#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xwe n SER 1509N 0.00 -0.79 -0.25 1.61 2.88 -1.26 -4.97 113.62 110.84 1xwe n SER 1509Ca 0.00 1.35 0.03 0.00 -1.33 0.00 0.00 58.87 58.91 1xwe n SER 1509Cb 0.00 -5.16 0.04 0.00 -0.75 0.00 0.00 64.21 58.34 1xwe n SER 1509CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xwe n HIS 1510N 1.72 0.07 -3.45 0.66 -0.00 -1.26 -5.01 115.22 107.95 1xwe n HIS 1510Ca -0.40 -0.15 -0.37 0.00 -0.00 0.00 0.00 57.72 56.79 1xwe n HIS 1510Cb 0.63 -0.01 -0.06 0.00 -0.00 0.00 0.00 29.99 30.55 1xwe n HIS 1510CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1xwe s MET 1511N -0.63 3.95 0.00 -1.40 0.00 -1.26 -4.89 119.30 115.07 1xwe s MET 1511Ca 0.08 0.44 0.00 0.00 0.00 0.00 0.00 55.69 56.21 1xwe s MET 1511Cb 0.05 -3.14 0.00 0.00 0.00 0.00 0.00 34.83 31.74 1xwe s MET 1511CO 0.07 0.63 0.00 0.00 0.00 0.00 0.00 175.02 175.72 1xwe n ALA 1512N 1.49 0.00 -0.34 3.16 0.00 -1.26 -5.09 120.51 118.47 1xwe n ALA 1512Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1xwe n ALA 1512Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1xwe n ALA 1512CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1xwe n ASP 1513N -1.01 0.00 -2.86 0.00 9.92 -1.26 -4.90 116.55 116.44 1xwe n ASP 1513Ca 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.24 1xwe n ASP 1513Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1xwe n ASP 1513CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xwe n GLY 1515N 1.62 0.43 3.59 0.00 0.00 -1.26 -3.61 105.19 105.96 1xwe n GLY 1515Ca -0.15 -0.39 -0.48 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.75 1.33 -4.39 1.61 7.27 -1.26 -3.83 117.38 116.37 1xwe n GLN 1516Ca -0.03 0.47 -0.19 0.00 0.07 0.00 0.00 57.00 57.32 1xwe n GLN 1516Cb 0.53 -1.98 -0.10 0.00 2.41 0.00 0.00 30.24 31.09 1xwe n GLN 1516CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 1xwe s MET 1517N -0.53 1.50 0.59 3.69 -1.94 -1.26 -4.58 119.30 116.76 1xwe s MET 1517Ca 0.70 -1.79 -0.01 0.00 -1.71 0.00 0.00 55.69 52.89 1xwe s MET 1517Cb -0.80 -0.80 0.04 0.00 2.01 0.00 0.00 34.83 35.28 1xwe s MET 1517CO 0.53 -0.11 0.83 -0.65 -0.01 0.00 0.00 175.02 175.61 1xwe s GLN 1518N -3.85 2.47 1.10 2.03 -1.52 -1.14 -5.03 119.66 113.72 1xwe s GLN 1518Ca 0.32 -0.63 -0.15 0.00 -1.95 0.00 0.00 55.36 52.96 1xwe s GLN 1518Cb 0.06 -2.41 0.24 0.00 -0.22 0.00 0.00 33.01 30.69 1xwe s GLN 1518CO 0.12 -0.84 1.08 -1.21 -0.25 0.00 0.00 175.29 174.19 1xwe s GLU 1519N -4.88 -0.40 -0.30 2.91 0.41 -1.26 -4.85 118.70 110.34 1xwe s GLU 1519Ca 0.58 0.38 -0.06 0.00 -0.41 0.00 0.00 54.97 55.46 1xwe s GLU 1519Cb -0.10 -1.65 0.02 0.00 -1.78 0.00 0.00 34.13 30.61 1xwe s GLU 1519CO 0.40 -3.26 0.06 -1.21 -0.49 0.00 0.00 175.26 170.76 1xwe s GLU 1520N -5.00 2.93 -0.21 1.61 2.02 -1.26 -4.62 118.70 114.16 1xwe s GLU 1520Ca 0.67 -0.96 -0.10 0.00 0.02 0.00 0.00 54.97 54.61 1xwe s GLU 1520Cb -0.17 -3.31 0.04 0.00 0.10 0.00 0.00 34.13 30.78 1xwe s GLU 1520CO 0.58 -0.49 0.20 1.28 0.02 0.00 0.00 175.26 176.85 1xwe n LEU 1521N 4.81 -6.54 -3.15 1.80 4.77 -1.26 -5.05 117.00 112.37 1xwe n LEU 1521Ca -0.14 2.12 0.01 0.00 -0.03 0.00 0.00 56.01 57.96 1xwe n LEU 1521Cb 0.47 -3.29 -0.01 0.00 -2.33 0.00 0.00 43.42 38.27 1xwe n LEU 1521CO 0.30 -3.89 0.11 -0.62 -1.33 0.00 0.00 177.39 171.97 1xwe s ASP 1522N -0.87 -1.48 -0.54 -1.43 -1.08 -1.26 -5.10 116.67 104.91 1xwe s ASP 1522Ca -0.23 -0.83 -0.27 0.00 -0.52 0.00 0.00 52.55 50.70 1xwe s ASP 1522Cb 0.02 1.89 -0.09 0.00 -1.46 0.00 0.00 42.92 43.27 1xwe s ASP 1522CO 0.79 -0.15 2.44 0.18 0.52 0.00 0.00 175.17 178.94 1xwe n LEU 1523N 4.26 2.05 0.00 -1.34 7.99 -1.26 -3.86 117.00 124.85 1xwe n LEU 1523Ca 0.11 -0.31 0.00 0.00 -0.01 0.00 0.00 56.01 55.80 1xwe n LEU 1523Cb 0.57 -1.46 0.00 0.00 -0.11 0.00 0.00 43.42 42.42 1xwe n LEU 1523CO 0.00 -1.34 0.00 1.07 -1.51 0.00 0.00 177.39 175.61 1xwe n THR 1524N 7.87 0.00 -1.68 -5.08 5.66 -1.26 -5.14 114.28 114.65 1xwe n THR 1524Ca 0.41 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 61.05 1xwe n THR 1524Cb 0.44 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.30 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 -0.21 2.06 -0.03 1.09 -1.09 -1.25 -5.03 121.20 116.75 1xwe s ILE 1525Ca 0.00 0.04 0.07 0.00 -2.23 0.00 0.00 60.65 58.53 1xwe s ILE 1525Cb 0.00 -2.94 -0.02 0.00 -1.58 0.00 0.00 42.46 37.92 1xwe s ILE 1525CO 0.00 -0.01 -0.23 -0.44 -1.23 0.00 0.00 174.94 173.03 1xwe s SER 1526N -1.50 3.30 0.58 3.58 0.01 -1.26 -5.01 113.70 113.40 1xwe s SER 1526Ca 0.81 -0.40 0.33 0.00 1.31 0.00 0.00 55.95 58.00 1xwe s SER 1526Cb -0.36 -0.47 1.76 0.00 0.21 0.00 0.00 66.02 67.16 1xwe s SER 1526CO 0.41 0.33 2.17 0.00 0.41 0.00 0.00 173.24 176.55 1xwe h ALA 1527N 5.45 1.21 0.11 1.44 0.00 -1.96 -2.26 119.26 123.25 1xwe h ALA 1527Ca -0.44 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.12 1xwe h ALA 1527Cb 1.13 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1xwe h ALA 1527CO 0.48 0.07 -1.52 0.93 0.00 0.00 0.00 179.25 179.20 1xwe h GLU 1528N 0.00 0.24 -0.57 0.00 4.39 -1.97 -3.23 114.58 113.43 1xwe h GLU 1528Ca -0.00 -0.40 0.06 0.00 0.34 0.00 0.00 59.36 59.35 1xwe h GLU 1528Cb 0.22 0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1xwe h GLU 1528CO 0.01 1.10 0.38 1.15 -1.16 0.00 0.00 179.01 180.48 1xwe h THR 1529N 0.06 1.01 0.01 1.13 2.02 -1.82 -0.00 112.91 115.31 1xwe h THR 1529Ca -0.24 -0.19 -0.21 0.00 0.77 0.00 0.00 66.41 66.53 1xwe h THR 1529Cb 2.01 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1xwe h THR 1529CO 0.16 0.10 -0.93 0.03 0.37 0.00 0.00 175.52 175.25 1xwe h ARG 1530N 0.56 0.29 0.00 6.66 3.08 -1.64 -3.22 114.38 120.12 1xwe h ARG 1530Ca 0.24 -0.33 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 1xwe h ARG 1530Cb 0.25 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1xwe h ARG 1530CO -0.07 1.04 -0.59 -0.22 -1.07 0.00 0.00 179.97 179.06 1xwe h LYS 1531N 0.16 0.00 0.00 0.04 1.63 -1.28 0.16 116.57 117.28 1xwe h LYS 1531Ca -0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1xwe h LYS 1531Cb 1.57 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.20 1xwe h LYS 1531CO 0.15 0.59 0.00 1.96 -3.45 0.00 0.00 179.45 178.70 1xwe h GLN 1532N 0.00 0.00 0.00 1.90 1.08 -1.05 -0.78 115.11 116.26 1xwe h GLN 1532Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1xwe h GLN 1532Cb 1.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1xwe h GLN 1532CO 0.08 0.00 -1.09 2.41 -0.95 0.00 0.00 178.83 179.28 1xwe n THR 1533N -2.52 0.00 0.15 -0.54 -1.04 -1.05 -4.53 114.28 104.75 1xwe n THR 1533Ca -0.01 -0.10 0.03 0.00 -2.04 0.00 0.00 64.05 61.93 1xwe n THR 1533Cb 0.08 0.46 0.08 0.00 -1.82 0.00 0.00 70.33 69.13 1xwe n THR 1533CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xwe h ALA 1534N 0.33 0.72 0.00 2.41 0.00 -0.19 -3.15 119.26 119.37 1xwe h ALA 1534Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1xwe h ALA 1534Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1xwe h ALA 1534CO 0.00 0.60 -0.40 0.00 0.00 0.00 0.00 179.25 179.45 1xwe s LYS 1536N -3.14 4.19 0.10 0.00 1.02 -1.19 -4.92 119.74 115.81 1xwe s LYS 1536Ca 0.08 1.17 0.07 0.00 0.02 0.00 0.00 55.97 57.31 1xwe s LYS 1536Cb 0.13 -2.21 0.37 0.00 -0.52 0.00 0.00 37.83 35.60 1xwe s LYS 1536CO 0.67 -0.07 1.20 -2.30 -0.92 0.00 0.00 175.35 173.94 1xwe n PRO 1537N -0.60 0.04 -0.02 -1.68 -0.02 -1.26 -2.04 135.00 129.43 1xwe n PRO 1537Ca 0.07 0.54 0.03 0.00 -2.02 0.00 0.00 63.50 62.12 1xwe n PRO 1537Cb 0.54 -1.65 0.38 0.00 -0.02 0.00 0.00 33.50 32.74 1xwe n PRO 1537CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1xwe h GLU 1538N 0.00 0.57 -5.33 -0.52 4.81 -1.91 -3.41 114.58 108.79 1xwe h GLU 1538Ca 0.00 -0.06 -0.65 0.00 -0.13 0.00 0.00 59.36 58.52 1xwe h GLU 1538Cb 0.01 -0.12 -0.25 0.00 0.63 0.00 0.00 28.75 29.02 1xwe h GLU 1538CO 0.00 0.43 -0.74 0.42 -0.73 0.00 0.00 179.01 178.40 1xwe s ILE 1539N -5.38 3.27 -0.17 2.32 1.09 -0.86 -2.77 121.20 118.70 1xwe s ILE 1539Ca -0.08 -0.58 -0.14 0.00 -1.10 0.00 0.00 60.65 58.74 1xwe s ILE 1539Cb 0.17 -2.39 -0.06 0.00 -1.06 0.00 0.00 42.46 39.12 1xwe s ILE 1539CO 0.74 0.52 -0.24 0.00 -0.10 0.00 0.00 174.94 175.87 1xwe n ALA 1540N 3.50 0.72 -2.82 9.38 0.00 0.68 -4.80 120.51 127.17 1xwe n ALA 1540Ca -0.18 -0.65 -0.24 0.00 0.00 0.00 0.00 53.44 52.37 1xwe n ALA 1540Cb 0.53 -0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 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 3.14 -0.34 0.00 -0.85 -0.80 -4.60 117.35 111.35 1xwe s TYR 1541Ca -0.24 -0.06 0.02 0.00 -0.52 0.00 0.00 57.07 56.28 1xwe s TYR 1541Cb 0.04 -1.47 0.15 0.00 0.38 0.00 0.00 41.96 41.07 1xwe s TYR 1541CO 0.36 0.52 0.38 0.00 -1.52 0.00 0.00 175.55 175.29 1xwe s ALA 1542N -1.93 -0.74 0.16 9.51 0.00 -0.93 -2.16 121.76 125.68 1xwe s ALA 1542Ca 0.32 -0.47 -0.06 0.00 0.00 0.00 0.00 51.96 51.74 1xwe s ALA 1542Cb -0.09 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 1xwe s ALA 1542CO 0.24 -1.95 0.22 1.52 0.00 0.00 0.00 175.76 175.78 1xwe s TYR 1543N 1.94 0.59 -0.07 0.00 -0.85 -0.71 -1.54 117.35 116.69 1xwe s TYR 1543Ca 0.13 -0.94 -0.02 0.00 -0.52 0.00 0.00 57.07 55.72 1xwe s TYR 1543Cb -0.14 -0.21 -0.04 0.00 0.38 0.00 0.00 41.96 41.96 1xwe s TYR 1543CO -0.17 -0.67 0.04 0.21 -1.52 0.00 0.00 175.55 173.44 1xwe s LYS 1544N -4.01 3.07 0.42 -3.49 2.20 -0.80 -1.50 119.74 115.64 1xwe s LYS 1544Ca 0.21 -0.38 0.04 0.00 -0.36 0.00 0.00 55.97 55.48 1xwe s LYS 1544Cb 0.05 -2.87 -0.02 0.00 -1.51 0.00 0.00 37.83 33.48 1xwe s LYS 1544CO 0.02 0.70 0.16 0.14 -0.36 0.00 0.00 175.35 176.01 1xwe s VAL 1545N -0.98 0.45 -0.10 4.02 -7.23 -0.64 -0.25 120.40 115.67 1xwe s VAL 1545Ca 0.16 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.29 1xwe s VAL 1545Cb -0.12 -2.29 0.04 0.00 0.56 0.00 0.00 36.38 34.58 1xwe s VAL 1545CO 0.05 0.00 0.07 -0.94 -0.31 0.00 0.00 175.10 173.98 1xwe s SER 1546N -3.62 1.64 0.36 4.85 1.04 -0.13 -2.32 113.70 115.53 1xwe s SER 1546Ca 0.23 -0.21 -0.28 0.00 0.48 0.00 0.00 55.95 56.17 1xwe s SER 1546Cb 0.01 -0.18 -0.11 0.00 0.10 0.00 0.00 66.02 65.84 1xwe s SER 1546CO 0.16 -0.29 1.49 -0.38 0.98 0.00 0.00 173.24 175.20 1xwe n ILE 1547N 5.29 1.80 -0.94 -1.02 2.08 -1.24 -1.21 119.36 124.13 1xwe n ILE 1547Ca -0.05 -0.45 0.00 0.00 0.56 0.00 0.00 62.75 62.81 1xwe n ILE 1547Cb 0.50 -1.92 0.00 0.00 -0.75 0.00 0.00 39.64 37.46 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 0.76 0.01 -3.58 1.39 -2.24 -0.58 -4.64 114.28 105.41 1xwe n THR 1548Ca 0.03 -0.04 -0.05 0.00 -2.27 0.00 0.00 64.05 61.72 1xwe n THR 1548Cb 0.38 1.73 -0.02 0.00 -2.10 0.00 0.00 70.33 70.32 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 -0.01 -0.19 -0.15 3.42 0.15 -0.92 -5.00 113.70 111.00 1xwe s SER 1549Ca 0.00 -0.01 -0.04 0.00 0.70 0.00 0.00 55.95 56.60 1xwe s SER 1549Cb 0.00 0.21 0.06 0.00 -1.71 0.00 0.00 66.02 64.57 1xwe s SER 1549CO 0.00 -0.34 0.09 -0.63 1.20 0.00 0.00 173.24 173.57 1xwe s ILE 1550N -2.60 -0.11 -0.05 6.45 1.01 -1.26 -1.80 121.20 122.84 1xwe s ILE 1550Ca 0.08 -0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.71 1xwe s ILE 1550Cb -0.01 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 1xwe s ILE 1550CO -0.06 -0.20 -0.14 -0.89 0.00 0.00 0.00 174.94 173.65 1xwe s THR 1551N 2.16 3.05 -0.02 2.92 2.01 -0.73 -4.99 115.64 120.03 1xwe s THR 1551Ca 0.03 -0.73 -0.01 0.00 0.31 0.00 0.00 61.69 61.29 1xwe s THR 1551Cb -0.15 -2.19 0.02 0.00 0.01 0.00 0.00 72.50 70.18 1xwe s THR 1551CO -0.08 0.59 0.04 0.54 -0.69 0.00 0.00 174.62 175.02 1xwe s VAL 1552N -0.69 -0.02 0.00 3.82 0.11 -1.26 -1.28 120.40 121.08 1xwe s VAL 1552Ca 0.10 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 1xwe s VAL 1552Cb -0.11 -0.08 0.00 0.00 -1.53 0.00 0.00 36.38 34.66 1xwe s VAL 1552CO 0.01 0.04 0.00 -0.62 -3.33 0.00 0.00 175.10 171.19 1xwe n GLU 1553N 3.54 0.00 0.03 1.54 -0.58 -1.26 -5.03 120.64 118.88 1xwe n GLU 1553Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 1xwe n GLU 1553Cb 0.56 -0.20 0.00 0.00 -0.57 0.00 0.00 31.44 31.23 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 -1.91 -0.21 0.03 1.62 4.13 -1.26 -5.03 115.26 112.63 1xwe n ASN 1554Ca 0.00 0.10 0.00 0.00 1.68 0.00 0.00 54.58 56.36 1xwe n ASN 1554Cb 0.00 0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.57 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 -2.66 0.43 -2.58 2.41 0.31 -1.26 -4.97 118.33 110.00 1xwe n VAL 1555Ca 0.00 0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 64.06 1xwe n VAL 1555Cb 0.00 -1.32 -0.03 0.00 -0.91 0.00 0.00 33.84 31.58 1xwe n VAL 1555CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1xwe s PHE 1556N -2.00 2.36 0.37 3.52 0.40 -1.26 -2.35 117.98 119.01 1xwe s PHE 1556Ca 0.00 -0.03 -0.21 0.00 -0.60 0.00 0.00 56.93 56.09 1xwe s PHE 1556Cb 0.00 -4.58 -0.10 0.00 0.51 0.00 0.00 43.02 38.85 1xwe s PHE 1556CO 0.00 -1.98 0.90 0.54 0.70 0.00 0.00 175.22 175.38 1xwe s VAL 1557N 5.49 4.40 -0.16 -0.44 0.11 -0.03 -4.24 120.40 125.53 1xwe s VAL 1557Ca 0.35 1.48 -0.03 0.00 -2.93 0.00 0.00 61.98 60.86 1xwe s VAL 1557Cb -0.09 -3.73 0.05 0.00 -1.53 0.00 0.00 36.38 31.08 1xwe s VAL 1557CO 0.16 -0.13 0.03 -0.54 -3.33 0.00 0.00 175.10 171.29 1xwe s LYS 1558N -2.75 0.63 -0.03 1.54 1.02 -0.40 -0.63 119.74 119.11 1xwe s LYS 1558Ca 0.56 -0.28 -0.14 0.00 0.02 0.00 0.00 55.97 56.13 1xwe s LYS 1558Cb -0.12 -1.84 -0.05 0.00 -0.52 0.00 0.00 37.83 35.29 1xwe s LYS 1558CO 0.17 -0.56 0.37 0.71 -0.92 0.00 0.00 175.35 175.12 1xwe s TYR 1559N 1.90 3.68 -0.21 3.18 2.02 -0.44 -1.78 117.35 125.70 1xwe s TYR 1559Ca 0.01 0.90 -0.11 0.00 -0.37 0.00 0.00 57.07 57.50 1xwe s TYR 1559Cb -0.16 -2.26 -0.05 0.00 -0.40 0.00 0.00 41.96 39.09 1xwe s TYR 1559CO -0.07 0.60 0.17 0.21 -1.57 0.00 0.00 175.55 174.88 1xwe s LYS 1560N -0.85 4.16 -0.08 -0.62 2.47 -0.74 -0.70 119.74 123.38 1xwe s LYS 1560Ca 0.22 -0.18 -0.07 0.00 -1.56 0.00 0.00 55.97 54.39 1xwe s LYS 1560Cb -0.16 -3.46 0.02 0.00 -1.46 0.00 0.00 37.83 32.78 1xwe s LYS 1560CO 0.11 0.21 0.21 0.00 0.16 0.00 0.00 175.35 176.04 1xwe s ALA 1561N 0.62 -0.50 -0.19 3.13 0.00 -0.97 -1.52 121.76 122.34 1xwe s ALA 1561Ca 0.09 0.63 -0.18 0.00 0.00 0.00 0.00 51.96 52.50 1xwe s ALA 1561Cb -0.12 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 1xwe s ALA 1561CO 0.01 -0.11 0.51 0.99 0.00 0.00 0.00 175.76 177.16 1xwe s THR 1562N 0.29 5.12 0.21 0.00 2.01 -0.35 -3.12 115.64 119.81 1xwe s THR 1562Ca -0.02 0.95 -0.32 0.00 0.31 0.00 0.00 61.69 62.62 1xwe s THR 1562Cb -0.03 -3.84 -0.12 0.00 0.01 0.00 0.00 72.50 68.52 1xwe s THR 1562CO -0.01 0.20 1.72 -0.11 -0.69 0.00 0.00 174.62 175.73 1xwe n LEU 1563N 4.59 4.02 -0.05 4.42 0.00 -0.89 -0.96 117.00 128.14 1xwe n LEU 1563Ca -0.05 1.07 -0.21 0.00 0.00 0.00 0.00 56.01 56.81 1xwe n LEU 1563Cb 0.51 -1.58 -0.13 0.00 0.00 0.00 0.00 43.42 42.22 1xwe n LEU 1563CO 0.42 0.18 -0.49 -0.07 0.00 0.00 0.00 177.39 177.43 1xwe h LEU 1564N 6.67 0.17 -7.00 -1.96 3.38 -0.92 -2.91 115.31 112.75 1xwe h LEU 1564Ca -0.43 -0.71 0.08 0.00 0.09 0.00 0.00 57.88 56.91 1xwe h LEU 1564Cb 1.20 -0.06 -0.27 0.00 0.09 0.00 0.00 40.66 41.63 1xwe h LEU 1564CO 0.95 1.56 0.51 -0.62 0.09 0.00 0.00 178.44 180.93 1xwe s ASP 1565N -6.89 -0.40 -0.25 -0.43 -1.08 -0.93 -4.33 116.67 102.36 1xwe s ASP 1565Ca -0.25 0.77 -0.13 0.00 -0.52 0.00 0.00 52.55 52.42 1xwe s ASP 1565Cb 0.05 0.78 -0.04 0.00 -1.46 0.00 0.00 42.92 42.25 1xwe s ASP 1565CO 0.67 -0.13 0.29 -0.63 0.52 0.00 0.00 175.17 175.90 1xwe s ILE 1566N 0.20 5.25 -0.34 4.11 1.01 -1.26 -1.90 121.20 128.27 1xwe s ILE 1566Ca 0.04 0.43 0.22 0.00 0.00 0.00 0.00 60.65 61.34 1xwe s ILE 1566Cb -0.05 -3.63 -0.21 0.00 0.01 0.00 0.00 42.46 38.59 1xwe s ILE 1566CO -0.08 0.23 0.78 -1.22 0.00 0.00 0.00 174.94 174.65 1xwe n TYR 1567N 4.91 0.24 -3.35 3.97 4.01 -0.61 -4.78 117.16 121.55 1xwe n TYR 1567Ca -0.11 0.07 -0.12 0.00 -0.16 0.00 0.00 57.90 57.58 1xwe n TYR 1567Cb 0.51 -0.51 -0.08 0.00 -0.31 0.00 0.00 39.34 38.96 1xwe n TYR 1567CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1xwe s LYS 1568N -3.35 0.36 0.13 -0.72 2.20 -0.59 -4.28 119.74 113.50 1xwe s LYS 1568Ca -0.02 0.11 -0.33 0.00 -0.36 0.00 0.00 55.97 55.37 1xwe s LYS 1568Cb 0.14 -0.49 -0.18 0.00 -1.51 0.00 0.00 37.83 35.79 1xwe s LYS 1568CO 0.85 -0.95 0.84 2.41 -0.36 0.00 0.00 175.35 178.14 1xwe n THR 1569N 5.34 1.11 -3.00 3.43 -1.04 -1.26 -2.19 114.28 116.67 1xwe n THR 1569Ca -0.01 -0.28 -0.39 0.00 -2.04 0.00 0.00 64.05 61.33 1xwe n THR 1569Cb 0.48 -0.17 -0.06 0.00 -1.82 0.00 0.00 70.33 68.77 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 -0.47 2.90 0.64 3.41 0.00 -1.26 -4.44 107.32 108.09 1xwe s GLY 1570Ca 0.75 0.34 0.28 0.00 0.00 0.00 0.00 44.72 46.09 1xwe s GLY 1570CO 0.56 0.86 1.87 0.83 0.00 0.00 0.00 173.10 177.22 1xwe h GLU 1571N 4.39 0.00 0.00 2.90 5.08 -1.91 -3.35 114.58 121.69 1xwe h GLU 1571Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1xwe h GLU 1571Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1xwe h GLU 1571CO 0.66 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.67 1xwe n ALA 1572N -2.05 0.00 -0.81 3.43 0.00 -1.26 -4.90 120.51 114.91 1xwe n ALA 1572Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.36 1xwe n ALA 1572Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 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 0.00 2.56 -1.81 0.00 3.14 -1.26 -4.93 118.33 116.02 1xwe n VAL 1573Ca 0.00 -1.30 -0.42 0.00 -2.96 0.00 0.00 64.34 59.66 1xwe n VAL 1573Cb 0.00 -1.54 -0.03 0.00 -1.06 0.00 0.00 33.84 31.21 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 -0.59 3.88 -0.04 1.55 0.00 -1.26 -4.99 121.76 120.31 1xwe s ALA 1574Ca 0.27 1.51 -0.08 0.00 0.00 0.00 0.00 51.96 53.66 1xwe s ALA 1574Cb 0.17 -3.67 0.01 0.00 0.00 0.00 0.00 23.12 19.64 1xwe s ALA 1574CO -0.03 -0.87 0.19 -2.00 0.00 0.00 0.00 175.76 173.06 1xwe s GLU 1575N 1.16 0.41 0.12 0.00 2.12 -1.26 -4.62 118.70 116.63 1xwe s GLU 1575Ca 0.73 -0.07 -0.32 0.00 0.36 0.00 0.00 54.97 55.67 1xwe s GLU 1575Cb -0.47 0.18 -0.12 0.00 0.26 0.00 0.00 34.13 33.98 1xwe s GLU 1575CO 0.32 -0.09 1.78 1.17 -0.54 0.00 0.00 175.26 177.90 1xwe n LYS 1576N 2.09 2.61 -3.19 4.30 4.81 -1.26 -1.58 118.16 125.94 1xwe n LYS 1576Ca -0.18 0.95 -0.18 0.00 -0.87 0.00 0.00 58.31 58.02 1xwe n LYS 1576Cb 0.57 -2.81 0.05 0.00 0.02 0.00 0.00 35.03 32.86 1xwe n LYS 1576CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1xwe n ASP 1577N 5.14 -5.33 -4.10 3.14 2.03 -1.10 -5.01 116.55 111.33 1xwe n ASP 1577Ca 0.18 -0.36 -0.23 0.00 0.52 0.00 0.00 54.79 54.90 1xwe n ASP 1577Cb 0.35 -4.00 0.14 0.00 -0.72 0.00 0.00 41.12 36.88 1xwe n ASP 1577CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1xwe n SER 1578N -1.86 0.81 -4.43 1.67 2.88 -0.61 -4.73 113.62 107.34 1xwe n SER 1578Ca -0.02 -1.81 -0.36 0.00 -1.33 0.00 0.00 58.87 55.35 1xwe n SER 1578Cb 0.56 -0.71 -0.13 0.00 -0.75 0.00 0.00 64.21 63.18 1xwe n SER 1578CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1xwe s GLU 1579N -5.16 3.61 0.04 -1.46 2.12 -1.26 -2.09 118.70 114.50 1xwe s GLU 1579Ca 0.63 -0.51 0.02 0.00 0.36 0.00 0.00 54.97 55.47 1xwe s GLU 1579Cb -0.03 -3.21 -0.02 0.00 0.26 0.00 0.00 34.13 31.13 1xwe s GLU 1579CO 0.43 -0.12 -0.07 0.96 -0.54 0.00 0.00 175.26 175.91 1xwe s ILE 1580N 1.40 0.48 -0.20 -3.70 -4.36 -1.18 -5.02 121.20 108.62 1xwe s ILE 1580Ca 0.05 -1.05 -0.00 0.00 -0.26 0.00 0.00 60.65 59.39 1xwe s ILE 1580Cb -0.15 -0.56 0.05 0.00 1.25 0.00 0.00 42.46 43.06 1xwe s ILE 1580CO 0.02 -0.40 -0.05 -0.89 0.24 0.00 0.00 174.94 173.87 1xwe s THR 1581N -1.38 1.23 -0.61 8.37 2.01 -1.26 -2.28 115.64 121.71 1xwe s THR 1581Ca -0.11 -0.86 -0.27 0.00 0.31 0.00 0.00 61.69 60.76 1xwe s THR 1581Cb -0.10 -1.47 0.03 0.00 0.01 0.00 0.00 72.50 70.98 1xwe s THR 1581CO 0.00 0.01 1.17 -0.36 -0.69 0.00 0.00 174.62 174.75 1xwe s PHE 1582N 1.56 2.57 -0.19 4.92 0.08 0.12 -2.08 117.98 124.96 1xwe s PHE 1582Ca -0.02 0.22 -0.21 0.00 0.12 0.00 0.00 56.93 57.04 1xwe s PHE 1582Cb -0.17 -4.47 -0.02 0.00 -0.57 0.00 0.00 43.02 37.79 1xwe s PHE 1582CO -0.07 -1.66 0.66 -1.50 -0.10 0.00 0.00 175.22 172.55 1xwe s ILE 1583N 4.95 5.00 0.28 0.64 2.07 0.51 -1.33 121.20 133.32 1xwe s ILE 1583Ca 0.39 1.25 0.04 0.00 -1.41 0.00 0.00 60.65 60.91 1xwe s ILE 1583Cb -0.09 -3.97 -0.06 0.00 0.13 0.00 0.00 42.46 38.47 1xwe s ILE 1583CO 0.22 0.10 0.03 -0.75 -1.91 0.00 0.00 174.94 172.62 1xwe s LYS 1584N 1.96 1.52 -0.14 3.50 2.20 0.20 -0.67 119.74 128.31 1xwe s LYS 1584Ca 0.30 -1.81 -0.09 0.00 -0.36 0.00 0.00 55.97 54.01 1xwe s LYS 1584Cb -0.16 -0.76 -0.04 0.00 -1.51 0.00 0.00 37.83 35.36 1xwe s LYS 1584CO 0.11 -0.15 0.16 0.15 -0.36 0.00 0.00 175.35 175.26 1xwe s LYS 1585N -3.88 3.71 0.00 4.03 3.01 -1.26 -0.86 119.74 124.50 1xwe s LYS 1585Ca 0.33 -0.11 0.03 0.00 -1.01 0.00 0.00 55.97 55.22 1xwe s LYS 1585Cb 0.07 -3.27 0.20 0.00 -1.01 0.00 0.00 37.83 33.83 1xwe s LYS 1585CO 0.13 0.62 1.03 1.33 0.51 0.00 0.00 175.35 178.97 1xwe n VAL 1586N 2.47 0.00 1.15 3.17 0.24 -0.99 -2.95 118.33 121.42 1xwe n VAL 1586Ca -0.18 0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.24 1xwe n VAL 1586Cb 0.54 -0.11 0.25 0.00 -1.47 0.00 0.00 33.84 33.05 1xwe n VAL 1586CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1xwe n THR 1587N -0.56 0.00 -0.75 3.34 5.66 -1.26 -4.95 114.28 115.76 1xwe n THR 1587Ca 0.03 -0.15 -0.29 0.00 -3.05 0.00 0.00 64.05 60.58 1xwe n THR 1587Cb 0.01 0.63 0.25 0.00 -1.55 0.00 0.00 70.33 69.67 1xwe n THR 1587CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xwe n THR 1589N -4.99 0.00 0.00 0.00 -1.04 -1.24 -4.88 114.28 102.13 1xwe n THR 1589Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1xwe n THR 1589Cb 0.58 0.54 0.00 0.00 -1.82 0.00 0.00 70.33 69.63 1xwe n THR 1589CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1xwe n ASN 1590N 0.00 1.18 -4.69 8.00 5.15 -1.14 -4.99 115.26 118.78 1xwe n ASN 1590Ca 0.00 -0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.57 1xwe n ASN 1590Cb 0.52 0.25 -0.05 0.00 -0.53 0.00 0.00 39.78 39.96 1xwe n ASN 1590CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xwe s ALA 1591N -0.48 3.45 -0.01 5.20 0.00 -1.24 -4.60 121.76 124.08 1xwe s ALA 1591Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.93 1xwe s ALA 1591Cb 0.00 -3.02 0.01 0.00 0.00 0.00 0.00 23.12 20.11 1xwe s ALA 1591CO 0.00 -0.37 0.00 -1.21 0.00 0.00 0.00 175.76 174.18 1xwe s GLU 1592N 1.47 0.02 -0.02 0.00 2.02 -1.26 -5.01 118.70 115.92 1xwe s GLU 1592Ca 0.35 0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.38 1xwe s GLU 1592Cb -0.17 -0.09 0.01 0.00 0.10 0.00 0.00 34.13 33.98 1xwe s GLU 1592CO 0.14 -0.04 -0.04 -0.51 0.02 0.00 0.00 175.26 174.83 1xwe s LEU 1593N 0.26 1.69 -0.30 1.80 1.43 -1.26 -5.12 118.68 117.18 1xwe s LEU 1593Ca -0.02 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1xwe s LEU 1593Cb -0.03 -0.32 0.10 0.00 0.03 0.00 0.00 46.19 45.96 1xwe s LEU 1593CO -0.01 0.01 0.09 0.54 0.23 0.00 0.00 176.35 177.21 1xwe s VAL 1594N 0.34 0.82 -0.47 -1.59 0.11 -1.26 -5.08 120.40 113.26 1xwe s VAL 1594Ca -0.04 -1.31 -0.38 0.00 -2.93 0.00 0.00 61.98 57.32 1xwe s VAL 1594Cb -0.07 -1.59 -0.15 0.00 -1.53 0.00 0.00 36.38 33.03 1xwe s VAL 1594CO -0.00 -0.64 2.22 1.17 -3.33 0.00 0.00 175.10 174.52 1xwe n LYS 1595N 4.88 0.55 0.00 1.54 4.81 -1.26 -3.99 118.16 124.69 1xwe n LYS 1595Ca -0.03 0.14 0.00 0.00 -0.87 0.00 0.00 58.31 57.55 1xwe n LYS 1595Cb 0.42 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.44 1xwe n LYS 1595CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xwe n GLY 1596N 6.91 0.00 3.26 3.14 0.00 -1.26 -5.09 105.19 112.15 1xwe n GLY 1596Ca 0.49 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.43 1xwe n GLY 1596CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xwe n ARG 1597N 0.00 0.96 -4.14 1.61 0.00 -1.26 -5.05 116.66 108.79 1xwe n ARG 1597Ca 0.00 -1.89 -0.23 0.00 -0.00 0.00 0.00 57.85 55.73 1xwe n ARG 1597Cb 0.00 2.37 -0.05 0.00 -0.00 0.00 0.00 32.46 34.78 1xwe n ARG 1597CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1xwe s GLN 1598N -2.08 2.80 0.09 2.89 -0.21 -1.25 -3.63 119.66 118.28 1xwe s GLN 1598Ca 0.14 -1.07 -0.04 0.00 0.02 0.00 0.00 55.36 54.41 1xwe s GLN 1598Cb -0.04 -2.51 -0.02 0.00 1.00 0.00 0.00 33.01 31.43 1xwe s GLN 1598CO 0.10 0.42 0.08 0.71 -2.12 0.00 0.00 175.29 174.48 1xwe s TYR 1599N -2.05 0.45 -0.12 0.91 2.02 -0.98 -2.02 117.35 115.55 1xwe s TYR 1599Ca 0.32 -0.91 0.02 0.00 -0.37 0.00 0.00 57.07 56.12 1xwe s TYR 1599Cb -0.08 -0.27 -0.01 0.00 -0.40 0.00 0.00 41.96 41.21 1xwe s TYR 1599CO 0.23 -0.49 -0.18 -1.17 -1.57 0.00 0.00 175.55 172.37 1xwe s LEU 1600N -2.93 2.40 -0.09 -1.29 1.98 0.11 -1.63 118.68 117.24 1xwe s LEU 1600Ca 0.10 -0.46 0.04 0.00 -2.89 0.00 0.00 54.13 50.92 1xwe s LEU 1600Cb 0.06 -1.51 -0.01 0.00 0.66 0.00 0.00 46.19 45.39 1xwe s LEU 1600CO -0.07 0.15 -0.21 -0.63 -1.89 0.00 0.00 176.35 173.70 1xwe s ILE 1601N 0.44 2.39 -0.23 6.68 1.09 -0.56 -1.39 121.20 129.62 1xwe s ILE 1601Ca -0.13 -0.92 -0.03 0.00 -1.10 0.00 0.00 60.65 58.47 1xwe s ILE 1601Cb -0.17 -1.93 0.12 0.00 -1.06 0.00 0.00 42.46 39.43 1xwe s ILE 1601CO 0.06 0.56 0.35 -0.32 -0.10 0.00 0.00 174.94 175.48 1xwe s MET 1602N 0.08 0.31 0.01 2.79 1.75 -0.81 -1.74 119.30 121.70 1xwe s MET 1602Ca -0.09 0.50 -0.08 0.00 -1.25 0.00 0.00 55.69 54.76 1xwe s MET 1602Cb -0.15 -0.57 0.03 0.00 2.84 0.00 0.00 34.83 36.98 1xwe s MET 1602CO 0.06 -0.62 0.38 0.41 -0.65 0.00 0.00 175.02 174.60 1xwe n GLY 1603N 5.36 0.66 3.33 2.11 0.00 -0.92 -0.37 105.19 115.36 1xwe n GLY 1603Ca -0.04 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 1xwe n GLY 1603CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xwe n LYS 1604N -0.27 -0.42 -0.25 1.61 3.00 -1.11 -0.23 118.16 120.48 1xwe n LYS 1604Ca 0.01 -0.09 -0.31 0.00 -0.00 0.00 0.00 58.31 57.92 1xwe n LYS 1604Cb 0.18 -1.70 0.30 0.00 0.00 0.00 0.00 35.03 33.81 1xwe n LYS 1604CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1xwe n GLU 1605N -1.07 -4.71 -0.00 1.64 0.28 -1.26 -4.48 120.64 111.03 1xwe n GLU 1605Ca 0.05 -1.39 -0.00 0.00 -0.16 0.00 0.00 57.16 55.65 1xwe n GLU 1605Cb 0.55 -1.95 0.00 0.00 1.43 0.00 0.00 31.44 31.47 1xwe n GLU 1605CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1xwe n ALA 1606N -5.80 -0.00 -3.70 -1.84 0.00 -1.26 -4.97 120.51 102.94 1xwe n ALA 1606Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1xwe n ALA 1606Cb 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1xwe n ALA 1606CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xwe n LEU 1607N 0.00 0.00 -2.78 0.00 4.77 -1.20 -5.00 117.00 112.79 1xwe n LEU 1607Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1xwe n LEU 1607Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1xwe n LEU 1607CO 0.00 0.00 0.40 0.00 -1.33 0.00 0.00 177.39 176.46 1xwe s GLN 1608N -1.48 0.36 0.33 3.23 -2.07 -1.14 -3.88 119.66 115.00 1xwe s GLN 1608Ca 0.00 -0.25 0.23 0.00 -1.82 0.00 0.00 55.36 53.53 1xwe s GLN 1608Cb 0.00 0.01 1.19 0.00 -1.09 0.00 0.00 33.01 33.12 1xwe s GLN 1608CO 0.00 -0.47 1.71 0.97 -1.32 0.00 0.00 175.29 176.18 1xwe h ILE 1609N 3.45 0.00 -4.34 3.63 6.09 -1.91 -3.44 117.51 120.98 1xwe h ILE 1609Ca -0.00 -0.06 -0.40 0.00 -1.37 0.00 0.00 64.86 63.02 1xwe h ILE 1609Cb 1.19 0.63 -0.10 0.00 0.47 0.00 0.00 36.82 39.01 1xwe h ILE 1609CO -0.06 0.00 -0.37 0.29 -3.07 0.00 0.00 178.15 174.94 1xwe n LYS 1610N -2.31 0.43 0.00 2.19 5.02 -1.26 -4.90 118.16 117.33 1xwe n LYS 1610Ca -0.01 -2.67 0.00 0.00 -2.02 0.00 0.00 58.31 53.61 1xwe n LYS 1610Cb 0.08 1.93 0.00 0.00 -0.02 0.00 0.00 35.03 37.02 1xwe n LYS 1610CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1xwe n TYR 1611N -0.58 0.00 -4.00 2.13 4.11 -1.26 -4.48 117.16 113.08 1xwe n TYR 1611Ca 0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 57.90 57.71 1xwe n TYR 1611Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.78 1xwe n TYR 1611CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.86 176.06 1xwe s ASN 1612N -1.47 5.47 0.00 9.48 -0.87 -1.26 -4.62 114.94 121.67 1xwe s ASN 1612Ca 0.00 -0.33 0.00 0.00 -1.57 0.00 0.00 52.86 50.96 1xwe s ASN 1612Cb 0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 41.25 39.97 1xwe s ASN 1612CO 0.00 -0.15 0.00 0.00 -2.57 0.00 0.00 177.10 174.38 1xwe n ALA 1613N -1.26 0.00 -3.24 0.60 0.00 -1.26 -4.05 120.51 111.31 1xwe n ALA 1613Ca -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 1xwe n ALA 1613Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.01 1xwe n ALA 1613CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xwe s SER 1614N -2.51 -0.75 0.75 0.00 0.15 -1.26 -5.16 113.70 104.93 1xwe s SER 1614Ca 0.00 -0.58 -0.12 0.00 0.70 0.00 0.00 55.95 55.95 1xwe s SER 1614Cb 0.00 1.59 0.05 0.00 -1.71 0.00 0.00 66.02 65.95 1xwe s SER 1614CO 0.00 -0.25 1.10 0.72 1.20 0.00 0.00 173.24 176.01 1xwe s PHE 1615N 2.17 2.54 -0.47 3.44 -0.12 -1.26 -4.81 117.98 119.48 1xwe s PHE 1615Ca 0.13 1.57 -0.02 0.00 -0.05 0.00 0.00 56.93 58.55 1xwe s PHE 1615Cb -0.09 -3.10 0.12 0.00 -0.63 0.00 0.00 43.02 39.33 1xwe s PHE 1615CO -0.16 -1.83 0.27 0.50 -0.05 0.00 0.00 175.22 173.95 1xwe s ARG 1616N -4.67 2.14 -0.15 1.99 6.06 -1.26 -4.89 118.95 118.16 1xwe s ARG 1616Ca 0.63 -2.05 0.03 0.00 -2.50 0.00 0.00 55.73 51.84 1xwe s ARG 1616Cb -0.18 -3.61 0.27 0.00 0.06 0.00 0.00 34.95 31.49 1xwe s ARG 1616CO 0.52 -1.10 1.25 0.66 -2.50 0.00 0.00 175.30 174.13 1xwe n TYR 1617N 4.23 1.07 -1.13 5.12 4.02 -1.25 -2.88 117.16 126.33 1xwe n TYR 1617Ca 0.01 -0.81 -0.35 0.00 -0.01 0.00 0.00 57.90 56.74 1xwe n TYR 1617Cb 0.40 -0.45 0.10 0.00 -0.02 0.00 0.00 39.34 39.38 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 -0.03 1.63 -3.81 -0.72 -5.35 -1.26 -4.31 119.36 105.51 1xwe n ILE 1618Ca 0.19 -0.29 -0.37 0.00 -0.27 0.00 0.00 62.75 62.02 1xwe n ILE 1618Cb 0.86 -0.90 -0.13 0.00 -1.74 0.00 0.00 39.64 37.72 1xwe n ILE 1618CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1xwe s TYR 1619N -2.06 3.16 1.31 4.28 1.51 -0.88 -3.25 117.35 121.41 1xwe s TYR 1619Ca 0.67 -1.25 -0.20 0.00 -1.01 0.00 0.00 57.07 55.28 1xwe s TYR 1619Cb -0.30 -2.20 0.33 0.00 -0.11 0.00 0.00 41.96 39.67 1xwe s TYR 1619CO 0.57 -0.66 0.99 -1.25 -1.11 0.00 0.00 175.55 174.09 1xwe s PRO 1620N 1.42 -2.09 -0.23 -1.71 0.04 -1.26 -0.37 135.00 130.81 1xwe s PRO 1620Ca 0.01 0.24 -0.04 0.00 0.04 0.00 0.00 61.00 61.25 1xwe s PRO 1620Cb -0.18 -1.47 0.10 0.00 0.04 0.00 0.00 34.50 32.99 1xwe s PRO 1620CO 0.01 -4.35 0.19 -1.17 0.04 0.00 0.00 177.00 171.72 1xwe s LEU 1621N -7.49 0.06 0.00 -3.56 2.96 0.15 -4.52 118.68 106.28 1xwe s LEU 1621Ca 0.69 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1xwe s LEU 1621Cb -0.15 0.17 0.00 0.00 0.50 0.00 0.00 46.19 46.71 1xwe s LEU 1621CO 0.59 -0.36 0.00 -0.90 -1.32 0.00 0.00 176.35 174.36 1xwe n ASP 1622N 5.30 0.00 -0.15 3.68 5.75 -1.26 -4.43 116.55 125.44 1xwe n ASP 1622Ca -0.05 -0.36 -0.11 0.00 -0.01 0.00 0.00 54.79 54.26 1xwe n ASP 1622Cb 0.48 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.56 1xwe n ASP 1622CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1xwe h SER 1623N 0.00 0.90 -0.54 -1.12 0.87 -1.86 -2.92 113.55 108.88 1xwe h SER 1623Ca 0.00 -0.38 0.09 0.00 -1.23 0.00 0.00 61.79 60.27 1xwe h SER 1623Cb 0.00 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.68 1xwe h SER 1623CO 0.00 1.08 0.36 0.17 -0.53 0.00 0.00 176.83 177.91 1xwe h LEU 1624N 0.71 0.32 -8.53 2.23 8.10 -1.97 -3.38 115.31 112.79 1xwe h LEU 1624Ca 0.10 0.01 -0.54 0.00 0.11 0.00 0.00 57.88 57.56 1xwe h LEU 1624Cb 0.71 -0.06 -0.06 0.00 -0.44 0.00 0.00 40.66 40.81 1xwe h LEU 1624CO 0.05 0.20 1.14 -0.89 -4.11 0.00 0.00 178.44 174.83 1xwe s THR 1625N -5.35 3.69 0.04 0.15 2.01 -1.10 -4.73 115.64 110.35 1xwe s THR 1625Ca -0.07 0.54 -0.30 0.00 0.31 0.00 0.00 61.69 62.16 1xwe s THR 1625Cb 0.19 -4.43 -0.09 0.00 0.01 0.00 0.00 72.50 68.18 1xwe s THR 1625CO 0.74 -1.24 1.98 1.87 -0.69 0.00 0.00 174.62 177.28 1xwe n TRP 1626N 10.09 2.52 -3.97 4.92 -0.00 0.50 -4.75 117.44 126.74 1xwe n TRP 1626Ca 0.12 -0.38 -0.34 0.00 -0.00 0.00 0.00 57.50 56.90 1xwe n TRP 1626Cb 0.50 -2.81 -0.14 0.00 -0.00 0.00 0.00 31.31 28.85 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 4.48 2.85 -0.25 5.87 -1.09 -1.26 -1.92 121.20 129.88 1xwe s ILE 1627Ca 0.89 -1.02 0.02 0.00 -2.23 0.00 0.00 60.65 58.32 1xwe s ILE 1627Cb -0.44 -2.44 0.06 0.00 -1.58 0.00 0.00 42.46 38.07 1xwe s ILE 1627CO 0.42 0.21 -0.10 -0.70 -1.23 0.00 0.00 174.94 173.55 1xwe s GLU 1628N 1.32 2.10 0.11 2.79 2.56 -0.48 -2.88 118.70 124.22 1xwe s GLU 1628Ca 0.00 -1.22 -0.31 0.00 0.00 0.00 0.00 54.97 53.44 1xwe s GLU 1628Cb -0.16 -2.79 -0.10 0.00 2.00 0.00 0.00 34.13 33.08 1xwe s GLU 1628CO -0.05 -0.56 1.85 -0.47 -0.56 0.00 0.00 175.26 175.47 1xwe s TYR 1629N 1.19 2.01 -0.42 5.30 6.14 -1.26 0.08 117.35 130.39 1xwe s TYR 1629Ca -0.07 -0.09 -0.14 0.00 0.64 0.00 0.00 57.07 57.40 1xwe s TYR 1629Cb -0.19 -4.19 0.03 0.00 0.42 0.00 0.00 41.96 38.03 1xwe s TYR 1629CO -0.06 -4.98 0.30 -0.46 0.64 0.00 0.00 175.55 170.99 1xwe s TRP 1630N 3.01 3.25 0.12 4.97 -0.11 -0.86 -4.87 118.94 124.45 1xwe s TRP 1630Ca 0.82 -0.76 -0.33 0.00 1.22 0.00 0.00 56.10 57.05 1xwe s TRP 1630Cb -0.46 -2.70 -0.13 0.00 -1.50 0.00 0.00 33.47 28.69 1xwe s TRP 1630CO 0.37 -0.65 1.67 -2.30 -4.62 0.00 0.00 176.95 171.42 1xwe n PRO 1631N 5.13 2.29 0.01 5.86 -0.02 -1.26 -3.75 135.00 143.27 1xwe n PRO 1631Ca -0.11 0.83 0.04 0.00 -2.02 0.00 0.00 63.50 62.24 1xwe n PRO 1631Cb 0.46 -2.64 -0.10 0.00 -0.02 0.00 0.00 33.50 31.20 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 4.27 0.64 -3.02 -0.52 0.63 -1.26 -4.89 116.66 112.51 1xwe n ARG 1632Ca 0.18 0.03 -0.40 0.00 -0.92 0.00 0.00 57.85 56.74 1xwe n ARG 1632Cb 0.30 -1.68 -0.05 0.00 0.45 0.00 0.00 32.46 31.49 1xwe n ARG 1632CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 1xwe s ASP 1633N -5.25 7.00 0.00 6.15 1.47 -1.26 -4.90 116.67 119.89 1xwe s ASP 1633Ca -0.05 1.21 0.00 0.00 1.18 0.00 0.00 52.55 54.89 1xwe s ASP 1633Cb 0.10 -2.42 0.00 0.00 -0.34 0.00 0.00 42.92 40.26 1xwe s ASP 1633CO 0.84 -0.14 0.57 0.35 0.68 0.00 0.00 175.17 177.47 1xwe n THR 1634N 3.84 0.00 -0.01 2.11 -2.24 -1.26 -3.75 114.28 112.97 1xwe n THR 1634Ca -0.01 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.57 1xwe n THR 1634Cb 0.51 0.76 -0.13 0.00 -2.10 0.00 0.00 70.33 69.37 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 3.99 1.11 -4.15 4.28 1.35 -1.95 -3.43 112.91 114.11 1xwe h THR 1635Ca 0.00 -2.37 -0.54 0.00 -0.55 0.00 0.00 66.41 62.95 1xwe h THR 1635Cb 1.09 2.73 0.16 0.00 -1.73 0.00 0.00 68.15 70.41 1xwe h THR 1635CO 0.00 0.64 0.43 0.00 -0.25 0.00 0.00 175.52 176.34 1xwe h SER 1637N -0.06 -0.13 -0.03 0.00 0.87 -2.01 -3.16 113.55 109.03 1xwe h SER 1637Ca -0.49 -0.42 0.01 0.00 -1.23 0.00 0.00 61.79 59.66 1xwe h SER 1637Cb 1.31 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1xwe h SER 1637CO 0.50 0.40 0.03 0.28 -0.53 0.00 0.00 176.83 177.51 1xwe h SER 1638N -0.71 0.00 -0.02 6.23 0.02 -2.00 -3.42 113.55 113.64 1xwe h SER 1638Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1xwe h SER 1638Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1xwe h SER 1638CO 0.02 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 1xwe n GLN 1640N 0.00 -2.83 -0.04 0.00 10.64 -1.25 -4.73 117.38 119.19 1xwe n GLN 1640Ca 0.00 0.13 0.04 0.00 -1.83 0.00 0.00 57.00 55.34 1xwe n GLN 1640Cb 0.00 -4.66 -0.15 0.00 -0.86 0.00 0.00 30.24 24.57 1xwe n GLN 1640CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1xwe n ALA 1641N -2.44 2.35 0.07 2.61 0.00 -1.26 -4.35 120.51 117.49 1xwe n ALA 1641Ca -0.03 -0.73 0.11 0.00 0.00 0.00 0.00 53.44 52.78 1xwe n ALA 1641Cb 0.52 -0.52 -0.05 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.37 0.71 0.57 0.00 7.35 -1.26 -3.91 117.46 118.54 1xwe n PHE 1642Ca -0.13 0.21 0.11 0.00 -0.76 0.00 0.00 57.45 56.88 1xwe n PHE 1642Cb 0.72 -0.84 0.44 0.00 0.35 0.00 0.00 39.48 40.15 1xwe n PHE 1642CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1xwe n LEU 1643N -2.57 0.40 0.15 -2.13 7.99 -1.26 -2.50 117.00 117.07 1xwe n LEU 1643Ca -0.02 0.57 0.06 0.00 -0.01 0.00 0.00 56.01 56.62 1xwe n LEU 1643Cb 0.57 -0.49 0.05 0.00 -0.11 0.00 0.00 43.42 43.44 1xwe n LEU 1643CO 0.42 -0.31 0.44 0.00 -1.51 0.00 0.00 177.39 176.42 1xwe h ALA 1644N 2.50 0.75 0.00 -1.18 0.00 -1.78 -3.06 119.26 116.49 1xwe h ALA 1644Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1xwe h ALA 1644Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xwe h ALA 1644CO 0.00 0.41 -0.65 0.09 0.00 0.00 0.00 179.25 179.10 1xwe n ASN 1645N -3.09 0.61 0.01 0.00 4.13 -1.04 -3.93 115.26 111.95 1xwe n ASN 1645Ca 0.01 -0.35 0.02 0.00 1.68 0.00 0.00 54.58 55.94 1xwe n ASN 1645Cb 0.67 0.43 -0.10 0.00 -1.54 0.00 0.00 39.78 39.24 1xwe n ASN 1645CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1xwe n LEU 1646N -1.58 0.56 0.20 3.41 4.77 -1.19 -4.05 117.00 119.12 1xwe n LEU 1646Ca 0.05 0.24 0.08 0.00 -0.03 0.00 0.00 56.01 56.34 1xwe n LEU 1646Cb 0.35 0.10 0.38 0.00 -2.33 0.00 0.00 43.42 41.93 1xwe n LEU 1646CO 0.37 0.12 0.73 -0.78 -1.33 0.00 0.00 177.39 176.50 1xwe h ASP 1647N 0.00 0.00 0.39 -1.43 3.58 -1.65 -0.66 116.42 116.64 1xwe h ASP 1647Ca -0.17 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.06 1xwe h ASP 1647Cb 1.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.54 1xwe h ASP 1647CO 0.03 0.30 -0.95 -0.08 -2.88 0.00 0.00 179.24 175.66 1xwe h GLU 1648N 0.00 0.37 0.00 0.28 4.81 -1.72 -3.17 114.58 115.15 1xwe h GLU 1648Ca -0.00 -0.41 -0.07 0.00 -0.13 0.00 0.00 59.36 58.74 1xwe h GLU 1648Cb 0.84 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 1xwe h GLU 1648CO 0.04 1.09 -0.80 0.35 -0.73 0.00 0.00 179.01 178.96 1xwe h PHE 1649N 0.20 0.00 -0.60 0.92 3.57 -1.67 -2.66 116.94 116.70 1xwe h PHE 1649Ca -0.08 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.32 1xwe h PHE 1649Cb 1.59 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.31 1xwe h PHE 1649CO 0.06 0.28 -0.01 0.00 -2.23 0.00 0.00 178.31 176.40 1xwe h ALA 1650N 1.72 0.85 0.04 2.41 0.00 -1.14 -3.10 119.26 120.04 1xwe h ALA 1650Ca -0.05 -0.32 -0.31 0.00 0.00 0.00 0.00 54.91 54.24 1xwe h ALA 1650Cb 1.25 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1xwe h ALA 1650CO 0.03 0.67 -1.72 1.05 0.00 0.00 0.00 179.25 179.28 1xwe h GLU 1651N 0.96 0.09 0.00 0.00 4.11 -1.66 -3.29 114.58 114.79 1xwe h GLU 1651Ca 0.17 -0.16 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1xwe h GLU 1651Cb 0.57 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1xwe h GLU 1651CO 0.03 0.76 0.00 -3.47 0.07 0.00 0.00 179.01 176.40 1xwe n ASP 1652N -3.21 0.00 0.02 3.06 2.03 -1.00 0.73 116.55 118.18 1xwe n ASP 1652Ca -0.19 0.83 0.12 0.00 0.52 0.00 0.00 54.79 56.06 1xwe n ASP 1652Cb 1.04 -0.33 0.56 0.00 -0.72 0.00 0.00 41.12 41.68 1xwe n ASP 1652CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1xwe h ILE 1653N 0.00 0.91 -0.04 5.18 6.09 -1.77 0.26 117.51 128.15 1xwe h ILE 1653Ca 0.00 -0.09 -0.10 0.00 -1.37 0.00 0.00 64.86 63.31 1xwe h ILE 1653Cb 0.00 0.64 -0.01 0.00 0.47 0.00 0.00 36.82 37.92 1xwe h ILE 1653CO 0.00 0.05 -0.43 0.15 -3.07 0.00 0.00 178.15 174.85 1xwe h PHE 1654N 0.25 0.10 0.00 2.19 3.04 -1.54 -3.28 116.94 117.70 1xwe h PHE 1654Ca 0.19 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.11 1xwe h PHE 1654Cb 0.43 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.92 1xwe h PHE 1654CO -0.00 0.50 0.00 1.28 -2.02 0.00 0.00 178.31 178.07 1xwe n LEU 1655N -4.02 0.00 0.02 0.59 4.77 0.22 -4.90 117.00 113.68 1xwe n LEU 1655Ca -0.02 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.93 1xwe n LEU 1655Cb 0.47 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 1xwe n LEU 1655CO 0.40 -0.25 0.08 -0.55 -1.33 0.00 0.00 177.39 175.74 1xwe h ASN 1656N 0.00 -0.13 -4.10 -1.43 7.08 -0.74 -3.51 115.58 112.76 1xwe h ASN 1656Ca 0.00 -0.03 0.00 0.00 -3.08 0.00 0.00 56.30 53.19 1xwe h ASN 1656Cb 0.00 0.03 -0.04 0.00 -2.08 0.00 0.00 38.32 36.24 1xwe h ASN 1656CO 0.00 0.37 -0.76 0.61 -2.08 0.00 0.00 177.43 175.56 1xwe n GLY 1657N 1.37 -4.51 3.18 9.14 0.00 -0.16 -4.93 105.19 109.30 1xwe n GLY 1657Ca -0.02 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1xwe n GLY 1657CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32