#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvi s TYR 1003N 0.00 3.59 -0.30 -1.42 1.51 -1.26 -4.94 117.35 114.53 1wvi s TYR 1003Ca 0.00 1.19 0.22 0.00 -1.01 0.00 0.00 57.07 57.47 1wvi s TYR 1003Cb 0.00 -2.73 -0.23 0.00 -0.11 0.00 0.00 41.96 38.89 1wvi s TYR 1003CO 0.00 0.16 0.69 1.63 -1.11 0.00 0.00 175.55 176.91 1wvi n LYS 1004N 3.52 0.49 -3.94 -0.62 4.76 0.17 -4.99 118.16 117.54 1wvi n LYS 1004Ca -0.03 -0.11 -0.10 0.00 -2.87 0.00 0.00 58.31 55.20 1wvi n LYS 1004Cb 0.51 -1.56 -0.10 0.00 -1.84 0.00 0.00 35.03 32.04 1wvi n LYS 1004CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1wvi s GLY 1005N -4.12 0.18 -0.09 0.72 0.00 -1.07 -4.09 107.32 98.86 1wvi s GLY 1005Ca -0.03 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.26 1wvi s GLY 1005CO 0.88 -0.56 -0.15 -0.19 0.00 0.00 0.00 173.10 173.08 1wvi s TYR 1006N -1.64 1.80 -0.18 1.90 1.51 -0.86 -2.31 117.35 117.57 1wvi s TYR 1006Ca -0.14 -0.75 -0.07 0.00 -1.01 0.00 0.00 57.07 55.10 1wvi s TYR 1006Cb -0.08 -1.29 -0.04 0.00 -0.11 0.00 0.00 41.96 40.44 1wvi s TYR 1006CO -0.01 -0.37 0.05 -0.51 -1.11 0.00 0.00 175.55 173.60 1wvi s LEU 1007N 0.76 3.72 -0.04 -1.29 1.43 -0.17 -0.97 118.68 122.13 1wvi s LEU 1007Ca -0.12 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 1wvi s LEU 1007Cb -0.16 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.13 1wvi s LEU 1007CO 0.02 0.16 -0.07 -0.63 0.23 0.00 0.00 176.35 176.06 1wvi s ILE 1008N 0.46 0.67 0.50 -0.59 1.01 -0.09 0.49 121.20 123.66 1wvi s ILE 1008Ca 0.02 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.23 1wvi s ILE 1008Cb -0.13 -0.64 -0.08 0.00 0.01 0.00 0.00 42.46 41.63 1wvi s ILE 1008CO 0.01 0.24 1.05 -0.62 0.00 0.00 0.00 174.94 175.61 1wvi s ASP 1009N 0.54 6.23 0.00 3.58 3.68 -0.09 0.03 116.67 130.64 1wvi s ASP 1009Ca -0.08 1.94 0.00 0.00 2.13 0.00 0.00 52.55 56.54 1wvi s ASP 1009Cb -0.12 -2.56 0.00 0.00 -1.45 0.00 0.00 42.92 38.79 1wvi s ASP 1009CO 0.01 -0.86 0.00 0.18 0.13 0.00 0.00 175.17 174.63 1wvi n LEU 1010N -1.11 0.74 -4.71 -1.34 4.77 -1.25 -4.25 117.00 109.85 1wvi n LEU 1010Ca 0.09 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 1wvi n LEU 1010Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1wvi n LEU 1010CO 0.41 0.00 1.31 -0.62 -1.33 0.00 0.00 177.39 177.16 1wvi s ASP 1011N -1.00 6.52 0.00 -1.43 2.15 -1.26 -1.87 116.67 119.78 1wvi s ASP 1011Ca 0.00 2.67 0.00 0.00 0.43 0.00 0.00 52.55 55.65 1wvi s ASP 1011Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1wvi s ASP 1011CO 0.00 -0.89 0.00 0.61 -0.17 0.00 0.00 175.17 174.72 1wvi n GLY 1012N 3.91 2.77 0.53 2.66 0.00 0.31 -4.88 105.19 110.50 1wvi n GLY 1012Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 1wvi n GLY 1012CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wvi n THR 1013N -2.00 1.23 -0.06 2.61 -1.04 -0.78 -3.33 114.28 110.91 1wvi n THR 1013Ca 0.00 0.13 0.12 0.00 -2.04 0.00 0.00 64.05 62.26 1wvi n THR 1013Cb 0.00 -1.92 0.27 0.00 -1.82 0.00 0.00 70.33 66.87 1wvi n THR 1013CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1wvi n ILE 1014N -3.92 0.77 0.00 12.58 -5.35 -0.99 -4.54 119.36 117.90 1wvi n ILE 1014Ca -0.14 -0.88 0.00 0.00 -0.27 0.00 0.00 62.75 61.46 1wvi n ILE 1014Cb 0.40 0.73 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 1wvi n ILE 1014CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wvi n TYR 1015N 1.59 0.00 -3.57 4.28 4.11 -1.26 -4.05 117.16 118.27 1wvi n TYR 1015Ca 0.22 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.92 1wvi n TYR 1015Cb 0.62 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.81 1wvi n TYR 1015CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1wvi s LYS 1016N -2.00 0.11 7.41 -3.48 2.20 0.03 0.11 119.74 124.12 1wvi s LYS 1016Ca 0.00 0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.80 1wvi s LYS 1016Cb 0.00 -1.20 0.00 0.00 -1.51 0.00 0.00 37.83 35.12 1wvi s LYS 1016CO 0.00 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 174.82 1wvi n GLY 1017N 5.31 2.89 0.11 5.54 0.00 -1.26 -1.17 105.19 116.61 1wvi n GLY 1017Ca -0.06 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1wvi n GLY 1017CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvi h LYS 1018N 0.00 0.00 -7.09 1.61 6.56 -2.03 -3.46 116.57 112.15 1wvi h LYS 1018Ca 0.00 0.00 -0.46 0.00 -1.06 0.00 0.00 60.65 59.13 1wvi h LYS 1018Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1wvi h LYS 1018CO 0.00 0.00 0.36 -0.51 -2.06 0.00 0.00 179.45 177.24 1wvi s ASP 1019N -5.06 6.67 0.38 0.86 -0.00 -0.32 -5.08 116.67 114.13 1wvi s ASP 1019Ca 0.04 1.73 0.08 0.00 -0.00 0.00 0.00 52.55 54.40 1wvi s ASP 1019Cb 0.10 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.46 1wvi s ASP 1019CO 0.74 -0.55 0.30 0.00 -0.00 0.00 0.00 175.17 175.66 1wvi s ARG 1020N -3.40 2.53 -0.36 8.23 1.70 -1.26 -0.79 118.95 125.59 1wvi s ARG 1020Ca 0.63 -1.51 0.01 0.00 -0.47 0.00 0.00 55.73 54.39 1wvi s ARG 1020Cb -0.11 -2.33 0.11 0.00 -0.57 0.00 0.00 34.95 32.05 1wvi s ARG 1020CO 0.19 -0.06 0.15 0.42 -1.08 0.00 0.00 175.30 174.92 1wvi s ILE 1021N -2.43 1.21 0.37 4.99 1.01 -1.26 -4.70 121.20 120.40 1wvi s ILE 1021Ca 0.44 -1.94 0.15 0.00 0.00 0.00 0.00 60.65 59.30 1wvi s ILE 1021Cb -0.03 -1.88 0.36 0.00 0.01 0.00 0.00 42.46 40.92 1wvi s ILE 1021CO 0.26 -0.76 1.78 1.55 0.00 0.00 0.00 174.94 177.78 1wvi h PRO 1022N 7.51 0.47 -0.62 2.79 0.13 -1.98 0.27 132.00 140.57 1wvi h PRO 1022Ca -0.08 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 1wvi h PRO 1022Cb 0.98 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.98 1wvi h PRO 1022CO 0.48 0.31 0.25 0.00 -0.23 0.00 0.00 178.00 178.81 1wvi h ALA 1023N 1.64 1.26 -0.08 -0.56 0.00 -1.94 -0.05 119.26 119.53 1wvi h ALA 1023Ca 0.58 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1wvi h ALA 1023Cb 1.31 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wvi h ALA 1023CO -0.31 0.54 -0.00 0.78 0.00 0.00 0.00 179.25 180.26 1wvi h GLY 1024N 1.00 0.15 0.86 0.00 0.00 -0.73 -0.53 103.07 103.82 1wvi h GLY 1024Ca 0.21 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1wvi h GLY 1024CO -0.02 0.11 0.54 0.83 0.00 0.00 0.00 176.54 178.00 1wvi h GLU 1025N -0.16 1.02 -0.44 4.80 5.08 -1.11 -1.31 114.58 122.46 1wvi h GLU 1025Ca 0.02 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1wvi h GLU 1025Cb 0.36 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1wvi h GLU 1025CO 0.00 0.68 -0.00 0.22 -1.00 0.00 0.00 179.01 178.91 1wvi h ASP 1026N 1.05 0.68 -0.47 1.42 3.58 -0.88 -2.30 116.42 119.49 1wvi h ASP 1026Ca 0.34 -0.15 0.04 0.00 0.42 0.00 0.00 57.03 57.68 1wvi h ASP 1026Cb 0.02 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 40.85 1wvi h ASP 1026CO -0.12 0.75 0.24 0.15 -2.88 0.00 0.00 179.24 177.38 1wvi h PHE 1027N 0.67 0.45 -0.28 0.28 3.04 0.08 0.33 116.94 121.51 1wvi h PHE 1027Ca 0.13 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.06 1wvi h PHE 1027Cb 0.42 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.78 1wvi h PHE 1027CO 0.02 0.23 0.02 0.28 -2.02 0.00 0.00 178.31 176.84 1wvi h VAL 1028N 0.48 1.25 -0.74 1.41 2.07 -1.25 -1.45 116.25 118.02 1wvi h VAL 1028Ca 0.20 -0.87 0.03 0.00 0.82 0.00 0.00 66.70 66.89 1wvi h VAL 1028Cb 0.10 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 1wvi h VAL 1028CO -0.14 0.28 0.46 0.11 0.02 0.00 0.00 177.57 178.30 1wvi h LYS 1029N 0.29 0.87 -0.80 1.57 1.57 -0.90 0.50 116.57 119.67 1wvi h LYS 1029Ca 0.08 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1wvi h LYS 1029Cb 0.39 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 1wvi h LYS 1029CO 0.01 0.58 0.40 0.00 -0.57 0.00 0.00 179.45 179.86 1wvi h ARG 1030N 0.90 1.14 -0.45 3.15 3.08 -0.14 -0.18 114.38 121.89 1wvi h ARG 1030Ca 0.30 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1wvi h ARG 1030Cb 0.03 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1wvi h ARG 1030CO -0.11 0.87 0.27 -0.07 -1.07 0.00 0.00 179.97 179.86 1wvi h LEU 1031N 1.12 0.53 -0.98 3.04 3.38 -0.24 -1.69 115.31 120.48 1wvi h LEU 1031Ca 0.28 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1wvi h LEU 1031Cb 0.10 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1wvi h LEU 1031CO -0.04 0.42 0.53 1.56 0.09 0.00 0.00 178.44 181.01 1wvi h GLN 1032N 0.60 1.24 -0.69 1.13 4.20 -0.41 0.01 115.11 121.18 1wvi h GLN 1032Ca 0.16 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 1wvi h GLN 1032Cb -0.02 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.48 1wvi h GLN 1032CO -0.03 0.88 0.23 0.93 -0.67 0.00 0.00 178.83 180.17 1wvi h GLU 1033N 1.26 1.07 -0.00 1.46 5.08 -0.55 -1.72 114.58 121.18 1wvi h GLU 1033Ca 0.32 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1wvi h GLU 1033Cb -0.03 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1wvi h GLU 1033CO -0.06 0.91 -0.04 0.54 -1.00 0.00 0.00 179.01 179.36 1wvi n ARG 1034N -4.32 0.44 -3.43 2.33 5.12 -0.68 -4.90 116.66 111.21 1wvi n ARG 1034Ca 0.05 -0.06 -0.23 0.00 -1.93 0.00 0.00 57.85 55.68 1wvi n ARG 1034Cb 0.21 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.08 1wvi n ARG 1034CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1wvi n GLN 1035N -1.23 -7.13 -3.17 5.56 6.02 -0.14 -4.96 117.38 112.33 1wvi n GLN 1035Ca 0.13 0.85 -0.39 0.00 -0.01 0.00 0.00 57.00 57.59 1wvi n GLN 1035Cb 0.26 -5.84 -0.05 0.00 1.02 0.00 0.00 30.24 25.62 1wvi n GLN 1035CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wvi s LEU 1036N -7.11 4.29 0.54 1.08 1.43 -0.44 -5.03 118.68 113.44 1wvi s LEU 1036Ca 0.51 1.01 -0.21 0.00 -1.03 0.00 0.00 54.13 54.40 1wvi s LEU 1036Cb -0.22 -2.90 -0.05 0.00 0.03 0.00 0.00 46.19 43.04 1wvi s LEU 1036CO 0.63 -0.07 1.28 -2.16 0.23 0.00 0.00 176.35 176.26 1wvi s PRO 1037N 0.75 3.25 -0.01 1.29 0.04 -1.26 -4.65 135.00 134.41 1wvi s PRO 1037Ca 0.32 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 63.12 1wvi s PRO 1037Cb -0.16 -2.23 0.07 0.00 0.04 0.00 0.00 34.50 32.22 1wvi s PRO 1037CO 0.14 -1.05 0.65 1.52 0.04 0.00 0.00 177.00 178.31 1wvi s TYR 1038N -1.41 -0.62 -0.03 0.56 1.13 -1.26 -2.02 117.35 113.69 1wvi s TYR 1038Ca 0.71 0.96 0.02 0.00 -1.41 0.00 0.00 57.07 57.35 1wvi s TYR 1038Cb -0.36 0.42 0.01 0.00 -1.10 0.00 0.00 41.96 40.94 1wvi s TYR 1038CO 0.42 -0.64 -0.06 0.42 -2.51 0.00 0.00 175.55 173.18 1wvi s ILE 1039N -1.63 0.55 -0.19 -3.49 1.09 -0.14 -4.78 121.20 112.61 1wvi s ILE 1039Ca -0.09 -0.19 -0.20 0.00 -1.10 0.00 0.00 60.65 59.07 1wvi s ILE 1039Cb -0.00 -0.54 -0.03 0.00 -1.06 0.00 0.00 42.46 40.83 1wvi s ILE 1039CO 0.06 0.20 0.58 -0.76 -0.10 0.00 0.00 174.94 174.92 1wvi s LEU 1040N 0.52 4.15 -0.17 2.97 2.01 0.19 -0.91 118.68 127.45 1wvi s LEU 1040Ca -0.07 0.77 -0.01 0.00 0.01 0.00 0.00 54.13 54.84 1wvi s LEU 1040Cb -0.11 -2.81 -0.00 0.00 0.01 0.00 0.00 46.19 43.28 1wvi s LEU 1040CO 0.00 -0.22 -0.13 -0.69 1.01 0.00 0.00 176.35 176.32 1wvi s VAL 1041N 1.73 2.77 0.03 -1.59 1.01 0.10 -0.95 120.40 123.51 1wvi s VAL 1041Ca 0.27 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.56 1wvi s VAL 1041Cb -0.16 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1wvi s VAL 1041CO 0.10 0.50 -0.12 0.28 0.00 0.00 0.00 175.10 175.86 1wvi s THR 1042N 0.98 0.91 -2.21 3.92 -1.32 -1.01 -3.76 115.64 113.15 1wvi s THR 1042Ca -0.02 -0.92 0.28 0.00 -1.21 0.00 0.00 61.69 59.83 1wvi s THR 1042Cb -0.15 -0.85 0.52 0.00 -1.51 0.00 0.00 72.50 70.51 1wvi s THR 1042CO -0.02 -0.05 1.77 0.59 -2.21 0.00 0.00 174.62 174.69 1wvi n ASN 1043N 1.95 1.15 -4.72 8.08 5.03 -1.26 -1.64 115.26 123.85 1wvi n ASN 1043Ca -0.18 -1.23 -0.42 0.00 0.87 0.00 0.00 54.58 53.62 1wvi n ASN 1043Cb 0.55 0.02 -0.03 0.00 -1.02 0.00 0.00 39.78 39.30 1wvi n ASN 1043CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1wvi s ASN 1044N -2.15 6.60 0.00 6.41 2.47 -1.26 -4.62 114.94 122.39 1wvi s ASN 1044Ca 0.35 2.60 0.08 0.00 0.42 0.00 0.00 52.86 56.31 1wvi s ASN 1044Cb 0.21 -2.59 0.17 0.00 -1.45 0.00 0.00 41.25 37.59 1wvi s ASN 1044CO 0.39 -0.81 1.04 0.35 -3.72 0.00 0.00 177.10 174.35 1wvi n THR 1045N 3.97 0.63 -0.04 -5.21 -2.24 -1.26 -4.21 114.28 105.93 1wvi n THR 1045Ca 0.14 -0.82 -0.21 0.00 -2.27 0.00 0.00 64.05 60.89 1wvi n THR 1045Cb 0.39 0.75 -0.13 0.00 -2.10 0.00 0.00 70.33 69.24 1wvi n THR 1045CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wvi n THR 1046N 0.36 1.69 -3.44 4.28 -2.24 -1.26 -3.83 114.28 109.84 1wvi n THR 1046Ca 0.08 -0.54 -0.38 0.00 -2.27 0.00 0.00 64.05 60.93 1wvi n THR 1046Cb 0.32 -1.73 -0.06 0.00 -2.10 0.00 0.00 70.33 66.76 1wvi n THR 1046CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1wvi s ARG 1047N -2.52 4.12 0.84 -0.78 0.52 -1.26 -4.62 118.95 115.24 1wvi s ARG 1047Ca -0.26 0.38 -0.12 0.00 -0.52 0.00 0.00 55.73 55.22 1wvi s ARG 1047Cb 0.07 -3.32 0.09 0.00 0.52 0.00 0.00 34.95 32.31 1wvi s ARG 1047CO 0.71 0.44 1.10 0.95 0.02 0.00 0.00 175.30 178.52 1wvi s THR 1048N -0.27 2.81 0.27 0.02 -4.23 -1.26 -4.76 115.64 108.21 1wvi s THR 1048Ca 0.23 0.26 -0.02 0.00 -1.18 0.00 0.00 61.69 60.99 1wvi s THR 1048Cb -0.16 -2.96 0.26 0.00 1.34 0.00 0.00 72.50 70.98 1wvi s THR 1048CO 0.11 -0.34 1.85 -0.65 -0.54 0.00 0.00 174.62 175.04 1wvi h PRO 1049N -1.25 0.98 -0.10 3.99 0.11 -1.96 0.22 132.00 133.99 1wvi h PRO 1049Ca -0.48 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1wvi h PRO 1049Cb 1.28 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1wvi h PRO 1049CO 0.59 0.65 0.07 0.93 -0.21 0.00 0.00 178.00 180.02 1wvi h GLU 1050N 1.01 0.14 -0.47 1.05 3.07 -1.94 0.34 114.58 117.78 1wvi h GLU 1050Ca 0.45 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.33 1wvi h GLU 1050Cb 0.34 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.18 1wvi h GLU 1050CO -0.23 0.11 0.25 0.52 -1.40 0.00 0.00 179.01 178.26 1wvi h MET 1051N 0.13 0.48 -0.32 2.33 2.86 -1.66 0.72 114.93 119.47 1wvi h MET 1051Ca 0.04 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1wvi h MET 1051Cb 0.00 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 1wvi h MET 1051CO -0.01 0.32 0.20 0.28 1.06 0.00 0.00 176.91 178.76 1wvi h VAL 1052N 0.49 1.10 -0.31 -2.22 2.07 -0.53 0.08 116.25 116.94 1wvi h VAL 1052Ca 0.20 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1wvi h VAL 1052Cb 0.08 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1wvi h VAL 1052CO -0.13 0.10 0.14 -0.61 0.02 0.00 0.00 177.57 177.09 1wvi h GLN 1053N 0.42 0.28 -0.50 1.57 4.15 0.26 -1.38 115.11 119.91 1wvi h GLN 1053Ca 0.12 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 1wvi h GLN 1053Cb -0.01 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 1wvi h GLN 1053CO -0.02 0.19 0.24 1.49 -1.93 0.00 0.00 178.83 178.79 1wvi h GLU 1054N 0.29 0.72 -0.48 1.69 4.81 -0.60 -2.37 114.58 118.64 1wvi h GLU 1054Ca 0.13 -0.11 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1wvi h GLU 1054Cb 0.07 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 1wvi h GLU 1054CO -0.11 0.61 0.23 1.98 -0.73 0.00 0.00 179.01 180.99 1wvi h MET 1055N 0.67 0.44 -0.53 1.92 4.05 -0.67 0.15 114.93 120.96 1wvi h MET 1055Ca 0.17 -0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.58 1wvi h MET 1055Cb 0.13 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.79 1wvi h MET 1055CO -0.02 0.29 0.33 -0.07 0.23 0.00 0.00 176.91 177.67 1wvi h LEU 1056N 0.46 0.54 -0.10 3.39 3.38 -0.99 0.19 115.31 122.18 1wvi h LEU 1056Ca 0.22 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1wvi h LEU 1056Cb 0.14 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1wvi h LEU 1056CO -0.16 0.39 -0.39 0.00 0.09 0.00 0.00 178.44 178.36 1wvi h ALA 1057N 1.23 0.18 -0.24 1.53 0.00 -0.48 -0.26 119.26 121.23 1wvi h ALA 1057Ca 0.21 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1wvi h ALA 1057Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1wvi h ALA 1057CO -0.08 0.28 -0.41 1.15 0.00 0.00 0.00 179.25 180.19 1wvi h THR 1058N 0.01 1.31 0.00 0.00 2.02 -0.63 -3.19 112.91 112.42 1wvi h THR 1058Ca -0.02 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.54 1wvi h THR 1058Cb 1.03 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 69.20 1wvi h THR 1058CO 0.08 0.51 -1.18 -1.20 0.37 0.00 0.00 175.52 174.10 1wvi n SER 1059N -4.20 0.86 -0.43 4.18 7.64 0.64 -4.70 113.62 117.62 1wvi n SER 1059Ca -0.05 -0.57 0.02 0.00 1.01 0.00 0.00 58.87 59.28 1wvi n SER 1059Cb 0.54 1.30 0.02 0.00 -1.01 0.00 0.00 64.21 65.07 1wvi n SER 1059CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1wvi n PHE 1060N -1.67 0.00 -1.98 1.43 3.72 -0.55 -4.95 117.46 113.45 1wvi n PHE 1060Ca 0.01 -0.17 -0.14 0.00 -0.05 0.00 0.00 57.45 57.09 1wvi n PHE 1060Cb 0.34 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.78 1wvi n PHE 1060CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1wvi n ASN 1061N -0.24 -4.14 -4.34 4.37 3.02 -0.96 -4.88 115.26 108.08 1wvi n ASN 1061Ca 0.03 0.24 -0.36 0.00 -0.03 0.00 0.00 54.58 54.45 1wvi n ASN 1061Cb 0.69 -3.63 -0.13 0.00 -0.61 0.00 0.00 39.78 36.10 1wvi n ASN 1061CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wvi s ILE 1062N -2.50 3.80 -0.30 2.41 1.01 -0.22 -4.94 121.20 120.46 1wvi s ILE 1062Ca 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 60.65 60.04 1wvi s ILE 1062Cb 0.00 -2.87 0.04 0.00 0.01 0.00 0.00 42.46 39.64 1wvi s ILE 1062CO 0.00 0.22 0.02 -0.54 0.00 0.00 0.00 174.94 174.64 1wvi s LYS 1063N 1.50 2.53 0.04 2.79 1.02 -1.26 -0.87 119.74 125.50 1wvi s LYS 1063Ca 0.04 -1.20 0.04 0.00 0.02 0.00 0.00 55.97 54.86 1wvi s LYS 1063Cb -0.16 -3.23 -0.02 0.00 -0.52 0.00 0.00 37.83 33.90 1wvi s LYS 1063CO 0.01 -0.60 -0.12 -0.08 -0.92 0.00 0.00 175.35 173.64 1wvi s THR 1064N 1.30 0.92 0.64 2.17 -1.32 -1.26 -5.07 115.64 113.01 1wvi s THR 1064Ca -0.04 -0.98 -0.18 0.00 -1.21 0.00 0.00 61.69 59.28 1wvi s THR 1064Cb -0.19 -0.87 -0.03 0.00 -1.51 0.00 0.00 72.50 69.90 1wvi s THR 1064CO -0.00 -0.10 1.03 -2.65 -2.21 0.00 0.00 174.62 170.69 1wvi n PRO 1065N 1.82 0.86 0.05 7.08 -0.02 -1.26 -4.89 135.00 138.64 1wvi n PRO 1065Ca -0.19 0.34 0.04 0.00 -2.02 0.00 0.00 63.50 61.67 1wvi n PRO 1065Cb 0.55 -2.25 0.45 0.00 -0.02 0.00 0.00 33.50 32.22 1wvi n PRO 1065CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wvi h LEU 1066N 0.33 0.39 0.00 2.45 5.85 -1.97 -2.28 115.31 120.08 1wvi h LEU 1066Ca -0.49 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1wvi h LEU 1066Cb 1.36 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1wvi h LEU 1066CO 0.50 0.31 0.00 -0.62 -0.34 0.00 0.00 178.44 178.29 1wvi n GLU 1067N -4.46 0.07 0.00 1.25 4.71 -1.26 -2.27 120.64 118.69 1wvi n GLU 1067Ca 0.02 0.21 0.13 0.00 -0.01 0.00 0.00 57.16 57.51 1wvi n GLU 1067Cb 0.09 -1.50 0.43 0.00 -1.01 0.00 0.00 31.44 29.45 1wvi n GLU 1067CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1wvi n THR 1068N -1.43 0.00 -3.54 2.62 -2.24 -0.86 -4.77 114.28 104.07 1wvi n THR 1068Ca 0.05 -0.12 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 1wvi n THR 1068Cb 0.15 0.29 -0.11 0.00 -2.10 0.00 0.00 70.33 68.57 1wvi n THR 1068CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1wvi s ILE 1069N -2.49 4.91 -0.22 2.28 1.01 -0.96 0.56 121.20 126.29 1wvi s ILE 1069Ca 0.25 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.23 1wvi s ILE 1069Cb 0.19 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 39.00 1wvi s ILE 1069CO 0.51 -0.23 -0.15 -0.47 0.00 0.00 0.00 174.94 174.60 1wvi s TYR 1070N 1.62 3.05 0.42 3.97 5.04 -0.13 -4.93 117.35 126.40 1wvi s TYR 1070Ca 0.04 -2.02 0.08 0.00 -2.44 0.00 0.00 57.07 52.72 1wvi s TYR 1070Cb -0.19 -1.92 -0.01 0.00 0.35 0.00 0.00 41.96 40.19 1wvi s TYR 1070CO 0.08 -0.85 0.43 0.95 -1.34 0.00 0.00 175.55 174.82 1wvi s THR 1071N 1.19 2.69 0.40 4.34 -4.23 -1.26 -2.42 115.64 116.34 1wvi s THR 1071Ca -0.03 -1.27 0.17 0.00 -1.18 0.00 0.00 61.69 59.38 1wvi s THR 1071Cb -0.17 -2.96 0.17 0.00 1.34 0.00 0.00 72.50 70.88 1wvi s THR 1071CO -0.09 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 175.92 1wvi h ALA 1072N 0.93 1.45 -0.17 3.99 0.00 -1.48 -1.52 119.26 122.46 1wvi h ALA 1072Ca -0.41 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 1wvi h ALA 1072Cb 1.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1wvi h ALA 1072CO 0.55 0.32 0.03 1.15 0.00 0.00 0.00 179.25 181.30 1wvi h THR 1073N 0.00 1.22 -0.41 0.00 2.02 -1.87 0.26 112.91 114.13 1wvi h THR 1073Ca -0.00 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.46 1wvi h THR 1073Cb 0.49 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1wvi h THR 1073CO 0.03 0.21 0.18 -0.07 0.37 0.00 0.00 175.52 176.25 1wvi h LEU 1074N 0.08 0.54 -0.71 2.58 3.38 -1.84 -1.41 115.31 117.93 1wvi h LEU 1074Ca 0.05 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.90 1wvi h LEU 1074Cb 0.29 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1wvi h LEU 1074CO 0.00 0.54 0.45 0.00 0.09 0.00 0.00 178.44 179.52 1wvi h ALA 1075N 1.03 0.92 -0.44 1.53 0.00 -1.19 -0.12 119.26 120.99 1wvi h ALA 1075Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1wvi h ALA 1075Cb 0.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1wvi h ALA 1075CO -0.02 0.25 0.24 1.15 0.00 0.00 0.00 179.25 180.88 1wvi h THR 1076N 0.90 1.16 -0.56 0.00 2.02 -0.60 -0.68 112.91 115.15 1wvi h THR 1076Ca 0.28 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 66.97 1wvi h THR 1076Cb -0.03 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1wvi h THR 1076CO -0.09 0.17 0.07 0.40 0.37 0.00 0.00 175.52 176.44 1wvi h ILE 1077N 0.57 1.26 -0.59 3.11 2.04 -0.94 0.08 117.51 123.04 1wvi h ILE 1077Ca 0.15 -1.00 0.02 0.00 1.00 0.00 0.00 64.86 65.03 1wvi h ILE 1077Cb 0.06 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1wvi h ILE 1077CO -0.02 0.36 0.38 0.44 0.00 0.00 0.00 178.15 179.30 1wvi h ASP 1078N 0.83 0.63 -0.27 1.72 3.32 -0.73 0.87 116.42 122.78 1wvi h ASP 1078Ca 0.17 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1wvi h ASP 1078Cb 0.44 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1wvi h ASP 1078CO 0.01 0.45 0.14 0.22 -1.72 0.00 0.00 179.24 178.34 1wvi h TYR 1079N 0.75 0.38 -0.50 4.55 3.20 -0.84 0.27 116.97 124.79 1wvi h TYR 1079Ca 0.23 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.14 1wvi h TYR 1079Cb -0.02 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.08 1wvi h TYR 1079CO -0.05 0.34 0.23 0.52 -1.64 0.00 0.00 178.16 177.56 1wvi h MET 1080N 0.32 0.44 -0.73 1.82 2.86 -0.40 -0.67 114.93 118.57 1wvi h MET 1080Ca 0.09 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1wvi h MET 1080Cb 0.09 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.62 1wvi h MET 1080CO -0.01 0.29 0.32 -0.91 1.06 0.00 0.00 176.91 177.66 1wvi h ASN 1081N 0.46 0.96 -0.25 1.22 2.35 -0.44 -2.53 115.58 117.33 1wvi h ASN 1081Ca 0.22 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1wvi h ASN 1081Cb 0.16 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1wvi h ASN 1081CO -0.18 0.83 0.04 0.44 -1.65 0.00 0.00 177.43 176.91 1wvi h ASP 1082N 1.04 0.40 0.61 5.81 3.45 -0.11 -2.98 116.42 124.63 1wvi h ASP 1082Ca 0.25 -0.26 -0.03 0.00 0.43 0.00 0.00 57.03 57.42 1wvi h ASP 1082Cb 0.14 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 38.80 1wvi h ASP 1082CO -0.03 0.56 -0.13 0.24 -1.57 0.00 0.00 179.24 178.31 1wvi h MET 1083N 0.23 0.00 -6.57 3.56 2.86 -1.05 -3.48 114.93 110.47 1wvi h MET 1083Ca 0.08 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.28 1wvi h MET 1083Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1wvi h MET 1083CO 0.01 0.13 -0.94 0.36 1.06 0.00 0.00 176.91 177.52 1wvi n LYS 1084N -3.45 -1.33 -4.33 1.72 2.85 -0.96 -5.02 118.16 107.63 1wvi n LYS 1084Ca -0.01 0.74 -0.30 0.00 -1.05 0.00 0.00 58.31 57.69 1wvi n LYS 1084Cb 0.30 -2.85 -0.03 0.00 -0.65 0.00 0.00 35.03 31.80 1wvi n LYS 1084CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1wvi s ARG 1085N -5.08 2.23 0.27 -1.58 3.00 -1.26 -5.07 118.95 111.46 1wvi s ARG 1085Ca 0.09 -2.26 -0.09 0.00 0.00 0.00 0.00 55.73 53.47 1wvi s ARG 1085Cb -0.04 -1.80 -0.07 0.00 0.00 0.00 0.00 34.95 33.03 1wvi s ARG 1085CO 0.89 -0.56 -0.10 0.41 0.00 0.00 0.00 175.30 175.94 1wvi n GLY 1086N -1.58 -1.64 2.17 -3.53 0.00 -1.26 -4.76 105.19 94.59 1wvi n GLY 1086Ca -0.12 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1wvi n GLY 1086CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wvi n LYS 1087N 0.78 2.12 -4.13 1.61 4.01 -1.26 -4.71 118.16 116.58 1wvi n LYS 1087Ca 0.03 -2.05 -0.15 0.00 -0.51 0.00 0.00 58.31 55.64 1wvi n LYS 1087Cb 0.23 -1.88 -0.11 0.00 -0.51 0.00 0.00 35.03 32.76 1wvi n LYS 1087CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1wvi s THR 1088N -2.56 0.83 -0.07 -0.18 -4.23 -1.26 -2.49 115.64 105.68 1wvi s THR 1088Ca 0.45 -1.29 -0.30 0.00 -1.18 0.00 0.00 61.69 59.37 1wvi s THR 1088Cb 0.32 -0.94 0.07 0.00 1.34 0.00 0.00 72.50 73.29 1wvi s THR 1088CO -0.09 -0.37 0.68 0.00 -0.54 0.00 0.00 174.62 174.30 1wvi s ALA 1089N -1.59 -1.76 -0.17 3.99 0.00 -0.89 -2.27 121.76 119.06 1wvi s ALA 1089Ca -0.04 1.36 -0.03 0.00 0.00 0.00 0.00 51.96 53.25 1wvi s ALA 1089Cb -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 1wvi s ALA 1089CO 0.01 -0.37 -0.04 -0.47 0.00 0.00 0.00 175.76 174.89 1wvi s TYR 1090N -1.07 2.98 -0.07 0.00 5.04 -0.36 -2.40 117.35 121.48 1wvi s TYR 1090Ca -0.10 -0.50 0.06 0.00 -2.44 0.00 0.00 57.07 54.09 1wvi s TYR 1090Cb -0.00 -2.00 -0.01 0.00 0.35 0.00 0.00 41.96 40.30 1wvi s TYR 1090CO 0.09 -0.20 -0.24 0.08 -1.34 0.00 0.00 175.55 173.94 1wvi s VAL 1091N 0.70 2.02 -0.22 3.14 1.01 -1.26 -1.07 120.40 124.73 1wvi s VAL 1091Ca -0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 60.88 1wvi s VAL 1091Cb -0.15 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1wvi s VAL 1091CO 0.02 0.56 -0.04 -0.63 0.00 0.00 0.00 175.10 175.01 1wvi s ILE 1092N -0.04 3.41 -3.33 2.22 1.01 0.10 -4.97 121.20 119.59 1wvi s ILE 1092Ca -0.07 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1wvi s ILE 1092Cb -0.15 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 39.77 1wvi s ILE 1092CO 0.05 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.02 1wvi n GLY 1093N 4.79 -1.56 3.77 6.18 0.00 -1.26 -0.60 105.19 116.51 1wvi n GLY 1093Ca -0.18 -1.12 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 1wvi n GLY 1093CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wvi s GLU 1094N -1.48 1.99 0.34 1.61 0.41 -1.04 -4.75 118.70 115.77 1wvi s GLU 1094Ca 0.00 0.91 0.08 0.00 -0.41 0.00 0.00 54.97 55.55 1wvi s GLU 1094Cb 0.00 -1.89 0.79 0.00 -1.78 0.00 0.00 34.13 31.26 1wvi s GLU 1094CO 0.00 -1.76 1.83 0.00 -0.49 0.00 0.00 175.26 174.84 1wvi h THR 1095N -1.20 0.78 -0.35 3.63 1.03 -1.95 -1.89 112.91 112.96 1wvi h THR 1095Ca -0.46 -0.25 0.04 0.00 -0.01 0.00 0.00 66.41 65.73 1wvi h THR 1095Cb 1.25 -0.00 -0.04 0.00 -1.07 0.00 0.00 68.15 68.29 1wvi h THR 1095CO 0.55 0.13 0.11 1.23 -0.01 0.00 0.00 175.52 177.53 1wvi h GLY 1096N 0.72 0.44 0.91 2.99 0.00 -1.87 0.56 103.07 106.82 1wvi h GLY 1096Ca 0.50 -0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.72 1wvi h GLY 1096CO -0.26 0.02 0.03 -2.00 0.00 0.00 0.00 176.54 174.32 1wvi h LEU 1097N 0.25 0.57 -1.05 3.11 5.85 -1.46 -0.97 115.31 121.61 1wvi h LEU 1097Ca 0.16 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 1wvi h LEU 1097Cb 0.15 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1wvi h LEU 1097CO -0.17 0.71 0.37 0.11 -0.34 0.00 0.00 178.44 179.12 1wvi h LYS 1098N 0.40 1.04 0.00 1.25 1.57 -1.19 -2.03 116.57 117.62 1wvi h LYS 1098Ca 0.10 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1wvi h LYS 1098Cb 0.41 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1wvi h LYS 1098CO 0.01 0.79 -0.00 -0.22 -0.57 0.00 0.00 179.45 179.46 1wvi h LYS 1099N 1.04 -0.00 -0.98 3.15 3.64 -0.72 -2.41 116.57 120.29 1wvi h LYS 1099Ca 0.26 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.74 1wvi h LYS 1099Cb 0.08 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.82 1wvi h LYS 1099CO -0.04 0.37 0.62 0.00 -2.27 0.00 0.00 179.45 178.14 1wvi h ALA 1100N 0.62 1.53 -0.30 5.00 0.00 -0.94 0.73 119.26 125.91 1wvi h ALA 1100Ca -0.00 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1wvi h ALA 1100Cb 0.38 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1wvi h ALA 1100CO 0.00 0.26 -0.25 0.28 0.00 0.00 0.00 179.25 179.54 1wvi h VAL 1101N 1.01 1.30 -0.53 0.00 2.07 -1.35 -1.64 116.25 117.11 1wvi h VAL 1101Ca 0.47 -1.40 -0.05 0.00 0.82 0.00 0.00 66.70 66.53 1wvi h VAL 1101Cb 0.41 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1wvi h VAL 1101CO -0.22 0.45 0.14 0.00 0.02 0.00 0.00 177.57 177.96 1wvi h ALA 1102N 0.72 0.69 0.00 1.67 0.00 -0.86 -2.15 119.26 119.33 1wvi h ALA 1102Ca 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1wvi h ALA 1102Cb 0.81 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1wvi h ALA 1102CO 0.06 0.38 0.00 0.93 0.00 0.00 0.00 179.25 180.62 1wvi h GLU 1103N 0.73 0.00 -0.02 0.00 5.08 -0.83 -1.26 114.58 118.28 1wvi h GLU 1103Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1wvi h GLU 1103Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1wvi h GLU 1103CO -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1wvi n ALA 1104N -2.06 2.62 0.00 3.43 0.00 -0.62 -4.87 120.51 119.01 1wvi n ALA 1104Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1wvi n ALA 1104Cb 0.28 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1wvi n ALA 1104CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvi n GLY 1105N 0.94 0.90 3.21 0.00 0.00 -0.48 -5.07 105.19 104.69 1wvi n GLY 1105Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1wvi n GLY 1105CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wvi s TYR 1106N -2.00 3.43 0.44 1.61 1.51 -0.93 -4.69 117.35 116.72 1wvi s TYR 1106Ca 0.00 -1.88 -0.22 0.00 -1.01 0.00 0.00 57.07 53.96 1wvi s TYR 1106Cb 0.00 -3.23 -0.08 0.00 -0.11 0.00 0.00 41.96 38.54 1wvi s TYR 1106CO 0.00 -0.94 1.08 -0.98 -1.11 0.00 0.00 175.55 173.60 1wvi s ARG 1107N 1.33 3.93 0.07 -0.62 1.70 -1.04 -3.55 118.95 120.78 1wvi s ARG 1107Ca 0.05 1.53 -0.31 0.00 -0.47 0.00 0.00 55.73 56.54 1wvi s ARG 1107Cb -0.24 -2.36 -0.08 0.00 -0.57 0.00 0.00 34.95 31.70 1wvi s ARG 1107CO -0.01 -0.35 1.53 -1.21 -1.08 0.00 0.00 175.30 174.19 1wvi s GLU 1108N -2.78 4.24 -0.20 3.89 0.41 -1.25 -2.10 118.70 120.91 1wvi s GLU 1108Ca 0.62 2.20 -0.05 0.00 -0.41 0.00 0.00 54.97 57.34 1wvi s GLU 1108Cb -0.22 -3.46 0.07 0.00 -1.78 0.00 0.00 34.13 28.74 1wvi s GLU 1108CO 0.27 -0.62 0.09 0.34 -0.49 0.00 0.00 175.26 174.85 1wvi s ASP 1109N 1.85 2.63 0.00 -0.19 -1.08 -1.01 -4.90 116.67 113.97 1wvi s ASP 1109Ca 0.69 -0.77 0.24 0.00 -0.52 0.00 0.00 52.55 52.19 1wvi s ASP 1109Cb -0.38 -0.29 0.94 0.00 -1.46 0.00 0.00 42.92 41.73 1wvi s ASP 1109CO 0.30 -0.36 1.66 -1.54 0.52 0.00 0.00 175.17 175.75 1wvi n SER 1110N 5.25 1.38 -0.08 -0.34 3.41 -1.26 -3.62 113.62 118.36 1wvi n SER 1110Ca -0.07 -1.58 -0.11 0.00 -0.26 0.00 0.00 58.87 56.86 1wvi n SER 1110Cb 0.47 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1wvi n SER 1110CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1wvi n GLU 1111N 0.11 0.48 -2.73 4.33 -0.58 -1.26 -4.81 120.64 116.17 1wvi n GLU 1111Ca 0.17 0.19 -0.16 0.00 -0.42 0.00 0.00 57.16 56.94 1wvi n GLU 1111Cb 0.30 -1.33 0.01 0.00 -0.57 0.00 0.00 31.44 29.85 1wvi n GLU 1111CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1wvi n ASN 1112N -4.32 2.33 -4.73 1.62 4.13 -1.26 -4.69 115.26 108.34 1wvi n ASN 1112Ca -0.17 -3.07 -0.35 0.00 1.68 0.00 0.00 54.58 52.66 1wvi n ASN 1112Cb 0.51 -0.53 0.07 0.00 -1.54 0.00 0.00 39.78 38.29 1wvi n ASN 1112CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1wvi s PRO 1113N -3.13 2.47 0.23 3.52 0.04 -1.24 -4.91 135.00 131.98 1wvi s PRO 1113Ca 0.36 1.80 0.12 0.00 0.04 0.00 0.00 61.00 63.32 1wvi s PRO 1113Cb 0.41 -1.87 0.06 0.00 0.04 0.00 0.00 34.50 33.15 1wvi s PRO 1113CO -0.05 -1.59 1.43 0.00 0.04 0.00 0.00 177.00 176.83 1wvi h ALA 1114N 0.17 0.61 -3.50 8.56 0.00 -1.74 -3.39 119.26 119.99 1wvi h ALA 1114Ca -0.49 -0.63 -0.39 0.00 0.00 0.00 0.00 54.91 53.40 1wvi h ALA 1114Cb 1.30 -0.11 -0.23 0.00 0.00 0.00 0.00 17.79 18.75 1wvi h ALA 1114CO 0.52 0.86 -0.77 0.71 0.00 0.00 0.00 179.25 180.57 1wvi s TYR 1115N -3.00 1.07 -0.21 0.00 2.02 -0.96 -0.97 117.35 115.29 1wvi s TYR 1115Ca 0.02 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.31 1wvi s TYR 1115Cb 0.09 -0.62 0.05 0.00 -0.40 0.00 0.00 41.96 41.09 1wvi s TYR 1115CO 0.77 0.02 -0.07 0.08 -1.57 0.00 0.00 175.55 174.77 1wvi s VAL 1116N -1.10 1.50 -0.13 0.71 1.01 -0.02 -1.23 120.40 121.14 1wvi s VAL 1116Ca -0.02 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 1wvi s VAL 1116Cb -0.09 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 1wvi s VAL 1116CO 0.01 0.04 -0.07 -0.69 0.00 0.00 0.00 175.10 174.39 1wvi s VAL 1117N 1.44 3.58 -0.07 2.92 1.01 -0.23 -0.79 120.40 128.26 1wvi s VAL 1117Ca -0.03 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1wvi s VAL 1117Cb -0.17 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.69 1wvi s VAL 1117CO -0.07 0.52 -0.07 -0.69 0.00 0.00 0.00 175.10 174.79 1wvi s VAL 1118N 0.20 0.78 0.15 2.92 1.01 0.01 -0.72 120.40 124.74 1wvi s VAL 1118Ca -0.04 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1wvi s VAL 1118Cb -0.14 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 1wvi s VAL 1118CO 0.04 0.29 0.07 0.61 0.00 0.00 0.00 175.10 176.11 1wvi n GLY 1119N 4.28 3.74 3.76 4.51 0.00 0.23 -1.27 105.19 120.44 1wvi n GLY 1119Ca -0.20 -1.94 -0.41 0.00 0.00 0.00 0.00 46.02 43.47 1wvi n GLY 1119CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wvi s LEU 1120N 0.00 4.36 -0.26 0.99 0.20 -1.26 -4.28 118.68 118.43 1wvi s LEU 1120Ca 0.09 2.88 -0.04 0.00 0.69 0.00 0.00 54.13 57.75 1wvi s LEU 1120Cb 0.00 -3.65 0.09 0.00 -0.43 0.00 0.00 46.19 42.20 1wvi s LEU 1120CO 0.07 -0.77 0.11 -0.62 -0.29 0.00 0.00 176.35 174.85 1wvi s ASP 1121N -0.00 3.25 0.00 3.68 -1.08 -1.26 -2.49 116.67 118.76 1wvi s ASP 1121Ca 0.55 -1.12 0.16 0.00 -0.52 0.00 0.00 52.55 51.61 1wvi s ASP 1121Cb -0.44 -0.37 0.93 0.00 -1.46 0.00 0.00 42.92 41.57 1wvi s ASP 1121CO 0.54 -0.41 1.34 0.35 0.52 0.00 0.00 175.17 177.51 1wvi n THR 1122N 5.22 0.00 -1.48 1.71 -2.24 -1.26 -1.63 114.28 114.60 1wvi n THR 1122Ca -0.06 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.78 1wvi n THR 1122Cb 0.44 -0.72 0.20 0.00 -2.10 0.00 0.00 70.33 68.14 1wvi n THR 1122CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1wvi n ASN 1123N -0.98 1.92 -4.68 3.42 4.13 -1.26 -5.06 115.26 112.76 1wvi n ASN 1123Ca 0.12 -3.73 -0.43 0.00 1.68 0.00 0.00 54.58 52.22 1wvi n ASN 1123Cb 0.05 -0.52 -0.01 0.00 -1.54 0.00 0.00 39.78 37.77 1wvi n ASN 1123CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1wvi n LEU 1124N -1.18 3.23 -4.16 3.41 0.00 -0.65 -5.01 117.00 112.66 1wvi n LEU 1124Ca 0.19 1.19 -0.10 0.00 0.00 0.00 0.00 56.01 57.29 1wvi n LEU 1124Cb 0.71 -1.44 -0.10 0.00 0.00 0.00 0.00 43.42 42.58 1wvi n LEU 1124CO -0.01 -0.71 -0.35 0.42 0.00 0.00 0.00 177.39 176.74 1wvi s THR 1125N -1.10 0.44 0.23 1.96 -4.23 -1.26 -5.04 115.64 106.63 1wvi s THR 1125Ca 0.57 -1.90 -0.08 0.00 -1.18 0.00 0.00 61.69 59.10 1wvi s THR 1125Cb -0.59 -1.78 0.21 0.00 1.34 0.00 0.00 72.50 71.68 1wvi s THR 1125CO 0.61 -0.76 1.89 0.22 -0.54 0.00 0.00 174.62 176.04 1wvi h TYR 1126N 2.95 1.17 -0.66 3.99 3.20 -1.99 -2.46 116.97 123.16 1wvi h TYR 1126Ca -0.35 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.59 1wvi h TYR 1126Cb 1.17 -0.39 -0.06 0.00 1.54 0.00 0.00 36.73 39.00 1wvi h TYR 1126CO 0.53 0.76 0.36 1.49 -1.64 0.00 0.00 178.16 179.67 1wvi h GLU 1127N 1.23 0.64 -0.77 1.82 4.57 -1.98 0.21 114.58 120.31 1wvi h GLU 1127Ca 0.33 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.41 1wvi h GLU 1127Cb -0.08 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.33 1wvi h GLU 1127CO -0.06 0.43 0.26 0.87 -1.18 0.00 0.00 179.01 179.32 1wvi h LYS 1128N 0.66 1.18 -0.56 1.92 1.57 -1.87 0.53 116.57 120.01 1wvi h LYS 1128Ca 0.30 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1wvi h LYS 1128Cb 0.21 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1wvi h LYS 1128CO -0.19 0.98 0.08 -0.07 -0.57 0.00 0.00 179.45 179.68 1wvi h LEU 1129N 1.14 0.90 -0.34 2.94 4.07 -0.95 -1.06 115.31 122.01 1wvi h LEU 1129Ca 0.25 -0.27 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1wvi h LEU 1129Cb 0.28 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 1wvi h LEU 1129CO -0.01 0.94 0.15 0.74 -1.08 0.00 0.00 178.44 179.18 1wvi h THR 1130N 0.82 1.17 -0.27 0.22 2.02 -0.22 0.20 112.91 116.86 1wvi h THR 1130Ca 0.17 -0.50 0.03 0.00 0.77 0.00 0.00 66.41 66.88 1wvi h THR 1130Cb 0.43 0.88 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1wvi h THR 1130CO 0.01 0.18 0.09 -0.07 0.37 0.00 0.00 175.52 176.11 1wvi h LEU 1131N 0.40 0.10 -0.39 2.58 4.07 -0.61 -0.68 115.31 120.79 1wvi h LEU 1131Ca 0.11 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 1wvi h LEU 1131Cb 0.14 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 1wvi h LEU 1131CO -0.01 0.09 0.19 0.00 -1.08 0.00 0.00 178.44 177.63 1wvi h ALA 1132N 1.17 0.50 -0.13 1.53 0.00 -1.00 -1.86 119.26 119.47 1wvi h ALA 1132Ca 0.12 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1wvi h ALA 1132Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1wvi h ALA 1132CO -0.12 0.06 -0.03 1.15 0.00 0.00 0.00 179.25 180.31 1wvi h THR 1133N 0.49 0.87 -0.57 0.00 2.02 -0.20 0.26 112.91 115.78 1wvi h THR 1133Ca 0.13 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 1wvi h THR 1133Cb 0.12 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1wvi h THR 1133CO -0.02 0.00 0.32 -0.07 0.37 0.00 0.00 175.52 176.13 1wvi h LEU 1134N -0.00 0.69 -0.55 2.58 4.07 -1.06 -1.21 115.31 119.84 1wvi h LEU 1134Ca 0.06 -0.08 -0.03 0.00 0.08 0.00 0.00 57.88 57.91 1wvi h LEU 1134Cb 0.10 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1wvi h LEU 1134CO -0.13 0.57 0.22 0.00 -1.08 0.00 0.00 178.44 178.02 1wvi h ALA 1135N 1.15 0.72 -0.37 1.53 0.00 -1.05 -1.87 119.26 119.36 1wvi h ALA 1135Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1wvi h ALA 1135Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1wvi h ALA 1135CO -0.03 0.32 0.22 0.82 0.00 0.00 0.00 179.25 180.58 1wvi h ILE 1136N 0.75 1.13 -0.66 0.00 2.04 -0.72 -2.04 117.51 118.01 1wvi h ILE 1136Ca 0.18 -0.31 0.09 0.00 1.00 0.00 0.00 64.86 65.83 1wvi h ILE 1136Cb 0.19 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 1wvi h ILE 1136CO -0.02 0.13 0.44 1.56 0.00 0.00 0.00 178.15 180.26 1wvi h GLN 1137N 0.48 0.52 0.00 2.37 4.20 -0.91 0.40 115.11 122.18 1wvi h GLN 1137Ca 0.13 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1wvi h GLN 1137Cb 0.02 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.68 1wvi h GLN 1137CO -0.02 0.35 0.00 1.63 -0.67 0.00 0.00 178.83 180.11 1wvi n LYS 1138N -4.48 0.44 0.00 1.46 5.02 -0.73 -4.87 118.16 114.99 1wvi n LYS 1138Ca 0.11 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1wvi n LYS 1138Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1wvi n LYS 1138CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wvi n GLY 1139N 0.73 0.88 3.75 0.72 0.00 0.13 -5.10 105.19 106.31 1wvi n GLY 1139Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1wvi n GLY 1139CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvi s ALA 1140N -2.00 2.84 -0.23 4.61 0.00 -0.98 -4.91 121.76 121.10 1wvi s ALA 1140Ca 0.00 1.36 -0.29 0.00 0.00 0.00 0.00 51.96 53.03 1wvi s ALA 1140Cb 0.00 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 1wvi s ALA 1140CO 0.00 -1.39 1.29 0.08 0.00 0.00 0.00 175.76 175.74 1wvi s VAL 1141N -1.29 4.20 -0.44 0.00 1.01 -0.14 -4.72 120.40 119.02 1wvi s VAL 1141Ca 0.71 1.40 -0.25 0.00 0.00 0.00 0.00 61.98 63.85 1wvi s VAL 1141Cb -0.41 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 31.93 1wvi s VAL 1141CO 0.49 -0.29 0.89 0.12 0.00 0.00 0.00 175.10 176.30 1wvi s PHE 1142N 3.96 2.96 -0.05 5.22 5.99 -1.26 -0.84 117.98 133.96 1wvi s PHE 1142Ca 0.56 0.39 0.07 0.00 0.00 0.00 0.00 56.93 57.95 1wvi s PHE 1142Cb -0.19 -3.84 -0.01 0.00 0.00 0.00 0.00 43.02 38.97 1wvi s PHE 1142CO 0.19 -1.03 -0.25 0.42 -0.00 0.00 0.00 175.22 174.55 1wvi s ILE 1143N 3.60 2.04 -0.10 3.12 1.01 0.03 -0.99 121.20 129.91 1wvi s ILE 1143Ca 0.35 -1.07 -0.00 0.00 0.00 0.00 0.00 60.65 59.93 1wvi s ILE 1143Cb -0.11 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 1wvi s ILE 1143CO 0.24 0.57 -0.08 -0.83 0.00 0.00 0.00 174.94 174.84 1wvi s GLY 1144N -0.28 1.65 0.09 6.18 0.00 -0.08 -0.81 107.32 114.07 1wvi s GLY 1144Ca 0.00 -0.88 -0.15 0.00 0.00 0.00 0.00 44.72 43.69 1wvi s GLY 1144CO 0.02 -0.46 1.35 -0.91 0.00 0.00 0.00 173.10 173.11 1wvi h THR 1145N 4.67 1.31 -2.98 0.90 1.35 -1.50 -0.91 112.91 115.75 1wvi h THR 1145Ca -0.40 -1.66 -0.09 0.00 -0.55 0.00 0.00 66.41 63.71 1wvi h THR 1145Cb 1.18 1.81 -0.18 0.00 -1.73 0.00 0.00 68.15 69.23 1wvi h THR 1145CO 0.55 0.52 -0.16 0.54 -0.25 0.00 0.00 175.52 176.72 1wvi s ASN 1146N -6.70 -0.26 0.00 5.36 2.20 -1.26 -0.15 114.94 114.13 1wvi s ASN 1146Ca -0.12 0.06 0.26 0.00 -0.94 0.00 0.00 52.86 52.12 1wvi s ASN 1146Cb 0.08 0.39 0.73 0.00 -2.00 0.00 0.00 41.25 40.45 1wvi s ASN 1146CO 0.85 -0.58 1.57 -0.81 -2.94 0.00 0.00 177.10 175.19 1wvi n PRO 1147N 0.80 0.00 -1.67 3.55 -0.04 -1.26 -3.44 135.00 132.93 1wvi n PRO 1147Ca -0.20 0.00 -0.60 0.00 -0.04 0.00 0.00 63.50 62.67 1wvi n PRO 1147Cb 0.58 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.46 1wvi n PRO 1147CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wvi n ASP 1148N -1.50 1.59 0.16 3.54 8.00 -1.26 -3.74 116.55 123.33 1wvi n ASP 1148Ca 0.06 1.13 0.03 0.00 0.71 0.00 0.00 54.79 56.72 1wvi n ASP 1148Cb 0.34 -1.04 0.17 0.00 -0.02 0.00 0.00 41.12 40.56 1wvi n ASP 1148CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wvi h LEU 1149N 5.54 0.00 -8.77 0.64 -0.00 -1.90 0.38 115.31 111.20 1wvi h LEU 1149Ca -0.47 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 57.06 1wvi h LEU 1149Cb 1.35 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 41.87 1wvi h LEU 1149CO 0.89 0.49 -0.68 0.20 -0.00 0.00 0.00 178.44 179.34 1wvi s ASN 1150N -6.48 1.79 -0.14 -0.43 0.01 -1.26 -0.45 114.94 107.99 1wvi s ASN 1150Ca 0.02 -1.12 -0.01 0.00 -0.71 0.00 0.00 52.86 51.04 1wvi s ASN 1150Cb 0.10 0.01 0.03 0.00 0.41 0.00 0.00 41.25 41.79 1wvi s ASN 1150CO 0.72 -0.43 -0.06 -0.51 -1.51 0.00 0.00 177.10 175.32 1wvi s ILE 1151N -3.39 1.00 -0.16 0.60 1.10 0.30 -4.46 121.20 116.20 1wvi s ILE 1151Ca 0.23 -0.42 -0.29 0.00 -0.51 0.00 0.00 60.65 59.66 1wvi s ILE 1151Cb 0.04 -1.12 -0.00 0.00 0.15 0.00 0.00 42.46 41.53 1wvi s ILE 1151CO 0.05 0.24 1.03 -2.16 -2.11 0.00 0.00 174.94 171.98 1wvi s PRO 1152N 1.70 4.34 0.35 3.50 0.04 -1.26 -1.45 135.00 142.21 1wvi s PRO 1152Ca 0.03 1.39 0.04 0.00 0.04 0.00 0.00 61.00 62.49 1wvi s PRO 1152Cb -0.14 -3.59 -0.06 0.00 0.04 0.00 0.00 34.50 30.75 1wvi s PRO 1152CO -0.08 -0.47 0.06 0.95 0.04 0.00 0.00 177.00 177.51 1wvi s THR 1153N 2.58 1.19 0.58 1.26 -4.23 -0.07 -4.98 115.64 111.98 1wvi s THR 1153Ca 0.47 -2.00 0.43 0.00 -1.18 0.00 0.00 61.69 59.41 1wvi s THR 1153Cb -0.17 -2.75 0.44 0.00 1.34 0.00 0.00 72.50 71.36 1wvi s THR 1153CO 0.12 0.00 2.32 -0.08 -0.54 0.00 0.00 174.62 176.44 1wvi h GLU 1154N 2.03 0.00 0.00 3.99 4.57 -2.05 0.18 114.58 123.30 1wvi h GLU 1154Ca -0.41 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 1wvi h GLU 1154Cb 1.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 1wvi h GLU 1154CO 0.69 0.00 -0.38 -0.09 -1.18 0.00 0.00 179.01 178.05 1wvi h ARG 1155N 0.00 0.00 0.00 1.92 2.43 -1.98 -3.50 114.38 113.25 1wvi h ARG 1155Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1wvi h ARG 1155Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1wvi h ARG 1155CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 1wvi n GLY 1156N 1.28 0.65 3.52 2.80 0.00 0.64 -4.98 105.19 109.11 1wvi n GLY 1156Ca 0.04 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1wvi n GLY 1156CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvi s LEU 1157N 0.00 3.75 0.53 0.99 1.43 -1.26 -0.89 118.68 123.24 1wvi s LEU 1157Ca 0.00 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.98 1wvi s LEU 1157Cb 0.00 -2.52 0.02 0.00 0.03 0.00 0.00 46.19 43.73 1wvi s LEU 1157CO 0.00 -1.54 0.76 -0.76 0.23 0.00 0.00 176.35 175.04 1wvi s LEU 1158N 4.76 3.34 0.18 1.79 1.02 -0.53 -4.85 118.68 124.38 1wvi s LEU 1158Ca 0.37 0.10 -0.32 0.00 0.02 0.00 0.00 54.13 54.30 1wvi s LEU 1158Cb -0.06 -2.97 -0.11 0.00 0.02 0.00 0.00 46.19 43.06 1wvi s LEU 1158CO 0.02 -1.05 1.77 -2.84 0.02 0.00 0.00 176.35 174.26 1wvi s PRO 1159N -4.74 4.13 0.62 1.29 0.02 -1.26 -0.54 135.00 134.52 1wvi s PRO 1159Ca 0.55 2.61 0.06 0.00 0.02 0.00 0.00 61.00 64.24 1wvi s PRO 1159Cb -0.10 -3.27 0.10 0.00 0.02 0.00 0.00 34.50 31.25 1wvi s PRO 1159CO 0.39 -0.79 0.85 0.20 -0.33 0.00 0.00 177.00 177.32 1wvi s GLY 1160N 1.77 1.75 0.24 0.52 0.00 0.41 -4.43 107.32 107.57 1wvi s GLY 1160Ca 0.77 -1.99 -0.04 0.00 0.00 0.00 0.00 44.72 43.45 1wvi s GLY 1160CO 0.34 -1.50 1.77 0.00 0.00 0.00 0.00 173.10 173.71 1wvi h ALA 1161N -0.04 1.10 -0.43 3.20 0.00 -1.80 -1.32 119.26 119.97 1wvi h ALA 1161Ca -0.32 0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.70 1wvi h ALA 1161Cb 1.28 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1wvi h ALA 1161CO 0.41 -0.06 0.29 0.78 0.00 0.00 0.00 179.25 180.67 1wvi h GLY 1162N 0.62 0.46 0.99 0.00 0.00 -0.27 0.12 103.07 104.98 1wvi h GLY 1162Ca 0.40 -0.15 -0.11 0.00 0.00 0.00 0.00 47.33 47.47 1wvi h GLY 1162CO -0.31 0.12 -0.22 0.00 0.00 0.00 0.00 176.54 176.14 1wvi h ALA 1163N 1.76 0.49 -0.43 3.60 0.00 -1.35 -1.48 119.26 121.85 1wvi h ALA 1163Ca 0.19 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1wvi h ALA 1163Cb 0.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1wvi h ALA 1163CO -0.04 0.45 0.14 0.82 0.00 0.00 0.00 179.25 180.62 1wvi h ILE 1164N 0.53 1.22 -0.77 0.00 2.04 -1.09 -2.56 117.51 116.88 1wvi h ILE 1164Ca 0.07 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.29 1wvi h ILE 1164Cb 0.77 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.66 1wvi h ILE 1164CO 0.06 0.26 0.44 -0.07 0.00 0.00 0.00 178.15 178.83 1wvi h LEU 1165N 0.56 0.63 -1.13 1.44 3.38 -0.68 -1.78 115.31 117.73 1wvi h LEU 1165Ca 0.14 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1wvi h LEU 1165Cb 0.26 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1wvi h LEU 1165CO -0.01 0.38 0.03 -0.26 0.09 0.00 0.00 178.44 178.67 1wvi h PHE 1166N 0.76 0.66 -0.10 1.13 0.04 -0.96 0.19 116.94 118.65 1wvi h PHE 1166Ca 0.36 -0.07 0.01 0.00 2.80 0.00 0.00 57.97 61.07 1wvi h PHE 1166Cb 0.30 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1wvi h PHE 1166CO -0.07 0.61 0.03 1.25 -0.60 0.00 0.00 178.31 179.54 1wvi h LEU 1167N 0.61 0.03 -0.67 1.54 7.12 -0.94 -0.13 115.31 122.87 1wvi h LEU 1167Ca 0.13 0.01 -0.09 0.00 0.13 0.00 0.00 57.88 58.06 1wvi h LEU 1167Cb 0.34 0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 40.45 1wvi h LEU 1167CO 0.01 0.04 0.02 -0.07 -0.13 0.00 0.00 178.44 178.30 1wvi h LEU 1168N 0.08 1.02 -0.52 2.25 3.38 -0.86 -0.94 115.31 119.73 1wvi h LEU 1168Ca 0.04 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1wvi h LEU 1168Cb 0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1wvi h LEU 1168CO -0.04 1.06 0.35 -0.08 0.09 0.00 0.00 178.44 179.81 1wvi h GLU 1169N 0.97 0.69 -0.44 1.13 4.81 -0.37 -0.24 114.58 121.12 1wvi h GLU 1169Ca 0.18 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1wvi h GLU 1169Cb 0.53 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1wvi h GLU 1169CO 0.03 0.45 0.13 0.87 -0.73 0.00 0.00 179.01 179.76 1wvi h LYS 1170N 0.71 0.68 0.00 1.92 1.79 -0.72 0.46 116.57 121.41 1wvi h LYS 1170Ca 0.19 -0.15 -0.08 0.00 -2.18 0.00 0.00 60.65 58.44 1wvi h LYS 1170Cb -0.08 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.46 1wvi h LYS 1170CO -0.04 0.67 -0.36 0.00 -1.08 0.00 0.00 179.45 178.63 1wvi h ALA 1171N 0.98 1.28 0.00 3.86 0.00 -0.77 -3.30 119.26 121.31 1wvi h ALA 1171Ca 0.14 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1wvi h ALA 1171Cb 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wvi h ALA 1171CO -0.00 0.46 -1.37 0.25 0.00 0.00 0.00 179.25 178.58 1wvi n THR 1172N -3.93 0.00 -1.08 0.00 -2.24 -0.14 -5.00 114.28 101.89 1wvi n THR 1172Ca -0.02 -0.27 -0.03 0.00 -2.27 0.00 0.00 64.05 61.47 1wvi n THR 1172Cb 0.42 0.37 -0.01 0.00 -2.10 0.00 0.00 70.33 69.01 1wvi n THR 1172CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1wvi n ARG 1173N -1.80 -0.72 -4.65 -0.78 1.74 0.16 -4.96 116.66 105.65 1wvi n ARG 1173Ca -0.01 0.41 -0.33 0.00 -0.77 0.00 0.00 57.85 57.14 1wvi n ARG 1173Cb 0.29 -4.09 -0.14 0.00 -1.02 0.00 0.00 32.46 27.50 1wvi n ARG 1173CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1wvi s VAL 1174N -1.85 3.06 0.02 1.55 -7.23 -1.22 -5.04 120.40 109.68 1wvi s VAL 1174Ca 0.00 -0.65 -0.30 0.00 -1.81 0.00 0.00 61.98 59.22 1wvi s VAL 1174Cb 0.00 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 1wvi s VAL 1174CO 0.00 0.51 1.14 -0.54 -0.31 0.00 0.00 175.10 175.91 1wvi s LYS 1175N 0.52 4.45 0.41 4.82 -0.14 -1.26 -4.41 119.74 124.13 1wvi s LYS 1175Ca -0.08 1.66 -0.23 0.00 -1.36 0.00 0.00 55.97 55.96 1wvi s LYS 1175Cb -0.16 -3.42 -0.09 0.00 -1.68 0.00 0.00 37.83 32.49 1wvi s LYS 1175CO 0.04 -0.24 1.03 -1.25 -0.76 0.00 0.00 175.35 174.17 1wvi s PRO 1176N 1.28 4.12 -0.30 -1.68 0.04 -1.26 -4.93 135.00 132.27 1wvi s PRO 1176Ca 0.56 1.44 -0.25 0.00 0.04 0.00 0.00 61.00 62.80 1wvi s PRO 1176Cb -0.26 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.84 1wvi s PRO 1176CO 0.27 -0.17 0.85 -1.50 0.04 0.00 0.00 177.00 176.49 1wvi s ILE 1177N -1.76 4.75 -0.20 0.56 1.10 -0.16 -4.82 121.20 120.67 1wvi s ILE 1177Ca 0.60 1.34 -0.12 0.00 -0.51 0.00 0.00 60.65 61.96 1wvi s ILE 1177Cb -0.20 -4.19 -0.05 0.00 0.15 0.00 0.00 42.46 38.17 1wvi s ILE 1177CO 0.25 -0.27 0.20 -0.63 -2.11 0.00 0.00 174.94 172.38 1wvi s ILE 1178N 3.06 5.35 -0.16 2.00 1.01 -1.26 -0.90 121.20 130.31 1wvi s ILE 1178Ca 0.35 0.32 -0.23 0.00 0.00 0.00 0.00 60.65 61.09 1wvi s ILE 1178Cb -0.14 -3.54 -0.21 0.00 0.01 0.00 0.00 42.46 38.58 1wvi s ILE 1178CO 0.12 0.38 0.49 0.40 0.00 0.00 0.00 174.94 176.33 1wvi h ILE 1179N 4.80 1.29 -3.24 2.92 1.08 -1.29 -3.44 117.51 119.64 1wvi h ILE 1179Ca -0.40 -2.12 -0.42 0.00 -0.39 0.00 0.00 64.86 61.53 1wvi h ILE 1179Cb 1.16 2.59 0.21 0.00 -3.07 0.00 0.00 36.82 37.71 1wvi h ILE 1179CO 0.73 0.44 -0.01 -0.83 -0.69 0.00 0.00 178.15 177.79 1wvi s GLY 1180N -4.36 1.51 0.43 5.37 0.00 0.79 -2.24 107.32 108.82 1wvi s GLY 1180Ca -0.20 -0.40 -0.25 0.00 0.00 0.00 0.00 44.72 43.86 1wvi s GLY 1180CO 0.58 0.41 1.34 0.28 0.00 0.00 0.00 173.10 175.70 1wvi n LYS 1181N -5.08 2.07 -0.58 2.90 5.02 -1.26 -0.42 118.16 120.82 1wvi n LYS 1181Ca 0.06 0.74 0.01 0.00 -2.02 0.00 0.00 58.31 57.09 1wvi n LYS 1181Cb 0.56 -2.48 0.22 0.00 -0.02 0.00 0.00 35.03 33.31 1wvi n LYS 1181CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1wvi n PRO 1182N -0.03 3.08 -1.45 1.97 -0.04 -1.25 -4.47 135.00 132.81 1wvi n PRO 1182Ca 0.06 -1.90 -0.30 0.00 -0.04 0.00 0.00 63.50 61.32 1wvi n PRO 1182Cb 0.40 -1.92 0.10 0.00 -0.04 0.00 0.00 33.50 32.04 1wvi n PRO 1182CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1wvi s GLU 1183N -2.06 1.89 0.13 0.54 0.41 0.45 -4.45 118.70 115.60 1wvi s GLU 1183Ca 0.33 0.72 -0.18 0.00 -0.41 0.00 0.00 54.97 55.43 1wvi s GLU 1183Cb 0.26 -1.89 -0.03 0.00 -1.78 0.00 0.00 34.13 30.69 1wvi s GLU 1183CO 0.09 -1.78 1.73 0.00 -0.49 0.00 0.00 175.26 174.82 1wvi h ALA 1184N -1.21 0.40 -0.29 5.21 0.00 -1.84 -3.30 119.26 118.23 1wvi h ALA 1184Ca -0.47 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.42 1wvi h ALA 1184Cb 1.27 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1wvi h ALA 1184CO 0.58 -0.08 -0.06 0.28 0.00 0.00 0.00 179.25 179.97 1wvi h VAL 1185N 0.39 0.72 -0.41 0.00 2.07 -1.85 0.14 116.25 117.30 1wvi h VAL 1185Ca 0.11 -0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.55 1wvi h VAL 1185Cb 0.05 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1wvi h VAL 1185CO -0.02 0.00 -0.04 -0.29 0.02 0.00 0.00 177.57 177.25 1wvi h ILE 1186N 0.01 1.24 -0.34 4.57 2.10 -1.57 -1.66 117.51 121.85 1wvi h ILE 1186Ca 0.14 -1.00 -0.14 0.00 1.08 0.00 0.00 64.86 64.95 1wvi h ILE 1186Cb 0.21 0.96 -0.01 0.00 -1.09 0.00 0.00 36.82 36.89 1wvi h ILE 1186CO -0.29 0.34 -0.31 0.24 -1.08 0.00 0.00 178.15 177.05 1wvi h MET 1187N 0.64 0.82 -0.29 2.19 2.86 -1.49 -0.40 114.93 119.26 1wvi h MET 1187Ca 0.12 -0.42 -0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1wvi h MET 1187Cb 0.46 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1wvi h MET 1187CO 0.02 1.06 0.17 -0.91 1.06 0.00 0.00 176.91 178.31 1wvi h ASN 1188N 0.60 0.36 -0.42 1.22 -0.26 -0.54 0.65 115.58 117.19 1wvi h ASN 1188Ca 0.06 -0.07 -0.11 0.00 -0.56 0.00 0.00 56.30 55.62 1wvi h ASN 1188Cb 0.89 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 38.05 1wvi h ASN 1188CO 0.08 0.32 -0.18 0.11 -1.06 0.00 0.00 177.43 176.70 1wvi h LYS 1189N 0.37 0.86 -0.68 0.81 1.79 -1.28 -0.37 116.57 118.07 1wvi h LYS 1189Ca 0.10 -0.37 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 1wvi h LYS 1189Cb 0.03 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.62 1wvi h LYS 1189CO -0.02 1.01 0.38 0.00 -1.08 0.00 0.00 179.45 179.74 1wvi h ALA 1190N 0.83 0.87 -0.86 3.86 0.00 -0.89 -0.64 119.26 122.43 1wvi h ALA 1190Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wvi h ALA 1190Cb 0.74 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1wvi h ALA 1190CO 0.06 0.37 0.55 1.25 0.00 0.00 0.00 179.25 181.48 1wvi h LEU 1191N 0.93 1.00 -0.30 0.00 6.46 -0.65 0.33 115.31 123.07 1wvi h LEU 1191Ca 0.24 -0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.94 1wvi h LEU 1191Cb 0.03 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 1wvi h LEU 1191CO -0.04 0.74 0.12 -0.78 -0.62 0.00 0.00 178.44 177.87 1wvi h ASP 1192N 1.17 0.42 0.39 1.25 1.82 -0.00 -2.22 116.42 119.24 1wvi h ASP 1192Ca 0.31 -0.17 -0.06 0.00 -0.39 0.00 0.00 57.03 56.72 1wvi h ASP 1192Cb -0.10 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 39.79 1wvi h ASP 1192CO -0.06 0.47 -0.31 0.03 -1.61 0.00 0.00 179.24 177.76 1wvi h ARG 1193N 0.34 0.00 0.00 0.28 3.08 -0.58 -2.31 114.38 115.20 1wvi h ARG 1193Ca 0.10 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1wvi h ARG 1193Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1wvi h ARG 1193CO -0.01 0.31 -0.20 1.25 -1.07 0.00 0.00 179.97 180.25 1wvi h LEU 1194N 0.00 0.00 0.70 3.04 5.85 -0.35 -3.47 115.31 121.08 1wvi h LEU 1194Ca -0.00 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.55 1wvi h LEU 1194Cb 0.58 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 1wvi h LEU 1194CO 0.04 0.20 -0.18 0.61 -0.34 0.00 0.00 178.44 178.77 1wvi n GLY 1195N -0.86 0.66 3.38 3.75 0.00 -0.87 -4.83 105.19 106.43 1wvi n GLY 1195Ca -0.02 -0.61 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1wvi n GLY 1195CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wvi s VAL 1196N -2.35 1.63 0.46 1.61 1.01 -1.26 -5.11 120.40 116.39 1wvi s VAL 1196Ca 0.00 -2.16 -0.21 0.00 0.00 0.00 0.00 61.98 59.62 1wvi s VAL 1196Cb 0.00 -2.26 -0.09 0.00 0.00 0.00 0.00 36.38 34.03 1wvi s VAL 1196CO 0.00 -0.44 1.02 -0.54 0.00 0.00 0.00 175.10 175.14 1wvi s LYS 1197N -3.70 3.94 0.26 2.72 1.02 -1.26 -4.85 119.74 117.87 1wvi s LYS 1197Ca 0.26 1.31 -0.04 0.00 0.02 0.00 0.00 55.97 57.52 1wvi s LYS 1197Cb 0.02 -2.15 0.51 0.00 -0.52 0.00 0.00 37.83 35.69 1wvi s LYS 1197CO 0.09 -0.31 1.64 -0.09 -0.92 0.00 0.00 175.35 175.77 1wvi h ARG 1198N 1.73 0.14 0.00 1.68 2.43 -1.95 0.28 114.38 118.69 1wvi h ARG 1198Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1wvi h ARG 1198Cb 1.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1wvi h ARG 1198CO 0.60 0.09 0.00 -2.39 -1.51 0.00 0.00 179.97 176.76 1wvi n HIS 1199N -5.30 0.00 1.01 2.20 1.44 -1.26 -2.47 115.22 110.83 1wvi n HIS 1199Ca 0.16 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.98 1wvi n HIS 1199Cb 0.53 -0.24 -0.02 0.00 0.12 0.00 0.00 29.99 30.38 1wvi n HIS 1199CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1wvi n GLU 1200N -1.24 0.95 -3.25 -1.40 1.02 0.98 -4.96 120.64 112.73 1wvi n GLU 1200Ca 0.12 -0.78 -0.18 0.00 -0.02 0.00 0.00 57.16 56.30 1wvi n GLU 1200Cb 0.16 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 1wvi n GLU 1200CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wvi s ALA 1201N -2.59 4.37 -0.14 0.62 0.00 -1.03 -0.66 121.76 122.32 1wvi s ALA 1201Ca 0.16 -1.60 -0.11 0.00 0.00 0.00 0.00 51.96 50.41 1wvi s ALA 1201Cb 0.18 -1.60 0.04 0.00 0.00 0.00 0.00 23.12 21.74 1wvi s ALA 1201CO 0.63 -0.17 0.37 -1.50 0.00 0.00 0.00 175.76 175.09 1wvi s ILE 1202N -2.29 -0.01 -0.22 0.00 2.07 -0.98 -3.94 121.20 115.84 1wvi s ILE 1202Ca 0.50 0.04 -0.16 0.00 -1.41 0.00 0.00 60.65 59.63 1wvi s ILE 1202Cb -0.09 -0.53 -0.04 0.00 0.13 0.00 0.00 42.46 41.93 1wvi s ILE 1202CO 0.32 0.02 0.39 -0.32 -1.91 0.00 0.00 174.94 173.43 1wvi s MET 1203N 0.65 4.13 -0.19 3.50 -2.45 0.12 -1.00 119.30 124.06 1wvi s MET 1203Ca -0.04 0.16 -0.04 0.00 -1.25 0.00 0.00 55.69 54.52 1wvi s MET 1203Cb -0.05 -3.57 -0.02 0.00 1.25 0.00 0.00 34.83 32.45 1wvi s MET 1203CO -0.04 -0.10 -0.04 0.08 1.05 0.00 0.00 175.02 175.97 1wvi s VAL 1204N 1.50 3.59 0.37 10.11 1.01 0.18 -0.85 120.40 136.31 1wvi s VAL 1204Ca 0.18 -0.44 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1wvi s VAL 1204Cb -0.15 -2.61 0.05 0.00 0.00 0.00 0.00 36.38 33.67 1wvi s VAL 1204CO 0.08 0.45 0.78 -0.83 0.00 0.00 0.00 175.10 175.58 1wvi s GLY 1205N 1.02 0.29 -0.01 4.51 0.00 -0.78 -0.91 107.32 111.45 1wvi s GLY 1205Ca 0.01 -0.68 0.08 0.00 0.00 0.00 0.00 44.72 44.13 1wvi s GLY 1205CO 0.01 -0.24 0.27 2.09 0.00 0.00 0.00 173.10 175.22 1wvi n ASP 1206N -1.26 1.65 -4.38 1.64 5.75 -1.26 -0.94 116.55 117.74 1wvi n ASP 1206Ca -0.08 -0.37 -0.39 0.00 -0.01 0.00 0.00 54.79 53.95 1wvi n ASP 1206Cb 0.60 1.18 -0.12 0.00 -1.03 0.00 0.00 41.12 41.75 1wvi n ASP 1206CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1wvi s ASN 1207N -2.34 5.49 0.12 -1.12 3.84 -1.26 -2.26 114.94 117.41 1wvi s ASN 1207Ca 0.00 -0.77 -0.22 0.00 0.21 0.00 0.00 52.86 52.09 1wvi s ASN 1207Cb 0.06 -1.97 -0.06 0.00 -0.55 0.00 0.00 41.25 38.73 1wvi s ASN 1207CO 0.34 -0.27 1.70 0.22 -2.79 0.00 0.00 177.10 176.31 1wvi h TYR 1208N 8.34 -0.18 -0.69 0.43 3.20 -1.94 0.65 116.97 126.77 1wvi h TYR 1208Ca -0.29 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 1wvi h TYR 1208Cb 1.12 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 39.46 1wvi h TYR 1208CO 0.61 -0.12 0.19 1.25 -1.64 0.00 0.00 178.16 178.45 1wvi h LEU 1209N -0.08 1.02 0.08 2.82 5.85 -1.96 -0.54 115.31 122.50 1wvi h LEU 1209Ca 0.07 -0.20 -0.36 0.00 0.84 0.00 0.00 57.88 58.22 1wvi h LEU 1209Cb 0.18 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1wvi h LEU 1209CO -0.15 0.96 -2.07 0.35 -0.34 0.00 0.00 178.44 177.18 1wvi n THR 1210N -4.25 1.69 -0.11 1.05 -2.24 -1.18 -4.27 114.28 104.98 1wvi n THR 1210Ca 0.05 -0.58 -0.22 0.00 -2.27 0.00 0.00 64.05 61.03 1wvi n THR 1210Cb 0.24 -1.69 -0.10 0.00 -2.10 0.00 0.00 70.33 66.68 1wvi n THR 1210CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1wvi n ASP 1211N -3.52 1.88 -0.11 3.42 8.00 0.20 -3.69 116.55 122.72 1wvi n ASP 1211Ca -0.36 0.42 -0.12 0.00 0.71 0.00 0.00 54.79 55.44 1wvi n ASP 1211Cb 1.00 -0.92 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1wvi n ASP 1211CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1wvi h ILE 1212N -1.00 1.29 -0.09 0.53 1.08 -1.28 -2.52 117.51 115.51 1wvi h ILE 1212Ca -0.39 -1.38 -0.04 0.00 -0.39 0.00 0.00 64.86 62.66 1wvi h ILE 1212Cb 1.30 1.44 -0.01 0.00 -3.07 0.00 0.00 36.82 36.47 1wvi h ILE 1212CO -0.24 0.45 -0.14 0.74 -0.69 0.00 0.00 178.15 178.28 1wvi h THR 1213N 0.53 1.15 -0.66 -0.27 2.02 -1.28 0.06 112.91 114.46 1wvi h THR 1213Ca 0.07 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 1wvi h THR 1213Cb 0.79 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 1wvi h THR 1213CO 0.06 0.21 0.36 0.00 0.37 0.00 0.00 175.52 176.52 1wvi h ALA 1214N 1.73 1.38 0.29 6.16 0.00 -1.54 0.38 119.26 127.67 1wvi h ALA 1214Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1wvi h ALA 1214Cb 0.33 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1wvi h ALA 1214CO 0.02 0.50 -0.14 0.78 0.00 0.00 0.00 179.25 180.42 1wvi h GLY 1215N 0.98 -0.41 -0.04 0.00 0.00 -0.75 -3.00 103.07 99.85 1wvi h GLY 1215Ca 0.24 0.15 0.07 0.00 0.00 0.00 0.00 47.33 47.79 1wvi h GLY 1215CO -0.04 -0.15 -0.30 -2.22 0.00 0.00 0.00 176.54 173.83 1wvi h ILE 1216N -1.07 0.28 -0.40 2.60 2.04 -1.11 0.19 117.51 120.02 1wvi h ILE 1216Ca -0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1wvi h ILE 1216Cb 0.37 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 1wvi h ILE 1216CO 0.07 0.00 0.27 0.50 0.00 0.00 0.00 178.15 178.98 1wvi h LYS 1217N -0.27 0.45 -0.47 2.37 3.64 -1.06 -2.73 116.57 118.50 1wvi h LYS 1217Ca 0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1wvi h LYS 1217Cb 0.52 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1wvi h LYS 1217CO -0.47 0.30 0.00 0.09 -2.27 0.00 0.00 179.45 177.09 1wvi n ASN 1218N -4.48 4.27 -3.46 4.20 3.02 -0.68 -4.97 115.26 113.15 1wvi n ASN 1218Ca 0.04 -2.59 -0.18 0.00 -0.03 0.00 0.00 54.58 51.82 1wvi n ASN 1218Cb 0.13 -0.51 0.07 0.00 -0.61 0.00 0.00 39.78 38.86 1wvi n ASN 1218CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wvi n ASP 1219N 0.47 -2.79 -4.00 6.41 2.03 0.00 -5.01 116.55 113.66 1wvi n ASP 1219Ca 0.22 -0.69 -0.21 0.00 0.52 0.00 0.00 54.79 54.62 1wvi n ASP 1219Cb 0.84 -4.85 -0.16 0.00 -0.72 0.00 0.00 41.12 36.23 1wvi n ASP 1219CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wvi s ILE 1220N -3.44 0.85 0.78 5.18 1.01 0.44 -4.75 121.20 121.27 1wvi s ILE 1220Ca 0.10 -0.37 -0.15 0.00 0.00 0.00 0.00 60.65 60.23 1wvi s ILE 1220Cb -0.02 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.70 1wvi s ILE 1220CO 0.75 0.27 0.78 0.00 0.00 0.00 0.00 174.94 176.74 1wvi n ALA 1221N 3.48 -1.01 -2.76 9.38 0.00 -1.25 -3.68 120.51 124.65 1wvi n ALA 1221Ca -0.20 -0.30 -0.16 0.00 0.00 0.00 0.00 53.44 52.78 1wvi n ALA 1221Cb 0.53 -2.00 -0.14 0.00 0.00 0.00 0.00 19.45 17.84 1wvi n ALA 1221CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wvi s THR 1222N -2.01 0.54 -0.21 0.00 -4.23 -1.26 -0.70 115.64 107.77 1wvi s THR 1222Ca 0.68 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.69 1wvi s THR 1222Cb -0.31 -0.49 0.05 0.00 1.34 0.00 0.00 72.50 73.08 1wvi s THR 1222CO 0.56 0.00 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.36 1wvi s LEU 1223N -0.55 2.21 -0.22 4.79 0.20 -0.03 -1.64 118.68 123.44 1wvi s LEU 1223Ca -0.01 -0.96 -0.10 0.00 0.69 0.00 0.00 54.13 53.76 1wvi s LEU 1223Cb -0.05 -1.11 -0.05 0.00 -0.43 0.00 0.00 46.19 44.56 1wvi s LEU 1223CO 0.00 -0.20 0.13 -0.22 -0.29 0.00 0.00 176.35 175.77 1wvi s LEU 1224N 1.47 4.03 -0.24 -0.68 1.98 0.01 -1.86 118.68 123.39 1wvi s LEU 1224Ca -0.03 0.11 -0.07 0.00 -2.89 0.00 0.00 54.13 51.25 1wvi s LEU 1224Cb -0.17 -2.06 -0.03 0.00 0.66 0.00 0.00 46.19 44.59 1wvi s LEU 1224CO -0.07 0.11 0.07 -0.69 -1.89 0.00 0.00 176.35 173.88 1wvi s VAL 1225N 0.78 4.38 -2.00 1.68 1.01 -0.12 -0.77 120.40 125.37 1wvi s VAL 1225Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1wvi s VAL 1225Cb -0.13 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.21 1wvi s VAL 1225CO 0.02 0.35 0.30 0.35 0.00 0.00 0.00 175.10 176.11 1wvi n THR 1226N 4.80 0.00 -1.67 3.92 -2.24 0.24 -4.38 114.28 114.94 1wvi n THR 1226Ca -0.16 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.37 1wvi n THR 1226Cb 0.52 -0.77 0.18 0.00 -2.10 0.00 0.00 70.33 68.15 1wvi n THR 1226CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1wvi n THR 1227N -0.78 0.00 -4.04 4.28 5.66 -1.26 -4.20 114.28 113.94 1wvi n THR 1227Ca 0.00 -0.77 0.00 0.00 -3.05 0.00 0.00 64.05 60.23 1wvi n THR 1227Cb 0.00 -1.55 0.00 0.00 -1.55 0.00 0.00 70.33 67.23 1wvi n THR 1227CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1wvi n GLY 1228N -2.39 0.89 0.00 1.09 0.00 -1.21 -4.31 105.19 99.27 1wvi n GLY 1228Ca 0.14 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1wvi n GLY 1228CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wvi n PHE 1229N 0.00 0.00 -1.99 1.61 7.35 -1.26 -4.30 117.46 118.88 1wvi n PHE 1229Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 1wvi n PHE 1229Cb 0.00 -0.38 -0.03 0.00 0.35 0.00 0.00 39.48 39.42 1wvi n PHE 1229CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1wvi s THR 1230N -2.76 3.41 0.58 -2.13 2.01 -0.96 -4.97 115.64 110.82 1wvi s THR 1230Ca 0.00 0.37 -0.19 0.00 0.31 0.00 0.00 61.69 62.18 1wvi s THR 1230Cb 0.00 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1wvi s THR 1230CO 0.00 -0.54 1.18 -0.54 -0.69 0.00 0.00 174.62 174.03 1wvi s LYS 1231N 6.23 3.06 0.59 4.92 1.02 -1.26 -4.52 119.74 129.78 1wvi s LYS 1231Ca 0.77 1.74 0.30 0.00 0.02 0.00 0.00 55.97 58.79 1wvi s LYS 1231Cb -0.19 -1.95 1.80 0.00 -0.52 0.00 0.00 37.83 36.97 1wvi s LYS 1231CO 0.29 -1.12 2.23 -1.00 -0.92 0.00 0.00 175.35 174.84 1wvi h PRO 1232N 0.91 0.00 0.00 -1.68 0.13 -1.94 -1.95 132.00 127.47 1wvi h PRO 1232Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 1wvi h PRO 1232Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1wvi h PRO 1232CO 0.55 0.00 -0.25 0.93 -0.23 0.00 0.00 178.00 179.01 1wvi h GLU 1233N 0.00 0.00 0.00 0.86 3.07 -1.96 -3.19 114.58 113.35 1wvi h GLU 1233Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1wvi h GLU 1233Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1wvi h GLU 1233CO -0.00 0.25 0.00 0.93 -1.40 0.00 0.00 179.01 178.79 1wvi h GLU 1234N 0.00 0.00 -0.90 2.33 5.08 -1.72 -3.36 114.58 116.01 1wvi h GLU 1234Ca -0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1wvi h GLU 1234Cb 1.08 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 1wvi h GLU 1234CO 0.03 0.00 0.59 -0.39 -1.00 0.00 0.00 179.01 178.24 1wvi h VAL 1235N 0.00 1.23 -0.02 3.13 -1.51 -1.61 -2.69 116.25 114.78 1wvi h VAL 1235Ca 0.00 -0.43 -0.01 0.00 -1.23 0.00 0.00 66.70 65.03 1wvi h VAL 1235Cb 0.81 -0.09 -0.00 0.00 -2.13 0.00 0.00 31.29 29.88 1wvi h VAL 1235CO 0.00 0.23 -0.03 -0.65 -1.23 0.00 0.00 177.57 175.89 1wvi h PRO 1236N 1.22 0.03 -0.00 5.19 0.11 -1.81 -2.28 132.00 134.45 1wvi h PRO 1236Ca 0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1wvi h PRO 1236Cb -0.13 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1wvi h PRO 1236CO -0.07 0.06 -0.15 0.00 -0.21 0.00 0.00 178.00 177.63 1wvi n ALA 1237N -2.53 2.81 -1.73 -0.75 0.00 -1.02 -4.92 120.51 112.37 1wvi n ALA 1237Ca -0.03 -0.26 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 1wvi n ALA 1237Cb 0.12 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 1wvi n ALA 1237CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wvi n LEU 1238N -1.06 4.09 -0.17 0.00 4.77 -0.86 -4.90 117.00 118.86 1wvi n LEU 1238Ca 0.12 1.18 -0.01 0.00 -0.03 0.00 0.00 56.01 57.28 1wvi n LEU 1238Cb 0.29 -1.55 0.24 0.00 -2.33 0.00 0.00 43.42 40.07 1wvi n LEU 1238CO 0.25 -0.08 1.14 1.55 -1.33 0.00 0.00 177.39 178.92 1wvi h PRO 1239N 3.82 0.90 -4.09 3.23 0.13 -1.91 -3.40 132.00 130.68 1wvi h PRO 1239Ca -0.47 -0.10 -0.50 0.00 -0.87 0.00 0.00 66.00 64.06 1wvi h PRO 1239Cb 1.25 -0.18 -0.37 0.00 0.13 0.00 0.00 31.00 31.83 1wvi h PRO 1239CO 0.72 0.67 -0.79 0.42 -0.23 0.00 0.00 178.00 178.79 1wvi s ILE 1240N -5.59 0.83 0.28 -3.56 -1.09 -1.26 -5.13 121.20 105.68 1wvi s ILE 1240Ca -0.10 -0.18 -0.29 0.00 -2.23 0.00 0.00 60.65 57.84 1wvi s ILE 1240Cb 0.17 -0.88 -0.10 0.00 -1.58 0.00 0.00 42.46 40.07 1wvi s ILE 1240CO 0.79 0.33 1.14 -1.10 -1.23 0.00 0.00 174.94 174.87 1wvi s GLN 1241N 1.67 4.58 0.96 2.79 -1.52 -1.26 -5.02 119.66 121.86 1wvi s GLN 1241Ca 0.03 1.87 -0.12 0.00 -1.95 0.00 0.00 55.36 55.19 1wvi s GLN 1241Cb -0.13 -3.18 0.17 0.00 -0.22 0.00 0.00 33.01 29.65 1wvi s GLN 1241CO -0.06 0.12 1.09 -1.25 -0.25 0.00 0.00 175.29 174.94 1wvi s PRO 1242N -1.39 0.73 0.36 2.91 0.04 -1.26 -4.90 135.00 131.49 1wvi s PRO 1242Ca 0.46 0.70 0.08 0.00 0.04 0.00 0.00 61.00 62.28 1wvi s PRO 1242Cb -0.33 -1.76 0.70 0.00 0.04 0.00 0.00 34.50 33.15 1wvi s PRO 1242CO 0.43 -2.57 1.88 -0.44 0.04 0.00 0.00 177.00 176.33 1wvi h ASP 1243N -1.78 0.29 -4.28 6.66 5.19 -1.86 -3.44 116.42 117.20 1wvi h ASP 1243Ca -0.52 -0.07 -0.20 0.00 -0.62 0.00 0.00 57.03 55.62 1wvi h ASP 1243Cb 1.31 -0.08 -0.25 0.00 0.18 0.00 0.00 39.33 40.49 1wvi h ASP 1243CO 0.55 0.46 -0.67 -0.36 -3.12 0.00 0.00 179.24 176.10 1wvi s PHE 1244N -4.71 0.08 -0.07 4.55 0.08 -0.65 -5.02 117.98 112.23 1wvi s PHE 1244Ca -0.06 -0.15 0.01 0.00 0.12 0.00 0.00 56.93 56.85 1wvi s PHE 1244Cb 0.15 -0.06 0.02 0.00 -0.57 0.00 0.00 43.02 42.56 1wvi s PHE 1244CO 0.75 -0.10 -0.08 0.08 -0.10 0.00 0.00 175.22 175.77 1wvi s VAL 1245N -0.62 0.87 0.05 -0.44 1.01 -1.26 -0.81 120.40 119.20 1wvi s VAL 1245Ca -0.07 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1wvi s VAL 1245Cb -0.04 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 1wvi s VAL 1245CO -0.00 0.31 -0.09 -0.76 0.00 0.00 0.00 175.10 174.56 1wvi s LEU 1246N 1.08 2.26 0.28 3.92 1.43 0.05 -4.98 118.68 122.71 1wvi s LEU 1246Ca -0.08 -0.56 0.20 0.00 -1.03 0.00 0.00 54.13 52.67 1wvi s LEU 1246Cb -0.14 -0.24 0.10 0.00 0.03 0.00 0.00 46.19 45.94 1wvi s LEU 1246CO -0.01 -0.17 1.28 0.77 0.23 0.00 0.00 176.35 178.45 1wvi h SER 1247N 4.48 0.00 -4.12 2.29 4.64 -1.95 0.70 113.55 119.58 1wvi h SER 1247Ca -0.37 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.84 1wvi h SER 1247Cb 1.20 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.06 1wvi h SER 1247CO 0.41 0.20 -0.21 -0.55 -0.87 0.00 0.00 176.83 175.80 1wvi s SER 1248N -5.94 -0.41 0.62 4.97 0.15 -1.26 -4.40 113.70 107.43 1wvi s SER 1248Ca 0.03 0.71 0.37 0.00 0.70 0.00 0.00 55.95 57.76 1wvi s SER 1248Cb 0.07 0.75 2.07 0.00 -1.71 0.00 0.00 66.02 67.20 1wvi s SER 1248CO 0.74 -0.22 2.28 -0.07 1.20 0.00 0.00 173.24 177.18 1wvi h LEU 1249N 5.10 0.00 -2.45 3.45 -0.00 -1.89 -1.09 115.31 118.42 1wvi h LEU 1249Ca -0.27 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.61 1wvi h LEU 1249Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.84 1wvi h LEU 1249CO 0.27 0.01 0.03 0.00 -0.00 0.00 0.00 178.44 178.75 1wvi h ALA 1250N 1.99 1.55 0.00 1.53 0.00 -1.96 -0.44 119.26 121.93 1wvi h ALA 1250Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wvi h ALA 1250Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1wvi h ALA 1250CO 0.00 -0.04 0.00 0.39 0.00 0.00 0.00 179.25 179.61 1wvi n GLU 1251N -3.83 0.15 -2.52 0.00 1.02 -0.41 -4.81 120.64 110.24 1wvi n GLU 1251Ca -0.02 0.25 -0.42 0.00 -0.02 0.00 0.00 57.16 56.95 1wvi n GLU 1251Cb 0.11 -1.73 -0.03 0.00 -0.02 0.00 0.00 31.44 29.77 1wvi n GLU 1251CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1wvi s TRP 1252N -3.14 3.55 -0.22 -0.32 -0.11 -0.18 -5.03 118.94 113.49 1wvi s TRP 1252Ca 0.08 1.50 -0.01 0.00 1.22 0.00 0.00 56.10 58.90 1wvi s TRP 1252Cb 0.12 -3.30 0.02 0.00 -1.50 0.00 0.00 33.47 28.82 1wvi s TRP 1252CO 0.46 -0.74 -0.11 0.34 -4.62 0.00 0.00 176.95 172.28 1wvi s ASP 1253N 0.65 3.91 0.00 5.86 2.15 -1.26 -5.10 116.67 122.88 1wvi s ASP 1253Ca 0.54 -0.77 0.22 0.00 0.43 0.00 0.00 52.55 52.97 1wvi s ASP 1253Cb -0.27 -1.60 1.33 0.00 -0.30 0.00 0.00 42.92 42.07 1wvi s ASP 1253CO 0.31 -0.07 1.70 0.49 -0.17 0.00 0.00 175.17 177.43