#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xwe s SER 1509N 0.00 6.39 -0.15 1.61 1.04 -1.26 -5.07 113.70 116.26 1xwe s SER 1509Ca 0.00 0.45 -0.10 0.00 0.48 0.00 0.00 55.95 56.78 1xwe s SER 1509Cb 0.00 -2.19 0.05 0.00 0.10 0.00 0.00 66.02 63.98 1xwe s SER 1509CO 0.00 0.03 0.37 -2.28 0.98 0.00 0.00 173.24 172.34 1xwe s HIS 1510N 0.85 -0.49 0.05 5.02 5.65 -1.26 -5.13 115.29 119.99 1xwe s HIS 1510Ca 0.16 1.10 0.00 0.00 0.25 0.00 0.00 55.06 56.57 1xwe s HIS 1510Cb -0.14 0.19 0.00 0.00 -1.18 0.00 0.00 32.58 31.45 1xwe s HIS 1510CO 0.05 -0.27 0.00 -1.33 -0.65 0.00 0.00 174.74 172.54 1xwe n MET 1511N 3.78 -0.46 -3.41 2.88 2.00 -1.26 -4.56 117.12 116.08 1xwe n MET 1511Ca -0.20 0.30 -0.42 0.00 0.00 0.00 0.00 57.70 57.38 1xwe n MET 1511Cb 0.56 -0.56 -0.10 0.00 0.00 0.00 0.00 33.22 33.12 1xwe n MET 1511CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1xwe s ALA 1512N -1.98 3.47 -0.20 3.04 0.00 -1.26 -4.94 121.76 119.88 1xwe s ALA 1512Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.40 1xwe s ALA 1512Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1xwe s ALA 1512CO 0.00 -1.42 0.85 -0.25 0.00 0.00 0.00 175.76 174.94 1xwe n ASP 1513N 5.33 2.45 -4.46 0.00 9.92 -1.26 -3.43 116.55 125.10 1xwe n ASP 1513Ca -0.10 -1.89 -0.48 0.00 -0.53 0.00 0.00 54.79 51.79 1xwe n ASP 1513Cb 0.48 -0.47 -0.07 0.00 -0.64 0.00 0.00 41.12 40.41 1xwe n ASP 1513CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xwe n GLY 1515N 6.48 2.89 2.86 0.00 0.00 -0.58 -4.02 105.19 112.82 1xwe n GLY 1515Ca 0.43 -0.76 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 1xwe n GLY 1515CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1xwe n GLN 1516N 0.00 -2.69 -3.03 1.61 7.27 0.47 -4.57 117.38 116.44 1xwe n GLN 1516Ca 0.00 2.25 -0.40 0.00 0.07 0.00 0.00 57.00 58.92 1xwe n GLN 1516Cb 0.00 -3.46 -0.05 0.00 2.41 0.00 0.00 30.24 29.14 1xwe n GLN 1516CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 1xwe s MET 1517N -0.92 4.45 0.64 3.69 -1.94 -1.18 -4.50 119.30 119.54 1xwe s MET 1517Ca -0.08 0.96 -0.10 0.00 -1.71 0.00 0.00 55.69 54.77 1xwe s MET 1517Cb 0.01 -3.39 -0.01 0.00 2.01 0.00 0.00 34.83 33.45 1xwe s MET 1517CO 0.47 0.21 1.01 -0.65 -0.01 0.00 0.00 175.02 176.05 1xwe s GLN 1518N 0.26 3.15 1.05 2.03 -1.52 -1.18 -5.07 119.66 118.38 1xwe s GLN 1518Ca 0.38 0.43 -0.18 0.00 -1.95 0.00 0.00 55.36 54.04 1xwe s GLN 1518Cb -0.19 -2.12 0.26 0.00 -0.22 0.00 0.00 33.01 30.74 1xwe s GLN 1518CO 0.21 -0.76 0.95 0.39 -0.25 0.00 0.00 175.29 175.83 1xwe n GLU 1519N -2.78 -2.76 -4.75 2.91 -0.58 -1.26 -4.72 120.64 106.71 1xwe n GLU 1519Ca 0.06 -1.51 -0.33 0.00 -0.42 0.00 0.00 57.16 54.95 1xwe n GLU 1519Cb 0.56 -1.39 -0.14 0.00 -0.57 0.00 0.00 31.44 29.90 1xwe n GLU 1519CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1xwe s GLU 1520N -5.15 3.37 -2.10 3.49 2.02 -1.26 -4.55 118.70 114.52 1xwe s GLU 1520Ca 0.61 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.93 1xwe s GLU 1520Cb -0.06 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.52 1xwe s GLU 1520CO 0.47 0.24 0.00 1.28 0.02 0.00 0.00 175.26 177.27 1xwe n LEU 1521N 3.46 -1.46 -4.60 1.80 4.77 -1.26 -4.87 117.00 114.85 1xwe n LEU 1521Ca -0.18 0.48 -0.43 0.00 -0.03 0.00 0.00 56.01 55.86 1xwe n LEU 1521Cb 0.53 -2.75 -0.03 0.00 -2.33 0.00 0.00 43.42 38.83 1xwe n LEU 1521CO 0.31 -1.02 1.82 1.51 -1.33 0.00 0.00 177.39 178.67 1xwe s ASP 1522N -2.67 5.44 -0.68 -1.43 -4.77 -1.26 -4.90 116.67 106.40 1xwe s ASP 1522Ca 0.00 1.73 -0.22 0.00 -3.30 0.00 0.00 52.55 50.76 1xwe s ASP 1522Cb 0.00 -2.51 0.07 0.00 -1.09 0.00 0.00 42.92 39.39 1xwe s ASP 1522CO 0.00 -2.00 0.99 -0.76 0.70 0.00 0.00 175.17 174.10 1xwe s LEU 1523N 8.40 4.39 0.00 2.11 1.43 -1.26 -4.29 118.68 129.47 1xwe s LEU 1523Ca 0.97 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1xwe s LEU 1523Cb -0.30 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.50 1xwe s LEU 1523CO 0.34 -1.43 0.00 1.07 0.23 0.00 0.00 176.35 176.56 1xwe n THR 1524N 5.92 0.00 -3.33 5.49 5.66 -1.26 -5.13 114.28 121.63 1xwe n THR 1524Ca -0.01 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.60 1xwe n THR 1524Cb 0.46 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.18 1xwe n THR 1524CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1xwe s ILE 1525N -0.89 5.08 0.55 1.09 -4.36 -1.26 -5.08 121.20 116.33 1xwe s ILE 1525Ca 0.00 1.00 -0.01 0.00 -0.26 0.00 0.00 60.65 61.38 1xwe s ILE 1525Cb 0.00 -3.82 0.11 0.00 1.25 0.00 0.00 42.46 40.00 1xwe s ILE 1525CO 0.00 0.40 0.76 -1.54 0.24 0.00 0.00 174.94 174.80 1xwe n SER 1526N 3.03 0.98 0.00 4.36 3.41 -1.26 -4.98 113.62 119.17 1xwe n SER 1526Ca -0.09 -1.84 0.12 0.00 -0.26 0.00 0.00 58.87 56.81 1xwe n SER 1526Cb 0.52 -0.50 0.54 0.00 -0.26 0.00 0.00 64.21 64.51 1xwe n SER 1526CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xwe n ALA 1527N -2.96 2.14 -0.04 7.33 0.00 -1.26 -3.17 120.51 122.55 1xwe n ALA 1527Ca -0.13 -0.09 -0.14 0.00 0.00 0.00 0.00 53.44 53.08 1xwe n ALA 1527Cb 0.44 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.36 1xwe n ALA 1527CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xwe n GLU 1528N -1.46 0.69 0.32 0.00 1.02 -1.26 -3.24 120.64 116.70 1xwe n GLU 1528Ca 0.07 0.21 0.20 0.00 -0.02 0.00 0.00 57.16 57.62 1xwe n GLU 1528Cb 0.27 -1.67 1.06 0.00 -0.02 0.00 0.00 31.44 31.08 1xwe n GLU 1528CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1xwe h THR 1529N 0.02 0.14 0.04 2.62 2.02 -1.93 -0.49 112.91 115.34 1xwe h THR 1529Ca -0.42 -0.12 -0.37 0.00 0.77 0.00 0.00 66.41 66.27 1xwe h THR 1529Cb 2.05 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 69.50 1xwe h THR 1529CO 0.05 0.01 -2.22 0.54 0.37 0.00 0.00 175.52 174.27 1xwe n ARG 1530N -3.26 0.69 -0.16 6.66 1.74 -1.25 -4.37 116.66 116.72 1xwe n ARG 1530Ca -0.02 0.18 -0.10 0.00 -0.77 0.00 0.00 57.85 57.14 1xwe n ARG 1530Cb 0.12 -1.61 0.03 0.00 -1.02 0.00 0.00 32.46 29.97 1xwe n ARG 1530CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1xwe h LYS 1531N 0.03 0.98 0.00 5.56 1.63 -1.43 -2.33 116.57 121.01 1xwe h LYS 1531Ca -0.49 -0.37 0.00 0.00 -0.85 0.00 0.00 60.65 58.93 1xwe h LYS 1531Cb 2.00 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.58 1xwe h LYS 1531CO 0.01 1.05 0.13 1.96 -3.45 0.00 0.00 179.45 179.15 1xwe h GLN 1532N 0.87 0.00 0.12 1.90 4.20 -1.30 -0.28 115.11 120.62 1xwe h GLN 1532Ca 0.13 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.47 1xwe h GLN 1532Cb 0.70 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 1xwe h GLN 1532CO 0.05 0.00 -2.00 2.41 -0.67 0.00 0.00 178.83 178.62 1xwe n THR 1533N -2.63 1.78 -0.38 -0.54 -1.04 -0.90 -4.05 114.28 106.52 1xwe n THR 1533Ca -0.02 -0.66 -0.02 0.00 -2.04 0.00 0.00 64.05 61.31 1xwe n THR 1533Cb 0.18 -1.71 0.11 0.00 -1.82 0.00 0.00 70.33 67.09 1xwe n THR 1533CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xwe h ALA 1534N 0.09 1.29 0.00 2.41 0.00 -0.83 -1.10 119.26 121.13 1xwe h ALA 1534Ca -0.42 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1xwe h ALA 1534Cb 2.03 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 1xwe h ALA 1534CO 0.09 0.66 -0.06 0.00 0.00 0.00 0.00 179.25 179.93 1xwe s LYS 1536N -4.10 3.12 0.56 0.00 1.02 -0.41 -4.91 119.74 115.01 1xwe s LYS 1536Ca -0.03 1.80 0.33 0.00 0.02 0.00 0.00 55.97 58.10 1xwe s LYS 1536Cb 0.12 -2.00 1.59 0.00 -0.52 0.00 0.00 37.83 37.03 1xwe s LYS 1536CO 0.53 -1.08 2.09 -1.00 -0.92 0.00 0.00 175.35 174.97 1xwe h PRO 1537N 1.08 0.00 0.00 -1.68 0.13 -1.85 -2.42 132.00 127.26 1xwe h PRO 1537Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1xwe h PRO 1537Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 1xwe h PRO 1537CO 0.56 0.06 -0.16 1.49 -0.23 0.00 0.00 178.00 179.72 1xwe h GLU 1538N 0.00 0.00 -4.01 0.86 4.81 -1.91 -3.37 114.58 110.97 1xwe h GLU 1538Ca -0.00 0.00 -0.76 0.00 -0.13 0.00 0.00 59.36 58.47 1xwe h GLU 1538Cb 0.36 0.00 -0.26 0.00 0.63 0.00 0.00 28.75 29.48 1xwe h GLU 1538CO 0.01 0.16 -0.14 0.42 -0.73 0.00 0.00 179.01 178.73 1xwe s ILE 1539N -4.30 5.14 -0.01 2.32 -1.09 -0.91 -0.58 121.20 121.76 1xwe s ILE 1539Ca -0.03 -1.94 -0.24 0.00 -2.23 0.00 0.00 60.65 56.21 1xwe s ILE 1539Cb 0.14 -4.26 -0.19 0.00 -1.58 0.00 0.00 42.46 36.57 1xwe s ILE 1539CO 0.63 -0.91 1.25 0.00 -1.23 0.00 0.00 174.94 174.67 1xwe h ALA 1540N 8.37 0.07 -2.89 9.38 0.00 -0.72 -3.45 119.26 130.02 1xwe h ALA 1540Ca -0.14 -0.30 -0.59 0.00 0.00 0.00 0.00 54.91 53.88 1xwe h ALA 1540Cb 1.07 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 18.67 1xwe h ALA 1540CO 0.90 -0.11 -0.79 1.52 0.00 0.00 0.00 179.25 180.77 1xwe s TYR 1541N -4.08 2.10 -0.30 0.00 -0.85 -0.88 -4.51 117.35 108.83 1xwe s TYR 1541Ca -0.15 -0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 55.99 1xwe s TYR 1541Cb 0.02 -1.02 0.13 0.00 0.38 0.00 0.00 41.96 41.48 1xwe s TYR 1541CO 0.71 0.47 0.27 0.00 -1.52 0.00 0.00 175.55 175.48 1xwe s ALA 1542N -2.00 -0.22 0.31 9.51 0.00 -0.91 -2.32 121.76 126.14 1xwe s ALA 1542Ca 0.21 -0.57 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 1xwe s ALA 1542Cb -0.06 -1.75 -0.01 0.00 0.00 0.00 0.00 23.12 21.30 1xwe s ALA 1542CO 0.09 -1.76 0.42 1.52 0.00 0.00 0.00 175.76 176.03 1xwe s TYR 1543N 2.18 1.06 0.09 0.00 -0.85 -0.80 -0.71 117.35 118.31 1xwe s TYR 1543Ca 0.10 -1.27 0.09 0.00 -0.52 0.00 0.00 57.07 55.48 1xwe s TYR 1543Cb -0.15 -0.17 -0.04 0.00 0.38 0.00 0.00 41.96 41.99 1xwe s TYR 1543CO -0.30 -1.04 -0.23 -1.59 -1.52 0.00 0.00 175.55 170.88 1xwe s LYS 1544N -3.34 1.75 0.30 -3.49 -2.85 -0.88 -1.29 119.74 109.93 1xwe s LYS 1544Ca 0.31 -1.16 0.07 0.00 -1.00 0.00 0.00 55.97 54.19 1xwe s LYS 1544Cb 0.01 -2.04 -0.03 0.00 -2.06 0.00 0.00 37.83 33.71 1xwe s LYS 1544CO 0.19 0.49 0.26 1.33 0.10 0.00 0.00 175.35 177.72 1xwe n VAL 1545N 1.24 0.00 -3.63 1.79 0.24 -0.74 -0.97 118.33 116.26 1xwe n VAL 1545Ca -0.17 -2.20 -0.18 0.00 -2.04 0.00 0.00 64.34 59.75 1xwe n VAL 1545Cb 0.52 1.10 -0.15 0.00 -1.47 0.00 0.00 33.84 33.84 1xwe n VAL 1545CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1xwe s SER 1546N -3.11 1.08 0.44 -1.34 0.15 -0.61 -2.08 113.70 108.23 1xwe s SER 1546Ca 0.36 0.10 -0.26 0.00 0.70 0.00 0.00 55.95 56.85 1xwe s SER 1546Cb 0.02 0.22 -0.09 0.00 -1.71 0.00 0.00 66.02 64.46 1xwe s SER 1546CO 0.26 -0.27 1.45 -0.63 1.20 0.00 0.00 173.24 175.25 1xwe s ILE 1547N 2.28 2.00 0.00 6.45 -1.09 -0.76 -2.22 121.20 127.86 1xwe s ILE 1547Ca 0.04 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.46 1xwe s ILE 1547Cb -0.13 -3.00 0.00 0.00 -1.58 0.00 0.00 42.46 37.75 1xwe s ILE 1547CO -0.07 0.00 0.00 0.35 -1.23 0.00 0.00 174.94 173.99 1xwe n THR 1548N -0.10 0.00 -3.83 2.92 -2.24 -0.96 -2.73 114.28 107.34 1xwe n THR 1548Ca 0.04 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.72 1xwe n THR 1548Cb 0.41 -0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 68.14 1xwe n THR 1548CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1xwe s SER 1549N -3.29 0.00 -0.25 3.42 0.01 -0.29 -4.78 113.70 108.53 1xwe s SER 1549Ca 0.00 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 1xwe s SER 1549Cb 0.00 0.29 0.08 0.00 0.21 0.00 0.00 66.02 66.60 1xwe s SER 1549CO 0.00 -0.55 0.03 -0.63 0.41 0.00 0.00 173.24 172.50 1xwe s ILE 1550N -2.45 1.00 0.01 1.44 1.01 -1.26 -0.92 121.20 120.03 1xwe s ILE 1550Ca -0.06 -1.11 -0.05 0.00 0.00 0.00 0.00 60.65 59.44 1xwe s ILE 1550Cb -0.02 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 1xwe s ILE 1550CO -0.03 -0.35 0.24 -0.89 0.00 0.00 0.00 174.94 173.90 1xwe s THR 1551N 1.60 5.35 0.00 2.92 2.01 -0.75 -5.00 115.64 121.78 1xwe s THR 1551Ca 0.02 0.01 -0.00 0.00 0.31 0.00 0.00 61.69 62.03 1xwe s THR 1551Cb -0.18 -3.56 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 1xwe s THR 1551CO -0.13 0.32 -0.00 0.54 -0.69 0.00 0.00 174.62 174.66 1xwe s VAL 1552N -1.34 0.01 0.00 3.82 0.11 -1.26 -0.28 120.40 121.46 1xwe s VAL 1552Ca 0.28 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 1xwe s VAL 1552Cb -0.13 -0.03 0.00 0.00 -1.53 0.00 0.00 36.38 34.69 1xwe s VAL 1552CO 0.18 -0.04 0.00 -0.62 -3.33 0.00 0.00 175.10 171.29 1xwe n GLU 1553N 2.97 0.00 0.13 1.54 1.02 -1.25 -5.01 120.64 120.05 1xwe n GLU 1553Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1xwe n GLU 1553Cb 0.60 -0.16 0.00 0.00 -0.02 0.00 0.00 31.44 31.85 1xwe n GLU 1553CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xwe n ASN 1554N -2.00 -0.91 -0.00 1.62 3.02 -1.26 -5.04 115.26 110.69 1xwe n ASN 1554Ca 0.00 0.45 -0.04 0.00 -0.03 0.00 0.00 54.58 54.96 1xwe n ASN 1554Cb 0.00 1.01 -0.01 0.00 -0.61 0.00 0.00 39.78 40.17 1xwe n ASN 1554CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1xwe n VAL 1555N -3.22 1.28 -2.40 2.41 0.31 -1.26 -4.99 118.33 110.45 1xwe n VAL 1555Ca 0.00 0.28 -0.43 0.00 -0.01 0.00 0.00 64.34 64.19 1xwe n VAL 1555Cb 0.00 -1.85 -0.02 0.00 -0.91 0.00 0.00 33.84 31.06 1xwe n VAL 1555CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1xwe s PHE 1556N -2.32 2.97 -0.26 3.52 0.08 -1.26 -3.20 117.98 117.51 1xwe s PHE 1556Ca -0.11 1.05 -0.12 0.00 0.12 0.00 0.00 56.93 57.87 1xwe s PHE 1556Cb 0.02 -3.50 -0.05 0.00 -0.57 0.00 0.00 43.02 38.92 1xwe s PHE 1556CO 0.16 -1.70 0.24 0.08 -0.10 0.00 0.00 175.22 173.90 1xwe s VAL 1557N 2.82 5.29 0.29 -0.44 1.01 -0.89 -3.81 120.40 124.67 1xwe s VAL 1557Ca 0.57 0.29 -0.07 0.00 0.00 0.00 0.00 61.98 62.77 1xwe s VAL 1557Cb -0.25 -3.57 -0.06 0.00 0.00 0.00 0.00 36.38 32.50 1xwe s VAL 1557CO 0.20 0.25 0.60 -0.54 0.00 0.00 0.00 175.10 175.61 1xwe s LYS 1558N 1.63 3.71 -0.26 2.72 -0.14 0.62 -1.60 119.74 126.41 1xwe s LYS 1558Ca 0.10 0.18 -0.03 0.00 -1.36 0.00 0.00 55.97 54.85 1xwe s LYS 1558Cb -0.15 -2.60 0.09 0.00 -1.68 0.00 0.00 37.83 33.49 1xwe s LYS 1558CO 0.09 0.20 0.10 0.71 -0.76 0.00 0.00 175.35 175.69 1xwe s TYR 1559N -2.06 0.69 -0.48 3.18 2.02 0.71 -1.82 117.35 119.61 1xwe s TYR 1559Ca 0.46 -0.97 -0.27 0.00 -0.37 0.00 0.00 57.07 55.93 1xwe s TYR 1559Cb -0.11 -1.06 0.03 0.00 -0.40 0.00 0.00 41.96 40.42 1xwe s TYR 1559CO 0.27 -0.76 1.02 0.15 -1.57 0.00 0.00 175.55 174.67 1xwe s LYS 1560N 1.97 3.61 0.18 -0.62 -0.14 -0.10 -1.24 119.74 123.39 1xwe s LYS 1560Ca 0.07 0.32 0.04 0.00 -1.36 0.00 0.00 55.97 55.04 1xwe s LYS 1560Cb -0.16 -3.93 -0.05 0.00 -1.68 0.00 0.00 37.83 32.01 1xwe s LYS 1560CO -0.26 -1.31 -0.07 0.00 -0.76 0.00 0.00 175.35 172.95 1xwe s ALA 1561N 4.10 1.57 -0.15 5.17 0.00 -0.94 -1.13 121.76 130.37 1xwe s ALA 1561Ca 0.42 -1.58 -0.04 0.00 0.00 0.00 0.00 51.96 50.76 1xwe s ALA 1561Cb -0.09 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 1xwe s ALA 1561CO 0.29 -0.15 -0.03 0.99 0.00 0.00 0.00 175.76 176.85 1xwe s THR 1562N -3.37 3.97 -0.47 0.00 2.01 -0.94 -2.80 115.64 114.05 1xwe s THR 1562Ca 0.21 -0.33 -0.28 0.00 0.31 0.00 0.00 61.69 61.60 1xwe s THR 1562Cb 0.04 -2.73 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 1xwe s THR 1562CO 0.03 0.50 1.75 -0.22 -0.69 0.00 0.00 174.62 176.00 1xwe s LEU 1563N 0.21 3.42 0.06 4.42 2.96 -0.89 -1.57 118.68 127.29 1xwe s LEU 1563Ca -0.02 0.80 -0.32 0.00 -0.22 0.00 0.00 54.13 54.36 1xwe s LEU 1563Cb -0.14 -3.10 -0.18 0.00 0.50 0.00 0.00 46.19 43.28 1xwe s LEU 1563CO 0.03 -1.94 1.49 -0.07 -1.32 0.00 0.00 176.35 174.54 1xwe h LEU 1564N 14.55 -1.04 -7.50 -0.68 3.38 -1.35 -1.70 115.31 120.97 1xwe h LEU 1564Ca -0.29 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1xwe h LEU 1564Cb 1.15 0.28 -0.13 0.00 0.09 0.00 0.00 40.66 42.05 1xwe h LEU 1564CO 1.12 -0.69 -0.15 -1.81 0.09 0.00 0.00 178.44 177.00 1xwe s ASP 1565N -3.78 -0.14 -0.10 -0.43 1.01 -0.95 -4.15 116.67 108.14 1xwe s ASP 1565Ca -0.17 -0.39 0.01 0.00 0.71 0.00 0.00 52.55 52.71 1xwe s ASP 1565Cb 0.02 0.44 -0.02 0.00 1.01 0.00 0.00 42.92 44.36 1xwe s ASP 1565CO 0.52 -0.81 -0.11 -0.63 0.21 0.00 0.00 175.17 174.35 1xwe s ILE 1566N -3.76 3.32 -0.03 0.77 1.01 -1.26 -2.08 121.20 119.17 1xwe s ILE 1566Ca 0.03 -0.60 0.07 0.00 0.00 0.00 0.00 60.65 60.15 1xwe s ILE 1566Cb 0.02 -2.37 -0.11 0.00 0.01 0.00 0.00 42.46 40.02 1xwe s ILE 1566CO -0.11 0.55 0.12 -1.22 0.00 0.00 0.00 174.94 174.28 1xwe n TYR 1567N 2.91 0.00 -3.50 3.97 4.02 -0.50 -4.93 117.16 119.13 1xwe n TYR 1567Ca -0.18 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.52 1xwe n TYR 1567Cb 0.53 -0.21 -0.13 0.00 -0.02 0.00 0.00 39.34 39.50 1xwe n TYR 1567CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 1xwe s LYS 1568N -2.41 0.18 0.37 -0.72 2.20 0.11 -4.42 119.74 115.04 1xwe s LYS 1568Ca -0.03 0.16 -0.24 0.00 -0.36 0.00 0.00 55.97 55.50 1xwe s LYS 1568Cb 0.04 -1.26 -0.13 0.00 -1.51 0.00 0.00 37.83 34.96 1xwe s LYS 1568CO 0.30 -0.67 0.64 2.41 -0.36 0.00 0.00 175.35 177.67 1xwe n THR 1569N 5.31 1.85 -3.51 3.43 -1.04 -1.26 -2.14 114.28 116.93 1xwe n THR 1569Ca -0.06 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.08 1xwe n THR 1569Cb 0.49 -0.59 -0.08 0.00 -1.82 0.00 0.00 70.33 68.34 1xwe n THR 1569CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1xwe s GLY 1570N -0.87 2.06 0.60 3.41 0.00 -1.26 -4.19 107.32 107.06 1xwe s GLY 1570Ca 0.62 -0.66 0.30 0.00 0.00 0.00 0.00 44.72 44.98 1xwe s GLY 1570CO 0.58 0.61 2.17 0.83 0.00 0.00 0.00 173.10 177.29 1xwe h GLU 1571N 7.35 0.00 -1.51 2.90 4.39 -1.92 -1.41 114.58 124.38 1xwe h GLU 1571Ca -0.37 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 58.88 1xwe h GLU 1571Cb 1.16 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.63 1xwe h GLU 1571CO 0.70 0.00 0.53 0.00 -1.16 0.00 0.00 179.01 179.08 1xwe n ALA 1572N -2.30 5.66 -2.63 3.43 0.00 -1.26 -4.89 120.51 118.52 1xwe n ALA 1572Ca -0.01 -2.37 -0.03 0.00 0.00 0.00 0.00 53.44 51.04 1xwe n ALA 1572Cb 0.22 -1.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 1xwe n ALA 1572CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xwe n VAL 1573N 0.14-12.50 -4.62 0.00 0.31 -0.55 -4.77 118.33 96.34 1xwe n VAL 1573Ca 0.41 2.38 -0.27 0.00 -0.01 0.00 0.00 64.34 66.85 1xwe n VAL 1573Cb 0.58 -6.71 -0.17 0.00 -0.91 0.00 0.00 33.84 26.63 1xwe n VAL 1573CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xwe s ALA 1574N -1.07 1.55 0.08 3.52 0.00 -1.11 -4.90 121.76 119.82 1xwe s ALA 1574Ca -0.17 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.22 1xwe s ALA 1574Cb 0.01 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1xwe s ALA 1574CO 0.79 0.06 -0.10 -1.21 0.00 0.00 0.00 175.76 175.30 1xwe s GLU 1575N 0.75 0.75 0.04 0.00 2.02 -1.26 -4.46 118.70 116.54 1xwe s GLU 1575Ca -0.12 -1.02 -0.33 0.00 0.02 0.00 0.00 54.97 53.53 1xwe s GLU 1575Cb -0.16 -0.51 -0.11 0.00 0.10 0.00 0.00 34.13 33.45 1xwe s GLU 1575CO 0.02 0.09 1.83 1.17 0.02 0.00 0.00 175.26 178.40 1xwe n LYS 1576N 0.92 2.48 -3.09 1.61 4.81 -1.26 -2.60 118.16 121.03 1xwe n LYS 1576Ca -0.19 0.90 -0.14 0.00 -0.87 0.00 0.00 58.31 58.02 1xwe n LYS 1576Cb 0.56 -2.77 0.06 0.00 0.02 0.00 0.00 35.03 32.91 1xwe n LYS 1576CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1xwe n ASP 1577N 5.94 -5.84 -4.79 3.14 2.03 -0.64 -5.04 116.55 111.35 1xwe n ASP 1577Ca 0.20 -0.63 -0.23 0.00 0.52 0.00 0.00 54.79 54.65 1xwe n ASP 1577Cb 0.34 -4.73 0.02 0.00 -0.72 0.00 0.00 41.12 36.03 1xwe n ASP 1577CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1xwe n SER 1578N -3.04 2.49 -4.64 1.67 7.64 -1.07 -4.84 113.62 111.84 1xwe n SER 1578Ca -0.08 -2.73 -0.35 0.00 1.01 0.00 0.00 58.87 56.73 1xwe n SER 1578Cb 0.61 -0.16 -0.10 0.00 -1.01 0.00 0.00 64.21 63.55 1xwe n SER 1578CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1xwe s GLU 1579N -4.32 3.99 0.02 1.43 2.56 -1.26 -2.10 118.70 119.02 1xwe s GLU 1579Ca 0.40 -0.33 0.02 0.00 0.00 0.00 0.00 54.97 55.06 1xwe s GLU 1579Cb -0.03 -3.25 -0.01 0.00 2.00 0.00 0.00 34.13 32.84 1xwe s GLU 1579CO 0.25 0.26 -0.07 0.96 -0.56 0.00 0.00 175.26 176.10 1xwe s ILE 1580N 0.42 0.50 -0.27 -3.70 -4.36 -1.12 -5.00 121.20 107.67 1xwe s ILE 1580Ca 0.04 -0.62 0.02 0.00 -0.26 0.00 0.00 60.65 59.83 1xwe s ILE 1580Cb -0.12 -0.49 0.07 0.00 1.25 0.00 0.00 42.46 43.17 1xwe s ILE 1580CO 0.00 -0.10 -0.03 -0.89 0.24 0.00 0.00 174.94 174.17 1xwe s THR 1581N -0.68 1.74 -0.05 8.37 2.01 -1.26 -2.22 115.64 123.55 1xwe s THR 1581Ca -0.03 -1.55 -0.29 0.00 0.31 0.00 0.00 61.69 60.13 1xwe s THR 1581Cb -0.06 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.37 1xwe s THR 1581CO 0.00 -0.25 0.97 -0.36 -0.69 0.00 0.00 174.62 174.29 1xwe s PHE 1582N 1.26 3.59 -0.31 4.92 0.40 -0.37 -2.15 117.98 125.32 1xwe s PHE 1582Ca -0.01 1.62 -0.05 0.00 -0.60 0.00 0.00 56.93 57.89 1xwe s PHE 1582Cb -0.19 -3.13 0.04 0.00 0.51 0.00 0.00 43.02 40.25 1xwe s PHE 1582CO -0.08 -0.10 0.06 -1.50 0.70 0.00 0.00 175.22 174.30 1xwe s ILE 1583N 1.42 3.49 -0.15 0.64 2.07 -0.24 -0.20 121.20 128.22 1xwe s ILE 1583Ca 0.49 -1.15 -0.00 0.00 -1.41 0.00 0.00 60.65 58.59 1xwe s ILE 1583Cb -0.20 -2.94 -0.01 0.00 0.13 0.00 0.00 42.46 39.44 1xwe s ILE 1583CO 0.23 -0.09 -0.14 -0.75 -1.91 0.00 0.00 174.94 172.28 1xwe s LYS 1584N 1.36 3.28 0.36 3.50 2.36 -0.63 -2.59 119.74 127.39 1xwe s LYS 1584Ca -0.02 -0.72 -0.27 0.00 -2.55 0.00 0.00 55.97 52.41 1xwe s LYS 1584Cb -0.19 -2.66 -0.09 0.00 -1.05 0.00 0.00 37.83 33.83 1xwe s LYS 1584CO 0.01 0.05 1.25 0.15 1.55 0.00 0.00 175.35 178.37 1xwe s LYS 1585N 0.74 4.21 0.55 4.03 1.02 -1.26 -2.09 119.74 126.94 1xwe s LYS 1585Ca -0.06 2.07 0.34 0.00 0.02 0.00 0.00 55.97 58.35 1xwe s LYS 1585Cb -0.15 -2.91 1.87 0.00 -0.52 0.00 0.00 37.83 36.11 1xwe s LYS 1585CO 0.01 -0.25 2.05 -0.24 -0.92 0.00 0.00 175.35 175.99 1xwe h VAL 1586N 2.73 0.00 -0.20 3.17 3.04 -1.95 -0.85 116.25 122.20 1xwe h VAL 1586Ca -0.49 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.08 1xwe h VAL 1586Cb 1.23 0.76 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 1xwe h VAL 1586CO 0.64 0.00 -0.41 0.71 -1.01 0.00 0.00 177.57 177.50 1xwe h THR 1587N 0.00 1.31 -1.72 3.17 1.35 -1.90 -3.42 112.91 111.70 1xwe h THR 1587Ca 0.00 -1.57 -0.54 0.00 -0.55 0.00 0.00 66.41 63.75 1xwe h THR 1587Cb 0.12 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 1xwe h THR 1587CO 0.00 0.49 1.56 0.00 -0.25 0.00 0.00 175.52 177.32 1xwe h THR 1589N 7.41 1.09 -0.06 0.00 2.02 -1.82 -3.30 112.91 118.24 1xwe h THR 1589Ca -0.32 -2.52 0.00 0.00 0.77 0.00 0.00 66.41 64.34 1xwe h THR 1589Cb 1.26 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 70.52 1xwe h THR 1589CO 1.06 0.79 0.00 0.59 0.37 0.00 0.00 175.52 178.33 1xwe n ASN 1590N -3.77 1.45 -3.95 4.18 3.02 -1.22 -4.67 115.26 110.30 1xwe n ASN 1590Ca -0.22 -2.09 -0.30 0.00 -0.03 0.00 0.00 54.58 51.94 1xwe n ASN 1590Cb 1.01 -0.51 -0.16 0.00 -0.61 0.00 0.00 39.78 39.51 1xwe n ASN 1590CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xwe s ALA 1591N -1.18 1.86 -0.29 5.41 0.00 -1.25 -3.12 121.76 123.20 1xwe s ALA 1591Ca 0.05 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 50.86 1xwe s ALA 1591Cb 0.04 -1.30 0.16 0.00 0.00 0.00 0.00 23.12 22.02 1xwe s ALA 1591CO 0.02 -0.95 0.42 -2.00 0.00 0.00 0.00 175.76 173.25 1xwe s GLU 1592N 1.45 0.42 0.30 0.00 2.12 -1.26 -4.94 118.70 116.80 1xwe s GLU 1592Ca -0.02 0.20 -0.05 0.00 0.36 0.00 0.00 54.97 55.46 1xwe s GLU 1592Cb -0.17 -0.26 -0.05 0.00 0.26 0.00 0.00 34.13 33.91 1xwe s GLU 1592CO -0.07 -1.00 0.57 -0.51 -0.54 0.00 0.00 175.26 173.70 1xwe s LEU 1593N 2.57 4.03 -0.01 2.70 1.02 -1.26 -5.11 118.68 122.63 1xwe s LEU 1593Ca 0.10 0.72 0.01 0.00 0.02 0.00 0.00 54.13 54.97 1xwe s LEU 1593Cb -0.12 -3.54 0.01 0.00 0.02 0.00 0.00 46.19 42.55 1xwe s LEU 1593CO -0.29 -0.22 -0.02 0.54 0.02 0.00 0.00 176.35 176.38 1xwe s VAL 1594N -2.13 0.17 0.71 -1.59 0.11 -1.26 -5.11 120.40 111.30 1xwe s VAL 1594Ca 0.44 -0.05 -0.14 0.00 -2.93 0.00 0.00 61.98 59.31 1xwe s VAL 1594Cb -0.11 -0.18 0.03 0.00 -1.53 0.00 0.00 36.38 34.59 1xwe s VAL 1594CO 0.31 0.07 1.12 -1.59 -3.33 0.00 0.00 175.10 171.69 1xwe s LYS 1595N 0.22 2.46 0.00 1.54 -2.85 -1.26 -3.57 119.74 116.28 1xwe s LYS 1595Ca -0.02 1.41 0.00 0.00 -1.00 0.00 0.00 55.97 56.36 1xwe s LYS 1595Cb -0.04 -1.91 0.00 0.00 -2.06 0.00 0.00 37.83 33.82 1xwe s LYS 1595CO -0.01 -1.52 0.00 0.41 0.10 0.00 0.00 175.35 174.34 1xwe n GLY 1596N -0.49 0.84 3.50 0.59 0.00 -1.11 -5.00 105.19 103.53 1xwe n GLY 1596Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1xwe n GLY 1596CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xwe s ARG 1597N -0.48 1.73 0.03 1.61 0.52 -1.23 -5.00 118.95 116.13 1xwe s ARG 1597Ca 0.00 -1.89 0.05 0.00 -0.52 0.00 0.00 55.73 53.37 1xwe s ARG 1597Cb 0.00 -1.48 -0.03 0.00 0.52 0.00 0.00 34.95 33.96 1xwe s ARG 1597CO 0.00 0.08 -0.11 -0.65 0.02 0.00 0.00 175.30 174.64 1xwe s GLN 1598N -3.67 2.33 0.02 3.54 -0.21 -1.26 -1.82 119.66 118.59 1xwe s GLN 1598Ca 0.32 -0.86 -0.00 0.00 0.02 0.00 0.00 55.36 54.84 1xwe s GLN 1598Cb 0.04 -2.37 -0.02 0.00 1.00 0.00 0.00 33.01 31.66 1xwe s GLN 1598CO 0.15 0.57 -0.03 0.71 -2.12 0.00 0.00 175.29 174.56 1xwe s TYR 1599N -1.01 0.28 -0.18 0.91 2.02 -0.89 -2.27 117.35 116.22 1xwe s TYR 1599Ca 0.17 -0.56 -0.11 0.00 -0.37 0.00 0.00 57.07 56.20 1xwe s TYR 1599Cb -0.11 -0.20 -0.05 0.00 -0.40 0.00 0.00 41.96 41.20 1xwe s TYR 1599CO 0.08 -0.20 0.18 -1.17 -1.57 0.00 0.00 175.55 172.87 1xwe s LEU 1600N -1.55 4.24 -0.08 -1.29 2.96 -0.19 -1.79 118.68 120.97 1xwe s LEU 1600Ca -0.14 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.15 1xwe s LEU 1600Cb -0.09 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 1xwe s LEU 1600CO -0.02 0.19 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.35 1xwe s ILE 1601N 0.22 2.27 -0.21 6.68 1.09 -0.41 -2.00 121.20 128.84 1xwe s ILE 1601Ca 0.11 -0.97 -0.04 0.00 -1.10 0.00 0.00 60.65 58.66 1xwe s ILE 1601Cb -0.12 -1.86 0.10 0.00 -1.06 0.00 0.00 42.46 39.52 1xwe s ILE 1601CO 0.00 0.56 0.28 -0.04 -0.10 0.00 0.00 174.94 175.65 1xwe s MET 1602N 0.06 0.24 0.00 2.79 -1.94 -0.67 -1.90 119.30 117.88 1xwe s MET 1602Ca -0.09 0.39 0.00 0.00 -1.71 0.00 0.00 55.69 54.28 1xwe s MET 1602Cb -0.15 -0.81 0.00 0.00 2.01 0.00 0.00 34.83 35.87 1xwe s MET 1602CO 0.06 -0.61 0.00 0.41 -0.01 0.00 0.00 175.02 174.87 1xwe n GLY 1603N 5.34 -1.27 3.43 -0.03 0.00 -0.98 -1.12 105.19 110.56 1xwe n GLY 1603Ca -0.05 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 1xwe n GLY 1603CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xwe n LYS 1604N -0.02 0.03 -0.95 1.61 4.76 0.26 -0.16 118.16 123.68 1xwe n LYS 1604Ca 0.00 0.06 -0.30 0.00 -2.87 0.00 0.00 58.31 55.19 1xwe n LYS 1604Cb 0.00 -1.83 0.15 0.00 -1.84 0.00 0.00 35.03 31.51 1xwe n LYS 1604CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1xwe s GLU 1605N -3.16 1.11 0.55 1.97 -1.05 -1.26 -4.63 118.70 112.24 1xwe s GLU 1605Ca 0.61 1.16 -0.20 0.00 -0.15 0.00 0.00 54.97 56.38 1xwe s GLU 1605Cb -0.28 -1.77 -0.05 0.00 -0.44 0.00 0.00 34.13 31.60 1xwe s GLU 1605CO 0.63 -2.44 1.24 0.00 0.95 0.00 0.00 175.26 175.64 1xwe s ALA 1606N -2.76 2.71 1.08 -0.84 0.00 -1.26 -4.95 121.76 115.74 1xwe s ALA 1606Ca 0.65 1.09 -0.07 0.00 0.00 0.00 0.00 51.96 53.63 1xwe s ALA 1606Cb -0.20 -3.47 0.10 0.00 0.00 0.00 0.00 23.12 19.55 1xwe s ALA 1606CO 0.58 -1.12 0.38 1.28 0.00 0.00 0.00 175.76 176.88 1xwe n LEU 1607N -1.20 0.00 -4.40 0.00 4.77 -0.50 -4.78 117.00 110.89 1xwe n LEU 1607Ca 0.11 -0.41 -0.20 0.00 -0.03 0.00 0.00 56.01 55.48 1xwe n LEU 1607Cb 0.48 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 1xwe n LEU 1607CO 0.47 -1.36 -0.25 -1.58 -1.33 0.00 0.00 177.39 173.34 1xwe s GLN 1608N -3.87 1.60 0.00 3.23 0.74 -1.26 -3.83 119.66 116.27 1xwe s GLN 1608Ca 0.25 -1.90 0.00 0.00 0.05 0.00 0.00 55.36 53.76 1xwe s GLN 1608Cb -0.02 -0.53 0.00 0.00 1.10 0.00 0.00 33.01 33.56 1xwe s GLN 1608CO 0.19 -0.30 0.00 0.44 -0.55 0.00 0.00 175.29 175.07 1xwe n ILE 1609N -0.63 -1.86 0.00 -2.34 -0.00 -1.26 -4.87 119.36 108.40 1xwe n ILE 1609Ca -0.02 0.43 0.00 0.00 -0.00 0.00 0.00 62.75 63.17 1xwe n ILE 1609Cb 0.66 -2.91 0.00 0.00 -0.00 0.00 0.00 39.64 37.39 1xwe n ILE 1609CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1xwe n LYS 1610N 1.43 0.00 0.00 6.28 0.00 -1.23 -4.76 118.16 119.88 1xwe n LYS 1610Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 1xwe n LYS 1610Cb 0.43 -0.34 0.00 0.00 0.00 0.00 0.00 35.03 35.12 1xwe n LYS 1610CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1xwe n TYR 1611N -0.55 0.00 -1.68 5.64 9.36 -1.26 -4.91 117.16 123.76 1xwe n TYR 1611Ca 0.00 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.79 1xwe n TYR 1611Cb 0.00 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 38.68 1xwe n TYR 1611CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1xwe n ASN 1612N -0.31 3.89 0.00 2.98 5.15 -1.26 -4.19 115.26 121.52 1xwe n ASN 1612Ca 0.00 0.99 0.00 0.00 -0.60 0.00 0.00 54.58 54.97 1xwe n ASN 1612Cb 0.00 -1.51 0.00 0.00 -0.53 0.00 0.00 39.78 37.74 1xwe n ASN 1612CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xwe n ALA 1613N 5.68 0.00 0.00 5.20 0.00 -1.26 -1.77 120.51 128.36 1xwe n ALA 1613Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1xwe n ALA 1613Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1xwe n ALA 1613CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xwe n SER 1614N 1.83 0.00 -3.58 0.00 2.88 -1.26 -5.14 113.62 108.36 1xwe n SER 1614Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 1xwe n SER 1614Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1xwe n SER 1614CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1xwe s PHE 1615N -0.70 -0.20 -0.30 0.66 -0.71 -0.73 -4.68 117.98 111.33 1xwe s PHE 1615Ca 0.00 0.18 -0.02 0.00 -1.04 0.00 0.00 56.93 56.04 1xwe s PHE 1615Cb 0.00 0.51 0.19 0.00 -1.21 0.00 0.00 43.02 42.51 1xwe s PHE 1615CO 0.00 -0.28 0.68 0.50 -1.34 0.00 0.00 175.22 174.78 1xwe s ARG 1616N -2.29 0.50 -0.26 1.99 6.06 -1.26 -4.70 118.95 118.99 1xwe s ARG 1616Ca 0.07 0.81 -0.28 0.00 -2.50 0.00 0.00 55.73 53.83 1xwe s ARG 1616Cb -0.01 0.44 -0.06 0.00 0.06 0.00 0.00 34.95 35.38 1xwe s ARG 1616CO -0.05 -0.61 2.25 0.66 -2.50 0.00 0.00 175.30 175.05 1xwe n TYR 1617N 5.43 1.88 -4.42 5.12 4.02 -1.26 -3.53 117.16 124.40 1xwe n TYR 1617Ca -0.01 -0.08 -0.24 0.00 -0.01 0.00 0.00 57.90 57.56 1xwe n TYR 1617Cb 0.52 -2.71 -0.09 0.00 -0.02 0.00 0.00 39.34 37.04 1xwe n TYR 1617CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1xwe s ILE 1618N 8.75 2.71 -0.33 -0.72 -4.36 -1.25 -4.78 121.20 121.22 1xwe s ILE 1618Ca 1.01 -2.20 -0.05 0.00 -0.26 0.00 0.00 60.65 59.15 1xwe s ILE 1618Cb -0.34 -2.55 0.05 0.00 1.25 0.00 0.00 42.46 40.86 1xwe s ILE 1618CO 0.35 -0.34 0.08 -0.31 0.24 0.00 0.00 174.94 174.96 1xwe s TYR 1619N -2.48 3.27 1.17 1.37 1.51 -0.91 -1.40 117.35 119.87 1xwe s TYR 1619Ca 0.31 -1.57 -0.19 0.00 -1.01 0.00 0.00 57.07 54.61 1xwe s TYR 1619Cb -0.04 -2.28 0.28 0.00 -0.11 0.00 0.00 41.96 39.81 1xwe s TYR 1619CO 0.17 -0.76 1.17 -1.25 -1.11 0.00 0.00 175.55 173.77 1xwe s PRO 1620N 1.36 -0.96 -0.31 -1.71 0.04 -1.26 -1.08 135.00 131.08 1xwe s PRO 1620Ca -0.02 -0.23 -0.02 0.00 0.04 0.00 0.00 61.00 60.77 1xwe s PRO 1620Cb -0.20 -1.64 0.12 0.00 0.04 0.00 0.00 34.50 32.82 1xwe s PRO 1620CO 0.02 -3.51 0.22 -0.51 0.04 0.00 0.00 177.00 173.26 1xwe s LEU 1621N -6.73 0.26 0.00 -3.56 1.43 -1.07 -4.68 118.68 104.33 1xwe s LEU 1621Ca 0.73 -1.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1xwe s LEU 1621Cb -0.07 0.04 0.00 0.00 0.03 0.00 0.00 46.19 46.19 1xwe s LEU 1621CO 0.55 -0.39 0.00 0.47 0.23 0.00 0.00 176.35 177.21 1xwe n ASP 1622N 5.02 1.91 -0.04 2.29 8.00 -1.26 -4.25 116.55 128.23 1xwe n ASP 1622Ca -0.01 -0.29 0.10 0.00 0.71 0.00 0.00 54.79 55.31 1xwe n ASP 1622Cb 0.43 0.00 0.58 0.00 -0.02 0.00 0.00 41.12 42.12 1xwe n ASP 1622CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1xwe n SER 1623N -0.31 0.12 -0.00 -2.24 3.41 -1.26 -1.53 113.62 111.80 1xwe n SER 1623Ca 0.00 -1.39 0.08 0.00 -0.26 0.00 0.00 58.87 57.30 1xwe n SER 1623Cb 0.00 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1xwe n SER 1623CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xwe n LEU 1624N -0.74 0.67 -4.75 1.04 -0.00 -1.26 -4.90 117.00 107.06 1xwe n LEU 1624Ca 0.15 -0.41 -0.40 0.00 -0.00 0.00 0.00 56.01 55.36 1xwe n LEU 1624Cb 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.46 1xwe n LEU 1624CO 0.11 0.17 0.42 -0.89 -0.00 0.00 0.00 177.39 177.20 1xwe s THR 1625N -2.76 4.81 -0.36 1.47 2.01 -1.16 -4.68 115.64 114.96 1xwe s THR 1625Ca 0.04 1.52 -0.15 0.00 0.31 0.00 0.00 61.69 63.41 1xwe s THR 1625Cb 0.13 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 1xwe s THR 1625CO 0.72 0.37 0.32 0.86 -0.69 0.00 0.00 174.62 176.19 1xwe s TRP 1626N 0.00 3.22 -0.24 4.92 -0.11 -0.28 -4.80 118.94 121.65 1xwe s TRP 1626Ca 0.37 -0.21 0.02 0.00 1.22 0.00 0.00 56.10 57.49 1xwe s TRP 1626Cb -0.20 -2.61 0.05 0.00 -1.50 0.00 0.00 33.47 29.22 1xwe s TRP 1626CO 0.21 -0.46 -0.10 0.42 -4.62 0.00 0.00 176.95 172.40 1xwe s ILE 1627N 1.87 1.90 -0.18 5.86 1.01 -1.25 -1.67 121.20 128.75 1xwe s ILE 1627Ca 0.09 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.38 1xwe s ILE 1627Cb -0.17 -2.02 0.04 0.00 0.01 0.00 0.00 42.46 40.32 1xwe s ILE 1627CO 0.11 0.03 -0.08 -0.70 0.00 0.00 0.00 174.94 174.31 1xwe s GLU 1628N 1.25 1.71 0.26 2.79 -6.30 -0.85 -3.08 118.70 114.48 1xwe s GLU 1628Ca -0.06 -0.64 -0.30 0.00 -2.50 0.00 0.00 54.97 51.48 1xwe s GLU 1628Cb -0.18 -2.16 -0.13 0.00 0.00 0.00 0.00 34.13 31.65 1xwe s GLU 1628CO -0.06 -0.41 1.30 0.98 0.02 0.00 0.00 175.26 177.08 1xwe n TYR 1629N 4.80 1.98 -3.40 5.30 9.36 -1.26 -1.02 117.16 132.91 1xwe n TYR 1629Ca -0.13 0.52 -0.44 0.00 3.32 0.00 0.00 57.90 61.17 1xwe n TYR 1629Cb 0.47 -2.40 -0.06 0.00 -0.63 0.00 0.00 39.34 36.72 1xwe n TYR 1629CO 0.00 0.00 0.00 -0.46 0.22 0.00 0.00 176.86 176.62 1xwe s TRP 1630N -0.43 3.31 -0.22 2.98 -0.11 -0.96 -4.83 118.94 118.67 1xwe s TRP 1630Ca 0.65 -1.44 -0.39 0.00 1.22 0.00 0.00 56.10 56.13 1xwe s TRP 1630Cb -0.66 -3.62 -0.16 0.00 -1.50 0.00 0.00 33.47 27.53 1xwe s TRP 1630CO 0.54 -0.99 1.69 -2.30 -4.62 0.00 0.00 176.95 171.27 1xwe n PRO 1631N 5.13 1.19 -0.75 5.86 -0.02 -1.26 -4.63 135.00 140.51 1xwe n PRO 1631Ca -0.12 0.43 0.01 0.00 -2.02 0.00 0.00 63.50 61.81 1xwe n PRO 1631Cb 0.41 -2.12 0.28 0.00 -0.02 0.00 0.00 33.50 32.05 1xwe n PRO 1631CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xwe n ARG 1632N 4.98 3.66 -4.90 -0.52 1.74 -1.26 -4.87 116.66 115.49 1xwe n ARG 1632Ca 0.25 -2.43 -0.28 0.00 -0.77 0.00 0.00 57.85 54.62 1xwe n ARG 1632Cb 0.14 -2.07 -0.17 0.00 -1.02 0.00 0.00 32.46 29.35 1xwe n ARG 1632CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1xwe s ASP 1633N -0.63 2.40 0.00 0.55 1.01 -1.26 -4.98 116.67 113.76 1xwe s ASP 1633Ca 0.43 -0.42 0.00 0.00 0.71 0.00 0.00 52.55 53.27 1xwe s ASP 1633Cb 0.33 -1.00 0.00 0.00 1.01 0.00 0.00 42.92 43.27 1xwe s ASP 1633CO 0.12 0.11 0.38 0.35 0.21 0.00 0.00 175.17 176.34 1xwe n THR 1634N 3.53 0.06 0.35 -1.27 -2.24 -1.26 -4.64 114.28 108.81 1xwe n THR 1634Ca -0.20 -0.07 -0.18 0.00 -2.27 0.00 0.00 64.05 61.33 1xwe n THR 1634Cb 0.52 1.27 -0.09 0.00 -2.10 0.00 0.00 70.33 69.93 1xwe n THR 1634CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1xwe h THR 1635N 2.16 0.21 -3.89 4.28 1.35 -1.93 -3.43 112.91 111.67 1xwe h THR 1635Ca 0.00 0.00 -0.51 0.00 -0.55 0.00 0.00 66.41 65.35 1xwe h THR 1635Cb 0.80 0.21 0.04 0.00 -1.73 0.00 0.00 68.15 67.48 1xwe h THR 1635CO 0.00 0.00 0.52 0.00 -0.25 0.00 0.00 175.52 175.79 1xwe h SER 1637N 3.13 0.71 0.51 0.00 4.64 -2.01 -1.16 113.55 119.37 1xwe h SER 1637Ca -0.48 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 1xwe h SER 1637Cb 1.23 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1xwe h SER 1637CO 0.64 0.67 -0.05 -1.20 -0.87 0.00 0.00 176.83 176.03 1xwe n SER 1638N -4.31 0.16 -0.79 4.97 7.64 -1.26 -3.04 113.62 116.98 1xwe n SER 1638Ca 0.04 -0.28 0.11 0.00 1.01 0.00 0.00 58.87 59.75 1xwe n SER 1638Cb 0.19 -0.21 0.30 0.00 -1.01 0.00 0.00 64.21 63.48 1xwe n SER 1638CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xwe n GLN 1640N 0.80 0.81 0.29 0.00 6.02 -1.17 -4.53 117.38 119.59 1xwe n GLN 1640Ca 0.17 -0.69 0.17 0.00 -0.01 0.00 0.00 57.00 56.65 1xwe n GLN 1640Cb 0.44 -1.04 0.87 0.00 1.02 0.00 0.00 30.24 31.53 1xwe n GLN 1640CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xwe h ALA 1641N 1.04 1.15 0.00 -1.58 0.00 -1.70 -0.61 119.26 117.55 1xwe h ALA 1641Ca 0.00 -0.05 -0.36 0.00 0.00 0.00 0.00 54.91 54.51 1xwe h ALA 1641Cb 0.22 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 1xwe h ALA 1641CO 0.00 0.06 -2.26 0.34 0.00 0.00 0.00 179.25 177.39 1xwe n PHE 1642N -3.36 0.20 1.01 0.00 7.35 -1.26 -4.18 117.46 117.22 1xwe n PHE 1642Ca -0.02 0.07 0.06 0.00 -0.76 0.00 0.00 57.45 56.81 1xwe n PHE 1642Cb 0.20 -1.04 0.20 0.00 0.35 0.00 0.00 39.48 39.19 1xwe n PHE 1642CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1xwe n LEU 1643N -2.83 1.73 -0.01 -2.13 4.77 -0.98 -3.69 117.00 113.86 1xwe n LEU 1643Ca -0.30 -0.84 -0.07 0.00 -0.03 0.00 0.00 56.01 54.77 1xwe n LEU 1643Cb 1.13 -0.20 -0.13 0.00 -2.33 0.00 0.00 43.42 41.90 1xwe n LEU 1643CO 0.43 0.42 -0.50 0.00 -1.33 0.00 0.00 177.39 176.41 1xwe n ALA 1644N 0.43 1.60 0.08 -1.18 0.00 -0.27 -3.79 120.51 117.37 1xwe n ALA 1644Ca 0.12 -0.74 -0.15 0.00 0.00 0.00 0.00 53.44 52.68 1xwe n ALA 1644Cb 0.29 -0.85 -0.14 0.00 0.00 0.00 0.00 19.45 18.75 1xwe n ALA 1644CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1xwe h ASN 1645N 0.00 0.34 -0.06 0.00 2.35 -1.79 -3.29 115.58 113.13 1xwe h ASN 1645Ca -0.27 -0.41 -0.03 0.00 -0.55 0.00 0.00 56.30 55.04 1xwe h ASN 1645Cb 1.92 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 40.17 1xwe h ASN 1645CO 0.07 1.33 -0.04 -0.07 -1.65 0.00 0.00 177.43 177.08 1xwe h LEU 1646N 0.06 0.23 -0.51 1.61 3.38 -1.72 -2.00 115.31 116.36 1xwe h LEU 1646Ca -0.17 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xwe h LEU 1646Cb 1.97 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 42.63 1xwe h LEU 1646CO 0.17 0.31 0.33 -0.78 0.09 0.00 0.00 178.44 178.56 1xwe h ASP 1647N 0.25 0.60 -0.36 -0.43 1.82 -1.66 -0.55 116.42 116.09 1xwe h ASP 1647Ca 0.06 -0.04 -0.14 0.00 -0.39 0.00 0.00 57.03 56.53 1xwe h ASP 1647Cb 0.23 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.08 1xwe h ASP 1647CO 0.01 0.46 -0.28 -0.08 -1.61 0.00 0.00 179.24 177.73 1xwe h GLU 1648N 0.69 0.88 0.00 0.28 4.57 -1.57 -2.81 114.58 116.62 1xwe h GLU 1648Ca 0.19 -0.40 -0.04 0.00 -1.18 0.00 0.00 59.36 57.93 1xwe h GLU 1648Cb -0.05 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 1xwe h GLU 1648CO -0.04 1.04 -0.17 0.35 -1.18 0.00 0.00 179.01 179.01 1xwe h PHE 1649N 0.74 0.00 0.69 0.92 3.57 -0.97 -1.14 116.94 120.75 1xwe h PHE 1649Ca 0.09 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1xwe h PHE 1649Cb 0.84 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.59 1xwe h PHE 1649CO 0.05 0.17 -0.33 0.00 -2.23 0.00 0.00 178.31 175.97 1xwe h ALA 1650N 1.83 -1.24 0.00 2.41 0.00 -0.83 -2.70 119.26 118.73 1xwe h ALA 1650Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1xwe h ALA 1650Cb 0.32 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1xwe h ALA 1650CO 0.02 -1.17 0.00 1.49 0.00 0.00 0.00 179.25 179.59 1xwe h GLU 1651N -0.93 0.00 0.00 0.00 4.81 -1.57 -2.73 114.58 114.17 1xwe h GLU 1651Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1xwe h GLU 1651Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 1xwe h GLU 1651CO 0.15 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.96 1xwe n ASP 1652N -2.45 0.00 0.22 1.04 -0.08 -0.44 -1.17 116.55 113.67 1xwe n ASP 1652Ca 0.02 0.79 0.07 0.00 -1.51 0.00 0.00 54.79 54.16 1xwe n ASP 1652Cb 0.25 -0.42 0.60 0.00 2.34 0.00 0.00 41.12 43.90 1xwe n ASP 1652CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1xwe h ILE 1653N 0.00 1.02 -0.29 5.18 6.09 -1.57 0.39 117.51 128.33 1xwe h ILE 1653Ca 0.00 -0.04 -0.08 0.00 -1.37 0.00 0.00 64.86 63.37 1xwe h ILE 1653Cb 0.00 0.92 -0.02 0.00 0.47 0.00 0.00 36.82 38.20 1xwe h ILE 1653CO 0.00 0.02 -0.16 0.15 -3.07 0.00 0.00 178.15 175.09 1xwe h PHE 1654N 0.09 0.54 0.00 2.19 3.57 -1.52 -3.06 116.94 118.76 1xwe h PHE 1654Ca 0.02 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1xwe h PHE 1654Cb -0.01 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1xwe h PHE 1654CO 0.00 0.64 0.00 -0.11 -2.23 0.00 0.00 178.31 176.61 1xwe n LEU 1655N -4.18 0.00 -1.46 0.59 0.00 -0.32 -4.73 117.00 106.91 1xwe n LEU 1655Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 56.01 55.99 1xwe n LEU 1655Cb 0.35 -0.07 0.01 0.00 0.00 0.00 0.00 43.42 43.71 1xwe n LEU 1655CO 0.41 -0.13 0.93 -0.46 0.00 0.00 0.00 177.39 178.14 1xwe n ASN 1656N -1.58 4.97 -4.65 1.96 0.23 0.13 -4.92 115.26 111.39 1xwe n ASN 1656Ca 0.00 -2.42 -0.47 0.00 -0.53 0.00 0.00 54.58 51.16 1xwe n ASN 1656Cb 0.00 -0.99 -0.04 0.00 -2.08 0.00 0.00 39.78 36.67 1xwe n ASN 1656CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xwe n GLY 1657N 1.11 1.42 0.00 4.83 0.00 -0.68 -4.67 105.19 107.20 1xwe n GLY 1657Ca 0.05 0.85 0.01 0.00 0.00 0.00 0.00 46.02 46.93 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32