#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 6.73 0.19 1.61 1.04 -1.26 -5.07 113.70 116.95 1xwe s SER 1509Ca 0.00 0.96 -0.26 0.00 0.48 0.00 0.00 55.95 57.13 1xwe s SER 1509Cb 0.00 -2.24 -0.08 0.00 0.10 0.00 0.00 66.02 63.79 1xwe s SER 1509CO 0.00 0.08 0.82 -1.00 0.98 0.00 0.00 173.24 174.12 1xwe s HIS 1510N -1.52 3.91 0.03 5.02 0.09 -1.26 -5.07 115.29 116.48 1xwe s HIS 1510Ca 0.39 1.69 0.03 0.00 -0.00 0.00 0.00 55.06 57.17 1xwe s HIS 1510Cb -0.14 -2.81 -0.02 0.00 -0.00 0.00 0.00 32.58 29.61 1xwe s HIS 1510CO 0.19 0.48 -0.10 -1.64 -0.00 0.00 0.00 174.74 173.68 1xwe s MET 1511N -1.24 0.69 -0.04 1.40 1.00 -1.26 -5.15 119.30 114.70 1xwe s MET 1511Ca 0.38 -0.64 -0.00 0.00 0.00 0.00 0.00 55.69 55.43 1xwe s MET 1511Cb -0.23 -0.61 0.03 0.00 0.00 0.00 0.00 34.83 34.01 1xwe s MET 1511CO 0.27 0.15 0.01 0.00 0.00 0.00 0.00 175.02 175.45 1xwe s ALA 1512N -0.87 0.41 0.02 3.03 0.00 -1.26 -5.07 121.76 118.03 1xwe s ALA 1512Ca -0.02 0.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.92 1xwe s ALA 1512Cb -0.07 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.50 1xwe s ALA 1512CO 0.01 -0.25 1.15 -0.44 0.00 0.00 0.00 175.76 176.23 1xwe h ASP 1513N 7.76 -0.34 -3.77 0.00 5.19 -1.97 -3.30 116.42 120.00 1xwe h ASP 1513Ca -0.30 0.02 -0.33 0.00 -0.62 0.00 0.00 57.03 55.80 1xwe h ASP 1513Cb 1.13 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.72 1xwe h ASP 1513CO 0.36 -0.21 -0.43 0.00 -3.12 0.00 0.00 179.24 175.83 1xwe n GLY 1515N -0.97 0.47 3.64 0.00 0.00 0.22 -4.61 105.19 103.93 1xwe n GLY 1515Ca -0.16 -0.41 -0.47 0.00 0.00 0.00 0.00 46.02 44.97 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 0.00 1.73 -4.60 1.61 10.64 -1.26 -3.76 117.38 121.74 1xwe n GLN 1516Ca 0.00 0.62 -0.24 0.00 -1.83 0.00 0.00 57.00 55.55 1xwe n GLN 1516Cb 0.00 -2.28 -0.16 0.00 -0.86 0.00 0.00 30.24 26.94 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 0.20 1.49 0.64 2.61 -1.94 -1.24 -4.54 119.30 116.52 1xwe s MET 1517Ca 0.76 -0.44 -0.18 0.00 -1.71 0.00 0.00 55.69 54.12 1xwe s MET 1517Cb -0.76 -1.29 -0.02 0.00 2.01 0.00 0.00 34.83 34.77 1xwe s MET 1517CO 0.46 0.12 1.26 -0.65 -0.01 0.00 0.00 175.02 176.21 1xwe s GLN 1518N 0.32 2.65 1.19 2.03 -1.52 -1.23 -4.99 119.66 118.11 1xwe s GLN 1518Ca -0.08 1.98 -0.15 0.00 -1.95 0.00 0.00 55.36 55.16 1xwe s GLN 1518Cb -0.12 -1.87 0.28 0.00 -0.22 0.00 0.00 33.01 31.08 1xwe s GLN 1518CO 0.02 -1.50 1.03 -1.21 -0.25 0.00 0.00 175.29 173.38 1xwe s GLU 1519N -3.40 -1.12 -0.26 2.91 2.02 -1.26 -4.61 118.70 112.99 1xwe s GLU 1519Ca 0.81 0.49 -0.25 0.00 0.02 0.00 0.00 54.97 56.04 1xwe s GLU 1519Cb -0.35 -1.56 0.00 0.00 0.10 0.00 0.00 34.13 32.32 1xwe s GLU 1519CO 0.38 -3.77 0.87 -1.21 0.02 0.00 0.00 175.26 171.56 1xwe s GLU 1520N -4.80 4.15 -0.19 1.61 8.01 -1.26 -4.58 118.70 121.64 1xwe s GLU 1520Ca 0.68 0.96 -0.13 0.00 0.01 0.00 0.00 54.97 56.49 1xwe s GLU 1520Cb -0.20 -3.66 0.05 0.00 -4.31 0.00 0.00 34.13 26.01 1xwe s GLU 1520CO 0.61 -0.59 0.26 1.28 0.01 0.00 0.00 175.26 176.82 1xwe n LEU 1521N 6.16 -6.11 -3.56 1.80 4.77 -1.26 -5.04 117.00 113.75 1xwe n LEU 1521Ca 0.07 2.32 -0.27 0.00 -0.03 0.00 0.00 56.01 58.11 1xwe n LEU 1521Cb 0.47 -3.29 -0.15 0.00 -2.33 0.00 0.00 43.42 38.12 1xwe n LEU 1521CO 0.49 -4.06 -0.31 -0.62 -1.33 0.00 0.00 177.39 171.56 1xwe s ASP 1522N -0.66 2.83 -0.03 -1.43 -1.08 -1.26 -4.99 116.67 110.04 1xwe s ASP 1522Ca -0.30 -0.92 0.03 0.00 -0.52 0.00 0.00 52.55 50.84 1xwe s ASP 1522Cb 0.02 -0.22 0.13 0.00 -1.46 0.00 0.00 42.92 41.39 1xwe s ASP 1522CO 0.80 -0.39 0.82 0.18 0.52 0.00 0.00 175.17 177.09 1xwe n LEU 1523N 5.27 1.48 -0.58 -1.34 4.77 -1.26 -3.59 117.00 121.75 1xwe n LEU 1523Ca -0.06 -0.74 0.12 0.00 -0.03 0.00 0.00 56.01 55.30 1xwe n LEU 1523Cb 0.46 -0.40 0.41 0.00 -2.33 0.00 0.00 43.42 41.55 1xwe n LEU 1523CO 0.07 0.27 0.80 0.35 -1.33 0.00 0.00 177.39 177.55 1xwe n THR 1524N 0.04 0.13 -5.02 -5.08 -2.24 -1.26 -4.85 114.28 96.01 1xwe n THR 1524Ca 0.05 -0.34 -0.28 0.00 -2.27 0.00 0.00 64.05 61.21 1xwe n THR 1524Cb 0.32 0.51 -0.16 0.00 -2.10 0.00 0.00 70.33 68.91 1xwe n THR 1524CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1xwe s ILE 1525N -1.87 1.65 0.58 2.28 1.01 -1.24 -5.14 121.20 118.48 1xwe s ILE 1525Ca 0.35 -0.87 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1xwe s ILE 1525Cb 0.19 -1.39 0.03 0.00 0.01 0.00 0.00 42.46 41.30 1xwe s ILE 1525CO 0.30 0.47 0.84 -0.44 0.00 0.00 0.00 174.94 176.11 1xwe s SER 1526N -0.32 5.34 0.27 3.58 0.01 -1.26 -4.99 113.70 116.32 1xwe s SER 1526Ca 0.04 0.33 0.05 0.00 1.31 0.00 0.00 55.95 57.68 1xwe s SER 1526Cb -0.10 -1.25 0.36 0.00 0.21 0.00 0.00 66.02 65.24 1xwe s SER 1526CO 0.01 -1.16 1.64 0.00 0.41 0.00 0.00 173.24 174.14 1xwe h ALA 1527N -0.09 0.99 -0.01 1.44 0.00 -1.98 -2.64 119.26 116.96 1xwe h ALA 1527Ca -0.44 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1xwe h ALA 1527Cb 1.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xwe h ALA 1527CO 0.57 0.65 -0.08 0.39 0.00 0.00 0.00 179.25 180.78 1xwe n GLU 1528N -3.96 1.00 -0.04 0.00 1.02 -1.26 -3.38 120.64 114.02 1xwe n GLU 1528Ca -0.02 -0.40 -0.14 0.00 -0.02 0.00 0.00 57.16 56.58 1xwe n GLU 1528Cb 0.54 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.35 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 0.99 1.57 0.00 2.62 2.02 -1.85 -3.23 112.91 115.02 1xwe h THR 1529Ca 0.00 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.43 1xwe h THR 1529Cb 0.35 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 69.49 1xwe h THR 1529CO 0.00 0.46 -0.23 0.08 0.37 0.00 0.00 175.52 176.20 1xwe h ARG 1530N -0.66 0.00 -0.06 6.66 -0.00 -1.68 -3.26 114.38 115.37 1xwe h ARG 1530Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.88 1xwe h ARG 1530Cb 0.78 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.74 1xwe h ARG 1530CO 0.01 0.00 -0.39 -0.22 -0.00 0.00 0.00 179.97 179.37 1xwe h LYS 1531N 0.00 0.13 0.00 0.08 1.63 -1.61 -2.36 116.57 114.43 1xwe h LYS 1531Ca 0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1xwe h LYS 1531Cb 0.76 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 1xwe h LYS 1531CO 0.00 0.51 0.02 1.96 -3.45 0.00 0.00 179.45 178.48 1xwe h GLN 1532N 0.11 0.00 0.12 1.90 1.08 -1.60 -1.34 115.11 115.38 1xwe h GLN 1532Ca 0.01 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.87 1xwe h GLN 1532Cb 0.75 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.16 1xwe h GLN 1532CO 0.06 0.00 -1.83 1.15 -0.95 0.00 0.00 178.83 177.25 1xwe h THR 1533N 0.00 0.73 0.00 -0.54 2.02 -1.65 -3.30 112.91 110.16 1xwe h THR 1533Ca 0.00 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.83 1xwe h THR 1533Cb 0.04 2.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 1xwe h THR 1533CO 0.00 0.81 0.00 0.00 0.37 0.00 0.00 175.52 176.70 1xwe n ALA 1534N -3.03 1.63 0.24 6.16 0.00 -0.53 -1.70 120.51 123.28 1xwe n ALA 1534Ca -0.31 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.18 1xwe n ALA 1534Cb 0.99 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 19.12 1xwe n ALA 1534CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xwe s LYS 1536N -3.22 3.81 0.51 0.00 1.02 -0.69 -4.90 119.74 116.28 1xwe s LYS 1536Ca -0.03 2.27 0.20 0.00 0.02 0.00 0.00 55.97 58.42 1xwe s LYS 1536Cb 0.13 -2.69 1.30 0.00 -0.52 0.00 0.00 37.83 36.05 1xwe s LYS 1536CO 0.81 -0.66 2.07 -1.35 -0.92 0.00 0.00 175.35 175.30 1xwe h PRO 1537N 2.47 0.05 0.48 -1.68 0.11 -1.93 -2.76 132.00 128.73 1xwe h PRO 1537Ca -0.50 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1xwe h PRO 1537Cb 1.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xwe h PRO 1537CO 0.62 0.03 -0.23 1.05 -0.21 0.00 0.00 178.00 179.26 1xwe h GLU 1538N 0.05 -0.62 -6.13 1.05 4.11 -1.91 -3.41 114.58 107.72 1xwe h GLU 1538Ca 0.14 0.04 -0.58 0.00 0.07 0.00 0.00 59.36 59.03 1xwe h GLU 1538Cb 0.49 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1xwe h GLU 1538CO -0.01 -0.33 1.38 0.42 0.07 0.00 0.00 179.01 180.54 1xwe s ILE 1539N -5.30 3.17 -0.13 -1.06 -1.09 -1.04 -3.75 121.20 112.00 1xwe s ILE 1539Ca -0.15 0.18 -0.08 0.00 -2.23 0.00 0.00 60.65 58.37 1xwe s ILE 1539Cb 0.03 -3.21 -0.05 0.00 -1.58 0.00 0.00 42.46 37.65 1xwe s ILE 1539CO 0.56 -0.11 0.01 0.00 -1.23 0.00 0.00 174.94 174.17 1xwe h ALA 1540N 13.57 0.02 -2.50 9.38 0.00 -0.06 -3.45 119.26 136.22 1xwe h ALA 1540Ca -0.40 -0.34 -0.55 0.00 0.00 0.00 0.00 54.91 53.62 1xwe h ALA 1540Cb 1.22 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 1xwe h ALA 1540CO 0.98 0.26 -0.55 1.52 0.00 0.00 0.00 179.25 181.45 1xwe s TYR 1541N -1.95 3.12 -0.29 0.00 -0.85 -0.58 -4.55 117.35 112.26 1xwe s TYR 1541Ca -0.10 -0.06 0.03 0.00 -0.52 0.00 0.00 57.07 56.42 1xwe s TYR 1541Cb 0.01 -1.46 0.17 0.00 0.38 0.00 0.00 41.96 41.06 1xwe s TYR 1541CO 0.19 0.52 0.47 0.00 -1.52 0.00 0.00 175.55 175.21 1xwe s ALA 1542N -1.91 -1.59 0.25 9.51 0.00 -0.72 -2.03 121.76 125.27 1xwe s ALA 1542Ca 0.32 0.57 -0.14 0.00 0.00 0.00 0.00 51.96 52.71 1xwe s ALA 1542Cb -0.09 -2.19 -0.00 0.00 0.00 0.00 0.00 23.12 20.84 1xwe s ALA 1542CO 0.24 -1.73 0.50 1.52 0.00 0.00 0.00 175.76 176.29 1xwe s TYR 1543N 2.64 0.30 -0.11 0.00 -0.85 -0.49 -0.11 117.35 118.74 1xwe s TYR 1543Ca 0.10 -0.67 -0.07 0.00 -0.52 0.00 0.00 57.07 55.91 1xwe s TYR 1543Cb -0.12 0.24 -0.04 0.00 0.38 0.00 0.00 41.96 42.42 1xwe s TYR 1543CO -0.28 -1.01 0.16 0.21 -1.52 0.00 0.00 175.55 173.11 1xwe s LYS 1544N -4.00 3.47 0.27 -3.49 2.20 -0.65 -1.18 119.74 116.36 1xwe s LYS 1544Ca 0.21 -0.11 0.05 0.00 -0.36 0.00 0.00 55.97 55.76 1xwe s LYS 1544Cb -0.01 -3.19 -0.02 0.00 -1.51 0.00 0.00 37.83 33.10 1xwe s LYS 1544CO 0.08 0.77 0.18 1.33 -0.36 0.00 0.00 175.35 177.35 1xwe n VAL 1545N 1.95 0.00 -3.66 4.02 0.24 -0.79 -0.22 118.33 119.87 1xwe n VAL 1545Ca -0.19 -1.82 -0.06 0.00 -2.04 0.00 0.00 64.34 60.22 1xwe n VAL 1545Cb 0.55 0.82 -0.08 0.00 -1.47 0.00 0.00 33.84 33.66 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 -2.81 -0.59 0.26 -1.34 0.15 -0.07 -1.63 113.70 107.66 1xwe s SER 1546Ca 0.25 1.20 -0.31 0.00 0.70 0.00 0.00 55.95 57.79 1xwe s SER 1546Cb 0.01 1.64 -0.13 0.00 -1.71 0.00 0.00 66.02 65.84 1xwe s SER 1546CO 0.18 -0.23 1.49 -0.38 1.20 0.00 0.00 173.24 175.50 1xwe n ILE 1547N 5.31 0.95 0.00 6.45 2.08 -0.98 -1.58 119.36 131.58 1xwe n ILE 1547Ca -0.11 -0.24 0.00 0.00 0.56 0.00 0.00 62.75 62.96 1xwe n ILE 1547Cb 0.50 -1.67 0.00 0.00 -0.75 0.00 0.00 39.64 37.72 1xwe n ILE 1547CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 1xwe n THR 1548N 2.05 0.00 -3.68 1.39 -2.24 -1.02 -2.83 114.28 107.96 1xwe n THR 1548Ca 0.11 -0.08 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 1xwe n THR 1548Cb 0.33 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 68.97 1xwe n THR 1548CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1xwe s SER 1549N -0.92 -0.46 -0.03 3.42 0.01 -0.88 -4.96 113.70 109.88 1xwe s SER 1549Ca 0.00 0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.96 1xwe s SER 1549Cb 0.00 0.73 0.03 0.00 0.21 0.00 0.00 66.02 66.99 1xwe s SER 1549CO 0.00 -0.34 0.00 -0.63 0.41 0.00 0.00 173.24 172.68 1xwe s ILE 1550N -0.47 0.20 0.00 1.44 1.01 -1.26 -1.63 121.20 120.49 1xwe s ILE 1550Ca -0.06 0.09 0.03 0.00 0.00 0.00 0.00 60.65 60.71 1xwe s ILE 1550Cb -0.03 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 1xwe s ILE 1550CO 0.04 0.16 -0.08 -0.89 0.00 0.00 0.00 174.94 174.16 1xwe s THR 1551N 1.12 0.66 -0.01 2.92 2.01 -0.61 -5.04 115.64 116.70 1xwe s THR 1551Ca -0.08 -0.45 0.06 0.00 0.31 0.00 0.00 61.69 61.53 1xwe s THR 1551Cb -0.13 -0.58 -0.02 0.00 0.01 0.00 0.00 72.50 71.78 1xwe s THR 1551CO -0.02 0.12 -0.21 0.54 -0.69 0.00 0.00 174.62 174.37 1xwe s VAL 1552N -0.33 1.65 0.00 3.82 0.11 -1.26 -1.28 120.40 123.10 1xwe s VAL 1552Ca 0.02 -0.90 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 1xwe s VAL 1552Cb -0.04 -1.37 0.00 0.00 -1.53 0.00 0.00 36.38 33.44 1xwe s VAL 1552CO -0.00 0.46 0.00 -0.62 -3.33 0.00 0.00 175.10 171.61 1xwe n GLU 1553N 2.55 0.00 0.00 1.54 -0.58 -1.23 -5.02 120.64 117.90 1xwe n GLU 1553Ca -0.15 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1xwe n GLU 1553Cb 0.53 -0.18 0.00 0.00 -0.57 0.00 0.00 31.44 31.21 1xwe n GLU 1553CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xwe n ASN 1554N -2.02 0.00 -0.12 1.62 4.13 -1.26 -5.02 115.26 112.59 1xwe n ASN 1554Ca 0.00 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.04 1xwe n ASN 1554Cb 0.00 0.05 -0.10 0.00 -1.54 0.00 0.00 39.78 38.20 1xwe n ASN 1554CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1xwe n VAL 1555N -2.02 1.33 -2.92 2.41 0.31 -1.26 -5.00 118.33 111.18 1xwe n VAL 1555Ca 0.00 -0.41 -0.27 0.00 -0.01 0.00 0.00 64.34 63.65 1xwe n VAL 1555Cb 0.00 -1.61 -0.01 0.00 -0.91 0.00 0.00 33.84 31.31 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 -2.45 3.53 -0.01 3.52 0.08 -1.26 -2.86 117.98 118.53 1xwe s PHE 1556Ca -0.33 0.72 0.05 0.00 0.12 0.00 0.00 56.93 57.49 1xwe s PHE 1556Cb 0.11 -2.20 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 1xwe s PHE 1556CO 0.47 -0.11 -0.15 0.08 -0.10 0.00 0.00 175.22 175.42 1xwe s VAL 1557N -2.51 1.18 -0.22 -0.44 1.01 -0.60 -3.50 120.40 115.32 1xwe s VAL 1557Ca 0.46 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1xwe s VAL 1557Cb -0.10 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 1xwe s VAL 1557CO 0.39 0.33 0.07 -0.54 0.00 0.00 0.00 175.10 175.35 1xwe s LYS 1558N -0.36 3.80 -0.26 2.72 -0.14 -0.41 -1.96 119.74 123.13 1xwe s LYS 1558Ca 0.06 -0.42 -0.01 0.00 -1.36 0.00 0.00 55.97 54.24 1xwe s LYS 1558Cb -0.06 -3.29 0.04 0.00 -1.68 0.00 0.00 37.83 32.84 1xwe s LYS 1558CO -0.01 0.01 -0.06 0.71 -0.76 0.00 0.00 175.35 175.24 1xwe s TYR 1559N 1.09 3.13 -0.61 3.18 2.02 -0.50 -1.57 117.35 124.10 1xwe s TYR 1559Ca 0.04 -1.77 -0.20 0.00 -0.37 0.00 0.00 57.07 54.78 1xwe s TYR 1559Cb -0.14 -2.04 0.10 0.00 -0.40 0.00 0.00 41.96 39.47 1xwe s TYR 1559CO 0.03 -0.78 0.76 0.15 -1.57 0.00 0.00 175.55 174.14 1xwe s LYS 1560N 1.27 3.06 0.04 -0.62 -0.14 -0.64 -1.17 119.74 121.52 1xwe s LYS 1560Ca -0.02 -1.23 0.03 0.00 -1.36 0.00 0.00 55.97 53.38 1xwe s LYS 1560Cb -0.18 -4.26 -0.04 0.00 -1.68 0.00 0.00 37.83 31.67 1xwe s LYS 1560CO -0.04 -1.60 -0.00 0.00 -0.76 0.00 0.00 175.35 172.95 1xwe s ALA 1561N 2.96 3.28 -0.14 5.17 0.00 -0.84 -2.06 121.76 130.11 1xwe s ALA 1561Ca 0.14 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.96 1xwe s ALA 1561Cb -0.23 -1.28 -0.05 0.00 0.00 0.00 0.00 23.12 21.57 1xwe s ALA 1561CO 0.07 0.67 0.25 0.99 0.00 0.00 0.00 175.76 177.73 1xwe s THR 1562N -1.17 5.33 -0.62 0.00 2.01 -0.62 -2.57 115.64 118.01 1xwe s THR 1562Ca 0.22 0.45 -0.27 0.00 0.31 0.00 0.00 61.69 62.40 1xwe s THR 1562Cb -0.12 -3.57 -0.00 0.00 0.01 0.00 0.00 72.50 68.82 1xwe s THR 1562CO 0.13 0.46 1.65 -0.22 -0.69 0.00 0.00 174.62 175.95 1xwe s LEU 1563N 0.02 3.29 0.20 4.42 0.20 -1.13 -0.89 118.68 124.79 1xwe s LEU 1563Ca 0.15 0.21 -0.11 0.00 0.69 0.00 0.00 54.13 55.07 1xwe s LEU 1563Cb -0.13 -2.69 0.19 0.00 -0.43 0.00 0.00 46.19 43.13 1xwe s LEU 1563CO 0.04 -2.10 1.82 -0.07 -0.29 0.00 0.00 176.35 175.75 1xwe h LEU 1564N 14.92 0.60 -7.00 -0.68 3.38 -0.88 -1.39 115.31 124.26 1xwe h LEU 1564Ca -0.27 0.01 0.11 0.00 0.09 0.00 0.00 57.88 57.82 1xwe h LEU 1564Cb 1.12 -0.11 -0.23 0.00 0.09 0.00 0.00 40.66 41.53 1xwe h LEU 1564CO 1.21 0.41 0.60 -0.62 0.09 0.00 0.00 178.44 180.13 1xwe s ASP 1565N -5.65 -0.32 -0.09 -0.43 -1.08 -0.90 -4.55 116.67 103.65 1xwe s ASP 1565Ca -0.13 0.33 -0.11 0.00 -0.52 0.00 0.00 52.55 52.13 1xwe s ASP 1565Cb 0.15 0.27 -0.05 0.00 -1.46 0.00 0.00 42.92 41.83 1xwe s ASP 1565CO 0.76 -0.31 0.25 -0.63 0.52 0.00 0.00 175.17 175.76 1xwe s ILE 1566N -1.20 5.31 -0.01 4.11 1.01 -1.26 -1.63 121.20 127.54 1xwe s ILE 1566Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.16 1xwe s ILE 1566Cb -0.01 -3.54 -0.06 0.00 0.01 0.00 0.00 42.46 38.87 1xwe s ILE 1566CO -0.00 0.57 0.08 -1.22 0.00 0.00 0.00 174.94 174.36 1xwe n TYR 1567N 2.22 0.00 -3.24 3.97 4.02 -0.61 -4.93 117.16 118.59 1xwe n TYR 1567Ca -0.17 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.69 1xwe n TYR 1567Cb 0.54 -0.08 -0.03 0.00 -0.02 0.00 0.00 39.34 39.74 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 -2.25 0.48 0.26 -0.72 2.36 0.85 -4.81 119.74 115.91 1xwe s LYS 1568Ca -0.01 0.29 -0.26 0.00 -2.55 0.00 0.00 55.97 53.44 1xwe s LYS 1568Cb 0.02 -0.07 -0.16 0.00 -1.05 0.00 0.00 37.83 36.57 1xwe s LYS 1568CO 0.15 -1.05 0.45 2.41 1.55 0.00 0.00 175.35 178.86 1xwe n THR 1569N 5.36 1.68 -3.26 3.43 -1.04 -1.26 -1.76 114.28 117.43 1xwe n THR 1569Ca 0.03 -0.50 -0.38 0.00 -2.04 0.00 0.00 64.05 61.15 1xwe n THR 1569Cb 0.51 -0.08 -0.06 0.00 -1.82 0.00 0.00 70.33 68.89 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 -0.97 2.50 0.62 3.41 0.00 -1.26 -4.35 107.32 107.27 1xwe s GLY 1570Ca 0.63 -0.08 0.37 0.00 0.00 0.00 0.00 44.72 45.64 1xwe s GLY 1570CO 0.58 0.75 2.30 0.83 0.00 0.00 0.00 173.10 177.56 1xwe h GLU 1571N 6.16 0.00 0.00 2.90 5.08 -1.91 -3.28 114.58 123.52 1xwe h GLU 1571Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1xwe h GLU 1571Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1xwe h GLU 1571CO 0.72 0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.74 1xwe n ALA 1572N -2.19 0.00 -2.46 3.43 0.00 -1.26 -4.92 120.51 113.11 1xwe n ALA 1572Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.38 1xwe n ALA 1572Cb 0.09 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.59 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 -0.03 0.18 -2.04 0.00 3.14 -1.25 -5.07 118.33 113.25 1xwe n VAL 1573Ca 0.00 -0.95 -0.42 0.00 -2.96 0.00 0.00 64.34 60.01 1xwe n VAL 1573Cb 0.00 0.88 -0.03 0.00 -1.06 0.00 0.00 33.84 33.64 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 -0.48 3.64 0.10 1.55 0.00 -1.24 -5.00 121.76 120.33 1xwe s ALA 1574Ca 0.11 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.12 1xwe s ALA 1574Cb 0.28 -3.68 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1xwe s ALA 1574CO -0.08 -1.13 -0.08 -1.21 0.00 0.00 0.00 175.76 173.26 1xwe s GLU 1575N 2.97 0.83 0.26 0.00 2.02 -1.26 -4.27 118.70 119.26 1xwe s GLU 1575Ca 0.70 -1.27 -0.31 0.00 0.02 0.00 0.00 54.97 54.12 1xwe s GLU 1575Cb -0.35 -0.32 -0.12 0.00 0.10 0.00 0.00 34.13 33.44 1xwe s GLU 1575CO 0.30 0.02 1.57 1.17 0.02 0.00 0.00 175.26 178.34 1xwe n LYS 1576N 0.18 2.55 -3.63 1.61 4.81 -1.26 -1.94 118.16 120.47 1xwe n LYS 1576Ca -0.14 0.91 -0.26 0.00 -0.87 0.00 0.00 58.31 57.95 1xwe n LYS 1576Cb 0.60 -2.67 -0.03 0.00 0.02 0.00 0.00 35.03 32.95 1xwe n LYS 1576CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1xwe n ASP 1577N 2.48 -2.67 -2.24 3.14 5.68 -0.52 -4.92 116.55 117.49 1xwe n ASP 1577Ca 0.11 -0.53 0.00 0.00 -0.50 0.00 0.00 54.79 53.86 1xwe n ASP 1577Cb 0.35 -2.26 0.00 0.00 -1.14 0.00 0.00 41.12 38.07 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 -2.23 0.00 -4.12 -1.12 3.41 -0.82 -4.69 113.62 104.04 1xwe n SER 1578Ca 0.04 -0.60 -0.32 0.00 -0.26 0.00 0.00 58.87 57.73 1xwe n SER 1578Cb 0.50 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1xwe n SER 1578CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1xwe s GLU 1579N -1.55 2.79 -0.03 4.33 2.02 -1.26 -2.83 118.70 122.16 1xwe s GLU 1579Ca 0.00 -0.76 0.05 0.00 0.02 0.00 0.00 54.97 54.28 1xwe s GLU 1579Cb 0.00 -2.35 -0.01 0.00 0.10 0.00 0.00 34.13 31.88 1xwe s GLU 1579CO 0.00 -0.11 -0.18 0.96 0.02 0.00 0.00 175.26 175.95 1xwe s ILE 1580N 1.07 1.46 -0.37 -1.63 -4.36 -1.06 -5.03 121.20 111.28 1xwe s ILE 1580Ca -0.02 -0.75 -0.05 0.00 -0.26 0.00 0.00 60.65 59.57 1xwe s ILE 1580Cb -0.14 -1.24 0.07 0.00 1.25 0.00 0.00 42.46 42.40 1xwe s ILE 1580CO -0.06 0.42 0.15 -0.89 0.24 0.00 0.00 174.94 174.79 1xwe s THR 1581N -0.13 3.60 -0.27 8.37 2.01 -1.26 -1.99 115.64 125.97 1xwe s THR 1581Ca -0.00 -1.50 -0.09 0.00 0.31 0.00 0.00 61.69 60.40 1xwe s THR 1581Cb -0.10 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 1xwe s THR 1581CO 0.01 -0.39 0.14 -0.36 -0.69 0.00 0.00 174.62 173.34 1xwe s PHE 1582N 1.31 3.16 0.06 4.92 0.40 -0.32 -0.98 117.98 126.53 1xwe s PHE 1582Ca 0.01 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.22 1xwe s PHE 1582Cb -0.21 -2.32 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 1xwe s PHE 1582CO -0.00 -0.26 0.15 0.96 0.70 0.00 0.00 175.22 176.78 1xwe s ILE 1583N 1.70 5.05 0.01 0.64 -4.36 -0.86 -1.41 121.20 121.96 1xwe s ILE 1583Ca 0.07 -0.51 -0.02 0.00 -0.26 0.00 0.00 60.65 59.93 1xwe s ILE 1583Cb -0.16 -3.44 -0.01 0.00 1.25 0.00 0.00 42.46 40.10 1xwe s ILE 1583CO 0.08 0.16 0.02 -0.75 0.24 0.00 0.00 174.94 174.69 1xwe s LYS 1584N -2.39 0.28 0.14 0.37 2.20 -0.83 -3.22 119.74 116.30 1xwe s LYS 1584Ca 0.32 -0.40 -0.22 0.00 -0.36 0.00 0.00 55.97 55.31 1xwe s LYS 1584Cb -0.13 0.11 -0.07 0.00 -1.51 0.00 0.00 37.83 36.23 1xwe s LYS 1584CO 0.25 -0.05 0.68 0.15 -0.36 0.00 0.00 175.35 176.01 1xwe s LYS 1585N -1.09 4.36 0.00 4.03 1.02 -1.26 -1.55 119.74 125.25 1xwe s LYS 1585Ca -0.12 0.93 0.18 0.00 0.02 0.00 0.00 55.97 56.99 1xwe s LYS 1585Cb -0.07 -3.19 0.87 0.00 -0.52 0.00 0.00 37.83 34.92 1xwe s LYS 1585CO -0.00 0.57 1.56 1.55 -0.92 0.00 0.00 175.35 178.11 1xwe n VAL 1586N 1.49 0.56 0.69 3.17 3.14 -1.13 -2.50 118.33 123.75 1xwe n VAL 1586Ca -0.07 0.14 0.12 0.00 -2.96 0.00 0.00 64.34 61.57 1xwe n VAL 1586Cb 0.50 -0.84 0.48 0.00 -1.06 0.00 0.00 33.84 32.92 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 -1.36 0.50 -0.83 1.55 -2.24 -1.26 -4.84 114.28 105.81 1xwe n THR 1587Ca 0.07 -0.03 -0.30 0.00 -2.27 0.00 0.00 64.05 61.52 1xwe n THR 1587Cb 0.17 -0.72 0.26 0.00 -2.10 0.00 0.00 70.33 67.94 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 -5.12 0.00 1.47 0.00 -1.04 -1.25 -4.85 114.28 103.49 1xwe n THR 1589Ca 0.14 0.00 0.10 0.00 -2.04 0.00 0.00 64.05 62.25 1xwe n THR 1589Cb 0.60 -0.11 0.42 0.00 -1.82 0.00 0.00 70.33 69.42 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 -1.80 1.13 -4.30 8.00 4.13 -1.12 -4.79 115.26 116.51 1xwe n ASN 1590Ca 0.00 -1.62 -0.33 0.00 1.68 0.00 0.00 54.58 54.31 1xwe n ASN 1590Cb 0.00 -0.07 -0.16 0.00 -1.54 0.00 0.00 39.78 38.01 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 -1.86 2.41 -0.29 5.41 0.00 -1.25 -3.66 121.76 122.53 1xwe s ALA 1591Ca 0.30 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.33 1xwe s ALA 1591Cb 0.16 -1.04 0.19 0.00 0.00 0.00 0.00 23.12 22.43 1xwe s ALA 1591CO 0.24 0.24 0.70 -2.00 0.00 0.00 0.00 175.76 174.95 1xwe s GLU 1592N 0.39 0.46 0.54 0.00 2.12 -1.26 -4.95 118.70 116.01 1xwe s GLU 1592Ca -0.14 0.54 -0.04 0.00 0.36 0.00 0.00 54.97 55.69 1xwe s GLU 1592Cb -0.17 0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.49 1xwe s GLU 1592CO 0.07 -0.79 0.82 -0.51 -0.54 0.00 0.00 175.26 174.31 1xwe s LEU 1593N 2.87 3.38 -0.02 2.70 1.02 -1.26 -5.11 118.68 122.26 1xwe s LEU 1593Ca 0.14 0.60 -0.06 0.00 0.02 0.00 0.00 54.13 54.83 1xwe s LEU 1593Cb -0.09 -3.45 0.01 0.00 0.02 0.00 0.00 46.19 42.67 1xwe s LEU 1593CO -0.24 -0.93 0.14 0.54 0.02 0.00 0.00 176.35 175.88 1xwe s VAL 1594N -2.85 0.06 0.11 -1.59 0.11 -1.26 -5.15 120.40 109.83 1xwe s VAL 1594Ca 0.52 -0.47 -0.29 0.00 -2.93 0.00 0.00 61.98 58.80 1xwe s VAL 1594Cb -0.10 -0.36 -0.06 0.00 -1.53 0.00 0.00 36.38 34.33 1xwe s VAL 1594CO 0.43 -0.26 0.94 -0.75 -3.33 0.00 0.00 175.10 172.13 1xwe s LYS 1595N -0.91 4.68 0.00 1.54 2.20 -1.26 -3.61 119.74 122.38 1xwe s LYS 1595Ca -0.10 1.41 0.00 0.00 -0.36 0.00 0.00 55.97 56.92 1xwe s LYS 1595Cb -0.06 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 1xwe s LYS 1595CO 0.01 0.23 0.00 0.41 -0.36 0.00 0.00 175.35 175.64 1xwe n GLY 1596N 2.24 2.06 4.02 5.54 0.00 -1.13 -5.04 105.19 112.88 1xwe n GLY 1596Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.75 2.64 0.06 1.61 3.00 -1.24 -4.94 118.95 119.33 1xwe s ARG 1597Ca 0.00 -1.33 0.07 0.00 0.00 0.00 0.00 55.73 54.46 1xwe s ARG 1597Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 34.95 32.21 1xwe s ARG 1597CO 0.00 -0.49 -0.14 -0.65 0.00 0.00 0.00 175.30 174.02 1xwe s GLN 1598N -4.48 2.12 -0.05 3.54 -0.21 -1.26 -2.33 119.66 116.99 1xwe s GLN 1598Ca 0.57 -0.98 -0.02 0.00 0.02 0.00 0.00 55.36 54.96 1xwe s GLN 1598Cb -0.09 -2.26 0.04 0.00 1.00 0.00 0.00 33.01 31.70 1xwe s GLN 1598CO 0.35 0.53 0.10 0.71 -2.12 0.00 0.00 175.29 174.87 1xwe s TYR 1599N -1.05 -0.09 -0.52 0.91 2.02 -0.65 -2.16 117.35 115.82 1xwe s TYR 1599Ca 0.17 0.37 -0.27 0.00 -0.37 0.00 0.00 57.07 56.98 1xwe s TYR 1599Cb -0.11 -0.20 0.03 0.00 -0.40 0.00 0.00 41.96 41.29 1xwe s TYR 1599CO 0.09 -0.16 1.06 -1.17 -1.57 0.00 0.00 175.55 173.79 1xwe s LEU 1600N 1.41 3.78 -0.12 -1.29 2.96 0.08 -1.89 118.68 123.61 1xwe s LEU 1600Ca -0.06 0.07 -0.14 0.00 -0.22 0.00 0.00 54.13 53.78 1xwe s LEU 1600Cb -0.12 -3.17 -0.05 0.00 0.50 0.00 0.00 46.19 43.35 1xwe s LEU 1600CO -0.05 -1.27 0.33 -0.63 -1.32 0.00 0.00 176.35 173.42 1xwe s ILE 1601N 4.32 5.25 -0.23 6.68 1.01 -0.32 -2.12 121.20 135.78 1xwe s ILE 1601Ca 0.39 0.65 -0.03 0.00 0.00 0.00 0.00 60.65 61.66 1xwe s ILE 1601Cb -0.09 -3.66 0.11 0.00 0.01 0.00 0.00 42.46 38.83 1xwe s ILE 1601CO 0.25 0.44 0.29 -0.04 0.00 0.00 0.00 174.94 175.88 1xwe s MET 1602N 0.05 0.27 0.19 2.79 -1.94 -0.60 -1.39 119.30 118.67 1xwe s MET 1602Ca 0.19 0.24 -0.06 0.00 -1.71 0.00 0.00 55.69 54.35 1xwe s MET 1602Cb -0.14 -0.87 0.03 0.00 2.01 0.00 0.00 34.83 35.86 1xwe s MET 1602CO 0.07 -0.73 0.37 0.41 -0.01 0.00 0.00 175.02 175.13 1xwe n GLY 1603N 5.33 1.65 0.83 -0.03 0.00 -0.86 0.01 105.19 112.13 1xwe n GLY 1603Ca -0.04 -1.18 -0.08 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.27 -2.47 -2.52 1.61 5.02 -1.25 0.54 118.16 118.82 1xwe n LYS 1604Ca -0.04 -0.39 -0.35 0.00 -2.02 0.00 0.00 58.31 55.51 1xwe n LYS 1604Cb 0.29 -0.47 -0.04 0.00 -0.02 0.00 0.00 35.03 34.80 1xwe n LYS 1604CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1xwe s GLU 1605N -3.56 3.94 0.54 1.97 2.12 -1.26 -4.08 118.70 118.38 1xwe s GLU 1605Ca 0.17 1.45 -0.18 0.00 0.36 0.00 0.00 54.97 56.77 1xwe s GLU 1605Cb -0.03 -2.29 -0.06 0.00 0.26 0.00 0.00 34.13 32.01 1xwe s GLU 1605CO 0.14 -0.33 1.05 0.00 -0.54 0.00 0.00 175.26 175.59 1xwe s ALA 1606N -1.82 2.80 1.00 6.30 0.00 -1.26 -5.01 121.76 123.77 1xwe s ALA 1606Ca 0.63 0.50 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1xwe s ALA 1606Cb -0.19 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1xwe s ALA 1606CO 0.24 -0.58 0.00 1.28 0.00 0.00 0.00 175.76 176.70 1xwe n LEU 1607N -1.52 0.00 -3.71 0.00 7.99 -1.12 -4.83 117.00 113.81 1xwe n LEU 1607Ca 0.09 0.00 -0.12 0.00 -0.01 0.00 0.00 56.01 55.97 1xwe n LEU 1607Cb 0.53 0.00 -0.11 0.00 -0.11 0.00 0.00 43.42 43.73 1xwe n LEU 1607CO 0.44 -1.19 0.05 0.00 -1.51 0.00 0.00 177.39 175.18 1xwe s GLN 1608N -2.59 0.41 0.00 3.23 -2.07 -1.26 -4.38 119.66 112.99 1xwe s GLN 1608Ca 0.00 0.68 0.00 0.00 -1.82 0.00 0.00 55.36 54.22 1xwe s GLN 1608Cb 0.00 0.07 0.00 0.00 -1.09 0.00 0.00 33.01 31.99 1xwe s GLN 1608CO 0.00 -0.12 0.00 0.44 -1.32 0.00 0.00 175.29 174.29 1xwe n ILE 1609N 3.69 0.00 -1.58 3.63 -0.00 -1.20 -4.31 119.36 119.60 1xwe n ILE 1609Ca -0.19 0.00 -0.45 0.00 -0.00 0.00 0.00 62.75 62.11 1xwe n ILE 1609Cb 0.56 0.00 -0.04 0.00 -0.00 0.00 0.00 39.64 40.16 1xwe n ILE 1609CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1xwe n LYS 1610N -0.06 1.88 -3.48 6.28 5.02 -1.26 -2.21 118.16 124.33 1xwe n LYS 1610Ca 0.00 0.55 -0.26 0.00 -2.02 0.00 0.00 58.31 56.58 1xwe n LYS 1610Cb 0.00 -3.01 -0.13 0.00 -0.02 0.00 0.00 35.03 31.87 1xwe n LYS 1610CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1xwe s TYR 1611N 7.42 0.24 0.00 2.13 5.04 0.19 -4.86 117.35 127.51 1xwe s TYR 1611Ca 1.01 -0.96 0.00 0.00 -2.44 0.00 0.00 57.07 54.68 1xwe s TYR 1611Cb -0.48 -0.78 0.00 0.00 0.35 0.00 0.00 41.96 41.04 1xwe s TYR 1611CO 0.40 -0.86 0.00 0.09 -1.34 0.00 0.00 175.55 173.84 1xwe n ASN 1612N 4.84 0.00 -0.06 4.32 5.03 -1.26 -1.05 115.26 127.08 1xwe n ASN 1612Ca 0.01 0.00 -0.05 0.00 0.87 0.00 0.00 54.58 55.41 1xwe n ASN 1612Cb 0.42 0.00 -0.15 0.00 -1.02 0.00 0.00 39.78 39.03 1xwe n ASN 1612CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1xwe n ALA 1613N 2.85 1.78 -1.94 5.41 0.00 -1.26 -4.97 120.51 122.39 1xwe n ALA 1613Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 53.44 52.12 1xwe n ALA 1613Cb 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 19.45 19.02 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 -5.44 5.66 0.00 0.00 0.01 -0.22 -5.01 113.70 108.71 1xwe s SER 1614Ca -0.08 1.10 0.12 0.00 1.31 0.00 0.00 55.95 58.40 1xwe s SER 1614Cb 0.08 -2.01 0.19 0.00 0.21 0.00 0.00 66.02 64.50 1xwe s SER 1614CO 0.84 -1.16 1.03 0.49 0.41 0.00 0.00 173.24 174.84 1xwe n PHE 1615N -2.85 0.00 0.00 2.43 3.72 -1.24 -0.64 117.46 118.88 1xwe n PHE 1615Ca 0.06 -0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.16 1xwe n PHE 1615Cb 0.57 0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.12 1xwe n PHE 1615CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1xwe n ARG 1616N 0.22 -3.23 -2.17 -1.08 1.85 -0.94 -3.98 116.66 107.33 1xwe n ARG 1616Ca -0.01 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.53 1xwe n ARG 1616Cb 0.88 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 32.25 1xwe n ARG 1616CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1xwe s TYR 1617N -2.00 2.06 0.54 2.89 1.51 -1.26 -3.24 117.35 117.85 1xwe s TYR 1617Ca 0.00 0.14 0.07 0.00 -1.01 0.00 0.00 57.07 56.27 1xwe s TYR 1617Cb 0.00 -4.18 0.05 0.00 -0.11 0.00 0.00 41.96 37.72 1xwe s TYR 1617CO 0.00 -1.54 0.52 0.96 -1.11 0.00 0.00 175.55 174.38 1xwe s ILE 1618N 9.27 1.87 -0.19 2.71 -4.36 -1.26 -4.80 121.20 124.45 1xwe s ILE 1618Ca 0.65 -1.33 0.00 0.00 -0.26 0.00 0.00 60.65 59.71 1xwe s ILE 1618Cb -0.02 -2.20 0.04 0.00 1.25 0.00 0.00 42.46 41.53 1xwe s ILE 1618CO 0.05 0.00 -0.09 -0.31 0.24 0.00 0.00 174.94 174.84 1xwe s TYR 1619N -2.72 2.21 0.84 1.37 1.51 -0.15 -2.78 117.35 117.62 1xwe s TYR 1619Ca 0.43 -1.45 -0.12 0.00 -1.01 0.00 0.00 57.07 54.92 1xwe s TYR 1619Cb -0.03 -1.54 0.09 0.00 -0.11 0.00 0.00 41.96 40.37 1xwe s TYR 1619CO 0.27 -0.71 1.12 -1.25 -1.11 0.00 0.00 175.55 173.87 1xwe s PRO 1620N 1.46 1.75 -0.29 -1.71 0.04 -1.26 -2.03 135.00 132.97 1xwe s PRO 1620Ca -0.01 0.46 -0.01 0.00 0.04 0.00 0.00 61.00 61.48 1xwe s PRO 1620Cb -0.16 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.61 1xwe s PRO 1620CO -0.08 -1.81 0.26 -0.51 0.04 0.00 0.00 177.00 174.90 1xwe s LEU 1621N -5.84 -0.07 0.00 -3.56 1.43 -1.20 -4.79 118.68 104.64 1xwe s LEU 1621Ca 0.62 -0.86 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1xwe s LEU 1621Cb -0.14 0.32 0.00 0.00 0.03 0.00 0.00 46.19 46.40 1xwe s LEU 1621CO 0.53 -0.40 0.00 -0.67 0.23 0.00 0.00 176.35 176.04 1xwe n ASP 1622N 5.30 0.00 0.00 2.29 2.03 -1.26 -4.71 116.55 120.19 1xwe n ASP 1622Ca -0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.28 1xwe n ASP 1622Cb 0.45 -0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.80 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 -1.67 0.00 0.04 1.67 3.41 -1.26 0.72 113.62 116.53 1xwe n SER 1623Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 1xwe n SER 1623Cb 0.00 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.39 1xwe n SER 1623CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xwe n LEU 1624N 0.00 0.27 -4.55 1.04 -0.00 -1.26 -4.62 117.00 107.87 1xwe n LEU 1624Ca 0.00 0.55 -0.42 0.00 -0.00 0.00 0.00 56.01 56.14 1xwe n LEU 1624Cb 0.00 -0.49 -0.07 0.00 -0.00 0.00 0.00 43.42 42.86 1xwe n LEU 1624CO 0.00 -0.25 0.36 -0.89 -0.00 0.00 0.00 177.39 176.61 1xwe s THR 1625N -3.09 4.89 0.02 1.47 2.01 -1.26 -4.78 115.64 114.90 1xwe s THR 1625Ca 0.09 0.42 -0.30 0.00 0.31 0.00 0.00 61.69 62.21 1xwe s THR 1625Cb 0.12 -4.09 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 1xwe s THR 1625CO 0.41 -0.38 1.63 0.86 -0.69 0.00 0.00 174.62 176.45 1xwe s TRP 1626N 2.69 2.30 -0.10 4.92 -0.11 0.10 -4.90 118.94 123.84 1xwe s TRP 1626Ca 0.23 0.33 0.02 0.00 1.22 0.00 0.00 56.10 57.90 1xwe s TRP 1626Cb -0.14 -3.91 0.01 0.00 -1.50 0.00 0.00 33.47 27.92 1xwe s TRP 1626CO 0.16 -3.70 -0.17 0.42 -4.62 0.00 0.00 176.95 169.03 1xwe s ILE 1627N 3.12 1.59 -0.15 5.86 1.01 -1.26 -1.56 121.20 129.81 1xwe s ILE 1627Ca 0.73 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1xwe s ILE 1627Cb -0.36 -1.43 0.05 0.00 0.01 0.00 0.00 42.46 40.73 1xwe s ILE 1627CO 0.31 0.46 0.04 -0.70 0.00 0.00 0.00 174.94 175.05 1xwe s GLU 1628N 0.81 0.46 0.24 2.79 -6.30 -0.90 -3.53 118.70 112.28 1xwe s GLU 1628Ca -0.10 -0.16 -0.31 0.00 -2.50 0.00 0.00 54.97 51.90 1xwe s GLU 1628Cb -0.16 -1.66 -0.13 0.00 0.00 0.00 0.00 34.13 32.18 1xwe s GLU 1628CO 0.01 -0.54 1.43 0.98 0.02 0.00 0.00 175.26 177.16 1xwe n TYR 1629N 5.14 2.23 -3.56 5.30 9.36 -1.26 -0.74 117.16 133.63 1xwe n TYR 1629Ca -0.08 0.41 -0.41 0.00 3.32 0.00 0.00 57.90 61.15 1xwe n TYR 1629Cb 0.48 -2.47 -0.10 0.00 -0.63 0.00 0.00 39.34 36.62 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 -0.04 3.29 -0.34 2.98 -0.11 -0.92 -4.80 118.94 119.00 1xwe s TRP 1630Ca 0.68 -1.21 -0.34 0.00 1.22 0.00 0.00 56.10 56.44 1xwe s TRP 1630Cb -0.64 -2.81 -0.11 0.00 -1.50 0.00 0.00 33.47 28.42 1xwe s TRP 1630CO 0.49 -0.77 2.20 -2.30 -4.62 0.00 0.00 176.95 171.95 1xwe n PRO 1631N 5.00 1.16 0.05 5.86 -0.02 -1.26 -4.29 135.00 141.50 1xwe n PRO 1631Ca -0.11 0.31 -0.09 0.00 -2.02 0.00 0.00 63.50 61.59 1xwe n PRO 1631Cb 0.44 -2.54 -0.13 0.00 -0.02 0.00 0.00 33.50 31.25 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 12.71 0.05 -6.33 -0.52 2.43 -1.96 -3.44 114.38 117.32 1xwe h ARG 1632Ca -0.28 -0.08 -0.57 0.00 -0.81 0.00 0.00 59.98 58.24 1xwe h ARG 1632Cb 1.31 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.86 1xwe h ARG 1632CO 1.02 0.94 1.07 0.34 -1.51 0.00 0.00 179.97 181.82 1xwe s ASP 1633N -6.67 6.47 -0.00 -3.80 -1.08 -1.26 -4.80 116.67 105.54 1xwe s ASP 1633Ca -0.01 1.38 0.00 0.00 -0.52 0.00 0.00 52.55 53.40 1xwe s ASP 1633Cb 0.09 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 1xwe s ASP 1633CO 0.83 -1.22 0.65 0.35 0.52 0.00 0.00 175.17 176.30 1xwe n THR 1634N 6.42 0.26 -3.28 1.71 -2.24 -1.26 -4.41 114.28 111.47 1xwe n THR 1634Ca 0.17 -0.26 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 1xwe n THR 1634Cb 0.46 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 69.45 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 -0.14 -0.98 0.00 4.28 -2.24 -1.26 -4.73 114.28 109.22 1xwe n THR 1635Ca 0.00 -3.43 0.00 0.00 -2.27 0.00 0.00 64.05 58.35 1xwe n THR 1635Cb 0.46 -1.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.15 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 -1.79 -2.04 -0.40 0.00 3.41 -1.26 -4.95 113.62 106.60 1xwe n SER 1637Ca 0.00 0.63 0.04 0.00 -0.26 0.00 0.00 58.87 59.27 1xwe n SER 1637Cb 0.00 2.11 0.09 0.00 -0.26 0.00 0.00 64.21 66.15 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 -3.07 2.43 -3.39 4.04 2.88 -1.26 -5.01 113.62 110.24 1xwe n SER 1638Ca 0.00 -1.87 0.00 0.00 -1.33 0.00 0.00 58.87 55.67 1xwe n SER 1638Cb 0.00 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 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 0.00 -2.62 0.00 0.00 7.27 -1.26 -4.98 117.38 115.79 1xwe n GLN 1640Ca 0.00 2.22 0.00 0.00 0.07 0.00 0.00 57.00 59.29 1xwe n GLN 1640Cb 0.00 -4.68 0.00 0.00 2.41 0.00 0.00 30.24 27.97 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 0.36 0.74 0.08 1.69 0.00 -1.26 -4.88 120.51 117.24 1xwe n ALA 1641Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.57 1xwe n ALA 1641Cb 0.28 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.70 1xwe n ALA 1641CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xwe n PHE 1642N -0.88 0.88 -0.02 0.00 7.35 -1.26 -4.03 117.46 119.49 1xwe n PHE 1642Ca 0.00 0.26 -0.06 0.00 -0.76 0.00 0.00 57.45 56.89 1xwe n PHE 1642Cb 0.00 -0.93 0.14 0.00 0.35 0.00 0.00 39.48 39.04 1xwe n PHE 1642CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1xwe h LEU 1643N 0.00 0.60 -1.44 -2.13 -0.00 -1.93 -2.83 115.31 107.58 1xwe h LEU 1643Ca -0.02 -0.22 0.01 0.00 -0.00 0.00 0.00 57.88 57.64 1xwe h LEU 1643Cb 1.08 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 41.55 1xwe h LEU 1643CO 0.01 0.86 0.38 0.00 -0.00 0.00 0.00 178.44 179.68 1xwe h ALA 1644N 1.19 1.60 0.00 1.53 0.00 -1.92 -0.18 119.26 121.48 1xwe h ALA 1644Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xwe h ALA 1644Cb 0.74 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1xwe h ALA 1644CO 0.06 0.37 0.00 -0.91 0.00 0.00 0.00 179.25 178.77 1xwe h ASN 1645N 0.77 0.00 0.75 0.00 2.35 -1.70 -3.08 115.58 114.67 1xwe h ASN 1645Ca 0.21 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.71 1xwe h ASN 1645Cb -0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1xwe h ASN 1645CO -0.05 0.00 -1.17 -0.07 -1.65 0.00 0.00 177.43 174.50 1xwe h LEU 1646N 0.00 0.29 -1.69 1.61 3.38 -0.92 -3.26 115.31 114.73 1xwe h LEU 1646Ca 0.00 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1xwe h LEU 1646Cb 0.72 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1xwe h LEU 1646CO 0.00 1.24 0.10 0.44 0.09 0.00 0.00 178.44 180.32 1xwe h ASP 1647N 0.05 0.27 0.13 -0.43 3.32 -1.32 -1.25 116.42 117.19 1xwe h ASP 1647Ca -0.10 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.86 1xwe h ASP 1647Cb 1.91 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 41.38 1xwe h ASP 1647CO 0.18 0.24 -0.26 -0.33 -1.72 0.00 0.00 179.24 177.35 1xwe h GLU 1648N 0.31 0.22 0.00 3.56 4.39 -1.64 -2.35 114.58 119.08 1xwe h GLU 1648Ca 0.08 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1xwe h GLU 1648Cb 0.04 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1xwe h GLU 1648CO -0.01 0.47 -0.39 0.35 -1.16 0.00 0.00 179.01 178.27 1xwe h PHE 1649N 0.20 0.00 -0.05 4.33 3.57 -1.33 -2.16 116.94 121.50 1xwe h PHE 1649Ca 0.03 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1xwe h PHE 1649Cb 0.57 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 1xwe h PHE 1649CO 0.01 0.39 -0.01 0.00 -2.23 0.00 0.00 178.31 176.47 1xwe h ALA 1650N 1.61 0.07 -0.00 2.41 0.00 -1.27 -2.38 119.26 119.71 1xwe h ALA 1650Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1xwe h ALA 1650Cb 0.78 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1xwe h ALA 1650CO 0.05 -0.22 -0.00 -1.91 0.00 0.00 0.00 179.25 177.16 1xwe n GLU 1651N -4.84 0.56 0.03 0.00 2.13 -1.18 -2.11 120.64 115.23 1xwe n GLU 1651Ca -0.07 -0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.86 1xwe n GLU 1651Cb 0.21 -1.50 -0.04 0.00 0.27 0.00 0.00 31.44 30.38 1xwe n GLU 1651CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1xwe n ASP 1652N -1.22 0.53 -0.07 4.31 2.03 -0.82 -3.13 116.55 118.19 1xwe n ASP 1652Ca 0.17 -0.16 -0.06 0.00 0.52 0.00 0.00 54.79 55.26 1xwe n ASP 1652Cb 0.21 1.07 -0.12 0.00 -0.72 0.00 0.00 41.12 41.57 1xwe n ASP 1652CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xwe n ILE 1653N -2.10 0.90 0.04 5.18 0.13 -0.91 -0.53 119.36 122.07 1xwe n ILE 1653Ca 0.00 -0.60 -0.21 0.00 -1.10 0.00 0.00 62.75 60.85 1xwe n ILE 1653Cb 0.48 -0.52 -0.14 0.00 -0.84 0.00 0.00 39.64 38.62 1xwe n ILE 1653CO 0.00 0.00 0.00 0.15 2.80 0.00 0.00 176.55 179.50 1xwe h PHE 1654N 0.00 0.52 0.00 9.51 3.57 -1.61 -3.27 116.94 125.67 1xwe h PHE 1654Ca -0.36 -0.38 0.00 0.00 3.53 0.00 0.00 57.97 60.76 1xwe h PHE 1654Cb 1.78 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.50 1xwe h PHE 1654CO 0.00 1.38 0.00 -0.11 -2.23 0.00 0.00 178.31 177.35 1xwe n LEU 1655N -4.07 0.04 0.42 0.59 -0.00 -1.18 -4.68 117.00 108.12 1xwe n LEU 1655Ca -0.17 0.24 -0.19 0.00 -0.00 0.00 0.00 56.01 55.88 1xwe n LEU 1655Cb 0.85 -0.49 -0.10 0.00 -0.00 0.00 0.00 43.42 43.69 1xwe n LEU 1655CO 0.47 -0.49 0.55 0.78 -0.00 0.00 0.00 177.39 178.71 1xwe h ASN 1656N 0.00 -1.18 -5.77 1.96 2.35 -1.64 -3.47 115.58 107.83 1xwe h ASN 1656Ca 0.00 0.07 -0.38 0.00 -0.55 0.00 0.00 56.30 55.43 1xwe h ASN 1656Cb 0.00 0.34 0.15 0.00 0.05 0.00 0.00 38.32 38.86 1xwe h ASN 1656CO 0.00 -0.72 -0.70 0.61 -1.65 0.00 0.00 177.43 174.97 1xwe n GLY 1657N -1.61 -0.50 3.21 2.83 0.00 0.31 -4.96 105.19 104.48 1xwe n GLY 1657Ca -0.14 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32