#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 6.26 0.04 1.61 1.04 -1.26 -5.06 113.70 116.33 1xwe s SER 1509Ca 0.00 -0.21 0.08 0.00 0.48 0.00 0.00 55.95 56.30 1xwe s SER 1509Cb 0.00 -2.24 -0.03 0.00 0.10 0.00 0.00 66.02 63.85 1xwe s SER 1509CO 0.00 -0.47 -0.21 -1.00 0.98 0.00 0.00 173.24 172.54 1xwe s HIS 1510N 2.27 2.48 -0.04 5.02 4.02 -1.26 -5.13 115.29 122.65 1xwe s HIS 1510Ca 0.16 -0.31 0.03 0.00 1.02 0.00 0.00 55.06 55.96 1xwe s HIS 1510Cb -0.16 -1.45 0.01 0.00 -1.02 0.00 0.00 32.58 29.96 1xwe s HIS 1510CO 0.13 0.20 -0.10 1.41 1.02 0.00 0.00 174.74 177.40 1xwe s MET 1511N -1.31 1.23 -0.19 1.40 -2.45 -1.26 -4.99 119.30 111.72 1xwe s MET 1511Ca 0.13 -0.35 -0.18 0.00 -1.25 0.00 0.00 55.69 54.04 1xwe s MET 1511Cb -0.10 -1.10 0.05 0.00 1.25 0.00 0.00 34.83 34.93 1xwe s MET 1511CO 0.04 0.09 0.51 0.00 1.05 0.00 0.00 175.02 176.72 1xwe s ALA 1512N 0.35 -1.27 -0.03 4.11 0.00 -1.26 -5.03 121.76 118.63 1xwe s ALA 1512Ca -0.07 1.46 0.31 0.00 0.00 0.00 0.00 51.96 53.67 1xwe s ALA 1512Cb -0.11 -0.85 1.34 0.00 0.00 0.00 0.00 23.12 23.50 1xwe s ALA 1512CO 0.01 -0.24 1.93 -0.44 0.00 0.00 0.00 175.76 177.02 1xwe h ASP 1513N 5.38 0.00 0.00 0.00 5.19 -1.92 -3.22 116.42 121.85 1xwe h ASP 1513Ca -0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 1xwe h ASP 1513Cb 1.17 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.68 1xwe h ASP 1513CO 0.18 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.30 1xwe n GLY 1515N 0.00 0.46 3.47 0.00 0.00 -1.26 -3.24 105.19 104.63 1xwe n GLY 1515Ca 0.00 -0.47 -0.50 0.00 0.00 0.00 0.00 46.02 45.05 1xwe n GLY 1515CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xwe n GLN 1516N 8.02 0.34 -4.12 1.61 10.64 -1.03 -4.36 117.38 128.49 1xwe n GLN 1516Ca 0.44 0.12 -0.25 0.00 -1.83 0.00 0.00 57.00 55.48 1xwe n GLN 1516Cb 0.45 -1.34 -0.06 0.00 -0.86 0.00 0.00 30.24 28.43 1xwe n GLN 1516CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1xwe s MET 1517N -0.77 2.24 0.46 2.61 -1.94 -1.26 -4.50 119.30 116.14 1xwe s MET 1517Ca 0.70 -1.90 0.05 0.00 -1.71 0.00 0.00 55.69 52.83 1xwe s MET 1517Cb -0.96 -1.98 -0.04 0.00 2.01 0.00 0.00 34.83 33.86 1xwe s MET 1517CO 0.56 -0.22 0.09 -0.65 -0.01 0.00 0.00 175.02 174.79 1xwe s GLN 1518N -3.97 2.13 0.71 2.03 -1.52 -1.23 -5.05 119.66 112.76 1xwe s GLN 1518Ca 0.37 -2.13 -0.15 0.00 -1.95 0.00 0.00 55.36 51.50 1xwe s GLN 1518Cb 0.02 -1.73 0.03 0.00 -0.22 0.00 0.00 33.01 31.11 1xwe s GLN 1518CO 0.21 -0.22 1.18 -1.21 -0.25 0.00 0.00 175.29 175.00 1xwe s GLU 1519N -3.87 2.32 -0.00 2.91 0.41 -1.26 -4.74 118.70 114.47 1xwe s GLU 1519Ca 0.27 1.66 -0.18 0.00 -0.41 0.00 0.00 54.97 56.30 1xwe s GLU 1519Cb 0.05 -1.87 -0.34 0.00 -1.78 0.00 0.00 34.13 30.19 1xwe s GLU 1519CO 0.15 -1.68 0.96 0.93 -0.49 0.00 0.00 175.26 175.13 1xwe h GLU 1520N -0.21 0.45 -2.50 1.61 5.08 -2.00 -3.43 114.58 113.58 1xwe h GLU 1520Ca -0.47 -0.77 -0.29 0.00 -1.00 0.00 0.00 59.36 56.83 1xwe h GLU 1520Cb 1.28 0.28 -0.35 0.00 0.50 0.00 0.00 28.75 30.47 1xwe h GLU 1520CO 0.51 1.37 -0.60 -0.51 -1.00 0.00 0.00 179.01 178.77 1xwe s LEU 1521N -7.72 -0.17 -0.23 1.33 1.43 -1.26 -4.84 118.68 107.22 1xwe s LEU 1521Ca -0.11 -0.10 -0.09 0.00 -1.03 0.00 0.00 54.13 52.80 1xwe s LEU 1521Cb 0.03 0.48 0.10 0.00 0.03 0.00 0.00 46.19 46.82 1xwe s LEU 1521CO 0.90 -0.32 0.50 -0.62 0.23 0.00 0.00 176.35 177.05 1xwe s ASP 1522N 2.35 -0.58 -0.71 2.29 -1.08 -1.26 -5.08 116.67 112.59 1xwe s ASP 1522Ca 0.07 1.18 -0.27 0.00 -0.52 0.00 0.00 52.55 53.02 1xwe s ASP 1522Cb -0.15 1.56 0.02 0.00 -1.46 0.00 0.00 42.92 42.88 1xwe s ASP 1522CO -0.12 -0.22 1.45 -0.76 0.52 0.00 0.00 175.17 176.04 1xwe s LEU 1523N 2.50 3.20 0.00 -1.34 1.43 -1.26 -3.99 118.68 119.22 1xwe s LEU 1523Ca -0.04 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1xwe s LEU 1523Cb -0.11 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1xwe s LEU 1523CO -0.15 -1.99 0.00 1.07 0.23 0.00 0.00 176.35 175.51 1xwe n THR 1524N 6.64 0.00 -3.01 5.49 5.66 -1.26 -5.10 114.28 122.71 1xwe n THR 1524Ca 0.09 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.66 1xwe n THR 1524Cb 0.50 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.22 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 -0.20 4.68 0.85 1.09 1.01 -1.26 -5.05 121.20 122.33 1xwe s ILE 1525Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 60.65 60.73 1xwe s ILE 1525Cb 0.00 -4.33 0.17 0.00 0.01 0.00 0.00 42.46 38.30 1xwe s ILE 1525CO 0.00 -0.78 1.17 -0.44 0.00 0.00 0.00 174.94 174.89 1xwe s SER 1526N 2.33 3.68 0.39 3.58 0.01 -1.26 -4.93 113.70 117.51 1xwe s SER 1526Ca 0.26 -0.04 0.15 0.00 1.31 0.00 0.00 55.95 57.63 1xwe s SER 1526Cb -0.14 -0.15 0.81 0.00 0.21 0.00 0.00 66.02 66.75 1xwe s SER 1526CO 0.19 -2.34 1.85 0.00 0.41 0.00 0.00 173.24 173.36 1xwe h ALA 1527N -1.13 1.35 0.00 1.44 0.00 -1.97 -2.38 119.26 116.57 1xwe h ALA 1527Ca -0.40 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 1xwe h ALA 1527Cb 1.25 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1xwe h ALA 1527CO 0.39 0.42 -0.26 0.93 0.00 0.00 0.00 179.25 180.73 1xwe h GLU 1528N 0.00 0.00 0.00 0.00 5.08 -1.93 -3.04 114.58 114.69 1xwe h GLU 1528Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1xwe h GLU 1528Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1xwe h GLU 1528CO 0.04 0.26 -0.29 1.15 -1.00 0.00 0.00 179.01 179.18 1xwe h THR 1529N 0.00 1.04 -0.56 1.13 2.02 -1.79 -0.30 112.91 114.46 1xwe h THR 1529Ca -0.00 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 66.14 1xwe h THR 1529Cb 0.98 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.98 1xwe h THR 1529CO 0.03 0.28 0.00 0.54 0.37 0.00 0.00 175.52 176.75 1xwe n ARG 1530N -3.96 2.79 0.01 6.66 1.74 -1.15 -4.13 116.66 118.62 1xwe n ARG 1530Ca -0.02 -2.21 -0.00 0.00 -0.77 0.00 0.00 57.85 54.85 1xwe n ARG 1530Cb 0.36 -1.62 -0.00 0.00 -1.02 0.00 0.00 32.46 30.18 1xwe n ARG 1530CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1xwe n LYS 1531N 1.04 0.01 0.31 5.56 3.00 -0.70 -3.92 118.16 123.45 1xwe n LYS 1531Ca 0.20 0.00 0.17 0.00 -0.00 0.00 0.00 58.31 58.69 1xwe n LYS 1531Cb 0.62 -0.51 0.90 0.00 0.00 0.00 0.00 35.03 36.04 1xwe n LYS 1531CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 1xwe h GLN 1532N -0.01 0.00 0.00 1.64 4.20 -1.28 0.31 115.11 119.96 1xwe h GLN 1532Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1xwe h GLN 1532Cb 0.77 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.55 1xwe h GLN 1532CO -0.00 0.00 -1.76 2.41 -0.67 0.00 0.00 178.83 178.81 1xwe n THR 1533N -3.04 0.00 0.10 -0.54 -1.04 -1.26 -4.25 114.28 104.25 1xwe n THR 1533Ca -0.01 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.05 61.50 1xwe n THR 1533Cb 0.33 0.12 -0.08 0.00 -1.82 0.00 0.00 70.33 68.88 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 1.53 -0.31 0.00 2.41 0.00 -0.54 -3.03 119.26 119.31 1xwe h ALA 1534Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xwe h ALA 1534Cb 0.76 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1xwe h ALA 1534CO 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 178.83 1xwe n LYS 1536N -1.11 2.54 -0.36 0.00 4.81 -1.15 -4.90 118.16 118.00 1xwe n LYS 1536Ca 0.12 0.89 0.08 0.00 -0.87 0.00 0.00 58.31 58.53 1xwe n LYS 1536Cb 0.09 -2.60 0.26 0.00 0.02 0.00 0.00 35.03 32.80 1xwe n LYS 1536CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1xwe h PRO 1537N 3.29 0.91 0.00 1.64 0.11 -1.89 0.99 132.00 137.06 1xwe h PRO 1537Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1xwe h PRO 1537Cb 1.25 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1xwe h PRO 1537CO 0.67 0.60 0.03 0.93 -0.21 0.00 0.00 178.00 180.03 1xwe h GLU 1538N 0.94 0.00 -4.94 1.05 4.39 -1.92 -3.39 114.58 110.71 1xwe h GLU 1538Ca 0.51 0.00 -0.64 0.00 0.34 0.00 0.00 59.36 59.57 1xwe h GLU 1538Cb 0.58 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 29.04 1xwe h GLU 1538CO -0.29 0.00 -0.56 0.42 -1.16 0.00 0.00 179.01 177.42 1xwe s ILE 1539N -4.09 4.96 -0.10 3.13 -1.09 0.34 -2.02 121.20 122.34 1xwe s ILE 1539Ca -0.05 0.05 0.14 0.00 -2.23 0.00 0.00 60.65 58.56 1xwe s ILE 1539Cb 0.12 -3.34 -0.24 0.00 -1.58 0.00 0.00 42.46 37.42 1xwe s ILE 1539CO 0.38 0.29 0.47 0.00 -1.23 0.00 0.00 174.94 174.85 1xwe n ALA 1540N 4.93 1.48 -2.22 9.38 0.00 0.10 -4.69 120.51 129.49 1xwe n ALA 1540Ca -0.15 -0.94 -0.08 0.00 0.00 0.00 0.00 53.44 52.27 1xwe n ALA 1540Cb 0.52 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 19.23 1xwe n ALA 1540CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1xwe s TYR 1541N -2.56 0.54 -0.38 0.00 -0.85 -0.41 -4.24 117.35 109.44 1xwe s TYR 1541Ca -0.07 -0.98 0.04 0.00 -0.52 0.00 0.00 57.07 55.54 1xwe s TYR 1541Cb 0.07 -0.38 0.16 0.00 0.38 0.00 0.00 41.96 42.19 1xwe s TYR 1541CO 0.82 -0.32 0.42 0.00 -1.52 0.00 0.00 175.55 174.95 1xwe s ALA 1542N -3.54 -0.63 0.13 9.51 0.00 -0.93 -1.61 121.76 124.68 1xwe s ALA 1542Ca 0.05 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.10 1xwe s ALA 1542Cb 0.05 -2.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1xwe s ALA 1542CO -0.08 -2.16 0.03 1.52 0.00 0.00 0.00 175.76 175.07 1xwe s TYR 1543N 1.38 0.88 -0.14 0.00 -0.85 -0.64 -1.16 117.35 116.82 1xwe s TYR 1543Ca 0.18 -1.16 -0.02 0.00 -0.52 0.00 0.00 57.07 55.56 1xwe s TYR 1543Cb -0.13 -0.51 -0.02 0.00 0.38 0.00 0.00 41.96 41.68 1xwe s TYR 1543CO -0.03 -0.42 -0.08 0.21 -1.52 0.00 0.00 175.55 173.70 1xwe s LYS 1544N -3.99 3.48 0.42 -3.49 2.36 -0.75 -1.80 119.74 115.98 1xwe s LYS 1544Ca 0.21 -0.59 0.02 0.00 -2.55 0.00 0.00 55.97 53.06 1xwe s LYS 1544Cb 0.07 -2.77 -0.01 0.00 -1.05 0.00 0.00 37.83 34.08 1xwe s LYS 1544CO 0.00 0.26 0.07 1.33 1.55 0.00 0.00 175.35 178.57 1xwe n VAL 1545N 3.43 0.00 -3.85 4.02 0.24 -0.89 -1.24 118.33 120.03 1xwe n VAL 1545Ca -0.18 -2.23 -0.12 0.00 -2.04 0.00 0.00 64.34 59.77 1xwe n VAL 1545Cb 0.53 0.64 -0.13 0.00 -1.47 0.00 0.00 33.84 33.40 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 -3.46 -0.06 0.19 -1.34 0.15 -0.50 -1.74 113.70 106.94 1xwe s SER 1546Ca 0.10 0.11 -0.30 0.00 0.70 0.00 0.00 55.95 56.57 1xwe s SER 1546Cb 0.01 0.15 -0.08 0.00 -1.71 0.00 0.00 66.02 64.39 1xwe s SER 1546CO 0.07 -0.05 1.00 -0.63 1.20 0.00 0.00 173.24 174.84 1xwe s ILE 1547N -0.07 4.09 0.00 6.45 -1.09 -0.59 -1.75 121.20 128.25 1xwe s ILE 1547Ca -0.01 1.91 0.00 0.00 -2.23 0.00 0.00 60.65 60.32 1xwe s ILE 1547Cb -0.01 -4.22 0.00 0.00 -1.58 0.00 0.00 42.46 36.65 1xwe s ILE 1547CO 0.00 0.38 0.00 1.07 -1.23 0.00 0.00 174.94 175.16 1xwe n THR 1548N 2.06 0.00 -3.62 2.92 5.66 -1.17 -2.30 114.28 117.83 1xwe n THR 1548Ca 0.01 -0.04 -0.15 0.00 -3.05 0.00 0.00 64.05 60.81 1xwe n THR 1548Cb 0.47 0.40 -0.07 0.00 -1.55 0.00 0.00 70.33 69.57 1xwe n THR 1548CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1xwe s SER 1549N -0.47 -0.56 -0.01 1.09 0.01 -0.20 -4.90 113.70 108.67 1xwe s SER 1549Ca 0.00 0.79 0.02 0.00 1.31 0.00 0.00 55.95 58.06 1xwe s SER 1549Cb 0.00 0.76 0.00 0.00 0.21 0.00 0.00 66.02 66.99 1xwe s SER 1549CO 0.00 -0.42 -0.05 -0.63 0.41 0.00 0.00 173.24 172.55 1xwe s ILE 1550N -0.64 0.42 -0.07 1.44 1.01 -1.26 -0.70 121.20 121.40 1xwe s ILE 1550Ca -0.07 -0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.42 1xwe s ILE 1550Cb -0.03 -0.38 -0.02 0.00 0.01 0.00 0.00 42.46 42.05 1xwe s ILE 1550CO 0.05 0.13 -0.17 -0.89 0.00 0.00 0.00 174.94 174.07 1xwe s THR 1551N 0.08 2.79 -0.06 2.92 2.01 -0.43 -4.94 115.64 118.01 1xwe s THR 1551Ca -0.01 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1xwe s THR 1551Cb -0.04 -2.09 0.02 0.00 0.01 0.00 0.00 72.50 70.40 1xwe s THR 1551CO -0.00 0.57 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.78 1xwe s VAL 1552N -0.35 0.54 0.00 3.82 1.01 -1.26 -1.46 120.40 122.69 1xwe s VAL 1552Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1xwe s VAL 1552Cb -0.12 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.65 1xwe s VAL 1552CO 0.02 0.25 0.00 -0.62 0.00 0.00 0.00 175.10 174.76 1xwe n GLU 1553N 4.53 3.46 0.02 2.72 1.02 -1.18 -5.02 120.64 126.19 1xwe n GLU 1553Ca -0.17 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.87 1xwe n GLU 1553Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.89 1xwe n GLU 1553CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1xwe h ASN 1554N 0.00 -0.65 0.00 1.62 -0.26 -2.04 -3.42 115.58 110.83 1xwe h ASN 1554Ca 0.00 0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.84 1xwe h ASN 1554Cb 0.00 0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 1xwe h ASN 1554CO 0.00 -0.27 -0.31 1.33 -1.06 0.00 0.00 177.43 177.12 1xwe n VAL 1555N -5.34 0.07 -2.83 2.81 0.24 -1.26 -5.04 118.33 106.98 1xwe n VAL 1555Ca -0.04 0.02 -0.41 0.00 -2.04 0.00 0.00 64.34 61.88 1xwe n VAL 1555Cb 0.26 -0.87 -0.04 0.00 -1.47 0.00 0.00 33.84 31.72 1xwe n VAL 1555CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1xwe s PHE 1556N -2.00 3.68 0.22 6.34 0.08 -1.26 -2.69 117.98 122.34 1xwe s PHE 1556Ca 0.00 1.58 0.08 0.00 0.12 0.00 0.00 56.93 58.71 1xwe s PHE 1556Cb 0.00 -2.99 -0.05 0.00 -0.57 0.00 0.00 43.02 39.41 1xwe s PHE 1556CO 0.00 0.09 -0.13 0.14 -0.10 0.00 0.00 175.22 175.22 1xwe s VAL 1557N 0.63 1.77 0.35 -0.44 -7.23 -0.94 -3.12 120.40 111.43 1xwe s VAL 1557Ca 0.46 -2.21 0.04 0.00 -1.81 0.00 0.00 61.98 58.46 1xwe s VAL 1557Cb -0.21 -2.13 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 1xwe s VAL 1557CO 0.25 -0.53 0.06 -0.54 -0.31 0.00 0.00 175.10 174.02 1xwe s LYS 1558N -3.65 1.74 -0.14 4.82 1.02 -0.53 -2.21 119.74 120.79 1xwe s LYS 1558Ca 0.24 -1.98 -0.04 0.00 0.02 0.00 0.00 55.97 54.21 1xwe s LYS 1558Cb -0.00 -0.98 0.06 0.00 -0.52 0.00 0.00 37.83 36.38 1xwe s LYS 1558CO 0.08 -0.20 0.10 0.71 -0.92 0.00 0.00 175.35 175.12 1xwe s TYR 1559N -3.19 0.09 -0.48 3.18 2.02 0.87 -1.31 117.35 118.55 1xwe s TYR 1559Ca 0.34 -0.07 -0.21 0.00 -0.37 0.00 0.00 57.07 56.76 1xwe s TYR 1559Cb 0.08 -0.58 0.04 0.00 -0.40 0.00 0.00 41.96 41.09 1xwe s TYR 1559CO 0.15 -0.43 0.67 0.15 -1.57 0.00 0.00 175.55 174.52 1xwe s LYS 1560N 2.17 3.23 0.09 -0.62 -0.14 0.12 -1.90 119.74 122.69 1xwe s LYS 1560Ca 0.03 -0.55 0.05 0.00 -1.36 0.00 0.00 55.97 54.14 1xwe s LYS 1560Cb -0.15 -4.01 -0.03 0.00 -1.68 0.00 0.00 37.83 31.95 1xwe s LYS 1560CO -0.08 -1.14 -0.13 0.00 -0.76 0.00 0.00 175.35 173.25 1xwe s ALA 1561N 2.88 1.19 -0.09 5.17 0.00 -0.95 -1.03 121.76 128.93 1xwe s ALA 1561Ca 0.21 -1.10 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 1xwe s ALA 1561Cb -0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1xwe s ALA 1561CO 0.16 0.09 0.09 0.99 0.00 0.00 0.00 175.76 177.09 1xwe s THR 1562N -1.79 5.05 0.15 0.00 2.01 -0.71 -2.52 115.64 117.83 1xwe s THR 1562Ca 0.02 -0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.69 1xwe s THR 1562Cb -0.07 -3.20 -0.07 0.00 0.01 0.00 0.00 72.50 69.17 1xwe s THR 1562CO 0.02 0.56 1.04 -0.22 -0.69 0.00 0.00 174.62 175.33 1xwe s LEU 1563N -1.13 4.50 -0.22 4.42 0.20 -1.10 -1.41 118.68 123.93 1xwe s LEU 1563Ca 0.16 1.97 -0.17 0.00 0.69 0.00 0.00 54.13 56.78 1xwe s LEU 1563Cb -0.12 -3.60 -0.18 0.00 -0.43 0.00 0.00 46.19 41.86 1xwe s LEU 1563CO 0.06 -0.15 0.07 0.18 -0.29 0.00 0.00 176.35 176.21 1xwe n LEU 1564N 2.53 2.03 -3.58 -0.68 4.32 -0.37 -3.34 117.00 117.91 1xwe n LEU 1564Ca 0.02 0.35 -0.16 0.00 -0.02 0.00 0.00 56.01 56.21 1xwe n LEU 1564Cb 0.47 -0.95 -0.06 0.00 -1.62 0.00 0.00 43.42 41.26 1xwe n LEU 1564CO 0.53 0.45 0.44 -0.62 -1.22 0.00 0.00 177.39 176.97 1xwe s ASP 1565N -7.03 -0.69 -0.19 -1.43 2.15 -1.00 -4.41 116.67 104.08 1xwe s ASP 1565Ca -0.31 1.06 -0.05 0.00 0.43 0.00 0.00 52.55 53.68 1xwe s ASP 1565Cb 0.08 0.98 -0.02 0.00 -0.30 0.00 0.00 42.92 43.65 1xwe s ASP 1565CO 0.59 -0.43 -0.01 -0.63 -0.17 0.00 0.00 175.17 174.52 1xwe s ILE 1566N -0.43 3.93 -0.12 4.11 1.01 -1.26 -1.80 121.20 126.65 1xwe s ILE 1566Ca -0.05 -0.33 0.20 0.00 0.00 0.00 0.00 60.65 60.47 1xwe s ILE 1566Cb -0.02 -2.76 -0.28 0.00 0.01 0.00 0.00 42.46 39.40 1xwe s ILE 1566CO 0.05 0.45 0.31 -1.22 0.00 0.00 0.00 174.94 174.53 1xwe n TYR 1567N 4.05 0.07 -3.62 3.97 4.01 -0.31 -4.86 117.16 120.46 1xwe n TYR 1567Ca -0.17 0.02 -0.24 0.00 -0.16 0.00 0.00 57.90 57.35 1xwe n TYR 1567Cb 0.52 -0.77 -0.17 0.00 -0.31 0.00 0.00 39.34 38.61 1xwe n TYR 1567CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1xwe s LYS 1568N -3.00 0.02 0.29 -0.72 1.02 -0.72 -4.80 119.74 111.83 1xwe s LYS 1568Ca -0.09 0.09 -0.27 0.00 0.02 0.00 0.00 55.97 55.73 1xwe s LYS 1568Cb 0.10 -1.35 -0.15 0.00 -0.52 0.00 0.00 37.83 35.91 1xwe s LYS 1568CO 0.87 -0.55 0.79 2.41 -0.92 0.00 0.00 175.35 177.94 1xwe n THR 1569N 5.29 1.96 -3.87 2.17 -1.04 -1.26 -2.20 114.28 115.34 1xwe n THR 1569Ca -0.06 -0.50 -0.35 0.00 -2.04 0.00 0.00 64.05 61.10 1xwe n THR 1569Cb 0.49 -0.64 -0.08 0.00 -1.82 0.00 0.00 70.33 68.28 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 -0.76 2.00 0.56 3.41 0.00 -1.26 -4.14 107.32 107.13 1xwe s GLY 1570Ca 0.61 -0.71 0.25 0.00 0.00 0.00 0.00 44.72 44.87 1xwe s GLY 1570CO 0.59 0.03 2.20 0.83 0.00 0.00 0.00 173.10 176.74 1xwe h GLU 1571N 6.45 0.00 -3.20 2.90 5.08 -1.93 -2.90 114.58 120.98 1xwe h GLU 1571Ca -0.41 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.19 1xwe h GLU 1571Cb 1.17 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.26 1xwe h GLU 1571CO 0.71 0.02 2.03 0.00 -1.00 0.00 0.00 179.01 180.78 1xwe n ALA 1572N -2.39 5.76 -3.27 3.43 0.00 -1.26 -4.80 120.51 117.99 1xwe n ALA 1572Ca -0.03 -4.30 -0.34 0.00 0.00 0.00 0.00 53.44 48.78 1xwe n ALA 1572Cb 0.11 -2.87 0.03 0.00 0.00 0.00 0.00 19.45 16.72 1xwe n ALA 1572CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1xwe n VAL 1573N 2.70 -3.38 -4.63 0.00 3.14 -1.20 -4.90 118.33 110.06 1xwe n VAL 1573Ca 0.45 0.09 -0.33 0.00 -2.96 0.00 0.00 64.34 61.59 1xwe n VAL 1573Cb 0.33 -3.15 -0.14 0.00 -1.06 0.00 0.00 33.84 29.81 1xwe n VAL 1573CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1xwe s ALA 1574N -1.29 2.67 0.07 1.55 0.00 -1.10 -4.98 121.76 118.68 1xwe s ALA 1574Ca 0.33 -0.92 -0.05 0.00 0.00 0.00 0.00 51.96 51.33 1xwe s ALA 1574Cb -0.03 -1.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.77 1xwe s ALA 1574CO 0.75 0.16 0.08 -1.83 0.00 0.00 0.00 175.76 174.92 1xwe s GLU 1575N 0.49 0.73 -0.30 0.00 -1.05 -1.26 -4.46 118.70 112.85 1xwe s GLU 1575Ca -0.08 -1.10 -0.33 0.00 -0.15 0.00 0.00 54.97 53.31 1xwe s GLU 1575Cb -0.15 0.28 -0.10 0.00 -0.44 0.00 0.00 34.13 33.71 1xwe s GLU 1575CO 0.04 -0.19 2.18 1.17 0.95 0.00 0.00 175.26 179.41 1xwe n LYS 1576N 0.02 1.38 -2.76 -4.83 3.00 -1.26 -3.10 118.16 110.60 1xwe n LYS 1576Ca -0.14 0.38 -0.07 0.00 -0.00 0.00 0.00 58.31 58.48 1xwe n LYS 1576Cb 0.62 -2.69 0.01 0.00 0.00 0.00 0.00 35.03 32.97 1xwe n LYS 1576CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1xwe n ASP 1577N 10.19 -7.66 -1.34 3.14 -0.08 -1.21 -5.05 116.55 114.55 1xwe n ASP 1577Ca 0.37 0.59 0.00 0.00 -1.51 0.00 0.00 54.79 54.25 1xwe n ASP 1577Cb 0.29 -5.17 0.00 0.00 2.34 0.00 0.00 41.12 38.59 1xwe n ASP 1577CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1xwe n SER 1578N -0.21 1.48 -4.06 1.67 3.41 -1.18 -4.82 113.62 109.91 1xwe n SER 1578Ca 0.10 -0.67 -0.33 0.00 -0.26 0.00 0.00 58.87 57.72 1xwe n SER 1578Cb 0.39 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.20 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 -0.83 1.77 0.06 4.33 -6.30 -1.26 -2.71 118.70 113.77 1xwe s GLU 1579Ca 0.00 -1.74 0.04 0.00 -2.50 0.00 0.00 54.97 50.77 1xwe s GLU 1579Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 34.13 30.85 1xwe s GLU 1579CO 0.00 -0.89 -0.01 0.96 0.02 0.00 0.00 175.26 175.34 1xwe s ILE 1580N 1.01 4.00 -0.08 -3.70 -4.36 -1.05 -5.04 121.20 111.98 1xwe s ILE 1580Ca 0.06 -0.90 -0.02 0.00 -0.26 0.00 0.00 60.65 59.54 1xwe s ILE 1580Cb -0.20 -2.87 0.03 0.00 1.25 0.00 0.00 42.46 40.68 1xwe s ILE 1580CO -0.06 0.20 0.02 -0.89 0.24 0.00 0.00 174.94 174.44 1xwe s THR 1581N -1.24 0.29 -0.21 8.37 2.01 -1.26 -2.25 115.64 121.35 1xwe s THR 1581Ca 0.24 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.22 1xwe s THR 1581Cb -0.12 -0.53 -0.05 0.00 0.01 0.00 0.00 72.50 71.82 1xwe s THR 1581CO 0.16 0.17 0.15 -0.36 -0.69 0.00 0.00 174.62 174.05 1xwe s PHE 1582N 2.00 3.38 0.12 4.92 0.40 -0.80 -1.18 117.98 126.82 1xwe s PHE 1582Ca 0.04 0.32 0.10 0.00 -0.60 0.00 0.00 56.93 56.79 1xwe s PHE 1582Cb -0.13 -2.21 -0.04 0.00 0.51 0.00 0.00 43.02 41.15 1xwe s PHE 1582CO -0.05 0.21 -0.25 0.96 0.70 0.00 0.00 175.22 176.79 1xwe s ILE 1583N 0.60 2.09 0.13 0.64 -4.36 -0.30 -0.09 121.20 119.92 1xwe s ILE 1583Ca 0.09 -1.68 -0.24 0.00 -0.26 0.00 0.00 60.65 58.55 1xwe s ILE 1583Cb -0.12 -1.86 0.08 0.00 1.25 0.00 0.00 42.46 41.81 1xwe s ILE 1583CO 0.01 0.05 1.09 -1.59 0.24 0.00 0.00 174.94 174.74 1xwe s LYS 1584N -1.99 1.08 0.41 0.37 0.00 -0.94 -3.64 119.74 115.03 1xwe s LYS 1584Ca 0.12 -0.68 -0.05 0.00 0.00 0.00 0.00 55.97 55.35 1xwe s LYS 1584Cb -0.10 0.31 -0.04 0.00 0.00 0.00 0.00 37.83 38.00 1xwe s LYS 1584CO 0.05 -0.50 0.70 0.15 0.00 0.00 0.00 175.35 175.75 1xwe s LYS 1585N -2.26 3.59 0.00 1.78 1.02 -1.26 -2.20 119.74 120.40 1xwe s LYS 1585Ca 0.22 0.12 0.23 0.00 0.02 0.00 0.00 55.97 56.56 1xwe s LYS 1585Cb -0.02 -2.47 1.27 0.00 -0.52 0.00 0.00 37.83 36.09 1xwe s LYS 1585CO 0.03 -0.04 1.77 1.55 -0.92 0.00 0.00 175.35 177.75 1xwe n VAL 1586N -1.78 0.17 1.36 3.17 3.14 -1.10 -3.05 118.33 120.25 1xwe n VAL 1586Ca -0.00 0.04 0.10 0.00 -2.96 0.00 0.00 64.34 61.52 1xwe n VAL 1586Cb 0.55 -0.66 0.61 0.00 -1.06 0.00 0.00 33.84 33.27 1xwe n VAL 1586CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1xwe n THR 1587N -1.18 0.00 -2.43 1.55 -2.24 -1.26 -4.71 114.28 104.01 1xwe n THR 1587Ca 0.14 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.49 1xwe n THR 1587Cb 0.15 -0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 67.73 1xwe n THR 1587CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xwe n THR 1589N 6.68 2.59 -0.23 0.00 -1.04 -1.22 -4.51 114.28 116.56 1xwe n THR 1589Ca 0.15 -3.33 0.00 0.00 -2.04 0.00 0.00 64.05 58.83 1xwe n THR 1589Cb 0.48 -0.64 0.00 0.00 -1.82 0.00 0.00 70.33 68.35 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 -0.98 0.00 -4.05 8.00 4.13 -1.26 -4.96 115.26 116.14 1xwe n ASN 1590Ca 0.37 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 56.37 1xwe n ASN 1590Cb 0.91 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.99 1xwe n ASN 1590CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xwe s ALA 1591N 0.00 1.37 -0.26 5.41 0.00 -1.26 -4.15 121.76 122.87 1xwe s ALA 1591Ca 0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 1xwe s ALA 1591Cb 0.00 -0.59 0.13 0.00 0.00 0.00 0.00 23.12 22.66 1xwe s ALA 1591CO 0.00 0.14 0.30 -2.00 0.00 0.00 0.00 175.76 174.20 1xwe s GLU 1592N 0.60 0.30 0.41 0.00 2.12 -1.26 -4.96 118.70 115.91 1xwe s GLU 1592Ca -0.15 0.06 -0.17 0.00 0.36 0.00 0.00 54.97 55.08 1xwe s GLU 1592Cb -0.16 -0.73 -0.09 0.00 0.26 0.00 0.00 34.13 33.41 1xwe s GLU 1592CO 0.04 -0.88 0.87 -0.51 -0.54 0.00 0.00 175.26 174.24 1xwe s LEU 1593N 2.40 3.90 -0.02 2.70 1.43 -1.26 -5.08 118.68 122.75 1xwe s LEU 1593Ca 0.09 1.48 0.06 0.00 -1.03 0.00 0.00 54.13 54.73 1xwe s LEU 1593Cb -0.14 -4.34 -0.03 0.00 0.03 0.00 0.00 46.19 41.71 1xwe s LEU 1593CO -0.25 -0.36 -0.18 -0.69 0.23 0.00 0.00 176.35 175.09 1xwe s VAL 1594N -2.23 2.74 -0.57 -1.59 1.01 -1.26 -5.08 120.40 113.41 1xwe s VAL 1594Ca 0.58 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 61.35 1xwe s VAL 1594Cb -0.10 -2.06 0.03 0.00 0.00 0.00 0.00 36.38 34.25 1xwe s VAL 1594CO 0.20 0.53 1.22 -0.75 0.00 0.00 0.00 175.10 176.30 1xwe s LYS 1595N -0.86 3.51 0.00 2.72 2.20 -1.26 -3.15 119.74 122.89 1xwe s LYS 1595Ca 0.12 0.31 0.00 0.00 -0.36 0.00 0.00 55.97 56.04 1xwe s LYS 1595Cb -0.10 -4.02 0.00 0.00 -1.51 0.00 0.00 37.83 32.20 1xwe s LYS 1595CO 0.01 -1.69 0.00 0.41 -0.36 0.00 0.00 175.35 173.72 1xwe n GLY 1596N 5.07 1.73 3.98 5.54 0.00 -0.97 -4.97 105.19 115.57 1xwe n GLY 1596Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 1.99 0.10 1.61 3.00 -1.19 -4.84 118.95 119.62 1xwe s ARG 1597Ca 0.00 -0.99 0.08 0.00 0.00 0.00 0.00 55.73 54.82 1xwe s ARG 1597Cb 0.00 -2.38 -0.04 0.00 0.00 0.00 0.00 34.95 32.53 1xwe s ARG 1597CO 0.00 -1.19 -0.18 -0.65 0.00 0.00 0.00 175.30 173.28 1xwe s GLN 1598N -5.01 1.86 -0.03 3.54 -0.21 -1.26 -1.54 119.66 117.01 1xwe s GLN 1598Ca 0.63 -1.13 -0.03 0.00 0.02 0.00 0.00 55.36 54.85 1xwe s GLN 1598Cb -0.07 -2.13 0.01 0.00 1.00 0.00 0.00 33.01 31.81 1xwe s GLN 1598CO 0.42 0.50 0.08 0.71 -2.12 0.00 0.00 175.29 174.88 1xwe s TYR 1599N -1.08 -0.08 0.07 0.91 2.02 -0.71 -1.48 117.35 117.00 1xwe s TYR 1599Ca 0.17 0.19 -0.15 0.00 -0.37 0.00 0.00 57.07 56.92 1xwe s TYR 1599Cb -0.11 0.02 -0.06 0.00 -0.40 0.00 0.00 41.96 41.42 1xwe s TYR 1599CO 0.09 -0.06 0.48 -1.17 -1.57 0.00 0.00 175.55 173.32 1xwe s LEU 1600N -0.04 4.43 -0.03 -1.29 1.98 -0.44 -2.10 118.68 121.19 1xwe s LEU 1600Ca -0.01 1.03 0.00 0.00 -2.89 0.00 0.00 54.13 52.27 1xwe s LEU 1600Cb -0.01 -2.91 0.03 0.00 0.66 0.00 0.00 46.19 43.96 1xwe s LEU 1600CO 0.00 0.23 0.01 -0.63 -1.89 0.00 0.00 176.35 174.07 1xwe s ILE 1601N -1.24 0.09 -0.25 6.68 1.01 -0.74 -1.98 121.20 124.77 1xwe s ILE 1601Ca 0.30 0.13 -0.03 0.00 0.00 0.00 0.00 60.65 61.05 1xwe s ILE 1601Cb -0.16 -0.20 0.10 0.00 0.01 0.00 0.00 42.46 42.21 1xwe s ILE 1601CO 0.17 0.12 0.21 -0.04 0.00 0.00 0.00 174.94 175.40 1xwe s MET 1602N 1.02 0.22 0.21 2.79 -1.94 -0.65 -1.63 119.30 119.32 1xwe s MET 1602Ca -0.10 -0.10 -0.21 0.00 -1.71 0.00 0.00 55.69 53.57 1xwe s MET 1602Cb -0.13 -1.09 0.07 0.00 2.01 0.00 0.00 34.83 35.69 1xwe s MET 1602CO -0.02 -0.86 1.02 0.20 -0.01 0.00 0.00 175.02 175.35 1xwe s GLY 1603N 2.27 0.16 1.00 -0.03 0.00 -0.63 -2.83 107.32 107.25 1xwe s GLY 1603Ca 0.08 -0.41 -0.11 0.00 0.00 0.00 0.00 44.72 44.27 1xwe s GLY 1603CO -0.24 2.41 1.05 1.17 0.00 0.00 0.00 173.10 177.49 1xwe n LYS 1604N -0.71 -1.07 -0.43 2.90 3.00 -0.85 -0.72 118.16 120.28 1xwe n LYS 1604Ca -0.03 -0.26 -0.31 0.00 -0.00 0.00 0.00 58.31 57.71 1xwe n LYS 1604Cb 0.59 -2.28 0.29 0.00 0.00 0.00 0.00 35.03 33.63 1xwe n LYS 1604CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1xwe s GLU 1605N -4.49 -2.99 0.23 1.64 -1.05 -1.26 -4.62 118.70 106.17 1xwe s GLU 1605Ca 0.67 0.05 0.07 0.00 -0.15 0.00 0.00 54.97 55.60 1xwe s GLU 1605Cb -0.23 -1.38 -0.04 0.00 -0.44 0.00 0.00 34.13 32.04 1xwe s GLU 1605CO 0.61 -4.89 0.16 0.00 0.95 0.00 0.00 175.26 172.08 1xwe s ALA 1606N -2.33 3.53 0.54 -0.84 0.00 -1.26 -4.99 121.76 116.40 1xwe s ALA 1606Ca 0.69 -1.40 -0.21 0.00 0.00 0.00 0.00 51.96 51.04 1xwe s ALA 1606Cb -0.12 -1.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.70 1xwe s ALA 1606CO 0.57 0.31 1.25 -0.48 0.00 0.00 0.00 175.76 177.41 1xwe s LEU 1607N -3.65 3.83 -0.07 0.00 0.05 -1.26 -4.85 118.68 112.73 1xwe s LEU 1607Ca 0.32 2.49 0.04 0.00 0.05 0.00 0.00 54.13 57.03 1xwe s LEU 1607Cb -0.08 -4.38 -0.01 0.00 -2.05 0.00 0.00 46.19 39.66 1xwe s LEU 1607CO 0.24 -1.39 -0.20 -1.10 -0.55 0.00 0.00 176.35 173.35 1xwe s GLN 1608N -3.00 2.75 0.00 1.48 -0.21 -1.26 -4.33 119.66 115.08 1xwe s GLN 1608Ca 0.71 -0.82 0.00 0.00 0.02 0.00 0.00 55.36 55.28 1xwe s GLN 1608Cb -0.33 -2.31 0.00 0.00 1.00 0.00 0.00 33.01 31.37 1xwe s GLN 1608CO 0.38 0.38 0.00 0.44 -2.12 0.00 0.00 175.29 174.38 1xwe n ILE 1609N 2.97 0.00 -1.52 1.08 -0.00 -0.63 -5.02 119.36 116.24 1xwe n ILE 1609Ca -0.18 0.00 -0.60 0.00 -0.00 0.00 0.00 62.75 61.98 1xwe n ILE 1609Cb 0.52 0.53 -0.08 0.00 -0.00 0.00 0.00 39.64 40.61 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 0.00 0.00 0.00 6.28 4.81 -0.55 -4.44 118.16 124.26 1xwe n LYS 1610Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1xwe n LYS 1610Cb 0.00 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 33.65 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 2.64 0.00 0.06 5.64 9.36 -1.26 -4.83 117.16 128.78 1xwe n TYR 1611Ca 0.24 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.46 1xwe n TYR 1611Cb 0.01 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.72 1xwe n TYR 1611CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1xwe n ASN 1612N -1.38 -0.82 0.00 2.98 0.23 -1.26 -5.06 115.26 109.95 1xwe n ASN 1612Ca 0.00 0.23 0.00 0.00 -0.53 0.00 0.00 54.58 54.28 1xwe n ASN 1612Cb 0.16 0.99 0.00 0.00 -2.08 0.00 0.00 39.78 38.85 1xwe n ASN 1612CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xwe n ALA 1613N -2.80 0.00 0.42 -2.53 0.00 -1.26 -4.92 120.51 109.42 1xwe n ALA 1613Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1xwe n ALA 1613Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.70 1xwe n ALA 1613CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1xwe n SER 1614N -0.76 0.00 -4.41 0.00 7.64 -1.26 -4.73 113.62 110.11 1xwe n SER 1614Ca 0.00 0.42 -0.25 0.00 1.01 0.00 0.00 58.87 60.06 1xwe n SER 1614Cb 0.00 -0.46 -0.10 0.00 -1.01 0.00 0.00 64.21 62.65 1xwe n SER 1614CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1xwe s PHE 1615N -2.91 1.95 0.00 1.43 0.08 -1.26 -5.03 117.98 112.24 1xwe s PHE 1615Ca 0.07 -1.03 0.00 0.00 0.12 0.00 0.00 56.93 56.09 1xwe s PHE 1615Cb 0.07 -1.33 0.00 0.00 -0.57 0.00 0.00 43.02 41.19 1xwe s PHE 1615CO 0.20 -0.01 0.00 -2.13 -0.10 0.00 0.00 175.22 173.18 1xwe n ARG 1616N -0.84 0.00 0.03 0.44 0.63 -1.26 -4.35 116.66 111.30 1xwe n ARG 1616Ca -0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.88 1xwe n ARG 1616Cb 0.66 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.57 1xwe n ARG 1616CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1xwe n TYR 1617N 0.00 -0.44 -2.10 -0.14 4.02 -1.26 -1.47 117.16 115.77 1xwe n TYR 1617Ca 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1xwe n TYR 1617Cb 0.00 0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 1xwe n TYR 1617CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1xwe n ILE 1618N -2.83 -0.99 -1.58 -0.72 -0.00 -1.26 -4.30 119.36 107.68 1xwe n ILE 1618Ca 0.00 0.18 -0.45 0.00 -0.00 0.00 0.00 62.75 62.48 1xwe n ILE 1618Cb 0.10 -1.77 -0.02 0.00 -0.00 0.00 0.00 39.64 37.96 1xwe n ILE 1618CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 1xwe n TYR 1619N 1.44 1.17 0.29 4.28 4.02 -0.33 -4.73 117.16 123.31 1xwe n TYR 1619Ca 0.00 0.72 0.14 0.00 -0.01 0.00 0.00 57.90 58.75 1xwe n TYR 1619Cb 0.18 -2.24 0.42 0.00 -0.02 0.00 0.00 39.34 37.68 1xwe n TYR 1619CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1xwe h PRO 1620N 2.02 0.00 -5.41 -0.72 0.13 -1.85 -0.79 132.00 125.39 1xwe h PRO 1620Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1xwe h PRO 1620Cb 1.35 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.45 1xwe h PRO 1620CO 0.61 0.00 -1.06 -0.11 -0.23 0.00 0.00 178.00 177.21 1xwe n LEU 1621N -2.97 -6.63 0.00 1.56 7.94 -1.24 -4.48 117.00 111.19 1xwe n LEU 1621Ca 0.03 1.41 -0.16 0.00 -1.11 0.00 0.00 56.01 56.18 1xwe n LEU 1621Cb 0.41 -2.90 -0.03 0.00 0.53 0.00 0.00 43.42 41.42 1xwe n LEU 1621CO 0.30 -3.06 -0.11 0.47 -1.11 0.00 0.00 177.39 173.88 1xwe n ASP 1622N 1.15 2.42 0.15 1.96 8.00 -1.26 -4.53 116.55 124.43 1xwe n ASP 1622Ca -0.09 -2.12 0.01 0.00 0.71 0.00 0.00 54.79 53.30 1xwe n ASP 1622Cb 0.23 0.24 0.19 0.00 -0.02 0.00 0.00 41.12 41.76 1xwe n ASP 1622CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1xwe h SER 1623N 0.66 0.00 -0.20 -2.24 4.64 -1.89 -3.07 113.55 111.45 1xwe h SER 1623Ca -0.20 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.09 1xwe h SER 1623Cb 0.64 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1xwe h SER 1623CO 0.34 0.56 0.06 0.17 -0.87 0.00 0.00 176.83 177.09 1xwe h LEU 1624N 0.00 0.35 -8.43 5.97 8.10 -1.94 -3.39 115.31 115.97 1xwe h LEU 1624Ca -0.01 -0.04 -0.18 0.00 0.11 0.00 0.00 57.88 57.76 1xwe h LEU 1624Cb 1.12 -0.09 0.00 0.00 -0.44 0.00 0.00 40.66 41.25 1xwe h LEU 1624CO 0.07 0.36 0.66 0.41 -4.11 0.00 0.00 178.44 175.84 1xwe n THR 1625N -4.38 -0.03 -1.56 0.15 -1.04 -1.16 -4.80 114.28 101.45 1xwe n THR 1625Ca 0.01 -0.61 -0.39 0.00 -2.04 0.00 0.00 64.05 61.02 1xwe n THR 1625Cb 0.17 -2.24 -0.03 0.00 -1.82 0.00 0.00 70.33 66.40 1xwe n THR 1625CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1xwe n TRP 1626N 17.42 1.60 -5.18 -1.42 -0.00 -1.13 -4.84 117.44 123.89 1xwe n TRP 1626Ca 0.44 0.04 -0.32 0.00 -0.00 0.00 0.00 57.50 57.67 1xwe n TRP 1626Cb 0.46 -2.66 -0.16 0.00 -0.00 0.00 0.00 31.31 28.95 1xwe n TRP 1626CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 1xwe s ILE 1627N 10.67 2.20 -0.08 5.87 1.01 -1.25 -1.63 121.20 137.99 1xwe s ILE 1627Ca 1.00 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1xwe s ILE 1627Cb -0.28 -1.83 0.04 0.00 0.01 0.00 0.00 42.46 40.40 1xwe s ILE 1627CO 0.31 0.56 0.06 -0.70 0.00 0.00 0.00 174.94 175.17 1xwe s GLU 1628N 0.10 0.04 -0.01 2.79 2.12 -0.84 -3.49 118.70 119.41 1xwe s GLU 1628Ca -0.11 0.22 -0.33 0.00 0.36 0.00 0.00 54.97 55.11 1xwe s GLU 1628Cb -0.16 -0.90 -0.11 0.00 0.26 0.00 0.00 34.13 33.21 1xwe s GLU 1628CO 0.06 -0.41 1.86 0.98 -0.54 0.00 0.00 175.26 177.20 1xwe n TYR 1629N 5.27 2.39 -3.40 5.30 9.36 -1.26 -1.33 117.16 133.48 1xwe n TYR 1629Ca -0.04 -0.05 -0.44 0.00 3.32 0.00 0.00 57.90 60.68 1xwe n TYR 1629Cb 0.50 -2.68 -0.09 0.00 -0.63 0.00 0.00 39.34 36.44 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 3.60 3.23 -0.64 2.98 -0.11 -0.55 -4.87 118.94 122.58 1xwe s TRP 1630Ca 0.89 -0.74 -0.33 0.00 1.22 0.00 0.00 56.10 57.13 1xwe s TRP 1630Cb -0.62 -2.93 -0.16 0.00 -1.50 0.00 0.00 33.47 28.26 1xwe s TRP 1630CO 0.47 -0.72 2.41 -2.30 -4.62 0.00 0.00 176.95 172.19 1xwe n PRO 1631N 5.24 0.50 -0.11 5.86 -0.02 -1.26 -4.12 135.00 141.08 1xwe n PRO 1631Ca -0.11 0.08 0.20 0.00 -2.02 0.00 0.00 63.50 61.65 1xwe n PRO 1631Cb 0.45 -2.13 0.62 0.00 -0.02 0.00 0.00 33.50 32.42 1xwe n PRO 1631CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1xwe h ARG 1632N 13.03 0.16 -6.31 -0.52 2.43 -1.95 -3.41 114.38 117.81 1xwe h ARG 1632Ca -0.16 -0.01 -0.60 0.00 -0.81 0.00 0.00 59.98 58.41 1xwe h ARG 1632Cb 1.32 -0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 30.73 1xwe h ARG 1632CO 1.19 0.11 -0.64 -0.51 -1.51 0.00 0.00 179.97 178.60 1xwe s ASP 1633N -5.95 4.88 -0.01 -3.80 1.11 -1.26 -5.03 116.67 106.61 1xwe s ASP 1633Ca -0.06 -0.36 0.05 0.00 0.18 0.00 0.00 52.55 52.36 1xwe s ASP 1633Cb 0.21 -1.08 -0.08 0.00 1.07 0.00 0.00 42.92 43.04 1xwe s ASP 1633CO 0.76 0.09 0.12 0.35 1.18 0.00 0.00 175.17 177.66 1xwe n THR 1634N -0.15 0.00 -3.26 -1.27 -2.24 -1.26 -4.79 114.28 101.31 1xwe n THR 1634Ca -0.09 -0.13 -0.25 0.00 -2.27 0.00 0.00 64.05 61.30 1xwe n THR 1634Cb 0.55 0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 69.13 1xwe n THR 1634CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1xwe n THR 1635N -1.65 1.33 0.00 4.28 -2.24 -1.26 -4.33 114.28 110.40 1xwe n THR 1635Ca -0.01 -4.86 0.00 0.00 -2.27 0.00 0.00 64.05 56.91 1xwe n THR 1635Cb 0.13 -1.78 0.00 0.00 -2.10 0.00 0.00 70.33 66.58 1xwe n THR 1635CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xwe n SER 1637N -0.80 1.75 -1.17 0.00 3.41 -1.26 -4.92 113.62 110.63 1xwe n SER 1637Ca 0.00 -1.52 -0.15 0.00 -0.26 0.00 0.00 58.87 56.94 1xwe n SER 1637Cb 0.00 0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 63.92 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 0.30 -5.41 0.00 4.04 2.88 -1.26 -4.82 113.62 109.34 1xwe n SER 1638Ca 0.17 0.37 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 1xwe n SER 1638Cb 0.40 -4.35 0.00 0.00 -0.75 0.00 0.00 64.21 59.51 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 -2.10 -2.11 0.00 0.00 7.27 -1.26 -4.95 117.38 114.22 1xwe n GLN 1640Ca 0.00 1.74 0.00 0.00 0.07 0.00 0.00 57.00 58.81 1xwe n GLN 1640Cb 0.00 -3.62 0.00 0.00 2.41 0.00 0.00 30.24 29.03 1xwe n GLN 1640CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xwe n ALA 1641N -0.14 2.31 0.32 1.69 0.00 -1.26 -4.85 120.51 118.59 1xwe n ALA 1641Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.60 1xwe n ALA 1641Cb 0.56 0.00 0.55 0.00 0.00 0.00 0.00 19.45 20.57 1xwe n ALA 1641CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1xwe h PHE 1642N 0.00 0.00 -0.06 0.00 3.57 -1.92 -2.46 116.94 116.06 1xwe h PHE 1642Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1xwe h PHE 1642Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1xwe h PHE 1642CO 0.00 0.00 0.00 1.28 -2.23 0.00 0.00 178.31 177.36 1xwe n LEU 1643N -2.82 0.66 0.00 0.59 4.77 -1.26 -3.54 117.00 115.40 1xwe n LEU 1643Ca 0.02 -0.27 -0.16 0.00 -0.03 0.00 0.00 56.01 55.56 1xwe n LEU 1643Cb 0.32 -0.04 -0.14 0.00 -2.33 0.00 0.00 43.42 41.23 1xwe n LEU 1643CO 0.26 0.14 -0.66 0.00 -1.33 0.00 0.00 177.39 175.80 1xwe h ALA 1644N 3.77 0.54 0.00 -1.18 0.00 -1.78 -3.30 119.26 117.32 1xwe h ALA 1644Ca 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 54.91 53.41 1xwe h ALA 1644Cb 0.19 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1xwe h ALA 1644CO 0.00 1.40 -0.70 -0.91 0.00 0.00 0.00 179.25 179.04 1xwe h ASN 1645N 0.05 0.00 0.31 0.00 2.35 -1.72 -3.29 115.58 113.28 1xwe h ASN 1645Ca -0.36 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.25 1xwe h ASN 1645Cb 2.03 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.39 1xwe h ASN 1645CO 0.09 0.45 -0.57 -0.07 -1.65 0.00 0.00 177.43 175.68 1xwe h LEU 1646N 0.00 0.31 -1.14 1.61 3.38 -1.71 -2.97 115.31 114.78 1xwe h LEU 1646Ca -0.04 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 1xwe h LEU 1646Cb 1.38 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1xwe h LEU 1646CO 0.05 0.81 -0.36 -0.78 0.09 0.00 0.00 178.44 178.25 1xwe h ASP 1647N 0.21 0.13 -0.31 -0.43 3.58 -1.63 -2.38 116.42 115.58 1xwe h ASP 1647Ca -0.00 -0.05 -0.18 0.00 0.42 0.00 0.00 57.03 57.22 1xwe h ASP 1647Cb 1.07 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 42.08 1xwe h ASP 1647CO 0.09 0.49 -0.50 -0.08 -2.88 0.00 0.00 179.24 176.35 1xwe h GLU 1648N 0.11 0.89 0.00 0.28 4.81 -1.62 -3.04 114.58 116.02 1xwe h GLU 1648Ca 0.01 -0.54 -0.07 0.00 -0.13 0.00 0.00 59.36 58.63 1xwe h GLU 1648Cb 0.69 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1xwe h GLU 1648CO 0.05 1.18 -0.35 0.35 -0.73 0.00 0.00 179.01 179.51 1xwe h PHE 1649N 0.70 0.00 0.12 0.92 3.57 -1.39 -2.36 116.94 118.50 1xwe h PHE 1649Ca 0.03 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.55 1xwe h PHE 1649Cb 1.11 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 1xwe h PHE 1649CO 0.07 0.35 -0.29 0.00 -2.23 0.00 0.00 178.31 176.22 1xwe h ALA 1650N 1.65 -0.49 -0.01 2.41 0.00 -1.31 -1.89 119.26 119.63 1xwe h ALA 1650Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xwe h ALA 1650Cb 0.77 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1xwe h ALA 1650CO 0.05 -0.83 -0.13 -1.91 0.00 0.00 0.00 179.25 176.43 1xwe n GLU 1651N -5.40 0.86 -0.00 0.00 2.13 -1.22 -3.60 120.64 113.42 1xwe n GLU 1651Ca -0.07 -0.38 -0.00 0.00 0.66 0.00 0.00 57.16 57.37 1xwe n GLU 1651Cb 0.31 -1.49 -0.00 0.00 0.27 0.00 0.00 31.44 30.52 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 0.94 -0.01 -0.51 4.31 3.58 -0.80 -2.58 116.42 121.35 1xwe h ASP 1652Ca 0.00 0.00 0.09 0.00 0.42 0.00 0.00 57.03 57.54 1xwe h ASP 1652Cb 0.40 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.42 1xwe h ASP 1652CO 0.00 0.04 0.35 -0.29 -2.88 0.00 0.00 179.24 176.46 1xwe h ILE 1653N -0.11 0.89 -0.01 2.25 6.09 -1.58 0.75 117.51 125.78 1xwe h ILE 1653Ca -0.00 -0.10 -0.00 0.00 -1.37 0.00 0.00 64.86 63.39 1xwe h ILE 1653Cb 0.01 0.57 -0.00 0.00 0.47 0.00 0.00 36.82 37.87 1xwe h ILE 1653CO 0.00 0.05 -0.00 0.15 -3.07 0.00 0.00 178.15 175.28 1xwe h PHE 1654N 0.29 0.03 0.00 2.19 3.57 -1.71 -3.27 116.94 118.04 1xwe h PHE 1654Ca 0.23 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1xwe h PHE 1654Cb 0.55 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1xwe h PHE 1654CO -0.00 0.36 0.00 -0.11 -2.23 0.00 0.00 178.31 176.33 1xwe n LEU 1655N -4.91 0.19 0.00 0.59 0.00 -0.83 -4.78 117.00 107.25 1xwe n LEU 1655Ca -0.08 0.17 0.00 0.00 0.00 0.00 0.00 56.01 56.10 1xwe n LEU 1655Cb 0.19 -0.42 0.00 0.00 0.00 0.00 0.00 43.42 43.19 1xwe n LEU 1655CO 0.34 -0.42 0.38 0.59 0.00 0.00 0.00 177.39 178.27 1xwe n ASN 1656N -2.11 0.00 -0.69 1.96 3.02 0.24 -5.01 115.26 112.67 1xwe n ASN 1656Ca 0.00 0.76 0.06 0.00 -0.03 0.00 0.00 54.58 55.37 1xwe n ASN 1656Cb 0.00 -0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 38.87 1xwe n ASN 1656CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xwe n GLY 1657N -0.83 -3.09 0.00 7.41 0.00 -0.21 -4.95 105.19 103.52 1xwe n GLY 1657Ca 0.00 -1.22 0.04 0.00 0.00 0.00 0.00 46.02 44.85 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32