#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hwx s GLU 1240N 0.00 3.78 0.00 0.03 -1.05 -1.26 -4.86 118.70 115.33 2hwx s GLU 1240Ca 0.00 0.20 -0.17 0.00 -0.15 0.00 0.00 54.97 54.85 2hwx s GLU 1240Cb 0.00 -2.94 -0.06 0.00 -0.44 0.00 0.00 34.13 30.69 2hwx s GLU 1240CO 0.00 0.52 0.47 -0.51 0.95 0.00 0.00 175.26 176.69 2hwx s LEU 1241N -2.07 4.46 -0.36 1.83 1.02 -1.26 0.14 118.68 122.43 2hwx s LEU 1241Ca 0.36 1.03 -0.08 0.00 0.02 0.00 0.00 54.13 55.46 2hwx s LEU 1241Cb -0.14 -2.69 0.05 0.00 0.02 0.00 0.00 46.19 43.43 2hwx s LEU 1241CO 0.19 0.26 0.16 -0.70 0.02 0.00 0.00 176.35 176.27 2hwx s GLU 1242N -0.80 2.62 -0.22 1.70 2.12 0.05 -4.80 118.70 119.38 2hwx s GLU 1242Ca 0.26 -1.24 -0.07 0.00 0.36 0.00 0.00 54.97 54.28 2hwx s GLU 1242Cb -0.17 -3.57 -0.03 0.00 0.26 0.00 0.00 34.13 30.62 2hwx s GLU 1242CO 0.14 -0.74 0.05 0.42 -0.54 0.00 0.00 175.26 174.59 2hwx s ILE 1243N 1.42 4.27 -0.42 -3.70 1.01 -1.26 -1.32 121.20 121.20 2hwx s ILE 1243Ca 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.47 2hwx s ILE 1243Cb -0.20 -2.96 0.14 0.00 0.01 0.00 0.00 42.46 39.45 2hwx s ILE 1243CO 0.03 0.39 0.26 -0.13 0.00 0.00 0.00 174.94 175.49 2hwx s ARG 1244N 1.19 1.07 0.17 2.79 0.52 -0.41 -4.97 118.95 119.31 2hwx s ARG 1244Ca 0.04 -1.87 -0.34 0.00 -0.52 0.00 0.00 55.73 53.04 2hwx s ARG 1244Cb -0.14 -1.95 -0.14 0.00 0.52 0.00 0.00 34.95 33.24 2hwx s ARG 1244CO 0.03 -1.21 1.58 -2.30 0.02 0.00 0.00 175.30 173.41 2hwx n PRO 1245N 3.53 2.19 0.07 3.54 -0.02 -1.26 -4.38 135.00 138.67 2hwx n PRO 1245Ca 0.13 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2hwx n PRO 1245Cb 0.37 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2hwx n PRO 1245CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2hwx n LEU 1246N 3.39 0.17 -4.71 2.45 7.94 -0.35 -4.96 117.00 120.93 2hwx n LEU 1246Ca 0.17 0.23 -0.41 0.00 -1.11 0.00 0.00 56.01 54.89 2hwx n LEU 1246Cb 0.29 0.09 -0.04 0.00 0.53 0.00 0.00 43.42 44.29 2hwx n LEU 1246CO 0.63 -0.67 0.50 -0.36 -1.11 0.00 0.00 177.39 176.38 2hwx s PHE 1247N -1.60 3.56 -0.14 1.96 0.40 -0.29 -0.52 117.98 121.34 2hwx s PHE 1247Ca 0.00 1.35 0.01 0.00 -0.60 0.00 0.00 56.93 57.69 2hwx s PHE 1247Cb 0.00 -2.92 0.00 0.00 0.51 0.00 0.00 43.02 40.61 2hwx s PHE 1247CO 0.00 0.00 -0.18 -0.51 0.70 0.00 0.00 175.22 175.23 2hwx s LEU 1248N 1.12 2.35 -0.26 -0.37 1.43 0.24 -0.74 118.68 122.45 2hwx s LEU 1248Ca 0.41 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 2hwx s LEU 1248Cb -0.18 -1.52 0.04 0.00 0.03 0.00 0.00 46.19 44.56 2hwx s LEU 1248CO 0.19 0.10 -0.08 -0.69 0.23 0.00 0.00 176.35 176.10 2hwx s VAL 1249N 0.73 2.60 0.37 -1.59 1.01 -0.64 -0.70 120.40 122.19 2hwx s VAL 1249Ca -0.08 -1.29 0.04 0.00 0.00 0.00 0.00 61.98 60.65 2hwx s VAL 1249Cb -0.16 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 2hwx s VAL 1249CO 0.01 0.09 0.54 -2.16 0.00 0.00 0.00 175.10 173.57 2hwx s PRO 1250N 1.23 3.12 0.50 2.72 0.04 -1.26 -0.55 135.00 140.81 2hwx s PRO 1250Ca -0.04 -0.79 0.06 0.00 0.04 0.00 0.00 61.00 60.28 2hwx s PRO 1250Cb -0.18 -2.73 0.01 0.00 0.04 0.00 0.00 34.50 31.65 2hwx s PRO 1250CO -0.05 -0.04 0.39 0.16 0.04 0.00 0.00 177.00 177.50 2hwx s ASP 1251N -4.18 4.74 0.15 6.66 1.47 -1.22 -4.61 116.67 119.68 2hwx s ASP 1251Ca 0.45 -1.08 -0.18 0.00 1.18 0.00 0.00 52.55 52.93 2hwx s ASP 1251Cb -0.10 0.05 0.05 0.00 -0.34 0.00 0.00 42.92 42.58 2hwx s ASP 1251CO 0.34 -0.93 1.68 0.74 0.68 0.00 0.00 175.17 177.68 2hwx h THR 1252N 0.88 0.68 0.00 2.11 2.02 -1.95 -1.82 112.91 114.82 2hwx h THR 1252Ca -0.38 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.77 2hwx h THR 1252Cb 1.29 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2hwx h THR 1252CO 0.58 0.00 -0.13 0.78 0.37 0.00 0.00 175.52 177.12 2hwx h ASN 1253N 0.00 0.00 -0.70 4.18 2.35 -1.98 -0.74 115.58 118.69 2hwx h ASN 1253Ca 0.16 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 56.04 2hwx h ASN 1253Cb 0.24 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.51 2hwx h ASN 1253CO -0.33 0.13 0.24 1.23 -1.65 0.00 0.00 177.43 177.05 2hwx h GLY 1254N 0.74 1.01 0.94 2.83 0.00 -1.66 0.53 103.07 107.46 2hwx h GLY 1254Ca -0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 2hwx h GLY 1254CO 0.02 -0.10 -0.26 0.74 0.00 0.00 0.00 176.54 176.93 2hwx h PHE 1255N 0.38 0.78 -0.12 5.60 -1.00 -1.17 -0.96 116.94 120.45 2hwx h PHE 1255Ca 0.38 -0.23 -0.01 0.00 2.81 0.00 0.00 57.97 60.92 2hwx h PHE 1255Cb 0.57 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 2hwx h PHE 1255CO -0.19 0.96 0.04 0.82 -1.61 0.00 0.00 178.31 178.32 2hwx h ILE 1256N 0.37 1.17 0.00 -0.55 1.08 -1.22 -3.02 117.51 115.35 2hwx h ILE 1256Ca 0.04 -0.53 -0.21 0.00 -0.39 0.00 0.00 64.86 63.77 2hwx h ILE 1256Cb 0.83 1.31 -0.04 0.00 -3.07 0.00 0.00 36.82 35.84 2hwx h ILE 1256CO 0.07 0.16 -1.55 0.47 -0.69 0.00 0.00 178.15 176.60 2hwx n ASP 1257N -4.88 0.82 -0.89 1.72 8.00 0.16 -4.60 116.55 116.87 2hwx n ASP 1257Ca -0.05 0.37 0.03 0.00 0.71 0.00 0.00 54.79 55.85 2hwx n ASP 1257Cb 0.13 0.16 0.05 0.00 -0.02 0.00 0.00 41.12 41.44 2hwx n ASP 1257CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2hwx n HIS 1258N -2.92 0.00 -0.18 1.24 8.25 -0.37 -4.92 115.22 116.32 2hwx n HIS 1258Ca -0.13 -0.50 -0.01 0.00 -0.26 0.00 0.00 57.72 56.82 2hwx n HIS 1258Cb 0.91 -0.13 0.06 0.00 1.12 0.00 0.00 29.99 31.96 2hwx n HIS 1258CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2hwx h LEU 1259N 0.55 -0.38 -1.04 2.41 5.85 -1.51 -1.83 115.31 119.36 2hwx h LEU 1259Ca -0.10 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2hwx h LEU 1259Cb 1.52 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 42.79 2hwx h LEU 1259CO 0.04 -0.14 0.64 0.00 -0.34 0.00 0.00 178.44 178.64 2hwx h ALA 1260N 1.53 1.37 -0.55 1.25 0.00 -1.91 -0.37 119.26 120.58 2hwx h ALA 1260Ca 0.28 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2hwx h ALA 1260Cb 0.43 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2hwx h ALA 1260CO -0.52 0.52 0.14 0.77 0.00 0.00 0.00 179.25 180.15 2hwx h SER 1261N 1.22 0.84 -0.72 0.00 0.02 -1.76 -1.78 113.55 111.38 2hwx h SER 1261Ca 0.40 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2hwx h SER 1261Cb 0.04 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 2hwx h SER 1261CO -0.13 0.85 0.47 -0.07 -1.14 0.00 0.00 176.83 176.81 2hwx h LEU 1262N 0.78 0.84 -0.39 5.07 3.38 -0.64 -0.65 115.31 123.70 2hwx h LEU 1262Ca 0.17 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.15 2hwx h LEU 1262Cb 0.34 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2hwx h LEU 1262CO 0.00 0.62 0.16 0.00 0.09 0.00 0.00 178.44 179.31 2hwx h ALA 1263N 1.25 0.47 -0.91 1.53 0.00 -0.93 -1.50 119.26 119.17 2hwx h ALA 1263Ca 0.26 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2hwx h ALA 1263Cb -0.09 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2hwx h ALA 1263CO -0.05 -0.22 0.59 0.00 0.00 0.00 0.00 179.25 179.56 2hwx h ARG 1264N 0.33 1.12 -0.65 0.00 3.08 -1.02 -0.69 114.38 116.56 2hwx h ARG 1264Ca 0.18 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 2hwx h ARG 1264Cb 0.14 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 2hwx h ARG 1264CO -0.16 0.74 0.24 -0.07 -1.07 0.00 0.00 179.97 179.64 2hwx h LEU 1265N 1.15 0.91 -0.37 3.04 3.38 -0.73 -2.18 115.31 120.52 2hwx h LEU 1265Ca 0.36 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 2hwx h LEU 1265Cb 0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2hwx h LEU 1265CO -0.12 0.85 -0.19 0.25 0.09 0.00 0.00 178.44 179.32 2hwx h LEU 1266N 0.92 0.81 -1.60 1.67 5.85 -0.79 -3.00 115.31 119.16 2hwx h LEU 1266Ca 0.21 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.57 2hwx h LEU 1266Cb 0.24 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2hwx h LEU 1266CO -0.01 1.04 0.34 -0.33 -0.34 0.00 0.00 178.44 179.14 2hwx h GLU 1267N 0.58 0.49 -0.81 1.25 5.08 -1.06 -2.59 114.58 117.51 2hwx h GLU 1267Ca 0.08 -0.03 0.24 0.00 -1.00 0.00 0.00 59.36 58.65 2hwx h GLU 1267Cb 0.74 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2hwx h GLU 1267CO 0.06 0.33 0.59 0.66 -1.00 0.00 0.00 179.01 179.65 2hwx h SER 1268N 0.51 0.00 0.00 1.42 4.64 -1.24 -3.46 113.55 115.42 2hwx h SER 1268Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2hwx h SER 1268Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2hwx h SER 1268CO -0.06 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.44 2hwx n ARG 1269N -4.26 -1.57 0.13 4.77 5.12 -0.98 -4.85 116.66 115.02 2hwx n ARG 1269Ca 0.17 0.39 0.03 0.00 -1.93 0.00 0.00 57.85 56.51 2hwx n ARG 1269Cb 0.89 -4.79 0.02 0.00 -1.16 0.00 0.00 32.46 27.41 2hwx n ARG 1269CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 2hwx h LYS 1270N 0.08 0.00 -6.05 5.56 1.57 -1.85 -3.48 116.57 112.40 2hwx h LYS 1270Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2hwx h LYS 1270Cb 0.78 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.91 2hwx h LYS 1270CO 0.00 0.40 -0.80 0.71 -0.57 0.00 0.00 179.45 179.19 2hwx s TYR 1271N -2.99 1.86 -0.31 -1.35 1.51 -1.26 -4.88 117.35 109.93 2hwx s TYR 1271Ca 0.03 -0.45 -0.13 0.00 -1.01 0.00 0.00 57.07 55.51 2hwx s TYR 1271Cb 0.08 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.95 2hwx s TYR 1271CO 0.75 0.32 0.27 0.42 -1.11 0.00 0.00 175.55 176.20 2hwx s ILE 1272N -1.81 5.25 -0.30 2.71 -1.09 0.32 -4.78 121.20 121.50 2hwx s ILE 1272Ca 0.14 0.10 -0.22 0.00 -2.23 0.00 0.00 60.65 58.43 2hwx s ILE 1272Cb -0.07 -3.67 -0.00 0.00 -1.58 0.00 0.00 42.46 37.14 2hwx s ILE 1272CO 0.06 0.09 0.73 -0.22 -1.23 0.00 0.00 174.94 174.37 2hwx s LEU 1273N 1.85 4.11 -0.34 2.97 2.96 0.10 -0.59 118.68 129.74 2hwx s LEU 1273Ca 0.09 0.59 -0.03 0.00 -0.22 0.00 0.00 54.13 54.56 2hwx s LEU 1273Cb -0.16 -2.98 0.06 0.00 0.50 0.00 0.00 46.19 43.61 2hwx s LEU 1273CO 0.11 -0.55 0.08 -0.69 -1.32 0.00 0.00 176.35 173.97 2hwx s VAL 1274N 2.81 3.29 -0.32 1.68 1.01 0.12 -1.24 120.40 127.75 2hwx s VAL 1274Ca 0.30 -1.45 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 2hwx s VAL 1274Cb -0.14 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 2hwx s VAL 1274CO 0.12 -0.26 0.50 -0.69 0.00 0.00 0.00 175.10 174.77 2hwx s VAL 1275N 1.27 5.05 0.26 2.92 1.01 -0.01 -4.17 120.40 126.73 2hwx s VAL 1275Ca -0.01 0.50 -0.31 0.00 0.00 0.00 0.00 61.98 62.16 2hwx s VAL 1275Cb -0.20 -3.90 -0.13 0.00 0.00 0.00 0.00 36.38 32.15 2hwx s VAL 1275CO -0.01 -0.10 1.49 -2.65 0.00 0.00 0.00 175.10 173.83 2hwx n PRO 1276N 5.64 2.30 -0.36 2.72 -0.02 -1.26 -1.99 135.00 142.03 2hwx n PRO 1276Ca -0.05 0.82 0.06 0.00 -2.02 0.00 0.00 63.50 62.30 2hwx n PRO 1276Cb 0.49 -2.53 0.22 0.00 -0.02 0.00 0.00 33.50 31.67 2hwx n PRO 1276CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2hwx h LEU 1277N 4.51 0.97 -2.03 2.45 5.85 -1.27 -0.09 115.31 125.70 2hwx h LEU 1277Ca -0.46 0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.41 2hwx h LEU 1277Cb 1.25 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 2hwx h LEU 1277CO 0.78 0.55 0.29 -0.29 -0.34 0.00 0.00 178.44 179.43 2hwx h ILE 1278N 1.06 0.72 -0.35 4.05 6.09 -1.89 -1.67 117.51 125.52 2hwx h ILE 1278Ca 0.48 0.00 -0.07 0.00 -1.37 0.00 0.00 64.86 63.90 2hwx h ILE 1278Cb 0.38 0.79 -0.01 0.00 0.47 0.00 0.00 36.82 38.45 2hwx h ILE 1278CO -0.23 0.00 -0.04 0.58 -3.07 0.00 0.00 178.15 175.39 2hwx h VAL 1279N 0.00 1.27 -0.29 2.19 2.07 -1.36 -1.37 116.25 118.77 2hwx h VAL 1279Ca 0.18 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 2hwx h VAL 1279Cb 0.77 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2hwx h VAL 1279CO -0.00 0.35 0.17 0.40 0.02 0.00 0.00 177.57 178.50 2hwx h ILE 1280N 0.45 1.11 -0.78 4.57 2.04 -1.27 -1.28 117.51 122.36 2hwx h ILE 1280Ca 0.10 -0.27 0.09 0.00 1.00 0.00 0.00 64.86 65.78 2hwx h ILE 1280Cb 0.52 0.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 2hwx h ILE 1280CO 0.03 0.11 0.42 0.78 0.00 0.00 0.00 178.15 179.49 2hwx h ASN 1281N 0.36 0.59 -0.70 1.72 2.35 -1.20 0.26 115.58 118.96 2hwx h ASN 1281Ca 0.10 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2hwx h ASN 1281Cb 0.03 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 2hwx h ASN 1281CO -0.02 0.34 0.44 0.00 -1.65 0.00 0.00 177.43 176.54 2hwx h LEU 1283N 0.95 0.94 -0.23 0.00 3.38 -0.64 -1.43 115.31 118.28 2hwx h LEU 1283Ca 0.25 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.96 2hwx h LEU 1283Cb -0.07 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.39 2hwx h LEU 1283CO -0.05 1.02 -0.01 0.44 0.09 0.00 0.00 178.44 179.92 2hwx h ASP 1284N 0.84 -0.12 -0.69 -0.43 3.32 -0.75 -0.76 116.42 117.83 2hwx h ASP 1284Ca 0.16 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 2hwx h ASP 1284Cb 0.53 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.15 2hwx h ASP 1284CO 0.03 -0.03 0.42 1.23 -1.72 0.00 0.00 179.24 179.16 2hwx h GLY 1285N 0.06 0.99 1.11 2.75 0.00 -0.80 -1.38 103.07 105.81 2hwx h GLY 1285Ca 0.11 -0.41 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 2hwx h GLY 1285CO -0.20 0.40 -0.23 1.41 0.00 0.00 0.00 176.54 177.92 2hwx h LEU 1286N 0.93 1.02 -0.65 3.11 3.38 -1.05 -1.87 115.31 120.19 2hwx h LEU 1286Ca 0.25 -0.40 0.06 0.00 0.09 0.00 0.00 57.88 57.87 2hwx h LEU 1286Cb -0.04 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.38 2hwx h LEU 1286CO -0.05 1.20 0.36 0.00 0.09 0.00 0.00 178.44 180.04 2hwx h ALA 1287N 0.86 0.86 -0.09 1.53 0.00 -0.96 -3.22 119.26 118.24 2hwx h ALA 1287Ca 0.11 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2hwx h ALA 1287Cb 0.81 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2hwx h ALA 1287CO 0.07 0.03 -0.19 -0.22 0.00 0.00 0.00 179.25 178.95 2hwx h LYS 1288N 0.66 0.28 -0.50 0.00 3.64 -1.14 -3.47 116.57 116.04 2hwx h LYS 1288Ca 0.29 -0.19 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 2hwx h LYS 1288Cb 0.18 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2hwx h LYS 1288CO -0.18 0.78 -0.09 0.41 -2.27 0.00 0.00 179.45 178.10 2hwx n GLY 1289N 0.45 -1.52 0.45 5.01 0.00 -0.71 -5.10 105.19 103.76 2hwx n GLY 1289Ca -0.07 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.38 2hwx n GLY 1289CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hwx n GLN 1290N -1.79 0.22 0.00 1.61 1.13 -1.26 -4.97 117.38 112.31 2hwx n GLN 1290Ca -0.00 0.08 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 2hwx n GLN 1290Cb 0.10 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 29.47 2hwx n GLN 1290CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2hwx n ALA 1296N -3.21 0.00 -1.51 -1.58 0.00 -1.26 -5.20 120.51 107.75 2hwx n ALA 1296Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.96 2hwx n ALA 1296Cb 0.66 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.27 2hwx n ALA 1296CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2hwx s GLY 1297N 0.00 1.61 0.06 0.00 0.00 -1.26 -4.82 107.32 102.91 2hwx s GLY 1297Ca 0.00 -0.73 -0.24 0.00 0.00 0.00 0.00 44.72 43.75 2hwx s GLY 1297CO 0.00 -0.07 1.60 -1.33 0.00 0.00 0.00 173.10 173.30 2hwx h GLY 1298N -1.74 -0.06 0.96 0.20 0.00 -2.05 -1.60 103.07 98.79 2hwx h GLY 1298Ca -0.48 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 2hwx h GLY 1298CO 0.52 -0.02 0.20 -1.82 0.00 0.00 0.00 176.54 175.42 2hwx h TYR 1299N -0.19 0.51 -0.50 5.60 5.03 -1.99 0.06 116.97 125.49 2hwx h TYR 1299Ca -0.01 -0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.39 2hwx h TYR 1299Cb 0.17 -0.16 -0.08 0.00 1.55 0.00 0.00 36.73 38.21 2hwx h TYR 1299CO -0.03 0.40 0.03 0.00 -1.32 0.00 0.00 178.16 177.24 2hwx h ALA 1300N 1.06 0.50 -0.84 1.82 0.00 -1.92 -0.99 119.26 118.89 2hwx h ALA 1300Ca 0.13 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2hwx h ALA 1300Cb 0.06 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2hwx h ALA 1300CO -0.02 -0.36 0.40 0.00 0.00 0.00 0.00 179.25 179.26 2hwx h ARG 1301N 0.15 1.21 -0.24 0.00 3.08 -0.62 -0.35 114.38 117.62 2hwx h ARG 1301Ca 0.25 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.13 2hwx h ARG 1301Cb 0.37 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2hwx h ARG 1301CO -0.39 0.94 0.13 0.28 -1.07 0.00 0.00 179.97 179.86 2hwx h VAL 1302N 1.20 1.02 -0.69 2.04 2.07 -0.35 -2.53 116.25 119.00 2hwx h VAL 1302Ca 0.29 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.69 2hwx h VAL 1302Cb 0.13 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2hwx h VAL 1302CO -0.04 0.05 0.34 0.58 0.02 0.00 0.00 177.57 178.52 2hwx h VAL 1303N 0.27 1.23 -0.74 2.57 2.07 -0.94 -2.53 116.25 118.18 2hwx h VAL 1303Ca 0.09 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.03 2hwx h VAL 1303Cb 0.01 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 2hwx h VAL 1303CO -0.05 0.27 0.44 -0.61 0.02 0.00 0.00 177.57 177.64 2hwx h GLN 1304N 0.96 0.81 -0.38 1.57 4.15 -0.89 -0.38 115.11 120.96 2hwx h GLN 1304Ca 0.24 -0.05 -0.05 0.00 0.77 0.00 0.00 58.65 59.56 2hwx h GLN 1304Cb 0.11 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 2hwx h GLN 1304CO -0.03 0.53 0.06 1.49 -1.93 0.00 0.00 178.83 178.95 2hwx h GLU 1305N 0.83 0.64 -0.96 1.69 4.57 -1.29 -1.70 114.58 118.35 2hwx h GLU 1305Ca 0.32 -0.17 0.08 0.00 -1.18 0.00 0.00 59.36 58.41 2hwx h GLU 1305Cb 0.13 -0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.58 2hwx h GLU 1305CO -0.16 0.69 0.62 0.87 -1.18 0.00 0.00 179.01 179.86 2hwx h LYS 1306N 0.48 1.03 -0.25 1.92 1.57 -1.00 -0.94 116.57 119.38 2hwx h LYS 1306Ca 0.12 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2hwx h LYS 1306Cb 0.37 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2hwx h LYS 1306CO 0.01 0.68 -0.02 0.00 -0.57 0.00 0.00 179.45 179.55 2hwx h ALA 1307N 1.50 0.33 -0.13 3.86 0.00 -0.89 -2.44 119.26 121.50 2hwx h ALA 1307Ca 0.43 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2hwx h ALA 1307Cb 0.28 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2hwx h ALA 1307CO -0.18 0.09 -0.17 -0.09 0.00 0.00 0.00 179.25 178.89 2hwx h ARG 1308N 0.21 -0.21 -0.87 0.00 2.43 -0.95 -2.00 114.38 112.98 2hwx h ARG 1308Ca 0.07 0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.37 2hwx h ARG 1308Cb 0.45 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.98 2hwx h ARG 1308CO 0.02 -0.14 0.56 0.87 -1.51 0.00 0.00 179.97 179.77 2hwx h LYS 1309N -0.22 0.73 -0.08 0.20 1.57 -1.10 -1.75 116.57 115.92 2hwx h LYS 1309Ca 0.10 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2hwx h LYS 1309Cb 0.36 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2hwx h LYS 1309CO -0.26 0.48 -0.06 0.77 -0.57 0.00 0.00 179.45 179.81 2hwx h SER 1310N 0.75 0.20 -0.42 0.86 0.02 -0.91 -1.66 113.55 112.38 2hwx h SER 1310Ca 0.42 -0.46 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2hwx h SER 1310Cb 0.59 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 2hwx h SER 1310CO -0.19 0.62 0.19 0.40 -1.14 0.00 0.00 176.83 176.71 2hwx h ILE 1311N -0.22 0.94 -0.21 3.27 1.08 -1.04 -1.15 117.51 120.18 2hwx h ILE 1311Ca 0.01 -0.13 0.05 0.00 -0.39 0.00 0.00 64.86 64.40 2hwx h ILE 1311Cb 0.56 0.52 -0.05 0.00 -3.07 0.00 0.00 36.82 34.78 2hwx h ILE 1311CO 0.02 0.07 -0.08 -0.08 -0.69 0.00 0.00 178.15 177.39 2hwx h GLU 1312N 0.39 -0.04 0.01 2.37 4.81 -1.24 0.17 114.58 121.04 2hwx h GLU 1312Ca 0.18 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.44 2hwx h GLU 1312Cb 0.12 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2hwx h GLU 1312CO -0.15 -0.03 -0.53 0.35 -0.73 0.00 0.00 179.01 177.92 2hwx h PHE 1313N -0.04 -1.56 0.04 0.92 3.04 -0.98 -1.64 116.94 116.72 2hwx h PHE 1313Ca 0.11 0.05 0.03 0.00 3.98 0.00 0.00 57.97 62.14 2hwx h PHE 1313Cb 0.21 0.68 -0.04 0.00 2.56 0.00 0.00 35.95 39.36 2hwx h PHE 1313CO -0.25 -0.58 -0.26 -0.07 -2.02 0.00 0.00 178.31 175.13 2hwx h LEU 1314N -0.68 -0.76 -1.01 0.59 3.38 -0.86 -1.58 115.31 114.38 2hwx h LEU 1314Ca 0.01 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.17 2hwx h LEU 1314Cb 0.73 0.30 -0.08 0.00 0.09 0.00 0.00 40.66 41.71 2hwx h LEU 1314CO -0.35 -0.34 0.64 -0.33 0.09 0.00 0.00 178.44 178.15 2hwx h GLU 1315N -0.42 1.06 -0.11 1.13 5.08 -0.92 -0.64 114.58 119.75 2hwx h GLU 1315Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2hwx h GLU 1315Cb 0.49 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2hwx h GLU 1315CO -0.20 0.70 0.01 0.37 -1.00 0.00 0.00 179.01 178.89 2hwx h GLN 1316N 1.09 0.19 -0.30 2.33 -0.00 -0.74 -1.18 115.11 116.50 2hwx h GLN 1316Ca 0.46 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.65 59.05 2hwx h GLN 1316Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 27.48 27.77 2hwx h GLN 1316CO -0.22 0.40 0.13 0.00 0.00 0.00 0.00 178.83 179.14 2hwx h ARG 1317N -0.05 0.45 -0.67 1.69 2.47 -0.82 -1.74 114.38 115.71 2hwx h ARG 1317Ca 0.03 -0.08 -0.04 0.00 -1.26 0.00 0.00 59.98 58.64 2hwx h ARG 1317Cb 0.30 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 2hwx h ARG 1317CO 0.00 0.45 0.26 0.74 0.56 0.00 0.00 179.97 181.98 2hwx h PHE 1318N 0.34 1.03 -0.41 3.04 0.04 -1.12 -2.50 116.94 117.36 2hwx h PHE 1318Ca 0.10 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.77 2hwx h PHE 1318Cb 0.17 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 2hwx h PHE 1318CO -0.01 0.80 0.16 1.49 -0.60 0.00 0.00 178.31 180.16 2hwx h GLU 1319N 0.95 0.58 0.00 1.51 4.81 -0.97 -0.14 114.58 121.33 2hwx h GLU 1319Ca 0.22 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2hwx h GLU 1319Cb 0.22 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2hwx h GLU 1319CO -0.02 0.49 0.00 -1.13 -0.73 0.00 0.00 179.01 177.62 2hwx n SER 1320N -4.37 0.00 -2.50 1.04 3.41 -0.67 -4.92 113.62 105.60 2hwx n SER 1320Ca 0.03 -0.63 -0.16 0.00 -0.26 0.00 0.00 58.87 57.84 2hwx n SER 1320Cb 0.15 -0.11 0.05 0.00 -0.26 0.00 0.00 64.21 64.03 2hwx n SER 1320CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2hwx n ARG 1321N -1.11 -4.89 -1.66 4.33 5.12 -0.06 -4.88 116.66 113.50 2hwx n ARG 1321Ca 0.19 0.59 -0.42 0.00 -1.93 0.00 0.00 57.85 56.28 2hwx n ARG 1321Cb 0.15 -4.87 -0.03 0.00 -1.16 0.00 0.00 32.46 26.55 2hwx n ARG 1321CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2hwx s ASP 1322N -3.09 6.09 0.62 0.55 -1.08 -0.97 -4.84 116.67 113.96 2hwx s ASP 1322Ca 0.35 2.37 0.40 0.00 -0.52 0.00 0.00 52.55 55.15 2hwx s ASP 1322Cb -0.15 -2.52 2.05 0.00 -1.46 0.00 0.00 42.92 40.83 2hwx s ASP 1322CO 0.43 -1.38 2.24 0.77 0.52 0.00 0.00 175.17 177.75 2hwx h SER 1323N 12.19 0.00 -0.56 -0.34 4.64 -1.92 -2.66 113.55 124.90 2hwx h SER 1323Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2hwx h SER 1323Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2hwx h SER 1323CO 0.95 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.92 2hwx s LEU 1325N -1.35 1.94 0.08 0.00 2.96 -1.01 -0.72 118.68 120.59 2hwx s LEU 1325Ca 0.41 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 2hwx s LEU 1325Cb 0.24 -1.23 -0.04 0.00 0.50 0.00 0.00 46.19 45.66 2hwx s LEU 1325CO 0.24 0.11 -0.07 -0.13 -1.32 0.00 0.00 176.35 175.18 2hwx s ARG 1326N 0.52 0.74 0.05 1.98 0.52 -0.37 -4.84 118.95 117.53 2hwx s ARG 1326Ca -0.16 -1.17 0.08 0.00 -0.52 0.00 0.00 55.73 53.97 2hwx s ARG 1326Cb -0.17 -0.22 -0.03 0.00 0.52 0.00 0.00 34.95 35.05 2hwx s ARG 1326CO 0.06 -0.00 -0.22 0.00 0.02 0.00 0.00 175.30 175.15 2hwx s ALA 1327N -2.99 2.43 -0.13 2.13 0.00 -1.10 -0.83 121.76 121.26 2hwx s ALA 1327Ca 0.05 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.80 2hwx s ALA 1327Cb 0.01 -0.60 0.01 0.00 0.00 0.00 0.00 23.12 22.53 2hwx s ALA 1327CO -0.03 0.55 -0.22 -1.17 0.00 0.00 0.00 175.76 174.89 2hwx s LEU 1328N -1.36 2.15 0.84 0.00 2.96 -0.84 0.01 118.68 122.44 2hwx s LEU 1328Ca 0.13 -0.57 -0.11 0.00 -0.22 0.00 0.00 54.13 53.36 2hwx s LEU 1328Cb -0.10 -1.45 0.10 0.00 0.50 0.00 0.00 46.19 45.23 2hwx s LEU 1328CO 0.04 0.10 1.09 0.42 -1.32 0.00 0.00 176.35 176.68 2hwx s THR 1329N 0.68 2.95 0.40 3.68 -4.23 -0.04 -0.72 115.64 118.38 2hwx s THR 1329Ca -0.10 0.31 0.08 0.00 -1.18 0.00 0.00 61.69 60.80 2hwx s THR 1329Cb -0.16 -2.75 0.29 0.00 1.34 0.00 0.00 72.50 71.22 2hwx s THR 1329CO 0.01 -0.40 2.01 0.28 -0.54 0.00 0.00 174.62 175.98 2hwx h SER 1330N -1.38 0.51 0.03 3.99 0.02 -1.97 0.09 113.55 114.84 2hwx h SER 1330Ca -0.46 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2hwx h SER 1330Cb 1.26 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2hwx h SER 1330CO 0.52 0.34 -0.01 0.54 -1.14 0.00 0.00 176.83 177.08 2hwx n ARG 1331N -4.47 1.18 -0.58 3.45 3.00 -1.26 -4.91 116.66 113.07 2hwx n ARG 1331Ca 0.07 -0.31 0.00 0.00 -0.01 0.00 0.00 57.85 57.59 2hwx n ARG 1331Cb 0.17 -1.49 0.00 0.00 0.00 0.00 0.00 32.46 31.14 2hwx n ARG 1331CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hwx n GLY 1332N 1.08 0.67 3.66 -0.13 0.00 0.02 -5.07 105.19 105.41 2hwx n GLY 1332Ca 0.22 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2hwx n GLY 1332CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2hwx s ASN 1333N -2.37 6.78 0.09 1.61 0.01 -1.26 -4.84 114.94 114.96 2hwx s ASN 1333Ca 0.00 0.95 -0.31 0.00 -0.71 0.00 0.00 52.86 52.80 2hwx s ASN 1333Cb 0.00 -2.39 -0.06 0.00 0.41 0.00 0.00 41.25 39.21 2hwx s ASN 1333CO 0.00 -0.35 1.22 -1.61 -1.51 0.00 0.00 177.10 174.85 2hwx s GLU 1334N 2.14 4.43 -0.08 -0.60 2.02 -1.26 -0.86 118.70 124.49 2hwx s GLU 1334Ca 0.32 1.82 0.00 0.00 0.02 0.00 0.00 54.97 57.13 2hwx s GLU 1334Cb -0.16 -3.32 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 2hwx s GLU 1334CO 0.10 -0.25 -0.06 -0.51 0.02 0.00 0.00 175.26 174.57 2hwx s LEU 1335N 0.86 3.22 0.00 1.80 1.43 0.10 -4.98 118.68 121.11 2hwx s LEU 1335Ca 0.58 -0.01 0.16 0.00 -1.03 0.00 0.00 54.13 53.83 2hwx s LEU 1335Cb -0.31 -1.71 -0.06 0.00 0.03 0.00 0.00 46.19 44.14 2hwx s LEU 1335CO 0.30 0.35 0.79 -0.62 0.23 0.00 0.00 176.35 177.40 2hwx n GLU 1336N 2.34 1.74 -4.35 1.70 1.02 -1.26 -2.71 120.64 119.12 2hwx n GLU 1336Ca -0.18 -0.53 -0.18 0.00 -0.02 0.00 0.00 57.16 56.25 2hwx n GLU 1336Cb 0.53 -1.26 -0.15 0.00 -0.02 0.00 0.00 31.44 30.54 2hwx n GLU 1336CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2hwx s SER 1337N -2.11 1.05 -0.15 1.62 0.15 -1.26 -4.90 113.70 108.09 2hwx s SER 1337Ca 0.11 -0.18 0.15 0.00 0.70 0.00 0.00 55.95 56.73 2hwx s SER 1337Cb 0.13 -0.11 0.33 0.00 -1.71 0.00 0.00 66.02 64.66 2hwx s SER 1337CO 0.49 0.10 1.17 2.30 1.20 0.00 0.00 173.24 178.49 2hwx n ILE 1338N 2.79 1.83 -0.25 6.45 -5.35 -1.26 -4.94 119.36 118.63 2hwx n ILE 1338Ca -0.14 -2.47 -0.02 0.00 -0.27 0.00 0.00 62.75 59.86 2hwx n ILE 1338Cb 0.57 -0.15 0.10 0.00 -1.74 0.00 0.00 39.64 38.41 2hwx n ILE 1338CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2hwx h ALA 1339N 0.42 0.95 -3.10 -1.28 0.00 -1.98 -3.36 119.26 110.90 2hwx h ALA 1339Ca -0.01 -0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.41 2hwx h ALA 1339Cb 1.06 -0.18 -0.41 0.00 0.00 0.00 0.00 17.79 18.26 2hwx h ALA 1339CO 0.00 0.15 -0.76 0.12 0.00 0.00 0.00 179.25 178.77 2hwx s PHE 1340N -6.10 0.48 -0.01 0.00 5.36 -1.26 -5.13 117.98 111.31 2hwx s PHE 1340Ca -0.13 -0.53 -0.05 0.00 -0.96 0.00 0.00 56.93 55.26 2hwx s PHE 1340Cb 0.16 -0.82 -0.04 0.00 -0.34 0.00 0.00 43.02 41.98 2hwx s PHE 1340CO 0.77 -0.56 0.22 1.03 -1.46 0.00 0.00 175.22 175.21 2hwx s ARG 1341N 2.04 3.50 -0.13 10.12 0.52 -1.26 -5.05 118.95 128.69 2hwx s ARG 1341Ca 0.02 -0.20 -0.29 0.00 -0.52 0.00 0.00 55.73 54.73 2hwx s ARG 1341Cb -0.16 -3.09 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 2hwx s ARG 1341CO -0.10 0.67 1.48 0.45 0.02 0.00 0.00 175.30 177.81 2hwx s SER 1342N -1.77 6.74 0.21 0.23 0.15 -1.26 -4.99 113.70 113.01 2hwx s SER 1342Ca 0.27 1.88 -0.11 0.00 0.70 0.00 0.00 55.95 58.69 2hwx s SER 1342Cb -0.13 -2.54 -0.07 0.00 -1.71 0.00 0.00 66.02 61.58 2hwx s SER 1342CO 0.16 -0.91 0.55 -1.61 1.20 0.00 0.00 173.24 172.63 2hwx s GLU 1343N 3.92 3.84 0.48 5.44 2.02 -1.26 -5.04 118.70 128.09 2hwx s GLU 1343Ca 0.65 0.32 -0.24 0.00 0.02 0.00 0.00 54.97 55.73 2hwx s GLU 1343Cb -0.27 -2.71 -0.07 0.00 0.10 0.00 0.00 34.13 31.19 2hwx s GLU 1343CO 0.23 0.35 1.32 -0.51 0.02 0.00 0.00 175.26 176.68 2hwx s ASP 1344N -2.22 5.77 0.15 -0.19 1.01 -1.26 -4.93 116.67 115.00 2hwx s ASP 1344Ca 0.45 2.69 -0.17 0.00 0.71 0.00 0.00 52.55 56.23 2hwx s ASP 1344Cb -0.12 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.21 2hwx s ASP 1344CO 0.21 -1.22 1.74 0.40 0.21 0.00 0.00 175.17 176.51 2hwx h ILE 1345N 1.91 0.89 -4.24 0.77 2.04 -2.04 -3.44 117.51 113.40 2hwx h ILE 1345Ca -0.50 -0.07 -0.20 0.00 1.00 0.00 0.00 64.86 65.08 2hwx h ILE 1345Cb 1.27 0.66 -0.15 0.00 -0.74 0.00 0.00 36.82 37.86 2hwx h ILE 1345CO 0.60 0.04 -0.66 0.28 0.00 0.00 0.00 178.15 178.41 2hwx s THR 1346N -6.17 0.26 0.30 -0.27 -1.32 -1.26 -5.13 115.64 102.04 2hwx s THR 1346Ca -0.13 -1.91 -0.28 0.00 -1.21 0.00 0.00 61.69 58.15 2hwx s THR 1346Cb 0.11 -1.99 -0.14 0.00 -1.51 0.00 0.00 72.50 68.98 2hwx s THR 1346CO 0.70 -0.54 1.09 0.61 -2.21 0.00 0.00 174.62 174.27 2hwx n GLY 1347N -0.10 -0.02 0.00 6.08 0.00 -1.26 -5.11 105.19 104.77 2hwx n GLY 1347Ca -0.07 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2hwx n GLY 1347CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hwx n GLN 1348N 0.76 0.00 -0.27 1.61 6.02 -1.26 -5.18 117.38 119.07 2hwx n GLN 1348Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 2hwx n GLN 1348Cb 0.33 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.59 2hwx n GLN 1348CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2hwx n ASN 1351N 0.00 -0.31 -0.72 1.08 3.02 -1.26 -5.15 115.26 111.93 2hwx n ASN 1351Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.62 2hwx n ASN 1351Cb 0.00 -0.08 0.21 0.00 -0.61 0.00 0.00 39.78 39.30 2hwx n ASN 1351CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2hwx n ASN 1352N -0.19 3.41 -0.26 6.41 3.02 -1.26 -4.76 115.26 121.63 2hwx n ASN 1352Ca 0.00 -2.69 0.06 0.00 -0.03 0.00 0.00 54.58 51.93 2hwx n ASN 1352Cb 0.08 -0.42 0.19 0.00 -0.61 0.00 0.00 39.78 39.01 2hwx n ASN 1352CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2hwx h ASP 1353N 1.65 -0.13 -0.89 6.41 3.32 -2.02 -1.54 116.42 123.21 2hwx h ASP 1353Ca 0.00 0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.23 2hwx h ASP 1353Cb 1.16 0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.93 2hwx h ASP 1353CO 0.13 -0.11 0.59 0.44 -1.72 0.00 0.00 179.24 178.57 2hwx h ASP 1354N 0.19 1.02 0.36 6.45 3.32 -1.98 0.30 116.42 126.08 2hwx h ASP 1354Ca 0.43 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 57.22 2hwx h ASP 1354Cb 0.78 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 40.08 2hwx h ASP 1354CO -0.59 0.73 -1.02 -0.07 -1.72 0.00 0.00 179.24 176.57 2hwx h LEU 1355N 1.20 0.56 -0.05 1.55 3.38 -1.73 -0.85 115.31 119.36 2hwx h LEU 1355Ca 0.33 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2hwx h LEU 1355Cb -0.13 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2hwx h LEU 1355CO -0.08 1.29 0.02 0.40 0.09 0.00 0.00 178.44 180.16 2hwx h ILE 1356N 0.21 1.13 -0.63 1.22 2.04 -0.79 -1.00 117.51 119.70 2hwx h ILE 1356Ca -0.10 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.41 2hwx h ILE 1356Cb 1.67 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 39.00 2hwx h ILE 1356CO 0.18 0.11 0.39 -0.07 0.00 0.00 0.00 178.15 178.75 2hwx h LEU 1357N -0.06 0.63 -0.68 1.44 3.38 -0.35 -2.14 115.31 117.53 2hwx h LEU 1357Ca 0.02 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.06 2hwx h LEU 1357Cb 0.15 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 2hwx h LEU 1357CO -0.00 0.43 0.37 0.28 0.09 0.00 0.00 178.44 179.61 2hwx h SER 1358N 0.76 0.52 -0.12 -0.43 0.02 -0.96 -0.62 113.55 112.72 2hwx h SER 1358Ca 0.26 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.29 2hwx h SER 1358Cb 0.04 -0.06 -0.07 0.00 0.14 0.00 0.00 62.40 62.45 2hwx h SER 1358CO -0.11 0.33 -0.45 0.00 -1.14 0.00 0.00 176.83 175.46 2hwx h LEU 1361N 0.38 0.00 -2.07 0.00 3.38 -0.73 -1.60 115.31 114.66 2hwx h LEU 1361Ca 0.30 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.33 2hwx h LEU 1361Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2hwx h LEU 1361CO -0.31 0.16 0.17 -0.74 0.09 0.00 0.00 178.44 177.81 2hwx h HIS 1362N 0.00 0.00 -0.47 1.13 2.76 -0.25 -2.46 115.15 115.86 2hwx h HIS 1362Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2hwx h HIS 1362Cb 0.55 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.51 2hwx h HIS 1362CO 0.00 0.00 0.00 0.66 -1.30 0.00 0.00 177.93 177.29 2hwx n TYR 1363N -4.30 1.20 -3.34 5.26 4.02 -0.60 -4.67 117.16 114.73 2hwx n TYR 1363Ca 0.02 -0.68 -0.46 0.00 -0.01 0.00 0.00 57.90 56.77 2hwx n TYR 1363Cb 0.32 -0.25 -0.03 0.00 -0.02 0.00 0.00 39.34 39.36 2hwx n TYR 1363CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hwx n LYS 1365N 4.26 4.25 -2.62 0.00 4.76 -1.26 -5.00 118.16 122.55 2hwx n LYS 1365Ca 0.07 -3.72 -0.41 0.00 -2.87 0.00 0.00 58.31 51.38 2hwx n LYS 1365Cb 0.45 -2.44 -0.05 0.00 -1.84 0.00 0.00 35.03 31.16 2hwx n LYS 1365CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2hwx s ASP 1366N -0.48 7.42 0.01 4.39 1.01 -1.26 -5.04 116.67 122.72 2hwx s ASP 1366Ca 0.49 2.00 0.02 0.00 0.71 0.00 0.00 52.55 55.77 2hwx s ASP 1366Cb 0.26 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.57 2hwx s ASP 1366CO -0.18 -0.08 -0.07 -0.54 0.21 0.00 0.00 175.17 174.50 2hwx s LYS 1367N -0.57 0.54 0.24 8.23 1.02 -1.26 -5.06 119.74 122.87 2hwx s LYS 1367Ca 0.46 -0.44 -0.05 0.00 0.02 0.00 0.00 55.97 55.96 2hwx s LYS 1367Cb -0.27 -0.45 0.37 0.00 -0.52 0.00 0.00 37.83 36.95 2hwx s LYS 1367CO 0.34 0.11 1.80 0.00 -0.92 0.00 0.00 175.35 176.67 2hwx h ALA 1368N 5.41 1.09 -1.21 5.17 0.00 -1.96 -0.95 119.26 126.80 2hwx h ALA 1368Ca -0.32 0.04 0.42 0.00 0.00 0.00 0.00 54.91 55.05 2hwx h ALA 1368Cb 1.19 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.74 2hwx h ALA 1368CO 0.46 0.04 0.75 0.87 0.00 0.00 0.00 179.25 181.37 2hwx h LYS 1369N 0.71 0.10 0.00 0.00 1.57 -1.97 -2.31 116.57 114.66 2hwx h LYS 1369Ca 0.37 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2hwx h LYS 1369Cb 0.36 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2hwx h LYS 1369CO -0.25 0.06 0.00 -0.25 -0.57 0.00 0.00 179.45 178.44 2hwx n ASP 1370N -4.86 0.00 -3.81 0.86 8.00 -0.36 -3.61 116.55 112.77 2hwx n ASP 1370Ca 0.37 0.16 -0.28 0.00 0.71 0.00 0.00 54.79 55.74 2hwx n ASP 1370Cb 1.34 -0.35 -0.12 0.00 -0.02 0.00 0.00 41.12 41.98 2hwx n ASP 1370CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2hwx s PHE 1371N -2.70 3.17 -1.06 1.24 0.40 -0.87 -4.97 117.98 113.19 2hwx s PHE 1371Ca 0.16 -3.18 -0.05 0.00 -0.60 0.00 0.00 56.93 53.26 2hwx s PHE 1371Cb 0.13 -2.41 0.01 0.00 0.51 0.00 0.00 43.02 41.26 2hwx s PHE 1371CO 0.32 -0.59 0.68 -1.33 0.70 0.00 0.00 175.22 174.99 2hwx n MET 1372N 2.10 -4.82 0.00 0.44 2.81 -1.24 -5.00 117.12 111.41 2hwx n MET 1372Ca 0.22 0.63 0.00 0.00 -1.81 0.00 0.00 57.70 56.74 2hwx n MET 1372Cb 0.37 -4.99 0.00 0.00 -0.71 0.00 0.00 33.22 27.90 2hwx n MET 1372CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 2hwx n ILE 1380N -4.26 0.00 -4.40 2.02 0.13 -1.26 -4.59 119.36 107.00 2hwx n ILE 1380Ca -0.03 0.00 -0.25 0.00 -1.10 0.00 0.00 62.75 61.37 2hwx n ILE 1380Cb 0.56 0.00 -0.09 0.00 -0.84 0.00 0.00 39.64 39.27 2hwx n ILE 1380CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 2hwx s ARG 1381N 0.00 1.98 -0.40 9.51 0.52 -1.26 -4.78 118.95 124.52 2hwx s ARG 1381Ca 0.00 -1.78 -0.19 0.00 -0.52 0.00 0.00 55.73 53.23 2hwx s ARG 1381Cb 0.00 -1.87 0.01 0.00 0.52 0.00 0.00 34.95 33.62 2hwx s ARG 1381CO 0.00 0.17 0.57 -1.17 0.02 0.00 0.00 175.30 174.89 2hwx s LEU 1382N -3.67 4.49 0.11 2.53 2.96 0.12 -4.76 118.68 120.46 2hwx s LEU 1382Ca 0.34 -0.25 -0.31 0.00 -0.22 0.00 0.00 54.13 53.68 2hwx s LEU 1382Cb -0.00 -2.64 -0.10 0.00 0.50 0.00 0.00 46.19 43.95 2hwx s LEU 1382CO 0.18 -0.64 1.83 -0.22 -1.32 0.00 0.00 176.35 176.18 2hwx s LEU 1383N 2.57 4.40 -0.12 -0.68 2.96 -1.26 -0.77 118.68 125.79 2hwx s LEU 1383Ca 0.20 2.73 0.00 0.00 -0.22 0.00 0.00 54.13 56.84 2hwx s LEU 1383Cb -0.15 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.00 2hwx s LEU 1383CO 0.16 -1.00 -0.10 -0.13 -1.32 0.00 0.00 176.35 173.95 2hwx s ARG 1384N 2.91 1.82 -0.01 1.98 1.81 -0.43 -4.92 118.95 122.10 2hwx s ARG 1384Ca 0.81 -0.38 0.11 0.00 -1.72 0.00 0.00 55.73 54.56 2hwx s ARG 1384Cb -0.45 -1.75 0.32 0.00 -0.45 0.00 0.00 34.95 32.61 2hwx s ARG 1384CO 0.37 -0.23 1.26 0.39 -0.68 0.00 0.00 175.30 176.41 2hwx n GLU 1385N 4.78 2.88 -5.00 3.54 1.02 -1.26 -1.28 120.64 125.32 2hwx n GLU 1385Ca -0.15 -2.10 -0.31 0.00 -0.02 0.00 0.00 57.16 54.59 2hwx n GLU 1385Cb 0.50 -1.30 -0.15 0.00 -0.02 0.00 0.00 31.44 30.47 2hwx n GLU 1385CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2hwx s VAL 1386N -1.11 2.27 -0.05 2.62 0.11 -1.26 -1.14 120.40 121.83 2hwx s VAL 1386Ca 0.24 -1.22 0.01 0.00 -2.93 0.00 0.00 61.98 58.08 2hwx s VAL 1386Cb 0.13 -1.86 0.02 0.00 -1.53 0.00 0.00 36.38 33.14 2hwx s VAL 1386CO 0.15 0.45 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.62 2hwx s VAL 1387N -0.75 0.65 -0.08 2.04 1.01 0.08 -4.24 120.40 119.11 2hwx s VAL 1387Ca 0.12 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.62 2hwx s VAL 1387Cb -0.10 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.60 2hwx s VAL 1387CO 0.01 0.25 1.00 -0.22 0.00 0.00 0.00 175.10 176.15 2hwx s LEU 1388N 0.95 4.27 -0.35 3.92 2.96 -0.51 -1.62 118.68 128.31 2hwx s LEU 1388Ca -0.10 1.56 -0.11 0.00 -0.22 0.00 0.00 54.13 55.25 2hwx s LEU 1388Cb -0.14 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 42.99 2hwx s LEU 1388CO 0.00 -0.41 0.20 -0.76 -1.32 0.00 0.00 176.35 174.07 2hwx s LEU 1389N 1.81 4.50 -0.07 -0.68 1.43 0.29 -1.80 118.68 124.15 2hwx s LEU 1389Ca 0.49 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 2hwx s LEU 1389Cb -0.19 -2.05 0.07 0.00 0.03 0.00 0.00 46.19 44.05 2hwx s LEU 1389CO 0.20 -0.29 0.68 0.28 0.23 0.00 0.00 176.35 177.45 2hwx s THR 1390N 1.62 0.00 -0.87 5.49 -1.32 -0.95 -3.39 115.64 116.22 2hwx s THR 1390Ca 0.04 -0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.76 2hwx s THR 1390Cb -0.18 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.74 2hwx s THR 1390CO 0.08 -0.00 1.20 0.47 -2.21 0.00 0.00 174.62 174.16 2hwx n ASP 1391N 1.09 0.64 -4.63 8.08 8.00 -1.26 -3.31 116.55 125.17 2hwx n ASP 1391Ca -0.18 -0.36 -0.43 0.00 0.71 0.00 0.00 54.79 54.52 2hwx n ASP 1391Cb 0.57 0.54 -0.02 0.00 -0.02 0.00 0.00 41.12 42.18 2hwx n ASP 1391CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2hwx s ASP 1392N -3.32 6.47 0.21 -2.24 -1.08 -1.26 -4.92 116.67 110.53 2hwx s ASP 1392Ca 0.08 1.55 -0.10 0.00 -0.52 0.00 0.00 52.55 53.56 2hwx s ASP 1392Cb 0.16 -2.53 0.16 0.00 -1.46 0.00 0.00 42.92 39.25 2hwx s ASP 1392CO 0.76 -1.19 1.87 0.03 0.52 0.00 0.00 175.17 177.17 2hwx h ARG 1393N 10.28 1.03 -0.10 4.34 2.47 -1.99 -0.64 114.38 129.77 2hwx h ARG 1393Ca -0.32 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.30 2hwx h ARG 1393Cb 1.14 -0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 29.23 2hwx h ARG 1393CO 1.01 0.70 -0.06 -0.91 0.56 0.00 0.00 179.97 181.27 2hwx h ASN 1394N 1.05 0.23 -0.58 7.04 2.35 -2.00 -2.49 115.58 121.19 2hwx h ASN 1394Ca 0.28 -0.42 0.12 0.00 -0.55 0.00 0.00 56.30 55.73 2hwx h ASN 1394Cb -0.09 -0.06 -0.10 0.00 0.05 0.00 0.00 38.32 38.12 2hwx h ASN 1394CO -0.06 0.60 0.01 0.25 -1.65 0.00 0.00 177.43 176.59 2hwx h LEU 1395N -0.14 -0.23 -0.54 1.61 5.85 -1.96 -1.98 115.31 117.91 2hwx h LEU 1395Ca 0.02 0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.99 2hwx h LEU 1395Cb 0.52 0.24 -0.11 0.00 0.37 0.00 0.00 40.66 41.68 2hwx h LEU 1395CO 0.02 -0.09 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.71 2hwx h ARG 1396N 0.13 -0.10 -0.12 1.25 2.43 -1.02 -0.27 114.38 116.68 2hwx h ARG 1396Ca 0.30 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.52 2hwx h ARG 1396Cb 0.47 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.99 2hwx h ARG 1396CO -0.48 -0.06 -0.23 0.28 -1.51 0.00 0.00 179.97 177.96 2hwx h VAL 1397N -0.10 0.44 -0.36 0.20 2.07 -0.97 -0.58 116.25 116.94 2hwx h VAL 1397Ca 0.25 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.81 2hwx h VAL 1397Cb 0.49 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2hwx h VAL 1397CO -0.61 0.00 0.14 0.11 0.02 0.00 0.00 177.57 177.23 2hwx h LYS 1398N -0.29 0.29 -0.15 1.57 1.57 -0.75 -1.26 116.57 117.54 2hwx h LYS 1398Ca 0.10 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 2hwx h LYS 1398Cb 0.44 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 2hwx h LYS 1398CO -0.29 0.19 -0.06 0.00 -0.57 0.00 0.00 179.45 178.72 2hwx h ALA 1399N 1.22 0.08 -0.71 3.86 0.00 -0.64 -2.58 119.26 120.49 2hwx h ALA 1399Ca 0.16 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2hwx h ALA 1399Cb 0.12 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2hwx h ALA 1399CO -0.15 -0.50 0.29 -0.07 0.00 0.00 0.00 179.25 178.82 2hwx h LEU 1400N -0.03 0.98 -0.22 0.00 3.38 -0.47 -0.27 115.31 118.68 2hwx h LEU 1400Ca 0.08 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2hwx h LEU 1400Cb 0.15 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2hwx h LEU 1400CO -0.18 0.88 0.00 0.35 0.09 0.00 0.00 178.44 179.59 2hwx n THR 1401N -4.36 0.85 -0.13 0.22 -2.24 -0.54 -1.71 114.28 106.36 2hwx n THR 1401Ca 0.06 0.20 0.12 0.00 -2.27 0.00 0.00 64.05 62.15 2hwx n THR 1401Cb 0.17 -0.99 0.28 0.00 -2.10 0.00 0.00 70.33 67.70 2hwx n THR 1401CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2hwx n ARG 1402N -1.76 2.65 -3.23 -0.78 1.74 -0.21 -4.96 116.66 110.11 2hwx n ARG 1402Ca 0.03 -2.53 -0.21 0.00 -0.77 0.00 0.00 57.85 54.37 2hwx n ARG 1402Cb 0.21 -1.55 0.05 0.00 -1.02 0.00 0.00 32.46 30.16 2hwx n ARG 1402CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2hwx n ASN 1403N 1.59 -5.88 -4.32 0.55 3.02 -0.69 -5.00 115.26 104.52 2hwx n ASN 1403Ca 0.23 -0.38 -0.37 0.00 -0.03 0.00 0.00 54.58 54.03 2hwx n ASN 1403Cb 0.62 -4.60 -0.13 0.00 -0.61 0.00 0.00 39.78 35.06 2hwx n ASN 1403CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2hwx s VAL 1404N -3.21 3.80 0.62 2.41 1.01 -0.64 -5.02 120.40 119.37 2hwx s VAL 1404Ca 0.41 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 2hwx s VAL 1404Cb -0.18 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2hwx s VAL 1404CO 0.51 0.09 0.80 -2.65 0.00 0.00 0.00 175.10 173.84 2hwx n PRO 1405N 4.84 0.67 -3.86 2.72 -0.02 -1.26 -3.71 135.00 134.38 2hwx n PRO 1405Ca -0.15 0.27 -0.12 0.00 -2.02 0.00 0.00 63.50 61.48 2hwx n PRO 1405Cb 0.48 -2.01 -0.13 0.00 -0.02 0.00 0.00 33.50 31.82 2hwx n PRO 1405CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2hwx s VAL 1406N -1.65 0.01 0.02 -1.45 1.01 -1.26 -1.43 120.40 115.66 2hwx s VAL 1406Ca 0.73 -0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.64 2hwx s VAL 1406Cb -0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 2hwx s VAL 1406CO 0.50 -0.04 -0.02 -0.13 0.00 0.00 0.00 175.10 175.41 2hwx s ARG 1407N -0.08 0.32 0.70 2.72 1.81 -0.74 -4.95 118.95 118.73 2hwx s ARG 1407Ca -0.01 -0.61 -0.16 0.00 -1.72 0.00 0.00 55.73 53.23 2hwx s ARG 1407Cb -0.01 0.11 0.02 0.00 -0.45 0.00 0.00 34.95 34.63 2hwx s ARG 1407CO 0.00 -0.05 1.22 0.16 -0.68 0.00 0.00 175.30 175.95 2hwx s ASP 1408N -1.48 4.36 0.15 0.23 -4.77 -1.21 -2.25 116.67 111.71 2hwx s ASP 1408Ca -0.16 2.40 -0.16 0.00 -3.30 0.00 0.00 52.55 51.33 2hwx s ASP 1408Cb -0.10 -2.59 0.03 0.00 -1.09 0.00 0.00 42.92 39.17 2hwx s ASP 1408CO -0.01 -2.16 1.80 0.40 0.70 0.00 0.00 175.17 175.90 2hwx h ILE 1409N -0.05 1.05 -0.47 2.11 2.04 -1.92 -0.28 117.51 119.99 2hwx h ILE 1409Ca -0.48 -0.16 0.07 0.00 1.00 0.00 0.00 64.86 65.29 2hwx h ILE 1409Cb 1.30 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 37.86 2hwx h ILE 1409CO 0.51 0.09 0.12 -0.65 0.00 0.00 0.00 178.15 178.21 2hwx h PRO 1410N 0.48 0.25 -0.39 2.37 0.11 -1.99 0.78 132.00 133.62 2hwx h PRO 1410Ca 0.15 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 2hwx h PRO 1410Cb -0.01 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 2hwx h PRO 1410CO -0.06 0.17 0.20 0.00 -0.21 0.00 0.00 178.00 178.10 2hwx h ALA 1411N 1.35 0.50 -0.35 -0.75 0.00 -1.88 -1.36 119.26 116.76 2hwx h ALA 1411Ca 0.23 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2hwx h ALA 1411Cb 0.29 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2hwx h ALA 1411CO -0.28 0.04 0.20 0.35 0.00 0.00 0.00 179.25 179.55 2hwx h PHE 1412N 0.49 0.48 -0.28 0.00 3.57 -0.46 -1.43 116.94 119.31 2hwx h PHE 1412Ca 0.13 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.65 2hwx h PHE 1412Cb 0.08 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 2hwx h PHE 1412CO -0.02 0.36 0.13 1.25 -2.23 0.00 0.00 178.31 177.80 2hwx h LEU 1413N 0.45 0.19 -0.28 0.59 5.85 -0.55 -0.16 115.31 121.40 2hwx h LEU 1413Ca 0.13 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.92 2hwx h LEU 1413Cb 0.04 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2hwx h LEU 1413CO -0.02 0.14 -0.08 0.74 -0.34 0.00 0.00 178.44 178.88 2hwx h THR 1414N 0.28 0.70 -0.74 1.05 2.02 -1.14 -2.52 112.91 112.56 2hwx h THR 1414Ca 0.12 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.36 2hwx h THR 1414Cb 0.05 0.70 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 2hwx h THR 1414CO -0.09 0.00 0.43 -0.25 0.37 0.00 0.00 175.52 175.98 2hwx h TRP 1415N -0.01 0.79 0.00 3.16 7.01 -0.68 -2.83 115.95 123.38 2hwx h TRP 1415Ca 0.14 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 2hwx h TRP 1415Cb 0.22 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2hwx h TRP 1415CO -0.28 0.37 -0.01 0.00 -2.79 0.00 0.00 178.44 175.73 2hwx h ALA 1416N 1.38 1.18 0.00 2.65 0.00 -0.59 -3.51 119.26 120.37 2hwx h ALA 1416Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2hwx h ALA 1416Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2hwx h ALA 1416CO -0.19 0.02 0.00 1.04 0.00 0.00 0.00 179.25 180.11