#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xpx n SER 1246N 0.00 2.27 -4.73 -3.46 3.41 -1.26 -0.69 113.62 109.16 1xpx n SER 1246Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 1xpx n SER 1246Cb 0.00 1.25 -0.08 0.00 -0.26 0.00 0.00 64.21 65.13 1xpx n SER 1246CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xpx s THR 1247N -2.62 4.37 -0.32 6.66 -4.23 -1.26 -4.74 115.64 113.51 1xpx s THR 1247Ca -0.05 -0.62 -0.29 0.00 -1.18 0.00 0.00 61.69 59.55 1xpx s THR 1247Cb 0.06 -3.01 0.01 0.00 1.34 0.00 0.00 72.50 70.90 1xpx s THR 1247CO 0.48 0.29 1.25 -0.76 -0.54 0.00 0.00 174.62 175.34 1xpx s LEU 1248N -1.85 3.87 0.56 4.79 1.43 -1.26 -5.02 118.68 121.20 1xpx s LEU 1248Ca 0.23 1.12 -0.07 0.00 -1.03 0.00 0.00 54.13 54.38 1xpx s LEU 1248Cb -0.12 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.54 1xpx s LEU 1248CO 0.14 -1.06 0.89 0.42 0.23 0.00 0.00 176.35 176.97 1xpx s THR 1249N 4.27 4.33 -0.35 5.49 -4.23 -1.26 -4.93 115.64 118.95 1xpx s THR 1249Ca 0.54 0.27 0.14 0.00 -1.18 0.00 0.00 61.69 61.46 1xpx s THR 1249Cb -0.15 -3.69 0.14 0.00 1.34 0.00 0.00 72.50 70.13 1xpx s THR 1249CO 0.22 -0.75 1.39 -2.65 -0.54 0.00 0.00 174.62 172.29 1xpx n PRO 1250N -2.51 0.09 0.08 3.99 -0.02 -1.26 -0.53 135.00 134.83 1xpx n PRO 1250Ca 0.03 0.57 -0.21 0.00 -2.02 0.00 0.00 63.50 61.88 1xpx n PRO 1250Cb 0.56 -1.87 -0.15 0.00 -0.02 0.00 0.00 33.50 32.02 1xpx n PRO 1250CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1xpx h MET 1251N 0.00 0.36 -0.97 -0.52 2.86 -1.97 -2.69 114.93 112.00 1xpx h MET 1251Ca 0.00 -0.61 0.13 0.00 -2.06 0.00 0.00 59.70 57.16 1xpx h MET 1251Cb 0.14 0.23 -0.08 0.00 0.06 0.00 0.00 31.60 31.95 1xpx h MET 1251CO 0.00 1.25 0.61 0.45 1.06 0.00 0.00 176.91 180.29 1xpx h HIS 1252N 0.10 1.03 0.11 -0.22 3.86 -1.17 0.54 115.15 119.39 1xpx h HIS 1252Ca -0.29 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 58.94 1xpx h HIS 1252Cb 2.08 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 30.22 1xpx h HIS 1252CO 0.09 0.38 -0.05 1.25 0.86 0.00 0.00 177.93 180.46 1xpx h LEU 1253N 0.87 -0.12 -1.15 2.43 5.85 -1.55 0.15 115.31 121.79 1xpx h LEU 1253Ca 0.49 -0.39 0.26 0.00 0.84 0.00 0.00 57.88 59.07 1xpx h LEU 1253Cb 0.60 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 41.55 1xpx h LEU 1253CO -0.25 0.37 0.63 -0.09 -0.34 0.00 0.00 178.44 178.75 1xpx h ARG 1254N -0.66 0.49 0.08 1.25 2.43 -0.88 0.14 114.38 117.23 1xpx h ARG 1254Ca -0.02 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1xpx h ARG 1254Cb 0.51 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1xpx h ARG 1254CO 0.02 0.32 -0.04 -0.22 -1.51 0.00 0.00 179.97 178.55 1xpx h LYS 1255N 0.50 -0.11 -0.52 0.20 3.64 0.23 -3.06 116.57 117.45 1xpx h LYS 1255Ca 0.63 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 60.11 1xpx h LYS 1255Cb 1.36 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.13 1xpx h LYS 1255CO -0.41 0.31 0.09 0.00 -2.27 0.00 0.00 179.45 177.17 1xpx h ALA 1256N 0.29 0.58 -0.87 5.00 0.00 0.18 -0.17 119.26 124.28 1xpx h ALA 1256Ca -0.01 0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.13 1xpx h ALA 1256Cb 0.47 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 1xpx h ALA 1256CO 0.02 -0.32 0.50 0.87 0.00 0.00 0.00 179.25 180.32 1xpx h LYS 1257N 0.22 0.77 -0.22 0.00 1.57 -0.95 -1.95 116.57 116.01 1xpx h LYS 1257Ca 0.27 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 1xpx h LYS 1257Cb 0.37 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1xpx h LYS 1257CO -0.36 0.51 0.12 -0.07 -0.57 0.00 0.00 179.45 179.08 1xpx h LEU 1258N 0.80 0.28 -1.78 2.94 3.38 -0.95 -2.21 115.31 117.77 1xpx h LEU 1258Ca 0.43 -0.09 0.23 0.00 0.09 0.00 0.00 57.88 58.54 1xpx h LEU 1258Cb 0.46 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1xpx h LEU 1258CO -0.28 0.30 0.61 0.24 0.09 0.00 0.00 178.44 179.39 1xpx h MET 1259N 0.25 0.17 0.00 1.13 2.86 -0.58 -0.52 114.93 118.24 1xpx h MET 1259Ca 0.08 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1xpx h MET 1259Cb 0.08 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1xpx h MET 1259CO -0.01 0.11 0.23 0.35 1.06 0.00 0.00 176.91 178.65 1xpx h PHE 1260N 0.17 0.00 0.00 -0.22 3.57 -1.01 0.56 116.94 120.01 1xpx h PHE 1260Ca 0.43 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.89 1xpx h PHE 1260Cb 1.43 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.17 1xpx h PHE 1260CO -0.00 0.00 -0.23 0.74 -2.23 0.00 0.00 178.31 176.59 1xpx h PHE 1261N 0.00 0.00 0.00 0.41 0.05 -1.23 -3.22 116.94 112.95 1xpx h PHE 1261Ca 0.00 0.00 -0.29 0.00 3.82 0.00 0.00 57.97 61.50 1xpx h PHE 1261Cb 0.46 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.35 1xpx h PHE 1261CO 0.00 0.23 -2.10 0.91 -0.18 0.00 0.00 178.31 177.17 1xpx n TRP 1262N -3.85 0.00 -3.76 -0.55 8.01 0.18 -4.17 117.44 113.30 1xpx n TRP 1262Ca -0.02 0.00 -0.16 0.00 -1.31 0.00 0.00 57.50 56.01 1xpx n TRP 1262Cb 0.32 -0.79 -0.16 0.00 -2.01 0.00 0.00 31.31 28.67 1xpx n TRP 1262CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.69 176.82 1xpx s VAL 1263N -2.41 -0.04 -0.19 -0.99 -7.23 -0.62 0.77 120.40 109.69 1xpx s VAL 1263Ca -0.08 0.25 0.08 0.00 -1.81 0.00 0.00 61.98 60.42 1xpx s VAL 1263Cb 0.05 -0.12 -0.22 0.00 0.56 0.00 0.00 36.38 36.65 1xpx s VAL 1263CO 0.66 0.12 0.09 0.54 -0.31 0.00 0.00 175.10 176.20 1xpx n ARG 1264N 4.45 0.68 -3.02 4.82 3.00 -1.26 -4.15 116.66 121.18 1xpx n ARG 1264Ca -0.22 0.13 -0.27 0.00 -0.01 0.00 0.00 57.85 57.49 1xpx n ARG 1264Cb 0.50 -1.59 -0.05 0.00 0.00 0.00 0.00 32.46 31.33 1xpx n ARG 1264CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1xpx n TYR 1265N -3.08 3.77 -2.12 -1.55 4.02 -1.26 -4.88 117.16 112.06 1xpx n TYR 1265Ca -0.35 -4.01 -0.41 0.00 -0.01 0.00 0.00 57.90 53.11 1xpx n TYR 1265Cb 1.07 -0.50 -0.03 0.00 -0.02 0.00 0.00 39.34 39.86 1xpx n TYR 1265CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1xpx s PRO 1266N -3.26 4.32 0.43 -0.72 0.04 -1.26 -4.98 135.00 129.56 1xpx s PRO 1266Ca 0.47 2.17 -0.24 0.00 0.04 0.00 0.00 61.00 63.43 1xpx s PRO 1266Cb 0.26 -3.17 -0.08 0.00 0.04 0.00 0.00 34.50 31.55 1xpx s PRO 1266CO -0.12 -0.36 1.18 -1.54 0.04 0.00 0.00 177.00 176.19 1xpx s SER 1267N 0.51 6.36 0.57 6.66 1.04 -1.26 -4.84 113.70 122.74 1xpx s SER 1267Ca 0.60 2.35 0.25 0.00 0.48 0.00 0.00 55.95 59.63 1xpx s SER 1267Cb -0.39 -2.61 1.57 0.00 0.10 0.00 0.00 66.02 64.69 1xpx s SER 1267CO 0.38 -0.79 2.14 0.77 0.98 0.00 0.00 173.24 176.72 1xpx h SER 1268N 2.39 0.00 -0.34 7.02 4.64 -1.99 0.18 113.55 125.44 1xpx h SER 1268Ca -0.49 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1xpx h SER 1268Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1xpx h SER 1268CO 0.61 0.00 0.22 0.00 -0.87 0.00 0.00 176.83 176.80 1xpx h ALA 1269N 1.88 0.43 -0.14 5.18 0.00 -2.02 -2.65 119.26 121.94 1xpx h ALA 1269Ca 0.07 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 1xpx h ALA 1269Cb 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1xpx h ALA 1269CO -0.00 -0.11 -0.72 0.28 0.00 0.00 0.00 179.25 178.70 1xpx h VAL 1270N 0.45 1.32 -0.54 0.00 2.07 -1.08 -3.25 116.25 115.23 1xpx h VAL 1270Ca 0.13 -2.00 0.07 0.00 0.82 0.00 0.00 66.70 65.72 1xpx h VAL 1270Cb -0.04 1.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.65 1xpx h VAL 1270CO -0.04 0.62 0.21 -0.07 0.02 0.00 0.00 177.57 178.32 1xpx h LEU 1271N 0.44 0.24 0.20 2.57 3.38 -0.95 -2.04 115.31 119.15 1xpx h LEU 1271Ca -0.03 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1xpx h LEU 1271Cb 1.32 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 1xpx h LEU 1271CO 0.14 0.16 -0.36 0.11 0.09 0.00 0.00 178.44 178.59 1xpx h LYS 1272N 0.41 -0.61 -1.00 1.13 1.57 -1.52 -1.90 116.57 114.65 1xpx h LYS 1272Ca 0.26 0.04 0.35 0.00 -1.87 0.00 0.00 60.65 59.43 1xpx h LYS 1272Cb 0.26 0.14 -0.16 0.00 0.08 0.00 0.00 32.23 32.55 1xpx h LYS 1272CO -0.24 -0.41 0.55 0.52 -0.57 0.00 0.00 179.45 179.30 1xpx h MET 1273N -0.64 0.22 -0.04 3.15 2.86 -1.41 1.08 114.93 120.15 1xpx h MET 1273Ca 0.01 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xpx h MET 1273Cb 0.63 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.24 1xpx h MET 1273CO -0.16 0.14 0.00 0.66 1.06 0.00 0.00 176.91 178.61 1xpx n TYR 1274N -5.12 0.05 -2.60 -0.22 4.02 -0.74 -3.88 117.16 108.67 1xpx n TYR 1274Ca 0.33 -0.02 -0.17 0.00 -0.01 0.00 0.00 57.90 58.03 1xpx n TYR 1274Cb 1.06 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.40 1xpx n TYR 1274CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1xpx n PHE 1275N -0.41 2.10 0.32 -0.72 3.01 0.37 -4.61 117.46 117.52 1xpx n PHE 1275Ca 0.18 -2.95 0.15 0.00 1.01 0.00 0.00 57.45 55.84 1xpx n PHE 1275Cb 0.19 -0.26 0.79 0.00 -0.01 0.00 0.00 39.48 40.19 1xpx n PHE 1275CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1xpx h PRO 1276N 2.83 0.00 0.00 -1.08 0.11 -1.66 0.30 132.00 132.50 1xpx h PRO 1276Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1xpx h PRO 1276Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1xpx h PRO 1276CO 0.65 0.00 -0.13 -0.40 -0.21 0.00 0.00 178.00 177.91 1xpx n ASP 1277N -2.82 0.28 -4.62 -2.05 5.75 -1.26 -4.78 116.55 107.06 1xpx n ASP 1277Ca -0.02 0.36 -0.34 0.00 -0.01 0.00 0.00 54.79 54.78 1xpx n ASP 1277Cb 0.37 -0.38 -0.10 0.00 -1.03 0.00 0.00 41.12 39.97 1xpx n ASP 1277CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1xpx s ILE 1278N -3.03 4.53 -0.60 2.12 1.09 0.10 -2.56 121.20 122.85 1xpx s ILE 1278Ca 0.12 -0.13 -0.19 0.00 -1.10 0.00 0.00 60.65 59.35 1xpx s ILE 1278Cb 0.17 -3.01 0.11 0.00 -1.06 0.00 0.00 42.46 38.67 1xpx s ILE 1278CO 0.58 0.50 0.70 -1.59 -0.10 0.00 0.00 174.94 175.03 1xpx s LYS 1279N 0.12 3.05 1.04 2.79 -2.85 0.14 -4.99 119.74 119.05 1xpx s LYS 1279Ca 0.03 -1.37 -0.13 0.00 -1.00 0.00 0.00 55.97 53.50 1xpx s LYS 1279Cb -0.13 -4.28 0.21 0.00 -2.06 0.00 0.00 37.83 31.57 1xpx s LYS 1279CO 0.01 -1.53 1.09 -0.06 0.10 0.00 0.00 175.35 174.96 1xpx s PHE 1280N 2.59 1.86 -0.12 1.78 0.40 -1.26 -4.67 117.98 118.56 1xpx s PHE 1280Ca 0.11 0.90 -0.33 0.00 -0.60 0.00 0.00 56.93 57.01 1xpx s PHE 1280Cb -0.24 -3.29 0.13 0.00 0.51 0.00 0.00 43.02 40.12 1xpx s PHE 1280CO 0.06 -3.10 1.22 0.54 0.70 0.00 0.00 175.22 174.64 1xpx s ASN 1281N -3.50 -0.12 0.14 1.36 2.20 -1.26 -5.01 114.94 108.75 1xpx s ASN 1281Ca 0.66 -0.06 -0.01 0.00 -0.94 0.00 0.00 52.86 52.51 1xpx s ASN 1281Cb -0.18 0.16 0.28 0.00 -2.00 0.00 0.00 41.25 39.52 1xpx s ASN 1281CO 0.58 -0.28 0.72 0.29 -2.94 0.00 0.00 177.10 175.46 1xpx n LYS 1282N -0.24 -0.04 0.00 3.55 4.01 -1.26 -2.26 118.16 121.92 1xpx n LYS 1282Ca -0.03 0.70 0.00 0.00 -0.51 0.00 0.00 58.31 58.47 1xpx n LYS 1282Cb 0.60 -1.08 0.00 0.00 -0.51 0.00 0.00 35.03 34.04 1xpx n LYS 1282CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1xpx n ASN 1283N -4.62 0.00 -0.50 4.39 3.02 -1.26 -1.97 115.26 114.32 1xpx n ASN 1283Ca 0.09 0.21 0.41 0.00 -0.03 0.00 0.00 54.58 55.26 1xpx n ASN 1283Cb 0.29 0.00 0.67 0.00 -0.61 0.00 0.00 39.78 40.14 1xpx n ASN 1283CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1xpx n ASN 1284N -0.33 0.15 -0.03 6.41 0.23 -1.17 0.25 115.26 120.78 1xpx n ASN 1284Ca 0.00 1.23 -0.12 0.00 -0.53 0.00 0.00 54.58 55.16 1xpx n ASN 1284Cb 0.00 -0.61 -0.07 0.00 -2.08 0.00 0.00 39.78 37.02 1xpx n ASN 1284CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1xpx h THR 1285N 0.00 1.27 -0.77 5.53 2.02 -1.55 0.49 112.91 119.90 1xpx h THR 1285Ca 0.85 -0.85 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1xpx h THR 1285Cb 2.90 1.66 -0.05 0.00 -1.74 0.00 0.00 68.15 70.91 1xpx h THR 1285CO -0.35 0.24 0.47 0.00 0.37 0.00 0.00 175.52 176.25 1xpx h ALA 1286N 0.71 1.03 0.25 6.16 0.00 0.39 -0.46 119.26 127.35 1xpx h ALA 1286Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xpx h ALA 1286Cb 0.38 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xpx h ALA 1286CO 0.01 0.21 -0.12 0.37 0.00 0.00 0.00 179.25 179.72 1xpx h GLN 1287N 0.87 -0.32 -0.77 0.00 4.15 -0.32 0.41 115.11 119.13 1xpx h GLN 1287Ca 0.33 0.02 0.12 0.00 0.77 0.00 0.00 58.65 59.89 1xpx h GLN 1287Cb 0.12 0.07 -0.08 0.00 0.21 0.00 0.00 27.48 27.80 1xpx h GLN 1287CO -0.15 -0.07 0.38 1.25 -1.93 0.00 0.00 178.83 178.30 1xpx h LEU 1288N -0.55 0.46 -0.74 -2.39 6.46 0.30 -0.09 115.31 118.75 1xpx h LEU 1288Ca -0.03 0.08 -0.08 0.00 -0.12 0.00 0.00 57.88 57.72 1xpx h LEU 1288Cb 0.41 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.32 1xpx h LEU 1288CO 0.06 0.23 0.08 0.58 -0.62 0.00 0.00 178.44 178.76 1xpx h VAL 1289N 0.59 1.26 -0.90 1.05 2.07 -0.96 -2.33 116.25 117.04 1xpx h VAL 1289Ca 0.40 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1xpx h VAL 1289Cb 0.50 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1xpx h VAL 1289CO -0.32 0.38 0.53 0.50 0.02 0.00 0.00 177.57 178.69 1xpx h LYS 1290N 0.97 1.22 -0.42 1.57 1.63 0.64 -1.96 116.57 120.23 1xpx h LYS 1290Ca 0.19 -0.12 0.09 0.00 -0.85 0.00 0.00 60.65 59.96 1xpx h LYS 1290Cb 0.45 -0.25 -0.08 0.00 -0.60 0.00 0.00 32.23 31.74 1xpx h LYS 1290CO 0.02 0.86 -0.15 -1.49 -3.45 0.00 0.00 179.45 175.24 1xpx h TRP 1291N 1.24 -0.35 -0.17 1.91 6.55 -0.51 0.95 115.95 125.56 1xpx h TRP 1291Ca 0.32 0.04 -0.06 0.00 0.95 0.00 0.00 58.89 60.14 1xpx h TRP 1291Cb -0.04 0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.47 1xpx h TRP 1291CO 0.00 -0.23 -0.18 0.74 -1.05 0.00 0.00 178.44 177.73 1xpx h PHE 1292N -0.06 0.30 -0.87 0.49 -1.00 -1.31 0.51 116.94 115.00 1xpx h PHE 1292Ca 0.20 -0.04 -0.03 0.00 2.81 0.00 0.00 57.97 60.91 1xpx h PHE 1292Cb 0.37 -0.08 -0.04 0.00 3.61 0.00 0.00 35.95 39.81 1xpx h PHE 1292CO -0.40 0.45 0.44 1.03 -1.61 0.00 0.00 178.31 178.21 1xpx h SER 1293N 0.26 1.13 -0.25 2.17 0.87 -0.37 0.28 113.55 117.64 1xpx h SER 1293Ca 0.05 -0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.41 1xpx h SER 1293Cb 0.47 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1xpx h SER 1293CO 0.03 0.93 -0.13 0.78 -0.53 0.00 0.00 176.83 177.92 1xpx h ASN 1294N 1.24 0.55 -0.96 6.23 2.35 0.64 -2.27 115.58 123.35 1xpx h ASN 1294Ca 0.30 -0.41 0.04 0.00 -0.55 0.00 0.00 56.30 55.67 1xpx h ASN 1294Cb 0.09 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.26 1xpx h ASN 1294CO -0.04 0.84 0.63 -0.26 -1.65 0.00 0.00 177.43 176.95 1xpx h PHE 1295N 0.25 1.18 -0.23 1.19 0.05 0.37 -2.59 116.94 117.17 1xpx h PHE 1295Ca 0.06 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.85 1xpx h PHE 1295Cb 0.64 -0.39 -0.01 0.00 2.00 0.00 0.00 35.95 38.18 1xpx h PHE 1295CO 0.06 0.68 0.06 0.00 -0.18 0.00 0.00 178.31 178.93 1xpx h ARG 1296N 1.22 0.36 0.31 1.51 3.08 -0.81 -2.33 114.38 117.73 1xpx h ARG 1296Ca 0.38 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1xpx h ARG 1296Cb 0.00 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 1xpx h ARG 1296CO -0.12 0.48 -0.17 0.93 -1.07 0.00 0.00 179.97 180.02 1xpx h GLU 1297N 0.19 -0.44 -0.32 0.04 5.08 -1.14 0.31 114.58 118.30 1xpx h GLU 1297Ca 0.07 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1xpx h GLU 1297Cb 0.28 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.54 1xpx h GLU 1297CO 0.00 -0.29 -0.28 0.35 -1.00 0.00 0.00 179.01 177.79 1xpx h PHE 1298N -0.46 -0.75 -0.20 4.33 3.57 -1.51 0.60 116.94 122.52 1xpx h PHE 1298Ca -0.04 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.57 1xpx h PHE 1298Cb 0.36 0.38 -0.07 0.00 2.79 0.00 0.00 35.95 39.41 1xpx h PHE 1298CO -0.07 -0.35 -0.28 -0.92 -2.23 0.00 0.00 178.31 174.46 1xpx h TYR 1299N -0.25 -0.76 -0.22 0.41 5.03 -0.98 0.62 116.97 120.83 1xpx h TYR 1299Ca 0.16 0.04 -0.09 0.00 2.58 0.00 0.00 58.73 61.42 1xpx h TYR 1299Cb 0.50 0.36 -0.01 0.00 1.55 0.00 0.00 36.73 39.13 1xpx h TYR 1299CO -0.46 -0.36 -0.25 1.88 -1.32 0.00 0.00 178.16 177.65 1xpx h TYR 1300N -0.31 0.45 -0.55 -3.82 -1.99 0.42 -0.32 116.97 110.85 1xpx h TYR 1300Ca 0.12 -0.09 0.02 0.00 2.00 0.00 0.00 58.73 60.78 1xpx h TYR 1300Cb 0.50 -0.11 -0.03 0.00 2.00 0.00 0.00 36.73 39.09 1xpx h TYR 1300CO -0.41 0.63 0.35 0.82 -0.00 0.00 0.00 178.16 179.55 1xpx h ILE 1301N 0.36 1.10 -0.46 -2.88 1.08 0.11 -0.41 117.51 116.41 1xpx h ILE 1301Ca 0.05 -0.24 -0.05 0.00 -0.39 0.00 0.00 64.86 64.24 1xpx h ILE 1301Cb 0.64 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 34.70 1xpx h ILE 1301CO 0.05 0.13 0.11 1.56 -0.69 0.00 0.00 178.15 179.30 1xpx h GLN 1302N 0.70 0.74 0.28 2.37 1.08 -0.37 -2.51 115.11 117.40 1xpx h GLN 1302Ca 0.21 -0.18 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1xpx h GLN 1302Cb -0.03 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.29 1xpx h GLN 1302CO -0.07 0.73 -0.24 0.52 -0.95 0.00 0.00 178.83 178.82 1xpx h MET 1303N 0.62 -0.52 -0.13 1.46 2.86 -0.48 -1.82 114.93 116.92 1xpx h MET 1303Ca 0.14 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1xpx h MET 1303Cb 0.33 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1xpx h MET 1303CO 0.00 -0.35 0.09 1.49 1.06 0.00 0.00 176.91 179.21 1xpx h GLU 1304N -0.54 0.17 0.06 1.72 4.81 -1.10 -0.41 114.58 119.29 1xpx h GLU 1304Ca -0.01 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1xpx h GLU 1304Cb 0.48 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1xpx h GLU 1304CO -0.03 0.11 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.12 1xpx h LYS 1305N 0.18 -0.07 -0.84 1.92 3.64 -1.01 -1.24 116.57 119.15 1xpx h LYS 1305Ca 0.05 0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.64 1xpx h LYS 1305Cb -0.01 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 31.68 1xpx h LYS 1305CO -0.01 -0.05 0.03 -0.92 -2.27 0.00 0.00 179.45 176.23 1xpx h TYR 1306N -0.11 -0.02 -0.68 1.91 3.20 -1.28 0.37 116.97 120.36 1xpx h TYR 1306Ca -0.01 0.06 0.06 0.00 3.14 0.00 0.00 58.73 61.98 1xpx h TYR 1306Cb 0.06 0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.41 1xpx h TYR 1306CO 0.14 -0.29 0.38 0.00 -1.64 0.00 0.00 178.16 176.75 1xpx h ALA 1307N 1.79 0.91 -0.05 1.82 0.00 -1.09 -1.24 119.26 121.41 1xpx h ALA 1307Ca 0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.38 1xpx h ALA 1307Cb 0.89 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1xpx h ALA 1307CO -0.74 0.05 -0.07 -0.09 0.00 0.00 0.00 179.25 178.40 1xpx h ARG 1308N 0.69 0.13 -0.40 0.00 2.43 0.91 -1.25 114.38 116.89 1xpx h ARG 1308Ca 0.31 -0.08 0.08 0.00 -0.81 0.00 0.00 59.98 59.48 1xpx h ARG 1308Cb 0.20 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1xpx h ARG 1308CO -0.19 0.62 0.28 -0.56 -1.51 0.00 0.00 179.97 178.60 1xpx h GLN 1309N -0.35 0.20 0.04 0.20 -0.00 -0.91 -1.26 115.11 113.03 1xpx h GLN 1309Ca 0.01 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1xpx h GLN 1309Cb 0.60 -0.04 0.00 0.00 -0.00 0.00 0.00 27.48 28.04 1xpx h GLN 1309CO 0.02 0.13 -0.02 0.00 -0.00 0.00 0.00 178.83 178.96 1xpx h ALA 1310N 1.79 -0.05 -0.33 0.06 0.00 -1.09 -2.45 119.26 117.20 1xpx h ALA 1310Ca 0.18 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1xpx h ALA 1310Cb 0.46 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1xpx h ALA 1310CO -0.03 -0.27 -0.36 0.28 0.00 0.00 0.00 179.25 178.88 1xpx h VAL 1311N -0.58 0.00 -0.78 0.00 2.07 -0.09 -1.15 116.25 115.73 1xpx h VAL 1311Ca -0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.59 1xpx h VAL 1311Cb 0.52 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.19 1xpx h VAL 1311CO 0.01 0.00 -0.56 0.74 0.02 0.00 0.00 177.57 177.78 1xpx h THR 1312N -0.20 0.01 0.00 2.57 2.02 -1.43 -3.52 112.91 112.36 1xpx h THR 1312Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.24 1xpx h THR 1312Cb 0.35 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1xpx h THR 1312CO -0.42 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 174.85 1xpx n GLU 1313N -5.31 0.00 0.00 6.66 1.02 -0.44 -5.13 120.64 117.44 1xpx n GLU 1313Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xpx n GLU 1313Cb 0.30 -0.01 0.00 0.00 -0.02 0.00 0.00 31.44 31.71 1xpx n GLU 1313CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1xpx n SER 1327N 0.00 0.00 0.01 1.62 3.41 -1.26 -5.04 113.62 112.36 1xpx n SER 1327Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1xpx n SER 1327Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 1xpx n SER 1327CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1xpx n GLU 1328N 0.00 0.01 -0.03 4.33 4.07 -1.26 -0.70 120.64 127.05 1xpx n GLU 1328Ca 0.00 0.31 0.22 0.00 -0.06 0.00 0.00 57.16 57.62 1xpx n GLU 1328Cb 0.00 -1.74 0.70 0.00 -0.06 0.00 0.00 31.44 30.34 1xpx n GLU 1328CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1xpx h LEU 1329N 0.00 0.00 -0.87 4.31 5.85 -2.03 0.58 115.31 123.15 1xpx h LEU 1329Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1xpx h LEU 1329Cb 0.44 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1xpx h LEU 1329CO 0.00 0.00 0.37 1.88 -0.34 0.00 0.00 178.44 180.35 1xpx h TYR 1330N 0.00 1.20 -0.89 1.25 -1.99 -1.35 -0.32 116.97 114.87 1xpx h TYR 1330Ca 0.28 -0.07 0.19 0.00 2.00 0.00 0.00 58.73 61.13 1xpx h TYR 1330Cb 1.13 -0.37 -0.11 0.00 2.00 0.00 0.00 36.73 39.38 1xpx h TYR 1330CO 0.00 0.88 0.44 -0.09 -0.00 0.00 0.00 178.16 179.39 1xpx h ARG 1331N 1.18 0.52 0.39 4.88 2.43 -0.04 1.39 114.38 125.12 1xpx h ARG 1331Ca 0.28 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1xpx h ARG 1331Cb 0.15 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1xpx h ARG 1331CO -0.03 0.34 -0.19 0.28 -1.51 0.00 0.00 179.97 178.86 1xpx h VAL 1332N 0.53 0.00 -0.64 0.20 2.07 -1.00 0.11 116.25 117.51 1xpx h VAL 1332Ca 0.53 -0.07 0.11 0.00 0.82 0.00 0.00 66.70 68.09 1xpx h VAL 1332Cb 0.90 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 1xpx h VAL 1332CO -0.45 0.00 0.21 -0.07 0.02 0.00 0.00 177.57 177.29 1xpx h LEU 1333N -0.60 0.16 -1.15 2.57 3.38 -0.39 0.27 115.31 119.55 1xpx h LEU 1333Ca -0.05 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1xpx h LEU 1333Cb 0.40 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1xpx h LEU 1333CO 0.09 0.08 -0.05 -1.13 0.09 0.00 0.00 178.44 177.52 1xpx h ASN 1334N 0.37 0.51 -0.07 -0.43 -1.24 0.18 -1.11 115.58 113.78 1xpx h ASN 1334Ca 0.34 -0.11 -0.01 0.00 0.71 0.00 0.00 56.30 57.23 1xpx h ASN 1334Cb 0.47 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.39 1xpx h ASN 1334CO -0.37 0.61 -0.00 0.25 -1.29 0.00 0.00 177.43 176.64 1xpx h LEU 1335N 0.51 0.12 -0.57 0.34 5.85 0.76 0.17 115.31 122.50 1xpx h LEU 1335Ca 0.10 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.52 1xpx h LEU 1335Cb 0.40 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1xpx h LEU 1335CO 0.02 0.41 0.38 -0.74 -0.34 0.00 0.00 178.44 178.16 1xpx h HIS 1336N -0.16 0.71 0.00 1.25 2.76 -0.64 -2.46 115.15 116.61 1xpx h HIS 1336Ca 0.02 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1xpx h HIS 1336Cb 0.34 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.06 1xpx h HIS 1336CO 0.03 0.45 -1.70 0.66 -1.30 0.00 0.00 177.93 176.08 1xpx n TYR 1337N -4.69 0.00 -2.64 5.26 4.02 -0.45 -4.67 117.16 113.98 1xpx n TYR 1337Ca 0.04 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.89 1xpx n TYR 1337Cb 0.02 -0.36 0.05 0.00 -0.02 0.00 0.00 39.34 39.02 1xpx n TYR 1337CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1xpx n ASN 1338N -2.04 2.13 -0.07 7.72 5.15 0.58 -3.87 115.26 124.87 1xpx n ASN 1338Ca -0.02 -2.37 0.01 0.00 -0.60 0.00 0.00 54.58 51.59 1xpx n ASN 1338Cb 0.45 -0.44 0.02 0.00 -0.53 0.00 0.00 39.78 39.28 1xpx n ASN 1338CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1xpx n ARG 1339N -0.54 -0.03 -1.17 1.20 3.00 -0.93 0.16 116.66 118.36 1xpx n ARG 1339Ca 0.14 0.30 -0.21 0.00 -0.00 0.00 0.00 57.85 58.08 1xpx n ARG 1339Cb 0.86 -0.45 0.17 0.00 0.00 0.00 0.00 32.46 33.04 1xpx n ARG 1339CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1xpx n ASN 1340N -4.31 3.88 -3.89 6.15 5.03 -1.26 -4.91 115.26 115.96 1xpx n ASN 1340Ca 0.03 -3.67 -0.33 0.00 0.87 0.00 0.00 54.58 51.47 1xpx n ASN 1340Cb 0.09 -0.80 -0.06 0.00 -1.02 0.00 0.00 39.78 37.99 1xpx n ASN 1340CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1xpx n ASN 1341N -1.11 -1.26 -0.02 6.41 5.15 0.42 -4.73 115.26 120.11 1xpx n ASN 1341Ca 0.54 -0.98 0.18 0.00 -0.60 0.00 0.00 54.58 53.72 1xpx n ASN 1341Cb 1.42 -1.25 0.64 0.00 -0.53 0.00 0.00 39.78 40.06 1xpx n ASN 1341CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 1xpx h HIS 1342N -0.72 0.11 -4.17 1.20 3.86 -1.91 -3.43 115.15 110.09 1xpx h HIS 1342Ca -0.47 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.44 1xpx h HIS 1342Cb 1.09 -0.04 -0.15 0.00 1.06 0.00 0.00 27.41 29.37 1xpx h HIS 1342CO 0.54 0.05 -0.62 0.96 0.86 0.00 0.00 177.93 179.72 1xpx s ILE 1343N -5.11 0.28 -0.12 2.45 -5.25 -1.26 -5.13 121.20 107.05 1xpx s ILE 1343Ca -0.06 -2.00 -0.19 0.00 -0.99 0.00 0.00 60.65 57.42 1xpx s ILE 1343Cb 0.20 -2.57 -0.04 0.00 2.95 0.00 0.00 42.46 43.00 1xpx s ILE 1343CO 0.73 0.00 0.50 -0.70 -1.79 0.00 0.00 174.94 173.68 1xpx s GLU 1344N -4.10 4.33 -0.25 0.37 2.12 -1.26 -5.00 118.70 114.92 1xpx s GLU 1344Ca 0.38 0.47 -0.32 0.00 0.36 0.00 0.00 54.97 55.87 1xpx s GLU 1344Cb 0.07 -3.45 -0.09 0.00 0.26 0.00 0.00 34.13 30.92 1xpx s GLU 1344CO 0.13 0.12 2.15 0.28 -0.54 0.00 0.00 175.26 177.40 1xpx n VAL 1345N 3.78 0.32 -1.88 3.70 0.31 -1.26 -4.89 118.33 118.40 1xpx n VAL 1345Ca -0.06 -0.31 -0.42 0.00 -0.01 0.00 0.00 64.34 63.53 1xpx n VAL 1345Cb 0.51 -2.05 -0.03 0.00 -0.91 0.00 0.00 33.84 31.37 1xpx n VAL 1345CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1xpx s PRO 1346N 5.91 4.19 0.39 5.55 0.04 -1.26 -4.89 135.00 144.93 1xpx s PRO 1346Ca 1.03 2.43 0.20 0.00 0.04 0.00 0.00 61.00 64.71 1xpx s PRO 1346Cb -0.62 -3.11 1.17 0.00 0.04 0.00 0.00 34.50 31.98 1xpx s PRO 1346CO 0.44 -0.61 1.71 0.37 0.04 0.00 0.00 177.00 178.96 1xpx h GLN 1347N 6.17 0.31 -0.66 4.56 5.75 -1.97 0.22 115.11 129.49 1xpx h GLN 1347Ca -0.44 -0.02 0.11 0.00 -0.15 0.00 0.00 58.65 58.15 1xpx h GLN 1347Cb 1.21 -0.07 -0.08 0.00 1.07 0.00 0.00 27.48 29.61 1xpx h GLN 1347CO 0.88 0.20 0.24 -0.91 -2.65 0.00 0.00 178.83 176.60 1xpx h ASN 1348N 0.32 0.23 -0.61 -0.69 2.35 -1.92 -0.49 115.58 114.76 1xpx h ASN 1348Ca 0.68 0.09 0.03 0.00 -0.55 0.00 0.00 56.30 56.55 1xpx h ASN 1348Cb 1.78 0.07 -0.04 0.00 0.05 0.00 0.00 38.32 40.18 1xpx h ASN 1348CO -0.38 0.12 0.37 0.15 -1.65 0.00 0.00 177.43 176.03 1xpx h PHE 1349N 0.41 0.68 0.00 1.19 3.57 -0.72 0.27 116.94 122.34 1xpx h PHE 1349Ca 0.34 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 1xpx h PHE 1349Cb 0.46 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 1xpx h PHE 1349CO -0.17 0.37 -0.03 -0.09 -2.23 0.00 0.00 178.31 176.16 1xpx h ARG 1350N 0.71 0.00 0.14 1.11 2.43 -1.07 -1.25 114.38 116.44 1xpx h ARG 1350Ca 0.25 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 59.07 1xpx h ARG 1350Cb 0.06 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1xpx h ARG 1350CO -0.12 0.03 -1.87 0.35 -1.51 0.00 0.00 179.97 176.85 1xpx h PHE 1351N 0.00 0.54 -0.56 2.20 3.57 -0.10 -3.19 116.94 119.39 1xpx h PHE 1351Ca -0.00 -0.39 0.04 0.00 3.53 0.00 0.00 57.97 61.15 1xpx h PHE 1351Cb 0.11 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 1xpx h PHE 1351CO 0.00 1.68 0.32 0.28 -2.23 0.00 0.00 178.31 178.36 1xpx h VAL 1352N 0.08 1.00 0.02 1.41 2.07 -0.06 -0.41 116.25 120.37 1xpx h VAL 1352Ca -0.38 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 66.96 1xpx h VAL 1352Cb 2.06 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 1xpx h VAL 1352CO 0.12 0.11 -0.33 0.58 0.02 0.00 0.00 177.57 178.07 1xpx h VAL 1353N 0.61 0.28 -0.67 2.57 2.07 -1.37 0.19 116.25 119.93 1xpx h VAL 1353Ca 0.24 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.85 1xpx h VAL 1353Cb 0.10 0.28 -0.07 0.00 -1.52 0.00 0.00 31.29 30.09 1xpx h VAL 1353CO -0.14 0.00 0.32 -0.33 0.02 0.00 0.00 177.57 177.45 1xpx h GLU 1354N -0.50 0.55 -0.57 1.57 4.39 -1.43 0.14 114.58 118.73 1xpx h GLU 1354Ca 0.05 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.76 1xpx h GLU 1354Cb 0.58 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 1xpx h GLU 1354CO -0.26 0.36 0.32 0.77 -1.16 0.00 0.00 179.01 179.05 1xpx h SER 1355N 0.57 0.49 -0.25 1.42 0.02 -0.23 0.67 113.55 116.24 1xpx h SER 1355Ca 0.33 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.27 1xpx h SER 1355Cb 0.33 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1xpx h SER 1355CO -0.26 0.34 0.06 0.74 -1.14 0.00 0.00 176.83 176.57 1xpx h THR 1356N 0.62 1.22 -0.63 -2.27 2.02 0.97 -2.21 112.91 112.63 1xpx h THR 1356Ca 0.24 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 1xpx h THR 1356Cb 0.09 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1xpx h THR 1356CO -0.13 0.23 0.22 -0.07 0.37 0.00 0.00 175.52 176.14 1xpx h LEU 1357N 0.24 0.86 -0.68 2.58 3.38 -0.42 -2.13 115.31 119.13 1xpx h LEU 1357Ca 0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1xpx h LEU 1357Cb 0.29 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1xpx h LEU 1357CO 0.00 0.79 0.39 0.03 0.09 0.00 0.00 178.44 179.74 1xpx h ARG 1358N 0.91 0.95 0.00 1.13 3.08 -0.71 -0.89 114.38 118.85 1xpx h ARG 1358Ca 0.21 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1xpx h ARG 1358Cb 0.22 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1xpx h ARG 1358CO -0.01 0.70 -0.00 0.93 -1.07 0.00 0.00 179.97 180.51 1xpx h GLU 1359N 0.93 -0.00 -0.10 0.04 4.39 -0.92 -0.95 114.58 117.97 1xpx h GLU 1359Ca 0.24 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.95 1xpx h GLU 1359Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1xpx h GLU 1359CO -0.04 0.19 0.04 0.74 -1.16 0.00 0.00 179.01 178.78 1xpx h PHE 1360N -0.19 0.07 -0.86 4.33 -1.00 -1.26 0.69 116.94 118.72 1xpx h PHE 1360Ca -0.00 0.01 0.10 0.00 2.81 0.00 0.00 57.97 60.88 1xpx h PHE 1360Cb 0.19 -0.02 -0.07 0.00 3.61 0.00 0.00 35.95 39.66 1xpx h PHE 1360CO -0.01 0.04 0.50 0.35 -1.61 0.00 0.00 178.31 177.58 1xpx h PHE 1361N 0.10 0.91 0.05 -0.55 3.57 -1.11 0.53 116.94 120.44 1xpx h PHE 1361Ca 0.04 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 1xpx h PHE 1361Cb 0.02 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.48 1xpx h PHE 1361CO -0.10 0.38 -0.02 -0.09 -2.23 0.00 0.00 178.31 176.25 1xpx h ARG 1362N 0.84 -0.07 0.01 1.11 1.12 -0.41 -0.32 114.38 116.66 1xpx h ARG 1362Ca 0.41 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 59.29 1xpx h ARG 1362Cb 0.37 0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.35 1xpx h ARG 1362CO -0.25 0.04 -0.00 0.00 -3.11 0.00 0.00 179.97 176.65 1xpx h ALA 1363N 0.79 -0.01 0.40 2.80 0.00 0.32 -1.97 119.26 121.58 1xpx h ALA 1363Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xpx h ALA 1363Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1xpx h ALA 1363CO 0.01 -0.47 -0.19 0.82 0.00 0.00 0.00 179.25 179.42 1xpx h ILE 1364N -0.08 0.61 -0.06 0.00 2.04 0.06 0.30 117.51 120.37 1xpx h ILE 1364Ca -0.00 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.67 1xpx h ILE 1364Cb 0.08 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1xpx h ILE 1364CO 0.00 0.04 0.11 -0.61 0.00 0.00 0.00 178.15 177.69 1xpx h GLN 1365N -0.66 0.00 -0.62 2.37 4.15 -1.08 0.80 115.11 120.07 1xpx h GLN 1365Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1xpx h GLN 1365Cb 0.48 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1xpx h GLN 1365CO 0.09 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.40 1xpx n GLY 1366N -1.26 1.96 3.22 2.39 0.00 -0.74 -4.89 105.19 105.86 1xpx n GLY 1366Ca -0.01 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1xpx n GLY 1366CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xpx n GLY 1367N 1.40 0.00 0.17 -0.02 0.00 0.28 -4.72 105.19 102.29 1xpx n GLY 1367Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1xpx n GLY 1367CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xpx n LYS 1368N -0.26 0.47 -0.07 1.61 4.76 0.04 -2.08 118.16 122.63 1xpx n LYS 1368Ca 0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.56 1xpx n LYS 1368Cb 0.22 -1.08 0.21 0.00 -1.84 0.00 0.00 35.03 32.54 1xpx n LYS 1368CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1xpx n ASP 1369N -0.23 2.85 0.10 4.39 5.68 -1.22 -4.09 116.55 124.02 1xpx n ASP 1369Ca 0.00 -1.91 0.02 0.00 -0.50 0.00 0.00 54.79 52.39 1xpx n ASP 1369Cb 0.04 -0.09 -0.02 0.00 -1.14 0.00 0.00 41.12 39.91 1xpx n ASP 1369CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1xpx h THR 1370N 4.14 0.72 -4.01 2.12 1.35 -1.78 -3.46 112.91 111.99 1xpx h THR 1370Ca 0.00 -2.12 -0.49 0.00 -0.55 0.00 0.00 66.41 63.25 1xpx h THR 1370Cb 0.89 2.26 0.04 0.00 -1.73 0.00 0.00 68.15 69.61 1xpx h THR 1370CO 0.00 0.41 0.43 -1.61 -0.25 0.00 0.00 175.52 174.50 1xpx s GLU 1371N -2.95 3.87 0.61 4.72 8.01 -1.26 -5.00 118.70 126.70 1xpx s GLU 1371Ca 0.01 1.58 -0.18 0.00 0.01 0.00 0.00 54.97 56.40 1xpx s GLU 1371Cb 0.08 -2.35 -0.02 0.00 -4.31 0.00 0.00 34.13 27.53 1xpx s GLU 1371CO 0.77 -0.41 1.18 -0.65 0.01 0.00 0.00 175.26 176.16 1xpx s GLN 1372N -2.79 2.90 -1.64 1.61 -1.52 -1.26 -3.33 119.66 113.63 1xpx s GLN 1372Ca 0.63 1.70 -0.11 0.00 -1.95 0.00 0.00 55.36 55.64 1xpx s GLN 1372Cb -0.23 -1.93 0.10 0.00 -0.22 0.00 0.00 33.01 30.72 1xpx s GLN 1372CO 0.28 -1.23 0.44 -1.13 -0.25 0.00 0.00 175.29 173.40 1xpx n SER 1373N -1.82 -1.08 0.13 5.90 3.41 -1.26 -4.83 113.62 114.06 1xpx n SER 1373Ca 0.13 -1.15 0.01 0.00 -0.26 0.00 0.00 58.87 57.60 1xpx n SER 1373Cb 0.50 -2.20 0.02 0.00 -0.26 0.00 0.00 64.21 62.27 1xpx n SER 1373CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 1xpx h TRP 1374N -1.50 0.00 0.00 7.33 5.08 -1.88 -3.15 115.95 121.84 1xpx h TRP 1374Ca -0.62 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.32 1xpx h TRP 1374Cb 1.39 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.54 1xpx h TRP 1374CO 0.59 0.61 -0.13 0.87 -1.28 0.00 0.00 178.44 179.09 1xpx h LYS 1375N 0.00 0.00 -0.68 0.12 1.57 -1.88 -3.12 116.57 112.58 1xpx h LYS 1375Ca -0.01 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1xpx h LYS 1375Cb 1.44 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.62 1xpx h LYS 1375CO 0.08 0.13 -0.32 0.87 -0.57 0.00 0.00 179.45 179.64 1xpx h LYS 1376N 0.00 -0.10 -0.51 3.15 1.79 -1.93 0.19 116.57 119.15 1xpx h LYS 1376Ca -0.00 0.01 0.09 0.00 -2.18 0.00 0.00 60.65 58.57 1xpx h LYS 1376Cb 0.25 0.02 -0.10 0.00 -1.58 0.00 0.00 32.23 30.82 1xpx h LYS 1376CO 0.02 -0.07 -0.34 1.03 -1.08 0.00 0.00 179.45 179.01 1xpx h SER 1377N -0.11 -1.17 -0.65 0.86 0.87 -1.77 -0.29 113.55 111.30 1xpx h SER 1377Ca 0.27 0.22 0.10 0.00 -1.23 0.00 0.00 61.79 61.15 1xpx h SER 1377Cb 0.56 0.56 -0.08 0.00 -0.44 0.00 0.00 62.40 63.00 1xpx h SER 1377CO -0.75 -0.31 0.26 0.40 -0.53 0.00 0.00 176.83 175.90 1xpx h ILE 1378N -0.21 0.77 -0.14 2.23 1.08 -1.18 -2.37 117.51 117.69 1xpx h ILE 1378Ca 0.20 -0.15 0.02 0.00 -0.39 0.00 0.00 64.86 64.54 1xpx h ILE 1378Cb 0.55 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 1xpx h ILE 1378CO -0.63 0.08 -0.01 1.88 -0.69 0.00 0.00 178.15 178.79 1xpx h TYR 1379N 0.45 -0.03 -0.93 1.37 0.99 0.05 -0.66 116.97 118.21 1xpx h TYR 1379Ca 0.33 0.01 0.10 0.00 2.00 0.00 0.00 58.73 61.17 1xpx h TYR 1379Cb 0.41 0.03 -0.07 0.00 1.00 0.00 0.00 36.73 38.11 1xpx h TYR 1379CO -0.16 -0.03 0.60 -0.22 -0.00 0.00 0.00 178.16 178.35 1xpx h LYS 1380N 0.03 0.93 -0.28 4.88 3.64 -0.68 0.08 116.57 125.16 1xpx h LYS 1380Ca 0.07 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1xpx h LYS 1380Cb 0.09 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1xpx h LYS 1380CO -0.12 0.61 0.00 0.82 -2.27 0.00 0.00 179.45 178.49 1xpx h ILE 1381N 0.95 1.26 0.00 2.00 2.04 -1.11 -3.12 117.51 119.53 1xpx h ILE 1381Ca 0.43 -0.92 -0.09 0.00 1.00 0.00 0.00 64.86 65.28 1xpx h ILE 1381Cb 0.39 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1xpx h ILE 1381CO -0.19 0.30 -0.42 0.40 0.00 0.00 0.00 178.15 178.23 1xpx h ILE 1382N 0.29 1.22 0.00 -0.67 1.08 -0.20 -2.95 117.51 116.28 1xpx h ILE 1382Ca 0.08 -1.49 -0.00 0.00 -0.39 0.00 0.00 64.86 63.06 1xpx h ILE 1382Cb 0.42 1.82 -0.00 0.00 -3.07 0.00 0.00 36.82 36.00 1xpx h ILE 1382CO 0.01 0.42 -0.00 0.77 -0.69 0.00 0.00 178.15 178.66 1xpx h SER 1383N 0.00 0.00 -0.32 1.72 4.64 -0.95 -0.37 113.55 118.27 1xpx h SER 1383Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xpx h SER 1383Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1xpx h SER 1383CO 0.06 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.56 1xpx n ARG 1384N -3.12 2.07 -0.19 4.77 1.74 -1.11 -4.25 116.66 116.56 1xpx n ARG 1384Ca -0.02 -1.63 0.12 0.00 -0.77 0.00 0.00 57.85 55.55 1xpx n ARG 1384Cb 0.11 -1.42 0.21 0.00 -1.02 0.00 0.00 32.46 30.34 1xpx n ARG 1384CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1xpx n MET 1385N 0.83 2.49 -1.52 5.56 2.81 -0.15 -4.98 117.12 122.16 1xpx n MET 1385Ca 0.17 -2.28 -0.36 0.00 -1.81 0.00 0.00 57.70 53.42 1xpx n MET 1385Cb 0.43 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.52 1xpx n MET 1385CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1xpx n ASP 1386N 1.46 1.35 -4.50 7.83 8.00 -1.26 -4.97 116.55 124.47 1xpx n ASP 1386Ca 0.19 0.74 -0.25 0.00 0.71 0.00 0.00 54.79 56.19 1xpx n ASP 1386Cb 0.60 -1.49 -0.10 0.00 -0.02 0.00 0.00 41.12 40.10 1xpx n ASP 1386CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1xpx s ASP 1387N -1.56 3.57 0.01 -2.24 1.11 0.23 -5.00 116.67 112.79 1xpx s ASP 1387Ca 0.78 -1.12 -0.30 0.00 0.18 0.00 0.00 52.55 52.09 1xpx s ASP 1387Cb -0.36 -0.31 -0.06 0.00 1.07 0.00 0.00 42.92 43.26 1xpx s ASP 1387CO 0.45 -0.11 1.51 -2.84 1.18 0.00 0.00 175.17 175.36 1xpx s PRO 1388N -3.58 4.24 0.18 8.23 0.02 -1.26 -4.50 135.00 138.34 1xpx s PRO 1388Ca 0.31 2.10 -0.31 0.00 0.02 0.00 0.00 61.00 63.12 1xpx s PRO 1388Cb -0.01 -3.64 -0.09 0.00 0.02 0.00 0.00 34.50 30.78 1xpx s PRO 1388CO 0.15 -0.66 1.46 0.08 -0.33 0.00 0.00 177.00 177.70 1xpx s VAL 1389N 2.70 2.86 0.42 3.83 1.01 -1.26 -4.92 120.40 125.04 1xpx s VAL 1389Ca 0.68 0.66 -0.22 0.00 0.00 0.00 0.00 61.98 63.10 1xpx s VAL 1389Cb -0.34 -3.42 -0.13 0.00 0.00 0.00 0.00 36.38 32.49 1xpx s VAL 1389CO 0.28 0.07 0.41 -2.65 0.00 0.00 0.00 175.10 173.22 1xpx n PRO 1390N 3.28 0.39 -0.30 2.72 -0.02 -1.26 -4.89 135.00 134.91 1xpx n PRO 1390Ca 0.10 0.14 -0.04 0.00 -2.02 0.00 0.00 63.50 61.68 1xpx n PRO 1390Cb 0.40 -1.36 0.07 0.00 -0.02 0.00 0.00 33.50 32.60 1xpx n PRO 1390CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1xpx h GLU 1391N 0.64 1.14 0.00 -0.52 4.57 -2.05 -2.96 114.58 115.40 1xpx h GLU 1391Ca -0.39 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 1xpx h GLU 1391Cb 1.41 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1xpx h GLU 1391CO 0.50 0.83 0.00 2.48 -1.18 0.00 0.00 179.01 181.64 1xpx n TYR 1392N -4.41 0.00 1.07 0.92 0.18 -1.26 -1.57 117.16 112.09 1xpx n TYR 1392Ca 0.08 0.00 0.14 0.00 1.88 0.00 0.00 57.90 60.00 1xpx n TYR 1392Cb 0.08 0.00 0.57 0.00 -0.38 0.00 0.00 39.34 39.61 1xpx n TYR 1392CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 1xpx n PHE 1393N -0.93 0.00 0.02 -3.48 3.01 -1.12 -2.92 117.46 112.03 1xpx n PHE 1393Ca 0.06 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.49 1xpx n PHE 1393Cb 0.03 -0.41 -0.10 0.00 -0.01 0.00 0.00 39.48 38.98 1xpx n PHE 1393CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1xpx h LYS 1394N 0.04 0.00 -6.34 -1.08 1.57 -1.52 -3.46 116.57 105.78 1xpx h LYS 1394Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 1xpx h LYS 1394Cb 0.47 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.80 1xpx h LYS 1394CO 0.00 0.38 1.13 0.45 -0.57 0.00 0.00 179.45 180.84 1xpx n SER 1395N -2.96 3.73 -0.33 0.86 2.88 -1.15 -4.83 113.62 111.83 1xpx n SER 1395Ca -0.12 0.96 0.21 0.00 -1.33 0.00 0.00 58.87 58.58 1xpx n SER 1395Cb 0.92 -1.44 0.47 0.00 -0.75 0.00 0.00 64.21 63.40 1xpx n SER 1395CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1xpx h PRO 1396N 9.45 0.45 0.00 -1.46 0.11 -1.91 0.80 132.00 139.45 1xpx h PRO 1396Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1xpx h PRO 1396Cb 1.26 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1xpx h PRO 1396CO 0.94 0.30 0.00 -0.91 -0.21 0.00 0.00 178.00 178.12 1xpx h ASN 1397N 0.47 0.00 0.32 -2.05 2.35 -1.93 -3.01 115.58 111.73 1xpx h ASN 1397Ca 0.60 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.33 1xpx h ASN 1397Cb 1.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1xpx h ASN 1397CO -0.34 0.00 -0.15 0.15 -1.65 0.00 0.00 177.43 175.44 1xpx h PHE 1398N 0.00 -0.40 -0.97 1.19 3.57 0.41 -3.13 116.94 117.60 1xpx h PHE 1398Ca 0.00 -0.01 0.36 0.00 3.53 0.00 0.00 57.97 61.85 1xpx h PHE 1398Cb 0.32 0.13 -0.18 0.00 2.79 0.00 0.00 35.95 39.02 1xpx h PHE 1398CO 0.00 -0.06 0.36 -0.11 -2.23 0.00 0.00 178.31 176.27 1xpx n LEU 1399N -5.12 0.19 0.00 0.59 7.94 -1.14 -3.88 117.00 115.59 1xpx n LEU 1399Ca -0.09 1.63 0.00 0.00 -1.11 0.00 0.00 56.01 56.44 1xpx n LEU 1399Cb 0.27 -0.73 0.00 0.00 0.53 0.00 0.00 43.42 43.49 1xpx n LEU 1399CO 0.29 -1.77 0.00 -0.62 -1.11 0.00 0.00 177.39 174.18 1xpx n GLU 1400N -5.28 1.25 0.00 1.96 1.02 -1.18 -5.05 120.64 113.35 1xpx n GLU 1400Ca 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1xpx n GLU 1400Cb 1.09 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.51 1xpx n GLU 1400CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31