#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bqi n ASP 1220N -1.45 3.80 0.00 0.00 5.68 -1.26 -4.84 116.55 118.48 3bqi n ASP 1220Ca 0.01 -2.20 0.00 0.00 -0.50 0.00 0.00 54.79 52.10 3bqi n ASP 1220Cb 0.61 -1.01 0.00 0.00 -1.14 0.00 0.00 41.12 39.58 3bqi n ASP 1220CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3bqi n LEU 1221N 2.57 0.00 -0.49 -2.12 -0.00 -1.26 -1.22 117.00 114.48 3bqi n LEU 1221Ca 0.29 0.19 0.13 0.00 -0.00 0.00 0.00 56.01 56.62 3bqi n LEU 1221Cb 0.65 -0.03 0.37 0.00 -0.00 0.00 0.00 43.42 44.41 3bqi n LEU 1221CO 0.15 -0.03 0.72 0.59 -0.00 0.00 0.00 177.39 178.82 3bqi n ASN 1222N -0.99 1.64 -4.55 1.45 3.02 -1.26 -4.82 115.26 109.75 3bqi n ASN 1222Ca 0.00 -1.40 -0.40 0.00 -0.03 0.00 0.00 54.58 52.74 3bqi n ASN 1222Cb 0.00 0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 3bqi n ASN 1222CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3bqi s ALA 1223N -2.19 2.60 0.18 5.41 0.00 -0.36 -4.99 121.76 122.41 3bqi s ALA 1223Ca 0.31 -1.04 -0.25 0.00 0.00 0.00 0.00 51.96 50.98 3bqi s ALA 1223Cb 0.20 -4.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.00 3bqi s ALA 1223CO 0.40 -3.39 0.78 -0.08 0.00 0.00 0.00 175.76 173.47 3bqi s THR 1224N 6.72 4.38 -0.22 0.00 -1.32 -1.26 -4.93 115.64 119.00 3bqi s THR 1224Ca 0.47 1.67 -0.04 0.00 -1.21 0.00 0.00 61.69 62.58 3bqi s THR 1224Cb -0.10 -4.11 0.12 0.00 -1.51 0.00 0.00 72.50 66.90 3bqi s THR 1224CO 0.18 0.49 0.38 0.21 -2.21 0.00 0.00 174.62 173.67 3bqi s ASN 1225N -1.21 0.12 0.07 8.08 3.84 -1.26 -5.16 114.94 119.42 3bqi s ASN 1225Ca 0.37 0.48 0.03 0.00 0.21 0.00 0.00 52.86 53.95 3bqi s ASN 1225Cb -0.22 1.15 -0.04 0.00 -0.55 0.00 0.00 41.25 41.58 3bqi s ASN 1225CO 0.26 -0.28 0.03 -0.72 -2.79 0.00 0.00 177.10 173.61 3bqi s TYR 1226N 2.55 3.10 0.00 0.43 -0.85 -1.26 -4.98 117.35 116.34 3bqi s TYR 1226Ca 0.07 0.04 0.08 0.00 -0.52 0.00 0.00 57.07 56.75 3bqi s TYR 1226Cb -0.14 -1.60 -0.02 0.00 0.38 0.00 0.00 41.96 40.58 3bqi s TYR 1226CO -0.14 0.50 -0.26 0.96 -1.52 0.00 0.00 175.55 175.09 3bqi s ILE 1227N -1.30 2.05 0.39 -3.49 -4.36 -1.26 -5.13 121.20 108.10 3bqi s ILE 1227Ca 0.26 -1.18 -0.24 0.00 -0.26 0.00 0.00 60.65 59.23 3bqi s ILE 1227Cb -0.12 -1.72 -0.10 0.00 1.25 0.00 0.00 42.46 41.78 3bqi s ILE 1227CO 0.18 0.51 0.99 0.00 0.24 0.00 0.00 174.94 176.86 3bqi s ARG 1228N -0.80 4.29 0.00 0.37 1.04 -1.26 -3.79 118.95 118.81 3bqi s ARG 1228Ca 0.10 1.34 0.00 0.00 -1.04 0.00 0.00 55.73 56.13 3bqi s ARG 1228Cb -0.10 -2.50 0.00 0.00 -2.04 0.00 0.00 34.95 30.31 3bqi s ARG 1228CO -0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.30 175.67 3bqi n GLY 1229N 0.11 3.29 3.07 3.88 0.00 -1.26 -4.65 105.19 109.63 3bqi n GLY 1229Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3bqi n GLY 1229CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bqi s GLN 1231N 0.26 2.56 0.26 0.00 -1.52 -1.26 -4.90 119.66 115.06 3bqi s GLN 1231Ca 0.14 -1.34 -0.28 0.00 -1.95 0.00 0.00 55.36 51.94 3bqi s GLN 1231Cb -0.22 -2.68 -0.15 0.00 -0.22 0.00 0.00 33.01 29.75 3bqi s GLN 1231CO -0.03 -0.57 0.83 0.43 -0.25 0.00 0.00 175.29 175.69 3bqi n SER 1232N -2.08 0.37 -4.76 5.90 7.64 -1.26 -4.90 113.62 114.53 3bqi n SER 1232Ca 0.11 1.16 -0.37 0.00 1.01 0.00 0.00 58.87 60.78 3bqi n SER 1232Cb 0.60 -1.17 0.02 0.00 -1.01 0.00 0.00 64.21 62.66 3bqi n SER 1232CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3bqi s LYS 1233N -1.36 3.26 0.00 1.43 -0.14 -1.26 -4.97 119.74 116.69 3bqi s LYS 1233Ca 0.61 1.92 0.00 0.00 -1.36 0.00 0.00 55.97 57.13 3bqi s LYS 1233Cb -0.78 -2.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.21 3bqi s LYS 1233CO 0.59 -1.00 0.43 0.25 -0.76 0.00 0.00 175.35 174.85 3bqi n THR 1234N -1.11 0.18 0.06 2.17 -2.24 -1.26 -4.43 114.28 107.65 3bqi n THR 1234Ca 0.11 -0.30 -0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3bqi n THR 1234Cb 0.48 1.24 0.30 0.00 -2.10 0.00 0.00 70.33 70.25 3bqi n THR 1234CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3bqi h TYR 1235N 0.00 0.39 -0.47 4.78 -0.00 -1.88 0.62 116.97 120.41 3bqi h TYR 1235Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 58.73 58.67 3bqi h TYR 1235Cb 0.52 -0.10 0.00 0.00 0.00 0.00 0.00 36.73 37.14 3bqi h TYR 1235CO 0.00 0.52 0.00 -0.25 -0.00 0.00 0.00 178.16 178.43 3bqi n ASP 1236N -4.20 4.69 0.00 0.10 8.00 -1.26 -0.52 116.55 123.35 3bqi n ASP 1236Ca -0.00 -2.78 0.00 0.00 0.71 0.00 0.00 54.79 52.72 3bqi n ASP 1236Cb 0.33 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 3bqi n ASP 1236CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3bqi n GLY 1237N 0.35 3.23 3.76 0.44 0.00 0.21 -4.82 105.19 108.36 3bqi n GLY 1237Ca 0.24 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 3bqi n GLY 1237CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bqi s LYS 1238N -3.50 3.31 0.16 1.61 1.02 0.69 -4.39 119.74 118.63 3bqi s LYS 1238Ca 0.00 2.09 -0.31 0.00 0.02 0.00 0.00 55.97 57.77 3bqi s LYS 1238Cb 0.00 -2.29 -0.09 0.00 -0.52 0.00 0.00 37.83 34.93 3bqi s LYS 1238CO 0.00 -1.01 1.44 0.42 -0.92 0.00 0.00 175.35 175.28 3bqi s ILE 1239N -1.38 3.00 0.20 2.17 1.01 -1.26 -4.55 121.20 120.39 3bqi s ILE 1239Ca 0.70 0.75 -0.31 0.00 0.00 0.00 0.00 60.65 61.78 3bqi s ILE 1239Cb -0.37 -3.48 -0.16 0.00 0.01 0.00 0.00 42.46 38.47 3bqi s ILE 1239CO 0.43 0.07 1.03 0.33 0.00 0.00 0.00 174.94 176.80 3bqi n PHE 1240N 3.61 1.00 1.78 3.97 -0.00 -1.26 -1.08 117.46 125.48 3bqi n PHE 1240Ca 0.11 0.75 0.15 0.00 -0.00 0.00 0.00 57.45 58.46 3bqi n PHE 1240Cb 0.41 -2.22 0.83 0.00 -0.00 0.00 0.00 39.48 38.51 3bqi n PHE 1240CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 3bqi n PRO 1241N 1.36 0.94 -1.85 -7.13 -0.02 -1.26 -5.10 135.00 121.94 3bqi n PRO 1241Ca 0.14 -0.13 -0.37 0.00 -2.02 0.00 0.00 63.50 61.13 3bqi n PRO 1241Cb 0.26 -1.50 0.05 0.00 -0.02 0.00 0.00 33.50 32.29 3bqi n PRO 1241CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3bqi s GLY 1242N -2.15 2.82 0.05 -1.23 0.00 -0.24 -5.05 107.32 101.53 3bqi s GLY 1242Ca 0.41 1.14 0.05 0.00 0.00 0.00 0.00 44.72 46.33 3bqi s GLY 1242CO 0.39 1.56 -0.14 1.25 0.00 0.00 0.00 173.10 176.17 3bqi s LYS 1243N -3.32 0.86 3.94 2.90 2.47 -1.26 -4.47 119.74 120.85 3bqi s LYS 1243Ca 0.80 -0.84 0.00 0.00 -1.56 0.00 0.00 55.97 54.37 3bqi s LYS 1243Cb -0.35 -0.86 0.00 0.00 -1.46 0.00 0.00 37.83 35.16 3bqi s LYS 1243CO 0.38 0.20 0.00 0.41 0.16 0.00 0.00 175.35 176.50 3bqi n GLY 1244N 1.60 0.78 2.36 5.54 0.00 -1.26 -4.66 105.19 109.55 3bqi n GLY 1244Ca -0.20 -0.76 -0.05 0.00 0.00 0.00 0.00 46.02 45.02 3bqi n GLY 1244CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bqi n GLY 1245N 0.00 0.71 3.79 -0.02 0.00 -1.26 -0.22 105.19 108.19 3bqi n GLY 1245Ca 0.00 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 3bqi n GLY 1245CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3bqi s GLU 1246N -1.90 3.90 0.16 1.61 1.03 -1.25 -4.56 118.70 117.68 3bqi s GLU 1246Ca 0.00 1.41 -0.00 0.00 0.03 0.00 0.00 54.97 56.41 3bqi s GLU 1246Cb 0.00 -2.22 -0.04 0.00 -0.80 0.00 0.00 34.13 31.07 3bqi s GLU 1246CO 0.00 -0.36 0.34 0.15 -1.33 0.00 0.00 175.26 174.06 3bqi s LYS 1247N -3.02 3.50 0.31 -4.83 1.02 0.32 -4.91 119.74 112.13 3bqi s LYS 1247Ca 0.65 -0.38 0.07 0.00 0.02 0.00 0.00 55.97 56.33 3bqi s LYS 1247Cb -0.18 -2.90 -0.03 0.00 -0.52 0.00 0.00 37.83 34.20 3bqi s LYS 1247CO 0.22 0.47 0.25 1.14 -0.92 0.00 0.00 175.35 176.51 3bqi s GLN 1248N -3.08 2.75 0.09 1.68 -2.07 -1.26 -4.78 119.66 112.99 3bqi s GLN 1248Ca 0.37 -1.24 -0.31 0.00 -1.82 0.00 0.00 55.36 52.36 3bqi s GLN 1248Cb -0.11 -2.48 -0.08 0.00 -1.09 0.00 0.00 33.01 29.25 3bqi s GLN 1248CO 0.28 0.19 1.53 -1.58 -1.32 0.00 0.00 175.29 174.40 3bqi s TRP 1249N -2.26 2.81 -0.46 9.60 0.52 -1.26 -4.35 118.94 123.54 3bqi s TRP 1249Ca 0.38 0.61 -0.13 0.00 0.02 0.00 0.00 56.10 56.98 3bqi s TRP 1249Cb -0.06 -3.84 0.08 0.00 -1.15 0.00 0.00 33.47 28.50 3bqi s TRP 1249CO 0.26 -3.20 0.35 0.42 0.02 0.00 0.00 176.95 174.80 3bqi s ILE 1250N 1.94 4.80 -0.19 2.03 1.01 -0.89 -4.87 121.20 125.04 3bqi s ILE 1250Ca 0.69 -1.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.01 3bqi s ILE 1250Cb -0.38 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.12 3bqi s ILE 1250CO 0.30 -0.58 0.10 0.00 0.00 0.00 0.00 174.94 174.77 3bqi s LYS 1252N 0.32 1.35 -0.03 0.00 -0.14 -0.42 -4.99 119.74 115.82 3bqi s LYS 1252Ca 0.06 -0.72 -0.03 0.00 -1.36 0.00 0.00 55.97 53.92 3bqi s LYS 1252Cb -0.12 -1.35 -0.02 0.00 -1.68 0.00 0.00 37.83 34.67 3bqi s LYS 1252CO -0.01 0.36 0.25 -0.44 -0.76 0.00 0.00 175.35 174.74 3bqi h ASP 1253N 5.41 -0.11 -0.34 2.83 3.45 -1.96 -3.06 116.42 122.63 3bqi h ASP 1253Ca -0.38 0.00 -0.70 0.00 0.43 0.00 0.00 57.03 56.38 3bqi h ASP 1253Cb 1.16 0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 39.92 3bqi h ASP 1253CO 0.47 0.11 3.26 1.07 -1.57 0.00 0.00 179.24 182.58 3bqi n THR 1254N -3.39 4.31 -3.78 0.35 5.66 -1.26 -3.26 114.28 112.91 3bqi n THR 1254Ca -0.02 -3.17 -0.13 0.00 -3.05 0.00 0.00 64.05 57.68 3bqi n THR 1254Cb 0.05 -2.49 -0.10 0.00 -1.55 0.00 0.00 70.33 66.24 3bqi n THR 1254CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 3bqi s ILE 1255N 1.61 0.04 -0.16 1.09 2.07 -1.26 -5.03 121.20 119.56 3bqi s ILE 1255Ca 0.59 -0.35 -0.05 0.00 -1.41 0.00 0.00 60.65 59.44 3bqi s ILE 1255Cb 0.16 -0.53 -0.03 0.00 0.13 0.00 0.00 42.46 42.19 3bqi s ILE 1255CO -0.07 -0.19 0.00 -0.63 -1.91 0.00 0.00 174.94 172.15 3bqi s ILE 1256N -0.84 4.27 -0.06 2.00 1.01 -1.26 -0.04 121.20 126.28 3bqi s ILE 1256Ca -0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 3bqi s ILE 1256Cb -0.05 -2.88 0.03 0.00 0.01 0.00 0.00 42.46 39.57 3bqi s ILE 1256CO 0.03 0.50 0.01 -2.28 0.00 0.00 0.00 174.94 173.19 3bqi s HIS 1257N 0.21 0.53 0.00 3.97 2.46 -0.29 -4.76 115.29 117.42 3bqi s HIS 1257Ca 0.00 -0.07 0.00 0.00 0.47 0.00 0.00 55.06 55.46 3bqi s HIS 1257Cb -0.13 -0.73 0.00 0.00 -0.13 0.00 0.00 32.58 31.59 3bqi s HIS 1257CO 0.02 -0.29 0.00 0.41 -2.47 0.00 0.00 174.74 172.40 3bqi n GLY 1258N 5.15 1.47 0.11 1.59 0.00 -1.26 -3.40 105.19 108.85 3bqi n GLY 1258Ca -0.07 -0.55 0.08 0.00 0.00 0.00 0.00 46.02 45.48 3bqi n GLY 1258CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3bqi h ASP 1259N 0.00 0.00 -4.82 1.61 3.32 -1.99 -3.50 116.42 111.03 3bqi h ASP 1259Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 3bqi h ASP 1259Cb 0.00 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.43 3bqi h ASP 1259CO 0.00 0.20 -0.45 1.07 -1.72 0.00 0.00 179.24 178.34 3bqi n THR 1260N -2.76 0.00 -2.36 0.35 5.66 -1.22 -5.10 114.28 108.86 3bqi n THR 1260Ca -0.03 -2.31 -0.35 0.00 -3.05 0.00 0.00 64.05 58.31 3bqi n THR 1260Cb 0.65 0.83 -0.01 0.00 -1.55 0.00 0.00 70.33 70.25 3bqi n THR 1260CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 3bqi s ASN 1261N -3.43 5.98 0.00 1.09 -0.87 -1.26 -1.13 114.94 115.32 3bqi s ASN 1261Ca 0.20 2.10 0.00 0.00 -1.57 0.00 0.00 52.86 53.59 3bqi s ASN 1261Cb 0.01 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.66 3bqi s ASN 1261CO 0.14 -1.03 0.00 0.61 -2.57 0.00 0.00 177.10 174.25 3bqi n GLY 1262N 0.05 -0.75 3.65 0.66 0.00 0.94 -4.77 105.19 104.97 3bqi n GLY 1262Ca 0.10 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.48 3bqi n GLY 1262CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bqi s ALA 1263N -2.82 -2.45 -0.26 4.61 0.00 -1.16 -3.60 121.76 116.09 3bqi s ALA 1263Ca 0.00 1.92 -0.05 0.00 0.00 0.00 0.00 51.96 53.83 3bqi s ALA 1263Cb 0.00 -1.86 0.01 0.00 0.00 0.00 0.00 23.12 21.27 3bqi s ALA 1263CO 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 175.76 175.51 3bqi s ILE 1265N 1.45 4.99 0.31 0.00 1.01 0.11 -4.86 121.20 124.21 3bqi s ILE 1265Ca 0.03 0.89 -0.30 0.00 0.00 0.00 0.00 60.65 61.27 3bqi s ILE 1265Cb -0.16 -3.93 -0.12 0.00 0.01 0.00 0.00 42.46 38.26 3bqi s ILE 1265CO -0.01 -0.04 1.53 -2.65 0.00 0.00 0.00 174.94 173.77 3bqi n PRO 1266N 5.73 2.58 -0.32 2.79 -0.02 -1.26 -2.10 135.00 142.40 3bqi n PRO 1266Ca -0.02 0.91 0.14 0.00 -2.02 0.00 0.00 63.50 62.51 3bqi n PRO 1266Cb 0.49 -2.66 0.28 0.00 -0.02 0.00 0.00 33.50 31.60 3bqi n PRO 1266CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3bqi h PRO 1267N 4.22 0.07 -0.06 0.52 0.11 -1.87 -2.28 132.00 132.70 3bqi h PRO 1267Ca -0.47 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.65 3bqi h PRO 1267Cb 1.24 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 3bqi h PRO 1267CO 0.75 0.04 -0.06 -0.09 -0.21 0.00 0.00 178.00 178.43 3bqi h ARG 1268N 0.07 -0.07 -0.76 1.05 2.43 -1.91 -2.36 114.38 112.83 3bqi h ARG 1268Ca 0.57 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.90 3bqi h ARG 1268Cb 1.17 0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 30.64 3bqi h ARG 1268CO -0.82 -0.05 0.29 1.15 -1.51 0.00 0.00 179.97 179.03 3bqi h THR 1269N -0.07 0.62 0.00 0.20 2.02 -1.80 0.14 112.91 114.01 3bqi h THR 1269Ca 0.05 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3bqi h THR 1269Cb 0.14 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 3bqi h THR 1269CO -0.11 0.07 0.00 0.00 0.37 0.00 0.00 175.52 175.86 3bqi n GLN 1270N -5.03 0.04 -0.08 6.66 6.02 -0.91 -1.77 117.38 122.30 3bqi n GLN 1270Ca 0.15 0.47 0.04 0.00 -0.01 0.00 0.00 57.00 57.65 3bqi n GLN 1270Cb 0.44 -1.60 0.08 0.00 1.02 0.00 0.00 30.24 30.18 3bqi n GLN 1270CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3bqi n ASN 1271N -1.68 2.29 -4.67 1.08 2.85 0.45 -5.05 115.26 110.53 3bqi n ASN 1271Ca 0.01 -1.75 -0.46 0.00 -0.11 0.00 0.00 54.58 52.27 3bqi n ASN 1271Cb 0.05 -0.10 -0.04 0.00 1.24 0.00 0.00 39.78 40.93 3bqi n ASN 1271CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 3bqi n LEU 1272N 0.31 3.09 -4.62 1.20 7.94 -0.73 -4.91 117.00 119.28 3bqi n LEU 1272Ca 0.07 1.08 -0.43 0.00 -1.11 0.00 0.00 56.01 55.62 3bqi n LEU 1272Cb 0.31 -1.42 -0.02 0.00 0.53 0.00 0.00 43.42 42.82 3bqi n LEU 1272CO 0.05 -0.29 1.22 0.00 -1.11 0.00 0.00 177.39 177.27 3bqi n VAL 1274N 6.60 0.00 -0.12 0.00 0.24 -1.26 -4.71 118.33 119.09 3bqi n VAL 1274Ca 0.16 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 3bqi n VAL 1274Cb 0.47 0.94 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 3bqi n VAL 1274CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3bqi n GLY 1275N 1.39 2.90 0.00 7.63 0.00 -1.26 -1.80 105.19 114.05 3bqi n GLY 1275Ca 0.10 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.11 3bqi n GLY 1275CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3bqi n GLU 1276N 14.00 0.94 0.10 1.61 -0.58 -1.26 -3.28 120.64 132.17 3bqi n GLU 1276Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 3bqi n GLU 1276Cb 0.00 -1.12 0.05 0.00 -0.57 0.00 0.00 31.44 29.80 3bqi n GLU 1276CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3bqi h LEU 1277N 0.00 0.02 -8.32 -4.62 3.38 -1.64 -3.43 115.31 100.70 3bqi h LEU 1277Ca 0.00 -0.02 -0.61 0.00 0.09 0.00 0.00 57.88 57.34 3bqi h LEU 1277Cb 0.00 -0.01 -0.31 0.00 0.09 0.00 0.00 40.66 40.43 3bqi h LEU 1277CO 0.00 0.79 -0.85 0.86 0.09 0.00 0.00 178.44 179.33 3bqi s TRP 1278N -3.25 1.96 -0.46 1.13 -0.11 -1.21 -1.05 118.94 115.95 3bqi s TRP 1278Ca -0.01 -0.56 -0.14 0.00 1.22 0.00 0.00 56.10 56.61 3bqi s TRP 1278Cb 0.11 -1.30 0.07 0.00 -1.50 0.00 0.00 33.47 30.85 3bqi s TRP 1278CO 0.79 -0.18 0.36 0.34 -4.62 0.00 0.00 176.95 173.64 3bqi s ASP 1279N -0.05 6.02 0.43 5.86 -1.08 0.79 -4.81 116.67 123.83 3bqi s ASP 1279Ca -0.03 -1.35 0.24 0.00 -0.52 0.00 0.00 52.55 50.88 3bqi s ASP 1279Cb -0.12 -2.14 0.66 0.00 -1.46 0.00 0.00 42.92 39.86 3bqi s ASP 1279CO 0.03 -0.61 1.71 0.11 0.52 0.00 0.00 175.17 176.93 3bqi h LYS 1280N 8.67 0.00 -7.00 4.34 1.57 -1.95 0.17 116.57 122.37 3bqi h LYS 1280Ca -0.27 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 57.96 3bqi h LYS 1280Cb 1.10 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.54 3bqi h LYS 1280CO 0.84 0.17 0.69 -1.54 -0.57 0.00 0.00 179.45 179.05 3bqi s SER 1281N -6.16 5.77 -1.13 0.86 1.04 -1.26 -3.19 113.70 109.64 3bqi s SER 1281Ca 0.03 2.90 -0.18 0.00 0.48 0.00 0.00 55.95 59.18 3bqi s SER 1281Cb 0.08 -2.65 -0.02 0.00 0.10 0.00 0.00 66.02 63.53 3bqi s SER 1281CO 0.65 -1.24 0.81 -1.22 0.98 0.00 0.00 173.24 173.22 3bqi n TYR 1282N -0.33 -1.99 -0.19 5.02 4.01 -1.26 -2.86 117.16 119.55 3bqi n TYR 1282Ca 0.06 0.52 0.00 0.00 -0.16 0.00 0.00 57.90 58.32 3bqi n TYR 1282Cb 0.42 -3.56 0.00 0.00 -0.31 0.00 0.00 39.34 35.89 3bqi n TYR 1282CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3bqi n GLY 1283N -1.61 2.23 0.00 2.72 0.00 -1.25 -4.85 105.19 102.43 3bqi n GLY 1283Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3bqi n GLY 1283CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bqi n GLY 1284N -2.00 0.77 3.49 -0.02 0.00 -1.14 -5.08 105.19 101.22 3bqi n GLY 1284Ca 0.00 -1.44 -0.14 0.00 0.00 0.00 0.00 46.02 44.44 3bqi n GLY 1284CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3bqi s ARG 1285N -5.18 1.07 0.16 1.61 1.70 0.61 -5.00 118.95 113.92 3bqi s ARG 1285Ca 0.00 -0.10 -0.31 0.00 -0.47 0.00 0.00 55.73 54.85 3bqi s ARG 1285Cb 0.00 0.50 -0.09 0.00 -0.57 0.00 0.00 34.95 34.79 3bqi s ARG 1285CO 0.00 -0.41 1.39 0.45 -1.08 0.00 0.00 175.30 175.66 3bqi s SER 1286N -1.94 6.80 -0.20 -2.89 0.15 -1.26 -0.15 113.70 114.21 3bqi s SER 1286Ca -0.04 2.43 0.15 0.00 0.70 0.00 0.00 55.95 59.19 3bqi s SER 1286Cb -0.01 -2.60 0.78 0.00 -1.71 0.00 0.00 66.02 62.49 3bqi s SER 1286CO -0.02 -0.64 1.70 -3.20 1.20 0.00 0.00 173.24 172.28 3bqi n ASN 1287N 3.36 5.39 -0.15 5.45 5.15 -0.21 -4.28 115.26 129.97 3bqi n ASN 1287Ca 0.10 -2.82 0.02 0.00 -0.60 0.00 0.00 54.58 51.28 3bqi n ASN 1287Cb 0.42 -0.65 0.03 0.00 -0.53 0.00 0.00 39.78 39.05 3bqi n ASN 1287CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 3bqi n ILE 1288N 0.66 0.69 -0.36 -1.44 -5.35 -1.25 -4.84 119.36 107.46 3bqi n ILE 1288Ca 0.27 -0.78 0.02 0.00 -0.27 0.00 0.00 62.75 61.99 3bqi n ILE 1288Cb 1.11 0.46 0.17 0.00 -1.74 0.00 0.00 39.64 39.63 3bqi n ILE 1288CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3bqi h LYS 1289N 0.00 1.18 -0.41 6.28 3.64 -1.94 -2.75 116.57 122.57 3bqi h LYS 1289Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3bqi h LYS 1289Cb 0.99 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 3bqi h LYS 1289CO 0.00 0.78 0.00 0.09 -2.27 0.00 0.00 179.45 178.05 3bqi n ASN 1290N -4.47 3.54 -4.78 4.20 4.13 -1.26 -5.00 115.26 111.62 3bqi n ASN 1290Ca 0.14 -2.31 -0.37 0.00 1.68 0.00 0.00 54.58 53.73 3bqi n ASN 1290Cb 0.14 -0.38 -0.03 0.00 -1.54 0.00 0.00 39.78 37.96 3bqi n ASN 1290CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3bqi s ASP 1291N -1.20 6.65 0.61 6.41 1.11 -1.04 -5.05 116.67 124.15 3bqi s ASP 1291Ca 0.34 2.09 -0.13 0.00 0.18 0.00 0.00 52.55 55.03 3bqi s ASP 1291Cb 0.22 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.58 3bqi s ASP 1291CO 0.17 -0.57 1.03 0.42 1.18 0.00 0.00 175.17 177.40 3bqi s THR 1292N -1.63 4.27 0.53 -1.27 -4.23 -1.26 -4.91 115.64 107.14 3bqi s THR 1292Ca 0.59 0.90 0.26 0.00 -1.18 0.00 0.00 61.69 62.26 3bqi s THR 1292Cb -0.23 -3.59 0.32 0.00 1.34 0.00 0.00 72.50 70.33 3bqi s THR 1292CO 0.29 -0.81 2.18 0.07 -0.54 0.00 0.00 174.62 175.81 3bqi h LYS 1293N 0.06 0.00 -0.40 3.99 2.10 -1.94 -1.11 116.57 119.27 3bqi h LYS 1293Ca -0.45 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.12 3bqi h LYS 1293Cb 1.20 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 3bqi h LYS 1293CO 0.59 0.04 -0.05 0.93 -2.00 0.00 0.00 179.45 178.97 3bqi h GLU 1294N 0.00 0.74 -0.03 0.07 3.07 -1.99 -1.46 114.58 114.98 3bqi h GLU 1294Ca -0.00 -0.26 -0.18 0.00 -0.50 0.00 0.00 59.36 58.42 3bqi h GLU 1294Cb 0.11 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 3bqi h GLU 1294CO 0.01 0.85 -0.78 1.25 -1.40 0.00 0.00 179.01 178.94 3bqi h LEU 1295N 0.56 0.28 -0.16 1.33 5.85 -1.75 -1.45 115.31 119.96 3bqi h LEU 1295Ca 0.11 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 3bqi h LEU 1295Cb 0.55 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3bqi h LEU 1295CO 0.03 0.95 0.09 0.25 -0.34 0.00 0.00 178.44 179.42 3bqi h LEU 1296N 0.14 0.20 -0.57 2.25 5.85 -1.25 -0.68 115.31 121.26 3bqi h LEU 1296Ca -0.03 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.66 3bqi h LEU 1296Cb 1.36 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 3bqi h LEU 1296CO 0.12 0.22 0.30 0.50 -0.34 0.00 0.00 178.44 179.24 3bqi h LYS 1297N 0.17 0.55 -0.38 1.25 3.64 -1.15 -0.68 116.57 119.97 3bqi h LYS 1297Ca 0.06 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 3bqi h LYS 1297Cb 0.06 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 3bqi h LYS 1297CO -0.01 0.37 0.12 1.49 -2.27 0.00 0.00 179.45 179.14 3bqi h GLU 1298N 0.57 0.25 -0.25 1.90 4.57 -1.10 -1.06 114.58 119.46 3bqi h GLU 1298Ca 0.25 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.36 3bqi h GLU 1298Cb 0.15 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3bqi h GLU 1298CO -0.17 0.17 -0.11 0.87 -1.18 0.00 0.00 179.01 178.59 3bqi h LYS 1299N 0.26 0.41 0.04 1.92 1.57 -0.55 -1.46 116.57 118.77 3bqi h LYS 1299Ca 0.18 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3bqi h LYS 1299Cb 0.18 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3bqi h LYS 1299CO -0.20 0.53 -0.02 0.82 -0.57 0.00 0.00 179.45 180.01 3bqi h ILE 1300N 0.38 1.25 -0.65 1.86 2.04 -0.93 -2.45 117.51 119.01 3bqi h ILE 1300Ca 0.08 -1.01 0.12 0.00 1.00 0.00 0.00 64.86 65.05 3bqi h ILE 1300Cb 0.43 1.91 -0.09 0.00 -0.74 0.00 0.00 36.82 38.34 3bqi h ILE 1300CO 0.02 0.25 0.19 0.50 0.00 0.00 0.00 178.15 179.12 3bqi h LYS 1301N -0.51 0.32 -0.53 2.37 3.64 -1.04 0.15 116.57 120.98 3bqi h LYS 1301Ca -0.01 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 3bqi h LYS 1301Cb 0.46 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 3bqi h LYS 1301CO 0.01 0.21 -0.09 -0.91 -2.27 0.00 0.00 179.45 176.41 3bqi h ASN 1302N 0.33 0.96 -0.22 4.20 2.35 -1.33 -0.43 115.58 121.45 3bqi h ASN 1302Ca 0.35 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 3bqi h ASN 1302Cb 0.52 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3bqi h ASN 1302CO -0.40 1.07 0.11 0.00 -1.65 0.00 0.00 177.43 176.57 3bqi h ALA 1303N 1.02 0.28 -0.81 -0.83 0.00 -0.84 -0.56 119.26 117.52 3bqi h ALA 1303Ca 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3bqi h ALA 1303Cb 0.63 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3bqi h ALA 1303CO 0.04 -0.18 0.46 0.82 0.00 0.00 0.00 179.25 180.39 3bqi h ILE 1304N 0.24 1.24 -0.65 0.00 2.04 -0.63 0.11 117.51 119.85 3bqi h ILE 1304Ca 0.08 -0.57 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 3bqi h ILE 1304Cb 0.08 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 3bqi h ILE 1304CO -0.01 0.26 0.17 -0.74 0.00 0.00 0.00 178.15 177.83 3bqi h HIS 1305N 1.12 1.08 -0.29 1.37 2.76 -0.97 -2.13 115.15 118.09 3bqi h HIS 1305Ca 0.29 -0.12 -0.14 0.00 -2.20 0.00 0.00 60.37 58.19 3bqi h HIS 1305Cb 0.01 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 28.66 3bqi h HIS 1305CO 0.00 0.89 -0.37 -0.22 -1.30 0.00 0.00 177.93 176.93 3bqi h LYS 1306N 0.95 0.76 -0.66 5.26 1.63 -0.79 -2.78 116.57 120.94 3bqi h LYS 1306Ca 0.20 -0.43 0.10 0.00 -0.85 0.00 0.00 60.65 59.68 3bqi h LYS 1306Cb 0.34 0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 31.93 3bqi h LYS 1306CO -0.00 1.06 0.28 1.49 -3.45 0.00 0.00 179.45 178.83 3bqi h GLU 1307N 0.51 0.46 -0.33 1.90 4.57 -0.72 -1.30 114.58 119.67 3bqi h GLU 1307Ca 0.04 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 3bqi h GLU 1307Cb 0.96 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 3bqi h GLU 1307CO 0.09 0.31 0.13 1.15 -1.18 0.00 0.00 179.01 179.51 3bqi h THR 1308N 0.48 1.18 -0.22 0.32 2.02 -1.33 0.07 112.91 115.43 3bqi h THR 1308Ca 0.34 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 66.97 3bqi h THR 1308Cb 0.42 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 3bqi h THR 1308CO -0.31 0.19 0.13 -0.33 0.37 0.00 0.00 175.52 175.57 3bqi h GLU 1309N 0.38 0.26 -0.19 6.66 5.08 -1.22 -1.18 114.58 124.38 3bqi h GLU 1309Ca 0.11 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 3bqi h GLU 1309Cb 0.18 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3bqi h GLU 1309CO -0.01 0.17 -0.34 -0.07 -1.00 0.00 0.00 179.01 177.76 3bqi h LEU 1310N 0.27 0.41 -0.66 1.33 3.38 -1.13 -2.23 115.31 116.69 3bqi h LEU 1310Ca 0.08 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 3bqi h LEU 1310Cb -0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3bqi h LEU 1310CO -0.04 0.73 -0.28 -0.07 0.09 0.00 0.00 178.44 178.88 3bqi h LEU 1311N 0.34 0.76 -0.03 1.67 3.38 -0.90 -1.49 115.31 119.05 3bqi h LEU 1311Ca 0.04 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3bqi h LEU 1311Cb 0.77 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3bqi h LEU 1311CO 0.06 1.00 0.02 0.22 0.09 0.00 0.00 178.44 179.82 3bqi h TYR 1312N 0.63 0.03 -0.75 1.13 5.03 -0.90 -1.72 116.97 120.42 3bqi h TYR 1312Ca 0.08 0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.45 3bqi h TYR 1312Cb 0.79 -0.01 -0.06 0.00 1.55 0.00 0.00 36.73 39.00 3bqi h TYR 1312CO 0.04 0.02 0.44 1.49 -1.32 0.00 0.00 178.16 178.83 3bqi h GLU 1313N 0.03 0.78 -0.01 1.82 4.81 -1.40 0.16 114.58 120.78 3bqi h GLU 1313Ca 0.01 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 3bqi h GLU 1313Cb -0.00 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 3bqi h GLU 1313CO -0.00 0.51 -0.24 -0.92 -0.73 0.00 0.00 179.01 177.63 3bqi h TYR 1314N 0.80 0.01 0.00 0.92 -0.00 -0.74 -1.95 116.97 116.01 3bqi h TYR 1314Ca 0.34 -0.00 -0.32 0.00 -0.00 0.00 0.00 58.73 58.74 3bqi h TYR 1314Cb 0.20 -0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 36.87 3bqi h TYR 1314CO -0.06 0.25 -2.26 0.72 -0.00 0.00 0.00 178.16 176.81 3bqi n HIS 1315N -4.25 0.13 -0.32 -3.82 8.25 -0.70 -1.65 115.22 112.86 3bqi n HIS 1315Ca -0.02 0.05 -0.04 0.00 -0.26 0.00 0.00 57.72 57.44 3bqi n HIS 1315Cb 0.30 -0.98 0.08 0.00 1.12 0.00 0.00 29.99 30.51 3bqi n HIS 1315CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 3bqi h ASP 1316N 0.00 1.12 0.31 0.41 3.58 -0.62 -2.84 116.42 118.37 3bqi h ASP 1316Ca -0.47 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 56.87 3bqi h ASP 1316Cb 2.10 -0.29 0.00 0.00 1.72 0.00 0.00 39.33 42.87 3bqi h ASP 1316CO 0.03 0.92 -0.03 0.35 -2.88 0.00 0.00 179.24 177.63 3bqi n THR 1317N -4.32 0.00 -1.11 2.25 -2.24 -0.74 -4.91 114.28 103.20 3bqi n THR 1317Ca 0.09 -0.03 -0.04 0.00 -2.27 0.00 0.00 64.05 61.80 3bqi n THR 1317Cb 0.12 -0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 67.98 3bqi n THR 1317CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bqi n GLY 1318N 1.19 0.68 0.14 3.38 0.00 -1.07 -4.94 105.19 104.57 3bqi n GLY 1318Ca 0.18 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 3bqi n GLY 1318CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3bqi h THR 1319N 0.00 1.08 -2.68 2.61 2.02 -1.71 -3.41 112.91 110.82 3bqi h THR 1319Ca -0.08 -2.60 -0.52 0.00 0.77 0.00 0.00 66.41 63.97 3bqi h THR 1319Cb 0.34 2.87 0.05 0.00 -1.74 0.00 0.00 68.15 69.67 3bqi h THR 1319CO 0.12 0.84 1.00 0.00 0.37 0.00 0.00 175.52 177.85 3bqi s ALA 1320N -2.59 3.87 0.27 6.16 0.00 -0.66 -4.79 121.76 124.01 3bqi s ALA 1320Ca -0.13 1.50 -0.02 0.00 0.00 0.00 0.00 51.96 53.32 3bqi s ALA 1320Cb 0.05 -3.69 0.58 0.00 0.00 0.00 0.00 23.12 20.06 3bqi s ALA 1320CO 0.89 -0.94 1.66 0.82 0.00 0.00 0.00 175.76 178.18 3bqi h ILE 1321N 4.03 0.38 0.00 0.00 2.04 -1.88 -0.39 117.51 121.69 3bqi h ILE 1321Ca -0.43 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.36 3bqi h ILE 1321Cb 1.20 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 3bqi h ILE 1321CO 0.95 0.04 0.00 2.30 0.00 0.00 0.00 178.15 181.43 3bqi n ILE 1322N -5.23 0.20 0.91 -0.67 -5.35 -1.26 -2.23 119.36 105.73 3bqi n ILE 1322Ca 0.18 0.05 0.09 0.00 -0.27 0.00 0.00 62.75 62.80 3bqi n ILE 1322Cb 0.57 -0.72 -0.08 0.00 -1.74 0.00 0.00 39.64 37.67 3bqi n ILE 1322CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3bqi n SER 1323N -1.14 1.19 -2.75 7.28 3.41 -0.16 -4.12 113.62 117.32 3bqi n SER 1323Ca 0.12 -1.10 -0.20 0.00 -0.26 0.00 0.00 58.87 57.44 3bqi n SER 1323Cb 0.12 0.85 -0.07 0.00 -0.26 0.00 0.00 64.21 64.85 3bqi n SER 1323CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3bqi n LYS 1324N -1.06 2.19 -3.71 4.33 5.02 -0.95 -4.75 118.16 119.24 3bqi n LYS 1324Ca 0.05 -1.31 -0.30 0.00 -2.02 0.00 0.00 58.31 54.73 3bqi n LYS 1324Cb 0.34 -2.28 -0.14 0.00 -0.02 0.00 0.00 35.03 32.93 3bqi n LYS 1324CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3bqi s ASN 1334N 2.63 3.81 -0.02 4.39 3.84 -1.26 -5.09 114.94 123.23 3bqi s ASN 1334Ca 0.51 -2.09 0.02 0.00 0.21 0.00 0.00 52.86 51.51 3bqi s ASN 1334Cb 0.18 -0.91 0.00 0.00 -0.55 0.00 0.00 41.25 39.97 3bqi s ASN 1334CO -0.03 -0.35 -0.07 -1.81 -2.79 0.00 0.00 177.10 172.05 3bqi s ASP 1335N 1.05 1.00 -0.01 -4.21 -0.00 -1.12 -4.74 116.67 108.64 3bqi s ASP 1335Ca 0.14 -0.15 0.09 0.00 -0.00 0.00 0.00 52.55 52.62 3bqi s ASP 1335Cb -0.21 -0.25 -0.12 0.00 -0.00 0.00 0.00 42.92 42.34 3bqi s ASP 1335CO -0.12 0.05 0.27 -0.81 -0.00 0.00 0.00 175.17 174.56 3bqi n PRO 1336N 3.28 1.90 0.00 8.23 -0.04 -1.26 -4.42 135.00 142.69 3bqi n PRO 1336Ca -0.18 -0.05 0.03 0.00 -0.04 0.00 0.00 63.50 63.27 3bqi n PRO 1336Cb 0.55 -1.09 0.20 0.00 -0.04 0.00 0.00 33.50 33.12 3bqi n PRO 1336CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3bqi n ASN 1337N -1.56 0.00 0.00 3.54 3.02 -1.26 -4.84 115.26 114.16 3bqi n ASN 1337Ca -0.00 -1.70 0.00 0.00 -0.03 0.00 0.00 54.58 52.85 3bqi n ASN 1337Cb 0.19 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 3bqi n ASN 1337CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3bqi n GLY 1338N 0.56 0.79 3.91 7.41 0.00 -1.26 -4.85 105.19 111.75 3bqi n GLY 1338Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 3bqi n GLY 1338CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bqi s LEU 1339N 0.00 4.04 0.29 0.99 1.43 -1.26 -4.77 118.68 119.39 3bqi s LEU 1339Ca 0.00 0.72 -0.30 0.00 -1.03 0.00 0.00 54.13 53.52 3bqi s LEU 1339Cb 0.00 -3.54 -0.13 0.00 0.03 0.00 0.00 46.19 42.55 3bqi s LEU 1339CO 0.00 -0.21 1.40 -2.65 0.23 0.00 0.00 176.35 175.12 3bqi n PRO 1340N -1.01 2.20 -1.65 1.29 -0.02 -1.26 -2.79 135.00 131.75 3bqi n PRO 1340Ca -0.02 0.78 -0.46 0.00 -2.02 0.00 0.00 63.50 61.78 3bqi n PRO 1340Cb 0.54 -2.43 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 3bqi n PRO 1340CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3bqi n LYS 1341N 1.49 1.85 0.00 -0.52 4.81 -1.26 -1.90 118.16 122.63 3bqi n LYS 1341Ca 0.08 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 3bqi n LYS 1341Cb 0.34 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.07 3bqi n LYS 1341CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3bqi n GLY 1342N 2.49 2.86 0.15 3.14 0.00 -1.26 -3.98 105.19 108.58 3bqi n GLY 1342Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 3bqi n GLY 1342CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3bqi h PHE 1343N 0.00 0.36 -0.49 1.61 3.57 -1.74 -1.48 116.94 118.78 3bqi h PHE 1343Ca 0.00 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 3bqi h PHE 1343Cb 0.00 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 3bqi h PHE 1343CO 0.00 0.22 0.14 0.00 -2.23 0.00 0.00 178.31 176.44 3bqi h HIS 1345N 0.66 0.20 -0.85 0.00 3.86 -1.91 0.18 115.15 117.29 3bqi h HIS 1345Ca 0.16 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 3bqi h HIS 1345Cb 0.29 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 28.67 3bqi h HIS 1345CO 0.02 0.09 0.43 0.00 0.86 0.00 0.00 177.93 179.32 3bqi h ALA 1346N 1.20 1.16 -0.27 2.45 0.00 -1.13 -0.75 119.26 121.91 3bqi h ALA 1346Ca 0.14 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3bqi h ALA 1346Cb 0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3bqi h ALA 1346CO -0.14 0.65 -0.10 0.28 0.00 0.00 0.00 179.25 179.94 3bqi h VAL 1347N 1.21 1.29 -0.79 0.00 2.07 -0.88 -1.02 116.25 118.13 3bqi h VAL 1347Ca 0.30 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.66 3bqi h VAL 1347Cb 0.08 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3bqi h VAL 1347CO -0.04 0.37 0.52 1.56 0.02 0.00 0.00 177.57 179.99 3bqi h GLN 1348N 0.29 1.05 -0.21 1.57 4.20 -0.75 -1.78 115.11 119.48 3bqi h GLN 1348Ca 0.06 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3bqi h GLN 1348Cb 0.60 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3bqi h GLN 1348CO 0.03 0.70 0.05 0.00 -0.67 0.00 0.00 178.83 178.95 3bqi h ARG 1349N 1.08 0.33 -0.70 1.46 3.08 -0.94 -1.68 114.38 117.01 3bqi h ARG 1349Ca 0.29 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 3bqi h ARG 1349Cb -0.11 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3bqi h ARG 1349CO -0.06 0.45 0.41 0.77 -1.07 0.00 0.00 179.97 180.47 3bqi h SER 1350N 0.16 0.84 -0.53 7.04 0.02 -1.08 -1.53 113.55 118.47 3bqi h SER 1350Ca 0.07 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 3bqi h SER 1350Cb 0.26 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3bqi h SER 1350CO 0.00 0.66 0.23 0.15 -1.14 0.00 0.00 176.83 176.73 3bqi h PHE 1351N 0.97 0.79 -1.01 3.45 3.57 -0.97 -0.11 116.94 123.63 3bqi h PHE 1351Ca 0.25 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.74 3bqi h PHE 1351Cb -0.02 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.42 3bqi h PHE 1351CO 0.00 0.63 0.66 0.82 -2.23 0.00 0.00 178.31 178.20 3bqi h ILE 1352N 0.71 1.18 -0.53 1.41 2.04 -1.06 -1.21 117.51 120.05 3bqi h ILE 1352Ca 0.18 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 3bqi h ILE 1352Cb 0.16 -0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.01 3bqi h ILE 1352CO -0.02 0.23 0.20 0.44 0.00 0.00 0.00 178.15 179.01 3bqi h ASP 1353N 1.28 0.73 -0.28 1.72 3.32 -0.64 -1.38 116.42 121.16 3bqi h ASP 1353Ca 0.40 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.29 3bqi h ASP 1353Cb -0.00 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3bqi h ASP 1353CO -0.13 0.71 0.16 1.88 -1.72 0.00 0.00 179.24 180.15 3bqi h TYR 1354N 0.71 0.31 -0.13 4.55 -1.99 -0.75 0.04 116.97 119.71 3bqi h TYR 1354Ca 0.17 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.96 3bqi h TYR 1354Cb 0.21 -0.10 -0.06 0.00 2.00 0.00 0.00 36.73 38.78 3bqi h TYR 1354CO 0.01 0.18 -0.30 -0.22 -0.00 0.00 0.00 178.16 177.83 3bqi h LYS 1355N 0.34 -0.36 0.00 4.88 3.64 -1.08 -1.10 116.57 122.90 3bqi h LYS 1355Ca 0.11 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 3bqi h LYS 1355Cb -0.00 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 3bqi h LYS 1355CO -0.05 -0.24 -0.29 -0.91 -2.27 0.00 0.00 179.45 175.69 3bqi h ASN 1356N -0.37 0.00 -0.35 4.20 4.21 -1.13 -0.40 115.58 121.74 3bqi h ASN 1356Ca 0.10 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.56 3bqi h ASN 1356Cb 0.52 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.71 3bqi h ASN 1356CO -0.34 0.29 0.04 -0.03 -1.29 0.00 0.00 177.43 176.10 3bqi h MET 1357N 0.00 0.59 -0.26 0.81 4.05 -0.57 -0.78 114.93 118.76 3bqi h MET 1357Ca -0.00 -0.17 -0.19 0.00 -0.28 0.00 0.00 59.70 59.06 3bqi h MET 1357Cb 0.55 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.29 3bqi h MET 1357CO 0.04 0.67 -0.59 0.82 0.23 0.00 0.00 176.91 178.08 3bqi h ILE 1358N 0.41 1.27 0.00 1.77 2.04 -0.89 -3.14 117.51 118.97 3bqi h ILE 1358Ca 0.10 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.19 3bqi h ILE 1358Cb 0.38 1.70 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3bqi h ILE 1358CO 0.01 0.58 0.00 0.18 0.00 0.00 0.00 178.15 178.92 3bqi n LEU 1359N -4.00 0.53 -0.61 1.44 4.32 -0.19 -4.85 117.00 113.63 3bqi n LEU 1359Ca -0.05 0.58 -0.07 0.00 -0.02 0.00 0.00 56.01 56.45 3bqi n LEU 1359Cb 0.65 -0.45 -0.02 0.00 -1.62 0.00 0.00 43.42 41.98 3bqi n LEU 1359CO 0.51 -0.28 -0.07 0.61 -1.22 0.00 0.00 177.39 176.94 3bqi n GLY 1360N 0.76 0.67 0.75 -0.72 0.00 -0.86 -4.93 105.19 100.86 3bqi n GLY 1360Ca 0.04 -0.69 0.07 0.00 0.00 0.00 0.00 46.02 45.44 3bqi n GLY 1360CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3bqi n THR 1361N -3.16 0.99 0.00 2.61 -2.24 -0.36 -4.94 114.28 107.19 3bqi n THR 1361Ca -0.07 -1.00 0.00 0.00 -2.27 0.00 0.00 64.05 60.71 3bqi n THR 1361Cb 0.33 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 3bqi n THR 1361CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3bqi n SER 1362N 0.69 0.00 -4.28 3.42 3.41 -1.06 -4.64 113.62 111.16 3bqi n SER 1362Ca 0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.45 3bqi n SER 1362Cb 0.46 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.25 3bqi n SER 1362CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3bqi s VAL 1363N 1.39 1.89 -0.21 -3.33 1.01 -1.26 -4.73 120.40 115.15 3bqi s VAL 1363Ca 0.00 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 60.96 3bqi s VAL 1363Cb 0.00 -1.57 0.24 0.00 0.00 0.00 0.00 36.38 35.05 3bqi s VAL 1363CO 0.00 0.52 1.28 -0.46 0.00 0.00 0.00 175.10 176.45 3bqi n ASN 1364N 2.46 3.20 -0.17 3.32 6.94 -1.26 -4.49 115.26 125.27 3bqi n ASN 1364Ca -0.16 -2.54 -0.03 0.00 -0.02 0.00 0.00 54.58 51.84 3bqi n ASN 1364Cb 0.52 -0.61 0.18 0.00 -2.36 0.00 0.00 39.78 37.51 3bqi n ASN 1364CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 3bqi h ILE 1365N 0.45 1.23 -3.54 1.53 6.09 -1.98 -3.40 117.51 117.88 3bqi h ILE 1365Ca 0.20 -0.74 -0.62 0.00 -1.37 0.00 0.00 64.86 62.33 3bqi h ILE 1365Cb 1.59 0.53 -0.14 0.00 0.47 0.00 0.00 36.82 39.28 3bqi h ILE 1365CO 0.37 0.29 -0.46 -0.31 -3.07 0.00 0.00 178.15 174.97 3bqi s TYR 1366N -5.36 3.33 0.30 2.19 1.51 -1.26 -4.96 117.35 113.11 3bqi s TYR 1366Ca -0.10 0.30 0.17 0.00 -1.01 0.00 0.00 57.07 56.43 3bqi s TYR 1366Cb 0.16 -2.30 0.80 0.00 -0.11 0.00 0.00 41.96 40.51 3bqi s TYR 1366CO 0.80 0.08 1.82 1.49 -1.11 0.00 0.00 175.55 178.63 3bqi h GLU 1367N 7.41 0.00 -0.01 -0.62 4.57 -1.98 -2.51 114.58 121.44 3bqi h GLU 1367Ca -0.38 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.62 3bqi h GLU 1367Cb 1.17 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 3bqi h GLU 1367CO 0.68 0.35 -0.80 1.12 -1.18 0.00 0.00 179.01 179.18 3bqi h HIS 1368N 0.00 0.17 0.00 0.92 2.07 -1.96 -2.54 115.15 113.81 3bqi h HIS 1368Ca -0.00 -0.09 -0.16 0.00 -2.85 0.00 0.00 60.37 57.27 3bqi h HIS 1368Cb 0.72 -0.02 -0.02 0.00 2.57 0.00 0.00 27.41 30.66 3bqi h HIS 1368CO 0.00 0.86 -0.74 -0.84 -3.07 0.00 0.00 177.93 174.14 3bqi h ILE 1369N 0.07 1.39 -0.80 6.12 3.07 -1.96 -2.86 117.51 122.53 3bqi h ILE 1369Ca -0.02 -2.67 0.04 0.00 1.55 0.00 0.00 64.86 63.76 3bqi h ILE 1369Cb 1.40 2.50 -0.05 0.00 -0.27 0.00 0.00 36.82 40.39 3bqi h ILE 1369CO 0.11 0.73 0.50 1.23 -1.05 0.00 0.00 178.15 179.67 3bqi h GLY 1370N 2.73 1.17 1.65 0.16 0.00 -1.30 0.13 103.07 107.61 3bqi h GLY 1370Ca -0.01 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 3bqi h GLY 1370CO 0.10 0.29 0.04 0.50 0.00 0.00 0.00 176.54 177.47 3bqi h LYS 1371N 0.95 0.45 -0.09 4.80 1.57 -1.40 -2.47 116.57 120.37 3bqi h LYS 1371Ca 0.33 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.96 3bqi h LYS 1371Cb 0.07 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3bqi h LYS 1371CO -0.14 0.45 -0.24 -0.07 -0.57 0.00 0.00 179.45 178.89 3bqi h LEU 1372N 0.44 0.36 -1.51 2.94 4.07 -0.92 -1.46 115.31 119.24 3bqi h LEU 1372Ca 0.10 -0.59 -0.05 0.00 0.08 0.00 0.00 57.88 57.42 3bqi h LEU 1372Cb 0.23 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 3bqi h LEU 1372CO 0.00 0.89 -0.25 1.56 -1.08 0.00 0.00 178.44 179.56 3bqi h GLN 1373N -0.15 0.00 0.07 1.13 4.20 -0.76 -1.19 115.11 118.42 3bqi h GLN 1373Ca -0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 3bqi h GLN 1373Cb 0.85 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.62 3bqi h GLN 1373CO 0.05 0.25 -1.10 1.49 -0.67 0.00 0.00 178.83 178.85 3bqi h GLU 1374N 0.00 0.24 -0.25 1.46 4.57 -1.40 -0.90 114.58 118.29 3bqi h GLU 1374Ca -0.00 -0.36 -0.14 0.00 -1.18 0.00 0.00 59.36 57.68 3bqi h GLU 1374Cb 0.47 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.18 3bqi h GLU 1374CO 0.03 1.13 -0.39 -0.44 -1.18 0.00 0.00 179.01 178.16 3bqi h ASP 1375N 0.09 0.78 -0.45 1.04 3.32 -1.15 -2.75 116.42 117.30 3bqi h ASP 1375Ca -0.09 -0.52 0.07 0.00 0.02 0.00 0.00 57.03 56.51 3bqi h ASP 1375Cb 1.81 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 41.08 3bqi h ASP 1375CO 0.18 1.14 0.12 0.40 -1.72 0.00 0.00 179.24 179.36 3bqi h ILE 1376N 0.43 0.80 -0.64 0.35 2.04 -1.19 0.12 117.51 119.43 3bqi h ILE 1376Ca 0.02 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.84 3bqi h ILE 1376Cb 0.98 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 3bqi h ILE 1376CO 0.09 0.05 0.36 0.50 0.00 0.00 0.00 178.15 179.14 3bqi h LYS 1377N 0.27 0.65 0.01 2.37 3.64 -1.17 -1.78 116.57 120.56 3bqi h LYS 1377Ca 0.22 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.36 3bqi h LYS 1377Cb 0.25 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3bqi h LYS 1377CO -0.26 0.43 -0.90 -0.22 -2.27 0.00 0.00 179.45 176.24 3bqi h LYS 1378N 0.67 0.11 -0.16 1.90 1.63 -1.12 -2.25 116.57 117.34 3bqi h LYS 1378Ca 0.28 -0.13 -0.00 0.00 -0.85 0.00 0.00 60.65 59.95 3bqi h LYS 1378Cb 0.15 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 3bqi h LYS 1378CO -0.17 0.93 0.09 0.82 -3.45 0.00 0.00 179.45 177.67 3bqi h ILE 1379N 0.05 1.09 -0.55 2.00 2.04 -0.57 -2.33 117.51 119.24 3bqi h ILE 1379Ca -0.03 -0.25 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 3bqi h ILE 1379Cb 1.55 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.59 3bqi h ILE 1379CO 0.13 0.09 -0.02 0.40 0.00 0.00 0.00 178.15 178.75 3bqi h ILE 1380N 0.16 1.26 -0.06 -0.67 1.08 -1.29 -1.62 117.51 116.37 3bqi h ILE 1380Ca 0.06 -1.13 -0.20 0.00 -0.39 0.00 0.00 64.86 63.20 3bqi h ILE 1380Cb 0.06 0.85 -0.00 0.00 -3.07 0.00 0.00 36.82 34.67 3bqi h ILE 1380CO -0.01 0.40 -0.79 -0.33 -0.69 0.00 0.00 178.15 176.73 3bqi h GLU 1381N 0.88 0.41 -0.04 2.37 5.08 -1.40 -2.10 114.58 119.78 3bqi h GLU 1381Ca 0.16 -0.36 -0.16 0.00 -1.00 0.00 0.00 59.36 58.00 3bqi h GLU 1381Cb 0.54 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 3bqi h GLU 1381CO 0.03 1.01 -0.68 -0.22 -1.00 0.00 0.00 179.01 178.15 3bqi h LYS 1382N 0.26 0.18 -0.40 2.33 3.64 -1.40 -3.34 116.57 117.84 3bqi h LYS 1382Ca -0.04 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 3bqi h LYS 1382Cb 1.39 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 3bqi h LYS 1382CO 0.14 0.79 0.00 0.41 -2.27 0.00 0.00 179.45 178.51 3bqi n GLY 1383N 0.42 1.69 3.14 5.01 0.00 -0.61 -4.92 105.19 109.92 3bqi n GLY 1383Ca -0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 3bqi n GLY 1383CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3bqi s THR 1384N -1.49 0.74 0.27 2.61 -4.23 -0.80 -4.99 115.64 107.74 3bqi s THR 1384Ca 0.39 -1.55 -0.30 0.00 -1.18 0.00 0.00 61.69 59.05 3bqi s THR 1384Cb 0.23 -1.22 -0.10 0.00 1.34 0.00 0.00 72.50 72.75 3bqi s THR 1384CO 0.32 -0.60 1.45 -2.16 -0.54 0.00 0.00 174.62 173.09 3bqi s PRO 1385N -2.72 4.24 0.49 3.99 0.04 -1.26 -4.84 135.00 134.94 3bqi s PRO 1385Ca 0.02 2.35 -0.20 0.00 0.04 0.00 0.00 61.00 63.21 3bqi s PRO 1385Cb -0.03 -3.08 -0.08 0.00 0.04 0.00 0.00 34.50 31.35 3bqi s PRO 1385CO -0.01 -0.44 1.05 -1.14 0.04 0.00 0.00 177.00 176.49 3bqi s GLN 1386N -0.62 3.78 0.00 4.56 0.74 -1.26 -5.06 119.66 121.80 3bqi s GLN 1386Ca 0.59 1.38 0.00 0.00 0.05 0.00 0.00 55.36 57.38 3bqi s GLN 1386Cb -0.43 -2.10 0.00 0.00 1.10 0.00 0.00 33.01 31.58 3bqi s GLN 1386CO 0.46 -0.45 0.00 0.00 -0.55 0.00 0.00 175.29 174.74 3bqi n GLN 1387N -0.97 1.64 0.00 1.67 -0.00 -1.26 -5.21 117.38 113.25 3bqi n GLN 1387Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.09 3bqi n GLN 1387Cb 0.52 -0.64 0.00 0.00 -0.00 0.00 0.00 30.24 30.12 3bqi n GLN 1387CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 3bqi n SER 1397N -0.84 0.00 0.00 2.61 2.88 -1.26 -5.19 113.62 111.82 3bqi n SER 1397Ca 0.00 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.57 3bqi n SER 1397Cb 0.12 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.73 3bqi n SER 1397CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3bqi n THR 1398N 0.00 0.00 0.08 2.46 -2.24 -1.26 -2.01 114.28 111.31 3bqi n THR 1398Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 3bqi n THR 1398Cb 0.00 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 3bqi n THR 1398CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3bqi h GLU 1399N 0.00 0.22 -0.31 -0.78 5.08 -2.00 -2.58 114.58 114.21 3bqi h GLU 1399Ca 0.00 -0.22 -0.17 0.00 -1.00 0.00 0.00 59.36 57.97 3bqi h GLU 1399Cb 0.00 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 3bqi h GLU 1399CO 0.00 0.94 -0.46 -0.91 -1.00 0.00 0.00 179.01 177.58 3bqi h ASN 1400N 0.13 0.94 -0.98 1.42 4.21 -1.82 -2.37 115.58 117.10 3bqi h ASN 1400Ca -0.04 -0.51 0.04 0.00 1.21 0.00 0.00 56.30 57.00 3bqi h ASN 1400Cb 1.46 -0.27 -0.06 0.00 -1.12 0.00 0.00 38.32 38.34 3bqi h ASN 1400CO 0.13 1.27 0.64 0.58 -1.29 0.00 0.00 177.43 178.76 3bqi h VAL 1401N 0.64 1.17 -0.54 2.81 2.07 -1.64 0.23 116.25 120.99 3bqi h VAL 1401Ca 0.03 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 3bqi h VAL 1401Cb 1.07 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3bqi h VAL 1401CO 0.11 0.23 0.15 0.78 0.02 0.00 0.00 177.57 178.85 3bqi h ASN 1402N 1.25 0.81 -0.11 0.57 2.35 -1.41 -1.87 115.58 117.18 3bqi h ASN 1402Ca 0.39 -0.22 -0.17 0.00 -0.55 0.00 0.00 56.30 55.75 3bqi h ASN 1402Cb 0.00 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.15 3bqi h ASN 1402CO -0.12 0.82 -0.53 0.00 -1.65 0.00 0.00 177.43 175.95 3bqi h ALA 1403N 1.02 0.62 -0.18 -0.83 0.00 -1.05 -2.70 119.26 116.15 3bqi h ALA 1403Ca 0.17 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3bqi h ALA 1403Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3bqi h ALA 1403CO -0.00 0.68 0.12 2.35 0.00 0.00 0.00 179.25 182.40 3bqi h TRP 1404N 0.53 0.22 -0.34 0.00 7.01 -0.48 -1.35 115.95 121.55 3bqi h TRP 1404Ca 0.02 0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.08 3bqi h TRP 1404Cb 1.10 -0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 28.03 3bqi h TRP 1404CO 0.06 0.15 0.02 2.35 -2.79 0.00 0.00 178.44 178.22 3bqi h TRP 1405N 0.24 0.02 -0.94 2.65 2.91 -1.33 -1.97 115.95 117.54 3bqi h TRP 1405Ca 0.06 0.02 0.09 0.00 1.13 0.00 0.00 58.89 60.20 3bqi h TRP 1405Cb -0.02 0.04 -0.07 0.00 -0.51 0.00 0.00 29.16 28.60 3bqi h TRP 1405CO -0.06 -0.04 0.61 0.87 -1.03 0.00 0.00 178.44 178.79 3bqi h LYS 1406N 0.12 0.96 0.00 2.65 1.57 -1.23 0.23 116.57 120.87 3bqi h LYS 1406Ca 0.16 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3bqi h LYS 1406Cb 0.21 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3bqi h LYS 1406CO -0.25 0.64 -0.25 0.78 -0.57 0.00 0.00 179.45 179.79 3bqi h GLY 1407N 0.99 0.00 -0.14 3.86 0.00 -0.53 -3.23 103.07 104.02 3bqi h GLY 1407Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 3bqi h GLY 1407CO -0.19 0.00 -0.61 0.29 0.00 0.00 0.00 176.54 176.03 3bqi n ILE 1408N -3.50 0.00 -0.25 2.60 -5.35 -0.69 -4.68 119.36 107.50 3bqi n ILE 1408Ca -0.00 -0.20 0.05 0.00 -0.27 0.00 0.00 62.75 62.33 3bqi n ILE 1408Cb 0.41 1.04 0.18 0.00 -1.74 0.00 0.00 39.64 39.53 3bqi n ILE 1408CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3bqi h GLU 1409N 0.35 0.41 -0.40 6.28 4.81 -0.60 -0.77 114.58 124.66 3bqi h GLU 1409Ca 0.00 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 3bqi h GLU 1409Cb 0.38 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3bqi h GLU 1409CO 0.00 0.27 0.17 0.00 -0.73 0.00 0.00 179.01 178.72 3bqi h ARG 1410N 0.42 0.60 -0.82 1.92 2.47 -1.83 -1.43 114.38 115.72 3bqi h ARG 1410Ca 0.40 -0.11 -0.01 0.00 -1.26 0.00 0.00 59.98 59.00 3bqi h ARG 1410Cb 0.60 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.78 3bqi h ARG 1410CO -0.40 0.56 0.47 1.49 0.56 0.00 0.00 179.97 182.65 3bqi h GLU 1411N 0.51 1.12 -0.13 0.04 4.81 -1.71 -1.06 114.58 118.16 3bqi h GLU 1411Ca 0.13 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3bqi h GLU 1411Cb 0.18 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 3bqi h GLU 1411CO -0.01 0.81 0.04 0.52 -0.73 0.00 0.00 179.01 179.64 3bqi h MET 1412N 1.13 0.21 -0.84 1.92 2.86 -0.89 -2.53 114.93 116.78 3bqi h MET 1412Ca 0.29 -0.05 0.12 0.00 -2.06 0.00 0.00 59.70 58.01 3bqi h MET 1412Cb -0.00 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.57 3bqi h MET 1412CO -0.05 0.35 0.55 2.35 1.06 0.00 0.00 176.91 181.17 3bqi h TRP 1413N 0.02 0.78 0.00 -0.22 2.91 -1.22 -2.47 115.95 115.75 3bqi h TRP 1413Ca 0.04 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.07 3bqi h TRP 1413Cb 0.23 -0.25 -0.00 0.00 -0.51 0.00 0.00 29.16 28.63 3bqi h TRP 1413CO 0.00 0.32 -0.05 -0.44 -1.03 0.00 0.00 178.44 177.25 3bqi h ASP 1414N 0.69 0.00 -0.41 2.65 3.32 -0.82 -1.81 116.42 120.05 3bqi h ASP 1414Ca 0.41 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.41 3bqi h ASP 1414Cb 0.61 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 3bqi h ASP 1414CO -0.17 0.05 0.10 0.00 -1.72 0.00 0.00 179.24 177.50 3bqi h ALA 1415N 1.95 1.29 0.10 3.45 0.00 -1.03 0.78 119.26 125.79 3bqi h ALA 1415Ca -0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3bqi h ALA 1415Cb 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3bqi h ALA 1415CO 0.01 0.50 -0.05 0.28 0.00 0.00 0.00 179.25 179.99 3bqi h VAL 1416N 0.70 1.12 -0.78 0.00 2.07 -1.36 -2.33 116.25 115.66 3bqi h VAL 1416Ca 0.16 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.76 3bqi h VAL 1416Cb 0.28 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.71 3bqi h VAL 1416CO -0.00 0.23 0.48 0.03 0.02 0.00 0.00 177.57 178.33 3bqi h ARG 1417N -0.59 0.88 -0.42 1.57 3.08 -1.30 -1.67 114.38 115.93 3bqi h ARG 1417Ca -0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3bqi h ARG 1417Cb 0.48 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 3bqi h ARG 1417CO 0.02 0.58 0.28 0.00 -1.07 0.00 0.00 179.97 179.78 3bqi h ALA 1419N 1.15 1.45 -0.19 0.00 0.00 -1.03 -2.34 119.26 118.29 3bqi h ALA 1419Ca 0.15 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 3bqi h ALA 1419Cb -0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3bqi h ALA 1419CO -0.03 0.39 -0.60 0.82 0.00 0.00 0.00 179.25 179.82 3bqi h ILE 1420N 0.32 1.31 -0.71 0.00 2.04 -1.07 -2.94 117.51 116.47 3bqi h ILE 1420Ca 0.07 -1.85 0.01 0.00 1.00 0.00 0.00 64.86 64.09 3bqi h ILE 1420Cb 0.37 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 3bqi h ILE 1420CO 0.02 0.58 0.47 0.74 0.00 0.00 0.00 178.15 179.96 3bqi h THR 1421N 0.48 1.18 0.00 -0.27 2.02 -0.88 -1.72 112.91 113.73 3bqi h THR 1421Ca -0.00 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.85 3bqi h THR 1421Cb 1.18 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3bqi h THR 1421CO 0.12 0.18 0.00 0.29 0.37 0.00 0.00 175.52 176.47 3bqi n LYS 1422N -4.43 0.16 0.09 6.66 5.02 -0.91 -2.18 118.16 122.57 3bqi n LYS 1422Ca 0.08 0.17 -0.02 0.00 -2.02 0.00 0.00 58.31 56.52 3bqi n LYS 1422Cb 0.04 -1.50 0.22 0.00 -0.02 0.00 0.00 35.03 33.77 3bqi n LYS 1422CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3bqi h ILE 1423N 0.00 1.31 -1.22 -0.18 2.04 -1.30 -2.98 117.51 115.19 3bqi h ILE 1423Ca 0.00 -1.54 0.36 0.00 1.00 0.00 0.00 64.86 64.68 3bqi h ILE 1423Cb 0.18 1.70 -0.10 0.00 -0.74 0.00 0.00 36.82 37.86 3bqi h ILE 1423CO 0.00 0.46 0.81 0.78 0.00 0.00 0.00 178.15 180.20 3bqi h ASN 1424N 0.20 0.26 0.04 1.72 -0.26 -1.59 0.93 115.58 116.88 3bqi h ASN 1424Ca 0.02 0.08 0.00 0.00 -0.56 0.00 0.00 56.30 55.84 3bqi h ASN 1424Cb 0.83 0.05 0.00 0.00 -1.06 0.00 0.00 38.32 38.13 3bqi h ASN 1424CO 0.06 -0.03 0.00 0.29 -1.06 0.00 0.00 177.43 176.70 3bqi n LYS 1425N -4.52 0.53 0.00 0.81 5.02 -1.12 -3.64 118.16 115.24 3bqi n LYS 1425Ca 0.30 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 3bqi n LYS 1425Cb 1.20 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.71 3bqi n LYS 1425CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3bqi n LYS 1426N -1.04 2.04 -3.76 1.97 5.02 0.21 -5.10 118.16 117.51 3bqi n LYS 1426Ca 0.13 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.29 3bqi n LYS 1426Cb 0.07 -0.17 -0.14 0.00 -0.02 0.00 0.00 35.03 34.77 3bqi n LYS 1426CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3bqi s ASN 1427N 0.00 -0.14 0.00 4.39 3.84 -0.55 -5.04 114.94 117.44 3bqi s ASN 1427Ca 0.00 0.32 0.15 0.00 0.21 0.00 0.00 52.86 53.54 3bqi s ASN 1427Cb 0.00 0.24 -0.08 0.00 -0.55 0.00 0.00 41.25 40.86 3bqi s ASN 1427CO 0.00 -0.13 0.72 -0.46 -2.79 0.00 0.00 177.10 174.44 3bqi n ASN 1428N 3.92 1.13 -0.26 -4.21 6.94 -1.26 -4.64 115.26 116.88 3bqi n ASN 1428Ca -0.23 -1.06 0.05 0.00 -0.02 0.00 0.00 54.58 53.31 3bqi n ASN 1428Cb 0.54 0.73 0.28 0.00 -2.36 0.00 0.00 39.78 38.97 3bqi n ASN 1428CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 3bqi h ASN 1429N 0.85 0.82 -2.57 0.53 2.35 -1.96 -3.47 115.58 112.14 3bqi h ASN 1429Ca 0.00 0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.82 3bqi h ASN 1429Cb 0.43 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 3bqi h ASN 1429CO 0.00 0.53 0.40 -0.24 -1.65 0.00 0.00 177.43 176.47 3bqi n SER 1430N -4.49 -1.82 -4.74 5.81 2.88 -1.26 -4.95 113.62 105.05 3bqi n SER 1430Ca 0.13 -2.13 -0.36 0.00 -1.33 0.00 0.00 58.87 55.18 3bqi n SER 1430Cb 0.21 3.00 -0.07 0.00 -0.75 0.00 0.00 64.21 66.60 3bqi n SER 1430CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3bqi s ILE 1431N -2.15 5.34 -0.26 2.46 -1.09 -1.26 -4.95 121.20 119.30 3bqi s ILE 1431Ca 0.18 0.44 -0.05 0.00 -2.23 0.00 0.00 60.65 58.99 3bqi s ILE 1431Cb -0.03 -3.58 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 3bqi s ILE 1431CO 0.08 0.42 0.01 -0.36 -1.23 0.00 0.00 174.94 173.86 3bqi s PHE 1432N 0.32 3.06 -1.20 3.97 0.08 -1.26 -4.96 117.98 118.00 3bqi s PHE 1432Ca 0.14 -0.99 0.26 0.00 0.12 0.00 0.00 56.93 56.46 3bqi s PHE 1432Cb -0.12 -2.17 0.64 0.00 -0.57 0.00 0.00 43.02 40.80 3bqi s PHE 1432CO 0.02 -0.56 1.50 0.27 -0.10 0.00 0.00 175.22 176.35 3bqi n ASN 1433N 4.82 0.59 0.00 1.36 0.23 -1.26 -4.58 115.26 116.41 3bqi n ASN 1433Ca -0.16 -0.36 0.00 0.00 -0.53 0.00 0.00 54.58 53.52 3bqi n ASN 1433Cb 0.49 0.16 0.00 0.00 -2.08 0.00 0.00 39.78 38.36 3bqi n ASN 1433CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3bqi n GLY 1434N 1.45 0.52 0.98 4.83 0.00 -1.26 -4.80 105.19 106.91 3bqi n GLY 1434Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 3bqi n GLY 1434CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3bqi n ASP 1435N 0.00 2.99 0.03 1.61 8.00 -1.26 -4.37 116.55 123.54 3bqi n ASP 1435Ca 0.00 -1.94 0.03 0.00 0.71 0.00 0.00 54.79 53.60 3bqi n ASP 1435Cb 0.00 -0.12 0.42 0.00 -0.02 0.00 0.00 41.12 41.40 3bqi n ASP 1435CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3bqi h GLU 1436N 4.24 0.48 -0.65 -1.24 3.07 -1.98 0.49 114.58 119.00 3bqi h GLU 1436Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3bqi h GLU 1436Cb 0.92 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 3bqi h GLU 1436CO 0.00 0.36 0.00 0.00 -1.40 0.00 0.00 179.01 177.97 3bqi n GLY 1438N 0.74 3.09 0.14 0.00 0.00 0.16 -4.92 105.19 104.41 3bqi n GLY 1438Ca 0.19 -1.51 -0.03 0.00 0.00 0.00 0.00 46.02 44.67 3bqi n GLY 1438CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3bqi h VAL 1439N 0.00 1.44 -3.02 1.61 -1.51 -1.90 -3.43 116.25 109.43 3bqi h VAL 1439Ca 0.00 -2.15 -0.62 0.00 -1.23 0.00 0.00 66.70 62.70 3bqi h VAL 1439Cb 0.00 2.14 -0.13 0.00 -2.13 0.00 0.00 31.29 31.17 3bqi h VAL 1439CO 0.00 0.62 -0.69 -0.44 -1.23 0.00 0.00 177.57 175.83 3bqi s SER 1440N -6.86 4.52 0.69 4.19 0.01 -1.26 -5.01 113.70 109.98 3bqi s SER 1440Ca -0.02 -0.46 -0.17 0.00 1.31 0.00 0.00 55.95 56.61 3bqi s SER 1440Cb 0.12 -0.88 0.01 0.00 0.21 0.00 0.00 66.02 65.49 3bqi s SER 1440CO 0.78 0.11 1.26 -2.16 0.41 0.00 0.00 173.24 173.64 3bqi s PRO 1441N -2.79 2.32 0.54 12.44 0.04 -1.26 -5.01 135.00 141.27 3bqi s PRO 1441Ca 0.26 1.95 -0.16 0.00 0.04 0.00 0.00 61.00 63.09 3bqi s PRO 1441Cb -0.09 -1.83 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 3bqi s PRO 1441CO 0.17 -1.74 1.00 -1.25 0.04 0.00 0.00 177.00 175.21 3bqi s PRO 1442N -3.61 3.80 0.00 0.56 0.04 -1.26 -5.15 135.00 129.38 3bqi s PRO 1442Ca 0.79 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.79 3bqi s PRO 1442Cb -0.34 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.09 3bqi s PRO 1442CO 0.42 -0.40 0.00 0.25 0.04 0.00 0.00 177.00 177.31 3bqi n THR 1443N -1.83 0.00 0.00 1.26 -2.24 -1.26 -4.95 114.28 105.26 3bqi n THR 1443Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 3bqi n THR 1443Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 3bqi n THR 1443CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3bqi n ASP 1448N -0.92 0.00 -0.17 3.42 -0.08 -1.26 -5.24 116.55 112.30 3bqi n ASP 1448Ca 0.00 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.31 3bqi n ASP 1448Cb 0.00 0.00 0.32 0.00 2.34 0.00 0.00 41.12 43.78 3bqi n ASP 1448CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 3bqi h GLN 1449N 0.00 0.81 -0.89 -0.67 4.15 -1.96 -0.95 115.11 115.61 3bqi h GLN 1449Ca 0.00 -0.05 0.05 0.00 0.77 0.00 0.00 58.65 59.42 3bqi h GLN 1449Cb 0.00 -0.18 -0.06 0.00 0.21 0.00 0.00 27.48 27.45 3bqi h GLN 1449CO 0.00 0.54 0.58 0.66 -1.93 0.00 0.00 178.83 178.68 3bqi h SER 1450N 0.84 0.92 -0.31 -0.69 4.64 -1.96 0.29 113.55 117.28 3bqi h SER 1450Ca 0.27 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.42 3bqi h SER 1450Cb 0.04 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 61.94 3bqi h SER 1450CO -0.07 0.61 -0.50 0.58 -0.87 0.00 0.00 176.83 176.58 3bqi h VAL 1451N 1.05 1.28 -0.60 0.95 2.07 -1.69 -2.50 116.25 116.81 3bqi h VAL 1451Ca 0.37 -1.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.19 3bqi h VAL 1451Cb 0.13 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3bqi h VAL 1451CO -0.13 0.55 0.26 -1.28 0.02 0.00 0.00 177.57 176.99 3bqi h SER 1452N 0.67 0.81 -0.73 0.57 0.87 -0.46 0.42 113.55 115.71 3bqi h SER 1452Ca 0.03 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.37 3bqi h SER 1452Cb 1.10 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.82 3bqi h SER 1452CO 0.11 0.74 0.19 -0.50 -0.53 0.00 0.00 176.83 176.84 3bqi h TRP 1453N 0.83 1.20 -0.42 2.24 4.06 -0.50 -2.40 115.95 120.96 3bqi h TRP 1453Ca 0.20 -0.14 -0.13 0.00 2.06 0.00 0.00 58.89 60.89 3bqi h TRP 1453Cb 0.16 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 27.97 3bqi h TRP 1453CO 0.01 0.96 -0.24 0.35 -3.56 0.00 0.00 178.44 175.96 3bqi h PHE 1454N 1.09 1.06 -0.52 0.49 3.57 -1.11 -1.45 116.94 120.07 3bqi h PHE 1454Ca 0.23 -0.27 0.02 0.00 3.53 0.00 0.00 57.97 61.48 3bqi h PHE 1454Cb 0.35 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 3bqi h PHE 1454CO 0.03 1.08 0.32 0.87 -2.23 0.00 0.00 178.31 178.37 3bqi h LYS 1455N 0.74 0.62 -0.28 1.11 1.57 -0.88 -0.98 116.57 118.47 3bqi h LYS 1455Ca 0.09 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3bqi h LYS 1455Cb 0.82 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 3bqi h LYS 1455CO 0.07 0.41 0.17 1.49 -0.57 0.00 0.00 179.45 181.02 3bqi h GLU 1456N 0.63 0.34 -0.40 3.15 4.81 -1.29 -0.61 114.58 121.21 3bqi h GLU 1456Ca 0.21 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.50 3bqi h GLU 1456Cb 0.00 -0.08 -0.09 0.00 0.63 0.00 0.00 28.75 29.22 3bqi h GLU 1456CO -0.09 0.22 -0.22 2.35 -0.73 0.00 0.00 179.01 180.55 3bqi h TRP 1457N 0.35 -0.57 0.12 0.92 7.01 -1.08 -1.69 115.95 121.01 3bqi h TRP 1457Ca 0.11 0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.17 3bqi h TRP 1457Cb -0.02 0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 27.33 3bqi h TRP 1457CO -0.07 -0.30 -0.19 0.78 -2.79 0.00 0.00 178.44 175.87 3bqi h GLY 1458N -0.15 -0.36 0.43 2.65 0.00 -0.79 0.85 103.07 105.70 3bqi h GLY 1458Ca 0.19 0.22 0.07 0.00 0.00 0.00 0.00 47.33 47.82 3bqi h GLY 1458CO -0.49 -0.18 0.09 -2.09 0.00 0.00 0.00 176.54 173.87 3bqi h GLU 1459N -0.38 0.22 0.03 4.80 4.81 -1.00 -0.53 114.58 122.53 3bqi h GLU 1459Ca 0.02 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3bqi h GLU 1459Cb 0.39 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 3bqi h GLU 1459CO -0.10 0.14 -0.02 0.37 -0.73 0.00 0.00 179.01 178.68 3bqi h GLN 1460N 0.22 -0.04 -0.89 1.92 4.15 -1.14 -2.34 115.11 117.00 3bqi h GLN 1460Ca 0.22 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.66 3bqi h GLN 1460Cb 0.28 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.93 3bqi h GLN 1460CO -0.29 -0.03 0.58 0.35 -1.93 0.00 0.00 178.83 177.52 3bqi h PHE 1461N -0.04 1.09 -0.27 3.99 3.04 -0.38 -1.52 116.94 122.86 3bqi h PHE 1461Ca -0.00 0.03 -0.19 0.00 3.98 0.00 0.00 57.97 61.78 3bqi h PHE 1461Cb 0.03 -0.37 0.00 0.00 2.56 0.00 0.00 35.95 38.18 3bqi h PHE 1461CO -0.08 0.66 -0.58 0.00 -2.02 0.00 0.00 178.31 176.29 3bqi h ILE 1463N 0.65 1.01 -0.87 0.00 2.04 -1.29 -1.86 117.51 117.18 3bqi h ILE 1463Ca 0.00 -0.35 0.07 0.00 1.00 0.00 0.00 64.86 65.58 3bqi h ILE 1463Cb 1.20 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 38.45 3bqi h ILE 1463CO 0.13 0.09 0.54 -0.33 0.00 0.00 0.00 178.15 178.57 3bqi h GLU 1464N -0.28 0.94 -0.87 2.37 5.08 -1.24 -1.94 114.58 118.65 3bqi h GLU 1464Ca -0.01 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 3bqi h GLU 1464Cb 0.23 -0.21 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 3bqi h GLU 1464CO 0.02 0.62 0.54 -0.09 -1.00 0.00 0.00 179.01 179.10 3bqi h ARG 1465N 0.97 0.95 0.00 2.33 2.43 -0.66 -1.03 114.38 119.37 3bqi h ARG 1465Ca 0.38 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.37 3bqi h ARG 1465Cb 0.19 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3bqi h ARG 1465CO -0.18 0.63 -0.59 -0.07 -1.51 0.00 0.00 179.97 178.25 3bqi h LEU 1466N 0.98 0.00 -0.40 3.80 3.38 -0.76 -1.84 115.31 120.46 3bqi h LEU 1466Ca 0.38 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.27 3bqi h LEU 1466Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3bqi h LEU 1466CO -0.17 0.59 -0.04 0.03 0.09 0.00 0.00 178.44 178.94 3bqi h ARG 1467N 0.00 0.74 -0.60 1.13 3.08 -0.87 -0.43 114.38 117.44 3bqi h ARG 1467Ca -0.01 -0.26 0.03 0.00 0.07 0.00 0.00 59.98 59.81 3bqi h ARG 1467Cb 1.08 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.04 3bqi h ARG 1467CO 0.08 0.85 0.36 1.88 -1.07 0.00 0.00 179.97 182.07 3bqi h TYR 1468N 0.56 0.67 -0.20 3.04 -1.99 -1.04 -1.73 116.97 116.28 3bqi h TYR 1468Ca 0.11 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.86 3bqi h TYR 1468Cb 0.54 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.05 3bqi h TYR 1468CO 0.04 0.38 0.13 1.49 -0.00 0.00 0.00 178.16 180.20 3bqi h GLU 1469N 0.71 0.27 -0.47 4.88 4.81 -1.24 -0.70 114.58 122.85 3bqi h GLU 1469Ca 0.24 -0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.55 3bqi h GLU 1469Cb 0.03 -0.06 -0.10 0.00 0.63 0.00 0.00 28.75 29.26 3bqi h GLU 1469CO -0.11 0.20 -0.22 0.37 -0.73 0.00 0.00 179.01 178.52 3bqi h GLN 1470N 0.26 -0.12 -0.08 1.92 4.15 -0.80 0.79 115.11 121.23 3bqi h GLN 1470Ca 0.07 0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.39 3bqi h GLN 1470Cb -0.01 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3bqi h GLN 1470CO -0.01 -0.08 -0.43 -0.91 -1.93 0.00 0.00 178.83 175.46 3bqi h ASN 1471N -0.12 0.20 -0.10 -0.69 2.35 -1.11 -1.56 115.58 114.55 3bqi h ASN 1471Ca 0.22 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 3bqi h ASN 1471Cb 0.46 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 3bqi h ASN 1471CO -0.54 0.62 0.00 0.40 -1.65 0.00 0.00 177.43 176.26 3bqi h ILE 1472N 0.16 1.24 -0.34 2.81 2.04 -0.42 -2.56 117.51 120.45 3bqi h ILE 1472Ca 0.01 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.05 3bqi h ILE 1472Cb 0.84 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 3bqi h ILE 1472CO 0.07 0.22 -0.02 0.03 0.00 0.00 0.00 178.15 178.45 3bqi h ARG 1473N -0.08 0.53 0.00 2.37 3.08 -0.73 0.23 114.38 119.78 3bqi h ARG 1473Ca 0.03 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 3bqi h ARG 1473Cb 0.33 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3bqi h ARG 1473CO 0.00 0.57 -0.32 0.93 -1.07 0.00 0.00 179.97 180.08 3bqi h GLU 1474N 0.51 0.00 0.00 0.04 5.08 -1.25 -0.29 114.58 118.67 3bqi h GLU 1474Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3bqi h GLU 1474Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3bqi h GLU 1474CO 0.01 0.32 -1.38 0.00 -1.00 0.00 0.00 179.01 176.96 3bqi n ALA 1475N -2.32 3.42 0.08 3.43 0.00 -0.92 -4.36 120.51 119.83 3bqi n ALA 1475Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 53.44 52.99 3bqi n ALA 1475Cb 0.44 -0.63 0.03 0.00 0.00 0.00 0.00 19.45 19.28 3bqi n ALA 1475CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bqi s THR 1477N -0.59 -0.87 0.17 0.00 2.01 -0.12 -4.44 115.64 111.80 3bqi s THR 1477Ca 0.06 -0.16 0.00 0.00 0.31 0.00 0.00 61.69 61.90 3bqi s THR 1477Cb 0.04 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 72.02 3bqi s THR 1477CO 0.05 -0.11 0.00 1.21 -0.69 0.00 0.00 174.62 175.08 3bqi n GLU 1483N 4.84 -1.94 -2.53 4.92 2.13 -1.26 -4.87 120.64 121.93 3bqi n GLU 1483Ca 0.08 1.41 -0.01 0.00 0.66 0.00 0.00 57.16 59.30 3bqi n GLU 1483Cb 0.54 -1.57 0.07 0.00 0.27 0.00 0.00 31.44 30.74 3bqi n GLU 1483CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3bqi n LYS 1484N -0.39 1.33 -1.89 5.31 4.81 -1.26 -5.07 118.16 121.00 3bqi n LYS 1484Ca 0.00 -2.44 -0.40 0.00 -0.87 0.00 0.00 58.31 54.60 3bqi n LYS 1484Cb 0.00 -0.64 -0.03 0.00 0.02 0.00 0.00 35.03 34.38 3bqi n LYS 1484CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3bqi s LYS 1485N -1.88 2.84 -0.10 1.64 1.02 -1.26 -4.96 119.74 117.04 3bqi s LYS 1485Ca 0.20 1.20 0.02 0.00 0.02 0.00 0.00 55.97 57.40 3bqi s LYS 1485Cb 0.35 -4.35 0.01 0.00 -0.52 0.00 0.00 37.83 33.32 3bqi s LYS 1485CO -0.08 -2.45 -0.14 0.00 -0.92 0.00 0.00 175.35 171.76 3bqi s ILE 1487N 0.93 4.53 0.61 0.00 -1.09 -1.03 -4.86 121.20 120.30 3bqi s ILE 1487Ca -0.08 2.01 -0.19 0.00 -2.23 0.00 0.00 60.65 60.15 3bqi s ILE 1487Cb -0.15 -4.29 -0.02 0.00 -1.58 0.00 0.00 42.46 36.41 3bqi s ILE 1487CO -0.00 0.33 1.31 0.59 -1.23 0.00 0.00 174.94 175.94 3bqi n ASN 1488N 2.78 2.27 0.08 3.58 3.02 -1.26 -1.40 115.26 124.32 3bqi n ASN 1488Ca 0.02 0.88 0.00 0.00 -0.03 0.00 0.00 54.58 55.45 3bqi n ASN 1488Cb 0.49 -1.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.10 3bqi n ASN 1488CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3bqi n SER 1489N -1.58 0.13 -4.58 6.41 7.64 -1.26 -4.77 113.62 115.61 3bqi n SER 1489Ca 0.14 0.25 -0.34 0.00 1.01 0.00 0.00 58.87 59.93 3bqi n SER 1489Cb 0.47 0.13 -0.11 0.00 -1.01 0.00 0.00 64.21 63.68 3bqi n SER 1489CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3bqi s ASP 1495N -4.94 4.90 -0.04 6.43 -0.00 -1.26 -5.30 116.67 116.46 3bqi s ASP 1495Ca 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 52.55 52.59 3bqi s ASP 1495Cb 0.00 -1.51 -0.01 0.00 -0.00 0.00 0.00 42.92 41.40 3bqi s ASP 1495CO 0.00 0.29 -0.19 -0.54 -0.00 0.00 0.00 175.17 174.73 3bqi s LYS 1496N -0.36 1.90 0.75 8.23 3.01 -0.49 -4.48 119.74 128.30 3bqi s LYS 1496Ca 0.06 -0.68 -0.15 0.00 -1.01 0.00 0.00 55.97 54.19 3bqi s LYS 1496Cb -0.12 -1.67 0.02 0.00 -1.01 0.00 0.00 37.83 35.05 3bqi s LYS 1496CO 0.02 0.30 0.99 0.44 0.51 0.00 0.00 175.35 177.61 3bqi n ILE 1497N 3.02 2.56 -3.88 2.17 -5.35 -1.26 -2.47 119.36 114.15 3bqi n ILE 1497Ca -0.17 -0.33 -0.10 0.00 -0.27 0.00 0.00 62.75 61.88 3bqi n ILE 1497Cb 0.53 -1.10 -0.06 0.00 -1.74 0.00 0.00 39.64 37.27 3bqi n ILE 1497CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 3bqi s GLN 1498N -3.50 1.22 6.08 6.28 -0.44 -1.26 -4.79 119.66 123.25 3bqi s GLN 1498Ca 0.73 -1.06 0.00 0.00 -2.50 0.00 0.00 55.36 52.53 3bqi s GLN 1498Cb -0.33 0.42 0.00 0.00 -1.64 0.00 0.00 33.01 31.47 3bqi s GLN 1498CO 0.51 -0.47 0.00 0.41 0.50 0.00 0.00 175.29 176.24 3bqi n GLY 1499N -0.25 2.58 0.31 2.59 0.00 -1.26 -3.04 105.19 106.11 3bqi n GLY 1499Ca -0.09 -0.42 0.03 0.00 0.00 0.00 0.00 46.02 45.55 3bqi n GLY 1499CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bqi h ALA 1500N -0.79 1.18 0.35 4.61 0.00 -1.98 -1.40 119.26 121.24 3bqi h ALA 1500Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3bqi h ALA 1500Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3bqi h ALA 1500CO 0.00 0.07 -0.23 0.00 0.00 0.00 0.00 179.25 179.08 3bqi h LYS 1502N -0.57 0.95 0.43 0.00 3.64 -1.39 -1.44 116.57 118.18 3bqi h LYS 1502Ca -0.03 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 3bqi h LYS 1502Cb 0.48 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3bqi h LYS 1502CO 0.02 0.66 -0.28 0.00 -2.27 0.00 0.00 179.45 177.58 3bqi h ARG 1503N 0.97 -0.66 -0.79 1.90 3.08 -1.08 0.89 114.38 118.69 3bqi h ARG 1503Ca 0.25 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.35 3bqi h ARG 1503Cb -0.05 0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 3bqi h ARG 1503CO -0.05 -0.44 0.50 0.87 -1.07 0.00 0.00 179.97 179.78 3bqi h LYS 1504N -0.69 1.05 -0.37 0.04 1.79 -1.15 -1.05 116.57 116.20 3bqi h LYS 1504Ca -0.05 -0.08 -0.06 0.00 -2.18 0.00 0.00 60.65 58.28 3bqi h LYS 1504Cb 0.57 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 3bqi h LYS 1504CO 0.04 0.72 -0.02 0.00 -1.08 0.00 0.00 179.45 179.10 3bqi h GLU 1506N 0.48 0.00 -0.62 0.00 5.08 -0.45 -2.12 114.58 116.94 3bqi h GLU 1506Ca 0.10 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3bqi h GLU 1506Cb 0.50 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 3bqi h GLU 1506CO 0.02 0.28 0.27 0.87 -1.00 0.00 0.00 179.01 179.45 3bqi h LYS 1507N 0.00 0.92 -0.18 2.33 1.57 -1.01 -1.60 116.57 118.60 3bqi h LYS 1507Ca -0.00 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 3bqi h LYS 1507Cb 0.50 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 3bqi h LYS 1507CO 0.04 0.76 -0.19 -0.92 -0.57 0.00 0.00 179.45 178.57 3bqi h TYR 1508N 0.86 0.54 -0.60 -1.35 5.03 -1.34 -0.51 116.97 119.60 3bqi h TYR 1508Ca 0.21 -0.16 0.10 0.00 2.58 0.00 0.00 58.73 61.46 3bqi h TYR 1508Cb 0.17 -0.11 -0.08 0.00 1.55 0.00 0.00 36.73 38.26 3bqi h TYR 1508CO 0.01 0.82 0.17 -0.22 -1.32 0.00 0.00 178.16 177.62 3bqi h LYS 1509N 0.10 0.31 -0.21 1.82 3.64 -1.36 0.96 116.57 121.83 3bqi h LYS 1509Ca 0.03 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3bqi h LYS 1509Cb 0.74 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 3bqi h LYS 1509CO 0.05 0.21 0.08 -0.22 -2.27 0.00 0.00 179.45 177.30 3bqi h LYS 1510N 0.32 0.32 -0.16 1.90 3.64 -1.25 -2.21 116.57 119.14 3bqi h LYS 1510Ca 0.31 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.67 3bqi h LYS 1510Cb 0.42 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 3bqi h LYS 1510CO -0.35 0.39 -0.14 -0.92 -2.27 0.00 0.00 179.45 176.15 3bqi h TYR 1511N 0.19 -0.35 -0.99 1.91 3.20 -0.56 -2.54 116.97 117.83 3bqi h TYR 1511Ca 0.07 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.02 3bqi h TYR 1511Cb 0.19 0.18 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 3bqi h TYR 1511CO -0.01 -0.21 0.64 0.82 -1.64 0.00 0.00 178.16 177.76 3bqi h ILE 1512N -0.16 1.11 -0.38 1.81 1.08 -0.75 -1.76 117.51 118.46 3bqi h ILE 1512Ca 0.10 -0.41 -0.03 0.00 -0.39 0.00 0.00 64.86 64.13 3bqi h ILE 1512Cb 0.31 -0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 33.86 3bqi h ILE 1512CO -0.26 0.22 0.10 0.77 -0.69 0.00 0.00 178.15 178.28 3bqi h SER 1513N 1.18 0.52 0.48 1.72 4.64 -1.11 -1.77 113.55 119.21 3bqi h SER 1513Ca 0.41 -0.07 -0.29 0.00 -0.47 0.00 0.00 61.79 61.38 3bqi h SER 1513Cb 0.11 -0.13 0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3bqi h SER 1513CO -0.16 0.52 -1.27 -0.33 -0.87 0.00 0.00 176.83 174.73 3bqi h GLU 1514N 0.55 0.37 0.00 4.77 5.08 -1.04 -3.31 114.58 121.00 3bqi h GLU 1514Ca 0.13 -0.60 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3bqi h GLU 1514Cb 0.21 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3bqi h GLU 1514CO -0.00 1.27 0.00 0.87 -1.00 0.00 0.00 179.01 180.15 3bqi h LYS 1515N 0.12 0.00 -0.59 2.33 1.79 -1.16 -3.35 116.57 115.71 3bqi h LYS 1515Ca -0.16 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.36 3bqi h LYS 1515Cb 1.97 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.57 3bqi h LYS 1515CO 0.22 0.00 0.33 -0.22 -1.08 0.00 0.00 179.45 178.70 3bqi h LYS 1516N 0.00 0.61 -0.62 3.15 1.63 -1.42 -1.44 116.57 118.48 3bqi h LYS 1516Ca 0.00 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 3bqi h LYS 1516Cb 0.71 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.18 3bqi h LYS 1516CO 0.00 0.40 0.33 -0.56 -3.45 0.00 0.00 179.45 176.18 3bqi h GLN 1517N 0.63 0.86 -0.25 1.90 3.07 -1.80 -1.75 115.11 117.76 3bqi h GLN 1517Ca 0.26 -0.09 -0.16 0.00 0.09 0.00 0.00 58.65 58.74 3bqi h GLN 1517Cb 0.13 -0.17 0.00 0.00 0.08 0.00 0.00 27.48 27.52 3bqi h GLN 1517CO -0.16 0.64 -0.48 0.93 0.09 0.00 0.00 178.83 179.86 3bqi h GLU 1518N 0.87 0.77 0.47 0.06 5.08 -1.58 -2.32 114.58 117.93 3bqi h GLU 1518Ca 0.22 -0.49 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 3bqi h GLU 1518Cb 0.03 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3bqi h GLU 1518CO -0.04 1.12 -0.23 2.35 -1.00 0.00 0.00 179.01 181.22 3bqi h TRP 1519N 0.52 -0.59 -0.30 4.33 2.91 -1.10 -2.59 115.95 119.14 3bqi h TRP 1519Ca 0.01 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.09 3bqi h TRP 1519Cb 1.08 0.19 -0.07 0.00 -0.51 0.00 0.00 29.16 29.85 3bqi h TRP 1519CO 0.08 -0.34 -0.17 -0.44 -1.03 0.00 0.00 178.44 176.54 3bqi h ASP 1520N -0.68 -0.57 0.28 2.65 3.32 -1.34 0.21 116.42 120.29 3bqi h ASP 1520Ca -0.06 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3bqi h ASP 1520Cb 0.51 0.30 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 3bqi h ASP 1520CO 0.11 -0.21 -0.33 0.11 -1.72 0.00 0.00 179.24 177.20 3bqi h LYS 1521N -0.14 -0.63 -0.47 3.56 1.57 -1.44 -2.10 116.57 116.92 3bqi h LYS 1521Ca 0.16 0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.86 3bqi h LYS 1521Cb 0.38 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 3bqi h LYS 1521CO -0.39 -0.42 -0.17 1.96 -0.57 0.00 0.00 179.45 179.86 3bqi h GLN 1522N -0.65 0.95 -0.09 3.15 4.20 -1.20 -2.44 115.11 119.01 3bqi h GLN 1522Ca -0.01 -0.39 0.01 0.00 0.06 0.00 0.00 58.65 58.32 3bqi h GLN 1522Cb 0.62 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 3bqi h GLN 1522CO -0.10 1.05 0.04 -0.22 -0.67 0.00 0.00 178.83 178.94 3bqi h LYS 1523N 0.79 0.09 -0.21 1.46 3.64 -0.56 -0.29 116.57 121.50 3bqi h LYS 1523Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3bqi h LYS 1523Cb 0.74 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 3bqi h LYS 1523CO 0.06 0.06 0.13 1.15 -2.27 0.00 0.00 179.45 178.57 3bqi h THR 1524N 0.09 1.04 -0.22 1.00 2.02 -1.37 0.95 112.91 116.42 3bqi h THR 1524Ca 0.04 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3bqi h THR 1524Cb 0.01 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3bqi h THR 1524CO -0.03 0.05 0.15 0.50 0.37 0.00 0.00 175.52 176.56 3bqi h LYS 1525N 0.26 0.29 0.49 6.66 3.64 -1.35 -2.23 116.57 124.33 3bqi h LYS 1525Ca 0.08 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3bqi h LYS 1525Cb -0.02 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3bqi h LYS 1525CO -0.03 0.19 -0.24 -0.92 -2.27 0.00 0.00 179.45 176.19 3bqi h TYR 1526N 0.30 -0.62 -0.04 1.91 3.20 -0.87 -2.87 116.97 117.98 3bqi h TYR 1526Ca 0.08 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 3bqi h TYR 1526Cb -0.03 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 3bqi h TYR 1526CO -0.06 -0.34 -0.53 0.93 -1.64 0.00 0.00 178.16 176.52 3bqi h GLU 1527N -0.77 0.11 -0.14 1.82 5.08 -0.81 0.12 114.58 119.99 3bqi h GLU 1527Ca -0.07 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3bqi h GLU 1527Cb 0.56 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3bqi h GLU 1527CO 0.11 0.61 0.00 0.27 -1.00 0.00 0.00 179.01 179.01 3bqi n ASN 1528N -3.92 2.06 -0.11 1.42 0.23 -0.84 -3.67 115.26 110.42 3bqi n ASN 1528Ca -0.02 -1.73 -0.25 0.00 -0.53 0.00 0.00 54.58 52.05 3bqi n ASN 1528Cb 0.55 -0.09 -0.11 0.00 -2.08 0.00 0.00 39.78 38.05 3bqi n ASN 1528CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 3bqi n LYS 1529N 0.59 0.60 -3.19 -3.83 4.81 -1.03 -4.77 118.16 111.33 3bqi n LYS 1529Ca 0.17 0.37 -0.45 0.00 -0.87 0.00 0.00 58.31 57.53 3bqi n LYS 1529Cb 0.41 -1.61 -0.01 0.00 0.02 0.00 0.00 35.03 33.85 3bqi n LYS 1529CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3bqi s TYR 1530N -2.46 3.83 0.10 5.64 2.02 0.40 -5.02 117.35 121.86 3bqi s TYR 1530Ca -0.34 -2.24 -0.31 0.00 -0.37 0.00 0.00 57.07 53.81 3bqi s TYR 1530Cb 0.10 -4.01 -0.09 0.00 -0.40 0.00 0.00 41.96 37.56 3bqi s TYR 1530CO 0.56 -1.14 1.60 0.14 -1.57 0.00 0.00 175.55 175.14 3bqi s VAL 1531N 0.25 2.93 0.00 0.71 -7.23 -1.24 -1.70 120.40 114.12 3bqi s VAL 1531Ca 0.31 0.51 0.00 0.00 -1.81 0.00 0.00 61.98 60.99 3bqi s VAL 1531Cb -0.08 -3.33 0.00 0.00 0.56 0.00 0.00 36.38 33.54 3bqi s VAL 1531CO -0.06 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.35 3bqi n GLY 1532N 3.88 0.82 3.77 2.32 0.00 -1.26 -5.05 105.19 109.67 3bqi n GLY 1532Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3bqi n GLY 1532CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bqi s LYS 1533N -0.25 3.09 -0.10 1.61 1.02 -0.69 -5.11 119.74 119.31 3bqi s LYS 1533Ca 0.00 -0.42 -0.10 0.00 0.02 0.00 0.00 55.97 55.47 3bqi s LYS 1533Cb 0.00 -2.88 -0.05 0.00 -0.52 0.00 0.00 37.83 34.38 3bqi s LYS 1533CO 0.00 0.68 0.22 0.45 -0.92 0.00 0.00 175.35 175.78 3bqi s SER 1534N -1.44 6.48 0.26 2.83 0.15 -1.26 -4.67 113.70 116.04 3bqi s SER 1534Ca 0.20 0.57 -0.00 0.00 0.70 0.00 0.00 55.95 57.41 3bqi s SER 1534Cb -0.12 -2.13 0.33 0.00 -1.71 0.00 0.00 66.02 62.39 3bqi s SER 1534CO 0.10 0.33 1.69 0.00 1.20 0.00 0.00 173.24 176.56 3bqi h ALA 1535N 5.27 1.02 -0.57 5.45 0.00 -1.96 -2.48 119.26 125.99 3bqi h ALA 1535Ca -0.51 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.04 3bqi h ALA 1535Cb 1.21 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 3bqi h ALA 1535CO 0.63 0.58 0.31 1.03 0.00 0.00 0.00 179.25 181.80 3bqi h SER 1536N 0.54 0.71 -0.55 0.00 0.87 -1.99 -3.03 113.55 110.10 3bqi h SER 1536Ca 0.08 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 3bqi h SER 1536Cb 0.67 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 3bqi h SER 1536CO 0.05 0.60 0.24 0.44 -0.53 0.00 0.00 176.83 177.62 3bqi h ASP 1537N 0.76 0.74 -0.64 6.23 3.32 -1.94 -2.33 116.42 122.55 3bqi h ASP 1537Ca 0.20 -0.16 0.14 0.00 0.02 0.00 0.00 57.03 57.23 3bqi h ASP 1537Cb 0.05 -0.19 -0.10 0.00 0.22 0.00 0.00 39.33 39.30 3bqi h ASP 1537CO -0.03 0.69 0.05 0.25 -1.72 0.00 0.00 179.24 178.48 3bqi h LEU 1538N 0.75 -0.19 0.10 1.55 5.85 -1.33 -0.57 115.31 121.48 3bqi h LEU 1538Ca 0.19 0.15 -0.20 0.00 0.84 0.00 0.00 57.88 58.85 3bqi h LEU 1538Cb 0.17 0.25 0.02 0.00 0.37 0.00 0.00 40.66 41.47 3bqi h LEU 1538CO -0.02 -0.09 -0.86 -0.07 -0.34 0.00 0.00 178.44 177.07 3bqi h LEU 1539N 0.16 0.57 -0.97 2.25 3.38 -1.49 -3.24 115.31 115.97 3bqi h LEU 1539Ca 0.34 -0.88 -0.09 0.00 0.09 0.00 0.00 57.88 57.35 3bqi h LEU 1539Cb 0.56 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3bqi h LEU 1539CO -0.52 1.39 -0.23 0.11 0.09 0.00 0.00 178.44 179.29 3bqi h LYS 1540N -0.17 0.48 0.00 1.13 1.57 -1.26 -0.76 116.57 117.56 3bqi h LYS 1540Ca -0.14 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 3bqi h LYS 1540Cb 1.62 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.90 3bqi h LYS 1540CO 0.16 0.68 0.00 1.05 -0.57 0.00 0.00 179.45 180.77 3bqi h GLU 1541N 0.43 0.00 0.01 3.15 4.11 -1.22 -3.35 114.58 117.71 3bqi h GLU 1541Ca 0.07 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 59.10 3bqi h GLU 1541Cb 0.63 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 3bqi h GLU 1541CO 0.05 0.00 -2.45 0.09 0.07 0.00 0.00 179.01 176.76 3bqi n ASN 1542N -2.67 1.99 -4.12 3.06 3.02 -0.95 -4.98 115.26 110.61 3bqi n ASN 1542Ca 0.03 -0.05 -0.33 0.00 -0.03 0.00 0.00 54.58 54.20 3bqi n ASN 1542Cb 0.37 -0.49 -0.16 0.00 -0.61 0.00 0.00 39.78 38.89 3bqi n ASN 1542CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3bqi s TYR 1543N -2.52 2.72 0.51 3.10 1.51 -0.33 -5.01 117.35 117.33 3bqi s TYR 1543Ca -0.35 -1.56 0.30 0.00 -1.01 0.00 0.00 57.07 54.45 3bqi s TYR 1543Cb 0.10 -1.88 1.72 0.00 -0.11 0.00 0.00 41.96 41.79 3bqi s TYR 1543CO 0.60 -0.76 2.18 -1.00 -1.11 0.00 0.00 175.55 175.46 3bqi h PRO 1544N 7.83 0.00 0.00 -1.71 0.13 -1.87 -1.85 132.00 134.52 3bqi h PRO 1544Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3bqi h PRO 1544Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3bqi h PRO 1544CO 0.62 0.05 0.00 0.93 -0.23 0.00 0.00 178.00 179.37 3bqi h GLU 1545N 0.00 0.00 0.00 0.86 3.07 -1.94 -2.90 114.58 113.66 3bqi h GLU 1545Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3bqi h GLU 1545Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 3bqi h GLU 1545CO 0.01 0.00 -0.48 0.00 -1.40 0.00 0.00 179.01 177.14 3bqi h ILE 1547N 0.00 1.02 0.00 0.00 2.04 -1.62 -1.42 117.51 117.53 3bqi h ILE 1547Ca 0.00 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3bqi h ILE 1547Cb 0.61 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 3bqi h ILE 1547CO 0.00 0.17 0.00 -1.54 0.00 0.00 0.00 178.15 176.78 3bqi n SER 1548N -4.64 0.00 -4.59 1.72 3.41 -1.26 -4.80 113.62 103.46 3bqi n SER 1548Ca 0.13 -0.17 -0.42 0.00 -0.26 0.00 0.00 58.87 58.15 3bqi n SER 1548Cb 0.20 -0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 63.82 3bqi n SER 1548CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3bqi s ALA 1549N -2.55 3.47 -0.74 7.33 0.00 -0.54 -5.00 121.76 123.74 3bqi s ALA 1549Ca 0.29 -0.60 -0.19 0.00 0.00 0.00 0.00 51.96 51.46 3bqi s ALA 1549Cb 0.20 -3.30 0.12 0.00 0.00 0.00 0.00 23.12 20.14 3bqi s ALA 1549CO 0.45 -1.34 0.91 1.21 0.00 0.00 0.00 175.76 177.00 3bqi s ASN 1550N 1.74 6.38 0.39 0.00 3.84 -1.26 -4.91 114.94 121.12 3bqi s ASN 1550Ca 0.30 -1.65 0.10 0.00 0.21 0.00 0.00 52.86 51.82 3bqi s ASN 1550Cb -0.14 -2.35 0.79 0.00 -0.55 0.00 0.00 41.25 39.00 3bqi s ASN 1550CO 0.15 -1.13 1.92 -0.26 -2.79 0.00 0.00 177.10 174.99 3bqi h PHE 1551N 9.03 0.25 -0.34 0.43 0.04 -1.94 0.12 116.94 124.53 3bqi h PHE 1551Ca -0.11 -0.03 -0.17 0.00 2.80 0.00 0.00 57.97 60.47 3bqi h PHE 1551Cb 1.06 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.13 3bqi h PHE 1551CO 0.99 0.36 -0.46 -0.44 -0.60 0.00 0.00 178.31 178.17 3bqi h ASP 1552N 0.23 0.97 0.10 2.17 3.32 -1.95 -2.24 116.42 119.02 3bqi h ASP 1552Ca 0.05 -0.48 -0.00 0.00 0.02 0.00 0.00 57.03 56.62 3bqi h ASP 1552Cb 0.36 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3bqi h ASP 1552CO 0.02 1.27 -0.05 0.15 -1.72 0.00 0.00 179.24 178.91 3bqi h PHE 1553N 0.71 -0.12 -0.61 4.55 3.57 -1.79 -0.82 116.94 122.42 3bqi h PHE 1553Ca 0.04 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.64 3bqi h PHE 1553Cb 1.06 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.76 3bqi h PHE 1553CO 0.07 0.24 0.19 0.82 -2.23 0.00 0.00 178.31 177.39 3bqi h ILE 1554N -0.51 0.70 -0.48 1.41 2.04 -0.83 -2.69 117.51 117.15 3bqi h ILE 1554Ca -0.01 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.73 3bqi h ILE 1554Cb 0.42 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3bqi h ILE 1554CO 0.02 0.06 0.00 0.49 0.00 0.00 0.00 178.15 178.72 3bqi n PHE 1555N -5.06 0.97 -1.60 1.37 3.01 -0.84 -4.94 117.46 110.38 3bqi n PHE 1555Ca 0.09 -0.61 -0.46 0.00 1.01 0.00 0.00 57.45 57.48 3bqi n PHE 1555Cb 0.31 -0.15 -0.02 0.00 -0.01 0.00 0.00 39.48 39.60 3bqi n PHE 1555CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3bqi n ASN 1556N 0.66 1.50 -0.60 4.37 2.85 -0.31 -4.93 115.26 118.80 3bqi n ASN 1556Ca 0.20 1.16 0.05 0.00 -0.11 0.00 0.00 54.58 55.88 3bqi n ASN 1556Cb 0.70 -1.29 0.19 0.00 1.24 0.00 0.00 39.78 40.63 3bqi n ASN 1556CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3bqi n ASP 1557N 1.56 2.23 -4.86 1.20 2.03 -1.26 -4.96 116.55 112.48 3bqi n ASP 1557Ca 0.11 -3.58 -0.30 0.00 0.52 0.00 0.00 54.79 51.53 3bqi n ASP 1557Cb 0.30 -0.53 0.04 0.00 -0.72 0.00 0.00 41.12 40.21 3bqi n ASP 1557CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 3bqi s ASN 1558N -2.88 5.58 0.13 1.67 0.01 -1.26 -5.01 114.94 113.17 3bqi s ASN 1558Ca 0.38 1.29 -0.07 0.00 -0.71 0.00 0.00 52.86 53.75 3bqi s ASN 1558Cb 0.35 -2.17 -0.09 0.00 0.41 0.00 0.00 41.25 39.75 3bqi s ASN 1558CO -0.02 -1.27 1.32 0.40 -1.51 0.00 0.00 177.10 176.02 3bqi h ILE 1559N -0.60 1.35 0.00 0.60 5.03 -2.05 -3.32 117.51 118.51 3bqi h ILE 1559Ca -0.45 -2.23 -0.10 0.00 -0.12 0.00 0.00 64.86 61.96 3bqi h ILE 1559Cb 1.23 2.24 -0.01 0.00 -3.03 0.00 0.00 36.82 37.24 3bqi h ILE 1559CO 0.62 0.68 -0.49 1.05 -0.68 0.00 0.00 178.15 179.33 3bqi h GLU 1560N 0.34 0.00 -0.24 2.37 4.11 -2.01 -3.34 114.58 115.81 3bqi h GLU 1560Ca -0.07 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.32 3bqi h GLU 1560Cb 1.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 3bqi h GLU 1560CO 0.16 0.49 -0.02 1.88 0.07 0.00 0.00 179.01 181.59 3bqi h TYR 1561N 0.00 0.37 -0.53 2.06 0.05 -1.95 -1.77 116.97 115.19 3bqi h TYR 1561Ca -0.00 -0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.65 3bqi h TYR 1561Cb 1.09 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.71 3bqi h TYR 1561CO 0.00 0.40 -0.06 -0.22 -1.05 0.00 0.00 178.16 177.23 3bqi h LYS 1562N 0.35 0.98 0.08 4.88 3.64 -1.78 -0.75 116.57 123.97 3bqi h LYS 1562Ca 0.08 -0.34 -0.19 0.00 -1.27 0.00 0.00 60.65 58.93 3bqi h LYS 1562Cb 0.27 -0.07 0.02 0.00 -0.41 0.00 0.00 32.23 32.04 3bqi h LYS 1562CO 0.01 1.01 -0.79 1.79 -2.27 0.00 0.00 179.45 179.20 3bqi h THR 1563N 0.85 1.44 0.06 1.00 1.35 -1.67 -3.28 112.91 112.66 3bqi h THR 1563Ca 0.14 -2.32 -0.24 0.00 -0.55 0.00 0.00 66.41 63.44 3bqi h THR 1563Cb 0.61 2.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.87 3bqi h THR 1563CO 0.04 0.67 -1.11 1.88 -0.25 0.00 0.00 175.52 176.75 3bqi h TYR 1564N -0.15 0.26 -2.70 4.73 -1.99 -1.42 -3.39 116.97 112.32 3bqi h TYR 1564Ca -0.12 -0.19 -0.61 0.00 2.00 0.00 0.00 58.73 59.82 3bqi h TYR 1564Cb 1.54 -0.01 -0.41 0.00 2.00 0.00 0.00 36.73 39.85 3bqi h TYR 1564CO 0.16 1.14 -0.65 0.66 -0.00 0.00 0.00 178.16 179.46 3bqi n TYR 1565N -3.46 2.69 -0.13 4.88 4.01 -0.29 -4.96 117.16 119.90 3bqi n TYR 1565Ca -0.04 -4.12 0.03 0.00 -0.16 0.00 0.00 57.90 53.61 3bqi n TYR 1565Cb 0.97 -0.49 0.32 0.00 -0.31 0.00 0.00 39.34 39.84 3bqi n TYR 1565CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3bqi h PRO 1566N 5.00 0.79 -0.41 -0.72 0.11 -1.75 -2.55 132.00 132.48 3bqi h PRO 1566Ca 0.17 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.08 3bqi h PRO 1566Cb 0.75 -0.18 -0.09 0.00 0.11 0.00 0.00 31.00 31.59 3bqi h PRO 1566CO 0.70 0.52 0.04 0.66 -0.21 0.00 0.00 178.00 179.71 3bqi n TYR 1567N -4.45 1.31 -0.35 0.65 4.01 -1.26 -4.88 117.16 112.19 3bqi n TYR 1567Ca 0.07 -1.38 0.00 0.00 -0.16 0.00 0.00 57.90 56.43 3bqi n TYR 1567Cb 0.07 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 38.60 3bqi n TYR 1567CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3bqi n GLY 1568N -0.89 2.62 0.00 2.72 0.00 -0.96 -2.42 105.19 106.26 3bqi n GLY 1568Ca 0.33 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 46.14 3bqi n GLY 1568CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3bqi n ASP 1569N 5.30 0.02 -1.39 1.61 5.75 -1.26 -2.39 116.55 124.19 3bqi n ASP 1569Ca 0.00 0.50 0.08 0.00 -0.01 0.00 0.00 54.79 55.36 3bqi n ASP 1569Cb 0.00 -0.51 0.33 0.00 -1.03 0.00 0.00 41.12 39.91 3bqi n ASP 1569CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 3bqi n TYR 1570N -1.52 1.45 -0.11 2.11 4.01 -1.01 -4.67 117.16 117.42 3bqi n TYR 1570Ca 0.04 -0.74 0.02 0.00 -0.16 0.00 0.00 57.90 57.07 3bqi n TYR 1570Cb 0.22 -0.36 0.34 0.00 -0.31 0.00 0.00 39.34 39.23 3bqi n TYR 1570CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3bqi h SER 1571N 3.11 0.66 -0.24 7.72 0.02 -1.54 -1.74 113.55 121.54 3bqi h SER 1571Ca 0.00 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 3bqi h SER 1571Cb 1.60 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.98 3bqi h SER 1571CO 0.31 0.48 -0.23 0.28 -1.14 0.00 0.00 176.83 176.53 3bqi h SER 1572N 0.78 0.61 0.28 3.07 0.02 -1.86 -2.43 113.55 114.02 3bqi h SER 1572Ca 0.21 -0.47 -0.06 0.00 -0.84 0.00 0.00 61.79 60.63 3bqi h SER 1572Cb -0.09 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 3bqi h SER 1572CO -0.05 0.96 -0.29 0.40 -1.14 0.00 0.00 176.83 176.72 3bqi h ILE 1573N 0.28 1.21 -0.78 3.27 2.04 -1.90 -2.90 117.51 118.74 3bqi h ILE 1573Ca 0.04 -1.01 -0.51 0.00 1.00 0.00 0.00 64.86 64.38 3bqi h ILE 1573Cb 0.78 1.53 -0.23 0.00 -0.74 0.00 0.00 36.82 38.17 3bqi h ILE 1573CO 0.06 0.29 0.66 0.00 0.00 0.00 0.00 178.15 179.16 3bqi s SER 1575N -0.95 1.23 -0.04 0.00 1.04 -0.95 -4.88 113.70 109.14 3bqi s SER 1575Ca 0.50 -1.48 -0.05 0.00 0.48 0.00 0.00 55.95 55.40 3bqi s SER 1575Cb 0.39 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.79 3bqi s SER 1575CO 0.00 -0.83 0.18 0.00 0.98 0.00 0.00 173.24 173.57