82 n GLY 1292CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1n82 n ILE 1293N 7.02 0.00 -4.03 -0.61 3.06 -1.26 -4.16 119.36 119.37 1n82 n ILE 1293Ca 0.00 0.00 -0.08 0.00 -2.50 0.00 0.00 62.75 60.17 1n82 n ILE 1293Cb 0.00 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.08 1n82 n ILE 1293CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1n82 s ALA 1294N -1.00 0.32 -1.84 1.51 0.00 -1.26 -3.74 121.76 115.76 1n82 s ALA 1294Ca 0.00 -1.02 0.17 0.00 0.00 0.00 0.00 51.96 51.12 1n82 s ALA 1294Cb 0.00 0.29 0.99 0.00 0.00 0.00 0.00 23.12 24.40 1n82 s ALA 1294CO 0.00 -0.37 1.46 -0.25 0.00 0.00 0.00 175.76 176.61 1n82 n ASP 1295N 0.27 0.00 0.00 0.00 8.00 -0.08 -1.65 116.55 123.10 1n82 n ASP 1295Ca -0.15 -0.38 0.10 0.00 0.71 0.00 0.00 54.79 55.07 1n82 n ASP 1295Cb 0.60 -0.08 0.51 0.00 -0.02 0.00 0.00 41.12 42.13 1n82 n ASP 1295CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1n82 n ASP 1296N -1.08 0.00 -3.64 -2.24 5.75 -1.26 -4.62 116.55 109.46 1n82 n ASP 1296Ca 0.12 0.20 -0.14 0.00 -0.01 0.00 0.00 54.79 54.96 1n82 n ASP 1296Cb 0.08 -0.38 -0.13 0.00 -1.03 0.00 0.00 41.12 39.67 1n82 n ASP 1296CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1n82 s HIS 1297N -2.75 -0.42 -0.24 2.11 5.04 -0.66 -5.10 115.29 113.27 1n82 s HIS 1297Ca 0.16 0.90 -0.20 0.00 -1.54 0.00 0.00 55.06 54.38 1n82 s HIS 1297Cb 0.14 -0.07 0.06 0.00 0.04 0.00 0.00 32.58 32.76 1n82 s HIS 1297CO 0.35 -0.39 0.63 -0.08 -2.34 0.00 0.00 174.74 172.91 1n82 s THR 1298N 2.42 -0.00 0.63 0.89 -1.32 -1.26 -4.58 115.64 112.42 1n82 s THR 1298Ca 0.02 0.01 0.39 0.00 -1.21 0.00 0.00 61.69 60.90 1n82 s THR 1298Cb -0.12 -0.88 0.41 0.00 -1.51 0.00 0.00 72.50 70.40 1n82 s THR 1298CO -0.09 0.00 2.33 4.11 -2.21 0.00 0.00 174.62 178.76 1n82 h TRP 1299N 5.55 0.00 0.00 9.09 5.08 -1.97 -1.96 115.95 131.74 1n82 h TRP 1299Ca -0.29 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.68 1n82 h TRP 1299Cb 1.18 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.34 1n82 h TRP 1299CO 0.33 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 178.77 1n82 n LEU 1300N -3.36 0.00 0.16 0.11 4.77 -1.26 -2.07 117.00 115.35 1n82 n LEU 1300Ca -0.03 0.31 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1n82 n LEU 1300Cb 0.08 -0.31 0.54 0.00 -2.33 0.00 0.00 43.42 41.39 1n82 n LEU 1300CO 0.23 -0.10 0.89 0.44 -1.33 0.00 0.00 177.39 177.52 1n82 h ASP 1301N 0.00 0.00 0.00 -1.43 3.32 -1.53 -3.31 116.42 113.47 1n82 h ASP 1301Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1n82 h ASP 1301Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1n82 h ASP 1301CO 0.00 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.11 1n82 n ASN 1302N -2.44 0.53 -4.06 6.45 3.02 -0.88 -1.68 115.26 116.19 1n82 n ASN 1302Ca 0.02 -1.05 -0.21 0.00 -0.03 0.00 0.00 54.58 53.31 1n82 n ASN 1302Cb 0.25 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.27 1n82 n ASN 1302CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1n82 s PHE 1303N -0.05 1.09 -2.07 3.10 5.36 -0.94 -3.15 117.98 121.31 1n82 s PHE 1303Ca 0.00 -0.23 0.18 0.00 -0.96 0.00 0.00 56.93 55.92 1n82 s PHE 1303Cb 0.00 -0.72 0.93 0.00 -0.34 0.00 0.00 43.02 42.89 1n82 s PHE 1303CO 0.00 -0.04 1.62 -0.35 -1.46 0.00 0.00 175.22 174.98 1n82 n PRO 1304N 2.91 1.19 -4.03 10.12 -0.04 -1.26 -4.42 135.00 139.47 1n82 n PRO 1304Ca -0.15 -0.29 -0.33 0.00 -0.04 0.00 0.00 63.50 62.69 1n82 n PRO 1304Cb 0.55 -1.30 -0.15 0.00 -0.04 0.00 0.00 33.50 32.57 1n82 n PRO 1304CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1n82 s VAL 1305N -1.94 2.40 0.23 0.52 1.01 -1.25 -5.08 120.40 116.28 1n82 s VAL 1305Ca 0.27 -1.53 -0.31 0.00 0.00 0.00 0.00 61.98 60.41 1n82 s VAL 1305Cb 0.13 -2.38 -0.11 0.00 0.00 0.00 0.00 36.38 34.01 1n82 s VAL 1305CO 0.21 -0.02 1.66 -2.28 0.00 0.00 0.00 175.10 174.67 1n82 s HIS 1306N 1.15 2.89 -1.69 5.22 2.46 -1.19 -1.98 115.29 122.16 1n82 s HIS 1306Ca -0.07 0.53 -0.01 0.00 0.47 0.00 0.00 55.06 55.97 1n82 s HIS 1306Cb -0.20 -4.08 0.00 0.00 -0.13 0.00 0.00 32.58 28.18 1n82 s HIS 1306CO -0.04 -3.94 0.16 0.41 -2.47 0.00 0.00 174.74 168.86 1n82 n GLY 1307N 3.40 -0.48 3.36 1.59 0.00 -1.14 -4.97 105.19 106.95 1n82 n GLY 1307Ca 0.13 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1n82 n GLY 1307CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1n82 s ARG 1308N -5.19 3.25 0.39 1.61 3.52 -0.68 -5.03 118.95 116.82 1n82 s ARG 1308Ca 0.08 -0.74 -0.26 0.00 -0.13 0.00 0.00 55.73 54.68 1n82 s ARG 1308Cb -0.03 -3.31 -0.09 0.00 -1.56 0.00 0.00 34.95 29.96 1n82 s ARG 1308CO 0.10 -0.35 1.17 0.21 -0.81 0.00 0.00 175.30 175.61 1n82 s LYS 1309N 1.52 4.13 0.26 5.12 2.47 -1.26 -4.27 119.74 127.71 1n82 s LYS 1309Ca 0.04 1.84 0.05 0.00 -1.56 0.00 0.00 55.97 56.34 1n82 s LYS 1309Cb -0.16 -2.73 -0.06 0.00 -1.46 0.00 0.00 37.83 33.42 1n82 s LYS 1309CO 0.02 -0.26 -0.02 1.21 0.16 0.00 0.00 175.35 176.46 1n82 s ASN 1310N -1.09 2.22 -0.40 1.43 3.84 -1.26 -4.97 114.94 114.70 1n82 s ASN 1310Ca 0.56 -1.23 0.10 0.00 0.21 0.00 0.00 52.86 52.50 1n82 s ASN 1310Cb -0.31 -0.06 0.31 0.00 -0.55 0.00 0.00 41.25 40.64 1n82 s ASN 1310CO 0.39 -0.46 0.67 0.79 -2.79 0.00 0.00 177.10 175.70 1n82 n TRP 1311N -0.51 0.34 1.26 0.43 8.01 -1.26 -4.89 117.44 120.83 1n82 n TRP 1311Ca -0.05 -3.75 0.13 0.00 -1.31 0.00 0.00 57.50 52.52 1n82 n TRP 1311Cb 0.64 -0.41 0.32 0.00 -2.01 0.00 0.00 31.31 29.86 1n82 n TRP 1311CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 1n82 n PRO 1312N 0.66 1.66 -2.99 -0.99 -0.02 -1.26 -4.71 135.00 127.35 1n82 n PRO 1312Ca 0.24 -1.16 -0.13 0.00 -2.02 0.00 0.00 63.50 60.43 1n82 n PRO 1312Cb 0.59 -1.48 -0.02 0.00 -0.02 0.00 0.00 33.50 32.57 1n82 n PRO 1312CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n82 n LEU 1313N 0.35 0.00 0.17 2.45 4.77 -1.26 -1.78 117.00 121.69 1n82 n LEU 1313Ca 0.15 -1.34 0.12 0.00 -0.03 0.00 0.00 56.01 54.91 1n82 n LEU 1313Cb 0.43 0.11 0.11 0.00 -2.33 0.00 0.00 43.42 41.75 1n82 n LEU 1313CO 0.19 -0.25 0.49 -0.07 -1.33 0.00 0.00 177.39 176.43 1n82 h LEU 1314N 0.00 0.00 -8.95 2.23 3.38 -1.95 -3.46 115.31 106.56 1n82 h LEU 1314Ca -0.17 -0.01 -0.69 0.00 0.09 0.00 0.00 57.88 57.10 1n82 h LEU 1314Cb 0.55 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.08 1n82 h LEU 1314CO 0.29 0.00 -0.84 -0.36 0.09 0.00 0.00 178.44 177.62 1n82 s PHE 1315N -3.27 2.44 0.46 1.13 0.08 -1.25 -1.12 117.98 116.46 1n82 s PHE 1315Ca 0.04 -0.32 -0.04 0.00 0.12 0.00 0.00 56.93 56.73 1n82 s PHE 1315Cb 0.07 -1.35 0.10 0.00 -0.57 0.00 0.00 43.02 41.27 1n82 s PHE 1315CO 0.72 0.30 0.63 -0.40 -0.10 0.00 0.00 175.22 176.37 1n82 n ASP 1316N 1.17 0.40 0.28 1.36 5.68 0.19 -0.90 116.55 124.73 1n82 n ASP 1316Ca -0.17 -1.44 0.19 0.00 -0.50 0.00 0.00 54.79 52.87 1n82 n ASP 1316Cb 0.53 -0.45 0.88 0.00 -1.14 0.00 0.00 41.12 40.93 1n82 n ASP 1316CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1n82 h GLU 1317N 0.00 0.00 -0.47 0.11 5.08 -1.90 0.47 114.58 117.87 1n82 h GLU 1317Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1n82 h GLU 1317Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1n82 h GLU 1317CO 0.18 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.23 1n82 n GLN 1318N -2.97 2.13 -1.70 2.33 3.00 -1.26 -4.59 117.38 114.31 1n82 n GLN 1318Ca -0.01 -1.75 -0.15 0.00 -0.01 0.00 0.00 57.00 55.09 1n82 n GLN 1318Cb 0.19 -1.39 -0.04 0.00 0.00 0.00 0.00 30.24 29.00 1n82 n GLN 1318CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1n82 n HIS 1319N 0.92 -0.23 -3.48 1.08 8.25 0.15 -5.02 115.22 116.90 1n82 n HIS 1319Ca 0.16 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.30 1n82 n HIS 1319Cb 0.42 -2.73 -0.05 0.00 1.12 0.00 0.00 29.99 28.74 1n82 n HIS 1319CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1n82 s LYS 1320N -3.72 3.79 0.23 -0.41 -0.14 -1.26 -4.76 119.74 113.48 1n82 s LYS 1320Ca 0.00 0.22 -0.30 0.00 -1.36 0.00 0.00 55.97 54.53 1n82 s LYS 1320Cb 0.00 -2.79 -0.09 0.00 -1.68 0.00 0.00 37.83 33.27 1n82 s LYS 1320CO 0.00 0.41 1.31 -1.25 -0.76 0.00 0.00 175.35 175.06 1n82 s PRO 1321N -2.50 4.39 0.60 -1.68 0.04 -1.26 -0.63 135.00 133.95 1n82 s PRO 1321Ca 0.42 2.10 -0.03 0.00 0.04 0.00 0.00 61.00 63.53 1n82 s PRO 1321Cb -0.12 -3.16 0.03 0.00 0.04 0.00 0.00 34.50 31.29 1n82 s PRO 1321CO 0.21 -0.23 0.87 0.15 0.04 0.00 0.00 177.00 178.04 1n82 s LYS 1322N -0.54 2.55 0.39 4.56 1.02 -0.27 -4.85 119.74 122.60 1n82 s LYS 1322Ca 0.55 -0.42 0.19 0.00 0.02 0.00 0.00 55.97 56.31 1n82 s LYS 1322Cb -0.37 -2.34 1.13 0.00 -0.52 0.00 0.00 37.83 35.72 1n82 s LYS 1322CO 0.42 -0.84 1.74 -1.35 -0.92 0.00 0.00 175.35 174.39 1n82 h PRO 1323N -0.17 0.36 -0.81 -1.68 0.11 -1.90 -0.67 132.00 127.25 1n82 h PRO 1323Ca -0.44 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.71 1n82 h PRO 1323Cb 1.29 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 1n82 h PRO 1323CO 0.57 0.24 0.53 0.00 -0.21 0.00 0.00 178.00 179.12 1n82 h ALA 1324N 1.64 1.61 0.25 -0.75 0.00 -1.84 -0.81 119.26 119.35 1n82 h ALA 1324Ca 0.64 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.52 1n82 h ALA 1324Cb 1.63 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1n82 h ALA 1324CO -0.35 0.26 -0.14 0.35 0.00 0.00 0.00 179.25 179.37 1n82 h PHE 1325N 0.88 -0.37 -0.71 0.00 3.57 -1.22 -0.20 116.94 118.88 1n82 h PHE 1325Ca 0.35 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 1n82 h PHE 1325Cb 0.23 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1n82 h PHE 1325CO -0.00 -0.23 0.21 -1.49 -2.23 0.00 0.00 178.31 174.57 1n82 h TRP 1326N -0.37 1.15 -0.28 0.41 4.06 -1.30 -0.78 115.95 118.84 1n82 h TRP 1326Ca -0.03 -0.12 -0.14 0.00 2.06 0.00 0.00 58.89 60.66 1n82 h TRP 1326Cb 0.31 -0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 28.12 1n82 h TRP 1326CO -0.08 0.92 -0.41 0.00 -3.56 0.00 0.00 178.44 175.30 1n82 h ARG 1327N 1.07 0.68 -0.55 0.49 2.47 -1.07 -2.35 114.38 115.11 1n82 h ARG 1327Ca 0.23 -0.36 0.01 0.00 -1.26 0.00 0.00 59.98 58.60 1n82 h ARG 1327Cb 0.32 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.62 1n82 h ARG 1327CO -0.01 0.97 0.35 0.00 0.56 0.00 0.00 179.97 181.85 1n82 h ALA 1328N 0.98 0.70 0.00 0.04 0.00 -0.59 -2.44 119.26 117.95 1n82 h ALA 1328Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1n82 h ALA 1328Cb 0.95 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1n82 h ALA 1328CO 0.09 0.11 0.00 1.33 0.00 0.00 0.00 179.25 180.77 1n82 n VAL 1329N -4.73 0.01 0.61 0.00 0.24 -0.34 -3.27 118.33 110.86 1n82 n VAL 1329Ca 0.04 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.47 1n82 n VAL 1329Cb 0.04 -0.51 0.43 0.00 -1.47 0.00 0.00 33.84 32.33 1n82 n VAL 1329CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1n82 n SER 1330N -1.24 0.75 0.00 -1.34 3.41 -0.89 -5.09 113.62 109.22 1n82 n SER 1330Ca 0.16 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 1n82 n SER 1330Cb 0.22 -0.78 0.73 0.00 -0.26 0.00 0.00 64.21 64.12 1n82 n SER 1330CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21