#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 0.39 -0.30 1.61 0.01 -1.26 -5.13 113.70 109.02 1xwe s SER 1509Ca 0.00 -0.85 -0.20 0.00 1.31 0.00 0.00 55.95 56.21 1xwe s SER 1509Cb 0.00 0.20 -0.01 0.00 0.21 0.00 0.00 66.02 66.42 1xwe s SER 1509CO 0.00 -0.56 0.59 -1.00 0.41 0.00 0.00 173.24 172.68 1xwe s HIS 1510N -3.46 3.22 0.39 2.43 0.09 -1.26 -5.06 115.29 111.64 1xwe s HIS 1510Ca 0.03 0.56 0.05 0.00 -0.00 0.00 0.00 55.06 55.70 1xwe s HIS 1510Cb 0.04 -2.92 0.07 0.00 -0.00 0.00 0.00 32.58 29.77 1xwe s HIS 1510CO -0.08 -0.44 0.53 0.00 -0.00 0.00 0.00 174.74 174.75 1xwe n MET 1511N 5.79 0.66 -3.93 1.40 -0.00 -1.26 -5.13 117.12 114.64 1xwe n MET 1511Ca -0.02 -1.96 -0.09 0.00 -0.00 0.00 0.00 57.70 55.63 1xwe n MET 1511Cb 0.49 -0.19 -0.07 0.00 -0.00 0.00 0.00 33.22 33.44 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 -2.53 -0.01 -0.40 3.17 0.00 -1.26 -5.04 121.76 115.70 1xwe s ALA 1512Ca 0.39 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.58 1xwe s ALA 1512Cb -0.03 0.66 0.40 0.00 0.00 0.00 0.00 23.12 24.15 1xwe s ALA 1512CO 0.25 -0.56 1.36 -0.40 0.00 0.00 0.00 175.76 176.42 1xwe n ASP 1513N -0.12 3.50 -4.45 0.00 5.75 -1.26 -3.82 116.55 116.14 1xwe n ASP 1513Ca -0.11 -2.72 -0.48 0.00 -0.01 0.00 0.00 54.79 51.47 1xwe n ASP 1513Cb 0.63 -0.65 -0.08 0.00 -1.03 0.00 0.00 41.12 39.99 1xwe n ASP 1513CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xwe n GLY 1515N 6.52 0.91 3.41 0.00 0.00 0.16 -3.66 105.19 112.54 1xwe n GLY 1515Ca 0.44 -0.63 -0.48 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.52 0.12 -3.36 1.61 7.27 0.10 -4.41 117.38 118.19 1xwe n GLN 1516Ca 0.00 0.02 -0.38 0.00 0.07 0.00 0.00 57.00 56.70 1xwe n GLN 1516Cb 0.48 -1.65 -0.07 0.00 2.41 0.00 0.00 30.24 31.40 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 7.78 4.17 1.09 3.69 -1.94 -1.26 -4.42 119.30 128.41 1xwe s MET 1517Ca 1.27 0.23 -0.13 0.00 -1.71 0.00 0.00 55.69 55.36 1xwe s MET 1517Cb -1.26 -3.55 0.24 0.00 2.01 0.00 0.00 34.83 32.27 1xwe s MET 1517CO 0.54 -0.07 1.06 -0.65 -0.01 0.00 0.00 175.02 175.89 1xwe s GLN 1518N 1.41 -0.29 1.00 2.03 -1.52 -1.14 -5.01 119.66 116.13 1xwe s GLN 1518Ca 0.20 0.62 -0.12 0.00 -1.95 0.00 0.00 55.36 54.10 1xwe s GLN 1518Cb -0.15 -1.64 0.19 0.00 -0.22 0.00 0.00 33.01 31.18 1xwe s GLN 1518CO 0.08 -3.24 1.09 -1.21 -0.25 0.00 0.00 175.29 171.76 1xwe s GLU 1519N -4.74 0.45 -0.15 2.91 0.41 -1.26 -4.81 118.70 111.50 1xwe s GLU 1519Ca 0.67 0.62 -0.04 0.00 -0.41 0.00 0.00 54.97 55.81 1xwe s GLU 1519Cb -0.21 -1.73 -0.03 0.00 -1.78 0.00 0.00 34.13 30.37 1xwe s GLU 1519CO 0.61 -2.74 -0.02 -1.21 -0.49 0.00 0.00 175.26 171.40 1xwe s GLU 1520N -4.90 3.65 -0.28 1.61 2.02 -1.26 -4.75 118.70 114.78 1xwe s GLU 1520Ca 0.65 -0.48 -0.04 0.00 0.02 0.00 0.00 54.97 55.11 1xwe s GLU 1520Cb -0.19 -2.94 0.01 0.00 0.10 0.00 0.00 34.13 31.10 1xwe s GLU 1520CO 0.58 0.30 0.13 1.28 0.02 0.00 0.00 175.26 177.57 1xwe n LEU 1521N 3.39 -7.04 -3.39 1.80 4.77 -1.26 -5.04 117.00 110.23 1xwe n LEU 1521Ca -0.17 1.05 -0.15 0.00 -0.03 0.00 0.00 56.01 56.71 1xwe n LEU 1521Cb 0.53 -2.99 -0.09 0.00 -2.33 0.00 0.00 43.42 38.53 1xwe n LEU 1521CO 0.33 -2.65 -0.15 -1.81 -1.33 0.00 0.00 177.39 171.78 1xwe s ASP 1522N -1.68 1.27 -0.70 -1.43 1.11 -1.26 -5.06 116.67 108.92 1xwe s ASP 1522Ca 0.06 -0.51 -0.26 0.00 0.18 0.00 0.00 52.55 52.02 1xwe s ASP 1522Cb -0.01 0.66 -0.02 0.00 1.07 0.00 0.00 42.92 44.61 1xwe s ASP 1522CO 0.66 -0.36 1.83 -0.76 1.18 0.00 0.00 175.17 177.72 1xwe s LEU 1523N 2.41 3.26 0.00 1.23 1.43 -1.26 -3.98 118.68 121.76 1xwe s LEU 1523Ca 0.09 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 1xwe s LEU 1523Cb -0.14 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.54 1xwe s LEU 1523CO -0.28 -2.41 0.00 1.07 0.23 0.00 0.00 176.35 174.96 1xwe n THR 1524N 7.31 0.00 -3.31 5.49 5.66 -1.26 -5.08 114.28 123.09 1xwe n THR 1524Ca 0.24 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.80 1xwe n THR 1524Cb 0.51 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.21 1xwe n THR 1524CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1xwe s ILE 1525N -0.24 5.10 0.99 1.09 1.01 -1.26 -5.06 121.20 122.83 1xwe s ILE 1525Ca 0.00 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 1xwe s ILE 1525Cb 0.00 -4.18 0.18 0.00 0.01 0.00 0.00 42.46 38.48 1xwe s ILE 1525CO 0.00 -0.64 1.09 -0.94 0.00 0.00 0.00 174.94 174.45 1xwe s SER 1526N 2.56 2.47 0.00 3.58 1.04 -1.26 -4.88 113.70 117.21 1xwe s SER 1526Ca 0.08 1.76 0.16 0.00 0.48 0.00 0.00 55.95 58.43 1xwe s SER 1526Cb -0.22 -2.37 0.71 0.00 0.10 0.00 0.00 66.02 64.24 1xwe s SER 1526CO 0.09 -3.31 1.50 0.00 0.98 0.00 0.00 173.24 172.50 1xwe n ALA 1527N -4.34 1.77 -0.06 5.32 0.00 -1.26 -2.48 120.51 119.46 1xwe n ALA 1527Ca 0.07 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.35 1xwe n ALA 1527Cb 0.54 -1.26 -0.15 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.44 0.67 0.02 0.00 1.02 -1.26 -3.38 120.64 116.26 1xwe n GLU 1528Ca 0.05 0.16 0.02 0.00 -0.02 0.00 0.00 57.16 57.37 1xwe n GLU 1528Cb 0.17 -1.66 0.36 0.00 -0.02 0.00 0.00 31.44 30.30 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 0.01 1.16 0.21 2.62 2.02 -1.84 -1.25 112.91 115.83 1xwe h THR 1529Ca -0.42 -0.55 -0.34 0.00 0.77 0.00 0.00 66.41 65.86 1xwe h THR 1529Cb 2.11 0.83 0.02 0.00 -1.74 0.00 0.00 68.15 69.36 1xwe h THR 1529CO 0.05 0.20 -1.63 0.03 0.37 0.00 0.00 175.52 174.54 1xwe h ARG 1530N 0.47 0.43 -0.43 6.66 3.08 -1.73 -3.31 114.38 119.55 1xwe h ARG 1530Ca 0.11 -0.74 0.01 0.00 0.07 0.00 0.00 59.98 59.43 1xwe h ARG 1530Cb 0.19 0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1xwe h ARG 1530CO -0.00 1.36 0.27 -0.22 -1.07 0.00 0.00 179.97 180.31 1xwe h LYS 1531N 0.08 0.54 -0.08 0.04 3.64 -1.52 -0.17 116.57 119.10 1xwe h LYS 1531Ca -0.31 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.06 1xwe h LYS 1531Cb 2.09 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.79 1xwe h LYS 1531CO 0.20 0.36 0.11 1.96 -2.27 0.00 0.00 179.45 179.81 1xwe h GLN 1532N 0.56 0.00 0.00 1.90 4.20 -1.37 0.16 115.11 120.56 1xwe h GLN 1532Ca 0.16 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.69 1xwe h GLN 1532Cb -0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 1xwe h GLN 1532CO -0.05 0.00 -1.18 1.15 -0.67 0.00 0.00 178.83 178.08 1xwe h THR 1533N 0.00 0.82 -0.30 -0.54 2.02 -1.22 -2.92 112.91 110.76 1xwe h THR 1533Ca 0.04 -2.37 -0.02 0.00 0.77 0.00 0.00 66.41 64.83 1xwe h THR 1533Cb 0.26 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 1xwe h THR 1533CO -0.00 0.46 0.11 0.00 0.37 0.00 0.00 175.52 176.47 1xwe h ALA 1534N 1.31 0.40 -0.14 6.16 0.00 0.98 -2.53 119.26 125.44 1xwe h ALA 1534Ca -0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1xwe h ALA 1534Cb 1.63 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1xwe h ALA 1534CO 0.07 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.33 1xwe n LYS 1536N 0.44 2.34 0.34 0.00 4.81 -0.95 -4.85 118.16 120.28 1xwe n LYS 1536Ca 0.17 0.82 0.19 0.00 -0.87 0.00 0.00 58.31 58.62 1xwe n LYS 1536Cb 0.38 -2.53 1.01 0.00 0.02 0.00 0.00 35.03 33.91 1xwe n LYS 1536CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1xwe h PRO 1537N 2.59 0.00 0.00 1.64 0.13 -1.89 0.18 132.00 134.64 1xwe h PRO 1537Ca -0.49 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1xwe h PRO 1537Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1xwe h PRO 1537CO 0.62 0.00 -0.84 1.49 -0.23 0.00 0.00 178.00 179.05 1xwe h GLU 1538N 0.00 0.00 -4.77 0.86 4.81 -1.90 -3.44 114.58 110.15 1xwe h GLU 1538Ca 0.00 0.00 -0.68 0.00 -0.13 0.00 0.00 59.36 58.56 1xwe h GLU 1538Cb 0.35 0.00 -0.23 0.00 0.63 0.00 0.00 28.75 29.50 1xwe h GLU 1538CO -0.00 0.29 -0.56 0.42 -0.73 0.00 0.00 179.01 178.42 1xwe s ILE 1539N -3.05 4.53 -0.07 2.32 1.09 0.64 -2.55 121.20 124.10 1xwe s ILE 1539Ca 0.01 -0.48 -0.25 0.00 -1.10 0.00 0.00 60.65 58.83 1xwe s ILE 1539Cb 0.08 -3.33 -0.27 0.00 -1.06 0.00 0.00 42.46 37.89 1xwe s ILE 1539CO 0.77 0.05 0.91 0.00 -0.10 0.00 0.00 174.94 176.57 1xwe h ALA 1540N 8.34 -0.01 -2.83 9.38 0.00 -0.58 -3.39 119.26 130.18 1xwe h ALA 1540Ca -0.32 -0.55 -0.51 0.00 0.00 0.00 0.00 54.91 53.54 1xwe h ALA 1540Cb 1.14 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 18.79 1xwe h ALA 1540CO 0.62 0.16 -0.77 1.52 0.00 0.00 0.00 179.25 180.78 1xwe s TYR 1541N -2.65 1.78 -0.30 0.00 -0.85 -0.69 -4.37 117.35 110.27 1xwe s TYR 1541Ca -0.16 -0.49 -0.01 0.00 -0.52 0.00 0.00 57.07 55.89 1xwe s TYR 1541Cb -0.00 -0.88 0.12 0.00 0.38 0.00 0.00 41.96 41.58 1xwe s TYR 1541CO 0.76 0.32 0.23 0.00 -1.52 0.00 0.00 175.55 175.34 1xwe s ALA 1542N -2.17 0.12 0.24 9.51 0.00 -0.94 -1.97 121.76 126.56 1xwe s ALA 1542Ca 0.16 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.16 1xwe s ALA 1542Cb -0.05 -1.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.42 1xwe s ALA 1542CO 0.06 -1.77 0.41 1.52 0.00 0.00 0.00 175.76 175.98 1xwe s TYR 1543N 2.03 0.52 -0.08 0.00 -0.85 -0.89 -0.82 117.35 117.26 1xwe s TYR 1543Ca 0.11 -0.86 -0.03 0.00 -0.52 0.00 0.00 57.07 55.77 1xwe s TYR 1543Cb -0.16 0.04 -0.04 0.00 0.38 0.00 0.00 41.96 42.19 1xwe s TYR 1543CO -0.28 -0.93 0.05 0.21 -1.52 0.00 0.00 175.55 173.08 1xwe s LYS 1544N -4.03 3.11 0.32 -3.49 2.20 -0.86 -1.82 119.74 115.17 1xwe s LYS 1544Ca 0.26 -0.35 0.06 0.00 -0.36 0.00 0.00 55.97 55.58 1xwe s LYS 1544Cb 0.01 -2.90 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 1xwe s LYS 1544CO 0.10 0.72 0.22 1.33 -0.36 0.00 0.00 175.35 177.35 1xwe n VAL 1545N 1.96 0.00 -3.70 4.02 0.24 -0.66 -0.45 118.33 119.74 1xwe n VAL 1545Ca -0.18 -2.19 -0.11 0.00 -2.04 0.00 0.00 64.34 59.82 1xwe n VAL 1545Cb 0.54 1.00 -0.12 0.00 -1.47 0.00 0.00 33.84 33.79 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 -3.16 -0.27 0.36 -1.34 0.15 -0.83 -1.88 113.70 106.74 1xwe s SER 1546Ca 0.31 0.74 -0.28 0.00 0.70 0.00 0.00 55.95 57.41 1xwe s SER 1546Cb 0.01 0.72 -0.11 0.00 -1.71 0.00 0.00 66.02 64.93 1xwe s SER 1546CO 0.22 -0.20 1.44 -0.63 1.20 0.00 0.00 173.24 175.27 1xwe s ILE 1547N 1.67 2.24 0.00 6.45 -1.09 -0.85 -2.08 121.20 127.54 1xwe s ILE 1547Ca -0.07 0.24 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 1xwe s ILE 1547Cb -0.10 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1xwe s ILE 1547CO -0.11 0.06 0.00 0.35 -1.23 0.00 0.00 174.94 174.01 1xwe n THR 1548N 0.64 0.00 -3.75 2.92 -2.24 -1.10 -2.72 114.28 108.04 1xwe n THR 1548Ca 0.01 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.68 1xwe n THR 1548Cb 0.40 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.40 1xwe n THR 1548CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xwe s SER 1549N -1.47 -0.12 -0.16 3.42 0.15 0.32 -4.86 113.70 110.98 1xwe s SER 1549Ca 0.00 -0.26 -0.04 0.00 0.70 0.00 0.00 55.95 56.35 1xwe s SER 1549Cb 0.00 0.37 0.06 0.00 -1.71 0.00 0.00 66.02 64.75 1xwe s SER 1549CO 0.00 -0.66 0.13 -0.63 1.20 0.00 0.00 173.24 173.27 1xwe s ILE 1550N -2.89 -0.17 -0.21 6.45 1.01 -1.26 -1.62 121.20 122.51 1xwe s ILE 1550Ca -0.03 -0.05 -0.18 0.00 0.00 0.00 0.00 60.65 60.40 1xwe s ILE 1550Cb 0.00 -0.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.91 1xwe s ILE 1550CO -0.05 -0.18 0.51 -0.89 0.00 0.00 0.00 174.94 174.32 1xwe s THR 1551N 2.21 5.11 -0.17 2.92 2.01 0.34 -4.99 115.64 123.07 1xwe s THR 1551Ca 0.04 0.92 -0.08 0.00 0.31 0.00 0.00 61.69 62.88 1xwe s THR 1551Cb -0.15 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1xwe s THR 1551CO -0.09 0.17 0.09 0.54 -0.69 0.00 0.00 174.62 174.64 1xwe s VAL 1552N 1.73 5.08 0.46 3.82 0.11 -1.26 -0.54 120.40 129.81 1xwe s VAL 1552Ca 0.23 0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.37 1xwe s VAL 1552Cb -0.15 -3.27 -0.02 0.00 -1.53 0.00 0.00 36.38 31.40 1xwe s VAL 1552CO 0.09 0.50 0.06 -0.70 -3.33 0.00 0.00 175.10 171.72 1xwe s GLU 1553N -0.04 2.06 0.24 1.54 2.56 -0.80 -4.98 118.70 119.29 1xwe s GLU 1553Ca 0.08 -2.28 -0.05 0.00 0.00 0.00 0.00 54.97 52.72 1xwe s GLU 1553Cb -0.12 -1.13 0.46 0.00 2.00 0.00 0.00 34.13 35.34 1xwe s GLU 1553CO 0.00 -0.39 1.69 -2.95 -0.56 0.00 0.00 175.26 173.05 1xwe h ASN 1554N 1.57 0.04 0.00 -1.70 7.08 -2.05 -3.39 115.58 117.14 1xwe h ASN 1554Ca -0.40 0.14 0.00 0.00 -3.08 0.00 0.00 56.30 52.96 1xwe h ASN 1554Cb 1.29 0.18 0.00 0.00 -2.08 0.00 0.00 38.32 37.72 1xwe h ASN 1554CO 0.67 -0.02 -0.35 0.52 -2.08 0.00 0.00 177.43 176.17 1xwe n VAL 1555N -5.14 0.19 -1.40 6.14 0.31 -1.26 -5.09 118.33 112.08 1xwe n VAL 1555Ca 0.14 0.06 -0.31 0.00 -0.01 0.00 0.00 64.34 64.23 1xwe n VAL 1555Cb 0.45 -1.02 0.09 0.00 -0.91 0.00 0.00 33.84 32.45 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 -2.00 2.73 -0.21 3.52 0.08 -1.26 -3.66 117.98 117.17 1xwe s PHE 1556Ca 0.00 1.37 -0.04 0.00 0.12 0.00 0.00 56.93 58.38 1xwe s PHE 1556Cb 0.00 -3.04 0.07 0.00 -0.57 0.00 0.00 43.02 39.48 1xwe s PHE 1556CO 0.00 -1.76 0.09 0.08 -0.10 0.00 0.00 175.22 173.54 1xwe s VAL 1557N -3.00 0.08 0.42 -0.44 1.01 -0.34 -1.90 120.40 116.23 1xwe s VAL 1557Ca 0.61 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.92 1xwe s VAL 1557Cb -0.16 -0.82 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 1xwe s VAL 1557CO 0.56 -0.41 0.96 -0.54 0.00 0.00 0.00 175.10 175.67 1xwe s LYS 1558N 2.05 4.22 -0.16 2.72 3.01 0.30 -1.17 119.74 130.71 1xwe s LYS 1558Ca 0.04 1.19 -0.01 0.00 -1.01 0.00 0.00 55.97 56.17 1xwe s LYS 1558Cb -0.16 -2.26 0.04 0.00 -1.01 0.00 0.00 37.83 34.44 1xwe s LYS 1558CO -0.17 -0.04 -0.02 0.71 0.51 0.00 0.00 175.35 176.33 1xwe s TYR 1559N -2.07 1.43 -0.41 3.18 2.02 -0.09 -0.50 117.35 120.90 1xwe s TYR 1559Ca 0.61 -0.93 -0.15 0.00 -0.37 0.00 0.00 57.07 56.23 1xwe s TYR 1559Cb -0.12 -1.19 0.02 0.00 -0.40 0.00 0.00 41.96 40.28 1xwe s TYR 1559CO 0.16 -0.58 0.31 0.15 -1.57 0.00 0.00 175.55 174.02 1xwe s LYS 1560N 1.72 2.97 0.20 -0.62 -0.14 -0.64 -1.96 119.74 121.27 1xwe s LYS 1560Ca 0.01 -1.04 0.09 0.00 -1.36 0.00 0.00 55.97 53.66 1xwe s LYS 1560Cb -0.15 -3.99 -0.04 0.00 -1.68 0.00 0.00 37.83 31.96 1xwe s LYS 1560CO -0.07 -0.77 -0.17 0.00 -0.76 0.00 0.00 175.35 173.58 1xwe s ALA 1561N 1.69 2.10 -0.14 5.17 0.00 -0.98 -0.52 121.76 129.08 1xwe s ALA 1561Ca 0.05 -1.61 -0.04 0.00 0.00 0.00 0.00 51.96 50.35 1xwe s ALA 1561Cb -0.19 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1xwe s ALA 1561CO 0.10 0.17 0.02 0.99 0.00 0.00 0.00 175.76 177.03 1xwe s THR 1562N -2.51 4.44 0.41 0.00 2.01 -0.88 -2.68 115.64 116.43 1xwe s THR 1562Ca 0.20 -0.18 -0.26 0.00 0.31 0.00 0.00 61.69 61.77 1xwe s THR 1562Cb -0.03 -2.93 -0.08 0.00 0.01 0.00 0.00 72.50 69.46 1xwe s THR 1562CO 0.08 0.53 1.29 -0.22 -0.69 0.00 0.00 174.62 175.61 1xwe s LEU 1563N -0.19 4.19 -0.26 4.42 0.20 -1.04 -1.96 118.68 124.04 1xwe s LEU 1563Ca 0.06 2.62 -0.11 0.00 0.69 0.00 0.00 54.13 57.39 1xwe s LEU 1563Cb -0.12 -3.94 -0.12 0.00 -0.43 0.00 0.00 46.19 41.58 1xwe s LEU 1563CO 0.02 -0.86 -0.32 0.18 -0.29 0.00 0.00 176.35 175.08 1xwe n LEU 1564N 0.06 1.98 -3.64 -0.68 4.32 0.40 -3.42 117.00 116.01 1xwe n LEU 1564Ca 0.04 0.26 -0.06 0.00 -0.02 0.00 0.00 56.01 56.22 1xwe n LEU 1564Cb 0.44 -0.77 -0.07 0.00 -1.62 0.00 0.00 43.42 41.40 1xwe n LEU 1564CO 0.55 0.59 0.62 -0.62 -1.22 0.00 0.00 177.39 177.31 1xwe s ASP 1565N -7.20 -0.58 -0.14 -1.43 2.15 -0.99 -4.33 116.67 104.15 1xwe s ASP 1565Ca -0.36 1.00 -0.18 0.00 0.43 0.00 0.00 52.55 53.44 1xwe s ASP 1565Cb 0.13 1.15 -0.04 0.00 -0.30 0.00 0.00 42.92 43.86 1xwe s ASP 1565CO 0.47 -0.16 0.50 -0.63 -0.17 0.00 0.00 175.17 175.17 1xwe s ILE 1566N 0.95 5.16 -0.27 4.11 1.01 -1.26 -2.03 121.20 128.87 1xwe s ILE 1566Ca -0.04 0.98 0.12 0.00 0.00 0.00 0.00 60.65 61.70 1xwe s ILE 1566Cb -0.04 -3.83 -0.16 0.00 0.01 0.00 0.00 42.46 38.44 1xwe s ILE 1566CO -0.12 0.28 0.37 -1.22 0.00 0.00 0.00 174.94 174.25 1xwe n TYR 1567N 4.01 0.00 -3.66 3.97 4.02 -0.59 -4.94 117.16 119.98 1xwe n TYR 1567Ca -0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.76 1xwe n TYR 1567Cb 0.51 -0.14 -0.09 0.00 -0.02 0.00 0.00 39.34 39.61 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 -2.47 0.37 0.88 -0.72 2.47 0.00 -4.90 119.74 115.37 1xwe s LYS 1568Ca -0.00 1.10 -0.15 0.00 -1.56 0.00 0.00 55.97 55.36 1xwe s LYS 1568Cb 0.08 0.42 -0.04 0.00 -1.46 0.00 0.00 37.83 36.84 1xwe s LYS 1568CO 0.48 -0.24 0.13 2.41 0.16 0.00 0.00 175.35 178.30 1xwe n THR 1569N 5.39 0.47 0.49 3.43 -1.04 -1.26 -2.21 114.28 119.54 1xwe n THR 1569Ca -0.09 -0.33 0.12 0.00 -2.04 0.00 0.00 64.05 61.71 1xwe n THR 1569Cb 0.49 -0.48 0.19 0.00 -1.82 0.00 0.00 70.33 68.72 1xwe n THR 1569CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xwe n GLY 1570N 2.05 1.55 4.55 3.41 0.00 -1.26 -3.67 105.19 111.82 1xwe n GLY 1570Ca 0.06 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1xwe n GLY 1570CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xwe n GLU 1571N 1.46 0.00 -1.13 1.61 1.02 -1.26 -4.65 120.64 117.68 1xwe n GLU 1571Ca 0.18 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.13 1xwe n GLU 1571Cb 0.61 -0.08 -0.05 0.00 -0.02 0.00 0.00 31.44 31.90 1xwe n GLU 1571CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xwe n ALA 1572N 0.00 5.83 -2.79 0.62 0.00 -1.26 -4.81 120.51 118.11 1xwe n ALA 1572Ca 0.00 -2.14 -0.04 0.00 0.00 0.00 0.00 53.44 51.27 1xwe n ALA 1572Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 1.08-11.51 -3.35 0.00 0.31 -1.26 -4.99 118.33 98.61 1xwe n VAL 1573Ca 0.38 1.45 -0.38 0.00 -0.01 0.00 0.00 64.34 65.78 1xwe n VAL 1573Cb 0.62 -7.01 -0.06 0.00 -0.91 0.00 0.00 33.84 26.48 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 -2.01 3.62 0.01 3.52 0.00 -1.26 -4.92 121.76 120.72 1xwe s ALA 1574Ca 0.10 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.05 1xwe s ALA 1574Cb -0.03 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1xwe s ALA 1574CO 0.77 0.42 -0.12 -1.21 0.00 0.00 0.00 175.76 175.62 1xwe s GLU 1575N -1.07 0.89 0.36 0.00 2.02 -1.26 -4.88 118.70 114.75 1xwe s GLU 1575Ca 0.27 -0.54 -0.28 0.00 0.02 0.00 0.00 54.97 54.44 1xwe s GLU 1575Cb -0.19 -0.86 -0.12 0.00 0.10 0.00 0.00 34.13 33.07 1xwe s GLU 1575CO 0.17 0.23 1.43 1.63 0.02 0.00 0.00 175.26 178.74 1xwe n LYS 1576N 2.43 2.50 -3.26 1.61 5.02 -1.26 -1.79 118.16 123.41 1xwe n LYS 1576Ca -0.16 0.88 -0.20 0.00 -2.02 0.00 0.00 58.31 56.81 1xwe n LYS 1576Cb 0.56 -2.56 -0.01 0.00 -0.02 0.00 0.00 35.03 32.99 1xwe n LYS 1576CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1xwe n ASP 1577N 0.71 -2.94 -2.89 4.39 5.68 -1.22 -4.92 116.55 115.36 1xwe n ASP 1577Ca 0.03 -0.27 0.00 0.00 -0.50 0.00 0.00 54.79 54.05 1xwe n ASP 1577Cb 0.38 -2.49 0.00 0.00 -1.14 0.00 0.00 41.12 37.87 1xwe n ASP 1577CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xwe n SER 1578N -2.11 -0.83 -4.16 -1.12 3.41 -0.74 -4.43 113.62 103.65 1xwe n SER 1578Ca -0.01 -0.28 -0.35 0.00 -0.26 0.00 0.00 58.87 57.97 1xwe n SER 1578Cb 0.53 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.34 1xwe n SER 1578CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1xwe s GLU 1579N -2.10 2.37 -0.07 4.33 2.12 -1.26 -2.51 118.70 121.58 1xwe s GLU 1579Ca 0.00 -1.32 0.01 0.00 0.36 0.00 0.00 54.97 54.02 1xwe s GLU 1579Cb 0.00 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.19 1xwe s GLU 1579CO 0.00 -0.65 -0.06 0.96 -0.54 0.00 0.00 175.26 174.97 1xwe s ILE 1580N 1.22 3.78 -0.16 -3.70 -4.36 -1.09 -5.03 121.20 111.86 1xwe s ILE 1580Ca -0.05 -0.45 -0.02 0.00 -0.26 0.00 0.00 60.65 59.88 1xwe s ILE 1580Cb -0.20 -2.55 0.05 0.00 1.25 0.00 0.00 42.46 41.01 1xwe s ILE 1580CO -0.02 0.60 -0.01 -0.89 0.24 0.00 0.00 174.94 174.87 1xwe s THR 1581N -0.82 0.74 -0.07 8.37 2.01 -1.26 -2.31 115.64 122.30 1xwe s THR 1581Ca 0.12 -0.48 0.04 0.00 0.31 0.00 0.00 61.69 61.69 1xwe s THR 1581Cb -0.11 -1.05 0.00 0.00 0.01 0.00 0.00 72.50 71.35 1xwe s THR 1581CO 0.01 0.00 -0.20 0.72 -0.69 0.00 0.00 174.62 174.47 1xwe s PHE 1582N 1.78 2.08 0.30 4.92 -0.71 -0.83 -1.75 117.98 123.77 1xwe s PHE 1582Ca 0.01 -0.75 0.06 0.00 -1.04 0.00 0.00 56.93 55.20 1xwe s PHE 1582Cb -0.16 -1.41 -0.02 0.00 -1.21 0.00 0.00 43.02 40.22 1xwe s PHE 1582CO -0.07 -0.30 0.42 0.96 -1.34 0.00 0.00 175.22 174.89 1xwe s ILE 1583N 0.29 4.56 -0.17 -4.49 -4.36 -0.83 -0.92 121.20 115.29 1xwe s ILE 1583Ca -0.13 -1.00 -0.17 0.00 -0.26 0.00 0.00 60.65 59.10 1xwe s ILE 1583Cb -0.15 -3.59 0.05 0.00 1.25 0.00 0.00 42.46 40.01 1xwe s ILE 1583CO 0.05 -0.23 0.48 -0.75 0.24 0.00 0.00 174.94 174.74 1xwe s LYS 1584N -4.09 0.59 0.59 0.37 2.20 -0.32 -4.07 119.74 115.01 1xwe s LYS 1584Ca 0.40 0.62 -0.13 0.00 -0.36 0.00 0.00 55.97 56.50 1xwe s LYS 1584Cb -0.09 0.28 -0.05 0.00 -1.51 0.00 0.00 37.83 36.46 1xwe s LYS 1584CO 0.30 -0.08 1.02 0.15 -0.36 0.00 0.00 175.35 176.38 1xwe s LYS 1585N 0.14 3.66 0.08 4.03 1.02 -1.26 -1.19 119.74 126.21 1xwe s LYS 1585Ca -0.01 0.85 0.21 0.00 0.02 0.00 0.00 55.97 57.03 1xwe s LYS 1585Cb -0.03 -2.09 0.84 0.00 -0.52 0.00 0.00 37.83 36.03 1xwe s LYS 1585CO 0.01 -0.52 1.64 1.55 -0.92 0.00 0.00 175.35 177.11 1xwe n VAL 1586N -2.37 0.73 0.02 3.17 3.14 -1.24 -2.88 118.33 118.90 1xwe n VAL 1586Ca 0.06 0.15 -0.06 0.00 -2.96 0.00 0.00 64.34 61.53 1xwe n VAL 1586Cb 0.54 -0.90 0.14 0.00 -1.06 0.00 0.00 33.84 32.55 1xwe n VAL 1586CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1xwe h THR 1587N 0.00 1.31 -2.06 1.55 1.35 -1.92 -3.42 112.91 109.72 1xwe h THR 1587Ca 0.00 -1.58 -0.58 0.00 -0.55 0.00 0.00 66.41 63.70 1xwe h THR 1587Cb 0.37 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1xwe h THR 1587CO 0.00 0.49 1.45 0.00 -0.25 0.00 0.00 175.52 177.21 1xwe n THR 1589N 7.38 1.55 0.81 0.00 -1.04 -1.26 -4.25 114.28 117.48 1xwe n THR 1589Ca 0.28 -0.51 0.08 0.00 -2.04 0.00 0.00 64.05 61.86 1xwe n THR 1589Cb 0.44 -1.61 0.41 0.00 -1.82 0.00 0.00 70.33 67.76 1xwe n THR 1589CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1xwe n ASN 1590N -3.58 0.00 -4.38 8.00 3.02 -1.25 -4.55 115.26 112.52 1xwe n ASN 1590Ca -0.45 -0.12 -0.36 0.00 -0.03 0.00 0.00 54.58 53.62 1xwe n ASN 1590Cb 0.96 -0.19 -0.13 0.00 -0.61 0.00 0.00 39.78 39.81 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 -2.38 3.02 -0.19 5.41 0.00 -1.24 -4.16 121.76 122.22 1xwe s ALA 1591Ca 0.18 -1.20 -0.05 0.00 0.00 0.00 0.00 51.96 50.90 1xwe s ALA 1591Cb 0.10 -1.96 0.07 0.00 0.00 0.00 0.00 23.12 21.34 1xwe s ALA 1591CO 0.22 -0.54 0.13 -2.00 0.00 0.00 0.00 175.76 173.57 1xwe s GLU 1592N 1.55 0.11 0.09 0.00 2.56 -1.26 -4.96 118.70 116.79 1xwe s GLU 1592Ca 0.06 -0.05 -0.04 0.00 0.00 0.00 0.00 54.97 54.94 1xwe s GLU 1592Cb -0.15 -1.60 -0.05 0.00 2.00 0.00 0.00 34.13 34.33 1xwe s GLU 1592CO 0.01 -0.70 0.31 -0.51 -0.56 0.00 0.00 175.26 173.80 1xwe s LEU 1593N 2.19 4.31 -0.02 2.70 1.43 -1.26 -5.11 118.68 122.93 1xwe s LEU 1593Ca 0.04 0.49 0.07 0.00 -1.03 0.00 0.00 54.13 53.69 1xwe s LEU 1593Cb -0.16 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 42.95 1xwe s LEU 1593CO -0.12 0.12 -0.21 -0.69 0.23 0.00 0.00 176.35 175.68 1xwe s VAL 1594N -1.55 1.69 -0.34 -1.59 1.01 -1.26 -5.10 120.40 113.25 1xwe s VAL 1594Ca 0.37 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 1xwe s VAL 1594Cb -0.13 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.87 1xwe s VAL 1594CO 0.24 0.48 1.09 -0.75 0.00 0.00 0.00 175.10 176.16 1xwe s LYS 1595N -0.50 4.01 0.00 2.72 2.20 -1.26 -3.20 119.74 123.71 1xwe s LYS 1595Ca 0.08 1.00 0.00 0.00 -0.36 0.00 0.00 55.97 56.69 1xwe s LYS 1595Cb -0.08 -3.76 0.00 0.00 -1.51 0.00 0.00 37.83 32.47 1xwe s LYS 1595CO -0.01 -0.98 0.00 0.41 -0.36 0.00 0.00 175.35 174.41 1xwe n GLY 1596N 4.03 0.94 3.99 5.54 0.00 -1.10 -5.01 105.19 113.58 1xwe n GLY 1596Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.36 1.89 -0.07 1.61 0.52 -1.20 -4.89 118.95 116.46 1xwe s ARG 1597Ca 0.00 -1.06 0.04 0.00 -0.52 0.00 0.00 55.73 54.19 1xwe s ARG 1597Cb 0.00 -2.38 -0.00 0.00 0.52 0.00 0.00 34.95 33.09 1xwe s ARG 1597CO 0.00 -1.26 -0.21 -0.65 0.02 0.00 0.00 175.30 173.19 1xwe s GLN 1598N -5.04 2.47 0.04 3.54 -0.21 -1.26 -2.00 119.66 117.19 1xwe s GLN 1598Ca 0.64 -0.77 0.03 0.00 0.02 0.00 0.00 55.36 55.28 1xwe s GLN 1598Cb -0.06 -1.99 -0.02 0.00 1.00 0.00 0.00 33.01 31.94 1xwe s GLN 1598CO 0.43 0.23 -0.09 0.71 -2.12 0.00 0.00 175.29 174.44 1xwe s TYR 1599N 0.18 0.82 -0.24 0.91 2.02 -0.79 -2.28 117.35 117.97 1xwe s TYR 1599Ca -0.11 -0.42 -0.13 0.00 -0.37 0.00 0.00 57.07 56.04 1xwe s TYR 1599Cb -0.15 -0.48 -0.05 0.00 -0.40 0.00 0.00 41.96 40.88 1xwe s TYR 1599CO 0.05 -0.03 0.26 -1.17 -1.57 0.00 0.00 175.55 173.09 1xwe s LEU 1600N -1.38 4.11 -0.17 -1.29 2.96 -0.25 -1.65 118.68 121.01 1xwe s LEU 1600Ca -0.06 0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 54.07 1xwe s LEU 1600Cb -0.09 -2.27 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 1xwe s LEU 1600CO 0.01 -0.02 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.30 1xwe s ILE 1601N 1.34 3.27 -0.21 6.68 1.01 -0.76 -2.07 121.20 130.46 1xwe s ILE 1601Ca 0.12 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.17 1xwe s ILE 1601Cb -0.14 -2.43 0.09 0.00 0.01 0.00 0.00 42.46 39.98 1xwe s ILE 1601CO 0.07 0.48 0.17 -0.04 0.00 0.00 0.00 174.94 175.61 1xwe s MET 1602N 0.87 0.16 0.00 2.79 -1.94 -0.83 -2.09 119.30 118.25 1xwe s MET 1602Ca -0.02 -0.06 0.00 0.00 -1.71 0.00 0.00 55.69 53.90 1xwe s MET 1602Cb -0.15 -1.38 0.00 0.00 2.01 0.00 0.00 34.83 35.32 1xwe s MET 1602CO 0.01 -0.76 0.00 0.41 -0.01 0.00 0.00 175.02 174.67 1xwe n GLY 1603N 5.29 0.57 3.33 -0.03 0.00 -0.83 -1.63 105.19 111.90 1xwe n GLY 1603Ca -0.06 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 -0.49 -0.49 1.61 4.76 -1.06 0.07 118.16 122.56 1xwe n LYS 1604Ca 0.00 -0.11 -0.08 0.00 -2.87 0.00 0.00 58.31 55.25 1xwe n LYS 1604Cb 0.00 -1.70 0.06 0.00 -1.84 0.00 0.00 35.03 31.55 1xwe n LYS 1604CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1xwe n GLU 1605N -1.16 -0.59 -0.68 1.97 0.28 -1.26 -4.53 120.64 114.67 1xwe n GLU 1605Ca 0.04 -0.56 -0.06 0.00 -0.16 0.00 0.00 57.16 56.42 1xwe n GLU 1605Cb 0.56 -0.40 0.04 0.00 1.43 0.00 0.00 31.44 33.07 1xwe n GLU 1605CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1xwe n ALA 1606N -3.29 -0.20 -3.29 -1.84 0.00 -1.26 -4.90 120.51 105.72 1xwe n ALA 1606Ca -0.06 -0.41 -0.31 0.00 0.00 0.00 0.00 53.44 52.66 1xwe n ALA 1606Cb 0.16 0.02 -0.17 0.00 0.00 0.00 0.00 19.45 19.46 1xwe n ALA 1606CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xwe s LEU 1607N 0.00 2.00 -0.08 0.00 1.43 -1.19 -4.92 118.68 115.93 1xwe s LEU 1607Ca 0.16 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.45 1xwe s LEU 1607Cb -0.01 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.89 1xwe s LEU 1607CO 0.11 0.13 1.05 -1.10 0.23 0.00 0.00 176.35 176.77 1xwe s GLN 1608N 0.43 4.43 0.00 1.70 -0.21 -1.26 -3.72 119.66 121.03 1xwe s GLN 1608Ca -0.17 1.46 0.00 0.00 0.02 0.00 0.00 55.36 56.67 1xwe s GLN 1608Cb -0.17 -3.53 0.00 0.00 1.00 0.00 0.00 33.01 30.31 1xwe s GLN 1608CO 0.07 -0.30 0.00 0.44 -2.12 0.00 0.00 175.29 173.38 1xwe n ILE 1609N 4.46 0.00 -2.48 1.08 -5.35 -1.25 -4.96 119.36 110.86 1xwe n ILE 1609Ca 0.09 -0.06 -0.03 0.00 -0.27 0.00 0.00 62.75 62.48 1xwe n ILE 1609Cb 0.48 0.44 -0.02 0.00 -1.74 0.00 0.00 39.64 38.80 1xwe n ILE 1609CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1xwe n LYS 1610N -0.65 -4.78 0.00 6.28 4.81 -1.26 -4.81 118.16 117.74 1xwe n LYS 1610Ca 0.00 3.53 0.00 0.00 -0.87 0.00 0.00 58.31 60.97 1xwe n LYS 1610Cb 0.00 -4.75 0.00 0.00 0.02 0.00 0.00 35.03 30.30 1xwe n LYS 1610CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 1xwe n TYR 1611N 1.82 0.00 0.00 5.64 9.36 -1.16 -4.79 117.16 128.03 1xwe n TYR 1611Ca -0.20 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.02 1xwe n TYR 1611Cb 0.32 -0.18 0.00 0.00 -0.63 0.00 0.00 39.34 38.85 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 -1.65 0.00 -0.00 2.98 5.15 -1.26 -4.98 115.26 115.49 1xwe n ASN 1612Ca 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.97 1xwe n ASN 1612Cb 0.00 -0.29 -0.00 0.00 -0.53 0.00 0.00 39.78 38.96 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 -2.33 1.98 -2.73 5.20 0.00 -1.26 -5.05 120.51 116.32 1xwe n ALA 1613Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 1xwe n ALA 1613Cb 0.00 0.45 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 1xwe n ALA 1613CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xwe s SER 1614N -3.98 5.42 0.27 0.00 0.01 -1.26 -5.06 113.70 109.09 1xwe s SER 1614Ca -0.01 0.08 -0.31 0.00 1.31 0.00 0.00 55.95 57.02 1xwe s SER 1614Cb 0.00 -1.49 -0.12 0.00 0.21 0.00 0.00 66.02 64.62 1xwe s SER 1614CO 0.02 0.28 1.61 0.49 0.41 0.00 0.00 173.24 176.05 1xwe n PHE 1615N 1.29 2.79 -2.94 2.43 3.01 -1.26 -3.00 117.46 119.78 1xwe n PHE 1615Ca -0.14 0.22 -0.43 0.00 1.01 0.00 0.00 57.45 58.11 1xwe n PHE 1615Cb 0.53 -2.61 -0.05 0.00 -0.01 0.00 0.00 39.48 37.34 1xwe n PHE 1615CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1xwe s ARG 1616N -0.13 3.26 -0.64 -1.08 3.52 -1.26 -4.74 118.95 117.88 1xwe s ARG 1616Ca 0.67 -0.47 -0.25 0.00 -0.13 0.00 0.00 55.73 55.55 1xwe s ARG 1616Cb -0.51 -4.07 0.05 0.00 -1.56 0.00 0.00 34.95 28.86 1xwe s ARG 1616CO 0.45 -1.40 1.07 0.71 -0.81 0.00 0.00 175.30 175.32 1xwe s TYR 1617N 3.52 2.59 -0.08 5.12 2.02 -1.26 -3.79 117.35 125.47 1xwe s TYR 1617Ca 0.25 -0.16 0.03 0.00 -0.37 0.00 0.00 57.07 56.83 1xwe s TYR 1617Cb -0.15 -4.35 0.01 0.00 -0.40 0.00 0.00 41.96 37.07 1xwe s TYR 1617CO 0.17 -1.68 -0.18 0.96 -1.57 0.00 0.00 175.55 173.24 1xwe s ILE 1618N 4.60 1.60 0.09 2.71 -4.36 -1.24 -4.44 121.20 120.16 1xwe s ILE 1618Ca 0.30 -0.76 -0.30 0.00 -0.26 0.00 0.00 60.65 59.63 1xwe s ILE 1618Cb -0.12 -1.41 -0.05 0.00 1.25 0.00 0.00 42.46 42.13 1xwe s ILE 1618CO 0.16 0.46 1.00 -0.31 0.24 0.00 0.00 174.94 176.48 1xwe s TYR 1619N 0.43 3.73 0.01 1.37 2.02 -0.71 -3.18 117.35 121.01 1xwe s TYR 1619Ca -0.15 1.72 0.19 0.00 -0.37 0.00 0.00 57.07 58.46 1xwe s TYR 1619Cb -0.16 -3.12 0.49 0.00 -0.40 0.00 0.00 41.96 38.76 1xwe s TYR 1619CO 0.06 -0.04 1.64 -1.00 -1.57 0.00 0.00 175.55 174.64 1xwe h PRO 1620N 5.87 0.00 -5.79 -1.71 0.13 -1.90 -2.20 132.00 126.40 1xwe h PRO 1620Ca -0.43 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.57 1xwe h PRO 1620Cb 1.21 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.35 1xwe h PRO 1620CO 0.73 0.37 -0.85 -0.11 -0.23 0.00 0.00 178.00 177.91 1xwe n LEU 1621N -3.35 -5.75 0.00 1.56 7.94 -1.26 -4.57 117.00 111.58 1xwe n LEU 1621Ca 0.01 0.41 0.00 0.00 -1.11 0.00 0.00 56.01 55.32 1xwe n LEU 1621Cb 0.58 -2.63 0.00 0.00 0.53 0.00 0.00 43.42 41.90 1xwe n LEU 1621CO 0.37 -1.61 0.00 -0.67 -1.11 0.00 0.00 177.39 174.37 1xwe n ASP 1622N 0.03 0.00 0.00 1.96 2.03 -1.26 -4.76 116.55 114.55 1xwe n ASP 1622Ca 0.02 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.35 1xwe n ASP 1622Cb 0.48 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.79 1xwe n ASP 1622CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1xwe n SER 1623N -1.56 0.00 0.17 1.67 3.41 -1.26 0.36 113.62 116.41 1xwe n SER 1623Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 1xwe n SER 1623Cb 0.00 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.23 1xwe n SER 1623CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1xwe h LEU 1624N 0.00 0.00 -8.53 1.04 8.10 -1.96 -3.37 115.31 110.59 1xwe h LEU 1624Ca 0.00 0.00 -0.45 0.00 0.11 0.00 0.00 57.88 57.54 1xwe h LEU 1624Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.22 1xwe h LEU 1624CO 0.00 0.47 1.61 0.41 -4.11 0.00 0.00 178.44 176.82 1xwe n THR 1625N -3.67 -0.08 -1.64 0.15 -1.04 -1.26 -4.84 114.28 101.91 1xwe n THR 1625Ca -0.01 -0.71 -0.42 0.00 -2.04 0.00 0.00 64.05 60.87 1xwe n THR 1625Cb 0.54 -2.53 -0.03 0.00 -1.82 0.00 0.00 70.33 66.49 1xwe n THR 1625CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1xwe s TRP 1626N 11.96 1.21 -0.20 -1.42 -0.11 -0.64 -4.81 118.94 124.93 1xwe s TRP 1626Ca 1.02 0.73 -0.04 0.00 1.22 0.00 0.00 56.10 59.03 1xwe s TRP 1626Cb -0.29 -3.89 -0.02 0.00 -1.50 0.00 0.00 33.47 27.78 1xwe s TRP 1626CO 0.28 -3.70 -0.04 0.42 -4.62 0.00 0.00 176.95 169.29 1xwe s ILE 1627N 8.88 3.54 -0.15 5.86 1.01 -1.26 -1.96 121.20 137.12 1xwe s ILE 1627Ca 0.98 -0.45 -0.03 0.00 0.00 0.00 0.00 60.65 61.15 1xwe s ILE 1627Cb -0.29 -2.59 0.05 0.00 0.01 0.00 0.00 42.46 39.64 1xwe s ILE 1627CO 0.33 0.44 0.05 -0.70 0.00 0.00 0.00 174.94 175.07 1xwe s GLU 1628N 1.10 0.37 0.33 2.79 2.56 -0.88 -2.90 118.70 122.06 1xwe s GLU 1628Ca 0.01 -0.13 -0.28 0.00 0.00 0.00 0.00 54.97 54.57 1xwe s GLU 1628Cb -0.15 -1.65 -0.12 0.00 2.00 0.00 0.00 34.13 34.21 1xwe s GLU 1628CO -0.00 -0.56 1.31 0.98 -0.56 0.00 0.00 175.26 176.43 1xwe n TYR 1629N 5.17 2.26 -3.44 5.30 9.36 -1.26 -1.09 117.16 133.47 1xwe n TYR 1629Ca -0.07 0.53 -0.43 0.00 3.32 0.00 0.00 57.90 61.24 1xwe n TYR 1629Cb 0.49 -2.42 -0.06 0.00 -0.63 0.00 0.00 39.34 36.71 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 -0.92 3.39 0.10 2.98 -0.11 -0.97 -4.83 118.94 118.58 1xwe s TRP 1630Ca 0.57 -1.68 -0.34 0.00 1.22 0.00 0.00 56.10 55.87 1xwe s TRP 1630Cb -0.58 -3.65 -0.14 0.00 -1.50 0.00 0.00 33.47 27.61 1xwe s TRP 1630CO 0.60 -1.00 1.63 -0.35 -4.62 0.00 0.00 176.95 173.21 1xwe n PRO 1631N 4.89 2.09 -0.35 5.86 -0.04 -1.26 -4.74 135.00 141.45 1xwe n PRO 1631Ca -0.07 0.76 0.08 0.00 -0.04 0.00 0.00 63.50 64.22 1xwe n PRO 1631Cb 0.41 -2.53 0.22 0.00 -0.04 0.00 0.00 33.50 31.56 1xwe n PRO 1631CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1xwe n ARG 1632N 4.08 2.81 -4.64 0.54 1.85 -1.26 -4.96 116.66 115.08 1xwe n ARG 1632Ca 0.18 -2.60 -0.32 0.00 -1.00 0.00 0.00 57.85 54.11 1xwe n ARG 1632Cb 0.28 -1.67 -0.12 0.00 -1.05 0.00 0.00 32.46 29.91 1xwe n ARG 1632CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1xwe s ASP 1633N -1.75 4.15 -0.46 2.89 1.11 -1.26 -5.08 116.67 116.27 1xwe s ASP 1633Ca 0.36 -0.27 0.05 0.00 0.18 0.00 0.00 52.55 52.87 1xwe s ASP 1633Cb 0.28 -0.83 0.18 0.00 1.07 0.00 0.00 42.92 43.61 1xwe s ASP 1633CO 0.10 0.28 0.53 0.42 1.18 0.00 0.00 175.17 177.68 1xwe s THR 1634N -0.91 -0.39 -0.03 -1.27 -4.23 -1.26 -4.14 115.64 103.41 1xwe s THR 1634Ca 0.15 -1.64 -0.02 0.00 -1.18 0.00 0.00 61.69 59.00 1xwe s THR 1634Cb -0.11 -0.58 -0.01 0.00 1.34 0.00 0.00 72.50 73.15 1xwe s THR 1634CO 0.05 -0.57 -0.04 1.07 -0.54 0.00 0.00 174.62 174.59 1xwe n THR 1635N 3.08 0.30 0.00 3.99 5.66 -1.26 -4.93 114.28 121.12 1xwe n THR 1635Ca 0.22 0.44 0.00 0.00 -3.05 0.00 0.00 64.05 61.66 1xwe n THR 1635Cb 0.52 -1.69 0.00 0.00 -1.55 0.00 0.00 70.33 67.61 1xwe n THR 1635CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xwe n SER 1637N -1.04 -1.74 0.00 0.00 3.41 -1.26 -4.79 113.62 108.21 1xwe n SER 1637Ca 0.00 -0.12 0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1xwe n SER 1637Cb 0.00 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.32 1xwe n SER 1637CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1xwe n SER 1638N -2.97 0.00 0.19 4.04 2.88 -1.26 -2.47 113.62 114.03 1xwe n SER 1638Ca 0.00 -0.39 0.14 0.00 -1.33 0.00 0.00 58.87 57.29 1xwe n SER 1638Cb 0.00 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.03 1xwe n SER 1638CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xwe n GLN 1640N -2.55 0.58 0.30 0.00 7.27 -1.03 -4.41 117.38 117.54 1xwe n GLN 1640Ca 0.01 0.11 0.19 0.00 0.07 0.00 0.00 57.00 57.38 1xwe n GLN 1640Cb 0.25 -1.41 0.95 0.00 2.41 0.00 0.00 30.24 32.44 1xwe n GLN 1640CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xwe h ALA 1641N 0.06 1.07 -0.10 1.69 0.00 -1.67 -2.13 119.26 118.19 1xwe h ALA 1641Ca -0.45 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.24 1xwe h ALA 1641Cb 1.73 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1xwe h ALA 1641CO -0.06 0.03 -0.75 0.35 0.00 0.00 0.00 179.25 178.81 1xwe h PHE 1642N 0.00 0.70 0.00 0.00 3.57 -1.65 -3.12 116.94 116.44 1xwe h PHE 1642Ca -0.00 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.09 1xwe h PHE 1642Cb 0.23 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1xwe h PHE 1642CO 0.00 1.09 -0.48 -0.07 -2.23 0.00 0.00 178.31 176.62 1xwe h LEU 1643N 0.35 0.00 -1.91 0.59 3.38 -1.60 -2.59 115.31 113.53 1xwe h LEU 1643Ca -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1xwe h LEU 1643Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 1xwe h LEU 1643CO 0.14 0.48 -0.10 0.00 0.09 0.00 0.00 178.44 179.04 1xwe h ALA 1644N 1.52 1.22 0.00 1.53 0.00 -1.46 -1.32 119.26 120.74 1xwe h ALA 1644Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xwe h ALA 1644Cb 0.89 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1xwe h ALA 1644CO 0.06 0.13 -0.80 -0.97 0.00 0.00 0.00 179.25 177.67 1xwe h ASN 1645N 0.00 0.00 0.90 0.00 -1.24 -1.50 -3.32 115.58 110.41 1xwe h ASN 1645Ca -0.00 -0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.78 1xwe h ASN 1645Cb 0.35 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.36 1xwe h ASN 1645CO 0.01 0.00 -1.14 -0.07 -1.29 0.00 0.00 177.43 174.94 1xwe h LEU 1646N 0.00 0.00 -1.69 0.34 3.38 -1.12 -3.26 115.31 112.96 1xwe h LEU 1646Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1xwe h LEU 1646Cb 1.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1xwe h LEU 1646CO 0.00 1.00 -0.17 -0.78 0.09 0.00 0.00 178.44 178.58 1xwe h ASP 1647N 0.00 0.00 0.49 -0.43 3.58 -1.45 -0.81 116.42 117.79 1xwe h ASP 1647Ca -0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.38 1xwe h ASP 1647Cb 1.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.87 1xwe h ASP 1647CO 0.12 0.17 0.00 -0.33 -2.88 0.00 0.00 179.24 176.32 1xwe h GLU 1648N 0.00 0.00 0.00 0.28 5.08 -1.70 -2.33 114.58 115.91 1xwe h GLU 1648Ca -0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 1xwe h GLU 1648Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1xwe h GLU 1648CO 0.02 0.00 -2.19 0.34 -1.00 0.00 0.00 179.01 176.19 1xwe n PHE 1649N -2.91 0.00 1.39 4.33 7.35 -0.40 -3.17 117.46 124.05 1xwe n PHE 1649Ca -0.01 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.79 1xwe n PHE 1649Cb 0.18 -0.78 0.63 0.00 0.35 0.00 0.00 39.48 39.85 1xwe n PHE 1649CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xwe n ALA 1650N -2.54 2.32 0.00 3.13 0.00 -0.67 -2.68 120.51 120.07 1xwe n ALA 1650Ca -0.22 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1xwe n ALA 1650Cb 0.93 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1xwe n ALA 1650CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1xwe n GLU 1651N -0.98 2.64 0.09 0.00 2.13 -1.15 -4.79 120.64 118.58 1xwe n GLU 1651Ca 0.16 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.93 1xwe n GLU 1651Cb 0.07 -0.70 -0.02 0.00 0.27 0.00 0.00 31.44 31.06 1xwe n GLU 1651CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1xwe h ASP 1652N 0.00 0.01 0.68 4.31 1.82 -1.53 0.36 116.42 122.07 1xwe h ASP 1652Ca 0.00 -0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.61 1xwe h ASP 1652Cb 0.19 -0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.20 1xwe h ASP 1652CO 0.00 0.88 -0.12 -0.29 -1.61 0.00 0.00 179.24 178.10 1xwe h ILE 1653N 0.00 0.37 0.00 2.25 6.09 -1.79 0.19 117.51 124.62 1xwe h ILE 1653Ca -0.01 -0.68 -0.37 0.00 -1.37 0.00 0.00 64.86 62.43 1xwe h ILE 1653Cb 1.55 1.50 -0.07 0.00 0.47 0.00 0.00 36.82 40.27 1xwe h ILE 1653CO 0.11 0.11 -2.42 0.33 -3.07 0.00 0.00 178.15 173.22 1xwe n PHE 1654N -3.37 0.00 0.01 2.19 -0.00 -1.18 -3.38 117.46 111.73 1xwe n PHE 1654Ca -0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.32 1xwe n PHE 1654Cb 0.30 -0.96 -0.09 0.00 -0.00 0.00 0.00 39.48 38.73 1xwe n PHE 1654CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1xwe h LEU 1655N 0.00 -0.09 0.00 -2.13 7.12 -0.89 -3.40 115.31 115.92 1xwe h LEU 1655Ca -0.56 -0.50 0.00 0.00 0.13 0.00 0.00 57.88 56.96 1xwe h LEU 1655Cb 1.90 0.02 0.00 0.00 -0.53 0.00 0.00 40.66 42.05 1xwe h LEU 1655CO -0.08 0.50 -0.09 0.78 -0.13 0.00 0.00 178.44 179.42 1xwe h ASN 1656N -0.73 0.00 -4.00 1.25 -0.26 -0.87 -3.50 115.58 107.47 1xwe h ASN 1656Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1xwe h ASN 1656Cb 0.58 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.84 1xwe h ASN 1656CO 0.02 0.18 -0.01 0.61 -1.06 0.00 0.00 177.43 177.17 1xwe n GLY 1657N 1.78 -2.32 0.00 2.83 0.00 -0.68 -5.01 105.19 101.79 1xwe n GLY 1657Ca -0.01 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32