#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ynt n VAL 1502N 0.00 0.03 -3.78 -0.39 0.31 -1.26 -4.52 118.33 108.72 1ynt n VAL 1502Ca 0.00 -0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.19 1ynt n VAL 1502Cb 0.00 -0.56 -0.14 0.00 -0.91 0.00 0.00 33.84 32.23 1ynt n VAL 1502CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1ynt s GLN 1503N 2.97 0.11 -0.10 5.55 0.74 -0.57 -5.00 119.66 123.37 1ynt s GLN 1503Ca 1.04 0.29 0.04 0.00 0.05 0.00 0.00 55.36 56.77 1ynt s GLN 1503Cb -1.45 -0.08 -0.01 0.00 1.10 0.00 0.00 33.01 32.58 1ynt s GLN 1503CO 0.80 -0.10 -0.22 -0.51 -0.55 0.00 0.00 175.29 174.70 1ynt s LEU 1504N 0.71 2.20 -0.01 3.68 1.43 -1.26 -1.80 118.68 123.63 1ynt s LEU 1504Ca -0.05 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 52.62 1ynt s LEU 1504Cb -0.07 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 1ynt s LEU 1504CO -0.03 0.18 -0.24 -1.10 0.23 0.00 0.00 176.35 175.39 1ynt s GLN 1505N 0.22 1.89 0.24 1.70 -1.52 -1.02 -4.29 119.66 116.88 1ynt s GLN 1505Ca -0.14 -0.88 0.11 0.00 -1.95 0.00 0.00 55.36 52.50 1ynt s GLN 1505Cb -0.17 -1.86 -0.05 0.00 -0.22 0.00 0.00 33.01 30.72 1ynt s GLN 1505CO 0.07 0.51 -0.14 -0.65 -0.25 0.00 0.00 175.29 174.83 1ynt s GLN 1506N -0.65 1.87 1.05 2.91 -0.21 -1.26 -0.04 119.66 123.32 1ynt s GLN 1506Ca 0.09 -1.53 -0.12 0.00 0.02 0.00 0.00 55.36 53.82 1ynt s GLN 1506Cb -0.09 -1.96 0.22 0.00 1.00 0.00 0.00 33.01 32.18 1ynt s GLN 1506CO -0.01 0.37 1.08 -1.54 -2.12 0.00 0.00 175.29 173.08 1ynt s SER 1507N -3.23 1.91 1.27 5.90 1.04 -1.25 -4.94 113.70 114.39 1ynt s SER 1507Ca 0.27 1.76 -0.19 0.00 0.48 0.00 0.00 55.95 58.28 1ynt s SER 1507Cb -0.07 -2.39 0.28 0.00 0.10 0.00 0.00 66.02 63.94 1ynt s SER 1507CO 0.15 -3.66 0.89 0.61 0.98 0.00 0.00 173.24 172.21 1ynt n GLY 1508N 0.40 -3.04 3.73 7.32 0.00 -1.26 -4.71 105.19 107.63 1ynt n GLY 1508Ca 0.07 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 1ynt n GLY 1508CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynt s ALA 1509N -2.78 2.07 -0.01 4.61 0.00 -1.26 -4.69 121.76 119.69 1ynt s ALA 1509Ca 0.60 0.69 0.04 0.00 0.00 0.00 0.00 51.96 53.30 1ynt s ALA 1509Cb -0.07 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 1ynt s ALA 1509CO 0.47 -1.93 -0.14 -1.21 0.00 0.00 0.00 175.76 172.96 1ynt s GLU 1510N -4.20 1.12 -0.20 0.00 0.41 -0.12 -4.98 118.70 110.73 1ynt s GLU 1510Ca 0.70 -0.49 -0.02 0.00 -0.41 0.00 0.00 54.97 54.75 1ynt s GLU 1510Cb -0.25 -1.08 0.06 0.00 -1.78 0.00 0.00 34.13 31.07 1ynt s GLU 1510CO 0.48 0.29 0.00 -1.17 -0.49 0.00 0.00 175.26 174.38 1ynt s LEU 1511N -0.31 1.54 0.11 1.80 2.96 -1.26 -1.72 118.68 121.80 1ynt s LEU 1511Ca 0.05 -0.86 0.03 0.00 -0.22 0.00 0.00 54.13 53.14 1ynt s LEU 1511Cb -0.05 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.83 1ynt s LEU 1511CO -0.00 -0.27 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.97 1ynt s VAL 1512N 1.72 0.92 0.54 1.68 1.01 -0.65 -5.02 120.40 120.61 1ynt s VAL 1512Ca -0.02 -1.78 -0.15 0.00 0.00 0.00 0.00 61.98 60.03 1ynt s VAL 1512Cb -0.17 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.62 1ynt s VAL 1512CO -0.07 -0.67 1.00 -0.13 0.00 0.00 0.00 175.10 175.23 1ynt s ARG 1513N -3.21 3.85 1.10 2.72 0.52 -1.26 -0.60 118.95 122.07 1ynt s ARG 1513Ca 0.09 0.92 -0.13 0.00 -0.52 0.00 0.00 55.73 56.09 1ynt s ARG 1513Cb 0.00 -2.12 0.21 0.00 0.52 0.00 0.00 34.95 33.56 1ynt s ARG 1513CO -0.01 -0.36 0.83 -2.30 0.02 0.00 0.00 175.30 173.49 1ynt n PRO 1514N -1.84 -1.74 0.00 3.54 -0.02 -1.26 -3.14 135.00 130.53 1ynt n PRO 1514Ca 0.07 -0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 1ynt n PRO 1514Cb 0.54 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1ynt n PRO 1514CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynt n GLY 1515N 1.06 0.92 3.56 -1.23 0.00 0.20 -4.88 105.19 104.81 1ynt n GLY 1515Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1ynt n GLY 1515CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynt s VAL 1516N 0.00 2.02 0.27 1.61 1.01 -1.19 -3.34 120.40 120.78 1ynt s VAL 1516Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.07 1ynt s VAL 1516Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1ynt s VAL 1516CO 0.00 -0.01 0.05 -0.55 0.00 0.00 0.00 175.10 174.60 1ynt s SER 1517N -2.90 4.79 -0.04 3.32 0.15 -1.26 -1.68 113.70 116.09 1ynt s SER 1517Ca 0.67 -0.56 -0.15 0.00 0.70 0.00 0.00 55.95 56.62 1ynt s SER 1517Cb -0.22 -0.98 0.03 0.00 -1.71 0.00 0.00 66.02 63.14 1ynt s SER 1517CO 0.62 -0.03 0.34 0.54 1.20 0.00 0.00 173.24 175.91 1ynt s VAL 1518N -2.28 0.04 -0.06 4.45 0.11 0.76 -4.97 120.40 118.45 1ynt s VAL 1518Ca 0.32 -0.36 0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1ynt s VAL 1518Cb -0.07 -0.61 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 1ynt s VAL 1518CO 0.21 -0.20 -0.17 -0.75 -3.33 0.00 0.00 175.10 170.87 1ynt s LYS 1519N -1.02 1.94 0.01 1.54 2.20 -1.26 0.12 119.74 123.27 1ynt s LYS 1519Ca -0.11 -0.59 0.08 0.00 -0.36 0.00 0.00 55.97 54.99 1ynt s LYS 1519Cb -0.04 -1.62 -0.02 0.00 -1.51 0.00 0.00 37.83 34.64 1ynt s LYS 1519CO 0.04 0.18 -0.24 0.96 -0.36 0.00 0.00 175.35 175.92 1ynt s ILE 1520N 0.25 1.95 0.00 5.43 -4.36 0.91 -4.95 121.20 120.44 1ynt s ILE 1520Ca -0.09 -1.17 0.00 0.00 -0.26 0.00 0.00 60.65 59.13 1ynt s ILE 1520Cb -0.14 -1.65 0.00 0.00 1.25 0.00 0.00 42.46 41.93 1ynt s ILE 1520CO 0.04 0.44 0.00 -1.54 0.24 0.00 0.00 174.94 174.11 1ynt n SER 1521N 2.16 0.00 0.00 4.36 3.41 -1.26 -1.29 113.62 121.01 1ynt n SER 1521Ca -0.16 -0.80 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 1ynt n SER 1521Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1ynt n SER 1521CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ynt s LYS 1523N 0.00 3.44 0.59 0.00 1.02 0.94 0.37 119.74 126.10 1ynt s LYS 1523Ca 0.00 -0.68 -0.14 0.00 0.02 0.00 0.00 55.97 55.17 1ynt s LYS 1523Cb 0.00 -3.83 -0.04 0.00 -0.52 0.00 0.00 37.83 33.44 1ynt s LYS 1523CO 0.00 -0.48 1.03 0.20 -0.92 0.00 0.00 175.35 175.18 1ynt s GLY 1524N 1.72 1.95 -0.02 -3.33 0.00 -0.34 -2.42 107.32 104.88 1ynt s GLY 1524Ca 0.06 0.20 -0.29 0.00 0.00 0.00 0.00 44.72 44.69 1ynt s GLY 1524CO 0.11 0.49 0.77 -0.56 0.00 0.00 0.00 173.10 173.91 1ynt s SER 1525N -3.27 -0.52 0.00 1.64 0.01 -0.75 -4.86 113.70 105.95 1ynt s SER 1525Ca 0.60 0.36 0.00 0.00 1.31 0.00 0.00 55.95 58.22 1ynt s SER 1525Cb -0.13 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1ynt s SER 1525CO 0.41 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1ynt n GLY 1526N 0.39 0.64 3.82 3.44 0.00 -1.26 -1.51 105.19 110.71 1ynt n GLY 1526Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 1ynt n GLY 1526CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ynt s TYR 1527N -2.25 -0.02 -1.13 1.61 1.13 -1.26 -4.18 117.35 111.24 1ynt s TYR 1527Ca 0.00 -0.43 -0.23 0.00 -1.41 0.00 0.00 57.07 55.01 1ynt s TYR 1527Cb 0.00 0.72 -0.05 0.00 -1.10 0.00 0.00 41.96 41.53 1ynt s TYR 1527CO 0.00 -1.11 1.89 0.99 -2.51 0.00 0.00 175.55 174.81 1ynt s THR 1528N -2.84 3.61 0.30 -3.49 2.01 -1.26 -4.82 115.64 109.15 1ynt s THR 1528Ca 0.15 -0.91 0.17 0.00 0.31 0.00 0.00 61.69 61.42 1ynt s THR 1528Cb -0.03 -4.54 0.29 0.00 0.01 0.00 0.00 72.50 68.22 1ynt s THR 1528CO 0.06 -1.16 1.26 0.33 -0.69 0.00 0.00 174.62 174.42 1ynt n PHE 1529N 13.27 0.91 0.14 4.92 7.35 -1.26 0.11 117.46 142.90 1ynt n PHE 1529Ca 0.44 0.92 0.04 0.00 -0.76 0.00 0.00 57.45 58.09 1ynt n PHE 1529Cb 0.47 -1.34 0.03 0.00 0.35 0.00 0.00 39.48 39.00 1ynt n PHE 1529CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1ynt h THR 1530N 0.00 0.61 0.00 -2.13 2.02 -1.90 -3.25 112.91 108.26 1ynt h THR 1530Ca 0.68 -1.90 -0.01 0.00 0.77 0.00 0.00 66.41 65.95 1ynt h THR 1530Cb 1.82 2.24 -0.00 0.00 -1.74 0.00 0.00 68.15 70.47 1ynt h THR 1530CO -0.60 0.35 -0.04 0.44 0.37 0.00 0.00 175.52 176.04 1ynt h ASP 1531N 0.00 0.00 -2.77 4.18 3.45 0.39 -3.38 116.42 118.29 1ynt h ASP 1531Ca -0.02 0.00 -0.62 0.00 0.43 0.00 0.00 57.03 56.81 1ynt h ASP 1531Cb 1.32 0.00 -0.15 0.00 -0.56 0.00 0.00 39.33 39.94 1ynt h ASP 1531CO 0.05 0.04 -0.76 -0.31 -1.57 0.00 0.00 179.24 176.69 1ynt s TYR 1532N -4.42 2.43 0.71 4.55 1.51 -1.22 -4.98 117.35 115.93 1ynt s TYR 1532Ca -0.04 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 1ynt s TYR 1532Cb 0.14 -1.14 0.13 0.00 -0.11 0.00 0.00 41.96 40.98 1ynt s TYR 1532CO 0.54 0.58 0.98 0.20 -1.11 0.00 0.00 175.55 176.74 1ynt s GLY 1533N -3.05 1.76 -0.05 0.71 0.00 -1.23 -4.02 107.32 101.43 1ynt s GLY 1533Ca 0.25 -1.78 0.01 0.00 0.00 0.00 0.00 44.72 43.20 1ynt s GLY 1533CO 0.14 -1.21 -0.04 -0.29 0.00 0.00 0.00 173.10 171.70 1ynt s MET 1534N -5.11 0.81 -0.06 2.90 1.75 -0.67 -2.74 119.30 116.19 1ynt s MET 1534Ca 0.66 -0.08 -0.04 0.00 -1.25 0.00 0.00 55.69 54.99 1ynt s MET 1534Cb -0.05 -0.87 -0.04 0.00 2.84 0.00 0.00 34.83 36.71 1ynt s MET 1534CO 0.44 -0.12 0.12 -1.01 -0.65 0.00 0.00 175.02 173.80 1ynt s HIS 1535N 1.08 3.45 -0.16 4.11 3.76 0.11 -0.57 115.29 127.08 1ynt s HIS 1535Ca -0.08 0.36 0.01 0.00 -0.15 0.00 0.00 55.06 55.20 1ynt s HIS 1535Cb -0.14 -1.84 0.02 0.00 1.11 0.00 0.00 32.58 31.72 1ynt s HIS 1535CO -0.01 0.63 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.74 1ynt s TRP 1536N -1.12 2.60 0.07 1.40 0.52 -1.03 -0.33 118.94 121.05 1ynt s TRP 1536Ca 0.20 -1.44 0.10 0.00 0.02 0.00 0.00 56.10 54.97 1ynt s TRP 1536Cb -0.12 -1.81 -0.03 0.00 -1.15 0.00 0.00 33.47 30.36 1ynt s TRP 1536CO 0.10 -0.70 -0.26 0.08 0.02 0.00 0.00 176.95 176.19 1ynt s VAL 1537N 1.13 2.12 -0.12 4.03 1.01 0.15 0.32 120.40 129.05 1ynt s VAL 1537Ca 0.00 -1.49 -0.00 0.00 0.00 0.00 0.00 61.98 60.49 1ynt s VAL 1537Cb -0.14 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 1ynt s VAL 1537CO -0.08 0.25 -0.10 -0.75 0.00 0.00 0.00 175.10 174.42 1ynt s LYS 1538N -1.51 3.29 -0.14 2.72 2.20 0.07 0.01 119.74 126.37 1ynt s LYS 1538Ca 0.12 -0.63 0.01 0.00 -0.36 0.00 0.00 55.97 55.10 1ynt s LYS 1538Cb -0.10 -2.66 0.02 0.00 -1.51 0.00 0.00 37.83 33.58 1ynt s LYS 1538CO 0.03 0.31 -0.16 -1.14 -0.36 0.00 0.00 175.35 174.03 1ynt s GLN 1539N 0.11 2.47 -0.00 4.03 0.74 0.70 -0.87 119.66 126.84 1ynt s GLN 1539Ca -0.05 -0.64 -0.00 0.00 0.05 0.00 0.00 55.36 54.73 1ynt s GLN 1539Cb -0.14 -2.17 0.00 0.00 1.10 0.00 0.00 33.01 31.80 1ynt s GLN 1539CO 0.04 -0.17 0.01 -1.54 -0.55 0.00 0.00 175.29 173.08 1ynt s SER 1540N 1.27 0.00 -1.01 6.67 1.04 -1.22 -0.20 113.70 120.26 1ynt s SER 1540Ca 0.01 0.01 -0.03 0.00 0.48 0.00 0.00 55.95 56.42 1ynt s SER 1540Cb -0.14 0.00 0.22 0.00 0.10 0.00 0.00 66.02 66.21 1ynt s SER 1540CO -0.08 -0.01 2.20 1.41 0.98 0.00 0.00 173.24 177.73 1ynt n HIS 1541N 3.18 2.56 -0.93 5.02 8.25 -1.26 0.21 115.22 132.25 1ynt n HIS 1541Ca -0.13 -2.51 0.00 0.00 -0.26 0.00 0.00 57.72 54.82 1ynt n HIS 1541Cb 0.59 -1.44 0.00 0.00 1.12 0.00 0.00 29.99 30.26 1ynt n HIS 1541CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ynt n ALA 1542N 0.60 0.00 -0.81 -1.41 0.00 -1.26 -4.82 120.51 112.81 1ynt n ALA 1542Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1ynt n ALA 1542Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1ynt n ALA 1542CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ynt n LYS 1543N 0.00 0.00 0.00 0.00 5.02 -1.11 -5.16 118.16 116.90 1ynt n LYS 1543Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ynt n LYS 1543Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 1ynt n LYS 1543CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ynt n SER 1544N 0.00 0.00 -4.74 4.39 2.88 0.56 -4.77 113.62 111.94 1ynt n SER 1544Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1ynt n SER 1544Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1ynt n SER 1544CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1ynt s LEU 1545N 0.00 4.37 -0.05 2.46 1.43 -1.25 -3.37 118.68 122.26 1ynt s LEU 1545Ca 0.00 2.76 -0.02 0.00 -1.03 0.00 0.00 54.13 55.84 1ynt s LEU 1545Cb 0.00 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.64 1ynt s LEU 1545CO 0.00 -0.80 0.11 -1.61 0.23 0.00 0.00 176.35 174.28 1ynt s GLU 1546N -0.10 0.05 0.05 1.70 2.02 -0.05 -4.96 118.70 117.42 1ynt s GLU 1546Ca 0.63 0.33 -0.31 0.00 0.02 0.00 0.00 54.97 55.64 1ynt s GLU 1546Cb -0.44 -0.21 -0.05 0.00 0.10 0.00 0.00 34.13 33.52 1ynt s GLU 1546CO 0.42 -0.17 1.21 -0.46 0.02 0.00 0.00 175.26 176.28 1ynt s TRP 1547N 1.21 3.38 -0.17 1.61 -0.00 -1.26 -0.75 118.94 122.95 1ynt s TRP 1547Ca -0.08 1.26 0.11 0.00 -0.00 0.00 0.00 56.10 57.39 1ynt s TRP 1547Cb -0.12 -3.44 -0.23 0.00 -0.00 0.00 0.00 33.47 29.68 1ynt s TRP 1547CO -0.05 -1.36 0.17 -0.89 -0.00 0.00 0.00 176.95 174.82 1ynt n ILE 1548N 4.03 1.49 -3.98 5.86 5.41 0.15 -4.82 119.36 127.50 1ynt n ILE 1548Ca 0.09 -0.77 0.00 0.00 1.00 0.00 0.00 62.75 63.07 1ynt n ILE 1548Cb 0.46 -0.89 0.00 0.00 -0.71 0.00 0.00 39.64 38.50 1ynt n ILE 1548CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ynt n GLY 1549N 1.83 -1.15 3.26 7.39 0.00 -1.19 -3.46 105.19 111.86 1ynt n GLY 1549Ca -0.32 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 1ynt n GLY 1549CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ynt s ILE 1550N -3.00 -0.01 -0.14 -0.61 2.07 -0.57 -2.47 121.20 116.47 1ynt s ILE 1550Ca 0.00 0.02 0.01 0.00 -1.41 0.00 0.00 60.65 59.28 1ynt s ILE 1550Cb 0.00 -0.54 0.02 0.00 0.13 0.00 0.00 42.46 42.07 1ynt s ILE 1550CO 0.00 0.01 -0.18 -0.51 -1.91 0.00 0.00 174.94 172.35 1ynt s ILE 1551N 0.45 1.82 -0.42 2.00 1.10 0.26 -1.74 121.20 124.66 1ynt s ILE 1551Ca -0.02 -0.81 -0.29 0.00 -0.51 0.00 0.00 60.65 59.02 1ynt s ILE 1551Cb -0.04 -1.64 0.01 0.00 0.15 0.00 0.00 42.46 40.94 1ynt s ILE 1551CO -0.02 0.50 1.38 -0.44 -2.11 0.00 0.00 174.94 174.25 1ynt s SER 1552N 1.12 6.37 0.47 4.50 0.01 0.54 -1.66 113.70 125.05 1ynt s SER 1552Ca -0.01 0.79 0.22 0.00 1.31 0.00 0.00 55.95 58.25 1ynt s SER 1552Cb -0.14 -2.54 1.24 0.00 0.21 0.00 0.00 66.02 64.79 1ynt s SER 1552CO -0.06 -1.42 1.90 0.71 0.41 0.00 0.00 173.24 174.78 1ynt h THR 1553N 6.44 0.67 0.00 1.44 1.35 -1.84 0.77 112.91 121.74 1ynt h THR 1553Ca -0.27 -0.08 -0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1ynt h THR 1553Cb 1.10 0.43 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1ynt h THR 1553CO 1.09 0.04 -0.31 0.22 -0.25 0.00 0.00 175.52 176.32 1ynt h TYR 1554N 0.23 0.00 -0.71 4.73 3.20 -1.88 -3.38 116.97 119.16 1ynt h TYR 1554Ca 0.40 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.26 1ynt h TYR 1554Cb 1.23 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.47 1ynt h TYR 1554CO -0.00 0.03 0.38 0.66 -1.64 0.00 0.00 178.16 177.59 1ynt h SER 1555N -1.00 0.88 0.00 -2.11 4.64 -1.95 -3.46 113.55 110.56 1ynt h SER 1555Ca -0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1ynt h SER 1555Cb 0.32 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1ynt h SER 1555CO -0.00 0.72 0.00 0.61 -0.87 0.00 0.00 176.83 177.29 1ynt n GLY 1556N -1.19 0.58 3.79 -0.77 0.00 0.27 -5.02 105.19 102.84 1ynt n GLY 1556Ca 0.07 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 1ynt n GLY 1556CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ynt s ASP 1557N -2.16 6.89 0.55 1.61 2.15 -1.20 -4.77 116.67 119.74 1ynt s ASP 1557Ca 0.00 1.06 0.05 0.00 0.43 0.00 0.00 52.55 54.09 1ynt s ASP 1557Cb 0.00 -2.31 0.04 0.00 -0.30 0.00 0.00 42.92 40.34 1ynt s ASP 1557CO 0.00 0.19 0.36 0.00 -0.17 0.00 0.00 175.17 175.55 1ynt s ALA 1558N -0.53 4.43 -0.20 3.66 0.00 -1.26 -0.34 121.76 127.52 1ynt s ALA 1558Ca 0.27 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 51.06 1ynt s ALA 1558Cb -0.17 -0.63 0.08 0.00 0.00 0.00 0.00 23.12 22.40 1ynt s ALA 1558CO 0.15 -0.40 0.45 -1.12 0.00 0.00 0.00 175.76 174.84 1ynt s SER 1559N -4.24 -0.47 0.00 0.00 0.01 -0.71 -4.97 113.70 103.31 1ynt s SER 1559Ca 0.29 1.04 0.00 0.00 1.31 0.00 0.00 55.95 58.59 1ynt s SER 1559Cb -0.02 1.19 0.00 0.00 0.21 0.00 0.00 66.02 67.40 1ynt s SER 1559CO 0.18 -0.22 0.00 -1.22 0.41 0.00 0.00 173.24 172.40 1ynt n TYR 1560N 4.86 0.00 -3.84 2.43 4.01 -1.26 -1.51 117.16 121.85 1ynt n TYR 1560Ca -0.15 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.45 1ynt n TYR 1560Cb 0.52 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.41 1ynt n TYR 1560CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1ynt s ASN 1561N -0.84 0.06 0.16 7.72 3.84 -1.22 -4.73 114.94 119.93 1ynt s ASN 1561Ca 0.00 0.01 -0.09 0.00 0.21 0.00 0.00 52.86 53.00 1ynt s ASN 1561Cb 0.00 -0.04 0.22 0.00 -0.55 0.00 0.00 41.25 40.88 1ynt s ASN 1561CO 0.00 -0.06 1.02 0.00 -2.79 0.00 0.00 177.10 175.27 1ynt n GLN 1562N 3.60 -0.11 -0.20 0.43 1.13 -1.26 -1.25 117.38 119.70 1ynt n GLN 1562Ca -0.19 1.01 -0.07 0.00 -1.94 0.00 0.00 57.00 55.81 1ynt n GLN 1562Cb 0.55 -1.51 -0.06 0.00 0.11 0.00 0.00 30.24 29.33 1ynt n GLN 1562CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1ynt h LYS 1563N 0.00 -0.07 -0.30 -1.09 6.56 -1.96 -2.91 116.57 116.80 1ynt h LYS 1563Ca 0.26 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.86 1ynt h LYS 1563Cb 0.43 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1ynt h LYS 1563CO -0.66 -0.05 0.00 1.19 -2.06 0.00 0.00 179.45 177.87 1ynt n PHE 1564N -4.36 0.40 -1.92 -1.35 3.72 -0.38 -4.89 117.46 108.68 1ynt n PHE 1564Ca 0.00 -0.20 -0.41 0.00 -0.05 0.00 0.00 57.45 56.79 1ynt n PHE 1564Cb 0.17 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.69 1ynt n PHE 1564CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1ynt s LYS 1565N -1.60 4.21 0.00 -1.08 2.20 -1.07 0.06 119.74 122.46 1ynt s LYS 1565Ca 0.26 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.28 1ynt s LYS 1565Cb 0.14 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 1ynt s LYS 1565CO 0.19 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 175.07 1ynt n GLY 1566N 2.32 0.45 0.51 5.54 0.00 -1.26 -4.71 105.19 108.04 1ynt n GLY 1566Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1ynt n GLY 1566CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ynt n LYS 1567N -1.72 0.14 -3.73 1.61 0.00 0.20 -4.92 118.16 109.74 1ynt n LYS 1567Ca 0.00 0.05 -0.21 0.00 0.00 0.00 0.00 58.31 58.15 1ynt n LYS 1567Cb 0.11 -0.87 -0.03 0.00 0.00 0.00 0.00 35.03 34.23 1ynt n LYS 1567CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ynt s ALA 1568N -2.12 3.94 -0.36 3.14 0.00 0.11 -3.33 121.76 123.15 1ynt s ALA 1568Ca -0.09 -1.58 0.06 0.00 0.00 0.00 0.00 51.96 50.36 1ynt s ALA 1568Cb 0.03 -1.33 0.18 0.00 0.00 0.00 0.00 23.12 22.00 1ynt s ALA 1568CO 0.12 0.01 0.57 0.99 0.00 0.00 0.00 175.76 177.45 1ynt s THR 1569N -2.26 -0.90 -0.17 0.00 2.01 -1.15 -4.84 115.64 108.34 1ynt s THR 1569Ca 0.42 -0.13 -0.26 0.00 0.31 0.00 0.00 61.69 62.03 1ynt s THR 1569Cb -0.07 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 71.96 1ynt s THR 1569CO 0.28 -0.09 0.86 -0.04 -0.69 0.00 0.00 174.62 174.94 1ynt s MET 1570N 2.17 4.30 -0.01 4.92 -1.94 -1.26 -3.18 119.30 124.30 1ynt s MET 1570Ca 0.14 1.07 0.01 0.00 -1.71 0.00 0.00 55.69 55.20 1ynt s MET 1570Cb -0.08 -3.58 0.00 0.00 2.01 0.00 0.00 34.83 33.19 1ynt s MET 1570CO -0.15 -0.35 -0.03 0.95 -0.01 0.00 0.00 175.02 175.43 1ynt s THR 1571N 2.22 0.29 0.15 2.05 -4.23 -1.15 -4.78 115.64 110.19 1ynt s THR 1571Ca 0.39 -0.11 0.02 0.00 -1.18 0.00 0.00 61.69 60.81 1ynt s THR 1571Cb -0.17 -0.27 0.02 0.00 1.34 0.00 0.00 72.50 73.42 1ynt s THR 1571CO 0.12 0.10 0.15 0.55 -0.54 0.00 0.00 174.62 175.01 1ynt n VAL 1572N 3.25 0.00 -2.87 2.29 3.14 -1.26 -0.91 118.33 121.98 1ynt n VAL 1572Ca -0.16 -0.56 -0.02 0.00 -2.96 0.00 0.00 64.34 60.65 1ynt n VAL 1572Cb 0.57 -0.59 0.01 0.00 -1.06 0.00 0.00 33.84 32.77 1ynt n VAL 1572CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1ynt s ASP 1573N -1.91 -1.18 0.00 6.55 2.15 -1.16 -4.89 116.67 116.24 1ynt s ASP 1573Ca 0.12 -1.10 0.00 0.00 0.43 0.00 0.00 52.55 52.00 1ynt s ASP 1573Cb -0.01 1.53 0.00 0.00 -0.30 0.00 0.00 42.92 44.14 1ynt s ASP 1573CO 0.07 -0.08 0.16 1.17 -0.17 0.00 0.00 175.17 176.33 1ynt n LYS 1574N 3.36 0.00 0.00 4.34 4.81 -1.26 -2.71 118.16 126.70 1ynt n LYS 1574Ca 0.14 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1ynt n LYS 1574Cb 0.58 -0.55 0.00 0.00 0.02 0.00 0.00 35.03 35.08 1ynt n LYS 1574CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1ynt n SER 1575N -0.38 0.00 -1.15 3.14 3.41 -1.26 0.18 113.62 117.57 1ynt n SER 1575Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 1ynt n SER 1575Cb 0.00 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.23 1ynt n SER 1575CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ynt n SER 1576N -1.24 4.10 -3.88 4.04 3.41 -1.12 -5.01 113.62 113.91 1ynt n SER 1576Ca 0.00 -2.56 -0.37 0.00 -0.26 0.00 0.00 58.87 55.68 1ynt n SER 1576Cb 0.00 -0.49 0.02 0.00 -0.26 0.00 0.00 64.21 63.48 1ynt n SER 1576CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ynt n SER 1577N 0.39 -4.76 -3.92 4.04 7.64 0.47 -4.84 113.62 112.65 1ynt n SER 1577Ca 0.21 -1.12 -0.11 0.00 1.01 0.00 0.00 58.87 58.86 1ynt n SER 1577Cb 0.80 -2.30 -0.13 0.00 -1.01 0.00 0.00 64.21 61.57 1ynt n SER 1577CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ynt s THR 1578N -3.40 0.05 0.06 0.44 2.01 -1.24 -1.20 115.64 112.35 1ynt s THR 1578Ca 0.39 -0.42 0.06 0.00 0.31 0.00 0.00 61.69 62.03 1ynt s THR 1578Cb -0.19 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.15 1ynt s THR 1578CO 0.92 -0.23 -0.10 0.00 -0.69 0.00 0.00 174.62 174.52 1ynt s ALA 1579N -0.67 2.92 0.17 7.40 0.00 0.16 -2.98 121.76 128.75 1ynt s ALA 1579Ca -0.07 -1.16 0.11 0.00 0.00 0.00 0.00 51.96 50.84 1ynt s ALA 1579Cb -0.05 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.08 1ynt s ALA 1579CO -0.00 0.62 -0.24 0.71 0.00 0.00 0.00 175.76 176.85 1ynt s TYR 1580N -1.09 2.33 -0.09 0.00 2.02 -0.08 -2.23 117.35 118.20 1ynt s TYR 1580Ca 0.19 -0.36 -0.02 0.00 -0.37 0.00 0.00 57.07 56.51 1ynt s TYR 1580Cb -0.11 -1.19 0.03 0.00 -0.40 0.00 0.00 41.96 40.30 1ynt s TYR 1580CO 0.10 0.45 0.03 -1.64 -1.57 0.00 0.00 175.55 172.92 1ynt s MET 1581N -2.47 0.40 -0.19 -0.62 -1.94 -0.41 -2.93 119.30 111.13 1ynt s MET 1581Ca 0.19 0.09 -0.02 0.00 -1.71 0.00 0.00 55.69 54.24 1ynt s MET 1581Cb -0.09 -1.07 -0.01 0.00 2.01 0.00 0.00 34.83 35.68 1ynt s MET 1581CO 0.09 -0.38 -0.09 -2.00 -0.01 0.00 0.00 175.02 172.63 1ynt s GLU 1582N 2.02 3.32 -0.32 2.03 2.12 -1.19 -0.06 118.70 126.62 1ynt s GLU 1582Ca 0.04 -0.67 -0.06 0.00 0.36 0.00 0.00 54.97 54.64 1ynt s GLU 1582Cb -0.13 -2.86 0.03 0.00 0.26 0.00 0.00 34.13 31.43 1ynt s GLU 1582CO -0.05 -0.11 0.09 -0.51 -0.54 0.00 0.00 175.26 174.13 1ynt s LEU 1583N 1.20 4.12 0.36 2.70 1.02 0.33 -2.92 118.68 125.49 1ynt s LEU 1583Ca 0.02 -1.01 0.07 0.00 0.02 0.00 0.00 54.13 53.23 1ynt s LEU 1583Cb -0.14 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.20 1ynt s LEU 1583CO -0.03 -0.28 0.46 0.00 0.02 0.00 0.00 176.35 176.52 1ynt s ALA 1584N 1.42 4.24 -1.16 4.21 0.00 -1.21 -0.17 121.76 129.09 1ynt s ALA 1584Ca -0.01 -1.56 -0.26 0.00 0.00 0.00 0.00 51.96 50.13 1ynt s ALA 1584Cb -0.19 -1.56 0.01 0.00 0.00 0.00 0.00 23.12 21.39 1ynt s ALA 1584CO 0.02 -0.09 0.75 0.54 0.00 0.00 0.00 175.76 176.98 1ynt n ARG 1585N -1.64 -0.83 -2.36 0.00 1.74 -1.22 -4.86 116.66 107.48 1ynt n ARG 1585Ca 0.02 0.32 -0.40 0.00 -0.77 0.00 0.00 57.85 57.02 1ynt n ARG 1585Cb 0.59 -3.46 -0.03 0.00 -1.02 0.00 0.00 32.46 28.54 1ynt n ARG 1585CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ynt s LEU 1586N -6.82 4.43 0.05 0.55 1.43 -0.68 -4.76 118.68 112.87 1ynt s LEU 1586Ca 0.47 2.36 0.02 0.00 -1.03 0.00 0.00 54.13 55.96 1ynt s LEU 1586Cb -0.21 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.24 1ynt s LEU 1586CO 0.91 -0.36 -0.07 0.28 0.23 0.00 0.00 176.35 177.34 1ynt s THR 1587N -1.24 0.53 -1.17 5.49 -1.32 -1.26 0.59 115.64 117.26 1ynt s THR 1587Ca 0.49 -1.19 0.00 0.00 -1.21 0.00 0.00 61.69 59.78 1ynt s THR 1587Cb -0.33 -0.74 0.00 0.00 -1.51 0.00 0.00 72.50 69.92 1ynt s THR 1587CO 0.42 -0.46 0.18 -1.54 -2.21 0.00 0.00 174.62 171.02 1ynt n SER 1588N 1.26 0.00 0.07 8.08 3.41 -1.26 0.22 113.62 125.39 1ynt n SER 1588Ca -0.21 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.43 1ynt n SER 1588Cb 0.56 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 1ynt n SER 1588CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ynt h GLU 1589N 0.00 0.00 0.00 4.33 4.39 -1.95 -3.28 114.58 118.07 1ynt h GLU 1589Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ynt h GLU 1589Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1ynt h GLU 1589CO 0.00 0.24 -0.00 -0.25 -1.16 0.00 0.00 179.01 177.83 1ynt n ASP 1590N -2.88 0.55 -4.64 1.42 8.00 0.13 -4.76 116.55 114.38 1ynt n ASP 1590Ca -0.06 0.55 -0.47 0.00 0.71 0.00 0.00 54.79 55.52 1ynt n ASP 1590Cb 0.75 -0.69 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 1ynt n ASP 1590CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ynt n SER 1591N -2.01 3.31 0.00 -2.24 7.64 -1.24 -4.77 113.62 114.30 1ynt n SER 1591Ca 0.06 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.72 1ynt n SER 1591Cb 0.40 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.21 1ynt n SER 1591CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ynt n ALA 1592N 7.88 0.00 -2.35 -0.43 0.00 0.94 -4.87 120.51 121.68 1ynt n ALA 1592Ca 0.26 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.33 1ynt n ALA 1592Cb 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.71 1ynt n ALA 1592CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ynt s ILE 1593N -2.00 4.84 -0.10 0.00 -1.09 0.72 0.14 121.20 123.71 1ynt s ILE 1593Ca 0.00 0.98 0.01 0.00 -2.23 0.00 0.00 60.65 59.41 1ynt s ILE 1593Cb 0.00 -3.80 0.02 0.00 -1.58 0.00 0.00 42.46 37.10 1ynt s ILE 1593CO 0.00 0.42 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.72 1ynt s TYR 1594N -1.27 1.55 0.12 3.97 2.02 -1.11 -0.22 117.35 122.41 1ynt s TYR 1594Ca 0.32 -0.71 0.09 0.00 -0.37 0.00 0.00 57.07 56.40 1ynt s TYR 1594Cb -0.17 -1.21 -0.04 0.00 -0.40 0.00 0.00 41.96 40.14 1ynt s TYR 1594CO 0.18 -0.44 -0.17 0.71 -1.57 0.00 0.00 175.55 174.26 1ynt s TYR 1595N 1.27 2.55 0.08 2.71 2.02 0.10 -1.83 117.35 124.26 1ynt s TYR 1595Ca -0.03 -0.25 0.10 0.00 -0.37 0.00 0.00 57.07 56.52 1ynt s TYR 1595Cb -0.14 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.03 1ynt s TYR 1595CO -0.04 0.39 -0.26 0.00 -1.57 0.00 0.00 175.55 174.07 1ynt s ALA 1597N -0.91 -0.51 0.11 0.00 0.00 0.55 -0.46 121.76 120.55 1ynt s ALA 1597Ca 0.12 0.25 -0.22 0.00 0.00 0.00 0.00 51.96 52.11 1ynt s ALA 1597Cb -0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1ynt s ALA 1597CO 0.04 -0.18 0.66 0.50 0.00 0.00 0.00 175.76 176.77 1ynt s ARG 1598N -0.83 4.35 -0.25 0.00 3.52 0.07 0.08 118.95 125.90 1ynt s ARG 1598Ca -0.09 0.91 -0.02 0.00 -0.13 0.00 0.00 55.73 56.40 1ynt s ARG 1598Cb -0.05 -3.25 0.08 0.00 -1.56 0.00 0.00 34.95 30.17 1ynt s ARG 1598CO 0.02 0.61 0.06 -1.54 -0.81 0.00 0.00 175.30 173.64 1ynt s SER 1599N -1.10 3.51 0.53 -2.12 1.04 -1.11 0.43 113.70 114.88 1ynt s SER 1599Ca 0.32 -1.23 0.20 0.00 0.48 0.00 0.00 55.95 55.71 1ynt s SER 1599Cb -0.21 -0.73 1.35 0.00 0.10 0.00 0.00 66.02 66.53 1ynt s SER 1599CO 0.22 -0.36 2.12 0.77 0.98 0.00 0.00 173.24 176.97 1ynt h SER 1600N 8.17 0.00 -4.58 7.02 4.64 -1.89 -3.27 113.55 123.63 1ynt h SER 1600Ca -0.15 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.91 1ynt h SER 1600Cb 1.06 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.99 1ynt h SER 1600CO 0.41 0.00 -0.71 0.28 -0.87 0.00 0.00 176.83 175.94 1ynt s THR 1601N -5.01 0.71 0.06 2.95 -1.32 -1.26 -4.92 115.64 106.86 1ynt s THR 1601Ca -0.05 -1.70 -0.36 0.00 -1.21 0.00 0.00 61.69 58.37 1ynt s THR 1601Cb 0.17 -1.40 -0.20 0.00 -1.51 0.00 0.00 72.50 69.56 1ynt s THR 1601CO 0.67 -0.71 1.59 -0.50 -2.21 0.00 0.00 174.62 173.46 1ynt h TRP 1602N 3.39 -1.11 -0.19 9.09 4.06 -2.02 -3.31 115.95 125.87 1ynt h TRP 1602Ca -0.36 -0.03 0.05 0.00 2.06 0.00 0.00 58.89 60.62 1ynt h TRP 1602Cb 1.18 0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 29.70 1ynt h TRP 1602CO 0.61 -0.69 0.14 0.10 -3.56 0.00 0.00 178.44 175.04 1ynt h TYR 1603N -1.19 0.00 -3.37 0.49 -0.00 -1.99 -3.44 116.97 107.47 1ynt h TYR 1603Ca -0.12 0.00 -0.62 0.00 -0.00 0.00 0.00 58.73 57.99 1ynt h TYR 1603Cb 0.91 0.00 -0.19 0.00 -0.00 0.00 0.00 36.73 37.45 1ynt h TYR 1603CO -0.01 0.00 -0.82 1.52 -0.00 0.00 0.00 178.16 178.85 1ynt s TYR 1604N -5.03 2.13 -0.37 0.10 -0.00 -1.25 -5.12 117.35 107.81 1ynt s TYR 1604Ca -0.05 -0.39 -0.10 0.00 -0.00 0.00 0.00 57.07 56.52 1ynt s TYR 1604Cb 0.18 -1.08 0.03 0.00 -0.00 0.00 0.00 41.96 41.09 1ynt s TYR 1604CO 0.69 0.41 0.19 -0.06 -0.00 0.00 0.00 175.55 176.78 1ynt s PHE 1605N -1.64 3.25 0.00 -3.49 2.99 -1.26 -4.55 117.98 113.27 1ynt s PHE 1605Ca 0.17 -1.03 0.00 0.00 0.00 0.00 0.00 56.93 56.07 1ynt s PHE 1605Cb -0.08 -2.42 0.00 0.00 0.00 0.00 0.00 43.02 40.52 1ynt s PHE 1605CO 0.08 -0.66 0.31 -0.25 -0.00 0.00 0.00 175.22 174.70 1ynt n ASP 1606N 4.97 0.00 -4.35 1.36 8.00 0.17 -4.85 116.55 121.84 1ynt n ASP 1606Ca -0.12 0.31 -0.28 0.00 0.71 0.00 0.00 54.79 55.41 1ynt n ASP 1606Cb 0.46 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.43 1ynt n ASP 1606CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1ynt s TYR 1607N -0.62 2.18 0.30 1.24 1.51 -1.20 -4.95 117.35 115.81 1ynt s TYR 1607Ca 0.00 -0.39 0.09 0.00 -1.01 0.00 0.00 57.07 55.75 1ynt s TYR 1607Cb 0.00 -1.21 -0.04 0.00 -0.11 0.00 0.00 41.96 40.60 1ynt s TYR 1607CO 0.00 0.26 0.10 -1.58 -1.11 0.00 0.00 175.55 173.22 1ynt s TRP 1608N -1.02 2.77 0.00 2.71 0.52 -1.26 -0.75 118.94 121.91 1ynt s TRP 1608Ca 0.12 -0.27 0.00 0.00 0.02 0.00 0.00 56.10 55.96 1ynt s TRP 1608Cb -0.10 -1.43 0.00 0.00 -1.15 0.00 0.00 33.47 30.79 1ynt s TRP 1608CO 0.05 0.47 0.00 0.41 0.02 0.00 0.00 176.95 177.90 1ynt n GLY 1609N -1.06 0.08 0.00 0.98 0.00 0.40 -4.52 105.19 101.06 1ynt n GLY 1609Ca -0.05 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1ynt n GLY 1609CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ynt n GLN 1610N 0.00 0.77 0.00 1.61 -0.00 -1.26 -4.96 117.38 113.54 1ynt n GLN 1610Ca 0.00 -0.91 0.00 0.00 -0.00 0.00 0.00 57.00 56.09 1ynt n GLN 1610Cb 0.00 -0.97 0.00 0.00 -0.00 0.00 0.00 30.24 29.27 1ynt n GLN 1610CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ynt n GLY 1611N -0.21 -2.10 2.61 2.61 0.00 -1.26 -4.99 105.19 101.85 1ynt n GLY 1611Ca 0.00 -1.42 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 1ynt n GLY 1611CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ynt s THR 1612N -3.43 0.11 0.14 2.61 2.01 -0.76 -4.83 115.64 111.49 1ynt s THR 1612Ca 0.00 -0.60 -0.31 0.00 0.31 0.00 0.00 61.69 61.08 1ynt s THR 1612Cb 0.00 -0.93 -0.09 0.00 0.01 0.00 0.00 72.50 71.49 1ynt s THR 1612CO 0.00 -0.51 1.55 -0.89 -0.69 0.00 0.00 174.62 174.08 1ynt s THR 1613N 2.03 2.79 -0.14 -0.82 2.01 -1.26 -2.75 115.64 117.50 1ynt s THR 1613Ca 0.05 0.54 0.02 0.00 0.31 0.00 0.00 61.69 62.61 1ynt s THR 1613Cb -0.16 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.01 1ynt s THR 1613CO -0.23 0.04 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.32 1ynt s LEU 1614N 1.31 2.23 -0.21 4.42 2.96 0.12 -0.94 118.68 128.58 1ynt s LEU 1614Ca 0.69 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1ynt s LEU 1614Cb -0.42 -1.48 0.05 0.00 0.50 0.00 0.00 46.19 44.84 1ynt s LEU 1614CO 0.31 0.10 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.47 1ynt s THR 1615N 0.71 1.56 -0.33 3.68 2.01 -0.70 -0.04 115.64 122.53 1ynt s THR 1615Ca -0.09 -1.04 -0.13 0.00 0.31 0.00 0.00 61.69 60.74 1ynt s THR 1615Cb -0.16 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.63 1ynt s THR 1615CO 0.01 0.08 0.26 -0.69 -0.69 0.00 0.00 174.62 173.59 1ynt s VAL 1616N 1.42 5.26 -0.19 3.82 1.01 -1.26 -1.63 120.40 128.84 1ynt s VAL 1616Ca -0.03 -0.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 1ynt s VAL 1616Cb -0.17 -3.70 0.10 0.00 0.00 0.00 0.00 36.38 32.61 1ynt s VAL 1616CO -0.07 0.03 0.88 -0.94 0.00 0.00 0.00 175.10 175.00 1ynt s SER 1617N 1.73 -0.53 -0.91 3.32 1.04 0.23 -4.50 113.70 114.08 1ynt s SER 1617Ca 0.08 0.79 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 1ynt s SER 1617Cb -0.17 0.73 0.26 0.00 0.10 0.00 0.00 66.02 66.94 1ynt s SER 1617CO 0.11 -0.34 1.00 -1.54 0.98 0.00 0.00 173.24 173.45 1ynt n SER 1618N 1.53 4.84 -3.85 7.02 3.41 -1.26 -3.98 113.62 121.34 1ynt n SER 1618Ca -0.14 -3.28 -0.18 0.00 -0.26 0.00 0.00 58.87 55.01 1ynt n SER 1618Cb 0.57 -1.05 -0.16 0.00 -0.26 0.00 0.00 64.21 63.30 1ynt n SER 1618CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ynt s ALA 1619N -2.04 0.46 0.43 7.33 0.00 -1.26 -5.09 121.76 121.60 1ynt s ALA 1619Ca 0.32 0.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.15 1ynt s ALA 1619Cb 0.01 -0.36 -0.11 0.00 0.00 0.00 0.00 23.12 22.67 1ynt s ALA 1619CO -0.03 -0.05 0.94 0.15 0.00 0.00 0.00 175.76 176.78 1ynt s LYS 1620N 0.97 4.20 0.59 0.00 -0.14 -1.26 -5.00 119.74 119.10 1ynt s LYS 1620Ca -0.11 1.09 -0.18 0.00 -1.36 0.00 0.00 55.97 55.41 1ynt s LYS 1620Cb -0.14 -2.19 -0.06 0.00 -1.68 0.00 0.00 37.83 33.76 1ynt s LYS 1620CO -0.01 -0.04 0.80 2.41 -0.76 0.00 0.00 175.35 177.75 1ynt n THR 1621N -0.70 3.21 -3.63 2.17 -1.04 -1.26 -4.82 114.28 108.21 1ynt n THR 1621Ca 0.07 -0.50 -0.03 0.00 -2.04 0.00 0.00 64.05 61.54 1ynt n THR 1621Cb 0.54 -0.97 -0.06 0.00 -1.82 0.00 0.00 70.33 68.02 1ynt n THR 1621CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ynt s THR 1622N -1.59 -0.88 0.40 12.58 2.01 -0.90 -4.98 115.64 122.28 1ynt s THR 1622Ca 0.74 0.06 -0.26 0.00 0.31 0.00 0.00 61.69 62.53 1ynt s THR 1622Cb -0.43 -0.88 -0.09 0.00 0.01 0.00 0.00 72.50 71.11 1ynt s THR 1622CO 0.49 0.02 1.30 0.00 -0.69 0.00 0.00 174.62 175.74 1ynt s ALA 1623N 2.80 3.27 0.44 7.40 0.00 -1.26 -2.95 121.76 131.45 1ynt s ALA 1623Ca -0.03 1.23 -0.21 0.00 0.00 0.00 0.00 51.96 52.95 1ynt s ALA 1623Cb -0.12 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.41 1ynt s ALA 1623CO -0.17 -0.81 0.96 -1.25 0.00 0.00 0.00 175.76 174.50 1ynt s PRO 1624N -2.22 4.16 -0.14 0.00 0.04 -1.26 -4.58 135.00 131.01 1ynt s PRO 1624Ca 0.56 1.14 -0.10 0.00 0.04 0.00 0.00 61.00 62.64 1ynt s PRO 1624Cb -0.38 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 1ynt s PRO 1624CO 0.49 -0.09 0.20 -1.12 0.04 0.00 0.00 177.00 176.52 1ynt s SER 1625N -2.20 6.40 -0.15 6.66 0.01 0.13 -4.93 113.70 119.61 1ynt s SER 1625Ca 0.62 0.47 0.00 0.00 1.31 0.00 0.00 55.95 58.35 1ynt s SER 1625Cb -0.10 -2.12 -0.00 0.00 0.21 0.00 0.00 66.02 64.01 1ynt s SER 1625CO 0.15 0.27 -0.15 -0.69 0.41 0.00 0.00 173.24 173.23 1ynt s VAL 1626N -0.34 2.72 0.07 3.43 1.01 -1.26 -1.53 120.40 124.49 1ynt s VAL 1626Ca 0.14 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1ynt s VAL 1626Cb -0.12 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 1ynt s VAL 1626CO 0.03 0.51 -0.24 -0.31 0.00 0.00 0.00 175.10 175.10 1ynt s TYR 1627N 0.80 2.07 0.48 5.22 2.02 -0.80 -5.00 117.35 122.14 1ynt s TYR 1627Ca -0.05 -0.39 -0.08 0.00 -0.37 0.00 0.00 57.07 56.17 1ynt s TYR 1627Cb -0.15 -1.20 -0.05 0.00 -0.40 0.00 0.00 41.96 40.16 1ynt s TYR 1627CO 0.00 0.16 0.82 -2.14 -1.57 0.00 0.00 175.55 172.82 1ynt s PRO 1628N -1.44 3.63 -0.59 -1.71 0.02 -1.26 -1.21 135.00 132.44 1ynt s PRO 1628Ca 0.10 0.38 0.05 0.00 0.02 0.00 0.00 61.00 61.55 1ynt s PRO 1628Cb -0.10 -2.33 0.17 0.00 0.02 0.00 0.00 34.50 32.26 1ynt s PRO 1628CO 0.03 -0.21 0.44 1.28 -0.33 0.00 0.00 177.00 178.21 1ynt n LEU 1629N -2.02 1.65 -4.81 -5.54 4.77 -1.03 -4.82 117.00 105.20 1ynt n LEU 1629Ca 0.02 -4.89 -0.37 0.00 -0.03 0.00 0.00 56.01 50.74 1ynt n LEU 1629Cb 0.55 -0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 1ynt n LEU 1629CO 0.52 1.80 0.34 0.00 -1.33 0.00 0.00 177.39 178.72 1ynt s ALA 1630N -0.88 3.51 1.06 -1.18 0.00 -1.26 -2.60 121.76 120.40 1ynt s ALA 1630Ca 0.28 0.09 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 1ynt s ALA 1630Cb -0.01 -2.72 0.06 0.00 0.00 0.00 0.00 23.12 20.46 1ynt s ALA 1630CO -0.18 0.37 0.05 -2.30 0.00 0.00 0.00 175.76 173.70 1ynt n PRO 1631N 1.22 -1.05 -2.68 0.00 -0.02 -1.26 -4.94 135.00 126.28 1ynt n PRO 1631Ca -0.06 -0.28 -0.32 0.00 -2.02 0.00 0.00 63.50 60.81 1ynt n PRO 1631Cb 0.51 -1.70 -0.05 0.00 -0.02 0.00 0.00 33.50 32.23 1ynt n PRO 1631CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ynt s VAL 1632N -2.27 4.49 0.04 -1.45 1.01 -1.26 -4.70 120.40 116.26 1ynt s VAL 1632Ca 0.55 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.82 1ynt s VAL 1632Cb -0.14 -3.66 0.05 0.00 0.00 0.00 0.00 36.38 32.63 1ynt s VAL 1632CO 0.67 -0.47 0.17 0.00 0.00 0.00 0.00 175.10 175.48 1ynt s GLY 1634N -3.61 0.09 0.30 0.00 0.00 -1.26 -5.14 107.32 97.70 1ynt s GLY 1634Ca -0.01 -0.58 0.04 0.00 0.00 0.00 0.00 44.72 44.16 1ynt s GLY 1634CO 0.09 2.44 0.45 0.51 0.00 0.00 0.00 173.10 176.59 1ynt s ASP 1635N 2.27 6.20 -0.63 1.64 1.47 -1.11 -4.97 116.67 121.54 1ynt s ASP 1635Ca 0.09 0.13 -0.26 0.00 1.18 0.00 0.00 52.55 53.69 1ynt s ASP 1635Cb -0.15 -1.75 -0.09 0.00 -0.34 0.00 0.00 42.92 40.59 1ynt s ASP 1635CO -0.34 -0.25 2.34 0.42 0.68 0.00 0.00 175.17 178.02 1ynt s THR 1636N -2.15 3.06 0.00 2.11 -4.23 -1.26 -4.73 115.64 108.44 1ynt s THR 1636Ca 0.39 -0.01 -0.00 0.00 -1.18 0.00 0.00 61.69 60.89 1ynt s THR 1636Cb -0.09 -3.15 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 1ynt s THR 1636CO 0.32 -0.14 0.66 0.41 -0.54 0.00 0.00 174.62 175.33 1ynt n THR 1637N 8.22 0.41 0.00 3.99 -1.04 -1.26 -4.72 114.28 119.88 1ynt n THR 1637Ca 0.39 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 1ynt n THR 1637Cb 0.50 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.69 1ynt n THR 1637CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ynt n GLY 1638N 2.38 -2.84 0.16 3.41 0.00 -1.26 -4.87 105.19 102.16 1ynt n GLY 1638Ca 0.03 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 1ynt n GLY 1638CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ynt h SER 1639N 0.00 0.53 -2.71 1.61 0.02 -1.97 -3.43 113.55 107.60 1ynt h SER 1639Ca 0.00 -0.43 -0.53 0.00 -0.84 0.00 0.00 61.79 60.00 1ynt h SER 1639Cb 0.00 -0.16 -0.14 0.00 0.14 0.00 0.00 62.40 62.24 1ynt h SER 1639CO 0.00 1.23 -0.72 -0.94 -1.14 0.00 0.00 176.83 175.26 1ynt s SER 1640N -7.08 3.04 0.02 3.07 1.04 -1.26 -2.06 113.70 110.46 1ynt s SER 1640Ca -0.06 -1.09 0.05 0.00 0.48 0.00 0.00 55.95 55.33 1ynt s SER 1640Cb 0.09 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.98 1ynt s SER 1640CO 0.87 -0.16 -0.14 0.54 0.98 0.00 0.00 173.24 175.33 1ynt s VAL 1641N -2.81 1.11 -0.08 5.02 0.11 0.16 -4.52 120.40 119.38 1ynt s VAL 1641Ca 0.28 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.54 1ynt s VAL 1641Cb -0.00 -0.97 -0.02 0.00 -1.53 0.00 0.00 36.38 33.86 1ynt s VAL 1641CO 0.11 0.15 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.98 1ynt s THR 1642N -0.60 2.84 0.24 5.04 2.01 -1.26 -0.38 115.64 123.53 1ynt s THR 1642Ca 0.03 -0.77 0.11 0.00 0.31 0.00 0.00 61.69 61.37 1ynt s THR 1642Cb -0.07 -2.13 -0.05 0.00 0.01 0.00 0.00 72.50 70.27 1ynt s THR 1642CO 0.00 0.56 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.54 1ynt s LEU 1643N -0.20 2.54 0.00 4.42 1.43 0.27 -4.55 118.68 122.59 1ynt s LEU 1643Ca -0.00 -0.98 0.04 0.00 -1.03 0.00 0.00 54.13 52.16 1ynt s LEU 1643Cb -0.13 -1.00 -0.02 0.00 0.03 0.00 0.00 46.19 45.07 1ynt s LEU 1643CO 0.03 0.01 0.15 0.61 0.23 0.00 0.00 176.35 177.38 1ynt n GLY 1644N -0.30 3.41 3.62 -3.19 0.00 -1.07 0.38 105.19 108.03 1ynt n GLY 1644Ca -0.08 -1.86 -0.02 0.00 0.00 0.00 0.00 46.02 44.06 1ynt n GLY 1644CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynt s LEU 1646N 2.57 3.71 -0.49 0.00 2.96 -0.35 -1.37 118.68 125.70 1ynt s LEU 1646Ca -0.06 -0.54 -0.08 0.00 -0.22 0.00 0.00 54.13 53.23 1ynt s LEU 1646Cb -0.10 -1.90 0.13 0.00 0.50 0.00 0.00 46.19 44.82 1ynt s LEU 1646CO -0.19 -0.14 0.35 -0.69 -1.32 0.00 0.00 176.35 174.36 1ynt s VAL 1647N 1.54 4.06 0.20 1.68 1.01 0.85 -1.90 120.40 127.84 1ynt s VAL 1647Ca 0.04 -1.98 0.09 0.00 0.00 0.00 0.00 61.98 60.13 1ynt s VAL 1647Cb -0.16 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 1ynt s VAL 1647CO 0.03 -0.78 -0.17 -1.59 0.00 0.00 0.00 175.10 172.59 1ynt s LYS 1648N 1.13 1.37 0.00 2.72 -2.85 -0.58 0.24 119.74 121.77 1ynt s LYS 1648Ca 0.08 -1.56 0.00 0.00 -1.00 0.00 0.00 55.97 53.49 1ynt s LYS 1648Cb -0.24 -1.30 0.00 0.00 -2.06 0.00 0.00 37.83 34.22 1ynt s LYS 1648CO -0.02 0.24 0.00 0.41 0.10 0.00 0.00 175.35 176.08 1ynt n GLY 1649N -0.19 0.83 3.78 0.59 0.00 -1.10 0.20 105.19 109.30 1ynt n GLY 1649Ca -0.09 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1ynt n GLY 1649CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ynt s TYR 1650N -2.00 2.70 -0.28 1.61 1.13 -0.93 -4.41 117.35 115.17 1ynt s TYR 1650Ca 0.00 -0.46 -0.26 0.00 -1.41 0.00 0.00 57.07 54.95 1ynt s TYR 1650Cb 0.00 -1.87 0.16 0.00 -1.10 0.00 0.00 41.96 39.15 1ynt s TYR 1650CO 0.00 0.18 1.23 0.12 -2.51 0.00 0.00 175.55 174.57 1ynt s PHE 1651N -2.47 -0.25 0.75 -3.49 5.36 -1.15 0.83 117.98 117.56 1ynt s PHE 1651Ca 0.41 0.58 -0.12 0.00 -0.96 0.00 0.00 56.93 56.84 1ynt s PHE 1651Cb -0.01 0.43 0.04 0.00 -0.34 0.00 0.00 43.02 43.14 1ynt s PHE 1651CO 0.24 -0.14 1.12 -1.25 -1.46 0.00 0.00 175.22 173.73 1ynt s PRO 1652N -0.08 2.47 0.62 10.12 0.04 -1.26 -2.13 135.00 144.78 1ynt s PRO 1652Ca 0.05 0.41 0.02 0.00 0.04 0.00 0.00 61.00 61.53 1ynt s PRO 1652Cb -0.04 -1.98 0.13 0.00 0.04 0.00 0.00 34.50 32.65 1ynt s PRO 1652CO -0.10 -1.30 1.05 1.49 0.04 0.00 0.00 177.00 178.18 1ynt h GLU 1653N -0.85 0.00 -6.71 4.56 4.81 -2.01 -3.44 114.58 110.95 1ynt h GLU 1653Ca -0.46 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.27 1ynt h GLU 1653Cb 1.27 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1ynt h GLU 1653CO 0.63 0.00 0.38 -2.14 -0.73 0.00 0.00 179.01 177.15 1ynt s PRO 1654N -3.89 4.78 -0.30 0.92 0.02 -1.26 -5.00 135.00 130.27 1ynt s PRO 1654Ca -0.00 1.53 -0.07 0.00 0.02 0.00 0.00 61.00 62.48 1ynt s PRO 1654Cb 0.01 -3.29 0.19 0.00 0.02 0.00 0.00 34.50 31.42 1ynt s PRO 1654CO 0.02 0.38 0.91 0.54 -0.33 0.00 0.00 177.00 178.52 1ynt s VAL 1655N -0.83 -0.50 0.30 3.83 0.11 -1.26 -4.62 120.40 117.43 1ynt s VAL 1655Ca 0.43 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.19 1ynt s VAL 1655Cb -0.26 -0.69 -0.10 0.00 -1.53 0.00 0.00 36.38 33.79 1ynt s VAL 1655CO 0.33 0.00 1.41 -0.89 -3.33 0.00 0.00 175.10 172.61 1ynt s THR 1656N 2.92 2.56 -0.18 5.04 2.01 -0.05 -4.87 115.64 123.07 1ynt s THR 1656Ca 0.15 0.51 -0.05 0.00 0.31 0.00 0.00 61.69 62.62 1ynt s THR 1656Cb -0.07 -3.33 0.09 0.00 0.01 0.00 0.00 72.50 69.20 1ynt s THR 1656CO -0.20 0.10 0.32 -0.22 -0.69 0.00 0.00 174.62 173.93 1ynt s LEU 1657N -1.13 -0.42 0.13 4.42 1.98 -1.26 -0.13 118.68 122.26 1ynt s LEU 1657Ca 0.55 0.52 0.04 0.00 -2.89 0.00 0.00 54.13 52.35 1ynt s LEU 1657Cb -0.42 0.90 -0.04 0.00 0.66 0.00 0.00 46.19 47.28 1ynt s LEU 1657CO 0.50 -0.26 -0.10 0.42 -1.89 0.00 0.00 176.35 175.02 1ynt s THR 1658N 2.48 1.07 -0.18 3.68 -4.23 0.67 -4.99 115.64 114.14 1ynt s THR 1658Ca 0.03 -1.90 -0.04 0.00 -1.18 0.00 0.00 61.69 58.60 1ynt s THR 1658Cb -0.13 -1.66 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 1ynt s THR 1658CO -0.11 -0.68 -0.02 0.26 -0.54 0.00 0.00 174.62 173.52 1ynt s TRP 1659N -3.01 3.02 -1.11 3.99 0.52 -1.26 0.05 118.94 121.14 1ynt s TRP 1659Ca 0.12 -0.43 0.00 0.00 0.02 0.00 0.00 56.10 55.81 1ynt s TRP 1659Cb 0.01 -2.02 0.00 0.00 -1.15 0.00 0.00 33.47 30.30 1ynt s TRP 1659CO 0.00 -0.17 0.00 0.09 0.02 0.00 0.00 176.95 176.89 1ynt n ASN 1660N 3.96 -3.99 -2.49 2.95 5.03 0.66 -1.72 115.26 119.65 1ynt n ASN 1660Ca -0.17 0.19 -0.14 0.00 0.87 0.00 0.00 54.58 55.33 1ynt n ASN 1660Cb 0.52 -3.40 0.05 0.00 -1.02 0.00 0.00 39.78 35.93 1ynt n ASN 1660CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1ynt n SER 1661N -1.75 -3.84 0.00 6.41 7.64 -1.26 -3.14 113.62 117.68 1ynt n SER 1661Ca -0.15 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.37 1ynt n SER 1661Cb 0.61 -3.40 0.00 0.00 -1.01 0.00 0.00 64.21 60.41 1ynt n SER 1661CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ynt n GLY 1662N -1.33 2.11 0.31 0.23 0.00 -0.70 -4.90 105.19 100.91 1ynt n GLY 1662Ca -0.06 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.97 1ynt n GLY 1662CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ynt h SER 1663N 0.00 0.75 -3.61 1.61 0.02 -1.48 -3.38 113.55 107.46 1ynt h SER 1663Ca 0.00 0.03 -0.62 0.00 -0.84 0.00 0.00 61.79 60.36 1ynt h SER 1663Cb 0.00 -0.13 -0.14 0.00 0.14 0.00 0.00 62.40 62.28 1ynt h SER 1663CO 0.00 0.47 -0.31 -0.76 -1.14 0.00 0.00 176.83 175.09 1ynt s LEU 1664N -10.23 4.10 0.16 5.07 1.02 -1.10 -4.94 118.68 112.76 1ynt s LEU 1664Ca -0.13 0.31 0.00 0.00 0.02 0.00 0.00 54.13 54.33 1ynt s LEU 1664Cb 0.18 -2.36 0.00 0.00 0.02 0.00 0.00 46.19 44.03 1ynt s LEU 1664CO 0.78 -0.07 0.00 -1.20 0.02 0.00 0.00 176.35 175.88 1ynt n SER 1665N 4.73 0.45 -4.77 2.29 7.64 -1.26 -4.52 113.62 118.18 1ynt n SER 1665Ca -0.10 0.25 -0.38 0.00 1.01 0.00 0.00 58.87 59.65 1ynt n SER 1665Cb 0.51 -0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.67 1ynt n SER 1665CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ynt s SER 1666N -5.39 6.88 0.00 6.43 1.04 -1.26 -2.26 113.70 119.14 1ynt s SER 1666Ca 0.00 2.15 0.00 0.00 0.48 0.00 0.00 55.95 58.58 1ynt s SER 1666Cb 0.00 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.52 1ynt s SER 1666CO 0.00 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.42 1ynt n GLY 1667N 0.65 1.76 3.87 7.32 0.00 -1.26 -4.85 105.19 112.68 1ynt n GLY 1667Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1ynt n GLY 1667CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynt s VAL 1668N -2.40 4.74 -0.28 1.61 1.01 -0.96 -2.50 120.40 121.63 1ynt s VAL 1668Ca 0.00 0.75 0.01 0.00 0.00 0.00 0.00 61.98 62.73 1ynt s VAL 1668Cb 0.00 -3.70 0.17 0.00 0.00 0.00 0.00 36.38 32.86 1ynt s VAL 1668CO 0.00 -0.44 0.51 -1.00 0.00 0.00 0.00 175.10 174.17 1ynt s HIS 1669N -2.28 -1.36 -0.18 5.22 3.76 0.33 -4.96 115.29 115.82 1ynt s HIS 1669Ca 0.52 1.11 -0.03 0.00 -0.15 0.00 0.00 55.06 56.52 1ynt s HIS 1669Cb -0.10 0.25 -0.02 0.00 1.11 0.00 0.00 32.58 33.82 1ynt s HIS 1669CO 0.27 -0.90 -0.06 -0.08 -0.85 0.00 0.00 174.74 173.12 1ynt s THR 1670N 2.72 3.52 0.30 1.30 -1.32 -1.26 0.71 115.64 121.61 1ynt s THR 1670Ca 0.15 -0.47 -0.10 0.00 -1.21 0.00 0.00 61.69 60.05 1ynt s THR 1670Cb -0.14 -2.55 -0.07 0.00 -1.51 0.00 0.00 72.50 68.23 1ynt s THR 1670CO -0.22 0.47 0.63 -0.36 -2.21 0.00 0.00 174.62 172.93 1ynt s PHE 1671N 0.79 3.43 0.73 9.09 0.40 0.34 -4.97 117.98 127.80 1ynt s PHE 1671Ca -0.02 0.93 -0.16 0.00 -0.60 0.00 0.00 56.93 57.08 1ynt s PHE 1671Cb -0.15 -2.32 0.01 0.00 0.51 0.00 0.00 43.02 41.07 1ynt s PHE 1671CO 0.02 0.14 0.97 -0.35 0.70 0.00 0.00 175.22 176.70 1ynt n PRO 1672N -0.58 0.48 -2.20 0.24 -0.04 -1.26 -4.25 135.00 127.40 1ynt n PRO 1672Ca 0.01 0.22 -0.38 0.00 -0.04 0.00 0.00 63.50 63.31 1ynt n PRO 1672Cb 0.53 -2.23 -0.01 0.00 -0.04 0.00 0.00 33.50 31.75 1ynt n PRO 1672CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ynt s ALA 1673N -1.84 3.11 -0.12 0.55 0.00 -1.26 -4.81 121.76 117.39 1ynt s ALA 1673Ca 0.73 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.76 1ynt s ALA 1673Cb -0.34 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1ynt s ALA 1673CO 0.51 -0.68 -0.22 0.08 0.00 0.00 0.00 175.76 175.44 1ynt s VAL 1674N -1.40 2.11 -0.02 0.00 1.01 -1.04 -4.97 120.40 116.09 1ynt s VAL 1674Ca 0.59 -0.98 -0.18 0.00 0.00 0.00 0.00 61.98 61.42 1ynt s VAL 1674Cb -0.32 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 1ynt s VAL 1674CO 0.40 0.55 0.49 -0.22 0.00 0.00 0.00 175.10 176.33 1ynt s LEU 1675N 0.57 4.42 -0.20 3.92 1.98 -1.26 -1.97 118.68 126.14 1ynt s LEU 1675Ca -0.13 1.01 -0.29 0.00 -2.89 0.00 0.00 54.13 51.84 1ynt s LEU 1675Cb -0.17 -2.73 0.13 0.00 0.66 0.00 0.00 46.19 44.08 1ynt s LEU 1675CO 0.04 0.19 1.04 0.00 -1.89 0.00 0.00 176.35 175.73 1ynt s GLN 1676N -0.47 0.53 -1.48 1.98 1.03 -0.65 -4.91 119.66 115.69 1ynt s GLN 1676Ca 0.26 0.23 -0.05 0.00 0.04 0.00 0.00 55.36 55.85 1ynt s GLN 1676Cb -0.17 0.25 0.02 0.00 0.03 0.00 0.00 33.01 33.14 1ynt s GLN 1676CO 0.14 -0.14 0.47 0.43 -2.54 0.00 0.00 175.29 173.65 1ynt n SER 1677N 1.07 -5.40 -2.77 12.60 7.64 -1.26 -0.39 113.62 125.12 1ynt n SER 1677Ca -0.10 -0.25 -0.10 0.00 1.01 0.00 0.00 58.87 59.43 1ynt n SER 1677Cb 0.57 -4.40 -0.01 0.00 -1.01 0.00 0.00 64.21 59.36 1ynt n SER 1677CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ynt n ASP 1678N -2.37 -2.25 -3.88 6.43 10.43 -1.26 -4.90 116.55 118.75 1ynt n ASP 1678Ca -0.11 0.15 -0.13 0.00 2.57 0.00 0.00 54.79 57.28 1ynt n ASP 1678Cb 0.61 -1.98 -0.14 0.00 1.84 0.00 0.00 41.12 41.44 1ynt n ASP 1678CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ynt s LEU 1679N -5.56 1.94 0.36 0.64 1.43 0.48 -4.95 118.68 113.02 1ynt s LEU 1679Ca 0.12 -0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 53.08 1ynt s LEU 1679Cb -0.07 -0.04 -0.08 0.00 0.03 0.00 0.00 46.19 46.03 1ynt s LEU 1679CO 0.15 -0.00 0.75 -0.31 0.23 0.00 0.00 176.35 177.17 1ynt s TYR 1680N 0.06 3.42 -0.02 0.29 2.02 0.24 -1.64 117.35 121.72 1ynt s TYR 1680Ca -0.00 1.13 0.02 0.00 -0.37 0.00 0.00 57.07 57.85 1ynt s TYR 1680Cb -0.01 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.06 1ynt s TYR 1680CO -0.00 0.01 -0.07 0.99 -1.57 0.00 0.00 175.55 174.90 1ynt s THR 1681N -2.15 0.63 0.03 -0.71 2.01 -0.83 -2.19 115.64 112.42 1ynt s THR 1681Ca 0.53 -0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.24 1ynt s THR 1681Cb -0.10 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 1ynt s THR 1681CO 0.24 0.20 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.11 1ynt s LEU 1682N 0.15 2.25 0.06 4.42 0.20 0.65 -2.49 118.68 123.91 1ynt s LEU 1682Ca -0.02 -0.52 -0.00 0.00 0.69 0.00 0.00 54.13 54.28 1ynt s LEU 1682Cb -0.07 0.04 -0.04 0.00 -0.43 0.00 0.00 46.19 45.69 1ynt s LEU 1682CO 0.00 -0.28 -0.04 -0.94 -0.29 0.00 0.00 176.35 174.80 1ynt s SER 1683N -1.52 0.62 -0.03 3.68 1.04 -1.26 0.29 113.70 116.53 1ynt s SER 1683Ca -0.14 -0.89 -0.12 0.00 0.48 0.00 0.00 55.95 55.28 1ynt s SER 1683Cb -0.10 0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.19 1ynt s SER 1683CO -0.01 -0.49 0.25 -0.55 0.98 0.00 0.00 173.24 173.42 1ynt s SER 1684N -2.62 -0.14 0.15 7.02 0.15 -0.47 -0.51 113.70 117.28 1ynt s SER 1684Ca 0.03 0.08 0.06 0.00 0.70 0.00 0.00 55.95 56.83 1ynt s SER 1684Cb 0.03 0.33 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 1ynt s SER 1684CO -0.07 -0.36 -0.14 -0.94 1.20 0.00 0.00 173.24 172.94 1ynt s SER 1685N -1.07 2.12 0.00 5.45 1.04 0.22 -1.18 113.70 120.28 1ynt s SER 1685Ca -0.11 -0.89 -0.01 0.00 0.48 0.00 0.00 55.95 55.41 1ynt s SER 1685Cb -0.05 -0.08 -0.00 0.00 0.10 0.00 0.00 66.02 65.99 1ynt s SER 1685CO 0.03 -0.18 0.01 0.54 0.98 0.00 0.00 173.24 174.62 1ynt s VAL 1686N -2.52 0.04 -0.10 5.02 0.11 0.16 -0.52 120.40 122.59 1ynt s VAL 1686Ca 0.14 -0.29 0.01 0.00 -2.93 0.00 0.00 61.98 58.90 1ynt s VAL 1686Cb -0.03 -0.12 0.02 0.00 -1.53 0.00 0.00 36.38 34.72 1ynt s VAL 1686CO 0.04 -0.16 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.64 1ynt s THR 1687N -0.48 1.23 0.43 5.04 2.01 -1.04 0.95 115.64 123.79 1ynt s THR 1687Ca -0.05 -0.47 0.03 0.00 0.31 0.00 0.00 61.69 61.51 1ynt s THR 1687Cb -0.03 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 1ynt s THR 1687CO -0.00 0.39 0.11 -0.69 -0.69 0.00 0.00 174.62 173.74 1ynt s VAL 1688N 1.15 0.66 -0.03 3.82 1.01 0.49 -4.81 120.40 122.69 1ynt s VAL 1688Ca -0.05 -2.00 -0.30 0.00 0.00 0.00 0.00 61.98 59.63 1ynt s VAL 1688Cb -0.14 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 1ynt s VAL 1688CO -0.03 0.00 1.41 0.42 0.00 0.00 0.00 175.10 176.90 1ynt s THR 1689N -3.14 3.81 0.36 3.92 -4.23 -1.26 0.39 115.64 115.49 1ynt s THR 1689Ca 0.20 1.13 0.00 0.00 -1.18 0.00 0.00 61.69 61.84 1ynt s THR 1689Cb 0.02 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1ynt s THR 1689CO 0.13 -0.03 0.78 0.28 -0.54 0.00 0.00 174.62 175.23 1ynt h SER 1690N 8.11 0.00 0.21 3.99 0.02 -1.65 0.85 113.55 125.08 1ynt h SER 1690Ca -0.36 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.25 1ynt h SER 1690Cb 1.17 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.65 1ynt h SER 1690CO 0.92 0.00 -2.09 -1.54 -1.14 0.00 0.00 176.83 172.97 1ynt n SER 1691N -1.83 0.50 0.00 3.07 3.41 -1.26 -4.22 113.62 113.29 1ynt n SER 1691Ca -0.00 0.18 0.02 0.00 -0.26 0.00 0.00 58.87 58.81 1ynt n SER 1691Cb 0.77 0.45 0.12 0.00 -0.26 0.00 0.00 64.21 65.29 1ynt n SER 1691CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1ynt n THR 1692N -2.91 0.00 -3.72 6.66 -1.04 0.30 -4.38 114.28 109.18 1ynt n THR 1692Ca -0.27 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.61 1ynt n THR 1692Cb 1.11 -0.92 -0.10 0.00 -1.82 0.00 0.00 70.33 68.60 1ynt n THR 1692CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1ynt s TRP 1693N -2.00 -0.45 -1.84 -1.42 -0.00 -1.25 -2.34 118.94 109.64 1ynt s TRP 1693Ca 0.06 1.06 0.21 0.00 -0.00 0.00 0.00 56.10 57.42 1ynt s TRP 1693Cb 0.03 0.16 1.19 0.00 -0.00 0.00 0.00 33.47 34.85 1ynt s TRP 1693CO 0.05 -0.25 1.64 -2.30 -0.00 0.00 0.00 176.95 176.08 1ynt n PRO 1694N 2.63 0.56 0.00 5.86 -0.02 -1.26 -4.96 135.00 137.81 1ynt n PRO 1694Ca -0.14 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1ynt n PRO 1694Cb 0.57 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 1ynt n PRO 1694CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ynt n SER 1695N -1.08 0.00 -4.88 2.55 7.64 -1.26 -4.13 113.62 112.46 1ynt n SER 1695Ca 0.14 0.66 -0.30 0.00 1.01 0.00 0.00 58.87 60.38 1ynt n SER 1695Cb 0.10 -0.22 0.03 0.00 -1.01 0.00 0.00 64.21 63.10 1ynt n SER 1695CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ynt s GLN 1696N -2.01 3.21 0.04 1.43 1.11 -0.99 -5.05 119.66 117.39 1ynt s GLN 1696Ca 0.00 0.59 0.02 0.00 0.01 0.00 0.00 55.36 55.98 1ynt s GLN 1696Cb 0.00 -2.05 -0.04 0.00 -1.01 0.00 0.00 33.01 29.91 1ynt s GLN 1696CO 0.00 -0.81 0.03 -1.54 0.01 0.00 0.00 175.29 172.98 1ynt s SER 1697N -4.27 5.29 -0.02 5.90 1.04 -1.26 -4.52 113.70 115.85 1ynt s SER 1697Ca 0.57 -0.02 0.08 0.00 0.48 0.00 0.00 55.95 57.05 1ynt s SER 1697Cb -0.11 -1.39 -0.02 0.00 0.10 0.00 0.00 66.02 64.60 1ynt s SER 1697CO 0.53 0.23 -0.24 -0.63 0.98 0.00 0.00 173.24 174.10 1ynt s ILE 1698N -1.22 2.19 0.00 -1.02 1.01 -1.26 -5.01 121.20 115.88 1ynt s ILE 1698Ca 0.24 -1.08 0.01 0.00 0.00 0.00 0.00 60.65 59.82 1ynt s ILE 1698Cb -0.12 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.57 1ynt s ILE 1698CO 0.15 0.57 -0.04 -0.89 0.00 0.00 0.00 174.94 174.74 1ynt s THR 1699N -0.64 0.27 -0.56 2.92 2.01 -1.26 -1.85 115.64 116.53 1ynt s THR 1699Ca 0.10 -0.22 -0.15 0.00 0.31 0.00 0.00 61.69 61.73 1ynt s THR 1699Cb -0.10 -0.25 0.14 0.00 0.01 0.00 0.00 72.50 72.30 1ynt s THR 1699CO -0.01 0.03 0.51 0.00 -0.69 0.00 0.00 174.62 174.46 1ynt s ASN 1701N 3.43 6.61 0.07 0.00 -0.87 0.11 -2.29 114.94 122.00 1ynt s ASN 1701Ca 0.04 0.42 0.08 0.00 -1.57 0.00 0.00 52.86 51.84 1ynt s ASN 1701Cb -0.28 -2.45 -0.03 0.00 -0.02 0.00 0.00 41.25 38.46 1ynt s ASN 1701CO 0.02 -0.88 -0.21 -0.69 -2.57 0.00 0.00 177.10 172.77 1ynt s VAL 1702N 3.48 2.61 -0.08 1.60 1.01 0.06 -0.24 120.40 128.85 1ynt s VAL 1702Ca 0.37 -1.38 -0.11 0.00 0.00 0.00 0.00 61.98 60.85 1ynt s VAL 1702Cb -0.12 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.17 1ynt s VAL 1702CO 0.20 0.25 0.29 0.00 0.00 0.00 0.00 175.10 175.84 1ynt s ALA 1703N -0.98 -0.71 -0.42 5.51 0.00 0.82 -0.80 121.76 125.18 1ynt s ALA 1703Ca 0.15 0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.76 1ynt s ALA 1703Cb -0.10 -0.31 0.13 0.00 0.00 0.00 0.00 23.12 22.84 1ynt s ALA 1703CO 0.06 -0.17 0.22 -1.58 0.00 0.00 0.00 175.76 174.29 1ynt s HIS 1704N -0.31 1.91 0.44 0.00 2.46 -1.06 -0.87 115.29 117.86 1ynt s HIS 1704Ca -0.04 -2.32 0.25 0.00 0.47 0.00 0.00 55.06 53.42 1ynt s HIS 1704Cb -0.03 -1.83 1.28 0.00 -0.13 0.00 0.00 32.58 31.87 1ynt s HIS 1704CO 0.01 -0.80 1.75 -1.35 -2.47 0.00 0.00 174.74 171.88 1ynt h PRO 1705N 6.89 0.23 0.00 2.88 0.11 -1.83 -0.49 132.00 139.79 1ynt h PRO 1705Ca -0.02 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 1ynt h PRO 1705Cb 0.94 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1ynt h PRO 1705CO 0.47 0.15 -0.10 0.00 -0.21 0.00 0.00 178.00 178.31 1ynt h ALA 1706N 1.56 1.32 0.00 -0.75 0.00 -1.92 -2.93 119.26 116.54 1ynt h ALA 1706Ca 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1ynt h ALA 1706Cb 1.93 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1ynt h ALA 1706CO -0.25 0.12 -0.01 -1.13 0.00 0.00 0.00 179.25 177.99 1ynt n SER 1707N -3.67 1.87 -3.74 0.00 3.41 -0.26 -4.96 113.62 106.27 1ynt n SER 1707Ca -0.02 -2.07 -0.29 0.00 -0.26 0.00 0.00 58.87 56.23 1ynt n SER 1707Cb 0.21 -0.06 0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1ynt n SER 1707CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ynt n SER 1708N -0.58 -3.76 -4.47 4.04 7.64 -0.78 -4.99 113.62 110.72 1ynt n SER 1708Ca 0.02 -0.99 -0.24 0.00 1.01 0.00 0.00 58.87 58.67 1ynt n SER 1708Cb 0.33 -3.39 -0.10 0.00 -1.01 0.00 0.00 64.21 60.04 1ynt n SER 1708CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ynt s THR 1709N -3.60 2.51 -0.22 0.44 2.01 -1.16 -5.01 115.64 110.61 1ynt s THR 1709Ca 0.32 -2.38 -0.18 0.00 0.31 0.00 0.00 61.69 59.76 1ynt s THR 1709Cb -0.11 -2.31 0.06 0.00 0.01 0.00 0.00 72.50 70.15 1ynt s THR 1709CO 0.86 -0.39 0.57 -0.54 -0.69 0.00 0.00 174.62 174.43 1ynt s LYS 1710N -3.49 0.64 0.02 4.92 1.02 -1.26 -2.56 119.74 119.03 1ynt s LYS 1710Ca 0.30 0.86 0.00 0.00 0.02 0.00 0.00 55.97 57.15 1ynt s LYS 1710Cb -0.05 0.25 -0.02 0.00 -0.52 0.00 0.00 37.83 37.49 1ynt s LYS 1710CO 0.15 -0.10 -0.04 0.08 -0.92 0.00 0.00 175.35 174.52 1ynt s VAL 1711N 0.66 0.20 -0.51 3.17 1.01 0.02 -5.00 120.40 119.95 1ynt s VAL 1711Ca -0.03 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1ynt s VAL 1711Cb -0.05 -0.32 0.17 0.00 0.00 0.00 0.00 36.38 36.18 1ynt s VAL 1711CO -0.04 -0.43 0.38 -1.81 0.00 0.00 0.00 175.10 173.20 1ynt s ASP 1712N -1.35 2.78 -0.41 3.32 -0.00 -1.26 -0.76 116.67 119.00 1ynt s ASP 1712Ca -0.13 -3.27 -0.26 0.00 -0.00 0.00 0.00 52.55 48.89 1ynt s ASP 1712Cb -0.09 -0.88 0.02 0.00 -0.00 0.00 0.00 42.92 41.97 1ynt s ASP 1712CO -0.01 -0.15 0.96 -0.75 -0.00 0.00 0.00 175.17 175.22 1ynt s LYS 1713N -0.39 3.74 0.37 8.23 2.47 -0.97 -4.86 119.74 128.33 1ynt s LYS 1713Ca 0.29 0.47 -0.22 0.00 -1.56 0.00 0.00 55.97 54.94 1ynt s LYS 1713Cb -0.02 -3.85 -0.10 0.00 -1.46 0.00 0.00 37.83 32.40 1ynt s LYS 1713CO -0.17 -1.08 0.92 0.21 0.16 0.00 0.00 175.35 175.39 1ynt s LYS 1714N 3.68 4.33 -0.17 4.03 2.20 -1.26 -1.41 119.74 131.14 1ynt s LYS 1714Ca 0.39 1.14 -0.18 0.00 -0.36 0.00 0.00 55.97 56.96 1ynt s LYS 1714Cb -0.11 -2.46 -0.04 0.00 -1.51 0.00 0.00 37.83 33.72 1ynt s LYS 1714CO 0.22 0.12 0.47 0.42 -0.36 0.00 0.00 175.35 176.23 1ynt s ILE 1715N -1.93 5.16 0.18 5.43 -1.09 -0.77 -4.89 121.20 123.29 1ynt s ILE 1715Ca 0.56 0.89 0.10 0.00 -2.23 0.00 0.00 60.65 59.98 1ynt s ILE 1715Cb -0.13 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 1ynt s ILE 1715CO 0.18 0.25 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.34 1ynt s GLU 1716N 1.16 1.72 1.00 2.79 0.41 -1.26 -4.64 118.70 119.87 1ynt s GLU 1716Ca 0.24 -1.40 -0.14 0.00 -0.41 0.00 0.00 54.97 53.25 1ynt s GLU 1716Cb -0.15 -1.98 0.19 0.00 -1.78 0.00 0.00 34.13 30.41 1ynt s GLU 1716CO 0.09 0.42 1.15 -1.25 -0.49 0.00 0.00 175.26 175.18 1ynt s PRO 1717N -2.64 0.42 0.00 0.39 0.04 -1.26 -4.70 135.00 127.25 1ynt s PRO 1717Ca 0.21 0.15 0.27 0.00 0.04 0.00 0.00 61.00 61.68 1ynt s PRO 1717Cb -0.09 -1.77 0.75 0.00 0.04 0.00 0.00 34.50 33.43 1ynt s PRO 1717CO 0.11 -2.66 1.57 0.54 0.04 0.00 0.00 177.00 176.61