#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 2.40 -0.25 1.61 0.15 -1.26 -5.12 113.70 111.23 1xwe s SER 1509Ca 0.00 -0.63 -0.05 0.00 0.70 0.00 0.00 55.95 55.97 1xwe s SER 1509Cb 0.00 -0.28 -0.00 0.00 -1.71 0.00 0.00 66.02 64.03 1xwe s SER 1509CO 0.00 -0.34 0.01 -2.28 1.20 0.00 0.00 173.24 171.82 1xwe s HIS 1510N 2.11 3.04 0.15 3.44 5.65 -1.26 -5.09 115.29 123.34 1xwe s HIS 1510Ca 0.02 -0.95 -0.08 0.00 0.25 0.00 0.00 55.06 54.29 1xwe s HIS 1510Cb -0.16 -2.16 -0.01 0.00 -1.18 0.00 0.00 32.58 29.07 1xwe s HIS 1510CO -0.09 -0.55 0.26 0.00 -0.65 0.00 0.00 174.74 173.71 1xwe s MET 1511N 1.49 1.10 -0.29 2.88 0.00 -1.26 -5.13 119.30 118.08 1xwe s MET 1511Ca 0.04 -1.16 0.02 0.00 0.00 0.00 0.00 55.69 54.60 1xwe s MET 1511Cb -0.15 0.37 0.19 0.00 0.00 0.00 0.00 34.83 35.23 1xwe s MET 1511CO -0.01 -0.39 0.59 0.00 0.00 0.00 0.00 175.02 175.21 1xwe s ALA 1512N -3.96 -2.30 0.11 3.16 0.00 -1.20 -5.06 121.76 112.51 1xwe s ALA 1512Ca 0.16 1.46 -0.30 0.00 0.00 0.00 0.00 51.96 53.28 1xwe s ALA 1512Cb 0.04 -2.33 -0.07 0.00 0.00 0.00 0.00 23.12 20.76 1xwe s ALA 1512CO -0.01 -1.56 1.20 0.16 0.00 0.00 0.00 175.76 175.54 1xwe s ASP 1513N 2.84 7.09 -0.32 0.00 -4.77 -1.26 -3.18 116.67 117.06 1xwe s ASP 1513Ca 0.16 2.09 0.08 0.00 -3.30 0.00 0.00 52.55 51.58 1xwe s ASP 1513Cb -0.13 -2.59 0.54 0.00 -1.09 0.00 0.00 42.92 39.66 1xwe s ASP 1513CO -0.23 -0.43 1.55 0.00 0.70 0.00 0.00 175.17 176.76 1xwe n GLY 1515N -1.10 -1.04 3.50 0.00 0.00 -1.21 -3.13 105.19 102.20 1xwe n GLY 1515Ca 0.38 0.41 -0.42 0.00 0.00 0.00 0.00 46.02 46.39 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 0.77 -2.98 1.61 7.27 -1.26 -4.15 117.38 118.64 1xwe n GLN 1516Ca 0.00 0.10 -0.35 0.00 0.07 0.00 0.00 57.00 56.82 1xwe n GLN 1516Cb 0.00 -2.57 -0.06 0.00 2.41 0.00 0.00 30.24 30.01 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 7.79 4.29 0.69 3.69 -1.94 -1.22 -4.60 119.30 128.00 1xwe s MET 1517Ca 1.13 0.99 -0.12 0.00 -1.71 0.00 0.00 55.69 55.98 1xwe s MET 1517Cb -0.71 -2.67 0.01 0.00 2.01 0.00 0.00 34.83 33.48 1xwe s MET 1517CO 0.40 0.26 1.08 -0.65 -0.01 0.00 0.00 175.02 176.10 1xwe s GLN 1518N -2.36 2.75 0.63 2.03 -1.52 -0.62 -4.99 119.66 115.58 1xwe s GLN 1518Ca 0.50 1.16 -0.18 0.00 -1.95 0.00 0.00 55.36 54.88 1xwe s GLN 1518Cb -0.15 -1.96 -0.02 0.00 -0.22 0.00 0.00 33.01 30.66 1xwe s GLN 1518CO 0.20 -1.26 1.27 -1.21 -0.25 0.00 0.00 175.29 174.04 1xwe s GLU 1519N -4.63 2.69 0.05 2.91 2.02 -1.26 -4.64 118.70 115.84 1xwe s GLU 1519Ca 0.62 1.99 -0.26 0.00 0.02 0.00 0.00 54.97 57.34 1xwe s GLU 1519Cb -0.17 -1.87 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 1xwe s GLU 1519CO 0.49 -1.47 0.81 -1.21 0.02 0.00 0.00 175.26 173.90 1xwe s GLU 1520N -3.36 4.53 -1.87 1.61 2.02 -1.26 -3.61 118.70 116.76 1xwe s GLU 1520Ca 0.81 1.14 0.00 0.00 0.02 0.00 0.00 54.97 56.94 1xwe s GLU 1520Cb -0.35 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.50 1xwe s GLU 1520CO 0.38 0.25 0.00 1.28 0.02 0.00 0.00 175.26 177.18 1xwe n LEU 1521N 2.88 -1.20 -4.55 1.80 4.77 -1.26 -4.86 117.00 114.58 1xwe n LEU 1521Ca -0.01 0.44 -0.37 0.00 -0.03 0.00 0.00 56.01 56.03 1xwe n LEU 1521Cb 0.50 -2.66 -0.03 0.00 -2.33 0.00 0.00 43.42 38.90 1xwe n LEU 1521CO 0.48 -1.01 1.83 -0.62 -1.33 0.00 0.00 177.39 176.75 1xwe s ASP 1522N -2.57 4.85 -0.81 -1.43 2.15 -1.24 -4.91 116.67 112.72 1xwe s ASP 1522Ca 0.00 0.80 -0.18 0.00 0.43 0.00 0.00 52.55 53.60 1xwe s ASP 1522Cb 0.00 -2.51 0.15 0.00 -0.30 0.00 0.00 42.92 40.25 1xwe s ASP 1522CO 0.00 -2.62 0.93 -0.76 -0.17 0.00 0.00 175.17 172.55 1xwe s LEU 1523N 10.65 5.55 0.00 -1.34 1.43 -1.26 -4.20 118.68 129.52 1xwe s LEU 1523Ca 0.84 -2.02 0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1xwe s LEU 1523Cb -0.16 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1xwe s LEU 1523CO 0.24 -0.96 0.00 1.07 0.23 0.00 0.00 176.35 176.93 1xwe n THR 1524N 5.12 0.00 -3.12 5.49 5.66 -1.26 -5.14 114.28 121.03 1xwe n THR 1524Ca 0.12 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.75 1xwe n THR 1524Cb 0.47 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.19 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 0.00 4.58 0.91 1.09 1.01 -1.26 -5.08 121.20 122.45 1xwe s ILE 1525Ca 0.00 1.32 -0.12 0.00 0.00 0.00 0.00 60.65 61.85 1xwe s ILE 1525Cb 0.00 -3.90 0.20 0.00 0.01 0.00 0.00 42.46 38.77 1xwe s ILE 1525CO 0.00 0.31 1.24 -1.54 0.00 0.00 0.00 174.94 174.96 1xwe n SER 1526N 1.01 0.51 -0.94 3.58 3.41 -1.26 -5.00 113.62 114.93 1xwe n SER 1526Ca -0.04 -1.70 0.12 0.00 -0.26 0.00 0.00 58.87 56.99 1xwe n SER 1526Cb 0.51 -0.91 0.14 0.00 -0.26 0.00 0.00 64.21 63.69 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 -3.56 2.47 0.03 7.33 0.00 -1.26 -4.12 120.51 121.39 1xwe n ALA 1527Ca -0.20 -0.70 0.11 0.00 0.00 0.00 0.00 53.44 52.65 1xwe n ALA 1527Cb 0.59 -0.84 -0.13 0.00 0.00 0.00 0.00 19.45 19.06 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 1.27 0.64 0.08 0.00 1.02 -1.26 -3.94 120.64 118.45 1xwe n GLU 1528Ca 0.15 -0.13 -0.09 0.00 -0.02 0.00 0.00 57.16 57.06 1xwe n GLU 1528Cb 0.58 -1.58 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 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 0.00 1.48 -0.54 2.62 2.02 -1.98 -1.80 112.91 114.71 1xwe h THR 1529Ca 0.00 -2.60 0.00 0.00 0.77 0.00 0.00 66.41 64.58 1xwe h THR 1529Cb 0.99 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.86 1xwe h THR 1529CO 0.00 0.76 0.00 -2.11 0.37 0.00 0.00 175.52 174.54 1xwe n ARG 1530N -3.67 3.14 0.01 6.66 1.85 -1.26 -3.92 116.66 119.47 1xwe n ARG 1530Ca -0.04 -2.30 -0.00 0.00 -1.00 0.00 0.00 57.85 54.51 1xwe n ARG 1530Cb 0.81 -1.75 -0.00 0.00 -1.05 0.00 0.00 32.46 30.47 1xwe n ARG 1530CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 1xwe n LYS 1531N 0.91 0.00 0.29 2.89 0.00 -1.18 -4.43 118.16 116.65 1xwe n LYS 1531Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 58.31 58.66 1xwe n LYS 1531Cb 0.72 -0.50 0.87 0.00 0.00 0.00 0.00 35.03 36.12 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 -0.00 0.00 0.00 1.64 1.08 -1.52 0.37 115.11 116.67 1xwe h GLN 1532Ca -0.00 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.11 1xwe h GLN 1532Cb 0.76 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.18 1xwe h GLN 1532CO -0.00 0.00 -0.58 1.15 -0.95 0.00 0.00 178.83 178.45 1xwe h THR 1533N 0.00 0.63 -0.29 -0.54 2.02 -1.79 -2.99 112.91 109.94 1xwe h THR 1533Ca 0.01 -1.93 -0.03 0.00 0.77 0.00 0.00 66.41 65.23 1xwe h THR 1533Cb 0.03 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1xwe h THR 1533CO -0.00 0.36 0.08 0.00 0.37 0.00 0.00 175.52 176.32 1xwe h ALA 1534N 1.60 0.38 -0.22 6.16 0.00 -1.13 -2.59 119.26 123.45 1xwe h ALA 1534Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xwe h ALA 1534Cb 1.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1xwe h ALA 1534CO 0.05 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.33 1xwe s LYS 1536N -1.72 4.13 0.64 0.00 2.20 -0.98 -4.85 119.74 119.17 1xwe s LYS 1536Ca 0.31 2.54 0.29 0.00 -0.36 0.00 0.00 55.97 58.75 1xwe s LYS 1536Cb 0.17 -2.99 1.54 0.00 -1.51 0.00 0.00 37.83 35.04 1xwe s LYS 1536CO 0.25 -0.53 1.89 -1.35 -0.36 0.00 0.00 175.35 175.25 1xwe h PRO 1537N 3.50 0.00 0.03 4.03 0.11 -1.91 0.24 132.00 138.00 1xwe h PRO 1537Ca -0.50 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 1xwe h PRO 1537Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1xwe h PRO 1537CO 0.68 0.00 -1.26 1.49 -0.21 0.00 0.00 178.00 178.70 1xwe h GLU 1538N 0.00 0.06 -4.98 1.05 4.81 -1.90 -3.44 114.58 110.18 1xwe h GLU 1538Ca 0.07 -0.10 -0.65 0.00 -0.13 0.00 0.00 59.36 58.55 1xwe h GLU 1538Cb 0.86 0.04 -0.17 0.00 0.63 0.00 0.00 28.75 30.11 1xwe h GLU 1538CO -0.00 0.91 -0.32 0.42 -0.73 0.00 0.00 179.01 179.29 1xwe s ILE 1539N -2.67 5.20 -0.15 2.32 1.09 0.85 -3.15 121.20 124.70 1xwe s ILE 1539Ca -0.02 0.19 -0.24 0.00 -1.10 0.00 0.00 60.65 59.48 1xwe s ILE 1539Cb 0.09 -3.74 -0.21 0.00 -1.06 0.00 0.00 42.46 37.54 1xwe s ILE 1539CO 0.83 0.03 0.54 0.00 -0.10 0.00 0.00 174.94 176.24 1xwe h ALA 1540N 8.38 0.05 -2.87 9.38 0.00 -0.59 -3.39 119.26 130.22 1xwe h ALA 1540Ca -0.31 -0.59 -0.62 0.00 0.00 0.00 0.00 54.91 53.39 1xwe h ALA 1540Cb 1.16 0.17 -0.14 0.00 0.00 0.00 0.00 17.79 18.97 1xwe h ALA 1540CO 0.65 0.16 -0.73 1.52 0.00 0.00 0.00 179.25 180.86 1xwe s TYR 1541N -2.18 2.57 -0.25 0.00 -0.85 -0.73 -4.56 117.35 111.35 1xwe s TYR 1541Ca -0.19 -0.25 -0.03 0.00 -0.52 0.00 0.00 57.07 56.09 1xwe s TYR 1541Cb -0.01 -1.23 0.11 0.00 0.38 0.00 0.00 41.96 41.21 1xwe s TYR 1541CO 0.58 0.54 0.23 0.00 -1.52 0.00 0.00 175.55 175.38 1xwe s ALA 1542N -1.83 -0.17 0.22 9.51 0.00 -0.97 -2.13 121.76 126.39 1xwe s ALA 1542Ca 0.25 -0.21 -0.05 0.00 0.00 0.00 0.00 51.96 51.95 1xwe s ALA 1542Cb -0.08 -1.51 0.02 0.00 0.00 0.00 0.00 23.12 21.56 1xwe s ALA 1542CO 0.15 -1.47 0.39 2.48 0.00 0.00 0.00 175.76 177.31 1xwe n TYR 1543N 5.30 -1.49 -5.24 0.00 0.18 -0.91 -0.25 117.16 114.76 1xwe n TYR 1543Ca -0.04 -1.22 -0.31 0.00 1.88 0.00 0.00 57.90 58.21 1xwe n TYR 1543Cb 0.47 0.45 -0.16 0.00 -0.38 0.00 0.00 39.34 39.73 1xwe n TYR 1543CO 0.00 0.00 0.00 -1.59 -2.08 0.00 0.00 176.86 173.19 1xwe s LYS 1544N -2.23 2.23 0.29 -3.48 -2.85 -0.97 -2.28 119.74 110.46 1xwe s LYS 1544Ca 0.13 -0.89 0.04 0.00 -1.00 0.00 0.00 55.97 54.25 1xwe s LYS 1544Cb -0.02 -2.11 -0.03 0.00 -2.06 0.00 0.00 37.83 33.61 1xwe s LYS 1544CO 0.09 0.55 0.22 0.14 0.10 0.00 0.00 175.35 176.44 1xwe s VAL 1545N -0.57 0.05 -0.11 1.79 -7.23 -0.92 -0.44 120.40 112.97 1xwe s VAL 1545Ca 0.09 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.21 1xwe s VAL 1545Cb -0.11 -2.50 0.05 0.00 0.56 0.00 0.00 36.38 34.39 1xwe s VAL 1545CO -0.00 0.00 0.23 -0.55 -0.31 0.00 0.00 175.10 174.47 1xwe s SER 1546N -3.31 0.16 0.49 4.85 0.15 -0.47 -1.69 113.70 113.86 1xwe s SER 1546Ca 0.39 0.51 -0.23 0.00 0.70 0.00 0.00 55.95 57.32 1xwe s SER 1546Cb 0.04 0.50 -0.07 0.00 -1.71 0.00 0.00 66.02 64.78 1xwe s SER 1546CO 0.21 -0.21 1.34 -0.63 1.20 0.00 0.00 173.24 175.15 1xwe s ILE 1547N 1.90 2.31 0.00 6.45 -1.09 -1.10 -1.55 121.20 128.12 1xwe s ILE 1547Ca -0.03 0.25 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 1xwe s ILE 1547Cb -0.11 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1xwe s ILE 1547CO -0.08 0.01 0.00 0.35 -1.23 0.00 0.00 174.94 173.99 1xwe n THR 1548N -0.56 0.00 -4.25 2.92 -2.24 -0.94 -1.86 114.28 107.35 1xwe n THR 1548Ca 0.08 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.71 1xwe n THR 1548Cb 0.44 -0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 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 -3.72 1.75 -0.14 3.42 0.15 -0.66 -4.68 113.70 109.82 1xwe s SER 1549Ca 0.00 -1.04 -0.02 0.00 0.70 0.00 0.00 55.95 55.59 1xwe s SER 1549Cb 0.00 -0.00 0.05 0.00 -1.71 0.00 0.00 66.02 64.35 1xwe s SER 1549CO 0.00 -0.36 0.01 -0.63 1.20 0.00 0.00 173.24 173.46 1xwe s ILE 1550N -3.36 0.53 -0.14 6.45 1.01 -1.26 -1.78 121.20 122.66 1xwe s ILE 1550Ca 0.18 -0.30 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 1xwe s ILE 1550Cb 0.03 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1xwe s ILE 1550CO 0.01 0.01 0.10 -0.89 0.00 0.00 0.00 174.94 174.17 1xwe s THR 1551N 1.88 5.13 -0.04 2.92 2.01 -0.71 -5.01 115.64 121.82 1xwe s THR 1551Ca 0.02 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.11 1xwe s THR 1551Cb -0.15 -3.25 0.01 0.00 0.01 0.00 0.00 72.50 69.12 1xwe s THR 1551CO -0.07 0.56 -0.08 0.54 -0.69 0.00 0.00 174.62 174.89 1xwe s VAL 1552N -0.54 0.73 0.10 3.82 0.11 -1.26 -1.25 120.40 122.11 1xwe s VAL 1552Ca 0.11 -0.28 0.00 0.00 -2.93 0.00 0.00 61.98 58.89 1xwe s VAL 1552Cb -0.12 -0.70 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 1xwe s VAL 1552CO 0.02 0.25 0.00 1.21 -3.33 0.00 0.00 175.10 173.25 1xwe n GLU 1553N 3.72 0.00 0.00 1.54 2.13 -1.26 -5.06 120.64 121.71 1xwe n GLU 1553Ca -0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.60 1xwe n GLU 1553Cb 0.52 -0.15 0.00 0.00 0.27 0.00 0.00 31.44 32.08 1xwe n GLU 1553CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1xwe n ASN 1554N -3.00 0.00 0.33 4.31 0.23 -1.26 -4.99 115.26 110.87 1xwe n ASN 1554Ca 0.00 0.00 0.15 0.00 -0.53 0.00 0.00 54.58 54.20 1xwe n ASN 1554Cb 0.09 0.00 0.82 0.00 -2.08 0.00 0.00 39.78 38.61 1xwe n ASN 1554CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1xwe h VAL 1555N 0.00 0.00 -3.38 3.53 2.07 -2.00 -3.35 116.25 113.12 1xwe h VAL 1555Ca 0.00 0.00 -0.73 0.00 0.82 0.00 0.00 66.70 66.79 1xwe h VAL 1555Cb 0.00 0.66 -0.23 0.00 -1.52 0.00 0.00 31.29 30.20 1xwe h VAL 1555CO 0.00 0.00 -0.38 -0.36 0.02 0.00 0.00 177.57 176.85 1xwe s PHE 1556N -4.07 3.26 0.50 1.57 0.40 -1.26 -2.60 117.98 115.78 1xwe s PHE 1556Ca -0.03 -0.98 -0.15 0.00 -0.60 0.00 0.00 56.93 55.17 1xwe s PHE 1556Cb 0.09 -2.99 -0.07 0.00 0.51 0.00 0.00 43.02 40.56 1xwe s PHE 1556CO 0.27 -0.76 0.94 0.08 0.70 0.00 0.00 175.22 176.44 1xwe s VAL 1557N 1.60 4.61 0.09 -0.44 1.01 0.09 -4.40 120.40 122.97 1xwe s VAL 1557Ca 0.04 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.11 1xwe s VAL 1557Cb -0.23 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1xwe s VAL 1557CO 0.06 -0.69 -0.13 -0.54 0.00 0.00 0.00 175.10 173.81 1xwe s LYS 1558N -4.11 0.87 -0.05 2.72 1.02 -0.38 -0.99 119.74 118.82 1xwe s LYS 1558Ca 0.57 -1.08 -0.02 0.00 0.02 0.00 0.00 55.97 55.46 1xwe s LYS 1558Cb -0.10 -0.73 0.03 0.00 -0.52 0.00 0.00 37.83 36.50 1xwe s LYS 1558CO 0.33 0.14 0.04 0.71 -0.92 0.00 0.00 175.35 175.66 1xwe s TYR 1559N -1.85 0.20 -0.47 3.18 2.02 0.10 -1.73 117.35 118.80 1xwe s TYR 1559Ca 0.03 0.15 -0.17 0.00 -0.37 0.00 0.00 57.07 56.71 1xwe s TYR 1559Cb -0.07 -0.54 0.05 0.00 -0.40 0.00 0.00 41.96 41.01 1xwe s TYR 1559CO 0.02 -0.21 0.48 0.21 -1.57 0.00 0.00 175.55 174.47 1xwe s LYS 1560N 2.04 3.06 0.42 -0.62 2.47 -0.73 -1.53 119.74 124.84 1xwe s LYS 1560Ca 0.04 -1.02 0.07 0.00 -1.56 0.00 0.00 55.97 53.49 1xwe s LYS 1560Cb -0.12 -4.07 -0.06 0.00 -1.46 0.00 0.00 37.83 32.11 1xwe s LYS 1560CO -0.03 -1.03 0.07 0.00 0.16 0.00 0.00 175.35 174.51 1xwe s ALA 1561N 2.11 3.38 -0.09 3.13 0.00 -0.82 -1.65 121.76 127.83 1xwe s ALA 1561Ca 0.10 -2.09 0.02 0.00 0.00 0.00 0.00 51.96 49.99 1xwe s ALA 1561Cb -0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1xwe s ALA 1561CO 0.10 -0.13 -0.14 0.99 0.00 0.00 0.00 175.76 176.58 1xwe s THR 1562N -2.69 3.01 -0.84 0.00 2.01 -0.60 -2.21 115.64 114.32 1xwe s THR 1562Ca 0.34 -0.71 -0.25 0.00 0.31 0.00 0.00 61.69 61.38 1xwe s THR 1562Cb 0.07 -2.21 0.02 0.00 0.01 0.00 0.00 72.50 70.39 1xwe s THR 1562CO 0.18 0.56 1.49 -0.22 -0.69 0.00 0.00 174.62 175.94 1xwe s LEU 1563N -0.22 3.29 0.17 4.42 2.96 -1.05 -1.37 118.68 126.88 1xwe s LEU 1563Ca 0.01 -0.71 -0.17 0.00 -0.22 0.00 0.00 54.13 53.04 1xwe s LEU 1563Cb -0.13 -2.56 0.11 0.00 0.50 0.00 0.00 46.19 44.11 1xwe s LEU 1563CO 0.03 -1.90 1.65 -0.07 -1.32 0.00 0.00 176.35 174.74 1xwe h LEU 1564N 13.96 -0.52 -7.00 -0.68 4.07 -1.07 -0.16 115.31 123.91 1xwe h LEU 1564Ca -0.07 0.14 0.04 0.00 0.08 0.00 0.00 57.88 58.07 1xwe h LEU 1564Cb 1.05 0.31 -0.18 0.00 1.08 0.00 0.00 40.66 42.92 1xwe h LEU 1564CO 1.31 -0.18 0.38 -0.62 -1.08 0.00 0.00 178.44 178.25 1xwe s ASP 1565N -5.18 -0.48 -0.21 -0.43 -1.08 -0.98 -4.29 116.67 104.02 1xwe s ASP 1565Ca -0.14 0.29 -0.07 0.00 -0.52 0.00 0.00 52.55 52.11 1xwe s ASP 1565Cb 0.15 0.44 -0.04 0.00 -1.46 0.00 0.00 42.92 42.01 1xwe s ASP 1565CO 0.71 -0.60 0.06 -0.63 0.52 0.00 0.00 175.17 175.23 1xwe s ILE 1566N -2.20 4.56 -0.07 4.11 1.01 -1.26 -2.28 121.20 125.08 1xwe s ILE 1566Ca -0.02 -0.10 0.16 0.00 0.00 0.00 0.00 60.65 60.69 1xwe s ILE 1566Cb -0.01 -3.08 -0.24 0.00 0.01 0.00 0.00 42.46 39.14 1xwe s ILE 1566CO -0.02 0.41 0.25 -1.22 0.00 0.00 0.00 174.94 174.36 1xwe n TYR 1567N 4.10 0.00 -3.67 3.97 4.01 -0.57 -4.93 117.16 120.07 1xwe n TYR 1567Ca -0.16 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.47 1xwe n TYR 1567Cb 0.52 -0.52 -0.11 0.00 -0.31 0.00 0.00 39.34 38.91 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 -2.88 0.26 0.79 -0.72 1.02 0.65 -4.91 119.74 113.94 1xwe s LYS 1568Ca -0.07 0.84 -0.16 0.00 0.02 0.00 0.00 55.97 56.60 1xwe s LYS 1568Cb 0.08 0.09 -0.08 0.00 -0.52 0.00 0.00 37.83 37.41 1xwe s LYS 1568CO 0.67 -0.24 0.01 2.41 -0.92 0.00 0.00 175.35 177.28 1xwe n THR 1569N 5.07 0.66 0.12 2.17 -1.04 -1.26 -2.29 114.28 117.71 1xwe n THR 1569Ca -0.12 -0.42 0.10 0.00 -2.04 0.00 0.00 64.05 61.57 1xwe n THR 1569Cb 0.51 -0.36 0.20 0.00 -1.82 0.00 0.00 70.33 68.85 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 2.31 1.80 3.17 3.41 0.00 -1.26 -3.54 105.19 111.08 1xwe n GLY 1570Ca 0.06 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 1.20 -1.56 -3.43 1.61 -0.58 -1.26 -4.17 120.64 112.45 1xwe n GLU 1571Ca 0.17 0.37 -0.27 0.00 -0.42 0.00 0.00 57.16 57.01 1xwe n GLU 1571Cb 0.53 -4.78 -0.10 0.00 -0.57 0.00 0.00 31.44 26.52 1xwe n GLU 1571CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xwe s ALA 1572N -0.96 1.48 -1.85 0.62 0.00 -1.26 -4.92 121.76 114.87 1xwe s ALA 1572Ca 0.00 -2.46 -0.23 0.00 0.00 0.00 0.00 51.96 49.27 1xwe s ALA 1572Cb 0.00 -1.63 0.22 0.00 0.00 0.00 0.00 23.12 21.72 1xwe s ALA 1572CO 0.00 -1.99 0.63 1.55 0.00 0.00 0.00 175.76 175.94 1xwe n VAL 1573N 2.94 -0.17 -1.70 0.00 3.14 -1.26 -4.81 118.33 116.47 1xwe n VAL 1573Ca 0.27 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 61.22 1xwe n VAL 1573Cb 0.46 -0.70 -0.03 0.00 -1.06 0.00 0.00 33.84 32.51 1xwe n VAL 1573CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1xwe n ALA 1574N -4.10 2.41 -2.52 1.55 0.00 -1.26 -4.98 120.51 111.61 1xwe n ALA 1574Ca 0.11 0.38 -0.08 0.00 0.00 0.00 0.00 53.44 53.85 1xwe n ALA 1574Cb 0.46 -2.51 -0.10 0.00 0.00 0.00 0.00 19.45 17.30 1xwe n ALA 1574CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xwe s GLU 1575N 1.58 0.57 -0.01 0.00 2.56 -1.26 -4.90 118.70 117.24 1xwe s GLU 1575Ca 0.78 -0.92 -0.30 0.00 0.00 0.00 0.00 54.97 54.53 1xwe s GLU 1575Cb -0.53 0.21 -0.06 0.00 2.00 0.00 0.00 34.13 35.75 1xwe s GLU 1575CO 0.35 -0.13 1.57 0.15 -0.56 0.00 0.00 175.26 176.64 1xwe s LYS 1576N -3.01 4.22 -0.95 4.30 1.02 -1.26 -2.97 119.74 121.08 1xwe s LYS 1576Ca -0.01 2.14 -0.01 0.00 0.02 0.00 0.00 55.97 58.11 1xwe s LYS 1576Cb 0.01 -3.75 -0.01 0.00 -0.52 0.00 0.00 37.83 33.56 1xwe s LYS 1576CO -0.07 -0.73 0.79 -3.47 -0.92 0.00 0.00 175.35 170.95 1xwe n ASP 1577N 6.20 -2.48 -2.05 2.83 2.03 -0.07 -5.03 116.55 117.97 1xwe n ASP 1577Ca 0.16 -0.51 -0.01 0.00 0.52 0.00 0.00 54.79 54.95 1xwe n ASP 1577Cb 0.42 -4.22 0.00 0.00 -0.72 0.00 0.00 41.12 36.60 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 -2.73 0.02 -4.19 1.67 7.64 -1.16 -4.74 113.62 110.13 1xwe n SER 1578Ca -0.21 -1.02 -0.34 0.00 1.01 0.00 0.00 58.87 58.31 1xwe n SER 1578Cb 0.63 -0.02 -0.14 0.00 -1.01 0.00 0.00 64.21 63.67 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 -2.71 2.82 0.15 1.43 2.56 -1.26 -2.53 118.70 119.15 1xwe s GLU 1579Ca 0.02 -0.99 0.07 0.00 0.00 0.00 0.00 54.97 54.07 1xwe s GLU 1579Cb -0.00 -2.96 -0.04 0.00 2.00 0.00 0.00 34.13 33.13 1xwe s GLU 1579CO 0.01 -0.40 -0.02 0.96 -0.56 0.00 0.00 175.26 175.25 1xwe s ILE 1580N 1.31 3.68 -0.29 -3.70 -4.36 -0.94 -5.01 121.20 111.89 1xwe s ILE 1580Ca -0.00 -1.34 -0.03 0.00 -0.26 0.00 0.00 60.65 59.02 1xwe s ILE 1580Cb -0.17 -2.81 0.11 0.00 1.25 0.00 0.00 42.46 40.84 1xwe s ILE 1580CO -0.05 -0.03 0.17 -0.89 0.24 0.00 0.00 174.94 174.38 1xwe s THR 1581N -1.57 -0.12 -0.20 8.37 2.01 -1.26 -1.94 115.64 120.94 1xwe s THR 1581Ca 0.26 -0.76 -0.16 0.00 0.31 0.00 0.00 61.69 61.34 1xwe s THR 1581Cb -0.10 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 1xwe s THR 1581CO 0.17 -0.69 0.40 -0.36 -0.69 0.00 0.00 174.62 173.45 1xwe s PHE 1582N 2.08 3.38 0.05 4.92 0.40 -0.58 -0.90 117.98 127.33 1xwe s PHE 1582Ca 0.10 0.62 0.05 0.00 -0.60 0.00 0.00 56.93 57.10 1xwe s PHE 1582Cb -0.16 -2.52 -0.04 0.00 0.51 0.00 0.00 43.02 40.81 1xwe s PHE 1582CO -0.34 -0.00 -0.09 0.96 0.70 0.00 0.00 175.22 176.45 1xwe s ILE 1583N 1.28 3.43 0.04 0.64 -4.36 -0.85 -0.72 121.20 120.67 1xwe s ILE 1583Ca 0.19 -1.05 0.00 0.00 -0.26 0.00 0.00 60.65 59.54 1xwe s ILE 1583Cb -0.15 -2.54 -0.00 0.00 1.25 0.00 0.00 42.46 41.02 1xwe s ILE 1583CO 0.08 0.25 0.05 2.29 0.24 0.00 0.00 174.94 177.86 1xwe n LYS 1584N 1.15 0.07 -2.78 0.37 2.85 -0.16 -2.54 118.16 117.12 1xwe n LYS 1584Ca -0.14 -0.37 -0.16 0.00 -1.05 0.00 0.00 58.31 56.59 1xwe n LYS 1584Cb 0.52 0.33 0.03 0.00 -0.65 0.00 0.00 35.03 35.26 1xwe n LYS 1584CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1xwe n LYS 1585N -0.07 0.80 -0.27 -1.58 4.01 -1.26 -0.73 118.16 119.06 1xwe n LYS 1585Ca 0.00 -2.37 0.09 0.00 -0.51 0.00 0.00 58.31 55.52 1xwe n LYS 1585Cb 0.07 0.03 0.24 0.00 -0.51 0.00 0.00 35.03 34.86 1xwe n LYS 1585CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1xwe n VAL 1586N -1.70 0.96 1.06 -0.18 0.24 -1.07 -4.27 118.33 113.37 1xwe n VAL 1586Ca 0.06 -0.98 0.12 0.00 -2.04 0.00 0.00 64.34 61.50 1xwe n VAL 1586Cb 0.44 0.54 0.14 0.00 -1.47 0.00 0.00 33.84 33.49 1xwe n VAL 1586CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1xwe n THR 1587N 1.12 0.00 -1.37 3.34 -2.24 -1.26 -4.98 114.28 108.88 1xwe n THR 1587Ca 0.18 -0.42 -0.35 0.00 -2.27 0.00 0.00 64.05 61.19 1xwe n THR 1587Cb 0.53 1.32 0.10 0.00 -2.10 0.00 0.00 70.33 70.18 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 -2.77 0.00 0.53 0.00 -1.04 -1.22 -4.83 114.28 104.95 1xwe n THR 1589Ca 0.14 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.22 1xwe n THR 1589Cb 0.50 -0.08 0.06 0.00 -1.82 0.00 0.00 70.33 68.98 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 -0.62 2.16 -4.05 8.00 3.02 -1.26 -4.90 115.26 117.61 1xwe n ASN 1590Ca 0.00 -1.58 -0.32 0.00 -0.03 0.00 0.00 54.58 52.65 1xwe n ASN 1590Cb 0.04 -0.01 -0.15 0.00 -0.61 0.00 0.00 39.78 39.05 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 -1.12 2.37 -0.26 5.41 0.00 -1.26 -3.43 121.76 123.48 1xwe s ALA 1591Ca 0.16 -1.56 -0.01 0.00 0.00 0.00 0.00 51.96 50.55 1xwe s ALA 1591Cb 0.11 -1.47 0.14 0.00 0.00 0.00 0.00 23.12 21.90 1xwe s ALA 1591CO 0.17 -1.04 0.35 -2.00 0.00 0.00 0.00 175.76 173.24 1xwe s GLU 1592N 1.21 0.34 0.39 0.00 2.12 -1.26 -4.87 118.70 116.63 1xwe s GLU 1592Ca -0.06 0.26 -0.03 0.00 0.36 0.00 0.00 54.97 55.50 1xwe s GLU 1592Cb -0.18 -0.56 -0.04 0.00 0.26 0.00 0.00 34.13 33.61 1xwe s GLU 1592CO -0.07 -0.82 0.64 -0.51 -0.54 0.00 0.00 175.26 173.97 1xwe s LEU 1593N 2.48 3.88 -0.04 2.70 1.02 -1.26 -5.11 118.68 122.35 1xwe s LEU 1593Ca 0.11 0.70 -0.03 0.00 0.02 0.00 0.00 54.13 54.92 1xwe s LEU 1593Cb -0.14 -3.58 0.01 0.00 0.02 0.00 0.00 46.19 42.49 1xwe s LEU 1593CO -0.22 -0.38 0.10 0.54 0.02 0.00 0.00 176.35 176.40 1xwe s VAL 1594N -2.43 0.00 0.23 -1.59 0.11 -1.26 -5.14 120.40 110.32 1xwe s VAL 1594Ca 0.44 -0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.19 1xwe s VAL 1594Cb -0.10 -0.15 -0.09 0.00 -1.53 0.00 0.00 36.38 34.51 1xwe s VAL 1594CO 0.38 -0.00 1.23 -1.59 -3.33 0.00 0.00 175.10 171.79 1xwe s LYS 1595N 0.05 4.47 0.00 1.54 -2.85 -1.26 -3.26 119.74 118.43 1xwe s LYS 1595Ca -0.00 1.97 0.00 0.00 -1.00 0.00 0.00 55.97 56.94 1xwe s LYS 1595Cb -0.01 -3.19 0.00 0.00 -2.06 0.00 0.00 37.83 32.57 1xwe s LYS 1595CO 0.00 -0.09 0.00 0.41 0.10 0.00 0.00 175.35 175.77 1xwe n GLY 1596N 1.82 2.71 4.01 0.59 0.00 -0.78 -4.94 105.19 108.60 1xwe n GLY 1596Ca 0.03 0.00 -0.17 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 -0.44 2.81 0.02 1.61 3.00 -1.20 -4.97 118.95 119.79 1xwe s ARG 1597Ca 0.00 -1.19 0.03 0.00 0.00 0.00 0.00 55.73 54.57 1xwe s ARG 1597Cb 0.00 -2.74 -0.04 0.00 0.00 0.00 0.00 34.95 32.18 1xwe s ARG 1597CO 0.00 -0.30 -0.03 -0.65 0.00 0.00 0.00 175.30 174.32 1xwe s GLN 1598N -4.38 2.63 -0.02 3.54 -0.21 -1.26 -2.71 119.66 117.25 1xwe s GLN 1598Ca 0.55 -0.71 -0.05 0.00 0.02 0.00 0.00 55.36 55.17 1xwe s GLN 1598Cb -0.10 -2.57 0.01 0.00 1.00 0.00 0.00 33.01 31.35 1xwe s GLN 1598CO 0.33 0.60 0.11 0.71 -2.12 0.00 0.00 175.29 174.92 1xwe s TYR 1599N -1.09 -0.04 -0.10 0.91 2.02 -0.68 -2.08 117.35 116.29 1xwe s TYR 1599Ca 0.20 0.10 -0.14 0.00 -0.37 0.00 0.00 57.07 56.85 1xwe s TYR 1599Cb -0.11 -0.01 -0.05 0.00 -0.40 0.00 0.00 41.96 41.39 1xwe s TYR 1599CO 0.11 -0.15 0.34 -1.17 -1.57 0.00 0.00 175.55 173.10 1xwe s LEU 1600N -0.55 4.34 -0.05 -1.29 0.20 0.28 -2.17 118.68 119.44 1xwe s LEU 1600Ca -0.06 0.70 0.03 0.00 0.69 0.00 0.00 54.13 55.48 1xwe s LEU 1600Cb -0.04 -2.45 0.01 0.00 -0.43 0.00 0.00 46.19 43.28 1xwe s LEU 1600CO 0.00 0.20 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.50 1xwe s ILE 1601N -0.22 1.23 -0.23 6.68 1.01 -0.96 -2.07 121.20 126.63 1xwe s ILE 1601Ca 0.20 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 1xwe s ILE 1601Cb -0.14 -1.09 0.12 0.00 0.01 0.00 0.00 42.46 41.36 1xwe s ILE 1601CO 0.08 0.37 0.34 -0.04 0.00 0.00 0.00 174.94 175.68 1xwe s MET 1602N 0.35 0.30 0.00 2.79 -1.94 -0.71 -2.13 119.30 117.95 1xwe s MET 1602Ca -0.09 0.47 0.00 0.00 -1.71 0.00 0.00 55.69 54.36 1xwe s MET 1602Cb -0.13 -0.63 0.00 0.00 2.01 0.00 0.00 34.83 36.08 1xwe s MET 1602CO 0.03 -0.62 0.00 0.41 -0.01 0.00 0.00 175.02 174.83 1xwe n GLY 1603N 5.35 0.71 3.26 -0.03 0.00 -0.91 -0.63 105.19 112.96 1xwe n GLY 1603Ca -0.04 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.00 -0.18 1.61 4.76 -1.19 0.06 118.16 123.22 1xwe n LYS 1604Ca 0.00 0.02 -0.05 0.00 -2.87 0.00 0.00 58.31 55.41 1xwe n LYS 1604Cb 0.00 -1.45 0.05 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.40 -1.47 -4.21 1.97 0.00 -1.26 -4.52 120.64 111.56 1xwe n GLU 1605Ca 0.05 -0.31 -0.35 0.00 0.00 0.00 0.00 57.16 56.54 1xwe n GLU 1605Cb 0.53 -0.30 -0.08 0.00 0.00 0.00 0.00 31.44 31.59 1xwe n GLU 1605CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xwe s ALA 1606N -2.93 3.48 0.52 -1.84 0.00 -1.26 -4.77 121.76 114.97 1xwe s ALA 1606Ca 0.13 -0.76 -0.21 0.00 0.00 0.00 0.00 51.96 51.12 1xwe s ALA 1606Cb -0.01 -1.63 -0.06 0.00 0.00 0.00 0.00 23.12 21.42 1xwe s ALA 1606CO 0.10 0.60 1.22 -0.51 0.00 0.00 0.00 175.76 177.17 1xwe s LEU 1607N -0.98 3.85 -0.00 0.00 1.43 -1.13 -4.86 118.68 116.99 1xwe s LEU 1607Ca 0.14 2.42 0.16 0.00 -1.03 0.00 0.00 54.13 55.83 1xwe s LEU 1607Cb -0.12 -4.38 -0.19 0.00 0.03 0.00 0.00 46.19 41.53 1xwe s LEU 1607CO 0.04 -1.28 0.64 0.00 0.23 0.00 0.00 176.35 175.97 1xwe n GLN 1608N -0.99 1.45 -3.94 1.70 10.64 -1.26 -3.01 117.38 121.96 1xwe n GLN 1608Ca 0.10 -0.02 -0.31 0.00 -1.83 0.00 0.00 57.00 54.94 1xwe n GLN 1608Cb 0.48 -1.29 -0.15 0.00 -0.86 0.00 0.00 30.24 28.42 1xwe n GLN 1608CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 1xwe s ILE 1609N -2.64 2.04 -2.51 -0.39 -4.36 -1.25 -3.53 121.20 108.57 1xwe s ILE 1609Ca 0.04 -2.35 0.24 0.00 -0.26 0.00 0.00 60.65 58.32 1xwe s ILE 1609Cb 0.12 -2.49 0.43 0.00 1.25 0.00 0.00 42.46 41.77 1xwe s ILE 1609CO 0.67 -0.66 1.53 1.17 0.24 0.00 0.00 174.94 177.89 1xwe n LYS 1610N 4.13 1.95 -0.23 0.37 3.00 -1.04 -4.76 118.16 121.58 1xwe n LYS 1610Ca 0.03 -1.41 0.03 0.00 -0.00 0.00 0.00 58.31 56.96 1xwe n LYS 1610Cb 0.40 -1.45 -0.01 0.00 0.00 0.00 0.00 35.03 33.97 1xwe n LYS 1610CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1xwe n TYR 1611N 0.67 -2.03 -2.18 5.64 4.01 -1.26 -4.78 117.16 117.23 1xwe n TYR 1611Ca 0.17 0.29 0.00 0.00 -0.16 0.00 0.00 57.90 58.20 1xwe n TYR 1611Cb 0.43 -0.38 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1xwe n TYR 1611CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1xwe n ASN 1612N -2.12 -8.71 0.00 7.72 2.85 -1.26 -4.15 115.26 109.59 1xwe n ASN 1612Ca 0.00 1.63 0.00 0.00 -0.11 0.00 0.00 54.58 56.11 1xwe n ASN 1612Cb 0.11 -4.73 0.00 0.00 1.24 0.00 0.00 39.78 36.39 1xwe n ASN 1612CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1xwe n ALA 1613N 1.63 0.00 -0.93 5.20 0.00 -1.26 -4.11 120.51 121.04 1xwe n ALA 1613Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xwe n ALA 1613Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1xwe n ALA 1613CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xwe n SER 1614N 2.97 0.00 -3.60 0.00 3.41 -1.26 -5.18 113.62 109.96 1xwe n SER 1614Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1xwe n SER 1614Cb 0.00 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 1xwe n SER 1614CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1xwe s PHE 1615N -0.07 -0.18 -0.01 7.33 -0.71 -1.26 -4.13 117.98 118.95 1xwe s PHE 1615Ca 0.00 0.25 -0.06 0.00 -1.04 0.00 0.00 56.93 56.08 1xwe s PHE 1615Cb 0.00 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.30 1xwe s PHE 1615CO 0.00 -0.20 0.13 0.50 -1.34 0.00 0.00 175.22 174.32 1xwe s ARG 1616N -1.51 0.38 -0.53 1.99 3.52 -1.23 -4.72 118.95 116.86 1xwe s ARG 1616Ca 0.06 -0.23 -0.21 0.00 -0.13 0.00 0.00 55.73 55.22 1xwe s ARG 1616Cb -0.01 0.16 0.05 0.00 -1.56 0.00 0.00 34.95 33.60 1xwe s ARG 1616CO -0.04 -0.08 0.77 0.71 -0.81 0.00 0.00 175.30 175.84 1xwe s TYR 1617N -0.95 2.93 0.51 5.12 1.51 -1.26 -2.51 117.35 122.71 1xwe s TYR 1617Ca -0.10 -0.34 0.03 0.00 -1.01 0.00 0.00 57.07 55.65 1xwe s TYR 1617Cb -0.06 -3.79 -0.00 0.00 -0.11 0.00 0.00 41.96 38.00 1xwe s TYR 1617CO 0.01 -1.19 0.12 0.96 -1.11 0.00 0.00 175.55 174.34 1xwe s ILE 1618N 3.21 1.37 -0.07 2.71 -5.25 -1.17 -4.81 121.20 117.19 1xwe s ILE 1618Ca 0.21 -1.85 0.02 0.00 -0.99 0.00 0.00 60.65 58.04 1xwe s ILE 1618Cb -0.17 -2.22 0.01 0.00 2.95 0.00 0.00 42.46 43.04 1xwe s ILE 1618CO 0.15 0.00 -0.13 -0.31 -1.79 0.00 0.00 174.94 172.86 1xwe s TYR 1619N -2.83 1.56 0.57 1.37 1.51 -0.08 -2.83 117.35 116.61 1xwe s TYR 1619Ca 0.16 -0.61 -0.13 0.00 -1.01 0.00 0.00 57.07 55.48 1xwe s TYR 1619Cb 0.01 -1.14 -0.06 0.00 -0.11 0.00 0.00 41.96 40.66 1xwe s TYR 1619CO 0.09 -0.32 1.00 -1.25 -1.11 0.00 0.00 175.55 173.96 1xwe s PRO 1620N 0.77 3.74 -0.38 -1.71 0.04 -1.26 -2.01 135.00 134.18 1xwe s PRO 1620Ca -0.12 0.80 0.01 0.00 0.04 0.00 0.00 61.00 61.72 1xwe s PRO 1620Cb -0.16 -2.12 0.13 0.00 0.04 0.00 0.00 34.50 32.39 1xwe s PRO 1620CO 0.02 -0.43 0.19 -1.17 0.04 0.00 0.00 177.00 175.66 1xwe s LEU 1621N -4.70 2.16 0.00 -3.56 2.96 -1.05 -4.75 118.68 109.73 1xwe s LEU 1621Ca 0.56 -2.24 0.00 0.00 -0.22 0.00 0.00 54.13 52.23 1xwe s LEU 1621Cb -0.11 -0.84 0.00 0.00 0.50 0.00 0.00 46.19 45.75 1xwe s LEU 1621CO 0.44 -0.32 0.00 0.47 -1.32 0.00 0.00 176.35 175.62 1xwe n ASP 1622N 4.03 1.83 0.18 3.68 9.92 -1.18 -4.69 116.55 130.31 1xwe n ASP 1622Ca 0.06 -0.77 0.07 0.00 -0.53 0.00 0.00 54.79 53.62 1xwe n ASP 1622Cb 0.37 0.00 0.14 0.00 -0.64 0.00 0.00 41.12 40.99 1xwe n ASP 1622CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 1xwe h SER 1623N 0.00 0.00 0.69 -2.24 4.64 -1.84 -3.11 113.55 111.70 1xwe h SER 1623Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xwe h SER 1623Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xwe h SER 1623CO 0.00 0.30 0.00 0.00 -0.87 0.00 0.00 176.83 176.26 1xwe n LEU 1624N -3.20 0.00 -4.59 5.97 -0.00 -1.26 -4.42 117.00 109.50 1xwe n LEU 1624Ca 0.02 0.43 -0.43 0.00 -0.00 0.00 0.00 56.01 56.04 1xwe n LEU 1624Cb 0.62 -0.43 -0.04 0.00 -0.00 0.00 0.00 43.42 43.58 1xwe n LEU 1624CO 0.37 -0.08 0.77 -0.89 -0.00 0.00 0.00 177.39 177.56 1xwe s THR 1625N -2.86 4.52 -0.03 1.47 2.01 -1.18 -4.75 115.64 114.82 1xwe s THR 1625Ca 0.15 1.01 -0.30 0.00 0.31 0.00 0.00 61.69 62.87 1xwe s THR 1625Cb 0.16 -4.39 -0.07 0.00 0.01 0.00 0.00 72.50 68.21 1xwe s THR 1625CO 0.41 -0.68 1.79 0.86 -0.69 0.00 0.00 174.62 176.30 1xwe s TRP 1626N 3.65 1.69 -0.13 4.92 -0.11 0.20 -4.79 118.94 124.37 1xwe s TRP 1626Ca 0.38 -0.05 0.00 0.00 1.22 0.00 0.00 56.10 57.65 1xwe s TRP 1626Cb -0.11 -4.05 0.02 0.00 -1.50 0.00 0.00 33.47 27.84 1xwe s TRP 1626CO 0.23 -4.52 -0.11 0.42 -4.62 0.00 0.00 176.95 168.35 1xwe s ILE 1627N 4.30 1.32 -0.13 5.86 -1.09 -1.25 -1.74 121.20 128.47 1xwe s ILE 1627Ca 0.80 -0.48 -0.02 0.00 -2.23 0.00 0.00 60.65 58.72 1xwe s ILE 1627Cb -0.37 -1.27 0.04 0.00 -1.58 0.00 0.00 42.46 39.28 1xwe s ILE 1627CO 0.34 0.42 0.02 -0.70 -1.23 0.00 0.00 174.94 173.79 1xwe s GLU 1628N 1.53 0.66 0.22 2.79 2.12 -0.88 -1.58 118.70 123.56 1xwe s GLU 1628Ca 0.04 -0.15 -0.32 0.00 0.36 0.00 0.00 54.97 54.90 1xwe s GLU 1628Cb -0.13 -1.54 -0.14 0.00 0.26 0.00 0.00 34.13 32.59 1xwe s GLU 1628CO -0.09 -0.46 1.40 0.98 -0.54 0.00 0.00 175.26 176.55 1xwe n TYR 1629N 5.10 2.07 -3.55 5.30 9.36 -1.26 -0.55 117.16 133.63 1xwe n TYR 1629Ca -0.08 0.45 -0.41 0.00 3.32 0.00 0.00 57.90 61.17 1xwe n TYR 1629Cb 0.49 -2.45 -0.09 0.00 -0.63 0.00 0.00 39.34 36.66 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 0.02 3.38 -0.28 2.98 -0.11 -0.88 -4.84 118.94 119.21 1xwe s TRP 1630Ca 0.70 -1.69 -0.39 0.00 1.22 0.00 0.00 56.10 55.94 1xwe s TRP 1630Cb -0.68 -3.34 -0.15 0.00 -1.50 0.00 0.00 33.47 27.81 1xwe s TRP 1630CO 0.49 -0.94 1.81 -2.30 -4.62 0.00 0.00 176.95 171.39 1xwe n PRO 1631N 4.95 1.21 0.00 5.86 -0.02 -1.26 -4.36 135.00 141.38 1xwe n PRO 1631Ca -0.09 0.43 0.14 0.00 -2.02 0.00 0.00 63.50 61.96 1xwe n PRO 1631Cb 0.41 -2.17 0.45 0.00 -0.02 0.00 0.00 33.50 32.17 1xwe n PRO 1631CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1xwe n ARG 1632N 5.83 1.76 -3.60 -0.52 0.63 -1.26 -4.86 116.66 114.64 1xwe n ARG 1632Ca 0.28 -1.12 -0.36 0.00 -0.92 0.00 0.00 57.85 55.73 1xwe n ARG 1632Cb 0.15 -1.48 -0.08 0.00 0.45 0.00 0.00 32.46 31.50 1xwe n ARG 1632CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1xwe s ASP 1633N -2.01 6.30 0.00 6.15 1.11 -1.26 -4.89 116.67 122.07 1xwe s ASP 1633Ca 0.36 0.34 0.00 0.00 0.18 0.00 0.00 52.55 53.43 1xwe s ASP 1633Cb 0.21 -2.14 0.00 0.00 1.07 0.00 0.00 42.92 42.05 1xwe s ASP 1633CO 0.33 0.10 0.01 0.35 1.18 0.00 0.00 175.17 177.14 1xwe n THR 1634N 3.79 0.00 0.05 -1.27 -2.24 -1.26 -2.96 114.28 110.39 1xwe n THR 1634Ca -0.13 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 1xwe n THR 1634Cb 0.52 1.31 -0.00 0.00 -2.10 0.00 0.00 70.33 70.05 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 1.08 1.38 -4.00 4.28 1.35 -2.02 -3.45 112.91 111.52 1xwe h THR 1635Ca 0.00 -2.23 -0.64 0.00 -0.55 0.00 0.00 66.41 63.00 1xwe h THR 1635Cb 0.52 2.20 -0.23 0.00 -1.73 0.00 0.00 68.15 68.91 1xwe h THR 1635CO 0.00 0.67 -0.85 0.00 -0.25 0.00 0.00 175.52 175.09 1xwe s SER 1637N -1.80 5.02 0.29 0.00 0.15 -1.26 -4.05 113.70 112.06 1xwe s SER 1637Ca 0.11 0.27 0.00 0.00 0.70 0.00 0.00 55.95 57.03 1xwe s SER 1637Cb -0.10 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 1xwe s SER 1637CO 0.04 -2.62 0.00 -0.24 1.20 0.00 0.00 173.24 171.63 1xwe n SER 1638N 13.86 -2.62 0.02 5.45 2.88 -1.26 -4.95 113.62 127.00 1xwe n SER 1638Ca 0.28 0.74 0.08 0.00 -1.33 0.00 0.00 58.87 58.65 1xwe n SER 1638Cb 0.51 2.61 -0.11 0.00 -0.75 0.00 0.00 64.21 66.48 1xwe n SER 1638CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xwe h GLN 1640N 0.00 0.00 -0.13 0.00 4.15 -1.72 -2.02 115.11 115.38 1xwe h GLN 1640Ca -0.06 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.40 1xwe h GLN 1640Cb 1.15 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.84 1xwe h GLN 1640CO 0.01 0.09 0.11 0.00 -1.93 0.00 0.00 178.83 177.11 1xwe h ALA 1641N 1.91 1.95 0.01 3.38 0.00 -1.91 -1.09 119.26 123.52 1xwe h ALA 1641Ca -0.00 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 1xwe h ALA 1641Cb 0.22 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1xwe h ALA 1641CO 0.01 -0.18 -1.61 0.35 0.00 0.00 0.00 179.25 177.82 1xwe h PHE 1642N 0.00 0.05 0.00 0.00 3.57 -1.64 -3.31 116.94 115.61 1xwe h PHE 1642Ca 0.06 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1xwe h PHE 1642Cb 0.29 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.03 1xwe h PHE 1642CO 0.00 1.06 0.00 -0.11 -2.23 0.00 0.00 178.31 177.03 1xwe n LEU 1643N -3.13 0.00 0.08 0.59 7.94 -0.51 -2.86 117.00 119.11 1xwe n LEU 1643Ca -0.15 0.31 -0.13 0.00 -1.11 0.00 0.00 56.01 54.92 1xwe n LEU 1643Cb 1.04 -0.31 -0.13 0.00 0.53 0.00 0.00 43.42 44.55 1xwe n LEU 1643CO 0.45 -0.06 -0.08 0.00 -1.11 0.00 0.00 177.39 176.59 1xwe h ALA 1644N 3.11 0.24 0.00 1.96 0.00 -1.39 -3.08 119.26 120.10 1xwe h ALA 1644Ca 0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 54.91 53.76 1xwe h ALA 1644Cb 0.24 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1xwe h ALA 1644CO 0.00 1.12 -0.86 -0.91 0.00 0.00 0.00 179.25 178.60 1xwe h ASN 1645N 0.05 0.00 0.45 0.00 2.35 -1.70 -3.24 115.58 113.49 1xwe h ASN 1645Ca -0.13 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.50 1xwe h ASN 1645Cb 1.93 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.28 1xwe h ASN 1645CO 0.17 0.85 -0.53 -0.07 -1.65 0.00 0.00 177.43 176.20 1xwe h LEU 1646N 0.00 0.10 -1.25 1.61 3.38 -1.62 -2.95 115.31 114.58 1xwe h LEU 1646Ca -0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1xwe h LEU 1646Cb 1.66 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.35 1xwe h LEU 1646CO 0.11 0.61 0.34 -0.78 0.09 0.00 0.00 178.44 178.81 1xwe h ASP 1647N 0.07 0.76 -0.06 -0.43 3.58 -1.56 -1.37 116.42 117.41 1xwe h ASP 1647Ca -0.00 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1xwe h ASP 1647Cb 0.96 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.81 1xwe h ASP 1647CO 0.07 0.61 0.04 -0.33 -2.88 0.00 0.00 179.24 176.75 1xwe h GLU 1648N 0.86 0.08 -0.38 0.28 5.08 -1.63 -2.46 114.58 116.41 1xwe h GLU 1648Ca 0.22 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 1xwe h GLU 1648Cb 0.02 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1xwe h GLU 1648CO -0.04 0.06 0.04 0.35 -1.00 0.00 0.00 179.01 178.42 1xwe h PHE 1649N 0.07 0.60 -0.49 4.33 3.57 -1.51 0.16 116.94 123.67 1xwe h PHE 1649Ca 0.02 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.51 1xwe h PHE 1649Cb -0.00 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1xwe h PHE 1649CO -0.07 0.56 0.33 0.00 -2.23 0.00 0.00 178.31 176.90 1xwe h ALA 1650N 1.48 1.83 -0.01 2.41 0.00 -0.81 -1.48 119.26 122.68 1xwe h ALA 1650Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1xwe h ALA 1650Cb 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1xwe h ALA 1650CO 0.01 0.11 -0.37 -1.91 0.00 0.00 0.00 179.25 177.09 1xwe n GLU 1651N -4.48 1.53 0.09 0.00 2.13 -0.92 -3.36 120.64 115.64 1xwe n GLU 1651Ca 0.06 -0.92 0.12 0.00 0.66 0.00 0.00 57.16 57.08 1xwe n GLU 1651Cb 0.18 -1.35 0.06 0.00 0.27 0.00 0.00 31.44 30.61 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 2.11 0.00 0.00 4.31 3.58 0.30 -3.17 116.42 123.55 1xwe h ASP 1652Ca 0.00 -0.08 -0.11 0.00 0.42 0.00 0.00 57.03 57.25 1xwe h ASP 1652Cb 0.63 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 1xwe h ASP 1652CO 0.00 0.04 -1.52 0.00 -2.88 0.00 0.00 179.24 174.88 1xwe n ILE 1653N -2.49 0.43 -0.02 2.25 3.06 -0.77 -3.67 119.36 118.14 1xwe n ILE 1653Ca 0.01 -0.31 -0.15 0.00 -2.50 0.00 0.00 62.75 59.80 1xwe n ILE 1653Cb 0.51 -0.53 -0.10 0.00 0.54 0.00 0.00 39.64 40.06 1xwe n ILE 1653CO 0.00 0.00 0.00 0.15 -2.50 0.00 0.00 176.55 174.20 1xwe h PHE 1654N 0.00 0.43 0.07 9.51 3.04 -1.72 -1.16 116.94 127.11 1xwe h PHE 1654Ca -0.17 -0.20 -0.14 0.00 3.98 0.00 0.00 57.97 61.44 1xwe h PHE 1654Cb 1.25 -0.06 0.01 0.00 2.56 0.00 0.00 35.95 39.71 1xwe h PHE 1654CO 0.00 0.97 -0.59 1.25 -2.02 0.00 0.00 178.31 177.92 1xwe h LEU 1655N -0.23 0.39 0.00 0.59 6.46 -1.81 -3.42 115.31 117.29 1xwe h LEU 1655Ca -0.03 -0.89 0.00 0.00 -0.12 0.00 0.00 57.88 56.83 1xwe h LEU 1655Cb 1.03 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 1xwe h LEU 1655CO 0.07 1.25 0.00 0.59 -0.62 0.00 0.00 178.44 179.73 1xwe n ASN 1656N -4.25 0.00 0.00 1.25 5.03 -1.25 -5.09 115.26 110.94 1xwe n ASN 1656Ca -0.12 0.20 0.00 0.00 0.87 0.00 0.00 54.58 55.53 1xwe n ASN 1656Cb 0.71 -0.28 0.00 0.00 -1.02 0.00 0.00 39.78 39.19 1xwe n ASN 1656CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xwe n GLY 1657N 2.15 -2.39 0.53 7.41 0.00 -0.44 -4.98 105.19 107.47 1xwe n GLY 1657Ca 0.00 -1.46 0.14 0.00 0.00 0.00 0.00 46.02 44.70 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32