#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uyt s ILE 1483N 0.00 1.38 -0.71 4.25 -4.36 -1.26 -4.90 121.20 115.60 1uyt s ILE 1483Ca 0.00 -0.88 -0.04 0.00 -0.26 0.00 0.00 60.65 59.48 1uyt s ILE 1483Cb 0.00 -1.18 0.01 0.00 1.25 0.00 0.00 42.46 42.54 1uyt s ILE 1483CO 0.00 0.28 0.66 0.00 0.24 0.00 0.00 174.94 176.13 1uyt n ALA 1484N 2.36 -2.63 -2.67 2.27 0.00 -1.26 -5.02 120.51 113.56 1uyt n ALA 1484Ca -0.16 0.08 -0.32 0.00 0.00 0.00 0.00 53.44 53.04 1uyt n ALA 1484Cb 0.54 -1.58 -0.09 0.00 0.00 0.00 0.00 19.45 18.32 1uyt n ALA 1484CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1uyt s THR 1485N -2.88 4.06 0.24 0.00 -4.23 -1.26 -5.03 115.64 106.54 1uyt s THR 1485Ca 0.05 -0.74 -0.07 0.00 -1.18 0.00 0.00 61.69 59.74 1uyt s THR 1485Cb -0.01 -2.85 0.26 0.00 1.34 0.00 0.00 72.50 71.25 1uyt s THR 1485CO 0.80 0.30 1.64 -0.65 -0.54 0.00 0.00 174.62 176.16 1uyt h PRO 1486N 4.07 0.11 -5.80 3.99 0.11 -2.05 -3.42 132.00 129.01 1uyt h PRO 1486Ca -0.48 -0.01 -0.61 0.00 0.11 0.00 0.00 66.00 65.01 1uyt h PRO 1486Cb 1.17 -0.03 -0.12 0.00 0.11 0.00 0.00 31.00 32.14 1uyt h PRO 1486CO 0.58 0.07 -0.58 0.71 -0.21 0.00 0.00 178.00 178.57 1uyt s TYR 1487N -6.11 2.53 0.14 0.65 1.51 -1.26 -5.09 117.35 109.72 1uyt s TYR 1487Ca -0.13 -0.60 -0.33 0.00 -1.01 0.00 0.00 57.07 55.00 1uyt s TYR 1487Cb 0.22 -1.74 -0.13 0.00 -0.11 0.00 0.00 41.96 40.20 1uyt s TYR 1487CO 0.75 0.40 1.67 -2.30 -1.11 0.00 0.00 175.55 174.96 1uyt n PRO 1488N -1.02 2.35 -1.90 -1.71 -0.02 -1.26 -4.88 135.00 126.57 1uyt n PRO 1488Ca -0.04 0.85 -0.37 0.00 -2.02 0.00 0.00 63.50 61.92 1uyt n PRO 1488Cb 0.65 -2.66 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 1uyt n PRO 1488CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1uyt s VAL 1489N 1.48 3.25 0.19 -1.45 1.01 -1.26 -4.87 120.40 118.75 1uyt s VAL 1489Ca 0.80 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.79 1uyt s VAL 1489Cb -0.62 -3.66 0.12 0.00 0.00 0.00 0.00 36.38 32.21 1uyt s VAL 1489CO 0.38 -0.64 1.72 0.11 0.00 0.00 0.00 175.10 176.67 1uyt h LYS 1490N 16.24 0.28 0.00 2.72 1.57 -1.95 -0.05 116.57 135.38 1uyt h LYS 1490Ca -0.24 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1uyt h LYS 1490Cb 1.19 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1uyt h LYS 1490CO 1.20 0.18 0.01 0.39 -0.57 0.00 0.00 179.45 180.66 1uyt n GLU 1491N -5.08 0.14 -0.08 3.15 1.02 -1.26 -1.00 120.64 117.54 1uyt n GLU 1491Ca 0.07 0.64 -0.22 0.00 -0.02 0.00 0.00 57.16 57.62 1uyt n GLU 1491Cb 0.25 -1.98 -0.12 0.00 -0.02 0.00 0.00 31.44 29.58 1uyt n GLU 1491CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1uyt n TRP 1492N -2.27 0.74 0.28 -0.32 -0.00 -0.11 -1.95 117.44 113.81 1uyt n TRP 1492Ca -0.01 0.22 0.13 0.00 -0.00 0.00 0.00 57.50 57.84 1uyt n TRP 1492Cb 0.04 -1.09 0.82 0.00 -0.00 0.00 0.00 31.31 31.08 1uyt n TRP 1492CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1uyt h LEU 1493N -0.42 0.00 -6.16 5.87 3.38 -0.63 -3.32 115.31 114.04 1uyt h LEU 1493Ca -0.48 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.08 1uyt h LEU 1493Cb 1.74 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 42.18 1uyt h LEU 1493CO -0.12 0.06 -0.75 -1.10 0.09 0.00 0.00 178.44 176.63 1uyt s GLN 1494N -4.48 0.77 0.59 1.13 -0.21 -0.17 -5.01 119.66 112.29 1uyt s GLN 1494Ca -0.04 -1.26 0.29 0.00 0.02 0.00 0.00 55.36 54.36 1uyt s GLN 1494Cb 0.14 -0.84 1.38 0.00 1.00 0.00 0.00 33.01 34.70 1uyt s GLN 1494CO 0.57 -1.27 1.78 -1.35 -2.12 0.00 0.00 175.29 172.90 1uyt h PRO 1495N 6.35 0.00 -0.98 2.91 0.11 -1.50 0.08 132.00 138.97 1uyt h PRO 1495Ca 0.11 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.29 1uyt h PRO 1495Cb 1.02 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 1uyt h PRO 1495CO 0.22 0.00 0.62 0.87 -0.21 0.00 0.00 178.00 179.50 1uyt h LYS 1496N 0.00 1.08 -0.90 1.05 1.57 -1.93 -0.69 116.57 116.75 1uyt h LYS 1496Ca 0.29 -0.07 0.08 0.00 -1.87 0.00 0.00 60.65 59.08 1uyt h LYS 1496Cb 1.58 -0.24 -0.07 0.00 0.08 0.00 0.00 32.23 33.57 1uyt h LYS 1496CO -0.00 0.72 0.56 -0.09 -0.57 0.00 0.00 179.45 180.06 1uyt h ARG 1497N 1.12 0.94 -0.30 3.15 2.43 -1.25 0.19 114.38 120.65 1uyt h ARG 1497Ca 0.43 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.50 1uyt h ARG 1497Cb 0.21 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1uyt h ARG 1497CO -0.19 0.62 0.01 -0.92 -1.51 0.00 0.00 179.97 177.98 1uyt h TYR 1498N 0.97 0.57 -0.58 2.20 -0.00 -1.30 -2.10 116.97 116.72 1uyt h TYR 1498Ca 0.42 -0.10 0.06 0.00 -0.00 0.00 0.00 58.73 59.11 1uyt h TYR 1498Cb 0.28 -0.15 -0.05 0.00 -0.00 0.00 0.00 36.73 36.81 1uyt h TYR 1498CO -0.03 0.66 0.29 -0.22 -0.00 0.00 0.00 178.16 178.85 1uyt h LYS 1499N 0.32 0.52 -0.73 1.82 3.64 -0.18 0.10 116.57 122.06 1uyt h LYS 1499Ca 0.09 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1uyt h LYS 1499Cb 0.42 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1uyt h LYS 1499CO 0.01 0.34 0.24 0.00 -2.27 0.00 0.00 179.45 177.77 1uyt h ALA 1500N 1.33 1.05 -0.48 5.00 0.00 -0.56 -2.24 119.26 123.36 1uyt h ALA 1500Ca 0.27 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1uyt h ALA 1500Cb 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1uyt h ALA 1500CO -0.20 0.65 -0.18 0.45 0.00 0.00 0.00 179.25 179.97 1uyt h HIS 1501N 1.08 1.08 -0.60 0.00 3.86 -0.67 -2.03 115.15 117.88 1uyt h HIS 1501Ca 0.24 -0.24 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1uyt h HIS 1501Cb 0.28 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 1uyt h HIS 1501CO 0.02 1.04 0.40 -0.07 0.86 0.00 0.00 177.93 180.18 1uyt h LEU 1502N 0.84 0.66 -0.11 2.43 3.38 -0.71 0.18 115.31 121.97 1uyt h LEU 1502Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1uyt h LEU 1502Cb 0.73 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1uyt h LEU 1502CO 0.06 0.47 0.00 0.80 0.09 0.00 0.00 178.44 179.85 1uyt n MET 1503N -4.45 0.03 -1.58 1.13 1.56 -0.82 -4.86 117.12 108.12 1uyt n MET 1503Ca 0.06 0.32 0.00 0.00 -0.27 0.00 0.00 57.70 57.81 1uyt n MET 1503Cb 0.08 -1.55 0.00 0.00 2.15 0.00 0.00 33.22 33.90 1uyt n MET 1503CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1uyt n GLY 1504N -0.25 0.43 3.12 -5.12 0.00 0.62 -4.95 105.19 99.03 1uyt n GLY 1504Ca 0.03 -0.92 -0.07 0.00 0.00 0.00 0.00 46.02 45.05 1uyt n GLY 1504CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1uyt s THR 1505N -2.00 0.20 0.50 2.61 -1.32 -0.87 -4.88 115.64 109.88 1uyt s THR 1505Ca 0.00 -1.64 -0.20 0.00 -1.21 0.00 0.00 61.69 58.64 1uyt s THR 1505Cb 0.00 -1.46 -0.07 0.00 -1.51 0.00 0.00 72.50 69.45 1uyt s THR 1505CO 0.00 -0.91 1.08 -0.89 -2.21 0.00 0.00 174.62 171.69 1uyt s THR 1506N -3.87 3.54 0.02 5.08 2.01 -1.26 -3.27 115.64 117.87 1uyt s THR 1506Ca 0.06 0.97 -0.30 0.00 0.31 0.00 0.00 61.69 62.73 1uyt s THR 1506Cb 0.07 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.13 1uyt s THR 1506CO -0.10 -0.19 1.28 -0.47 -0.69 0.00 0.00 174.62 174.44 1uyt s TYR 1507N -1.88 3.18 0.31 4.92 6.04 -1.26 -4.91 117.35 123.75 1uyt s TYR 1507Ca 0.69 1.10 0.03 0.00 0.04 0.00 0.00 57.07 58.93 1uyt s TYR 1507Cb -0.20 -3.52 0.81 0.00 -1.04 0.00 0.00 41.96 38.01 1uyt s TYR 1507CO 0.23 -1.74 1.57 1.55 -1.54 0.00 0.00 175.55 175.62 1uyt n VAL 1508N 4.34 -0.42 0.67 3.14 3.14 -1.26 0.98 118.33 128.91 1uyt n VAL 1508Ca 0.11 2.19 0.09 0.00 -2.96 0.00 0.00 64.34 63.76 1uyt n VAL 1508Cb 0.45 -3.22 0.39 0.00 -1.06 0.00 0.00 33.84 30.41 1uyt n VAL 1508CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1uyt n TYR 1509N -5.48 0.00 0.41 1.45 4.02 -1.26 -2.22 117.16 114.08 1uyt n TYR 1509Ca 0.25 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.25 1uyt n TYR 1509Cb 0.81 -0.44 0.04 0.00 -0.02 0.00 0.00 39.34 39.72 1uyt n TYR 1509CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1uyt n ASP 1510N -1.44 0.65 -0.37 7.72 10.43 0.27 -4.32 116.55 129.49 1uyt n ASP 1510Ca 0.05 0.01 0.04 0.00 2.57 0.00 0.00 54.79 57.47 1uyt n ASP 1510Cb 0.19 0.65 0.20 0.00 1.84 0.00 0.00 41.12 44.00 1uyt n ASP 1510CO 0.00 0.00 0.00 -0.26 -1.07 0.00 0.00 177.20 175.87 1uyt h PHE 1511N 0.00 1.19 -0.90 1.24 -1.00 -1.33 -1.64 116.94 114.50 1uyt h PHE 1511Ca 0.00 0.03 0.11 0.00 2.81 0.00 0.00 57.97 60.92 1uyt h PHE 1511Cb 0.82 -0.38 -0.07 0.00 3.61 0.00 0.00 35.95 39.93 1uyt h PHE 1511CO 0.00 0.56 0.58 -1.35 -1.61 0.00 0.00 178.31 176.48 1uyt h PRO 1512N 1.11 0.83 -0.55 1.51 0.11 -1.77 0.36 132.00 133.60 1uyt h PRO 1512Ca 0.46 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.49 1uyt h PRO 1512Cb 0.30 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.20 1uyt h PRO 1512CO -0.21 0.55 0.20 1.49 -0.21 0.00 0.00 178.00 179.82 1uyt h GLU 1513N 0.86 0.80 -0.07 1.05 4.57 -1.57 -1.88 114.58 118.33 1uyt h GLU 1513Ca 0.43 -0.13 -0.08 0.00 -1.18 0.00 0.00 59.36 58.40 1uyt h GLU 1513Cb 0.47 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 1uyt h GLU 1513CO -0.19 0.67 -0.33 -0.07 -1.18 0.00 0.00 179.01 177.90 1uyt h LEU 1514N 0.79 0.13 -0.52 1.64 3.38 -0.83 -1.32 115.31 118.58 1uyt h LEU 1514Ca 0.19 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 1uyt h LEU 1514Cb 0.18 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1uyt h LEU 1514CO -0.01 0.47 -0.62 -0.26 0.09 0.00 0.00 178.44 178.10 1uyt h PHE 1515N 0.12 0.55 0.06 1.13 -1.00 -0.83 -0.73 116.94 116.23 1uyt h PHE 1515Ca 0.01 -0.21 -0.00 0.00 2.81 0.00 0.00 57.97 60.58 1uyt h PHE 1515Cb 0.65 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.12 1uyt h PHE 1515CO 0.01 0.93 -0.03 -0.09 -1.61 0.00 0.00 178.31 177.52 1uyt h ARG 1516N 0.32 -0.07 -0.65 1.51 2.43 -0.95 0.24 114.38 117.22 1uyt h ARG 1516Ca -0.01 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1uyt h ARG 1516Cb 1.16 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.69 1uyt h ARG 1516CO 0.11 0.10 0.41 1.96 -1.51 0.00 0.00 179.97 181.03 1uyt h GLN 1517N -0.23 0.78 -0.40 0.20 4.20 -1.18 0.98 115.11 119.46 1uyt h GLN 1517Ca -0.01 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 1uyt h GLN 1517Cb 0.20 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1uyt h GLN 1517CO 0.01 0.52 -0.06 0.00 -0.67 0.00 0.00 178.83 178.63 1uyt h ALA 1518N 1.27 1.17 -0.12 3.87 0.00 -0.95 -1.29 119.26 123.21 1uyt h ALA 1518Ca 0.25 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1uyt h ALA 1518Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1uyt h ALA 1518CO -0.09 0.54 -0.51 0.77 0.00 0.00 0.00 179.25 179.95 1uyt h SER 1519N 0.62 0.35 -0.39 0.00 0.02 0.48 -2.07 113.55 112.56 1uyt h SER 1519Ca 0.12 -0.18 -0.08 0.00 -0.84 0.00 0.00 61.79 60.81 1uyt h SER 1519Cb 0.47 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1uyt h SER 1519CO 0.02 0.80 -0.06 -1.28 -1.14 0.00 0.00 176.83 175.17 1uyt h SER 1520N 0.25 0.74 -0.55 3.07 0.87 -0.36 -2.74 113.55 114.84 1uyt h SER 1520Ca 0.01 -0.35 -0.02 0.00 -1.23 0.00 0.00 61.79 60.20 1uyt h SER 1520Cb 0.99 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.72 1uyt h SER 1520CO 0.08 0.91 0.29 0.28 -0.53 0.00 0.00 176.83 177.86 1uyt h SER 1521N 0.55 0.72 -0.32 6.23 0.02 -1.06 -1.25 113.55 118.45 1uyt h SER 1521Ca 0.10 -0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 1uyt h SER 1521Cb 0.57 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 1uyt h SER 1521CO 0.03 0.61 0.11 -0.61 -1.14 0.00 0.00 176.83 175.83 1uyt h GLN 1522N 0.81 0.24 -0.28 3.45 4.15 -1.09 -1.66 115.11 120.73 1uyt h GLN 1522Ca 0.20 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.59 1uyt h GLN 1522Cb 0.07 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1uyt h GLN 1522CO -0.03 0.16 0.11 -1.49 -1.93 0.00 0.00 178.83 175.65 1uyt h TRP 1523N 0.25 0.43 -1.01 3.99 4.06 -1.13 -1.84 115.95 120.70 1uyt h TRP 1523Ca 0.14 -0.03 0.22 0.00 2.06 0.00 0.00 58.89 61.28 1uyt h TRP 1523Cb 0.11 -0.13 -0.11 0.00 -1.00 0.00 0.00 29.16 28.03 1uyt h TRP 1523CO -0.14 0.43 0.61 -0.22 -3.56 0.00 0.00 178.44 175.57 1uyt h LYS 1524N 0.30 0.60 -0.01 0.49 3.64 -0.78 0.10 116.57 120.92 1uyt h LYS 1524Ca 0.09 -0.04 -0.24 0.00 -1.27 0.00 0.00 60.65 59.20 1uyt h LYS 1524Cb 0.18 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1uyt h LYS 1524CO -0.01 0.40 -0.96 -0.91 -2.27 0.00 0.00 179.45 175.70 1uyt h ASN 1525N 0.62 0.64 0.57 4.20 4.21 -1.03 -3.02 115.58 121.77 1uyt h ASN 1525Ca 0.60 -0.51 -0.03 0.00 1.21 0.00 0.00 56.30 57.58 1uyt h ASN 1525Cb 1.13 -0.20 0.01 0.00 -1.12 0.00 0.00 38.32 38.14 1uyt h ASN 1525CO -0.40 1.31 -0.28 0.15 -1.29 0.00 0.00 177.43 176.92 1uyt h PHE 1526N 0.28 -0.72 -2.95 1.19 3.04 -0.11 -3.42 116.94 114.26 1uyt h PHE 1526Ca -0.09 -0.02 -0.55 0.00 3.98 0.00 0.00 57.97 61.29 1uyt h PHE 1526Cb 1.60 0.24 -0.40 0.00 2.56 0.00 0.00 35.95 39.94 1uyt h PHE 1526CO 0.07 -0.44 -0.77 0.45 -2.02 0.00 0.00 178.31 175.60 1uyt s SER 1527N -4.50 3.76 0.17 0.41 0.15 0.14 -4.99 113.70 108.85 1uyt s SER 1527Ca -0.11 -1.45 0.11 0.00 0.70 0.00 0.00 55.95 55.20 1uyt s SER 1527Cb 0.01 -0.58 0.58 0.00 -1.71 0.00 0.00 66.02 64.32 1uyt s SER 1527CO 0.34 -0.43 1.30 0.00 1.20 0.00 0.00 173.24 175.65 1uyt n ALA 1528N 5.07 0.95 -0.06 5.45 0.00 -1.14 -2.88 120.51 127.89 1uyt n ALA 1528Ca -0.04 0.10 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 1uyt n ALA 1528Cb 0.42 -1.08 -0.13 0.00 0.00 0.00 0.00 19.45 18.66 1uyt n ALA 1528CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1uyt h ASP 1529N 0.00 0.09 -1.16 0.00 3.45 -1.90 -3.48 116.42 113.41 1uyt h ASP 1529Ca 0.00 -0.79 -0.73 0.00 0.43 0.00 0.00 57.03 55.95 1uyt h ASP 1529Cb 0.09 -0.03 0.07 0.00 -0.56 0.00 0.00 39.33 38.91 1uyt h ASP 1529CO 0.00 1.32 -0.07 1.33 -1.57 0.00 0.00 179.24 180.24 1uyt n VAL 1530N -4.40 0.74 -3.43 -1.35 0.24 -1.14 -4.93 118.33 104.07 1uyt n VAL 1530Ca -0.21 -0.18 -0.39 0.00 -2.04 0.00 0.00 64.34 61.51 1uyt n VAL 1530Cb 0.65 -0.15 -0.09 0.00 -1.47 0.00 0.00 33.84 32.77 1uyt n VAL 1530CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1uyt s LYS 1531N -0.34 3.84 0.14 7.34 1.02 -1.26 -4.98 119.74 125.50 1uyt s LYS 1531Ca 0.80 -0.18 -0.17 0.00 0.02 0.00 0.00 55.97 56.43 1uyt s LYS 1531Cb -1.09 -3.71 -0.07 0.00 -0.52 0.00 0.00 37.83 32.43 1uyt s LYS 1531CO 0.56 -0.35 0.60 -1.17 -0.92 0.00 0.00 175.35 174.07 1uyt s LEU 1532N 2.00 4.41 0.06 3.17 2.96 -1.26 -5.09 118.68 124.93 1uyt s LEU 1532Ca 0.13 1.23 0.05 0.00 -0.22 0.00 0.00 54.13 55.32 1uyt s LEU 1532Cb -0.16 -3.22 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 1uyt s LEU 1532CO 0.11 0.14 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.32 1uyt s THR 1533N -1.36 3.56 -1.16 3.68 2.01 -1.26 -5.00 115.64 116.12 1uyt s THR 1533Ca 0.36 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.36 1uyt s THR 1533Cb -0.17 -2.62 0.01 0.00 0.01 0.00 0.00 72.50 69.74 1uyt s THR 1533CO 0.20 0.24 0.96 0.47 -0.69 0.00 0.00 174.62 175.80 1uyt n ASP 1534N 1.08 0.00 -0.58 3.53 8.00 -1.26 -1.34 116.55 125.98 1uyt n ASP 1534Ca -0.14 0.42 0.05 0.00 0.71 0.00 0.00 54.79 55.83 1uyt n ASP 1534Cb 0.52 -0.42 0.15 0.00 -0.02 0.00 0.00 41.12 41.35 1uyt n ASP 1534CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1uyt n ASP 1535N -1.42 1.69 0.03 -2.24 5.75 -1.26 -3.39 116.55 115.70 1uyt n ASP 1535Ca 0.00 -1.99 0.12 0.00 -0.01 0.00 0.00 54.79 52.91 1uyt n ASP 1535Cb 0.01 -0.21 0.21 0.00 -1.03 0.00 0.00 41.12 40.11 1uyt n ASP 1535CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 1uyt n PHE 1536N 0.42 0.26 -3.84 2.11 1.16 -0.45 -4.77 117.46 112.36 1uyt n PHE 1536Ca 0.11 0.08 -0.23 0.00 -1.87 0.00 0.00 57.45 55.53 1uyt n PHE 1536Cb 0.27 -0.45 -0.17 0.00 -1.61 0.00 0.00 39.48 37.51 1uyt n PHE 1536CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 1uyt s PHE 1537N -3.09 0.77 -0.05 2.97 2.19 -1.22 -1.42 117.98 118.14 1uyt s PHE 1537Ca 0.08 -0.24 0.04 0.00 0.33 0.00 0.00 56.93 57.14 1uyt s PHE 1537Cb 0.16 -0.83 0.00 0.00 -1.31 0.00 0.00 43.02 41.03 1uyt s PHE 1537CO 0.71 -0.33 -0.16 0.42 1.83 0.00 0.00 175.22 177.69 1uyt s ILE 1538N 1.80 1.33 -0.23 3.12 1.01 -0.45 -5.01 121.20 122.77 1uyt s ILE 1538Ca 0.03 -0.65 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 1uyt s ILE 1538Cb -0.13 -1.16 0.06 0.00 0.01 0.00 0.00 42.46 41.25 1uyt s ILE 1538CO -0.05 0.39 -0.03 -0.55 0.00 0.00 0.00 174.94 174.70 1uyt s SER 1539N 0.18 3.66 -0.25 3.58 0.15 -1.26 -1.62 113.70 118.14 1uyt s SER 1539Ca -0.06 -1.12 -0.06 0.00 0.70 0.00 0.00 55.95 55.42 1uyt s SER 1539Cb -0.12 -1.05 -0.00 0.00 -1.71 0.00 0.00 66.02 63.13 1uyt s SER 1539CO 0.03 -0.25 0.02 0.20 1.20 0.00 0.00 173.24 174.44 1uyt s ASN 1540N 1.49 4.78 0.68 5.45 0.01 -0.49 -4.92 114.94 121.94 1uyt s ASN 1540Ca -0.04 -0.49 -0.17 0.00 -0.71 0.00 0.00 52.86 51.45 1uyt s ASN 1540Cb -0.18 -1.83 0.01 0.00 0.41 0.00 0.00 41.25 39.66 1uyt s ASN 1540CO -0.07 -0.09 1.26 -0.70 -1.51 0.00 0.00 177.10 175.99 1uyt s GLU 1541N 1.51 2.36 -0.09 -0.60 2.12 -1.22 -0.47 118.70 122.30 1uyt s GLU 1541Ca 0.04 1.95 0.04 0.00 0.36 0.00 0.00 54.97 57.37 1uyt s GLU 1541Cb -0.16 -1.84 0.00 0.00 0.26 0.00 0.00 34.13 32.40 1uyt s GLU 1541CO 0.00 -1.72 -0.23 -0.51 -0.54 0.00 0.00 175.26 172.27 1uyt s LEU 1542N -4.70 2.03 0.06 2.70 1.43 0.40 -1.65 118.68 118.96 1uyt s LEU 1542Ca 0.79 -0.52 -0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1uyt s LEU 1542Cb -0.34 -1.33 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 1uyt s LEU 1542CO 0.42 0.15 0.04 0.27 0.23 0.00 0.00 176.35 177.46 1uyt s ILE 1543N 0.31 0.19 0.20 -0.59 -4.36 -1.01 -4.23 121.20 111.72 1uyt s ILE 1543Ca -0.16 -1.60 -0.30 0.00 -0.26 0.00 0.00 60.65 58.33 1uyt s ILE 1543Cb -0.17 -1.45 -0.08 0.00 1.25 0.00 0.00 42.46 42.01 1uyt s ILE 1543CO 0.08 -0.88 0.93 -1.61 0.24 0.00 0.00 174.94 173.69 1uyt s GLU 1544N -3.87 4.80 0.00 0.37 2.02 -1.26 -1.38 118.70 119.37 1uyt s GLU 1544Ca 0.06 1.45 0.00 0.00 0.02 0.00 0.00 54.97 56.50 1uyt s GLU 1544Cb 0.07 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 31.00 1uyt s GLU 1544CO -0.10 0.45 0.00 -0.40 0.02 0.00 0.00 175.26 175.23 1uyt n ASP 1545N 1.81 0.00 -0.30 -0.19 3.85 0.60 -4.83 116.55 117.50 1uyt n ASP 1545Ca -0.01 0.00 -0.05 0.00 -0.71 0.00 0.00 54.79 54.01 1uyt n ASP 1545Cb 0.48 0.00 0.07 0.00 -1.35 0.00 0.00 41.12 40.32 1uyt n ASP 1545CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1uyt h GLU 1546N 0.00 1.21 -0.10 0.11 5.08 -1.97 -2.03 114.58 116.88 1uyt h GLU 1546Ca 0.00 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1uyt h GLU 1546Cb 0.00 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.04 1uyt h GLU 1546CO 0.00 0.96 0.00 0.09 -1.00 0.00 0.00 179.01 179.06 1uyt n ASN 1547N -4.29 0.74 -0.35 1.42 5.03 -1.26 -4.87 115.26 111.68 1uyt n ASN 1547Ca 0.08 -1.73 -0.05 0.00 0.87 0.00 0.00 54.58 53.75 1uyt n ASN 1547Cb 0.17 -0.07 -0.02 0.00 -1.02 0.00 0.00 39.78 38.84 1uyt n ASN 1547CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1uyt n GLY 1548N 0.85 0.72 3.86 7.41 0.00 -0.76 -5.01 105.19 112.26 1uyt n GLY 1548Ca 0.11 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 1uyt n GLY 1548CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uyt s GLU 1549N -1.99 3.63 0.18 1.61 0.41 -1.26 -4.64 118.70 116.64 1uyt s GLU 1549Ca 0.00 0.04 -0.30 0.00 -0.41 0.00 0.00 54.97 54.30 1uyt s GLU 1549Cb 0.00 -3.21 -0.08 0.00 -1.78 0.00 0.00 34.13 29.06 1uyt s GLU 1549CO 0.00 0.72 1.24 -0.51 -0.49 0.00 0.00 175.26 176.23 1uyt s LEU 1550N -0.96 4.43 0.03 1.80 1.43 -1.26 -0.29 118.68 123.86 1uyt s LEU 1550Ca 0.18 2.28 -0.06 0.00 -1.03 0.00 0.00 54.13 55.49 1uyt s LEU 1550Cb -0.13 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 1uyt s LEU 1550CO 0.07 -0.45 0.11 0.42 0.23 0.00 0.00 176.35 176.73 1uyt s THR 1551N 0.14 0.12 -0.18 5.49 -4.23 -0.48 -4.94 115.64 111.57 1uyt s THR 1551Ca 0.55 -0.98 -0.29 0.00 -1.18 0.00 0.00 61.69 59.79 1uyt s THR 1551Cb -0.34 -0.77 -0.00 0.00 1.34 0.00 0.00 72.50 72.73 1uyt s THR 1551CO 0.36 -0.54 1.10 -1.61 -0.54 0.00 0.00 174.62 173.39 1uyt s GLU 1552N -2.29 4.29 0.08 3.99 2.02 -1.26 -2.39 118.70 123.14 1uyt s GLU 1552Ca -0.08 1.46 0.07 0.00 0.02 0.00 0.00 54.97 56.44 1uyt s GLU 1552Cb -0.03 -3.64 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 1uyt s GLU 1552CO -0.03 -0.58 -0.18 0.14 0.02 0.00 0.00 175.26 174.63 1uyt s VAL 1553N 2.97 1.46 -0.82 2.63 -7.23 -0.66 -5.00 120.40 113.76 1uyt s VAL 1553Ca 0.48 -1.35 0.01 0.00 -1.81 0.00 0.00 61.98 59.32 1uyt s VAL 1553Cb -0.18 -1.33 0.20 0.00 0.56 0.00 0.00 36.38 35.63 1uyt s VAL 1553CO 0.11 -0.05 0.68 1.21 -0.31 0.00 0.00 175.10 176.74 1uyt n GLU 1554N 1.37 2.35 -2.83 4.82 2.13 -1.26 -3.46 120.64 123.76 1uyt n GLU 1554Ca -0.19 -4.50 -0.16 0.00 0.66 0.00 0.00 57.16 52.97 1uyt n GLU 1554Cb 0.54 -2.36 0.02 0.00 0.27 0.00 0.00 31.44 29.90 1uyt n GLU 1554CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1uyt n ARG 1555N 2.09 0.88 -3.27 5.31 1.85 -1.26 -5.11 116.66 117.15 1uyt n ARG 1555Ca 0.21 -2.25 -0.38 0.00 -1.00 0.00 0.00 57.85 54.43 1uyt n ARG 1555Cb 0.36 0.12 -0.06 0.00 -1.05 0.00 0.00 32.46 31.83 1uyt n ARG 1555CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1uyt s GLU 1556N -3.60 4.29 0.43 2.89 0.41 -1.26 -5.04 118.70 116.83 1uyt s GLU 1556Ca 0.27 0.59 -0.22 0.00 -0.41 0.00 0.00 54.97 55.21 1uyt s GLU 1556Cb -0.02 -3.38 -0.12 0.00 -1.78 0.00 0.00 34.13 28.83 1uyt s GLU 1556CO 0.17 0.29 0.54 -2.30 -0.49 0.00 0.00 175.26 173.48 1uyt n PRO 1557N 3.10 0.57 -0.63 0.39 -0.02 -1.26 -3.23 135.00 133.93 1uyt n PRO 1557Ca -0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1uyt n PRO 1557Cb 0.51 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 1uyt n PRO 1557CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uyt n GLY 1558N 1.79 0.70 0.00 -1.23 0.00 -1.26 -4.94 105.19 100.25 1uyt n GLY 1558Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 1uyt n GLY 1558CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uyt n ALA 1559N -0.11 4.20 -1.66 4.61 0.00 -1.20 -4.96 120.51 121.39 1uyt n ALA 1559Ca 0.00 -0.49 -0.55 0.00 0.00 0.00 0.00 53.44 52.40 1uyt n ALA 1559Cb 0.00 -0.93 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 1uyt n ALA 1559CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1uyt n ASN 1560N -1.51 2.12 0.13 0.00 2.04 -1.26 -4.84 115.26 111.93 1uyt n ASN 1560Ca 0.05 1.09 0.13 0.00 -0.44 0.00 0.00 54.58 55.40 1uyt n ASN 1560Cb 0.34 -1.17 0.38 0.00 -2.53 0.00 0.00 39.78 36.80 1uyt n ASN 1560CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1uyt h ALA 1561N 6.18 1.00 -1.29 -2.53 0.00 -1.93 -3.46 119.26 117.23 1uyt h ALA 1561Ca -0.47 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 53.85 1uyt h ALA 1561Cb 1.32 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.98 1uyt h ALA 1561CO 0.89 0.00 -0.54 0.96 0.00 0.00 0.00 179.25 180.56 1uyt s ILE 1562N -3.16 1.02 -0.28 0.00 -4.36 -1.26 -5.04 121.20 108.12 1uyt s ILE 1562Ca 0.09 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 1uyt s ILE 1562Cb 0.11 -2.43 0.35 0.00 1.25 0.00 0.00 42.46 41.74 1uyt s ILE 1562CO 0.59 0.00 1.63 0.61 0.24 0.00 0.00 174.94 178.01 1uyt n GLY 1563N -0.99 3.63 3.03 6.27 0.00 -1.26 -4.81 105.19 111.06 1uyt n GLY 1563Ca -0.10 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 45.03 1uyt n GLY 1563CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1uyt s MET 1564N -1.93 0.19 0.11 1.61 0.00 -1.26 -2.02 119.30 116.00 1uyt s MET 1564Ca 0.33 0.45 0.05 0.00 0.00 0.00 0.00 55.69 56.52 1uyt s MET 1564Cb 0.27 -0.09 -0.04 0.00 0.00 0.00 0.00 34.83 34.98 1uyt s MET 1564CO 0.05 -0.14 -0.12 0.08 0.00 0.00 0.00 175.02 174.89 1uyt s VAL 1565N 1.02 1.13 0.03 10.11 1.01 -0.32 -4.97 120.40 128.41 1uyt s VAL 1565Ca -0.07 -1.67 -0.07 0.00 0.00 0.00 0.00 61.98 60.17 1uyt s VAL 1565Cb -0.09 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 1uyt s VAL 1565CO -0.06 -0.48 0.12 0.00 0.00 0.00 0.00 175.10 174.68 1uyt s ALA 1566N -2.27 -0.17 0.02 5.51 0.00 -1.26 -0.86 121.76 122.73 1uyt s ALA 1566Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.61 1uyt s ALA 1566Cb -0.04 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.30 1uyt s ALA 1566CO 0.02 -0.31 -0.05 -0.06 0.00 0.00 0.00 175.76 175.36 1uyt s PHE 1567N -2.42 0.40 -0.23 0.00 0.40 -0.53 -0.45 117.98 115.14 1uyt s PHE 1567Ca -0.06 -0.40 -0.06 0.00 -0.60 0.00 0.00 56.93 55.81 1uyt s PHE 1567Cb -0.02 -0.25 -0.02 0.00 0.51 0.00 0.00 43.02 43.23 1uyt s PHE 1567CO -0.04 -0.11 0.02 0.21 0.70 0.00 0.00 175.22 176.01 1uyt s LYS 1568N -1.16 3.57 -0.16 0.44 2.20 0.38 -0.98 119.74 124.02 1uyt s LYS 1568Ca -0.10 -0.53 -0.03 0.00 -0.36 0.00 0.00 55.97 54.95 1uyt s LYS 1568Cb -0.08 -3.16 -0.02 0.00 -1.51 0.00 0.00 37.83 33.06 1uyt s LYS 1568CO -0.00 -0.12 -0.05 0.42 -0.36 0.00 0.00 175.35 175.23 1uyt s ILE 1569N 1.37 3.65 -0.20 5.43 1.01 -0.22 -1.40 121.20 130.84 1uyt s ILE 1569Ca 0.05 -0.44 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1uyt s ILE 1569Cb -0.15 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.73 1uyt s ILE 1569CO 0.01 0.49 -0.12 -0.89 0.00 0.00 0.00 174.94 174.42 1uyt s THR 1570N 0.55 2.68 -0.05 2.92 2.01 -0.64 -2.07 115.64 121.04 1uyt s THR 1570Ca -0.04 -0.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.19 1uyt s THR 1570Cb -0.15 -2.18 0.02 0.00 0.01 0.00 0.00 72.50 70.20 1uyt s THR 1570CO 0.03 0.48 0.11 0.54 -0.69 0.00 0.00 174.62 175.09 1uyt s VAL 1571N 1.38 -0.02 -0.07 3.82 0.11 -0.18 -1.34 120.40 124.09 1uyt s VAL 1571Ca 0.05 0.07 -0.26 0.00 -2.93 0.00 0.00 61.98 58.91 1uyt s VAL 1571Cb -0.14 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.51 1uyt s VAL 1571CO -0.08 0.03 0.84 -0.54 -3.33 0.00 0.00 175.10 172.02 1uyt s LYS 1572N 0.49 4.44 0.34 1.54 1.02 -0.51 -0.93 119.74 126.13 1uyt s LYS 1572Ca -0.04 1.12 0.04 0.00 0.02 0.00 0.00 55.97 57.11 1uyt s LYS 1572Cb -0.05 -3.49 -0.06 0.00 -0.52 0.00 0.00 37.83 33.71 1uyt s LYS 1572CO -0.02 -0.09 0.05 0.95 -0.92 0.00 0.00 175.35 175.33 1uyt s THR 1573N 1.25 1.26 0.20 2.17 -4.23 -0.05 -4.92 115.64 111.32 1uyt s THR 1573Ca 0.43 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.84 1uyt s THR 1573Cb -0.19 -2.81 0.13 0.00 1.34 0.00 0.00 72.50 70.97 1uyt s THR 1573CO 0.20 0.00 1.81 -0.65 -0.54 0.00 0.00 174.62 175.44 1uyt h PRO 1574N 2.07 0.63 -0.20 3.99 0.11 -1.96 -0.38 132.00 136.27 1uyt h PRO 1574Ca -0.41 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.56 1uyt h PRO 1574Cb 1.24 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1uyt h PRO 1574CO 0.71 0.42 -0.32 0.93 -0.21 0.00 0.00 178.00 179.53 1uyt h GLU 1575N 0.65 0.41 -2.69 1.05 3.07 -1.90 -3.36 114.58 111.81 1uyt h GLU 1575Ca 0.28 -0.17 -0.60 0.00 -0.50 0.00 0.00 59.36 58.36 1uyt h GLU 1575Cb 0.15 -0.02 -0.40 0.00 -0.84 0.00 0.00 28.75 27.65 1uyt h GLU 1575CO -0.17 0.69 -0.81 0.71 -1.40 0.00 0.00 179.01 178.03 1uyt s TYR 1576N -4.36 1.93 0.43 4.33 1.51 -0.80 -4.79 117.35 115.60 1uyt s TYR 1576Ca -0.06 -2.59 0.15 0.00 -1.01 0.00 0.00 57.07 53.56 1uyt s TYR 1576Cb 0.13 -1.60 1.04 0.00 -0.11 0.00 0.00 41.96 41.43 1uyt s TYR 1576CO 0.79 -0.74 1.96 -1.35 -1.11 0.00 0.00 175.55 175.10 1uyt h PRO 1577N 5.85 0.39 -0.01 -1.71 0.11 -1.25 0.29 132.00 135.68 1uyt h PRO 1577Ca 0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1uyt h PRO 1577Cb 0.87 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1uyt h PRO 1577CO 0.48 0.26 -0.02 0.54 -0.21 0.00 0.00 178.00 179.05 1uyt n ARG 1578N -4.47 1.40 0.00 1.05 1.74 -1.26 -4.58 116.66 110.54 1uyt n ARG 1578Ca 0.12 -0.67 0.00 0.00 -0.77 0.00 0.00 57.85 56.53 1uyt n ARG 1578Cb 0.44 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 1uyt n ARG 1578CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uyt n GLY 1579N 1.15 3.07 3.05 -0.13 0.00 -0.34 -4.86 105.19 107.14 1uyt n GLY 1579Ca 0.19 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.44 1uyt n GLY 1579CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uyt s ARG 1580N -4.25 0.50 0.22 1.61 1.70 -0.11 -4.91 118.95 113.71 1uyt s ARG 1580Ca 0.00 -0.91 0.08 0.00 -0.47 0.00 0.00 55.73 54.43 1uyt s ARG 1580Cb 0.00 0.18 -0.05 0.00 -0.57 0.00 0.00 34.95 34.51 1uyt s ARG 1580CO 0.00 -0.10 -0.13 -0.65 -1.08 0.00 0.00 175.30 173.34 1uyt s GLN 1581N -2.77 1.39 0.05 3.89 -0.21 -1.26 -1.01 119.66 119.74 1uyt s GLN 1581Ca -0.04 -1.63 -0.28 0.00 0.02 0.00 0.00 55.36 53.43 1uyt s GLN 1581Cb -0.00 -1.15 0.09 0.00 1.00 0.00 0.00 33.01 32.95 1uyt s GLN 1581CO -0.06 0.16 0.97 -0.59 -2.12 0.00 0.00 175.29 173.65 1uyt s PHE 1582N -2.96 -0.22 0.15 0.91 -0.12 -0.88 -4.27 117.98 110.58 1uyt s PHE 1582Ca 0.24 0.02 0.08 0.00 -0.05 0.00 0.00 56.93 57.22 1uyt s PHE 1582Cb -0.00 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1uyt s PHE 1582CO 0.08 -0.62 -0.10 0.14 -0.05 0.00 0.00 175.22 174.67 1uyt s VAL 1583N -3.09 3.26 -0.15 -2.49 -7.23 -0.66 -1.06 120.40 108.99 1uyt s VAL 1583Ca 0.09 -1.49 0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1uyt s VAL 1583Cb -0.01 -2.58 0.02 0.00 0.56 0.00 0.00 36.38 34.37 1uyt s VAL 1583CO -0.04 -0.02 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.89 1uyt s VAL 1584N -1.49 1.68 -0.06 1.32 1.01 -0.16 -0.39 120.40 122.31 1uyt s VAL 1584Ca 0.23 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1uyt s VAL 1584Cb -0.10 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1uyt s VAL 1584CO 0.14 0.48 -0.09 -0.69 0.00 0.00 0.00 175.10 174.94 1uyt s VAL 1585N 1.35 3.52 -0.08 2.92 1.01 0.55 -1.45 120.40 128.21 1uyt s VAL 1585Ca 0.03 -0.57 -0.20 0.00 0.00 0.00 0.00 61.98 61.24 1uyt s VAL 1585Cb -0.13 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.86 1uyt s VAL 1585CO -0.09 0.58 0.47 0.00 0.00 0.00 0.00 175.10 176.06 1uyt s ALA 1586N -0.80 -1.19 0.58 5.51 0.00 -0.04 0.14 121.76 125.95 1uyt s ALA 1586Ca 0.12 0.96 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 1uyt s ALA 1586Cb -0.11 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1uyt s ALA 1586CO 0.02 -0.28 0.99 -0.80 0.00 0.00 0.00 175.76 175.69 1uyt s ASN 1587N -0.73 6.33 -0.50 0.00 0.01 -1.17 -1.18 114.94 117.71 1uyt s ASN 1587Ca -0.08 1.40 -0.06 0.00 -0.71 0.00 0.00 52.86 53.41 1uyt s ASN 1587Cb -0.03 -2.45 0.13 0.00 0.41 0.00 0.00 41.25 39.30 1uyt s ASN 1587CO 0.04 -0.76 0.33 -0.62 -1.51 0.00 0.00 177.10 174.59 1uyt s ASP 1588N -3.88 5.48 0.64 -1.22 3.68 -0.85 -4.78 116.67 115.74 1uyt s ASP 1588Ca 0.55 -2.21 0.32 0.00 2.13 0.00 0.00 52.55 53.34 1uyt s ASP 1588Cb -0.11 -1.92 1.78 0.00 -1.45 0.00 0.00 42.92 41.23 1uyt s ASP 1588CO 0.47 -0.56 2.05 -0.29 0.13 0.00 0.00 175.17 176.97 1uyt h ILE 1589N 5.96 0.16 -0.00 4.11 6.09 -1.89 0.59 117.51 132.53 1uyt h ILE 1589Ca -0.12 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.37 1uyt h ILE 1589Cb 1.03 0.77 0.00 0.00 0.47 0.00 0.00 36.82 39.09 1uyt h ILE 1589CO 0.76 0.00 -0.19 0.35 -3.07 0.00 0.00 178.15 176.00 1uyt n THR 1590N -3.24 0.00 -3.50 2.19 -2.24 -1.26 -3.35 114.28 102.88 1uyt n THR 1590Ca -0.00 -0.02 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 1uyt n THR 1590Cb 0.34 -0.14 -0.08 0.00 -2.10 0.00 0.00 70.33 68.34 1uyt n THR 1590CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1uyt s PHE 1591N -2.83 3.31 -1.45 4.78 5.36 0.19 -4.59 117.98 122.76 1uyt s PHE 1591Ca 0.18 -1.38 -0.01 0.00 -0.96 0.00 0.00 56.93 54.76 1uyt s PHE 1591Cb 0.19 -3.21 0.00 0.00 -0.34 0.00 0.00 43.02 39.67 1uyt s PHE 1591CO 0.56 -0.88 0.32 1.63 -1.46 0.00 0.00 175.22 175.40 1uyt n LYS 1592N 5.04 -2.71 -2.93 10.12 5.02 -1.26 -0.55 118.16 130.89 1uyt n LYS 1592Ca -0.11 0.33 -0.16 0.00 -2.02 0.00 0.00 58.31 56.35 1uyt n LYS 1592Cb 0.42 -4.31 -0.01 0.00 -0.02 0.00 0.00 35.03 31.12 1uyt n LYS 1592CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1uyt n ILE 1593N -4.44 -0.67 -3.11 -0.18 -5.35 -1.22 -1.21 119.36 103.17 1uyt n ILE 1593Ca -0.31 0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 61.95 1uyt n ILE 1593Cb 0.68 -1.48 0.03 0.00 -1.74 0.00 0.00 39.64 37.13 1uyt n ILE 1593CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1uyt n GLY 1594N -0.93 -0.52 3.72 3.28 0.00 0.29 -2.74 105.19 108.29 1uyt n GLY 1594Ca -0.06 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1uyt n GLY 1594CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uyt s SER 1595N -2.73 3.66 -0.46 1.61 1.04 -0.35 -2.75 113.70 113.72 1uyt s SER 1595Ca 0.33 1.69 -0.11 0.00 0.48 0.00 0.00 55.95 58.35 1uyt s SER 1595Cb -0.15 -2.35 0.10 0.00 0.10 0.00 0.00 66.02 63.72 1uyt s SER 1595CO 0.41 -2.55 0.33 -0.36 0.98 0.00 0.00 173.24 172.05 1uyt s PHE 1596N -2.87 3.35 0.39 5.02 0.40 0.11 -4.78 117.98 119.60 1uyt s PHE 1596Ca 0.63 -1.54 0.08 0.00 -0.60 0.00 0.00 56.93 55.50 1uyt s PHE 1596Cb -0.19 -3.27 -0.02 0.00 0.51 0.00 0.00 43.02 40.06 1uyt s PHE 1596CO 0.57 -0.91 0.37 0.20 0.70 0.00 0.00 175.22 176.15 1uyt s GLY 1597N 2.54 2.03 0.26 4.36 0.00 -1.26 -0.83 107.32 114.42 1uyt s GLY 1597Ca 0.04 -1.81 -0.03 0.00 0.00 0.00 0.00 44.72 42.92 1uyt s GLY 1597CO 0.02 -1.65 1.67 -2.55 0.00 0.00 0.00 173.10 170.59 1uyt h PRO 1598N 1.06 0.24 -0.48 2.90 0.11 -1.89 0.34 132.00 134.28 1uyt h PRO 1598Ca -0.42 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.61 1uyt h PRO 1598Cb 1.26 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1uyt h PRO 1598CO 0.57 0.16 0.02 1.96 -0.21 0.00 0.00 178.00 180.50 1uyt h GLN 1599N 0.25 0.77 -0.29 1.05 4.20 -1.97 0.07 115.11 119.19 1uyt h GLN 1599Ca 0.45 -0.20 -0.12 0.00 0.06 0.00 0.00 58.65 58.85 1uyt h GLN 1599Cb 0.82 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.50 1uyt h GLN 1599CO -0.56 0.77 -0.29 0.93 -0.67 0.00 0.00 178.83 179.02 1uyt h GLU 1600N 0.73 0.71 -0.69 1.46 3.07 -1.39 -1.49 114.58 116.98 1uyt h GLU 1600Ca 0.15 -0.37 -0.07 0.00 -0.50 0.00 0.00 59.36 58.56 1uyt h GLU 1600Cb 0.42 0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.31 1uyt h GLU 1600CO 0.02 0.99 0.16 -0.44 -1.40 0.00 0.00 179.01 178.33 1uyt h ASP 1601N 0.46 1.04 -0.55 1.42 3.32 -0.91 0.14 116.42 121.34 1uyt h ASP 1601Ca 0.05 -0.22 -0.09 0.00 0.02 0.00 0.00 57.03 56.79 1uyt h ASP 1601Cb 0.85 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1uyt h ASP 1601CO 0.07 1.00 0.00 -0.08 -1.72 0.00 0.00 179.24 178.52 1uyt h GLU 1602N 1.04 0.96 -0.36 3.56 4.57 -0.89 0.05 114.58 123.51 1uyt h GLU 1602Ca 0.22 -0.30 -0.05 0.00 -1.18 0.00 0.00 59.36 58.04 1uyt h GLU 1602Cb 0.38 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1uyt h GLU 1602CO 0.00 0.97 0.02 0.35 -1.18 0.00 0.00 179.01 179.17 1uyt h PHE 1603N 0.84 0.68 0.05 0.92 3.57 -0.92 -1.31 116.94 120.77 1uyt h PHE 1603Ca 0.16 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1uyt h PHE 1603Cb 0.53 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1uyt h PHE 1603CO 0.04 0.71 -0.06 0.35 -2.23 0.00 0.00 178.31 177.12 1uyt h PHE 1604N 0.45 -0.15 -0.39 0.41 3.57 -0.57 0.27 116.94 120.54 1uyt h PHE 1604Ca 0.11 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.63 1uyt h PHE 1604Cb 0.43 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 1uyt h PHE 1604CO 0.03 -0.09 0.22 -0.97 -2.23 0.00 0.00 178.31 175.27 1uyt h ASN 1605N -0.13 0.35 -0.46 0.41 -0.73 -0.92 -0.44 115.58 113.66 1uyt h ASN 1605Ca 0.01 0.01 0.07 0.00 1.87 0.00 0.00 56.30 58.26 1uyt h ASN 1605Cb 0.13 -0.06 -0.06 0.00 0.27 0.00 0.00 38.32 38.60 1uyt h ASN 1605CO -0.03 0.25 0.12 0.11 -0.37 0.00 0.00 177.43 177.51 1uyt h LYS 1606N 0.45 0.25 -0.72 6.67 1.79 -0.85 -0.67 116.57 123.49 1uyt h LYS 1606Ca 0.16 -0.02 -0.07 0.00 -2.18 0.00 0.00 60.65 58.55 1uyt h LYS 1606Cb 0.02 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.59 1uyt h LYS 1606CO -0.08 0.17 0.19 0.28 -1.08 0.00 0.00 179.45 178.92 1uyt h VAL 1607N 0.26 1.26 -0.56 0.50 2.07 -0.51 -0.60 116.25 118.66 1uyt h VAL 1607Ca 0.22 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1uyt h VAL 1607Cb 0.27 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1uyt h VAL 1607CO -0.27 0.37 0.31 0.74 0.02 0.00 0.00 177.57 178.74 1uyt h THR 1608N 1.08 1.19 0.00 2.57 2.02 -0.46 -1.45 112.91 117.85 1uyt h THR 1608Ca 0.23 -0.48 -0.09 0.00 0.77 0.00 0.00 66.41 66.84 1uyt h THR 1608Cb 0.35 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1uyt h THR 1608CO -0.00 0.20 -0.44 -0.33 0.37 0.00 0.00 175.52 175.33 1uyt h GLU 1609N 0.76 0.00 -0.08 6.66 5.08 -0.85 -1.69 114.58 124.46 1uyt h GLU 1609Ca 0.20 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1uyt h GLU 1609Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1uyt h GLU 1609CO -0.03 0.44 0.04 -0.92 -1.00 0.00 0.00 179.01 177.53 1uyt h TYR 1610N 0.00 0.12 -0.06 4.33 3.20 -0.59 -1.62 116.97 122.36 1uyt h TYR 1610Ca -0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1uyt h TYR 1610Cb 0.84 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 1uyt h TYR 1610CO 0.00 0.21 0.03 0.00 -1.64 0.00 0.00 178.16 176.75 1uyt h ALA 1611N 0.90 0.07 -0.85 1.82 0.00 -1.00 -3.03 119.26 117.18 1uyt h ALA 1611Ca 0.03 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1uyt h ALA 1611Cb 0.13 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1uyt h ALA 1611CO -0.00 -0.36 0.53 0.00 0.00 0.00 0.00 179.25 179.41 1uyt h ARG 1612N -0.04 0.95 -0.96 0.00 3.08 -1.25 0.35 114.38 116.51 1uyt h ARG 1612Ca 0.02 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.02 1uyt h ARG 1612Cb 0.13 -0.22 -0.05 0.00 0.08 0.00 0.00 29.97 29.91 1uyt h ARG 1612CO -0.00 0.63 0.64 -0.22 -1.07 0.00 0.00 179.97 179.95 1uyt h LYS 1613N 0.98 1.26 -0.00 0.04 3.64 -1.24 -2.23 116.57 119.03 1uyt h LYS 1613Ca 0.36 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1uyt h LYS 1613Cb 0.13 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1uyt h LYS 1613CO -0.16 0.84 -0.27 0.54 -2.27 0.00 0.00 179.45 178.13 1uyt n ARG 1614N -4.41 0.07 -1.09 1.90 1.74 -0.79 -4.92 116.66 109.16 1uyt n ARG 1614Ca 0.11 -0.03 -0.03 0.00 -0.77 0.00 0.00 57.85 57.13 1uyt n ARG 1614Cb 0.01 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 29.94 1uyt n ARG 1614CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uyt n GLY 1615N 1.48 0.62 3.85 -0.13 0.00 0.04 -4.72 105.19 106.33 1uyt n GLY 1615Ca 0.07 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1uyt n GLY 1615CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uyt s ILE 1616N -2.04 4.82 0.78 -0.61 1.09 -0.74 0.11 121.20 124.61 1uyt s ILE 1616Ca 0.00 0.76 -0.13 0.00 -1.10 0.00 0.00 60.65 60.18 1uyt s ILE 1616Cb 0.00 -3.68 0.07 0.00 -1.06 0.00 0.00 42.46 37.79 1uyt s ILE 1616CO 0.00 0.03 1.18 -2.84 -0.10 0.00 0.00 174.94 173.21 1uyt s PRO 1617N -2.49 1.85 -0.26 2.79 0.02 -1.26 -4.47 135.00 131.17 1uyt s PRO 1617Ca 0.45 1.64 0.00 0.00 0.02 0.00 0.00 61.00 63.12 1uyt s PRO 1617Cb -0.13 -1.81 0.08 0.00 0.02 0.00 0.00 34.50 32.66 1uyt s PRO 1617CO 0.20 -2.03 0.01 0.50 -0.33 0.00 0.00 177.00 175.35 1uyt s ARG 1618N -4.21 1.19 -0.10 5.54 3.52 -0.66 -1.65 118.95 122.58 1uyt s ARG 1618Ca 0.71 -1.02 -0.16 0.00 -0.13 0.00 0.00 55.73 55.13 1uyt s ARG 1618Cb -0.26 -2.42 -0.05 0.00 -1.56 0.00 0.00 34.95 30.66 1uyt s ARG 1618CO 0.50 -0.75 0.41 0.42 -0.81 0.00 0.00 175.30 175.07 1uyt s ILE 1619N 1.48 5.18 -0.12 4.11 1.09 0.47 -3.00 121.20 130.41 1uyt s ILE 1619Ca 0.01 0.82 0.03 0.00 -1.10 0.00 0.00 60.65 60.41 1uyt s ILE 1619Cb -0.18 -3.74 0.00 0.00 -1.06 0.00 0.00 42.46 37.48 1uyt s ILE 1619CO -0.12 0.41 -0.22 -0.47 -0.10 0.00 0.00 174.94 174.44 1uyt s TYR 1620N 0.13 2.62 -0.46 3.97 6.04 -0.11 -0.33 117.35 129.20 1uyt s TYR 1620Ca 0.23 -1.16 -0.10 0.00 0.04 0.00 0.00 57.07 56.07 1uyt s TYR 1620Cb -0.15 -1.77 0.11 0.00 -1.04 0.00 0.00 41.96 39.11 1uyt s TYR 1620CO 0.09 -0.50 0.34 -0.51 -1.54 0.00 0.00 175.55 173.43 1uyt s LEU 1621N 0.56 5.59 -0.11 6.97 1.43 0.12 -0.49 118.68 132.75 1uyt s LEU 1621Ca -0.13 -1.77 -0.29 0.00 -1.03 0.00 0.00 54.13 50.91 1uyt s LEU 1621Cb -0.17 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 1uyt s LEU 1621CO 0.04 -0.67 1.00 0.00 0.23 0.00 0.00 176.35 176.96 1uyt s ALA 1622N 1.41 3.42 -0.41 4.21 0.00 0.11 -3.05 121.76 127.45 1uyt s ALA 1622Ca 0.05 0.35 0.04 0.00 0.00 0.00 0.00 51.96 52.40 1uyt s ALA 1622Cb -0.26 -3.43 0.19 0.00 0.00 0.00 0.00 23.12 19.62 1uyt s ALA 1622CO 0.01 -0.62 0.75 0.00 0.00 0.00 0.00 175.76 175.90 1uyt s ALA 1623N 2.06 -2.82 0.34 0.00 0.00 -1.25 -1.40 121.76 118.69 1uyt s ALA 1623Ca 0.48 0.30 -0.06 0.00 0.00 0.00 0.00 51.96 52.68 1uyt s ALA 1623Cb -0.18 -2.80 0.01 0.00 0.00 0.00 0.00 23.12 20.15 1uyt s ALA 1623CO 0.17 -2.29 0.52 0.54 0.00 0.00 0.00 175.76 174.70 1uyt s ASN 1624N 1.62 0.67 -0.15 0.00 4.22 -0.44 -4.02 114.94 116.84 1uyt s ASN 1624Ca 0.19 -1.38 0.15 0.00 -2.14 0.00 0.00 52.86 49.68 1uyt s ASN 1624Cb -0.01 0.68 0.33 0.00 1.28 0.00 0.00 41.25 43.54 1uyt s ASN 1624CO -0.08 -1.34 1.17 -1.20 -2.04 0.00 0.00 177.10 173.60 1uyt n SER 1625N -1.30 1.88 0.00 3.54 7.64 -1.11 -3.95 113.62 120.33 1uyt n SER 1625Ca -0.01 -3.29 0.00 0.00 1.01 0.00 0.00 58.87 56.58 1uyt n SER 1625Cb 0.61 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1uyt n SER 1625CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uyt n GLY 1626N -1.13 -1.97 3.76 0.23 0.00 -1.22 -4.84 105.19 100.02 1uyt n GLY 1626Ca 0.16 -1.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 1uyt n GLY 1626CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uyt s ALA 1627N -1.26 2.93 0.34 4.61 0.00 -1.26 0.07 121.76 127.18 1uyt s ALA 1627Ca 0.00 1.18 -0.27 0.00 0.00 0.00 0.00 51.96 52.86 1uyt s ALA 1627Cb 0.00 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1uyt s ALA 1627CO 0.00 -1.05 1.14 0.50 0.00 0.00 0.00 175.76 176.34 1uyt s ARG 1628N -2.76 4.38 0.46 0.00 3.52 -0.01 -4.54 118.95 120.01 1uyt s ARG 1628Ca 0.67 1.82 0.03 0.00 -0.13 0.00 0.00 55.73 58.12 1uyt s ARG 1628Cb -0.36 -2.95 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 1uyt s ARG 1628CO 0.43 -0.03 0.06 0.96 -0.81 0.00 0.00 175.30 175.92 1uyt s ILE 1629N -1.30 0.90 0.00 4.11 -4.36 -1.26 -4.57 121.20 114.73 1uyt s ILE 1629Ca 0.50 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.89 1uyt s ILE 1629Cb -0.31 -2.26 0.00 0.00 1.25 0.00 0.00 42.46 41.14 1uyt s ILE 1629CO 0.40 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.19 1uyt n GLY 1630N -1.09 1.28 3.42 6.27 0.00 -1.20 -4.78 105.19 109.09 1uyt n GLY 1630Ca -0.13 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.49 1uyt n GLY 1630CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uyt s MET 1631N -1.98 1.61 -1.10 1.61 -1.94 -1.26 -4.69 119.30 111.55 1uyt s MET 1631Ca 0.00 -1.90 -0.22 0.00 -1.71 0.00 0.00 55.69 51.87 1uyt s MET 1631Cb 0.00 -0.68 0.03 0.00 2.01 0.00 0.00 34.83 36.19 1uyt s MET 1631CO 0.00 -0.24 1.65 0.00 -0.01 0.00 0.00 175.02 176.42 1uyt s ALA 1632N -3.42 2.64 0.63 3.03 0.00 -1.26 -4.82 121.76 118.56 1uyt s ALA 1632Ca 0.36 -2.32 0.33 0.00 0.00 0.00 0.00 51.96 50.33 1uyt s ALA 1632Cb 0.08 -4.58 1.87 0.00 0.00 0.00 0.00 23.12 20.48 1uyt s ALA 1632CO 0.15 -3.86 2.13 0.93 0.00 0.00 0.00 175.76 175.11 1uyt h GLU 1633N 9.39 0.00 -0.02 0.00 4.39 -2.00 -0.99 114.58 125.35 1uyt h GLU 1633Ca 0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1uyt h GLU 1633Cb 0.96 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1uyt h GLU 1633CO 1.39 0.00 0.00 -0.85 -1.16 0.00 0.00 179.01 178.39 1uyt n GLU 1634N -3.37 1.10 -0.00 2.33 0.00 -1.26 -3.34 120.64 116.10 1uyt n GLU 1634Ca -0.01 -0.15 0.03 0.00 0.00 0.00 0.00 57.16 57.04 1uyt n GLU 1634Cb 0.27 -1.36 -0.05 0.00 0.00 0.00 0.00 31.44 30.30 1uyt n GLU 1634CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1uyt n ILE 1635N -0.70 0.00 0.20 3.84 2.08 -0.38 -4.64 119.36 119.77 1uyt n ILE 1635Ca 0.17 -0.19 0.06 0.00 0.56 0.00 0.00 62.75 63.35 1uyt n ILE 1635Cb 0.11 0.46 0.40 0.00 -0.75 0.00 0.00 39.64 39.86 1uyt n ILE 1635CO 0.00 0.00 0.00 1.62 0.56 0.00 0.00 176.55 178.73 1uyt h VAL 1636N 0.00 0.94 0.00 1.39 3.04 -1.58 -2.82 116.25 117.23 1uyt h VAL 1636Ca 0.00 -1.34 0.00 0.00 -1.01 0.00 0.00 66.70 64.35 1uyt h VAL 1636Cb 0.28 1.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.35 1uyt h VAL 1636CO 0.00 0.34 -0.66 -0.81 -1.01 0.00 0.00 177.57 175.43 1uyt n PRO 1637N -3.69 0.22 -0.44 4.17 -0.04 -1.26 -4.37 135.00 129.58 1uyt n PRO 1637Ca -0.01 0.05 0.06 0.00 -0.04 0.00 0.00 63.50 63.56 1uyt n PRO 1637Cb 0.45 -1.62 0.09 0.00 -0.04 0.00 0.00 33.50 32.38 1uyt n PRO 1637CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1uyt n LEU 1638N -1.93 1.52 -4.76 1.53 -0.00 -1.20 -5.04 117.00 107.13 1uyt n LEU 1638Ca 0.04 -2.44 -0.37 0.00 -0.00 0.00 0.00 56.01 53.23 1uyt n LEU 1638Cb 0.41 -0.26 -0.06 0.00 -0.00 0.00 0.00 43.42 43.51 1uyt n LEU 1638CO 0.37 0.65 0.08 0.72 -0.00 0.00 0.00 177.39 179.20 1uyt s PHE 1639N -1.72 3.56 0.01 1.47 -0.12 -1.07 -4.68 117.98 115.43 1uyt s PHE 1639Ca 0.23 0.80 0.03 0.00 -0.05 0.00 0.00 56.93 57.94 1uyt s PHE 1639Cb 0.22 -2.39 -0.04 0.00 -0.63 0.00 0.00 43.02 40.19 1uyt s PHE 1639CO -0.02 0.34 -0.03 -0.65 -0.05 0.00 0.00 175.22 174.81 1uyt s GLN 1640N 0.05 2.64 -0.11 1.99 -1.52 0.52 -4.97 119.66 118.26 1uyt s GLN 1640Ca 0.22 -0.69 -0.00 0.00 -1.95 0.00 0.00 55.36 52.93 1uyt s GLN 1640Cb -0.15 -2.57 -0.02 0.00 -0.22 0.00 0.00 33.01 30.05 1uyt s GLN 1640CO 0.09 0.60 -0.09 0.54 -0.25 0.00 0.00 175.29 176.18 1uyt s VAL 1641N -1.06 3.46 -0.57 1.09 0.11 -1.26 0.22 120.40 122.38 1uyt s VAL 1641Ca 0.19 -0.54 -0.21 0.00 -2.93 0.00 0.00 61.98 58.49 1uyt s VAL 1641Cb -0.11 -2.45 0.07 0.00 -1.53 0.00 0.00 36.38 32.35 1uyt s VAL 1641CO 0.10 0.54 0.80 0.00 -3.33 0.00 0.00 175.10 173.21 1uyt s ALA 1642N -0.09 3.27 1.03 1.54 0.00 -1.01 -4.98 121.76 121.52 1uyt s ALA 1642Ca -0.00 -1.75 -0.16 0.00 0.00 0.00 0.00 51.96 50.06 1uyt s ALA 1642Cb -0.13 -3.60 0.21 0.00 0.00 0.00 0.00 23.12 19.60 1uyt s ALA 1642CO 0.03 -2.35 1.18 0.91 0.00 0.00 0.00 175.76 175.53 1uyt n TRP 1643N 6.88 -3.98 0.08 0.00 7.02 -1.26 0.13 117.44 126.31 1uyt n TRP 1643Ca -0.05 -1.05 -0.07 0.00 -1.02 0.00 0.00 57.50 55.32 1uyt n TRP 1643Cb 0.45 -0.95 -0.05 0.00 -2.42 0.00 0.00 31.31 28.34 1uyt n TRP 1643CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1uyt h ASN 1644N -1.71 0.05 -0.65 -0.99 4.21 -1.79 -3.40 115.58 111.30 1uyt h ASN 1644Ca -0.39 -0.05 0.21 0.00 1.21 0.00 0.00 56.30 57.27 1uyt h ASN 1644Cb 1.08 -0.02 -0.24 0.00 -1.12 0.00 0.00 38.32 38.03 1uyt h ASN 1644CO 0.27 0.95 0.25 1.51 -1.29 0.00 0.00 177.43 179.12 1uyt s ASP 1645N -6.79 -0.47 0.63 5.81 -4.77 -1.26 -5.03 116.67 104.79 1uyt s ASP 1645Ca -0.00 0.53 0.25 0.00 -3.30 0.00 0.00 52.55 50.02 1uyt s ASP 1645Cb 0.10 1.49 1.24 0.00 -1.09 0.00 0.00 42.92 44.66 1uyt s ASP 1645CO 0.81 -0.09 1.69 0.00 0.70 0.00 0.00 175.17 178.29 1uyt h ALA 1646N 7.56 1.96 -0.35 2.11 0.00 -1.99 0.73 119.26 129.29 1uyt h ALA 1646Ca -0.15 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1uyt h ALA 1646Cb 1.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1uyt h ALA 1646CO 0.03 -0.77 -0.35 0.00 0.00 0.00 0.00 179.25 178.17 1uyt h ALA 1647N 1.07 0.72 -2.89 0.00 0.00 -2.01 -3.36 119.26 112.79 1uyt h ALA 1647Ca 0.15 -0.43 -0.61 0.00 0.00 0.00 0.00 54.91 54.01 1uyt h ALA 1647Cb 1.36 -0.13 -0.41 0.00 0.00 0.00 0.00 17.79 18.61 1uyt h ALA 1647CO -0.00 0.66 -0.65 0.09 0.00 0.00 0.00 179.25 179.35 1uyt n ASN 1648N -4.06 2.42 -0.10 0.00 3.02 0.25 -4.94 115.26 111.84 1uyt n ASN 1648Ca -0.01 -3.07 0.26 0.00 -0.03 0.00 0.00 54.58 51.72 1uyt n ASN 1648Cb 0.51 -0.72 0.72 0.00 -0.61 0.00 0.00 39.78 39.68 1uyt n ASN 1648CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1uyt h PRO 1649N 5.34 0.00 -2.22 3.52 0.11 -1.72 -2.69 132.00 134.35 1uyt h PRO 1649Ca 0.17 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.79 1uyt h PRO 1649Cb 0.78 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.76 1uyt h PRO 1649CO 0.66 0.00 0.94 -3.47 -0.21 0.00 0.00 178.00 175.92 1uyt n ASP 1650N -4.13 6.73 -0.86 -2.05 2.03 -1.26 -3.87 116.55 113.13 1uyt n ASP 1650Ca 0.15 -2.98 0.01 0.00 0.52 0.00 0.00 54.79 52.50 1uyt n ASP 1650Cb 0.87 -1.33 0.01 0.00 -0.72 0.00 0.00 41.12 39.95 1uyt n ASP 1650CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1uyt n LYS 1651N 1.65 0.00 0.00 -0.67 4.76 -1.01 -5.13 118.16 117.75 1uyt n LYS 1651Ca 0.53 -1.36 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 1uyt n LYS 1651Cb 0.54 -0.31 0.00 0.00 -1.84 0.00 0.00 35.03 33.42 1uyt n LYS 1651CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1uyt n GLY 1652N 0.18 -3.29 3.23 0.72 0.00 -1.25 -4.60 105.19 100.18 1uyt n GLY 1652Ca 0.02 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 1uyt n GLY 1652CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uyt s PHE 1653N -0.98 -0.37 0.06 1.61 -0.12 -1.26 -3.09 117.98 113.83 1uyt s PHE 1653Ca 0.00 0.91 -0.20 0.00 -0.05 0.00 0.00 56.93 57.58 1uyt s PHE 1653Cb 0.00 0.13 -0.11 0.00 -0.63 0.00 0.00 43.02 42.40 1uyt s PHE 1653CO 0.00 -0.18 1.49 1.96 -0.05 0.00 0.00 175.22 178.44 1uyt h GLN 1654N 5.60 0.31 0.00 1.99 4.20 -0.53 -3.48 115.11 123.20 1uyt h GLN 1654Ca -0.26 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1uyt h GLN 1654Cb 1.19 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1uyt h GLN 1654CO 0.29 0.53 0.00 2.48 -0.67 0.00 0.00 178.83 181.46 1uyt n TYR 1655N -4.72 -0.09 -4.61 2.96 0.18 -1.23 -5.04 117.16 104.61 1uyt n TYR 1655Ca -0.05 0.00 -0.22 0.00 1.88 0.00 0.00 57.90 59.51 1uyt n TYR 1655Cb 0.22 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.03 1uyt n TYR 1655CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1uyt s LEU 1656N 0.00 1.98 0.00 -3.48 1.43 -1.26 -2.40 118.68 114.95 1uyt s LEU 1656Ca 0.00 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1uyt s LEU 1656Cb 0.00 -0.71 -0.01 0.00 0.03 0.00 0.00 46.19 45.50 1uyt s LEU 1656CO 0.00 0.15 0.31 0.00 0.23 0.00 0.00 176.35 177.04 1uyt n TYR 1657N 2.86 -0.91 -4.21 0.29 4.11 0.13 -1.49 117.16 117.95 1uyt n TYR 1657Ca -0.15 -2.30 -0.17 0.00 -0.00 0.00 0.00 57.90 55.28 1uyt n TYR 1657Cb 0.55 0.33 -0.12 0.00 -0.00 0.00 0.00 39.34 40.10 1uyt n TYR 1657CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1uyt s LEU 1658N 0.00 2.21 0.61 -3.48 1.43 -0.09 -0.36 118.68 119.01 1uyt s LEU 1658Ca 0.31 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1uyt s LEU 1658Cb 0.01 -0.44 0.03 0.00 0.03 0.00 0.00 46.19 45.82 1uyt s LEU 1658CO 0.22 -0.06 0.89 0.42 0.23 0.00 0.00 176.35 178.06 1uyt s THR 1659N -1.05 2.92 0.57 5.49 -4.23 -1.26 -1.51 115.64 116.56 1uyt s THR 1659Ca -0.02 -0.31 0.27 0.00 -1.18 0.00 0.00 61.69 60.44 1uyt s THR 1659Cb -0.09 -3.17 0.36 0.00 1.34 0.00 0.00 72.50 70.95 1uyt s THR 1659CO 0.01 -0.16 2.05 -1.28 -0.54 0.00 0.00 174.62 174.70 1uyt h SER 1660N -0.22 0.00 -0.23 3.99 0.87 -1.99 0.11 113.55 116.08 1uyt h SER 1660Ca -0.44 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.00 1uyt h SER 1660Cb 1.29 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.25 1uyt h SER 1660CO 0.58 0.00 -0.32 -0.33 -0.53 0.00 0.00 176.83 176.23 1uyt h GLU 1661N 0.00 0.62 -0.02 2.24 5.08 -1.98 -2.28 114.58 118.24 1uyt h GLU 1661Ca 0.14 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1uyt h GLU 1661Cb 0.66 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.94 1uyt h GLU 1661CO -0.00 0.97 0.00 0.78 -1.00 0.00 0.00 179.01 179.76 1uyt h GLY 1662N 0.31 0.04 1.62 -3.84 0.00 -1.20 0.53 103.07 100.53 1uyt h GLY 1662Ca 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1uyt h GLY 1662CO 0.07 0.02 0.17 -0.33 0.00 0.00 0.00 176.54 176.47 1uyt h MET 1663N -0.20 0.00 0.09 4.80 2.86 -1.09 -0.43 114.93 120.96 1uyt h MET 1663Ca 0.01 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.32 1uyt h MET 1663Cb 0.25 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1uyt h MET 1663CO 0.00 0.00 -1.76 1.49 1.06 0.00 0.00 176.91 177.70 1uyt h GLU 1664N 0.00 0.19 -0.26 1.72 4.57 -0.84 -3.19 114.58 116.77 1uyt h GLU 1664Ca 0.04 -0.32 -0.00 0.00 -1.18 0.00 0.00 59.36 57.90 1uyt h GLU 1664Cb 0.38 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 1uyt h GLU 1664CO -0.00 0.98 0.14 1.15 -1.18 0.00 0.00 179.01 180.10 1uyt h THR 1665N 0.05 1.12 -0.06 0.32 2.02 0.74 -0.96 112.91 116.13 1uyt h THR 1665Ca -0.32 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.53 1uyt h THR 1665Cb 2.02 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 69.28 1uyt h THR 1665CO 0.11 0.11 -0.07 -0.07 0.37 0.00 0.00 175.52 175.98 1uyt h LEU 1666N 0.30 0.08 -0.58 2.58 -0.00 -1.50 -1.56 115.31 114.63 1uyt h LEU 1666Ca 0.09 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.88 57.90 1uyt h LEU 1666Cb 0.06 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 1uyt h LEU 1666CO -0.01 0.17 -0.29 0.50 -0.00 0.00 0.00 178.44 178.81 1uyt h LYS 1667N 0.09 0.00 0.00 1.13 3.64 -1.33 0.27 116.57 120.37 1uyt h LYS 1667Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1uyt h LYS 1667Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1uyt h LYS 1667CO 0.01 0.29 0.00 -0.22 -2.27 0.00 0.00 179.45 177.25 1uyt h LYS 1668N 0.00 0.00 -0.09 1.90 3.64 -0.14 -2.85 116.57 119.02 1uyt h LYS 1668Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1uyt h LYS 1668Cb 1.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1uyt h LYS 1668CO 0.04 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.41 1uyt n PHE 1669N -2.58 0.11 -0.99 1.91 3.72 -1.11 -4.96 117.46 113.57 1uyt n PHE 1669Ca 0.03 -0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1uyt n PHE 1669Cb 0.35 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 1uyt n PHE 1669CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1uyt n ASP 1670N 0.36 -4.61 -1.89 4.37 4.64 -0.81 -4.86 116.55 113.75 1uyt n ASP 1670Ca 0.06 0.00 -0.11 0.00 -1.38 0.00 0.00 54.79 53.36 1uyt n ASP 1670Cb 0.26 -2.29 -0.06 0.00 -1.04 0.00 0.00 41.12 37.99 1uyt n ASP 1670CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1uyt n LYS 1671N -0.63 1.69 0.09 -0.67 5.02 0.88 -4.32 118.16 120.22 1uyt n LYS 1671Ca 0.00 -0.95 -0.12 0.00 -2.02 0.00 0.00 58.31 55.22 1uyt n LYS 1671Cb 0.29 -1.63 -0.08 0.00 -0.02 0.00 0.00 35.03 33.60 1uyt n LYS 1671CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1uyt h GLU 1672N 2.10 0.24 -0.15 1.97 5.08 -1.89 -3.14 114.58 118.79 1uyt h GLU 1672Ca 0.17 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1uyt h GLU 1672Cb 1.14 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1uyt h GLU 1672CO 0.33 1.08 0.00 0.09 -1.00 0.00 0.00 179.01 179.51 1uyt n ASN 1673N -3.59 0.15 -0.09 1.42 4.13 -1.26 -3.41 115.26 112.60 1uyt n ASN 1673Ca -0.06 -1.78 0.15 0.00 1.68 0.00 0.00 54.58 54.57 1uyt n ASN 1673Cb 0.91 -0.07 0.74 0.00 -1.54 0.00 0.00 39.78 39.82 1uyt n ASN 1673CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1uyt n SER 1674N -0.41 0.32 -3.60 6.41 7.64 -1.19 -4.61 113.62 118.18 1uyt n SER 1674Ca 0.00 -0.71 -0.12 0.00 1.01 0.00 0.00 58.87 59.05 1uyt n SER 1674Cb 0.04 -0.09 -0.06 0.00 -1.01 0.00 0.00 64.21 63.08 1uyt n SER 1674CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1uyt s VAL 1675N -2.29 0.00 -0.39 0.44 0.11 -1.22 -1.95 120.40 115.10 1uyt s VAL 1675Ca 0.36 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.28 1uyt s VAL 1675Cb 0.21 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 34.08 1uyt s VAL 1675CO 0.42 0.00 0.25 -0.76 -3.33 0.00 0.00 175.10 171.69 1uyt s LEU 1676N -0.24 4.90 0.32 2.54 1.02 0.30 -4.95 118.68 122.57 1uyt s LEU 1676Ca -0.01 -0.94 0.10 0.00 0.02 0.00 0.00 54.13 53.30 1uyt s LEU 1676Cb -0.03 -2.09 -0.06 0.00 0.02 0.00 0.00 46.19 44.03 1uyt s LEU 1676CO -0.00 -0.41 -0.10 0.42 0.02 0.00 0.00 176.35 176.27 1uyt s THR 1677N 1.61 2.45 -0.28 5.49 -4.23 -1.26 -0.08 115.64 119.35 1uyt s THR 1677Ca 0.03 -2.21 -0.01 0.00 -1.18 0.00 0.00 61.69 58.32 1uyt s THR 1677Cb -0.19 -2.58 0.09 0.00 1.34 0.00 0.00 72.50 71.16 1uyt s THR 1677CO 0.08 -0.27 0.07 -1.61 -0.54 0.00 0.00 174.62 172.35 1uyt s GLU 1678N -3.60 0.77 0.10 3.99 2.02 0.78 -4.92 118.70 117.85 1uyt s GLU 1678Ca 0.32 -0.92 -0.31 0.00 0.02 0.00 0.00 54.97 54.08 1uyt s GLU 1678Cb -0.01 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 32.06 1uyt s GLU 1678CO 0.17 -0.88 1.88 0.50 0.02 0.00 0.00 175.26 176.95 1uyt s ARG 1679N 1.65 4.13 0.04 1.61 3.52 -1.26 -2.55 118.95 126.09 1uyt s ARG 1679Ca 0.06 2.62 -0.11 0.00 -0.13 0.00 0.00 55.73 58.17 1uyt s ARG 1679Cb -0.17 -3.76 0.01 0.00 -1.56 0.00 0.00 34.95 29.47 1uyt s ARG 1679CO -0.20 -0.88 0.24 0.95 -0.81 0.00 0.00 175.30 174.60 1uyt s THR 1680N 3.25 0.10 -0.02 4.11 -4.23 -1.06 -4.98 115.64 112.80 1uyt s THR 1680Ca 0.84 -0.78 0.06 0.00 -1.18 0.00 0.00 61.69 60.62 1uyt s THR 1680Cb -0.46 -0.91 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 1uyt s THR 1680CO 0.38 -0.43 -0.19 0.68 -0.54 0.00 0.00 174.62 174.52 1uyt s VAL 1681N -2.50 1.53 0.00 2.29 -7.23 -1.26 -0.20 120.40 113.03 1uyt s VAL 1681Ca -0.05 -0.83 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 1uyt s VAL 1681Cb -0.01 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1uyt s VAL 1681CO -0.03 0.43 0.00 2.30 -0.31 0.00 0.00 175.10 177.49 1uyt n ILE 1682N 2.65 0.00 -0.50 -0.62 -0.00 -1.20 -4.94 119.36 114.75 1uyt n ILE 1682Ca -0.15 0.00 -0.04 0.00 -0.00 0.00 0.00 62.75 62.55 1uyt n ILE 1682Cb 0.53 -0.51 -0.06 0.00 -0.00 0.00 0.00 39.64 39.60 1uyt n ILE 1682CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 1uyt n ASN 1683N -0.02 3.37 0.00 7.28 2.04 -1.26 -4.39 115.26 122.28 1uyt n ASN 1683Ca 0.00 -2.02 0.00 0.00 -0.44 0.00 0.00 54.58 52.12 1uyt n ASN 1683Cb 0.00 -0.82 0.00 0.00 -2.53 0.00 0.00 39.78 36.43 1uyt n ASN 1683CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1uyt n GLY 1684N 2.24 0.02 3.84 4.83 0.00 -1.26 -5.18 105.19 109.67 1uyt n GLY 1684Ca 0.15 0.49 -0.27 0.00 0.00 0.00 0.00 46.02 46.40 1uyt n GLY 1684CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uyt s GLU 1685N 1.54 2.26 -0.29 1.61 0.41 -1.26 -5.09 118.70 117.87 1uyt s GLU 1685Ca 0.00 -2.01 -0.26 0.00 -0.41 0.00 0.00 54.97 52.29 1uyt s GLU 1685Cb 0.00 -1.99 0.01 0.00 -1.78 0.00 0.00 34.13 30.37 1uyt s GLU 1685CO 0.00 -0.42 0.90 -1.83 -0.49 0.00 0.00 175.26 173.43 1uyt s GLU 1686N -4.11 4.05 -0.21 1.61 -1.05 -1.26 -3.25 118.70 114.49 1uyt s GLU 1686Ca 0.32 0.85 -0.04 0.00 -0.15 0.00 0.00 54.97 55.95 1uyt s GLU 1686Cb -0.00 -3.71 -0.01 0.00 -0.44 0.00 0.00 34.13 29.97 1uyt s GLU 1686CO 0.19 -0.72 -0.05 1.03 0.95 0.00 0.00 175.26 176.66 1uyt s ARG 1687N 3.17 3.40 -0.69 -4.83 0.52 0.71 -4.49 118.95 116.74 1uyt s ARG 1687Ca 0.38 -0.62 -0.25 0.00 -0.52 0.00 0.00 55.73 54.72 1uyt s ARG 1687Cb -0.14 -2.97 0.05 0.00 0.52 0.00 0.00 34.95 32.41 1uyt s ARG 1687CO 0.12 -0.13 1.14 -0.06 0.02 0.00 0.00 175.30 176.39 1uyt s PHE 1688N 1.30 2.47 -0.06 -0.53 0.40 -0.57 -2.58 117.98 118.41 1uyt s PHE 1688Ca 0.04 -0.23 -0.30 0.00 -0.60 0.00 0.00 56.93 55.83 1uyt s PHE 1688Cb -0.14 -4.47 -0.05 0.00 0.51 0.00 0.00 43.02 38.87 1uyt s PHE 1688CO -0.02 -1.86 1.48 0.08 0.70 0.00 0.00 175.22 175.60 1uyt s VAL 1689N 4.96 3.79 -0.32 -0.44 1.01 -1.06 -0.91 120.40 127.43 1uyt s VAL 1689Ca 0.30 1.03 -0.25 0.00 0.00 0.00 0.00 61.98 63.06 1uyt s VAL 1689Cb -0.12 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.60 1uyt s VAL 1689CO 0.14 -0.06 0.87 0.27 0.00 0.00 0.00 175.10 176.31 1uyt s ILE 1690N 3.38 4.70 -0.11 2.22 -4.36 -0.55 -0.15 121.20 126.33 1uyt s ILE 1690Ca 0.66 1.32 0.22 0.00 -0.26 0.00 0.00 60.65 62.59 1uyt s ILE 1690Cb -0.30 -4.23 -0.21 0.00 1.25 0.00 0.00 42.46 38.97 1uyt s ILE 1690CO 0.25 -0.33 0.70 0.29 0.24 0.00 0.00 174.94 176.09 1uyt n LYS 1691N 6.42 0.64 -3.65 0.37 5.02 0.89 -4.75 118.16 123.10 1uyt n LYS 1691Ca 0.06 -0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.16 1uyt n LYS 1691Cb 0.48 -1.64 -0.07 0.00 -0.02 0.00 0.00 35.03 33.77 1uyt n LYS 1691CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1uyt s THR 1692N -3.46 -0.00 -0.25 -0.18 2.01 -1.12 -5.01 115.64 107.63 1uyt s THR 1692Ca -0.05 0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 1uyt s THR 1692Cb 0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 72.50 71.67 1uyt s THR 1692CO 0.86 0.00 0.06 -0.63 -0.69 0.00 0.00 174.62 174.22 1uyt s ILE 1693N 0.83 4.10 -0.16 1.82 1.01 -1.26 -0.54 121.20 127.01 1uyt s ILE 1693Ca -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.29 1uyt s ILE 1693Cb -0.05 -2.95 -0.23 0.00 0.01 0.00 0.00 42.46 39.24 1uyt s ILE 1693CO -0.07 0.30 0.20 -0.38 0.00 0.00 0.00 174.94 175.00 1uyt n ILE 1694N 4.90 1.64 0.00 2.92 -0.00 -1.00 -4.99 119.36 122.84 1uyt n ILE 1694Ca -0.16 -0.67 0.00 0.00 -0.00 0.00 0.00 62.75 61.92 1uyt n ILE 1694Cb 0.51 -1.45 0.00 0.00 -0.00 0.00 0.00 39.64 38.70 1uyt n ILE 1694CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1uyt n GLY 1695N 2.00 -1.04 0.13 7.39 0.00 -0.82 -4.91 105.19 107.94 1uyt n GLY 1695Ca -0.34 -1.55 -0.21 0.00 0.00 0.00 0.00 46.02 43.91 1uyt n GLY 1695CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uyt n SER 1696N -1.23 2.02 -4.79 1.61 2.88 -1.26 -4.56 113.62 108.29 1uyt n SER 1696Ca 0.00 0.13 -0.35 0.00 -1.33 0.00 0.00 58.87 57.32 1uyt n SER 1696Cb 0.00 -0.71 -0.04 0.00 -0.75 0.00 0.00 64.21 62.71 1uyt n SER 1696CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1uyt s GLU 1697N -2.51 4.00 0.40 -1.46 2.12 -1.26 -5.05 118.70 114.93 1uyt s GLU 1697Ca -0.30 1.41 -0.06 0.00 0.36 0.00 0.00 54.97 56.38 1uyt s GLU 1697Cb 0.08 -2.30 -0.05 0.00 0.26 0.00 0.00 34.13 32.12 1uyt s GLU 1697CO 0.65 -0.27 0.70 0.34 -0.54 0.00 0.00 175.26 176.14 1uyt s ASP 1698N -1.81 6.39 -0.07 -1.70 3.68 -1.26 -4.59 116.67 117.31 1uyt s ASP 1698Ca 0.63 0.89 -0.00 0.00 2.13 0.00 0.00 52.55 56.20 1uyt s ASP 1698Cb -0.18 -2.22 0.00 0.00 -1.45 0.00 0.00 42.92 39.06 1uyt s ASP 1698CO 0.23 -0.40 0.06 0.61 0.13 0.00 0.00 175.17 175.80 1uyt n GLY 1699N -1.58 0.47 0.10 2.66 0.00 -1.26 -5.01 105.19 100.57 1uyt n GLY 1699Ca 0.00 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 1uyt n GLY 1699CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uyt n LEU 1700N -1.11 2.86 0.00 0.99 4.77 -1.26 -4.18 117.00 119.08 1uyt n LEU 1700Ca -0.01 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1uyt n LEU 1700Cb 0.51 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1uyt n LEU 1700CO 0.03 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1uyt n GLY 1701N 2.81 4.08 0.52 -0.72 0.00 -1.26 -3.23 105.19 107.40 1uyt n GLY 1701Ca -0.24 -0.50 0.34 0.00 0.00 0.00 0.00 46.02 45.62 1uyt n GLY 1701CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1uyt h VAL 1702N 0.00 0.40 0.00 1.61 -1.51 -1.98 0.41 116.25 115.17 1uyt h VAL 1702Ca 0.00 -0.02 -0.01 0.00 -1.23 0.00 0.00 66.70 65.44 1uyt h VAL 1702Cb 0.00 0.35 -0.00 0.00 -2.13 0.00 0.00 31.29 29.51 1uyt h VAL 1702CO 0.00 0.01 -0.05 1.05 -1.23 0.00 0.00 177.57 177.35 1uyt h GLU 1703N 0.05 0.00 0.08 5.19 9.09 -1.98 -0.88 114.58 126.12 1uyt h GLU 1703Ca 0.59 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.73 1uyt h GLU 1703Cb 2.23 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.32 1uyt h GLU 1703CO -0.05 0.05 -1.32 0.00 0.05 0.00 0.00 179.01 177.74 1uyt h LEU 1705N 0.04 0.41 -0.01 0.00 3.38 -1.25 -1.93 115.31 115.96 1uyt h LEU 1705Ca -0.15 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1uyt h LEU 1705Cb 1.93 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.57 1uyt h LEU 1705CO 0.16 0.78 0.00 -0.09 0.09 0.00 0.00 178.44 179.38 1uyt h ARG 1706N 0.32 0.01 -0.78 1.13 2.43 -1.27 -2.07 114.38 114.15 1uyt h ARG 1706Ca 0.03 -0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.31 1uyt h ARG 1706Cb 0.87 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.36 1uyt h ARG 1706CO 0.07 0.19 0.51 0.78 -1.51 0.00 0.00 179.97 180.02 1uyt h GLY 1707N -0.17 0.94 0.94 2.80 0.00 -1.43 -1.03 103.07 105.11 1uyt h GLY 1707Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 1uyt h GLY 1707CO -0.00 0.12 0.15 1.76 0.00 0.00 0.00 176.54 178.57 1uyt h SER 1708N 0.61 0.50 -0.52 0.19 0.02 -0.96 -2.47 113.55 110.92 1uyt h SER 1708Ca 0.37 -0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 61.07 1uyt h SER 1708Cb 0.62 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1uyt h SER 1708CO -0.14 0.52 -0.02 1.23 -1.14 0.00 0.00 176.83 177.28 1uyt h GLY 1709N 0.45 1.04 0.65 -3.77 0.00 -0.57 -1.72 103.07 99.15 1uyt h GLY 1709Ca 0.12 -0.76 0.01 0.00 0.00 0.00 0.00 47.33 46.71 1uyt h GLY 1709CO -0.01 0.70 -0.23 -2.00 0.00 0.00 0.00 176.54 175.00 1uyt h LEU 1710N 0.88 -0.63 -1.21 3.11 5.85 -1.04 -1.09 115.31 121.18 1uyt h LEU 1710Ca 0.16 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 1uyt h LEU 1710Cb 0.55 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1uyt h LEU 1710CO 0.03 -0.32 -0.26 0.16 -0.34 0.00 0.00 178.44 177.71 1uyt h ILE 1711N -0.44 0.68 -0.21 4.05 3.07 -1.36 -1.39 117.51 121.90 1uyt h ILE 1711Ca 0.02 -1.14 -0.05 0.00 1.55 0.00 0.00 64.86 65.24 1uyt h ILE 1711Cb 0.45 1.73 -0.01 0.00 -0.27 0.00 0.00 36.82 38.73 1uyt h ILE 1711CO -0.10 0.25 -0.07 0.00 -1.05 0.00 0.00 178.15 177.18 1uyt h ALA 1712N 1.74 0.29 -0.01 0.16 0.00 -0.81 -0.32 119.26 120.31 1uyt h ALA 1712Ca -0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1uyt h ALA 1712Cb 0.71 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1uyt h ALA 1712CO 0.03 0.10 -0.52 0.78 0.00 0.00 0.00 179.25 179.64 1uyt h GLY 1713N 0.13 0.03 1.13 0.00 0.00 -1.05 -0.64 103.07 102.67 1uyt h GLY 1713Ca 0.05 -0.03 -0.14 0.00 0.00 0.00 0.00 47.33 47.20 1uyt h GLY 1713CO 0.02 0.03 -0.29 0.00 0.00 0.00 0.00 176.54 176.31 1uyt h ALA 1714N 1.46 0.64 -0.39 3.60 0.00 -1.09 -1.42 119.26 122.07 1uyt h ALA 1714Ca -0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 1uyt h ALA 1714Cb 0.92 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1uyt h ALA 1714CO 0.07 0.68 -0.21 1.15 0.00 0.00 0.00 179.25 180.93 1uyt h THR 1715N 0.82 1.28 -0.99 0.00 2.02 -0.77 0.17 112.91 115.44 1uyt h THR 1715Ca 0.09 -1.35 0.09 0.00 0.77 0.00 0.00 66.41 66.00 1uyt h THR 1715Cb 0.87 1.32 -0.07 0.00 -1.74 0.00 0.00 68.15 68.53 1uyt h THR 1715CO 0.08 0.45 0.63 -1.28 0.37 0.00 0.00 175.52 175.77 1uyt h SER 1716N 0.63 0.98 -0.16 4.18 0.87 -1.00 -1.78 113.55 117.27 1uyt h SER 1716Ca 0.08 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.55 1uyt h SER 1716Cb 0.77 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1uyt h SER 1716CO 0.06 0.58 -0.36 0.03 -0.53 0.00 0.00 176.83 176.61 1uyt h ARG 1717N 1.09 0.53 -0.73 2.24 3.08 -0.88 -3.23 114.38 116.47 1uyt h ARG 1717Ca 0.45 -0.35 0.10 0.00 0.07 0.00 0.00 59.98 60.25 1uyt h ARG 1717Cb 0.30 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 1uyt h ARG 1717CO -0.21 0.97 0.48 0.00 -1.07 0.00 0.00 179.97 180.14 1uyt h ALA 1718N 0.56 1.85 -0.23 0.04 0.00 0.06 -2.06 119.26 119.48 1uyt h ALA 1718Ca -0.00 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1uyt h ALA 1718Cb 0.97 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1uyt h ALA 1718CO 0.08 0.00 0.18 -0.92 0.00 0.00 0.00 179.25 178.59 1uyt h TYR 1719N 0.62 0.00 -0.05 0.00 5.03 -1.36 -0.37 116.97 120.84 1uyt h TYR 1719Ca 0.34 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.65 1uyt h TYR 1719Cb 0.48 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.76 1uyt h TYR 1719CO -0.00 0.00 0.00 0.72 -1.32 0.00 0.00 178.16 177.56 1uyt n HIS 1720N -4.30 0.03 -0.04 -3.82 8.25 -0.78 -4.02 115.22 110.53 1uyt n HIS 1720Ca 0.03 -0.02 -0.07 0.00 -0.26 0.00 0.00 57.72 57.40 1uyt n HIS 1720Cb 0.32 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 1uyt n HIS 1720CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1uyt n ASP 1721N 0.83 2.53 -4.08 0.41 4.64 -0.29 -4.68 116.55 115.91 1uyt n ASP 1721Ca 0.16 0.00 -0.17 0.00 -1.38 0.00 0.00 54.79 53.40 1uyt n ASP 1721Cb 0.49 -0.16 -0.10 0.00 -1.04 0.00 0.00 41.12 40.31 1uyt n ASP 1721CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 1uyt s ILE 1722N -2.16 0.34 -0.24 5.18 -4.36 -0.39 -4.77 121.20 114.80 1uyt s ILE 1722Ca -0.11 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 57.99 1uyt s ILE 1722Cb 0.03 -2.54 -0.00 0.00 1.25 0.00 0.00 42.46 41.20 1uyt s ILE 1722CO 0.17 0.00 1.22 0.12 0.24 0.00 0.00 174.94 176.69 1uyt s PHE 1723N -3.71 2.90 -0.06 1.37 5.36 -1.26 -4.19 117.98 118.39 1uyt s PHE 1723Ca 0.37 1.05 0.03 0.00 -0.96 0.00 0.00 56.93 57.41 1uyt s PHE 1723Cb 0.06 -3.62 -0.03 0.00 -0.34 0.00 0.00 43.02 39.09 1uyt s PHE 1723CO 0.16 -1.42 -0.13 0.95 -1.46 0.00 0.00 175.22 173.32 1uyt s THR 1724N 3.76 3.18 -0.04 0.12 -4.23 -1.26 -1.66 115.64 115.51 1uyt s THR 1724Ca 0.53 -0.67 -0.18 0.00 -1.18 0.00 0.00 61.69 60.19 1uyt s THR 1724Cb -0.18 -2.27 0.03 0.00 1.34 0.00 0.00 72.50 71.43 1uyt s THR 1724CO 0.16 0.59 0.39 -0.51 -0.54 0.00 0.00 174.62 174.71 1uyt s ILE 1725N -0.63 0.04 -0.01 2.99 2.07 -1.16 -4.21 121.20 120.29 1uyt s ILE 1725Ca 0.09 -0.32 0.03 0.00 -1.41 0.00 0.00 60.65 59.04 1uyt s ILE 1725Cb -0.11 -0.68 -0.01 0.00 0.13 0.00 0.00 42.46 41.79 1uyt s ILE 1725CO 0.01 -0.18 -0.09 -0.89 -1.91 0.00 0.00 174.94 171.88 1uyt s THR 1726N -1.09 0.74 -0.19 4.00 2.01 -0.45 -0.93 115.64 119.72 1uyt s THR 1726Ca -0.11 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.47 1uyt s THR 1726Cb -0.04 -0.62 0.01 0.00 0.01 0.00 0.00 72.50 71.86 1uyt s THR 1726CO 0.05 0.20 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.79 1uyt s LEU 1727N -0.25 2.26 -0.78 4.42 2.96 0.35 -1.10 118.68 126.55 1uyt s LEU 1727Ca 0.03 -0.60 -0.22 0.00 -0.22 0.00 0.00 54.13 53.12 1uyt s LEU 1727Cb -0.04 -1.53 0.08 0.00 0.50 0.00 0.00 46.19 45.21 1uyt s LEU 1727CO -0.00 -0.00 1.10 -0.69 -1.32 0.00 0.00 176.35 175.43 1uyt s VAL 1728N 1.32 4.30 -0.99 1.68 1.01 -0.35 -0.71 120.40 126.67 1uyt s VAL 1728Ca 0.05 -0.61 0.25 0.00 0.00 0.00 0.00 61.98 61.67 1uyt s VAL 1728Cb -0.13 -4.78 0.01 0.00 0.00 0.00 0.00 36.38 31.48 1uyt s VAL 1728CO -0.11 -1.58 1.43 1.07 0.00 0.00 0.00 175.10 175.91 1uyt n THR 1729N 5.99 0.01 -3.85 3.92 5.66 -0.49 -2.29 114.28 123.23 1uyt n THR 1729Ca 0.08 -0.01 -0.05 0.00 -3.05 0.00 0.00 64.05 61.02 1uyt n THR 1729Cb 0.47 0.21 0.02 0.00 -1.55 0.00 0.00 70.33 69.49 1uyt n THR 1729CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uyt n ARG 1731N -0.64 0.00 -3.70 0.00 0.63 -1.26 -4.42 116.66 107.27 1uyt n ARG 1731Ca -0.05 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.60 1uyt n ARG 1731Cb 0.60 -0.93 -0.16 0.00 0.45 0.00 0.00 32.46 32.41 1uyt n ARG 1731CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1uyt s SER 1732N -0.93 3.05 0.09 6.15 0.15 -0.62 -1.33 113.70 120.27 1uyt s SER 1732Ca 0.59 -0.95 0.06 0.00 0.70 0.00 0.00 55.95 56.35 1uyt s SER 1732Cb -0.83 -0.56 -0.04 0.00 -1.71 0.00 0.00 66.02 62.88 1uyt s SER 1732CO 0.53 -0.34 -0.07 -0.69 1.20 0.00 0.00 173.24 173.87 1uyt s VAL 1733N 1.88 3.57 0.00 4.45 1.01 -1.25 -1.49 120.40 128.57 1uyt s VAL 1733Ca 0.02 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 60.84 1uyt s VAL 1733Cb -0.17 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1uyt s VAL 1733CO -0.13 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1uyt n GLY 1734N 0.71 2.22 0.37 4.51 0.00 -0.53 0.11 105.19 112.58 1uyt n GLY 1734Ca -0.13 0.42 0.19 0.00 0.00 0.00 0.00 46.02 46.50 1uyt n GLY 1734CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1uyt h ILE 1735N 0.00 0.76 -0.34 -0.61 6.09 -1.92 0.52 117.51 122.00 1uyt h ILE 1735Ca 0.00 -0.00 0.02 0.00 -1.37 0.00 0.00 64.86 63.51 1uyt h ILE 1735Cb 0.00 0.74 -0.03 0.00 0.47 0.00 0.00 36.82 38.01 1uyt h ILE 1735CO 0.00 0.00 0.18 1.23 -3.07 0.00 0.00 178.15 176.49 1uyt h GLY 1736N 0.01 0.46 0.83 8.18 0.00 0.48 -0.26 103.07 112.77 1uyt h GLY 1736Ca 0.24 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 1uyt h GLY 1736CO -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 176.54 176.63 1uyt h ALA 1737N 1.17 -0.04 -1.01 3.60 0.00 -0.96 -2.80 119.26 119.22 1uyt h ALA 1737Ca 0.14 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1uyt h ALA 1737Cb 0.03 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 1uyt h ALA 1737CO -0.08 -0.43 0.65 1.88 0.00 0.00 0.00 179.25 181.26 1uyt h TYR 1738N -0.21 1.21 -0.27 0.00 0.05 -1.24 -0.25 116.97 116.25 1uyt h TYR 1738Ca -0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1uyt h TYR 1738Cb 0.20 -0.40 -0.01 0.00 1.01 0.00 0.00 36.73 37.52 1uyt h TYR 1738CO -0.02 0.64 0.17 -0.07 -1.05 0.00 0.00 178.16 177.84 1uyt h LEU 1739N 1.20 0.32 -0.03 3.88 3.38 -0.92 0.47 115.31 123.61 1uyt h LEU 1739Ca 0.43 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.39 1uyt h LEU 1739Cb 0.14 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1uyt h LEU 1739CO -0.17 0.24 0.00 0.58 0.09 0.00 0.00 178.44 179.18 1uyt h VAL 1740N 0.37 1.21 -0.33 1.22 2.07 -0.78 -2.51 116.25 117.50 1uyt h VAL 1740Ca 0.10 -0.64 -0.14 0.00 0.82 0.00 0.00 66.70 66.84 1uyt h VAL 1740Cb -0.03 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1uyt h VAL 1740CO -0.02 0.17 -0.35 -0.09 0.02 0.00 0.00 177.57 177.30 1uyt h ARG 1741N -0.21 0.75 0.00 1.57 9.65 -1.01 -2.98 114.38 122.15 1uyt h ARG 1741Ca 0.01 -0.36 -0.04 0.00 -1.10 0.00 0.00 59.98 58.49 1uyt h ARG 1741Cb 0.27 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 1uyt h ARG 1741CO 0.00 0.98 -0.18 -0.07 2.80 0.00 0.00 179.97 183.50 1uyt h LEU 1742N 0.62 0.00 0.00 3.80 3.38 -0.09 0.13 115.31 123.15 1uyt h LEU 1742Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1uyt h LEU 1742Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1uyt h LEU 1742CO 0.08 0.18 -0.04 1.23 0.09 0.00 0.00 178.44 179.98 1uyt h GLY 1743N 1.20 0.00 0.00 0.83 0.00 -1.30 -3.40 103.07 100.40 1uyt h GLY 1743Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1uyt h GLY 1743CO 0.02 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.50 1uyt n GLN 1744N -2.47 0.00 -1.99 4.80 1.13 0.03 -4.52 117.38 114.36 1uyt n GLN 1744Ca 0.05 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.68 1uyt n GLN 1744Cb 0.46 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.78 1uyt n GLN 1744CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1uyt s ARG 1745N 0.00 3.85 -0.01 -1.09 0.52 -1.26 -4.81 118.95 116.16 1uyt s ARG 1745Ca 0.00 1.93 0.00 0.00 -0.52 0.00 0.00 55.73 57.14 1uyt s ARG 1745Cb 0.00 -4.07 0.01 0.00 0.52 0.00 0.00 34.95 31.40 1uyt s ARG 1745CO 0.00 -1.24 -0.01 0.00 0.02 0.00 0.00 175.30 174.08 1uyt s ALA 1746N 5.18 0.12 -0.26 2.13 0.00 -1.26 -1.35 121.76 126.33 1uyt s ALA 1746Ca 0.77 0.02 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 1uyt s ALA 1746Cb -0.30 -0.09 0.04 0.00 0.00 0.00 0.00 23.12 22.77 1uyt s ALA 1746CO 0.31 -0.00 -0.07 0.42 0.00 0.00 0.00 175.76 176.42 1uyt s ILE 1747N 0.23 2.71 -0.26 0.00 1.01 -0.26 -0.06 121.20 124.56 1uyt s ILE 1747Ca -0.02 -1.20 -0.12 0.00 0.00 0.00 0.00 60.65 59.31 1uyt s ILE 1747Cb -0.04 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.96 1uyt s ILE 1747CO -0.01 0.12 0.24 -1.58 0.00 0.00 0.00 174.94 173.71 1uyt s GLN 1748N 1.27 4.01 0.17 2.79 0.74 -0.14 -1.21 119.66 127.29 1uyt s GLN 1748Ca -0.02 -0.20 -0.30 0.00 0.05 0.00 0.00 55.36 54.89 1uyt s GLN 1748Cb -0.18 -3.62 -0.08 0.00 1.10 0.00 0.00 33.01 30.23 1uyt s GLN 1748CO -0.05 -0.14 1.22 0.08 -0.55 0.00 0.00 175.29 175.85 1uyt s VAL 1749N 1.63 3.57 0.19 1.34 1.01 -0.97 -1.53 120.40 125.64 1uyt s VAL 1749Ca 0.10 1.29 -0.33 0.00 0.00 0.00 0.00 61.98 63.04 1uyt s VAL 1749Cb -0.15 -3.82 -0.15 0.00 0.00 0.00 0.00 36.38 32.26 1uyt s VAL 1749CO 0.09 0.19 1.31 -0.62 0.00 0.00 0.00 175.10 176.07 1uyt n GLU 1750N 2.70 1.58 -0.62 2.72 1.02 0.22 -1.41 120.64 126.86 1uyt n GLU 1750Ca 0.05 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 1uyt n GLU 1750Cb 0.45 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.70 1uyt n GLU 1750CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uyt n GLY 1751N 2.25 1.24 3.28 0.62 0.00 -1.26 -4.97 105.19 106.35 1uyt n GLY 1751Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1uyt n GLY 1751CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uyt s GLN 1752N -0.20 2.67 0.52 1.61 -1.52 -0.50 -4.93 119.66 117.31 1uyt s GLN 1752Ca 0.00 -1.53 -0.20 0.00 -1.95 0.00 0.00 55.36 51.68 1uyt s GLN 1752Cb 0.00 -3.92 -0.07 0.00 -0.22 0.00 0.00 33.01 28.81 1uyt s GLN 1752CO 0.00 -1.05 1.11 -1.25 -0.25 0.00 0.00 175.29 173.84 1uyt s PRO 1753N 1.46 3.49 -0.34 2.91 0.04 -1.26 -4.73 135.00 136.57 1uyt s PRO 1753Ca 0.04 1.55 0.02 0.00 0.04 0.00 0.00 61.00 62.65 1uyt s PRO 1753Cb -0.25 -2.04 0.10 0.00 0.04 0.00 0.00 34.50 32.35 1uyt s PRO 1753CO 0.02 -0.72 0.06 0.42 0.04 0.00 0.00 177.00 176.82 1uyt s ILE 1754N -1.82 2.49 0.13 0.56 1.01 0.39 -1.59 121.20 122.36 1uyt s ILE 1754Ca 0.71 -2.18 0.03 0.00 0.00 0.00 0.00 60.65 59.22 1uyt s ILE 1754Cb -0.22 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 1uyt s ILE 1754CO 0.25 -0.53 -0.09 0.27 0.00 0.00 0.00 174.94 174.84 1uyt s ILE 1755N 0.98 1.00 -0.19 2.92 -4.36 -0.56 -3.98 121.20 117.01 1uyt s ILE 1755Ca 0.08 -2.02 -0.15 0.00 -0.26 0.00 0.00 60.65 58.30 1uyt s ILE 1755Cb -0.20 -1.79 -0.09 0.00 1.25 0.00 0.00 42.46 41.63 1uyt s ILE 1755CO -0.07 -0.79 -0.17 0.18 0.24 0.00 0.00 174.94 174.34 1uyt n LEU 1756N -0.14 1.88 -4.06 0.37 4.32 -1.26 -1.45 117.00 116.65 1uyt n LEU 1756Ca -0.11 0.46 -0.27 0.00 -0.02 0.00 0.00 56.01 56.08 1uyt n LEU 1756Cb 0.61 -0.85 -0.17 0.00 -1.62 0.00 0.00 43.42 41.39 1uyt n LEU 1756CO 0.31 -0.08 -0.49 -0.89 -1.22 0.00 0.00 177.39 175.03 1uyt s THR 1757N -2.48 1.37 0.85 -5.08 2.01 -1.26 -3.85 115.64 107.20 1uyt s THR 1757Ca -0.26 -0.61 -0.11 0.00 0.31 0.00 0.00 61.69 61.03 1uyt s THR 1757Cb 0.06 -1.24 0.11 0.00 0.01 0.00 0.00 72.50 71.44 1uyt s THR 1757CO 0.40 0.41 1.15 -0.83 -0.69 0.00 0.00 174.62 175.07 1uyt s GLY 1758N 0.69 1.84 0.16 4.40 0.00 -1.26 -4.81 107.32 108.34 1uyt s GLY 1758Ca -0.13 0.62 -0.17 0.00 0.00 0.00 0.00 44.72 45.04 1uyt s GLY 1758CO 0.03 1.03 1.71 0.00 0.00 0.00 0.00 173.10 175.87 1uyt h ALA 1759N -1.41 0.33 0.04 3.20 0.00 -1.93 -2.25 119.26 117.24 1uyt h ALA 1759Ca -0.44 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1uyt h ALA 1759Cb 1.27 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.17 1uyt h ALA 1759CO 0.45 -0.39 -0.53 -1.35 0.00 0.00 0.00 179.25 177.43 1uyt h PRO 1760N 0.11 -0.66 -0.92 0.00 0.11 -1.92 0.47 132.00 129.19 1uyt h PRO 1760Ca 0.17 0.05 0.15 0.00 0.11 0.00 0.00 66.00 66.48 1uyt h PRO 1760Cb 0.23 0.15 -0.08 0.00 0.11 0.00 0.00 31.00 31.41 1uyt h PRO 1760CO -0.28 -0.44 0.59 0.00 -0.21 0.00 0.00 178.00 177.66 1uyt h ALA 1761N -0.48 1.82 -0.14 -0.75 0.00 -1.90 -1.23 119.26 116.58 1uyt h ALA 1761Ca 0.01 0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 1uyt h ALA 1761Cb 0.72 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.41 1uyt h ALA 1761CO -0.33 -0.08 -0.81 0.82 0.00 0.00 0.00 179.25 178.85 1uyt h ILE 1762N 0.71 1.28 -0.84 0.00 2.04 -0.67 -2.42 117.51 117.60 1uyt h ILE 1762Ca 0.47 -2.00 0.03 0.00 1.00 0.00 0.00 64.86 64.36 1uyt h ILE 1762Cb 0.77 2.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.82 1uyt h ILE 1762CO -0.23 0.63 0.54 0.78 0.00 0.00 0.00 178.15 179.87 1uyt h ASN 1763N 0.53 0.91 -0.50 1.72 2.35 0.84 -1.68 115.58 119.74 1uyt h ASN 1763Ca -0.06 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1uyt h ASN 1763Cb 1.44 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.58 1uyt h ASN 1763CO 0.17 0.63 0.26 0.50 -1.65 0.00 0.00 177.43 177.33 1uyt h LYS 1764N 1.06 0.70 -0.71 0.81 3.64 -1.20 0.42 116.57 121.30 1uyt h LYS 1764Ca 0.33 -0.09 0.07 0.00 -1.27 0.00 0.00 60.65 59.68 1uyt h LYS 1764Cb -0.02 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 1uyt h LYS 1764CO -0.11 0.57 0.47 1.98 -2.27 0.00 0.00 179.45 180.09 1uyt h MET 1765N 0.66 0.69 -0.01 1.90 4.05 -0.85 -0.87 114.93 120.50 1uyt h MET 1765Ca 0.17 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.55 1uyt h MET 1765Cb 0.08 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 1uyt h MET 1765CO -0.02 0.46 -0.44 1.28 0.23 0.00 0.00 176.91 178.42 1uyt n LEU 1766N -4.48 1.24 0.00 3.39 4.32 -0.71 -4.96 117.00 115.80 1uyt n LEU 1766Ca 0.11 -0.39 0.00 0.00 -0.02 0.00 0.00 56.01 55.70 1uyt n LEU 1766Cb 0.24 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1uyt n LEU 1766CO 0.34 0.24 0.00 0.61 -1.22 0.00 0.00 177.39 177.36 1uyt n GLY 1767N 1.40 1.52 3.79 -0.72 0.00 0.14 -4.94 105.19 106.39 1uyt n GLY 1767Ca 0.09 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1uyt n GLY 1767CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uyt s ARG 1768N 0.00 4.35 -1.35 1.61 3.52 -1.23 -4.75 118.95 121.10 1uyt s ARG 1768Ca 0.00 1.35 -0.16 0.00 -0.13 0.00 0.00 55.73 56.79 1uyt s ARG 1768Cb 0.00 -2.57 0.07 0.00 -1.56 0.00 0.00 34.95 30.89 1uyt s ARG 1768CO 0.00 0.06 1.92 -1.91 -0.81 0.00 0.00 175.30 174.55 1uyt n GLU 1769N 0.06 3.10 0.08 5.12 4.07 -1.26 -4.64 120.64 127.17 1uyt n GLU 1769Ca 0.04 -3.07 -0.16 0.00 -0.06 0.00 0.00 57.16 53.91 1uyt n GLU 1769Cb 0.51 -3.36 -0.14 0.00 -0.06 0.00 0.00 31.44 28.38 1uyt n GLU 1769CO 0.00 0.00 0.00 -0.24 -0.06 0.00 0.00 177.13 176.83 1uyt h VAL 1770N 4.82 1.29 -3.46 6.31 3.04 -1.92 -3.46 116.25 122.88 1uyt h VAL 1770Ca 0.48 -2.90 -0.68 0.00 -1.01 0.00 0.00 66.70 62.59 1uyt h VAL 1770Cb 0.77 2.84 -0.17 0.00 -2.01 0.00 0.00 31.29 32.72 1uyt h VAL 1770CO 1.62 0.84 -0.65 -0.31 -1.01 0.00 0.00 177.57 178.06 1uyt s TYR 1771N -2.63 3.06 -0.26 3.17 1.51 -1.26 -4.88 117.35 116.06 1uyt s TYR 1771Ca -0.07 0.09 -0.08 0.00 -1.01 0.00 0.00 57.07 56.00 1uyt s TYR 1771Cb 0.07 -1.77 -0.13 0.00 -0.11 0.00 0.00 41.96 40.02 1uyt s TYR 1771CO 0.87 0.38 -0.30 2.41 -1.11 0.00 0.00 175.55 177.79 1uyt n THR 1772N 2.28 1.45 -4.36 -0.71 -1.04 -1.26 -4.86 114.28 105.77 1uyt n THR 1772Ca -0.18 -0.43 -0.23 0.00 -2.04 0.00 0.00 64.05 61.17 1uyt n THR 1772Cb 0.53 -1.70 -0.13 0.00 -1.82 0.00 0.00 70.33 67.21 1uyt n THR 1772CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1uyt s SER 1773N -7.06 2.27 0.49 8.00 0.15 -1.26 -4.99 113.70 111.29 1uyt s SER 1773Ca -0.36 -0.60 0.33 0.00 0.70 0.00 0.00 55.95 56.02 1uyt s SER 1773Cb 0.12 -0.14 1.72 0.00 -1.71 0.00 0.00 66.02 66.01 1uyt s SER 1773CO 0.50 0.06 2.00 0.78 1.20 0.00 0.00 173.24 177.79 1uyt h ASN 1774N 4.42 0.00 0.43 5.45 2.35 -1.99 -1.49 115.58 124.75 1uyt h ASN 1774Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1uyt h ASN 1774Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1uyt h ASN 1774CO 0.41 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 176.37 1uyt n LEU 1775N -2.69 0.51 0.15 1.61 4.77 -1.26 -1.07 117.00 119.02 1uyt n LEU 1775Ca -0.02 0.66 0.04 0.00 -0.03 0.00 0.00 56.01 56.67 1uyt n LEU 1775Cb 0.10 -0.64 0.04 0.00 -2.33 0.00 0.00 43.42 40.59 1uyt n LEU 1775CO 0.17 -0.64 0.49 1.56 -1.33 0.00 0.00 177.39 177.64 1uyt h GLN 1776N 0.00 0.00 0.04 3.23 4.20 -1.65 -1.54 115.11 119.39 1uyt h GLN 1776Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 1uyt h GLN 1776Cb 0.21 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1uyt h GLN 1776CO 0.00 0.40 -2.12 1.28 -0.67 0.00 0.00 178.83 177.73 1uyt n LEU 1777N -3.18 2.45 -1.26 1.46 4.77 -0.28 -4.74 117.00 116.22 1uyt n LEU 1777Ca 0.02 0.17 0.05 0.00 -0.03 0.00 0.00 56.01 56.22 1uyt n LEU 1777Cb 0.70 -0.97 0.07 0.00 -2.33 0.00 0.00 43.42 40.90 1uyt n LEU 1777CO 0.40 0.71 0.14 0.61 -1.33 0.00 0.00 177.39 177.92 1uyt n GLY 1778N 1.81 2.12 3.92 -0.72 0.00 -0.23 -4.89 105.19 107.20 1uyt n GLY 1778Ca -0.41 -0.97 -0.28 0.00 0.00 0.00 0.00 46.02 44.35 1uyt n GLY 1778CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uyt s GLY 1779N -2.33 1.67 0.55 -0.02 0.00 -0.58 -0.47 107.32 106.14 1uyt s GLY 1779Ca 0.35 -0.92 0.23 0.00 0.00 0.00 0.00 44.72 44.39 1uyt s GLY 1779CO -0.14 -0.36 2.11 -0.91 0.00 0.00 0.00 173.10 173.80 1uyt h THR 1780N -1.11 0.73 0.00 0.90 1.35 -1.87 0.65 112.91 113.56 1uyt h THR 1780Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1uyt h THR 1780Cb 1.30 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1uyt h THR 1780CO 0.56 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.83 1uyt n GLN 1781N -4.21 0.09 -0.04 4.72 3.00 -1.26 -1.51 117.38 118.16 1uyt n GLN 1781Ca 0.01 0.20 -0.07 0.00 -0.01 0.00 0.00 57.00 57.14 1uyt n GLN 1781Cb 0.27 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 28.99 1uyt n GLN 1781CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1uyt n ILE 1782N -1.41 1.37 0.12 5.09 2.08 0.13 -4.46 119.36 122.28 1uyt n ILE 1782Ca 0.05 0.21 -0.02 0.00 0.56 0.00 0.00 62.75 63.54 1uyt n ILE 1782Cb 0.15 -2.04 0.13 0.00 -0.75 0.00 0.00 39.64 37.14 1uyt n ILE 1782CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 1uyt h MET 1783N -0.62 0.04 0.04 0.38 2.86 -1.37 0.15 114.93 116.41 1uyt h MET 1783Ca -0.03 -0.03 -0.26 0.00 -2.06 0.00 0.00 59.70 57.32 1uyt h MET 1783Cb 0.68 0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.36 1uyt h MET 1783CO -0.02 0.68 -1.08 -0.92 1.06 0.00 0.00 176.91 176.63 1uyt h TYR 1784N 0.03 0.86 0.00 -0.22 3.20 -1.47 0.30 116.97 119.66 1uyt h TYR 1784Ca -0.01 -0.50 -0.06 0.00 3.14 0.00 0.00 58.73 61.30 1uyt h TYR 1784Cb 1.16 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 1uyt h TYR 1784CO 0.00 1.34 -0.30 -0.91 -1.64 0.00 0.00 178.16 176.65 1uyt h ASN 1785N 0.29 0.00 -0.03 -2.11 4.21 -1.56 -3.18 115.58 113.20 1uyt h ASN 1785Ca -0.13 0.00 -0.15 0.00 1.21 0.00 0.00 56.30 57.23 1uyt h ASN 1785Cb 1.74 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.95 1uyt h ASN 1785CO 0.20 0.30 -0.57 -1.13 -1.29 0.00 0.00 177.43 174.95 1uyt h ASN 1786N 0.00 0.55 0.00 5.81 -0.73 -0.63 -3.38 115.58 117.20 1uyt h ASN 1786Ca -0.00 -0.72 0.00 0.00 1.87 0.00 0.00 56.30 57.44 1uyt h ASN 1786Cb 0.97 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 39.40 1uyt h ASN 1786CO 0.04 1.20 0.00 0.61 -0.37 0.00 0.00 177.43 178.91 1uyt n GLY 1787N 0.95 0.72 0.20 1.57 0.00 -0.50 -4.92 105.19 103.21 1uyt n GLY 1787Ca -0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1uyt n GLY 1787CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1uyt h VAL 1788N 0.00 1.31 -3.72 1.61 2.07 -1.50 -3.40 116.25 112.62 1uyt h VAL 1788Ca 0.00 -1.99 -0.64 0.00 0.82 0.00 0.00 66.70 64.89 1uyt h VAL 1788Cb 0.00 2.14 -0.15 0.00 -1.52 0.00 0.00 31.29 31.76 1uyt h VAL 1788CO 0.00 0.62 -0.26 -0.44 0.02 0.00 0.00 177.57 177.51 1uyt s SER 1789N -7.02 6.22 0.26 0.57 0.01 0.93 -4.45 113.70 110.23 1uyt s SER 1789Ca -0.11 0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.35 1uyt s SER 1789Cb 0.07 -2.20 0.34 0.00 0.21 0.00 0.00 66.02 64.43 1uyt s SER 1789CO 0.89 -0.23 1.61 0.45 0.41 0.00 0.00 173.24 176.36 1uyt h HIS 1790N 8.27 0.18 -3.36 2.43 3.86 -0.70 -3.39 115.15 122.43 1uyt h HIS 1790Ca -0.31 -0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 58.80 1uyt h HIS 1790Cb 1.16 -0.03 -0.11 0.00 1.06 0.00 0.00 27.41 29.49 1uyt h HIS 1790CO 0.74 0.68 -0.01 -0.51 0.86 0.00 0.00 177.93 179.69 1uyt s LEU 1791N -7.87 0.19 0.25 2.43 1.43 -1.09 -0.26 118.68 113.76 1uyt s LEU 1791Ca -0.03 -0.48 0.12 0.00 -1.03 0.00 0.00 54.13 52.71 1uyt s LEU 1791Cb 0.12 2.02 -0.05 0.00 0.03 0.00 0.00 46.19 48.32 1uyt s LEU 1791CO 0.78 -1.00 -0.20 0.42 0.23 0.00 0.00 176.35 176.58 1uyt s THR 1792N -3.87 2.51 -0.01 5.49 -4.23 -1.26 -0.96 115.64 113.31 1uyt s THR 1792Ca 0.09 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 1uyt s THR 1792Cb -0.00 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.56 1uyt s THR 1792CO -0.04 -0.31 -0.01 0.00 -0.54 0.00 0.00 174.62 173.72 1uyt s ALA 1793N -2.24 0.17 0.39 3.99 0.00 -0.58 -4.86 121.76 118.62 1uyt s ALA 1793Ca 0.27 0.04 0.08 0.00 0.00 0.00 0.00 51.96 52.36 1uyt s ALA 1793Cb -0.06 -0.13 0.78 0.00 0.00 0.00 0.00 23.12 23.71 1uyt s ALA 1793CO 0.14 -0.01 1.94 -0.24 0.00 0.00 0.00 175.76 177.59 1uyt h VAL 1794N 5.55 1.16 -3.38 0.00 3.04 -1.93 0.66 116.25 121.36 1uyt h VAL 1794Ca -0.33 -0.63 -0.02 0.00 -1.01 0.00 0.00 66.70 64.71 1uyt h VAL 1794Cb 1.17 1.00 -0.06 0.00 -2.01 0.00 0.00 31.29 31.39 1uyt h VAL 1794CO 0.50 0.21 0.05 1.51 -1.01 0.00 0.00 177.57 178.82 1uyt s ASP 1795N -6.82 -0.06 0.15 3.17 1.47 -1.26 -4.51 116.67 108.80 1uyt s ASP 1795Ca -0.06 -0.88 -0.23 0.00 1.18 0.00 0.00 52.55 52.55 1uyt s ASP 1795Cb 0.16 0.68 0.02 0.00 -0.34 0.00 0.00 42.92 43.43 1uyt s ASP 1795CO 0.74 -1.29 1.63 0.44 0.68 0.00 0.00 175.17 177.36 1uyt h ASP 1796N 2.12 -0.81 -0.89 2.11 3.32 -1.94 -0.40 116.42 119.94 1uyt h ASP 1796Ca -0.24 0.14 0.13 0.00 0.02 0.00 0.00 57.03 57.07 1uyt h ASP 1796Cb 1.25 0.37 -0.07 0.00 0.22 0.00 0.00 39.33 41.10 1uyt h ASP 1796CO 0.32 -0.29 0.57 0.25 -1.72 0.00 0.00 179.24 178.37 1uyt h LEU 1797N -0.27 0.70 -0.68 1.55 5.85 -1.97 0.18 115.31 120.67 1uyt h LEU 1797Ca 0.13 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 1uyt h LEU 1797Cb 0.47 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1uyt h LEU 1797CO -0.38 0.38 -0.04 0.00 -0.34 0.00 0.00 178.44 178.06 1uyt h ALA 1798N 1.59 0.88 -0.28 1.25 0.00 -1.54 -1.54 119.26 119.61 1uyt h ALA 1798Ca 0.44 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1uyt h ALA 1798Cb 0.61 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1uyt h ALA 1798CO -0.20 0.65 0.16 0.78 0.00 0.00 0.00 179.25 180.65 1uyt h GLY 1799N 0.98 0.41 1.29 0.00 0.00 0.77 -1.80 103.07 104.71 1uyt h GLY 1799Ca 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 1uyt h GLY 1799CO 0.03 0.17 0.29 -2.08 0.00 0.00 0.00 176.54 174.95 1uyt h VAL 1800N 0.35 1.22 -0.44 4.60 2.07 -0.74 -0.96 116.25 122.34 1uyt h VAL 1800Ca 0.10 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 1uyt h VAL 1800Cb 0.03 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1uyt h VAL 1800CO -0.02 0.26 0.08 -0.33 0.02 0.00 0.00 177.57 177.58 1uyt h GLU 1801N 0.92 0.72 -0.72 1.57 5.08 -0.97 -1.01 114.58 120.17 1uyt h GLU 1801Ca 0.22 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 1uyt h GLU 1801Cb 0.13 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1uyt h GLU 1801CO -0.03 0.75 0.19 0.87 -1.00 0.00 0.00 179.01 179.79 1uyt h LYS 1802N 0.59 1.14 -0.19 2.33 1.57 -1.00 0.18 116.57 121.19 1uyt h LYS 1802Ca 0.13 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1uyt h LYS 1802Cb 0.37 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1uyt h LYS 1802CO 0.01 0.99 0.08 0.82 -0.57 0.00 0.00 179.45 180.78 1uyt h ILE 1803N 1.08 0.98 -0.56 1.86 2.04 -0.84 0.25 117.51 122.32 1uyt h ILE 1803Ca 0.23 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.98 1uyt h ILE 1803Cb 0.35 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1uyt h ILE 1803CO -0.00 0.03 0.17 0.58 0.00 0.00 0.00 178.15 178.94 1uyt h VAL 1804N 0.18 1.24 -0.65 1.67 2.07 -0.95 -1.36 116.25 118.46 1uyt h VAL 1804Ca 0.08 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 1uyt h VAL 1804Cb 0.03 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1uyt h VAL 1804CO -0.07 0.30 0.33 -0.08 0.02 0.00 0.00 177.57 178.08 1uyt h GLU 1805N 0.79 0.92 -0.90 1.57 4.81 -0.27 -2.21 114.58 119.28 1uyt h GLU 1805Ca 0.18 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1uyt h GLU 1805Cb 0.28 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1uyt h GLU 1805CO -0.01 0.72 0.53 2.35 -0.73 0.00 0.00 179.01 181.87 1uyt h TRP 1806N 0.89 1.19 0.00 0.92 2.91 -0.11 -1.89 115.95 119.87 1uyt h TRP 1806Ca 0.22 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.23 1uyt h TRP 1806Cb 0.08 -0.39 0.00 0.00 -0.51 0.00 0.00 29.16 28.35 1uyt h TRP 1806CO -0.00 0.80 0.00 0.52 -1.03 0.00 0.00 178.44 178.73 1uyt h MET 1807N 1.24 0.00 0.00 2.65 2.86 -0.74 -3.07 114.93 117.87 1uyt h MET 1807Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1uyt h MET 1807Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 1uyt h MET 1807CO -0.06 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 176.78 1uyt n SER 1808N -2.90 0.05 -0.40 1.22 3.41 -0.71 -0.88 113.62 113.41 1uyt n SER 1808Ca 0.01 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.22 1uyt n SER 1808Cb 0.29 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1uyt n SER 1808CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1uyt n TYR 1809N -1.56 0.00 -4.08 7.33 4.02 -1.16 -4.89 117.16 116.82 1uyt n TYR 1809Ca 0.01 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.56 1uyt n TYR 1809Cb 0.08 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.33 1uyt n TYR 1809CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1uyt s VAL 1810N -1.95 4.92 0.52 -0.72 1.01 -0.06 -4.56 120.40 119.56 1uyt s VAL 1810Ca 0.14 -0.19 -0.22 0.00 0.00 0.00 0.00 61.98 61.72 1uyt s VAL 1810Cb 0.14 -3.19 -0.07 0.00 0.00 0.00 0.00 36.38 33.26 1uyt s VAL 1810CO 0.42 0.47 1.10 -2.65 0.00 0.00 0.00 175.10 174.44 1uyt n PRO 1811N 1.57 1.34 -0.27 2.72 -0.02 -1.26 -4.66 135.00 134.42 1uyt n PRO 1811Ca -0.16 0.49 0.18 0.00 -2.02 0.00 0.00 63.50 62.00 1uyt n PRO 1811Cb 0.53 -2.25 0.48 0.00 -0.02 0.00 0.00 33.50 32.24 1uyt n PRO 1811CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uyt h ALA 1812N 1.20 2.11 -2.96 3.55 0.00 -1.90 -3.44 119.26 117.82 1uyt h ALA 1812Ca -0.48 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1uyt h ALA 1812Cb 1.33 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.99 1uyt h ALA 1812CO 0.55 -0.42 0.23 -1.59 0.00 0.00 0.00 179.25 178.02 1uyt s LYS 1813N -5.51 1.42 0.03 0.00 -2.85 -1.26 -4.52 119.74 107.05 1uyt s LYS 1813Ca -0.09 -0.63 -0.39 0.00 -1.00 0.00 0.00 55.97 53.87 1uyt s LYS 1813Cb 0.23 0.58 -0.19 0.00 -2.06 0.00 0.00 37.83 36.40 1uyt s LYS 1813CO 0.79 -0.63 1.12 -2.13 0.10 0.00 0.00 175.35 174.60 1uyt n ARG 1814N -0.40 0.31 -0.88 1.78 0.63 0.12 -1.62 116.66 116.60 1uyt n ARG 1814Ca -0.12 0.11 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1uyt n ARG 1814Cb 0.63 -1.63 0.00 0.00 0.45 0.00 0.00 32.46 31.91 1uyt n ARG 1814CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1uyt n ASN 1815N 1.78 -1.65 -4.88 6.15 5.03 -1.26 -4.99 115.26 115.44 1uyt n ASN 1815Ca 0.19 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.34 1uyt n ASN 1815Cb 0.12 -1.27 -0.01 0.00 -1.02 0.00 0.00 39.78 37.60 1uyt n ASN 1815CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1uyt s MET 1816N -0.56 3.68 0.48 3.52 -1.94 -0.64 -5.01 119.30 118.84 1uyt s MET 1816Ca 0.00 0.56 -0.23 0.00 -1.71 0.00 0.00 55.69 54.31 1uyt s MET 1816Cb 0.00 -2.25 -0.08 0.00 2.01 0.00 0.00 34.83 34.51 1uyt s MET 1816CO 0.00 -0.29 1.20 -2.30 -0.01 0.00 0.00 175.02 173.62 1uyt n PRO 1817N -2.07 1.62 -1.81 2.03 -0.02 -1.26 -4.82 135.00 128.68 1uyt n PRO 1817Ca 0.04 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 1uyt n PRO 1817Cb 0.54 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 1uyt n PRO 1817CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1uyt s VAL 1818N -1.28 2.09 -0.12 -1.45 -7.23 -1.26 -4.66 120.40 106.49 1uyt s VAL 1818Ca 0.66 0.08 -0.29 0.00 -1.81 0.00 0.00 61.98 60.62 1uyt s VAL 1818Cb -0.48 -3.05 -0.05 0.00 0.56 0.00 0.00 36.38 33.35 1uyt s VAL 1818CO 0.54 0.02 1.86 -2.16 -0.31 0.00 0.00 175.10 175.05 1uyt s PRO 1819N -1.47 3.79 -0.11 4.82 0.04 -1.26 -4.91 135.00 135.90 1uyt s PRO 1819Ca 0.57 2.09 -0.20 0.00 0.04 0.00 0.00 61.00 63.49 1uyt s PRO 1819Cb -0.47 -4.15 -0.04 0.00 0.04 0.00 0.00 34.50 29.89 1uyt s PRO 1819CO 0.57 -1.33 0.58 0.42 0.04 0.00 0.00 177.00 177.28 1uyt s ILE 1820N 5.56 5.12 -0.34 0.56 1.01 -1.26 -4.24 121.20 127.60 1uyt s ILE 1820Ca 0.83 1.16 -0.01 0.00 0.00 0.00 0.00 60.65 62.63 1uyt s ILE 1820Cb -0.33 -3.91 0.12 0.00 0.01 0.00 0.00 42.46 38.35 1uyt s ILE 1820CO 0.34 0.27 0.18 -0.22 0.00 0.00 0.00 174.94 175.51 1uyt s LEU 1821N 0.87 1.12 0.06 2.97 2.96 -0.85 -4.87 118.68 120.94 1uyt s LEU 1821Ca 0.30 -1.91 -0.30 0.00 -0.22 0.00 0.00 54.13 52.01 1uyt s LEU 1821Cb -0.16 -0.48 -0.05 0.00 0.50 0.00 0.00 46.19 46.00 1uyt s LEU 1821CO 0.13 -0.35 0.98 -1.61 -1.32 0.00 0.00 176.35 174.18 1uyt s GLU 1822N 1.37 4.62 0.00 1.98 2.02 -1.26 -4.38 118.70 123.04 1uyt s GLU 1822Ca 0.14 1.46 0.00 0.00 0.02 0.00 0.00 54.97 56.59 1uyt s GLU 1822Cb -0.21 -3.41 0.00 0.00 0.10 0.00 0.00 34.13 30.61 1uyt s GLU 1822CO -0.13 0.07 0.00 0.25 0.02 0.00 0.00 175.26 175.47 1uyt n THR 1823N 3.31 0.00 -0.23 3.63 -2.24 -1.26 -5.02 114.28 112.47 1uyt n THR 1823Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1uyt n THR 1823Cb 0.50 -0.41 0.12 0.00 -2.10 0.00 0.00 70.33 68.43 1uyt n THR 1823CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1uyt h LYS 1824N 0.00 0.56 -5.75 -0.78 6.56 -1.96 -3.37 116.57 111.82 1uyt h LYS 1824Ca 0.00 -0.03 -0.35 0.00 -1.06 0.00 0.00 60.65 59.21 1uyt h LYS 1824Cb 0.00 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.50 1uyt h LYS 1824CO 0.00 0.37 0.97 0.34 -2.06 0.00 0.00 179.45 179.07 1uyt s ASP 1825N -5.50 4.95 0.83 0.86 3.68 -1.26 -4.95 116.67 115.28 1uyt s ASP 1825Ca -0.13 -0.02 -0.10 0.00 2.13 0.00 0.00 52.55 54.42 1uyt s ASP 1825Cb 0.17 -2.54 0.09 0.00 -1.45 0.00 0.00 42.92 39.19 1uyt s ASP 1825CO 0.76 -2.77 1.11 0.28 0.13 0.00 0.00 175.17 174.67 1uyt s THR 1826N 10.56 2.88 0.28 1.71 -1.32 -1.26 -4.73 115.64 123.76 1uyt s THR 1826Ca 0.75 0.28 0.09 0.00 -1.21 0.00 0.00 61.69 61.60 1uyt s THR 1826Cb -0.11 -2.61 -0.00 0.00 -1.51 0.00 0.00 72.50 68.27 1uyt s THR 1826CO 0.11 -0.37 1.65 4.11 -2.21 0.00 0.00 174.62 177.90 1uyt h TRP 1827N -1.40 0.10 -1.39 9.09 5.08 -1.92 -3.40 115.95 122.09 1uyt h TRP 1827Ca -0.44 -0.03 -0.61 0.00 1.08 0.00 0.00 58.89 58.89 1uyt h TRP 1827Cb 1.25 -0.02 -0.11 0.00 -3.00 0.00 0.00 29.16 27.28 1uyt h TRP 1827CO 0.55 0.61 1.37 0.34 -1.28 0.00 0.00 178.44 180.03 1uyt s ASP 1828N -6.88 6.49 -0.18 0.11 3.68 -1.26 -4.43 116.67 114.20 1uyt s ASP 1828Ca -0.02 -1.45 -0.32 0.00 2.13 0.00 0.00 52.55 52.89 1uyt s ASP 1828Cb 0.13 -2.54 0.14 0.00 -1.45 0.00 0.00 42.92 39.20 1uyt s ASP 1828CO 0.77 -1.47 1.16 0.00 0.13 0.00 0.00 175.17 175.75 1uyt s ARG 1829N 4.72 0.37 0.77 4.34 1.70 -1.26 -5.14 118.95 124.44 1uyt s ARG 1829Ca 0.43 -0.06 -0.12 0.00 -0.47 0.00 0.00 55.73 55.51 1uyt s ARG 1829Cb -0.01 0.17 0.05 0.00 -0.57 0.00 0.00 34.95 34.59 1uyt s ARG 1829CO -0.08 -0.15 1.14 -2.14 -1.08 0.00 0.00 175.30 172.99 1uyt s PRO 1830N -1.97 2.35 -0.23 3.89 0.02 -1.26 -4.49 135.00 133.30 1uyt s PRO 1830Ca 0.07 0.30 -0.16 0.00 0.02 0.00 0.00 61.00 61.22 1uyt s PRO 1830Cb -0.01 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 1uyt s PRO 1830CO -0.05 -1.36 0.42 0.08 -0.33 0.00 0.00 177.00 175.76 1uyt s VAL 1831N -3.45 5.16 0.00 3.83 1.01 0.77 -4.94 120.40 122.79 1uyt s VAL 1831Ca 0.60 0.72 0.00 0.00 0.00 0.00 0.00 61.98 63.30 1uyt s VAL 1831Cb -0.11 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1uyt s VAL 1831CO 0.51 0.19 0.06 0.47 0.00 0.00 0.00 175.10 176.33 1uyt n ASP 1832N 4.92 0.00 -4.57 3.32 8.00 -0.79 -4.56 116.55 122.87 1uyt n ASP 1832Ca -0.07 0.06 -0.51 0.00 0.71 0.00 0.00 54.79 54.97 1uyt n ASP 1832Cb 0.51 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.55 1uyt n ASP 1832CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1uyt n PHE 1833N -0.50 1.27 -3.86 1.24 7.35 -1.11 -4.98 117.46 116.88 1uyt n PHE 1833Ca 0.00 0.71 -0.15 0.00 -0.76 0.00 0.00 57.45 57.25 1uyt n PHE 1833Cb 0.00 -2.27 -0.15 0.00 0.35 0.00 0.00 39.48 37.40 1uyt n PHE 1833CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1uyt s THR 1834N 0.13 0.04 0.62 -2.13 2.01 -1.26 -4.88 115.64 110.16 1uyt s THR 1834Ca 0.80 0.10 -0.18 0.00 0.31 0.00 0.00 61.69 62.73 1uyt s THR 1834Cb -0.95 -0.13 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 1uyt s THR 1834CO 0.50 0.08 1.19 -2.84 -0.69 0.00 0.00 174.62 172.87 1uyt s PRO 1835N 0.72 2.86 -0.05 4.92 0.02 -1.26 -5.05 135.00 137.16 1uyt s PRO 1835Ca -0.06 1.77 0.06 0.00 0.02 0.00 0.00 61.00 62.79 1uyt s PRO 1835Cb -0.09 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.49 1uyt s PRO 1835CO -0.02 -1.28 -0.24 0.99 -0.33 0.00 0.00 177.00 176.12 1uyt s THR 1836N -1.72 2.15 0.02 0.99 2.01 -1.26 -4.75 115.64 113.07 1uyt s THR 1836Ca 0.76 -1.05 0.29 0.00 0.31 0.00 0.00 61.69 62.00 1uyt s THR 1836Cb -0.29 -1.77 0.30 0.00 0.01 0.00 0.00 72.50 70.75 1uyt s THR 1836CO 0.35 0.57 1.89 0.78 -0.69 0.00 0.00 174.62 177.52 1uyt h ASN 1837N 5.87 0.00 -0.43 3.53 4.21 -1.96 -2.66 115.58 124.13 1uyt h ASN 1837Ca -0.36 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 56.84 1uyt h ASN 1837Cb 1.16 0.00 -0.34 0.00 -1.12 0.00 0.00 38.32 38.02 1uyt h ASN 1837CO 0.47 0.00 -0.88 0.47 -1.29 0.00 0.00 177.43 176.20 1uyt n ASP 1838N -2.55 2.88 -3.66 5.81 8.00 -1.26 -5.02 116.55 120.75 1uyt n ASP 1838Ca -0.01 -3.04 -0.08 0.00 0.71 0.00 0.00 54.79 52.36 1uyt n ASP 1838Cb 0.10 -0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 40.70 1uyt n ASP 1838CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1uyt s GLU 1839N -3.14 0.35 0.38 -1.24 2.02 -1.00 -5.14 118.70 110.91 1uyt s GLU 1839Ca 0.39 1.03 -0.27 0.00 0.02 0.00 0.00 54.97 56.14 1uyt s GLU 1839Cb 0.37 0.32 -0.11 0.00 0.10 0.00 0.00 34.13 34.81 1uyt s GLU 1839CO -0.03 -0.24 1.36 2.41 0.02 0.00 0.00 175.26 178.78 1uyt n THR 1840N 5.25 2.16 -3.77 3.63 -1.04 -1.26 -4.33 114.28 114.91 1uyt n THR 1840Ca -0.11 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.05 61.30 1uyt n THR 1840Cb 0.50 -1.72 -0.07 0.00 -1.82 0.00 0.00 70.33 67.23 1uyt n THR 1840CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1uyt s TYR 1841N -1.13 -0.03 -0.29 -1.42 -0.85 -1.26 -5.01 117.35 107.36 1uyt s TYR 1841Ca 0.56 -0.24 -0.15 0.00 -0.52 0.00 0.00 57.07 56.73 1uyt s TYR 1841Cb -0.52 0.07 -0.03 0.00 0.38 0.00 0.00 41.96 41.86 1uyt s TYR 1841CO 0.62 -0.55 0.36 0.34 -1.52 0.00 0.00 175.55 174.81 1uyt s ASP 1842N -2.44 6.22 0.41 -0.18 3.68 -1.26 -4.63 116.67 118.47 1uyt s ASP 1842Ca -0.01 0.11 0.21 0.00 2.13 0.00 0.00 52.55 54.99 1uyt s ASP 1842Cb 0.01 -2.20 1.16 0.00 -1.45 0.00 0.00 42.92 40.44 1uyt s ASP 1842CO -0.07 -0.23 1.77 1.62 0.13 0.00 0.00 175.17 178.38 1uyt h VAL 1843N 5.44 0.49 -0.64 1.11 3.04 -2.00 0.49 116.25 124.19 1uyt h VAL 1843Ca -0.31 -0.12 0.19 0.00 -1.01 0.00 0.00 66.70 65.45 1uyt h VAL 1843Cb 1.16 0.12 -0.03 0.00 -2.01 0.00 0.00 31.29 30.53 1uyt h VAL 1843CO 0.66 0.06 0.48 0.03 -1.01 0.00 0.00 177.57 177.79 1uyt h ARG 1844N 0.34 0.00 -0.24 4.17 3.08 -1.92 0.19 114.38 120.00 1uyt h ARG 1844Ca 0.60 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.56 1uyt h ARG 1844Cb 1.62 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.66 1uyt h ARG 1844CO -0.28 0.00 -0.25 -1.49 -1.07 0.00 0.00 179.97 176.88 1uyt h TRP 1845N 0.00 0.51 0.00 3.04 6.55 -0.19 -0.00 115.95 125.86 1uyt h TRP 1845Ca 0.30 -0.11 -0.13 0.00 0.95 0.00 0.00 58.89 59.91 1uyt h TRP 1845Cb 1.27 -0.13 -0.02 0.00 -0.86 0.00 0.00 29.16 29.42 1uyt h TRP 1845CO 0.00 0.67 -0.60 0.52 -1.05 0.00 0.00 178.44 177.98 1uyt h MET 1846N 0.41 0.00 0.04 0.49 2.86 -0.73 -1.01 114.93 116.99 1uyt h MET 1846Ca 0.06 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1uyt h MET 1846Cb 0.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1uyt h MET 1846CO 0.05 0.60 -0.02 0.82 1.06 0.00 0.00 176.91 179.42 1uyt h ILE 1847N 0.00 0.00 0.00 -1.22 2.04 -0.92 0.21 117.51 117.62 1uyt h ILE 1847Ca -0.01 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1uyt h ILE 1847Cb 1.07 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1uyt h ILE 1847CO 0.08 0.00 -1.55 -1.84 0.00 0.00 0.00 178.15 174.84 1uyt n GLU 1848N -3.15 0.63 0.00 2.37 0.28 -0.07 -0.95 120.64 119.76 1uyt n GLU 1848Ca -0.01 -0.02 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1uyt n GLU 1848Cb 0.02 -1.68 0.00 0.00 1.43 0.00 0.00 31.44 31.22 1uyt n GLU 1848CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1uyt n GLY 1849N 1.26 1.37 3.22 -1.84 0.00 -0.38 -3.84 105.19 104.97 1uyt n GLY 1849Ca -0.04 -2.12 -0.19 0.00 0.00 0.00 0.00 46.02 43.67 1uyt n GLY 1849CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uyt s ARG 1850N -1.61 0.96 -0.45 1.61 3.52 -0.46 -4.33 118.95 118.19 1uyt s ARG 1850Ca 0.00 -1.12 -0.10 0.00 -0.13 0.00 0.00 55.73 54.38 1uyt s ARG 1850Cb 0.00 -0.96 0.10 0.00 -1.56 0.00 0.00 34.95 32.53 1uyt s ARG 1850CO 0.00 0.20 0.32 -2.00 -0.81 0.00 0.00 175.30 173.02 1uyt s GLU 1851N -2.19 2.62 0.43 5.12 2.56 -1.26 -0.98 118.70 124.99 1uyt s GLU 1851Ca 0.04 -1.59 0.08 0.00 0.00 0.00 0.00 54.97 53.50 1uyt s GLU 1851Cb -0.08 -3.91 -0.01 0.00 2.00 0.00 0.00 34.13 32.13 1uyt s GLU 1851CO 0.03 -1.09 0.42 0.95 -0.56 0.00 0.00 175.26 175.01 1uyt s THR 1852N 1.43 2.66 0.23 -1.70 -4.23 -0.93 -5.01 115.64 108.09 1uyt s THR 1852Ca 0.04 -1.29 -0.05 0.00 -1.18 0.00 0.00 61.69 59.21 1uyt s THR 1852Cb -0.25 -2.95 0.11 0.00 1.34 0.00 0.00 72.50 70.75 1uyt s THR 1852CO 0.01 0.00 1.73 -0.08 -0.54 0.00 0.00 174.62 175.75 1uyt h GLU 1853N 0.94 0.96 -1.58 3.99 4.81 -2.02 -2.82 114.58 118.85 1uyt h GLU 1853Ca -0.41 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 58.55 1uyt h GLU 1853Cb 1.27 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1uyt h GLU 1853CO 0.55 0.90 0.04 -1.13 -0.73 0.00 0.00 179.01 178.64 1uyt n SER 1854N -4.22 4.50 0.00 1.04 3.41 -1.26 -4.94 113.62 112.15 1uyt n SER 1854Ca 0.04 -2.31 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 1uyt n SER 1854Cb 0.29 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1uyt n SER 1854CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uyt n GLY 1855N 1.01 -3.31 3.76 5.00 0.00 -1.07 -4.97 105.19 105.62 1uyt n GLY 1855Ca 0.03 -2.02 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 1uyt n GLY 1855CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1uyt s PHE 1856N -0.65 3.62 -0.40 1.61 5.36 -1.26 -2.18 117.98 124.08 1uyt s PHE 1856Ca 0.00 1.01 -0.11 0.00 -0.96 0.00 0.00 56.93 56.87 1uyt s PHE 1856Cb 0.00 -2.51 0.05 0.00 -0.34 0.00 0.00 43.02 40.22 1uyt s PHE 1856CO 0.00 0.34 0.24 -1.21 -1.46 0.00 0.00 175.22 173.12 1uyt s GLU 1857N -0.03 2.76 0.59 10.12 2.02 -0.15 -4.97 118.70 129.03 1uyt s GLU 1857Ca 0.27 -1.23 -0.19 0.00 0.02 0.00 0.00 54.97 53.84 1uyt s GLU 1857Cb -0.16 -3.77 -0.04 0.00 0.10 0.00 0.00 34.13 30.25 1uyt s GLU 1857CO 0.13 -0.81 1.21 0.71 0.02 0.00 0.00 175.26 176.52 1uyt s TYR 1858N 1.52 2.40 0.00 1.61 1.51 -1.26 -1.36 117.35 121.77 1uyt s TYR 1858Ca 0.02 1.51 0.00 0.00 -1.01 0.00 0.00 57.07 57.59 1uyt s TYR 1858Cb -0.21 -3.49 0.00 0.00 -0.11 0.00 0.00 41.96 38.15 1uyt s TYR 1858CO 0.05 -2.21 0.00 0.41 -1.11 0.00 0.00 175.55 172.69 1uyt n GLY 1859N 0.51 2.32 0.20 0.71 0.00 -1.25 -1.89 105.19 105.79 1uyt n GLY 1859Ca 0.13 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.97 1uyt n GLY 1859CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1uyt h LEU 1860N 0.00 0.68-10.43 0.99 5.85 -0.81 -3.43 115.31 108.16 1uyt h LEU 1860Ca 0.00 -0.43 -0.42 0.00 0.84 0.00 0.00 57.88 57.87 1uyt h LEU 1860Cb 0.00 -0.20 0.02 0.00 0.37 0.00 0.00 40.66 40.85 1uyt h LEU 1860CO 0.00 1.19 -0.27 -0.36 -0.34 0.00 0.00 178.44 178.66 1uyt s PHE 1861N -3.72 2.82 0.32 1.25 0.40 -0.13 -4.72 117.98 114.20 1uyt s PHE 1861Ca -0.08 -0.40 -0.29 0.00 -0.60 0.00 0.00 56.93 55.57 1uyt s PHE 1861Cb 0.10 -2.36 -0.12 0.00 0.51 0.00 0.00 43.02 41.14 1uyt s PHE 1861CO 0.86 -0.40 1.33 -0.25 0.70 0.00 0.00 175.22 177.47 1uyt n ASP 1862N -1.83 2.84 -4.68 1.36 10.43 0.41 -4.76 116.55 120.31 1uyt n ASP 1862Ca 0.08 1.19 -0.42 0.00 2.57 0.00 0.00 54.79 58.21 1uyt n ASP 1862Cb 0.59 -1.48 -0.03 0.00 1.84 0.00 0.00 41.12 42.04 1uyt n ASP 1862CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 1uyt s LYS 1863N -1.52 4.15 -0.15 -1.24 2.20 -1.26 -1.68 119.74 120.23 1uyt s LYS 1863Ca 0.58 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.75 1uyt s LYS 1863Cb -0.58 -3.77 0.00 0.00 -1.51 0.00 0.00 37.83 31.97 1uyt s LYS 1863CO 0.59 -0.86 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 1uyt n GLY 1864N 4.29 0.52 0.60 5.54 0.00 -1.26 -4.92 105.19 109.96 1uyt n GLY 1864Ca 0.18 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1uyt n GLY 1864CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uyt n SER 1865N 0.70 2.23 -4.69 1.61 3.41 -0.67 -4.94 113.62 111.27 1uyt n SER 1865Ca -0.01 -1.62 -0.42 0.00 -0.26 0.00 0.00 58.87 56.56 1uyt n SER 1865Cb 0.08 0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1uyt n SER 1865CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1uyt s PHE 1866N -2.36 3.47 -0.46 7.33 5.99 -1.26 -3.76 117.98 126.93 1uyt s PHE 1866Ca 0.21 1.53 0.03 0.00 0.00 0.00 0.00 56.93 58.70 1uyt s PHE 1866Cb 0.19 -3.23 0.13 0.00 0.00 0.00 0.00 43.02 40.11 1uyt s PHE 1866CO 0.50 -0.41 0.22 0.12 -0.00 0.00 0.00 175.22 175.66 1uyt s PHE 1867N 1.95 2.65 0.34 10.12 5.36 0.25 -4.94 117.98 133.72 1uyt s PHE 1867Ca 0.50 -2.77 -0.27 0.00 -0.96 0.00 0.00 56.93 53.43 1uyt s PHE 1867Cb -0.20 -2.38 -0.09 0.00 -0.34 0.00 0.00 43.02 40.01 1uyt s PHE 1867CO 0.20 -0.79 1.11 -2.00 -1.46 0.00 0.00 175.22 172.28 1uyt s GLU 1868N 0.20 4.37 0.09 10.12 2.12 -1.26 -0.71 118.70 133.62 1uyt s GLU 1868Ca 0.16 1.74 0.01 0.00 0.36 0.00 0.00 54.97 57.25 1uyt s GLU 1868Cb -0.24 -2.89 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 1uyt s GLU 1868CO -0.02 -0.02 -0.06 0.95 -0.54 0.00 0.00 175.26 175.57 1uyt s THR 1869N -1.36 0.62 -1.49 -1.70 -4.23 -0.17 -4.77 115.64 102.54 1uyt s THR 1869Ca 0.51 -1.83 -0.02 0.00 -1.18 0.00 0.00 61.69 59.16 1uyt s THR 1869Cb -0.29 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.01 1uyt s THR 1869CO 0.37 -0.84 0.23 0.18 -0.54 0.00 0.00 174.62 174.01 1uyt n LEU 1870N 0.13 -1.91 0.00 4.79 4.77 0.64 -4.39 117.00 121.03 1uyt n LEU 1870Ca -0.13 -0.08 0.08 0.00 -0.03 0.00 0.00 56.01 55.84 1uyt n LEU 1870Cb 0.60 -2.66 0.44 0.00 -2.33 0.00 0.00 43.42 39.47 1uyt n LEU 1870CO 0.29 -0.03 0.69 -1.54 -1.33 0.00 0.00 177.39 175.47 1uyt n SER 1871N -2.14 0.00 -0.29 -1.43 3.41 -1.25 -2.80 113.62 109.13 1uyt n SER 1871Ca -0.16 -0.28 0.04 0.00 -0.26 0.00 0.00 58.87 58.21 1uyt n SER 1871Cb 0.63 -0.11 0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1uyt n SER 1871CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uyt n GLY 1872N 0.01 -0.53 0.00 5.00 0.00 -1.26 -4.87 105.19 103.54 1uyt n GLY 1872Ca 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1uyt n GLY 1872CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1uyt n TRP 1873N 0.28 0.00 -3.81 1.61 -0.00 -1.12 -4.09 117.44 110.30 1uyt n TRP 1873Ca 0.04 0.00 -0.31 0.00 -0.00 0.00 0.00 57.50 57.24 1uyt n TRP 1873Cb 0.20 -0.00 -0.10 0.00 -0.00 0.00 0.00 31.31 31.40 1uyt n TRP 1873CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1uyt s ALA 1874N -4.67 3.98 -0.47 5.87 0.00 -1.26 -4.91 121.76 120.30 1uyt s ALA 1874Ca 0.00 -3.85 0.01 0.00 0.00 0.00 0.00 51.96 48.11 1uyt s ALA 1874Cb 0.00 -2.39 0.04 0.00 0.00 0.00 0.00 23.12 20.77 1uyt s ALA 1874CO 0.00 -2.12 0.78 1.63 0.00 0.00 0.00 175.76 176.06 1uyt n LYS 1875N 2.07 0.01 0.29 0.00 5.02 -1.26 -1.77 118.16 122.51 1uyt n LYS 1875Ca 0.20 0.27 0.15 0.00 -2.02 0.00 0.00 58.31 56.92 1uyt n LYS 1875Cb 0.36 -1.77 0.89 0.00 -0.02 0.00 0.00 35.03 34.48 1uyt n LYS 1875CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1uyt h GLY 1876N 0.00 0.00 -4.54 0.72 0.00 -1.90 -3.42 103.07 93.93 1uyt h GLY 1876Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 1uyt h GLY 1876CO 0.00 0.00 -0.80 -1.34 0.00 0.00 0.00 176.54 174.40 1uyt s VAL 1877N -4.36 1.30 -0.18 4.60 -7.23 -0.73 -1.82 120.40 111.97 1uyt s VAL 1877Ca -0.04 -1.20 -0.02 0.00 -1.81 0.00 0.00 61.98 58.91 1uyt s VAL 1877Cb 0.14 -1.19 -0.01 0.00 0.56 0.00 0.00 36.38 35.89 1uyt s VAL 1877CO 0.54 -0.03 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.51 1uyt s VAL 1878N -1.00 3.06 -0.02 1.32 1.01 0.77 -4.86 120.40 120.68 1uyt s VAL 1878Ca 0.02 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.45 1uyt s VAL 1878Cb -0.09 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 1uyt s VAL 1878CO 0.02 0.48 -0.20 0.68 0.00 0.00 0.00 175.10 176.07 1uyt s VAL 1879N 1.08 1.61 0.07 2.92 -7.23 -1.26 -0.14 120.40 117.45 1uyt s VAL 1879Ca 0.00 -0.87 -0.10 0.00 -1.81 0.00 0.00 61.98 59.20 1uyt s VAL 1879Cb -0.15 -1.34 0.04 0.00 0.56 0.00 0.00 36.38 35.49 1uyt s VAL 1879CO -0.02 0.46 0.49 0.61 -0.31 0.00 0.00 175.10 176.33 1uyt n GLY 1880N 2.60 0.88 3.55 2.32 0.00 -0.65 -1.00 105.19 112.89 1uyt n GLY 1880Ca -0.15 -1.01 -0.28 0.00 0.00 0.00 0.00 46.02 44.58 1uyt n GLY 1880CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uyt s ARG 1881N -2.02 2.00 0.37 1.61 1.81 0.11 0.33 118.95 123.15 1uyt s ARG 1881Ca 0.11 -1.18 -0.10 0.00 -1.72 0.00 0.00 55.73 52.85 1uyt s ARG 1881Cb -0.01 -2.18 0.03 0.00 -0.45 0.00 0.00 34.95 32.34 1uyt s ARG 1881CO 0.02 0.47 0.64 0.00 -0.68 0.00 0.00 175.30 175.75 1uyt s ALA 1882N -1.41 -0.05 0.03 2.13 0.00 -0.68 0.88 121.76 122.66 1uyt s ALA 1882Ca 0.22 -1.10 0.06 0.00 0.00 0.00 0.00 51.96 51.14 1uyt s ALA 1882Cb -0.10 0.90 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 1uyt s ALA 1882CO 0.13 -0.90 -0.17 1.03 0.00 0.00 0.00 175.76 175.86 1uyt s ARG 1883N -2.67 1.19 -0.45 0.00 0.52 -1.26 -1.11 118.95 115.16 1uyt s ARG 1883Ca 0.22 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.66 1uyt s ARG 1883Cb -0.03 -1.22 0.12 0.00 0.52 0.00 0.00 34.95 34.34 1uyt s ARG 1883CO 0.16 0.31 0.21 -1.17 0.02 0.00 0.00 175.30 174.83 1uyt s LEU 1884N -0.98 4.80 -1.90 2.53 0.20 0.48 -0.44 118.68 123.36 1uyt s LEU 1884Ca 0.05 -2.51 0.00 0.00 0.69 0.00 0.00 54.13 52.36 1uyt s LEU 1884Cb -0.08 -1.71 0.00 0.00 -0.43 0.00 0.00 46.19 43.97 1uyt s LEU 1884CO 0.01 -0.36 0.00 0.61 -0.29 0.00 0.00 176.35 176.32 1uyt n GLY 1885N 3.84 0.56 0.00 7.98 0.00 -1.26 -1.98 105.19 114.32 1uyt n GLY 1885Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1uyt n GLY 1885CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uyt n GLY 1886N -0.80 1.88 3.65 -0.02 0.00 -1.26 -4.71 105.19 103.93 1uyt n GLY 1886Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1uyt n GLY 1886CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uyt s ILE 1887N -2.10 4.05 0.31 -0.61 1.01 -0.84 -2.00 121.20 121.02 1uyt s ILE 1887Ca 0.00 1.25 -0.27 0.00 0.00 0.00 0.00 60.65 61.62 1uyt s ILE 1887Cb 0.00 -3.87 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 1uyt s ILE 1887CO 0.00 -0.18 1.00 -2.16 0.00 0.00 0.00 174.94 173.60 1uyt s PRO 1888N 3.83 4.57 0.23 2.79 0.04 -1.26 -0.39 135.00 144.81 1uyt s PRO 1888Ca 0.61 1.52 -0.18 0.00 0.04 0.00 0.00 61.00 62.99 1uyt s PRO 1888Cb -0.24 -2.94 0.02 0.00 0.04 0.00 0.00 34.50 31.37 1uyt s PRO 1888CO 0.20 0.23 0.58 -0.48 0.04 0.00 0.00 177.00 177.57 1uyt s LEU 1889N -1.84 0.00 0.06 -3.56 2.34 -0.27 -4.40 118.68 111.02 1uyt s LEU 1889Ca 0.48 -0.61 -0.12 0.00 0.06 0.00 0.00 54.13 53.94 1uyt s LEU 1889Cb -0.24 2.26 -0.06 0.00 -0.56 0.00 0.00 46.19 47.59 1uyt s LEU 1889CO 0.30 -1.17 0.41 -0.83 -1.06 0.00 0.00 176.35 174.01 1uyt s GLY 1890N -2.92 2.39 0.00 -3.48 0.00 -0.36 -1.69 107.32 101.26 1uyt s GLY 1890Ca 0.13 -0.31 0.05 0.00 0.00 0.00 0.00 44.72 44.59 1uyt s GLY 1890CO 0.03 -0.04 -0.16 0.14 0.00 0.00 0.00 173.10 173.07 1uyt s VAL 1891N -1.30 1.25 -0.12 1.40 1.01 0.15 -2.08 120.40 120.71 1uyt s VAL 1891Ca 0.30 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1uyt s VAL 1891Cb -0.15 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.20 1uyt s VAL 1891CO 0.17 0.26 -0.06 -0.63 0.00 0.00 0.00 175.10 174.83 1uyt s ILE 1892N -0.51 0.99 0.26 2.22 1.01 -0.87 -1.64 121.20 122.66 1uyt s ILE 1892Ca 0.05 -0.33 0.12 0.00 0.00 0.00 0.00 60.65 60.49 1uyt s ILE 1892Cb -0.07 -1.06 -0.05 0.00 0.01 0.00 0.00 42.46 41.30 1uyt s ILE 1892CO 0.00 0.31 -0.20 -0.83 0.00 0.00 0.00 174.94 174.21 1uyt s GLY 1893N 1.71 1.85 -0.17 6.18 0.00 0.80 -0.34 107.32 117.36 1uyt s GLY 1893Ca 0.04 -1.83 -0.08 0.00 0.00 0.00 0.00 44.72 42.84 1uyt s GLY 1893CO -0.08 -1.92 0.11 0.14 0.00 0.00 0.00 173.10 171.35 1uyt s VAL 1894N -2.39 5.20 -0.36 1.40 1.01 -1.26 -0.17 120.40 123.83 1uyt s VAL 1894Ca 0.28 0.11 -0.23 0.00 0.00 0.00 0.00 61.98 62.14 1uyt s VAL 1894Cb -0.05 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.00 1uyt s VAL 1894CO 0.14 0.49 0.79 -0.70 0.00 0.00 0.00 175.10 175.82 1uyt s GLU 1895N 0.00 3.76 0.07 2.72 2.56 -0.76 -4.61 118.70 122.44 1uyt s GLU 1895Ca 0.08 0.33 -0.01 0.00 0.00 0.00 0.00 54.97 55.37 1uyt s GLU 1895Cb -0.12 -3.81 -0.27 0.00 2.00 0.00 0.00 34.13 31.94 1uyt s GLU 1895CO 0.00 -0.85 1.10 1.79 -0.56 0.00 0.00 175.26 176.73 1uyt h THR 1896N 5.75 1.45 -3.27 -1.70 1.35 -1.86 -3.08 112.91 111.56 1uyt h THR 1896Ca -0.25 -3.07 -0.53 0.00 -0.55 0.00 0.00 66.41 62.02 1uyt h THR 1896Cb 1.09 2.87 0.03 0.00 -1.73 0.00 0.00 68.15 70.42 1uyt h THR 1896CO 0.92 0.88 0.68 -0.13 -0.25 0.00 0.00 175.52 177.62 1uyt s ARG 1897N -2.66 4.36 0.31 4.72 0.52 -1.26 -3.88 118.95 121.06 1uyt s ARG 1897Ca -0.04 2.07 -0.29 0.00 -0.52 0.00 0.00 55.73 56.96 1uyt s ARG 1897Cb 0.08 -3.21 -0.13 0.00 0.52 0.00 0.00 34.95 32.21 1uyt s ARG 1897CO 0.86 -0.32 1.24 2.41 0.02 0.00 0.00 175.30 179.51 1uyt n THR 1898N 3.02 1.79 -3.77 0.02 -1.04 -1.26 -4.53 114.28 108.51 1uyt n THR 1898Ca 0.08 -0.45 -0.37 0.00 -2.04 0.00 0.00 64.05 61.27 1uyt n THR 1898Cb 0.42 -1.40 -0.07 0.00 -1.82 0.00 0.00 70.33 67.47 1uyt n THR 1898CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1uyt s VAL 1899N -0.88 5.41 -0.98 12.58 1.01 -0.28 -4.94 120.40 132.32 1uyt s VAL 1899Ca 0.59 0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.81 1uyt s VAL 1899Cb -0.62 -3.48 0.25 0.00 0.00 0.00 0.00 36.38 32.53 1uyt s VAL 1899CO 0.59 0.56 0.93 -1.61 0.00 0.00 0.00 175.10 175.57 1uyt s GLU 1900N -0.61 3.78 -0.58 2.72 0.41 -1.26 -1.23 118.70 121.94 1uyt s GLU 1900Ca 0.15 -3.07 -0.27 0.00 -0.41 0.00 0.00 54.97 51.37 1uyt s GLU 1900Cb -0.12 -4.34 0.03 0.00 -1.78 0.00 0.00 34.13 27.92 1uyt s GLU 1900CO 0.04 -1.25 1.11 1.21 -0.49 0.00 0.00 175.26 175.88 1uyt s ASN 1901N 1.07 6.40 -0.29 -0.19 2.47 -0.37 -4.90 114.94 119.14 1uyt s ASN 1901Ca 0.27 -0.07 -0.18 0.00 0.42 0.00 0.00 52.86 53.29 1uyt s ASN 1901Cb -0.10 -2.51 -0.02 0.00 -1.45 0.00 0.00 41.25 37.17 1uyt s ASN 1901CO -0.09 -1.41 0.53 -0.22 -3.72 0.00 0.00 177.10 172.20 1uyt s LEU 1902N 4.63 4.12 -0.27 3.21 2.96 -1.26 0.54 118.68 132.61 1uyt s LEU 1902Ca 0.38 0.39 -0.09 0.00 -0.22 0.00 0.00 54.13 54.59 1uyt s LEU 1902Cb -0.09 -2.67 -0.03 0.00 0.50 0.00 0.00 46.19 43.90 1uyt s LEU 1902CO 0.23 -0.36 0.12 -0.63 -1.32 0.00 0.00 176.35 174.40 1uyt s ILE 1903N 2.38 4.70 1.11 6.68 1.01 0.23 -4.98 121.20 132.32 1uyt s ILE 1903Ca 0.21 -0.08 -0.12 0.00 0.00 0.00 0.00 60.65 60.66 1uyt s ILE 1903Cb -0.15 -3.24 0.24 0.00 0.01 0.00 0.00 42.46 39.31 1uyt s ILE 1903CO 0.10 0.27 0.96 -2.65 0.00 0.00 0.00 174.94 173.63 1uyt n PRO 1904N 4.98 -1.88 -3.02 2.79 -0.02 -1.26 -0.64 135.00 135.95 1uyt n PRO 1904Ca -0.15 -0.51 -0.29 0.00 -2.02 0.00 0.00 63.50 60.52 1uyt n PRO 1904Cb 0.51 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 1uyt n PRO 1904CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uyt s ALA 1905N -2.45 3.45 -0.69 3.55 0.00 -1.26 -4.61 121.76 119.76 1uyt s ALA 1905Ca 0.67 -0.35 -0.25 0.00 0.00 0.00 0.00 51.96 52.03 1uyt s ALA 1905Cb -0.24 -2.55 0.05 0.00 0.00 0.00 0.00 23.12 20.38 1uyt s ALA 1905CO 0.64 0.06 1.13 0.34 0.00 0.00 0.00 175.76 177.93 1uyt s ASP 1906N -3.21 6.19 0.60 0.00 3.68 -1.26 -4.88 116.67 117.79 1uyt s ASP 1906Ca 0.48 -0.63 0.28 0.00 2.13 0.00 0.00 52.55 54.82 1uyt s ASP 1906Cb -0.10 -2.49 1.35 0.00 -1.45 0.00 0.00 42.92 40.22 1uyt s ASP 1906CO 0.31 -1.62 1.76 -0.65 0.13 0.00 0.00 175.17 175.10 1uyt h PRO 1907N 9.77 0.00 -0.02 4.34 0.11 -1.94 0.93 132.00 145.19 1uyt h PRO 1907Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1uyt h PRO 1907Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1uyt h PRO 1907CO 1.22 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 179.01 1uyt n ALA 1908N -2.29 2.63 -3.83 -0.75 0.00 -1.26 -4.57 120.51 110.44 1uyt n ALA 1908Ca 0.11 -0.31 -0.30 0.00 0.00 0.00 0.00 53.44 52.94 1uyt n ALA 1908Cb 0.85 -1.34 -0.15 0.00 0.00 0.00 0.00 19.45 18.81 1uyt n ALA 1908CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1uyt s ASN 1909N -1.95 4.20 0.65 0.00 3.04 0.32 -4.97 114.94 116.23 1uyt s ASN 1909Ca 0.42 -1.73 0.26 0.00 0.04 0.00 0.00 52.86 51.84 1uyt s ASN 1909Cb 0.21 -1.10 1.37 0.00 -1.54 0.00 0.00 41.25 40.19 1uyt s ASN 1909CO 0.34 -0.39 1.78 -0.65 -3.04 0.00 0.00 177.10 175.14 1uyt h PRO 1910N 7.94 0.00 0.00 0.43 0.11 -1.81 0.36 132.00 139.04 1uyt h PRO 1910Ca -0.11 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.75 1uyt h PRO 1910Cb 1.02 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1uyt h PRO 1910CO 0.48 0.00 -1.53 -0.91 -0.21 0.00 0.00 178.00 175.83 1uyt h ASN 1911N 0.00 0.00 -1.74 -2.05 4.21 -1.93 -3.47 115.58 110.60 1uyt h ASN 1911Ca 0.06 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.90 1uyt h ASN 1911Cb 1.02 0.00 0.08 0.00 -1.12 0.00 0.00 38.32 38.29 1uyt h ASN 1911CO -0.00 0.87 0.21 -1.54 -1.29 0.00 0.00 177.43 175.68 1uyt n SER 1912N -3.03 1.04 -4.09 5.81 3.41 0.13 -4.97 113.62 111.91 1uyt n SER 1912Ca -0.13 1.14 -0.20 0.00 -0.26 0.00 0.00 58.87 59.42 1uyt n SER 1912Cb 0.97 -1.16 -0.14 0.00 -0.26 0.00 0.00 64.21 63.62 1uyt n SER 1912CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uyt s ALA 1913N -0.15 1.03 0.06 7.33 0.00 -1.26 -4.59 121.76 124.17 1uyt s ALA 1913Ca 0.76 -0.61 -0.34 0.00 0.00 0.00 0.00 51.96 51.77 1uyt s ALA 1913Cb -0.92 -0.22 -0.13 0.00 0.00 0.00 0.00 23.12 21.86 1uyt s ALA 1913CO 0.52 0.23 1.72 -1.91 0.00 0.00 0.00 175.76 176.32 1uyt n GLU 1914N 2.47 2.20 -5.15 0.00 2.13 -1.26 -4.53 120.64 116.50 1uyt n GLU 1914Ca -0.15 0.80 -0.32 0.00 0.66 0.00 0.00 57.16 58.15 1uyt n GLU 1914Cb 0.55 -2.61 -0.15 0.00 0.27 0.00 0.00 31.44 29.51 1uyt n GLU 1914CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1uyt s THR 1915N 2.30 2.41 -0.25 6.31 2.01 0.19 -4.97 115.64 123.65 1uyt s THR 1915Ca 0.85 -0.97 -0.07 0.00 0.31 0.00 0.00 61.69 61.81 1uyt s THR 1915Cb -0.67 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 69.93 1uyt s THR 1915CO 0.43 0.58 0.05 -0.22 -0.69 0.00 0.00 174.62 174.77 1uyt s LEU 1916N -0.57 3.35 -0.26 4.42 0.20 -1.26 0.75 118.68 125.31 1uyt s LEU 1916Ca 0.08 -0.27 -0.09 0.00 0.69 0.00 0.00 54.13 54.54 1uyt s LEU 1916Cb -0.11 -1.88 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 1uyt s LEU 1916CO 0.00 -0.04 0.12 -0.63 -0.29 0.00 0.00 176.35 175.51 1uyt s ILE 1917N 1.58 4.73 -0.14 6.68 -1.09 0.19 -4.96 121.20 128.19 1uyt s ILE 1917Ca 0.06 -0.04 -0.29 0.00 -2.23 0.00 0.00 60.65 58.15 1uyt s ILE 1917Cb -0.15 -3.24 -0.01 0.00 -1.58 0.00 0.00 42.46 37.48 1uyt s ILE 1917CO 0.02 0.29 0.99 -1.10 -1.23 0.00 0.00 174.94 173.91 1uyt s GLN 1918N 1.67 4.37 -0.35 2.79 -1.52 -1.26 -1.23 119.66 124.13 1uyt s GLN 1918Ca 0.07 1.33 0.04 0.00 -1.95 0.00 0.00 55.36 54.85 1uyt s GLN 1918Cb -0.16 -3.57 0.10 0.00 -0.22 0.00 0.00 33.01 29.17 1uyt s GLN 1918CO 0.07 -0.39 0.06 -1.21 -0.25 0.00 0.00 175.29 173.57 1uyt s GLU 1919N 2.30 1.49 0.39 2.91 2.02 -0.36 -4.98 118.70 122.47 1uyt s GLU 1919Ca 0.46 -1.91 -0.26 0.00 0.02 0.00 0.00 54.97 53.28 1uyt s GLU 1919Cb -0.17 -3.19 -0.11 0.00 0.10 0.00 0.00 34.13 30.76 1uyt s GLU 1919CO 0.14 -0.95 1.28 -2.30 0.02 0.00 0.00 175.26 173.45 1uyt n PRO 1920N 4.19 2.01 -1.52 0.39 -0.02 -1.26 -1.13 135.00 137.66 1uyt n PRO 1920Ca 0.04 0.71 -0.30 0.00 -2.02 0.00 0.00 63.50 61.93 1uyt n PRO 1920Cb 0.41 -2.36 0.08 0.00 -0.02 0.00 0.00 33.50 31.62 1uyt n PRO 1920CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1uyt s GLY 1921N -0.44 1.64 -1.80 -1.23 0.00 -1.25 -3.72 107.32 100.51 1uyt s GLY 1921Ca 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1uyt s GLY 1921CO 0.60 0.31 0.00 -1.06 0.00 0.00 0.00 173.10 172.95 1uyt n GLN 1922N -3.37 -1.66 -3.88 2.90 6.02 -1.16 -4.91 117.38 111.31 1uyt n GLN 1922Ca 0.07 1.01 -0.17 0.00 -0.01 0.00 0.00 57.00 57.91 1uyt n GLN 1922Cb 0.55 -5.57 -0.16 0.00 1.02 0.00 0.00 30.24 26.08 1uyt n GLN 1922CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1uyt s VAL 1923N -2.86 0.13 0.10 5.09 1.01 -1.24 0.87 120.40 123.49 1uyt s VAL 1923Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 1uyt s VAL 1923Cb 0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 36.38 36.08 1uyt s VAL 1923CO 0.00 0.14 0.95 0.26 0.00 0.00 0.00 175.10 176.45 1uyt s TRP 1924N 1.13 3.80 0.24 5.22 0.51 -0.26 -4.91 118.94 124.67 1uyt s TRP 1924Ca -0.08 1.77 0.10 0.00 -2.12 0.00 0.00 56.10 55.77 1uyt s TRP 1924Cb -0.13 -3.04 -0.05 0.00 -0.81 0.00 0.00 33.47 29.44 1uyt s TRP 1924CO -0.02 0.20 -0.19 -1.01 -0.51 0.00 0.00 176.95 175.42 1uyt s HIS 1925N 0.07 2.08 0.34 -1.98 3.76 -1.26 -1.38 115.29 116.93 1uyt s HIS 1925Ca 0.47 -0.41 0.15 0.00 -0.15 0.00 0.00 55.06 55.11 1uyt s HIS 1925Cb -0.23 -0.94 1.12 0.00 1.11 0.00 0.00 32.58 33.63 1uyt s HIS 1925CO 0.29 0.56 1.65 -1.00 -0.85 0.00 0.00 174.74 175.39 1uyt h PRO 1926N 2.55 0.26 -0.16 8.40 0.13 -1.87 0.45 132.00 141.76 1uyt h PRO 1926Ca -0.40 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.60 1uyt h PRO 1926Cb 1.24 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1uyt h PRO 1926CO 0.58 0.17 -0.32 -2.95 -0.23 0.00 0.00 178.00 175.25 1uyt h ASN 1927N 0.27 0.56 0.71 1.44 -1.07 -1.95 -0.03 115.58 115.50 1uyt h ASN 1927Ca 0.75 -0.55 -0.09 0.00 0.07 0.00 0.00 56.30 56.48 1uyt h ASN 1927Cb 1.74 -0.16 -0.01 0.00 -2.07 0.00 0.00 38.32 37.82 1uyt h ASN 1927CO -0.64 1.01 -0.42 0.77 0.07 0.00 0.00 177.43 178.23 1uyt h SER 1928N 0.14 0.00 -0.14 6.14 4.64 -1.37 -0.55 113.55 122.40 1uyt h SER 1928Ca 0.01 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.12 1uyt h SER 1928Cb 0.92 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1uyt h SER 1928CO 0.07 0.42 -0.72 0.00 -0.87 0.00 0.00 176.83 175.73 1uyt h ALA 1929N 1.58 0.28 -0.23 5.18 0.00 -0.10 -1.31 119.26 124.67 1uyt h ALA 1929Ca -0.00 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1uyt h ALA 1929Cb 0.89 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1uyt h ALA 1929CO 0.05 0.61 0.13 0.35 0.00 0.00 0.00 179.25 180.40 1uyt h PHE 1930N 0.45 0.30 -0.64 0.00 -0.00 -0.71 -1.04 116.94 115.30 1uyt h PHE 1930Ca -0.05 -0.00 0.01 0.00 -0.00 0.00 0.00 57.97 57.93 1uyt h PHE 1930Cb 1.35 -0.10 -0.03 0.00 -0.00 0.00 0.00 35.95 37.17 1uyt h PHE 1930CO 0.09 0.25 0.42 -0.22 -0.00 0.00 0.00 178.31 178.85 1uyt h LYS 1931N 0.27 0.83 0.02 1.11 3.64 -1.09 0.30 116.57 121.65 1uyt h LYS 1931Ca 0.08 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1uyt h LYS 1931Cb 0.03 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1uyt h LYS 1931CO -0.01 0.55 -0.09 1.15 -2.27 0.00 0.00 179.45 178.77 1uyt h THR 1932N 0.85 0.77 -0.48 1.00 2.02 -0.81 0.12 112.91 116.39 1uyt h THR 1932Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.42 1uyt h THR 1932Cb -0.07 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1uyt h THR 1932CO -0.06 0.00 0.30 0.00 0.37 0.00 0.00 175.52 176.13 1uyt h ALA 1933N 0.79 0.61 -0.77 6.16 0.00 -0.79 -2.24 119.26 123.02 1uyt h ALA 1933Ca 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1uyt h ALA 1933Cb 0.20 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1uyt h ALA 1933CO -0.08 0.07 0.49 0.37 0.00 0.00 0.00 179.25 180.11 1uyt h GLN 1934N 0.64 0.92 -0.37 0.00 5.75 0.07 -2.03 115.11 120.09 1uyt h GLN 1934Ca 0.17 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1uyt h GLN 1934Cb -0.04 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.28 1uyt h GLN 1934CO -0.04 0.61 0.19 0.00 -2.65 0.00 0.00 178.83 176.94 1uyt h ALA 1935N 1.33 0.48 -0.22 3.38 0.00 -0.48 -0.96 119.26 122.79 1uyt h ALA 1935Ca 0.31 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1uyt h ALA 1935Cb 0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1uyt h ALA 1935CO -0.11 0.02 -0.02 0.82 0.00 0.00 0.00 179.25 179.96 1uyt h ILE 1936N 0.47 0.83 -0.48 0.00 2.04 -0.99 -0.16 117.51 119.21 1uyt h ILE 1936Ca 0.13 -0.02 -0.06 0.00 1.00 0.00 0.00 64.86 65.91 1uyt h ILE 1936Cb 0.09 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1uyt h ILE 1936CO -0.02 0.01 0.06 0.78 0.00 0.00 0.00 178.15 178.98 1uyt h ASN 1937N 0.05 0.72 1.27 1.72 2.35 -1.16 -1.17 115.58 119.36 1uyt h ASN 1937Ca 0.10 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1uyt h ASN 1937Cb 0.14 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1uyt h ASN 1937CO -0.19 0.75 -0.02 0.44 -1.65 0.00 0.00 177.43 176.77 1uyt h ASP 1938N 0.73 0.00 0.11 5.81 3.32 -0.69 0.14 116.42 125.84 1uyt h ASP 1938Ca 0.15 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.02 1uyt h ASP 1938Cb 0.36 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.93 1uyt h ASP 1938CO 0.01 0.02 -0.79 -0.26 -1.72 0.00 0.00 179.24 176.49 1uyt h PHE 1939N 0.00 0.59 0.52 4.55 0.05 -0.47 -3.38 116.94 118.81 1uyt h PHE 1939Ca -0.00 -0.40 -0.03 0.00 3.82 0.00 0.00 57.97 61.37 1uyt h PHE 1939Cb 0.65 -0.04 0.01 0.00 2.00 0.00 0.00 35.95 38.57 1uyt h PHE 1939CO 0.00 1.28 -0.25 -0.97 -0.18 0.00 0.00 178.31 178.19 1uyt h ASN 1940N -0.27 -0.59 -3.38 2.17 -1.24 -1.06 -1.56 115.58 109.66 1uyt h ASN 1940Ca -0.13 -0.01 -0.52 0.00 0.71 0.00 0.00 56.30 56.35 1uyt h ASN 1940Cb 1.58 0.15 0.02 0.00 0.73 0.00 0.00 38.32 40.80 1uyt h ASN 1940CO 0.15 -0.18 0.58 0.20 -1.29 0.00 0.00 177.43 176.89 1uyt s ASN 1941N -4.76 7.05 0.00 1.15 0.01 0.02 -2.08 114.94 116.32 1uyt s ASN 1941Ca -0.11 2.21 0.00 0.00 -0.71 0.00 0.00 52.86 54.25 1uyt s ASN 1941Cb 0.01 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1uyt s ASN 1941CO 0.35 -0.43 0.00 0.61 -1.51 0.00 0.00 177.10 176.12 1uyt n GLY 1942N 2.52 0.90 0.15 0.66 0.00 -1.26 -4.28 105.19 103.88 1uyt n GLY 1942Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.07 1uyt n GLY 1942CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1uyt h GLU 1943N 0.00 0.00 -6.85 1.61 5.08 -1.73 -3.37 114.58 109.32 1uyt h GLU 1943Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1uyt h GLU 1943Cb 0.00 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.01 1uyt h GLU 1943CO 0.00 0.55 -0.86 1.04 -1.00 0.00 0.00 179.01 178.74 1uyt n GLN 1944N -3.70 -2.54 -3.55 2.33 6.02 -0.75 -4.48 117.38 110.70 1uyt n GLN 1944Ca -0.01 0.31 -0.28 0.00 -0.01 0.00 0.00 57.00 57.01 1uyt n GLN 1944Cb 0.60 -4.90 -0.03 0.00 1.02 0.00 0.00 30.24 26.92 1uyt n GLN 1944CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1uyt s LEU 1945N -7.25 4.16 0.91 1.08 1.43 -0.66 -4.84 118.68 113.51 1uyt s LEU 1945Ca 0.67 0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 54.17 1uyt s LEU 1945Cb -0.37 -3.32 0.14 0.00 0.03 0.00 0.00 46.19 42.67 1uyt s LEU 1945CO 0.95 -0.10 1.15 -2.84 0.23 0.00 0.00 176.35 175.74 1uyt s PRO 1946N -3.39 1.11 0.01 1.29 0.02 -1.26 -4.65 135.00 128.13 1uyt s PRO 1946Ca 0.41 0.21 -0.08 0.00 0.02 0.00 0.00 61.00 61.56 1uyt s PRO 1946Cb -0.11 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.57 1uyt s PRO 1946CO 0.29 -2.20 0.15 1.41 -0.33 0.00 0.00 177.00 176.32 1uyt s MET 1947N -5.36 0.53 -0.03 5.54 1.75 -0.56 -1.23 119.30 119.95 1uyt s MET 1947Ca 0.64 -0.46 0.02 0.00 -1.25 0.00 0.00 55.69 54.65 1uyt s MET 1947Cb -0.13 0.22 0.00 0.00 2.84 0.00 0.00 34.83 37.76 1uyt s MET 1947CO 0.53 -0.13 -0.09 1.41 -0.65 0.00 0.00 175.02 176.09 1uyt s MET 1948N -1.68 0.94 -0.19 4.11 1.75 -0.88 -0.24 119.30 123.11 1uyt s MET 1948Ca -0.12 -0.29 0.01 0.00 -1.25 0.00 0.00 55.69 54.03 1uyt s MET 1948Cb -0.06 -0.88 0.02 0.00 2.84 0.00 0.00 34.83 36.76 1uyt s MET 1948CO 0.00 0.11 -0.19 0.42 -0.65 0.00 0.00 175.02 174.71 1uyt s ILE 1949N 0.21 2.09 -1.30 10.11 1.01 0.03 -2.06 121.20 131.29 1uyt s ILE 1949Ca -0.03 -1.00 -0.15 0.00 0.00 0.00 0.00 60.65 59.47 1uyt s ILE 1949Cb -0.08 -1.91 0.10 0.00 0.01 0.00 0.00 42.46 40.58 1uyt s ILE 1949CO 0.00 0.49 1.75 0.18 0.00 0.00 0.00 174.94 177.37 1uyt n LEU 1950N 4.61 5.52 -4.67 2.97 7.99 0.54 -1.46 117.00 132.50 1uyt n LEU 1950Ca -0.20 -4.18 -0.44 0.00 -0.01 0.00 0.00 56.01 51.18 1uyt n LEU 1950Cb 0.49 -1.67 -0.03 0.00 -0.11 0.00 0.00 43.42 42.10 1uyt n LEU 1950CO 0.26 0.60 1.56 0.00 -1.51 0.00 0.00 177.39 178.29 1uyt n ALA 1951N 6.77 1.52 -2.78 -1.18 0.00 -0.85 -4.13 120.51 119.86 1uyt n ALA 1951Ca 0.45 0.24 -0.09 0.00 0.00 0.00 0.00 53.44 54.04 1uyt n ALA 1951Cb 0.43 -2.63 0.05 0.00 0.00 0.00 0.00 19.45 17.30 1uyt n ALA 1951CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1uyt n ASN 1952N 7.02 -2.55 -4.18 0.00 5.15 -1.25 -4.19 115.26 115.26 1uyt n ASN 1952Ca 0.20 -3.34 -0.25 0.00 -0.60 0.00 0.00 54.58 50.59 1uyt n ASN 1952Cb 0.38 1.66 -0.15 0.00 -0.53 0.00 0.00 39.78 41.14 1uyt n ASN 1952CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1uyt s TRP 1953N 0.45 1.63 -0.68 1.20 0.51 -0.83 -4.53 118.94 116.70 1uyt s TRP 1953Ca 0.30 -0.31 0.25 0.00 -2.12 0.00 0.00 56.10 54.23 1uyt s TRP 1953Cb 0.24 -1.05 0.57 0.00 -0.81 0.00 0.00 33.47 32.43 1uyt s TRP 1953CO -0.20 -0.03 1.56 0.00 -0.51 0.00 0.00 176.95 177.76 1uyt h ARG 1954N 5.70 0.00 0.00 4.98 3.08 0.23 -3.09 114.38 125.28 1uyt h ARG 1954Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1uyt h ARG 1954Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1uyt h ARG 1954CO 0.48 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.79 1uyt n GLY 1955N 1.31 0.83 3.94 0.04 0.00 -1.26 -4.38 105.19 105.67 1uyt n GLY 1955Ca 0.04 -1.88 -0.24 0.00 0.00 0.00 0.00 46.02 43.94 1uyt n GLY 1955CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uyt s PHE 1956N -1.85 3.40 -0.14 1.61 0.40 -1.26 -1.11 117.98 119.03 1uyt s PHE 1956Ca 0.00 0.42 -0.29 0.00 -0.60 0.00 0.00 56.93 56.46 1uyt s PHE 1956Cb 0.00 -2.18 -0.01 0.00 0.51 0.00 0.00 43.02 41.34 1uyt s PHE 1956CO 0.00 -0.20 1.03 0.45 0.70 0.00 0.00 175.22 177.21 1uyt s SER 1957N -4.13 7.19 0.00 1.36 0.15 -0.48 -4.83 113.70 112.96 1uyt s SER 1957Ca 0.45 1.50 0.22 0.00 0.70 0.00 0.00 55.95 58.83 1uyt s SER 1957Cb -0.10 -2.55 0.63 0.00 -1.71 0.00 0.00 66.02 62.29 1uyt s SER 1957CO 0.39 -0.53 1.53 0.61 1.20 0.00 0.00 173.24 176.44 1uyt n GLY 1958N 3.19 2.35 3.43 9.45 0.00 -1.26 -4.48 105.19 117.87 1uyt n GLY 1958Ca 0.10 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 1uyt n GLY 1958CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uyt s GLY 1959N -1.01 1.51 0.01 -0.02 0.00 -1.26 -4.75 107.32 101.79 1uyt s GLY 1959Ca 0.48 -0.30 -0.25 0.00 0.00 0.00 0.00 44.72 44.65 1uyt s GLY 1959CO 0.33 0.50 1.38 -1.61 0.00 0.00 0.00 173.10 173.70 1uyt h GLN 1960N -2.87 0.04 -0.11 2.90 -0.00 -1.98 -1.76 115.11 111.32 1uyt h GLN 1960Ca -0.59 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.04 1uyt h GLN 1960Cb 1.34 -0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.81 1uyt h GLN 1960CO 0.46 0.40 0.06 -0.09 0.00 0.00 0.00 178.83 179.66 1uyt h ARG 1961N -0.33 0.16 -0.20 1.69 2.43 -1.98 0.23 114.38 116.38 1uyt h ARG 1961Ca 0.00 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1uyt h ARG 1961Cb 0.39 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1uyt h ARG 1961CO 0.00 0.21 -0.26 -0.44 -1.51 0.00 0.00 179.97 177.98 1uyt h ASP 1962N 0.07 0.38 -0.23 -3.80 3.32 -1.89 0.18 116.42 114.45 1uyt h ASP 1962Ca 0.04 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 1uyt h ASP 1962Cb 0.10 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1uyt h ASP 1962CO -0.01 0.64 -0.28 -0.03 -1.72 0.00 0.00 179.24 177.84 1uyt h MET 1963N 0.34 0.59 -0.15 3.56 4.05 -1.06 -2.49 114.93 119.78 1uyt h MET 1963Ca 0.05 -0.33 -0.04 0.00 -0.28 0.00 0.00 59.70 59.09 1uyt h MET 1963Cb 0.64 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.45 1uyt h MET 1963CO 0.05 0.93 -0.11 0.35 0.23 0.00 0.00 176.91 178.36 1uyt h PHE 1964N 0.29 0.23 -0.07 1.39 3.04 -0.26 -1.92 116.94 119.64 1uyt h PHE 1964Ca 0.03 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 1uyt h PHE 1964Cb 0.85 -0.07 -0.00 0.00 2.56 0.00 0.00 35.95 39.29 1uyt h PHE 1964CO 0.08 0.34 0.00 0.09 -2.02 0.00 0.00 178.31 176.80 1uyt n ASN 1965N -4.30 1.64 -2.55 0.41 3.02 0.61 -4.88 115.26 109.22 1uyt n ASN 1965Ca -0.01 -2.12 -0.17 0.00 -0.03 0.00 0.00 54.58 52.25 1uyt n ASN 1965Cb 0.25 -0.52 0.04 0.00 -0.61 0.00 0.00 39.78 38.93 1uyt n ASN 1965CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1uyt n GLU 1966N 0.09 -4.69 0.26 3.52 1.02 -0.72 -4.88 120.64 115.24 1uyt n GLU 1966Ca 0.03 0.67 0.16 0.00 -0.02 0.00 0.00 57.16 58.00 1uyt n GLU 1966Cb 0.38 -5.09 0.89 0.00 -0.02 0.00 0.00 31.44 27.59 1uyt n GLU 1966CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1uyt h VAL 1967N -1.47 0.48 -0.44 2.62 3.04 -1.61 -0.78 116.25 118.09 1uyt h VAL 1967Ca -0.42 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.16 1uyt h VAL 1967Cb 1.28 0.92 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 1uyt h VAL 1967CO 0.43 0.00 -0.20 -0.07 -1.01 0.00 0.00 177.57 176.72 1uyt h LEU 1968N 0.00 0.88 -0.20 3.16 3.38 -1.87 -0.86 115.31 119.80 1uyt h LEU 1968Ca 0.04 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1uyt h LEU 1968Cb 0.23 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1uyt h LEU 1968CO -0.00 1.06 0.10 0.11 0.09 0.00 0.00 178.44 179.80 1uyt h LYS 1969N 0.76 0.28 -0.39 1.13 1.57 -1.53 -1.58 116.57 116.81 1uyt h LYS 1969Ca 0.11 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 1uyt h LYS 1969Cb 0.74 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1uyt h LYS 1969CO 0.06 0.28 -0.28 1.88 -0.57 0.00 0.00 179.45 180.82 1uyt h TYR 1970N 0.21 0.95 -0.99 -1.35 0.05 -1.47 -2.14 116.97 112.23 1uyt h TYR 1970Ca 0.07 -0.24 0.01 0.00 0.05 0.00 0.00 58.73 58.62 1uyt h TYR 1970Cb 0.09 -0.22 -0.05 0.00 1.01 0.00 0.00 36.73 37.56 1uyt h TYR 1970CO -0.03 1.00 0.65 0.78 -1.05 0.00 0.00 178.16 179.51 1uyt h GLY 1971N 0.93 1.39 2.00 3.88 0.00 -1.02 -1.79 103.07 108.46 1uyt h GLY 1971Ca 0.08 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 1uyt h GLY 1971CO 0.07 0.51 -0.36 1.76 0.00 0.00 0.00 176.54 178.52 1uyt h SER 1972N 1.34 0.00 -0.53 0.19 0.02 -0.86 -2.35 113.55 111.35 1uyt h SER 1972Ca 0.36 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.35 1uyt h SER 1972Cb -0.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 1uyt h SER 1972CO -0.08 0.36 0.36 -0.26 -1.14 0.00 0.00 176.83 176.07 1uyt h PHE 1973N 0.00 0.57 -0.33 3.45 0.05 -0.68 -1.41 116.94 118.59 1uyt h PHE 1973Ca -0.00 0.01 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 1uyt h PHE 1973Cb 0.66 -0.19 -0.02 0.00 2.00 0.00 0.00 35.95 38.41 1uyt h PHE 1973CO 0.00 0.32 0.17 0.82 -0.18 0.00 0.00 178.31 179.45 1uyt h ILE 1974N 0.58 1.14 -0.08 -0.55 2.04 -1.31 0.31 117.51 119.64 1uyt h ILE 1974Ca 0.22 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1uyt h ILE 1974Cb 0.14 0.80 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1uyt h ILE 1974CO -0.06 0.14 0.05 0.58 0.00 0.00 0.00 178.15 178.86 1uyt h VAL 1975N 0.40 1.04 -0.82 1.67 2.07 -1.40 -1.78 116.25 117.43 1uyt h VAL 1975Ca 0.11 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.63 1uyt h VAL 1975Cb 0.08 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 1uyt h VAL 1975CO -0.02 0.04 0.47 0.44 0.02 0.00 0.00 177.57 178.52 1uyt h ASP 1976N 0.08 0.66 0.11 0.57 3.45 -1.02 -1.54 116.42 118.73 1uyt h ASP 1976Ca 0.03 0.05 -0.13 0.00 0.43 0.00 0.00 57.03 57.41 1uyt h ASP 1976Cb 0.02 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 1uyt h ASP 1976CO -0.01 0.38 -0.45 0.00 -1.57 0.00 0.00 179.24 177.59 1uyt h ALA 1977N 1.46 0.91 -0.26 3.45 0.00 -0.53 -2.92 119.26 121.37 1uyt h ALA 1977Ca 0.40 -0.45 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 1uyt h ALA 1977Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1uyt h ALA 1977CO -0.25 0.65 -0.40 -0.07 0.00 0.00 0.00 179.25 179.17 1uyt h LEU 1978N 0.34 0.65 -1.66 0.00 3.38 -0.83 -2.67 115.31 114.52 1uyt h LEU 1978Ca 0.02 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1uyt h LEU 1978Cb 0.93 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1uyt h LEU 1978CO 0.08 0.97 -0.09 0.58 0.09 0.00 0.00 178.44 180.08 1uyt h VAL 1979N 0.50 1.11 0.00 1.22 2.07 -1.12 -2.38 116.25 117.65 1uyt h VAL 1979Ca 0.04 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1uyt h VAL 1979Cb 0.92 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1uyt h VAL 1979CO 0.08 0.15 -0.47 -0.67 0.02 0.00 0.00 177.57 176.68 1uyt n ASP 1980N -4.37 0.49 -4.71 0.57 2.03 -1.09 -4.94 116.55 104.52 1uyt n ASP 1980Ca -0.02 -0.08 -0.42 0.00 0.52 0.00 0.00 54.79 54.79 1uyt n ASP 1980Cb 0.20 0.15 -0.03 0.00 -0.72 0.00 0.00 41.12 40.72 1uyt n ASP 1980CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1uyt s TYR 1981N -3.04 2.80 -1.59 -0.67 5.04 -0.90 -4.93 117.35 114.07 1uyt s TYR 1981Ca 0.10 0.33 0.16 0.00 -2.44 0.00 0.00 57.07 55.22 1uyt s TYR 1981Cb 0.17 -4.11 0.32 0.00 0.35 0.00 0.00 41.96 38.70 1uyt s TYR 1981CO 0.69 -4.24 1.23 1.63 -1.34 0.00 0.00 175.55 173.52 1uyt n LYS 1982N 4.28 2.22 -4.42 4.97 4.76 -1.26 -4.89 118.16 123.83 1uyt n LYS 1982Ca 0.16 -1.98 -0.21 0.00 -2.87 0.00 0.00 58.31 53.41 1uyt n LYS 1982Cb 0.36 -1.36 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 1uyt n LYS 1982CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1uyt s GLN 1983N -1.13 1.53 0.27 1.97 1.11 -1.26 -5.09 119.66 117.06 1uyt s GLN 1983Ca 0.28 -1.76 -0.30 0.00 0.01 0.00 0.00 55.36 53.59 1uyt s GLN 1983Cb 0.16 -1.20 -0.13 0.00 -1.01 0.00 0.00 33.01 30.83 1uyt s GLN 1983CO 0.22 0.08 1.36 -2.30 0.01 0.00 0.00 175.29 174.65 1uyt n PRO 1984N -0.56 2.01 -4.97 2.91 -0.02 -1.26 -4.78 135.00 128.33 1uyt n PRO 1984Ca -0.06 0.71 -0.28 0.00 -2.02 0.00 0.00 63.50 61.86 1uyt n PRO 1984Cb 0.63 -2.34 -0.16 0.00 -0.02 0.00 0.00 33.50 31.61 1uyt n PRO 1984CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1uyt s ILE 1985N -0.37 1.64 -0.14 4.25 1.01 0.11 -1.50 121.20 126.20 1uyt s ILE 1985Ca 0.65 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.49 1uyt s ILE 1985Cb -0.63 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 40.45 1uyt s ILE 1985CO 0.53 0.46 -0.21 -0.63 0.00 0.00 0.00 174.94 175.09 1uyt s ILE 1986N 0.02 2.00 -0.15 2.92 1.01 0.67 -1.85 121.20 125.83 1uyt s ILE 1986Ca -0.05 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 59.64 1uyt s ILE 1986Cb -0.13 -1.77 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 1uyt s ILE 1986CO 0.03 0.54 -0.10 -0.63 0.00 0.00 0.00 174.94 174.78 1uyt s ILE 1987N 0.83 3.25 -0.07 2.92 -1.09 -0.10 -0.79 121.20 126.15 1uyt s ILE 1987Ca -0.07 -0.58 -0.03 0.00 -2.23 0.00 0.00 60.65 57.74 1uyt s ILE 1987Cb -0.15 -2.39 0.04 0.00 -1.58 0.00 0.00 42.46 38.37 1uyt s ILE 1987CO -0.02 0.51 0.14 -0.47 -1.23 0.00 0.00 174.94 173.87 1uyt s TYR 1988N 0.50 -0.14 -0.30 3.97 6.04 -0.54 0.21 117.35 127.09 1uyt s TYR 1988Ca -0.07 0.53 -0.22 0.00 0.04 0.00 0.00 57.07 57.35 1uyt s TYR 1988Cb -0.15 -0.26 -0.01 0.00 -1.04 0.00 0.00 41.96 40.50 1uyt s TYR 1988CO 0.04 -0.24 0.70 0.42 -1.54 0.00 0.00 175.55 174.93 1uyt s ILE 1989N 2.06 4.88 1.15 3.14 1.01 -0.49 -2.00 121.20 130.95 1uyt s ILE 1989Ca 0.01 1.06 -0.12 0.00 0.00 0.00 0.00 60.65 61.59 1uyt s ILE 1989Cb -0.12 -4.06 0.28 0.00 0.01 0.00 0.00 42.46 38.57 1uyt s ILE 1989CO -0.05 -0.16 1.04 -2.84 0.00 0.00 0.00 174.94 172.92 1uyt s PRO 1990N 2.75 -0.82 0.06 2.79 0.02 -1.26 -1.70 135.00 136.84 1uyt s PRO 1990Ca 0.29 0.95 -0.14 0.00 0.02 0.00 0.00 61.00 62.12 1uyt s PRO 1990Cb -0.15 -1.56 -0.05 0.00 0.02 0.00 0.00 34.50 32.77 1uyt s PRO 1990CO 0.11 -3.69 1.24 -1.35 -0.33 0.00 0.00 177.00 172.98 1uyt h PRO 1991N -2.61 -0.15 -0.14 5.54 0.11 -1.92 -0.11 132.00 132.73 1uyt h PRO 1991Ca -0.60 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.52 1uyt h PRO 1991Cb 1.33 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1uyt h PRO 1991CO 0.49 -0.10 0.00 0.25 -0.21 0.00 0.00 178.00 178.43 1uyt n THR 1992N -3.89 0.18 -1.96 -1.15 -2.24 -1.26 -2.98 114.28 100.99 1uyt n THR 1992Ca -0.01 -0.20 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 1uyt n THR 1992Cb 0.15 0.08 0.07 0.00 -2.10 0.00 0.00 70.33 68.53 1uyt n THR 1992CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1uyt s GLY 1993N -1.12 1.61 0.19 3.38 0.00 -0.05 -4.94 107.32 106.39 1uyt s GLY 1993Ca 0.15 -0.62 -0.16 0.00 0.00 0.00 0.00 44.72 44.09 1uyt s GLY 1993CO 0.11 -0.17 0.48 -1.83 0.00 0.00 0.00 173.10 171.68 1uyt s GLU 1994N -5.46 1.34 -0.11 2.90 -1.05 -1.26 -2.02 118.70 113.03 1uyt s GLU 1994Ca 0.61 -0.91 -0.05 0.00 -0.15 0.00 0.00 54.97 54.47 1uyt s GLU 1994Cb -0.11 0.50 0.05 0.00 -0.44 0.00 0.00 34.13 34.13 1uyt s GLU 1994CO 0.49 -0.55 0.23 -1.17 0.95 0.00 0.00 175.26 175.21 1uyt s LEU 1995N -2.89 0.08 0.25 1.83 2.96 -0.70 -1.96 118.68 118.26 1uyt s LEU 1995Ca 0.10 0.51 0.08 0.00 -0.22 0.00 0.00 54.13 54.60 1uyt s LEU 1995Cb -0.00 0.63 -0.05 0.00 0.50 0.00 0.00 46.19 47.26 1uyt s LEU 1995CO -0.03 -0.20 -0.11 -0.13 -1.32 0.00 0.00 176.35 174.56 1uyt s ARG 1996N 1.86 1.49 0.00 1.98 3.00 -1.17 -2.62 118.95 123.49 1uyt s ARG 1996Ca -0.03 -1.72 0.00 0.00 0.00 0.00 0.00 55.73 53.98 1uyt s ARG 1996Cb -0.11 -1.23 0.00 0.00 0.00 0.00 0.00 34.95 33.61 1uyt s ARG 1996CO -0.08 0.13 0.00 0.41 0.00 0.00 0.00 175.30 175.76 1uyt n GLY 1997N -0.52 0.00 0.32 -3.53 0.00 -0.82 -0.25 105.19 100.39 1uyt n GLY 1997Ca -0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.09 1uyt n GLY 1997CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1uyt h GLY 1998N 0.00 0.06 0.37 -0.02 0.00 -1.85 -3.07 103.07 98.57 1uyt h GLY 1998Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 1uyt h GLY 1998CO 0.00 0.01 -0.10 1.76 0.00 0.00 0.00 176.54 178.21 1uyt h SER 1999N 0.05 0.11 -0.56 0.19 0.02 -0.90 -3.31 113.55 109.15 1uyt h SER 1999Ca 0.14 -0.73 0.07 0.00 -0.84 0.00 0.00 61.79 60.43 1uyt h SER 1999Cb 0.49 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.94 1uyt h SER 1999CO -0.01 0.82 0.24 -0.25 -1.14 0.00 0.00 176.83 176.49 1uyt h TRP 2000N -0.60 0.43 -0.61 3.45 2.91 -1.40 -2.77 115.95 117.36 1uyt h TRP 2000Ca -0.01 0.03 0.12 0.00 1.13 0.00 0.00 58.89 60.15 1uyt h TRP 2000Cb 0.83 -0.11 -0.12 0.00 -0.51 0.00 0.00 29.16 29.25 1uyt h TRP 2000CO 0.17 0.17 -0.23 0.28 -1.03 0.00 0.00 178.44 177.80 1uyt h VAL 2001N 0.45 0.28 0.00 2.65 2.07 -1.63 -0.72 116.25 119.35 1uyt h VAL 2001Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1uyt h VAL 2001Cb 0.25 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1uyt h VAL 2001CO -0.23 0.00 0.00 0.55 0.02 0.00 0.00 177.57 177.91 1uyt n VAL 2002N -5.44 0.00 -0.95 2.57 3.14 -1.05 -3.50 118.33 113.10 1uyt n VAL 2002Ca 0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.44 1uyt n VAL 2002Cb 0.34 -0.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.70 1uyt n VAL 2002CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1uyt n VAL 2003N -0.86 0.17 -1.98 1.55 0.31 -0.39 -4.46 118.33 112.68 1uyt n VAL 2003Ca 0.15 -0.18 -0.39 0.00 -0.01 0.00 0.00 64.34 63.91 1uyt n VAL 2003Cb 0.07 0.86 0.00 0.00 -0.91 0.00 0.00 33.84 33.87 1uyt n VAL 2003CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1uyt s ASP 2004N -0.28 6.13 0.62 4.52 2.15 -0.55 -4.91 116.67 124.35 1uyt s ASP 2004Ca 0.01 2.72 0.36 0.00 0.43 0.00 0.00 52.55 56.07 1uyt s ASP 2004Cb 0.00 -2.64 2.08 0.00 -0.30 0.00 0.00 42.92 42.06 1uyt s ASP 2004CO 0.00 -0.98 2.30 -0.65 -0.17 0.00 0.00 175.17 175.67 1uyt h PRO 2005N 2.49 0.00 0.00 4.34 0.11 -1.90 -1.85 132.00 135.20 1uyt h PRO 2005Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1uyt h PRO 2005Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1uyt h PRO 2005CO 0.62 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.20 1uyt h THR 2006N 0.00 0.00 -0.83 -1.15 1.35 -1.91 -2.07 112.91 108.30 1uyt h THR 2006Ca 0.00 -0.33 0.01 0.00 -0.55 0.00 0.00 66.41 65.54 1uyt h THR 2006Cb 0.01 1.16 -0.04 0.00 -1.73 0.00 0.00 68.15 67.55 1uyt h THR 2006CO -0.00 0.00 0.55 0.40 -0.25 0.00 0.00 175.52 176.22 1uyt h ILE 2007N 0.00 1.21 -1.25 6.82 2.04 -1.71 -3.34 117.51 121.28 1uyt h ILE 2007Ca 0.00 -0.39 -0.37 0.00 1.00 0.00 0.00 64.86 65.11 1uyt h ILE 2007Cb 0.42 -0.01 -0.26 0.00 -0.74 0.00 0.00 36.82 36.23 1uyt h ILE 2007CO 0.00 0.21 -0.75 -3.20 0.00 0.00 0.00 178.15 174.40 1uyt n ASN 2008N -4.41 -1.75 0.30 1.72 4.05 -1.04 -4.66 115.26 109.46 1uyt n ASN 2008Ca 0.09 -2.86 0.18 0.00 0.45 0.00 0.00 54.58 52.45 1uyt n ASN 2008Cb 0.03 0.69 0.98 0.00 1.23 0.00 0.00 39.78 42.71 1uyt n ASN 2008CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1uyt h ALA 2009N 4.58 1.09 0.00 5.20 0.00 -1.51 0.17 119.26 128.79 1uyt h ALA 2009Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1uyt h ALA 2009Cb 0.99 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1uyt h ALA 2009CO 0.29 -0.09 -0.33 -0.44 0.00 0.00 0.00 179.25 178.69 1uyt h ASP 2010N 0.00 0.00 0.00 0.00 3.45 -1.94 -3.38 116.42 114.54 1uyt h ASP 2010Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1uyt h ASP 2010Cb 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 1uyt h ASP 2010CO 0.00 0.33 -0.61 0.00 -1.57 0.00 0.00 179.24 177.40 1uyt n GLN 2011N -3.27 2.24 -3.61 3.56 1.13 -0.42 -4.98 117.38 112.03 1uyt n GLN 2011Ca 0.02 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.72 1uyt n GLN 2011Cb 0.59 -0.79 -0.06 0.00 0.11 0.00 0.00 30.24 30.10 1uyt n GLN 2011CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1uyt s MET 2012N -1.27 3.75 -0.04 -1.09 -1.94 0.46 0.07 119.30 119.24 1uyt s MET 2012Ca 0.00 0.18 -0.03 0.00 -1.71 0.00 0.00 55.69 54.13 1uyt s MET 2012Cb 0.00 -3.09 0.02 0.00 2.01 0.00 0.00 34.83 33.77 1uyt s MET 2012CO 0.00 0.63 0.10 -1.21 -0.01 0.00 0.00 175.02 174.53 1uyt s GLU 2013N -1.57 0.09 -0.01 2.03 2.02 -0.77 -4.75 118.70 115.74 1uyt s GLU 2013Ca 0.28 0.19 0.07 0.00 0.02 0.00 0.00 54.97 55.53 1uyt s GLU 2013Cb -0.14 -0.03 -0.02 0.00 0.10 0.00 0.00 34.13 34.04 1uyt s GLU 2013CO 0.15 -0.06 -0.22 1.41 0.02 0.00 0.00 175.26 176.56 1uyt s MET 2014N 0.39 2.14 0.06 1.61 1.75 -1.26 -0.92 119.30 123.07 1uyt s MET 2014Ca -0.03 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 53.53 1uyt s MET 2014Cb -0.04 -2.13 -0.03 0.00 2.84 0.00 0.00 34.83 35.47 1uyt s MET 2014CO -0.02 0.56 -0.11 0.71 -0.65 0.00 0.00 175.02 175.52 1uyt s TYR 2015N -0.72 0.92 -0.05 4.11 1.51 0.13 -0.20 117.35 123.04 1uyt s TYR 2015Ca 0.11 -0.50 0.02 0.00 -1.01 0.00 0.00 57.07 55.70 1uyt s TYR 2015Cb -0.10 -0.53 0.01 0.00 -0.11 0.00 0.00 41.96 41.23 1uyt s TYR 2015CO 0.01 -0.02 -0.10 0.00 -1.11 0.00 0.00 175.55 174.32 1uyt s ALA 2016N -1.42 1.08 0.55 3.71 0.00 -1.14 -1.39 121.76 123.15 1uyt s ALA 2016Ca -0.06 -0.35 -0.20 0.00 0.00 0.00 0.00 51.96 51.35 1uyt s ALA 2016Cb -0.09 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.50 1uyt s ALA 2016CO 0.01 0.11 1.21 0.34 0.00 0.00 0.00 175.76 177.43 1uyt s ASP 2017N 0.55 5.48 0.59 0.00 2.15 -0.69 -1.22 116.67 123.54 1uyt s ASP 2017Ca -0.11 2.39 0.29 0.00 0.43 0.00 0.00 52.55 55.56 1uyt s ASP 2017Cb -0.14 -2.60 1.70 0.00 -0.30 0.00 0.00 42.92 41.58 1uyt s ASP 2017CO 0.02 -1.40 2.12 -0.37 -0.17 0.00 0.00 175.17 175.38 1uyt h VAL 2018N 1.21 0.45 -0.55 1.11 -1.51 -1.01 0.12 116.25 116.07 1uyt h VAL 2018Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 1uyt h VAL 2018Cb 1.28 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 1uyt h VAL 2018CO 0.57 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.50 1uyt n ASN 2019N -3.76 4.78 -4.95 4.19 3.02 -1.26 -4.62 115.26 112.65 1uyt n ASN 2019Ca 0.01 -2.61 -0.21 0.00 -0.03 0.00 0.00 54.58 51.74 1uyt n ASN 2019Cb 0.29 -0.61 0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1uyt n ASN 2019CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uyt s ALA 2020N -2.19 4.01 0.02 5.41 0.00 0.42 -4.21 121.76 125.22 1uyt s ALA 2020Ca 0.47 -1.45 0.02 0.00 0.00 0.00 0.00 51.96 51.00 1uyt s ALA 2020Cb 0.33 -1.98 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 1uyt s ALA 2020CO 0.18 -0.75 -0.06 1.03 0.00 0.00 0.00 175.76 176.17 1uyt s ARG 2021N -4.73 0.42 -0.27 0.00 1.81 -0.86 -4.32 118.95 111.00 1uyt s ARG 2021Ca 0.58 -0.52 -0.21 0.00 -1.72 0.00 0.00 55.73 53.85 1uyt s ARG 2021Cb -0.10 -0.24 0.08 0.00 -0.45 0.00 0.00 34.95 34.24 1uyt s ARG 2021CO 0.38 0.05 0.73 0.00 -0.68 0.00 0.00 175.30 175.78 1uyt s ALA 2022N -0.94 -1.84 -0.08 2.13 0.00 -1.01 -1.73 121.76 118.29 1uyt s ALA 2022Ca -0.07 2.17 -0.32 0.00 0.00 0.00 0.00 51.96 53.75 1uyt s ALA 2022Cb -0.07 -1.30 0.12 0.00 0.00 0.00 0.00 23.12 21.87 1uyt s ALA 2022CO -0.00 -0.35 1.16 0.20 0.00 0.00 0.00 175.76 176.77 1uyt s GLY 2023N 0.86 -0.35 0.24 0.00 0.00 -1.08 -4.19 107.32 102.80 1uyt s GLY 2023Ca -0.04 1.10 -0.06 0.00 0.00 0.00 0.00 44.72 45.72 1uyt s GLY 2023CO -0.08 0.33 1.91 -2.08 0.00 0.00 0.00 173.10 173.18 1uyt h VAL 2024N 2.00 1.20 -2.64 1.40 2.07 -1.93 -2.67 116.25 115.68 1uyt h VAL 2024Ca -0.19 -0.42 -0.50 0.00 0.82 0.00 0.00 66.70 66.41 1uyt h VAL 2024Cb 1.19 -0.14 -0.14 0.00 -1.52 0.00 0.00 31.29 30.69 1uyt h VAL 2024CO 0.26 0.22 -0.62 -0.76 0.02 0.00 0.00 177.57 176.69 1uyt s LEU 2025N -10.14 2.35 0.48 2.57 1.43 -1.26 -1.95 118.68 112.16 1uyt s LEU 2025Ca -0.13 -1.33 -0.05 0.00 -1.03 0.00 0.00 54.13 51.59 1uyt s LEU 2025Cb 0.18 -0.51 -0.04 0.00 0.03 0.00 0.00 46.19 45.85 1uyt s LEU 2025CO 0.81 -0.52 0.79 -1.61 0.23 0.00 0.00 176.35 176.04 1uyt s GLU 2026N -3.83 3.55 0.20 1.70 2.02 -1.26 -4.81 118.70 116.27 1uyt s GLU 2026Ca 0.35 0.22 -0.21 0.00 0.02 0.00 0.00 54.97 55.34 1uyt s GLU 2026Cb 0.08 -2.37 0.14 0.00 0.10 0.00 0.00 34.13 32.08 1uyt s GLU 2026CO 0.15 -0.21 1.56 -1.35 0.02 0.00 0.00 175.26 175.44 1uyt h PRO 2027N 0.24 -0.09 -0.35 0.39 0.11 -1.93 0.50 132.00 130.87 1uyt h PRO 2027Ca -0.47 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.72 1uyt h PRO 2027Cb 1.20 0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.25 1uyt h PRO 2027CO 0.62 -0.06 -0.36 1.96 -0.21 0.00 0.00 178.00 179.94 1uyt h GLN 2028N -0.10 -0.30 -0.69 1.05 1.08 -1.93 -0.80 115.11 113.41 1uyt h GLN 2028Ca 0.27 0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 57.43 1uyt h GLN 2028Cb 0.56 0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.03 1uyt h GLN 2028CO -0.83 -0.20 0.20 0.78 -0.95 0.00 0.00 178.83 177.83 1uyt h GLY 2029N -0.31 1.16 0.97 3.46 0.00 -1.66 -2.70 103.07 103.99 1uyt h GLY 2029Ca 0.15 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 1uyt h GLY 2029CO -0.52 0.65 0.20 1.98 0.00 0.00 0.00 176.54 178.85 1uyt h MET 2030N 1.04 0.48 -0.11 4.80 1.85 -0.24 -2.55 114.93 120.19 1uyt h MET 2030Ca 0.22 -0.05 -0.06 0.00 -0.61 0.00 0.00 59.70 59.20 1uyt h MET 2030Cb 0.32 -0.10 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 1uyt h MET 2030CO -0.00 0.38 -0.22 -0.24 -0.40 0.00 0.00 176.91 176.43 1uyt h VAL 2031N 0.45 1.21 0.00 -5.77 3.04 -1.12 -1.49 116.25 112.57 1uyt h VAL 2031Ca 0.12 -0.97 0.00 0.00 -1.01 0.00 0.00 66.70 64.85 1uyt h VAL 2031Cb 0.03 1.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1uyt h VAL 2031CO -0.02 0.29 0.00 0.61 -1.01 0.00 0.00 177.57 177.44 1uyt n GLY 2032N -0.71 -0.72 1.44 3.17 0.00 -0.96 -1.34 105.19 106.07 1uyt n GLY 2032Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1uyt n GLY 2032CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1uyt n ILE 2033N -0.55 0.00 0.98 -0.61 2.08 -0.89 -4.85 119.36 115.51 1uyt n ILE 2033Ca 0.02 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.45 1uyt n ILE 2033Cb 0.01 -0.79 0.15 0.00 -0.75 0.00 0.00 39.64 38.26 1uyt n ILE 2033CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1uyt n LYS 2034N -2.59 2.28 -3.14 0.38 4.76 -0.61 -4.55 118.16 114.69 1uyt n LYS 2034Ca 0.00 -1.87 -0.17 0.00 -2.87 0.00 0.00 58.31 53.39 1uyt n LYS 2034Cb 0.19 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 31.89 1uyt n LYS 2034CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1uyt n PHE 2035N 1.25 -0.19 -0.67 2.13 -0.00 -0.45 -5.00 117.46 114.54 1uyt n PHE 2035Ca 0.15 -3.62 -0.30 0.00 -0.00 0.00 0.00 57.45 53.68 1uyt n PHE 2035Cb 0.58 -0.19 0.26 0.00 -0.00 0.00 0.00 39.48 40.13 1uyt n PHE 2035CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1uyt s ARG 2036N -2.06 -1.88 0.22 -4.13 1.81 -1.24 -4.64 118.95 107.03 1uyt s ARG 2036Ca 0.38 0.22 -0.09 0.00 -1.72 0.00 0.00 55.73 54.52 1uyt s ARG 2036Cb 0.33 -1.49 0.18 0.00 -0.45 0.00 0.00 34.95 33.52 1uyt s ARG 2036CO -0.08 -4.21 1.89 0.00 -0.68 0.00 0.00 175.30 172.22 1uyt h ARG 2037N -2.94 1.04 -0.43 3.54 -0.00 -1.99 -1.82 114.38 111.78 1uyt h ARG 2037Ca -0.48 -0.06 0.10 0.00 -0.50 0.00 0.00 59.98 59.04 1uyt h ARG 2037Cb 1.33 -0.23 -0.02 0.00 0.00 0.00 0.00 29.97 31.04 1uyt h ARG 2037CO 0.36 0.69 0.30 1.49 0.00 0.00 0.00 179.97 182.81 1uyt h GLU 2038N 1.07 0.11 0.00 0.04 4.81 -2.01 0.16 114.58 118.76 1uyt h GLU 2038Ca 0.30 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 1uyt h GLU 2038Cb -0.11 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 1uyt h GLU 2038CO -0.07 0.07 -0.67 -0.22 -0.73 0.00 0.00 179.01 177.39 1uyt h LYS 2039N 0.11 0.00 -0.21 1.92 3.64 -1.68 -3.16 116.57 117.19 1uyt h LYS 2039Ca 0.20 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.43 1uyt h LYS 2039Cb 0.65 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1uyt h LYS 2039CO -0.02 0.16 -0.48 -0.07 -2.27 0.00 0.00 179.45 176.76 1uyt h LEU 2040N 0.00 0.60 0.59 5.20 3.38 -0.03 -2.71 115.31 122.34 1uyt h LEU 2040Ca -0.03 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1uyt h LEU 2040Cb 1.19 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.77 1uyt h LEU 2040CO 0.02 0.99 -0.28 -0.07 0.09 0.00 0.00 178.44 179.19 1uyt h LEU 2041N 0.44 -0.67 -1.91 1.67 3.38 -1.33 0.32 115.31 117.21 1uyt h LEU 2041Ca 0.02 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.17 1uyt h LEU 2041Cb 1.01 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 1uyt h LEU 2041CO 0.09 -0.27 0.53 0.44 0.09 0.00 0.00 178.44 179.32 1uyt h ASP 2042N -1.21 0.00 0.62 -0.43 5.19 -1.63 1.37 116.42 120.34 1uyt h ASP 2042Ca -0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 1uyt h ASP 2042Cb 0.61 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.12 1uyt h ASP 2042CO 0.13 0.00 -1.10 0.41 -3.12 0.00 0.00 179.24 175.57 1uyt n THR 2043N -3.76 0.32 1.09 0.35 -1.04 -1.02 -3.82 114.28 106.41 1uyt n THR 2043Ca 0.10 -0.38 0.08 0.00 -2.04 0.00 0.00 64.05 61.80 1uyt n THR 2043Cb 0.74 -0.04 0.45 0.00 -1.82 0.00 0.00 70.33 69.65 1uyt n THR 2043CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1uyt n MET 2044N -2.26 0.55 -2.12 -2.82 0.00 0.47 -3.68 117.12 107.25 1uyt n MET 2044Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.32 1uyt n MET 2044Cb 0.49 -1.43 -0.00 0.00 0.00 0.00 0.00 33.22 32.28 1uyt n MET 2044CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1uyt n ASN 2045N -0.93 7.70 0.00 6.12 3.02 -1.19 -4.18 115.26 125.80 1uyt n ASN 2045Ca 0.11 -3.33 0.00 0.00 -0.03 0.00 0.00 54.58 51.34 1uyt n ASN 2045Cb 0.05 -1.28 0.00 0.00 -0.61 0.00 0.00 39.78 37.94 1uyt n ASN 2045CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1uyt n ARG 2046N 1.06 0.00 0.00 3.52 5.12 -1.24 -5.14 116.66 119.98 1uyt n ARG 2046Ca 0.57 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.49 1uyt n ARG 2046Cb 0.28 -0.66 0.00 0.00 -1.16 0.00 0.00 32.46 30.92 1uyt n ARG 2046CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1uyt n LEU 2047N -2.60 0.00 0.00 0.55 0.00 -1.26 -5.26 117.00 108.43 1uyt n LEU 2047Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 56.01 55.98 1uyt n LEU 2047Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.82 1uyt n LEU 2047CO 0.00 0.15 0.00 -0.62 0.00 0.00 0.00 177.39 176.92 1uyt n GLU 2081N 0.00 0.00 -1.13 1.96 4.71 -1.26 -5.15 120.64 119.78 1uyt n GLU 2081Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.16 56.96 1uyt n GLU 2081Cb 0.04 0.00 0.18 0.00 -1.01 0.00 0.00 31.44 30.65 1uyt n GLU 2081CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 1uyt n LEU 2082N 0.00 5.97 -0.04 -4.62 -0.00 -1.26 -4.59 117.00 112.46 1uyt n LEU 2082Ca 0.00 -3.74 -0.14 0.00 -0.00 0.00 0.00 56.01 52.13 1uyt n LEU 2082Cb 0.00 -0.78 -0.08 0.00 -0.00 0.00 0.00 43.42 42.56 1uyt n LEU 2082CO 0.00 1.17 0.50 0.25 -0.00 0.00 0.00 177.39 179.32 1uyt h LEU 2083N 1.10 0.40 -0.54 1.47 7.12 -2.02 -2.51 115.31 120.32 1uyt h LEU 2083Ca 0.50 -0.58 0.09 0.00 0.13 0.00 0.00 57.88 58.02 1uyt h LEU 2083Cb 2.32 -0.12 -0.07 0.00 -0.53 0.00 0.00 40.66 42.27 1uyt h LEU 2083CO 0.91 0.91 0.16 -0.65 -0.13 0.00 0.00 178.44 179.64 1uyt h PRO 2084N -0.09 0.31 -0.02 5.25 0.11 -2.01 0.54 132.00 136.09 1uyt h PRO 2084Ca -0.00 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.92 1uyt h PRO 2084Cb 0.86 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 1uyt h PRO 2084CO 0.05 0.20 -0.74 0.97 -0.21 0.00 0.00 178.00 178.28 1uyt h ILE 2085N 0.32 1.47 0.00 4.15 6.09 -1.91 -2.97 117.51 124.65 1uyt h ILE 2085Ca 0.27 -2.36 -0.06 0.00 -1.37 0.00 0.00 64.86 61.34 1uyt h ILE 2085Cb 0.35 2.27 -0.01 0.00 0.47 0.00 0.00 36.82 39.90 1uyt h ILE 2085CO -0.31 0.69 -0.30 1.88 -3.07 0.00 0.00 178.15 177.04 1uyt h TYR 2086N 0.09 0.00 -0.51 2.19 -1.99 -0.92 -2.77 116.97 113.06 1uyt h TYR 2086Ca -0.02 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.61 1uyt h TYR 2086Cb 1.30 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 40.01 1uyt h TYR 2086CO 0.02 0.30 -0.07 0.78 -0.00 0.00 0.00 178.16 179.18 1uyt h GLY 2087N 1.89 1.03 2.00 3.88 0.00 -0.75 -2.09 103.07 109.02 1uyt h GLY 2087Ca -0.00 -0.81 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1uyt h GLY 2087CO 0.04 0.74 -0.08 1.46 0.00 0.00 0.00 176.54 178.71 1uyt h GLN 2088N 0.81 0.00 -0.32 4.80 1.08 -1.47 0.92 115.11 120.93 1uyt h GLN 2088Ca 0.13 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.26 1uyt h GLN 2088Cb 0.62 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.04 1uyt h GLN 2088CO 0.04 0.08 -0.13 0.82 -0.95 0.00 0.00 178.83 178.69 1uyt h ILE 2089N 0.00 1.24 0.17 2.54 2.04 -1.24 -1.63 117.51 120.63 1uyt h ILE 2089Ca -0.00 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 1uyt h ILE 2089Cb 0.15 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1uyt h ILE 2089CO 0.01 0.35 -0.08 0.28 0.00 0.00 0.00 178.15 178.71 1uyt h SER 2090N 0.50 -0.19 -0.05 1.72 0.02 -0.64 -1.54 113.55 113.37 1uyt h SER 2090Ca 0.09 -0.25 0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1uyt h SER 2090Cb 0.52 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.07 1uyt h SER 2090CO 0.03 0.16 -0.36 -0.07 -1.14 0.00 0.00 176.83 175.46 1uyt h LEU 2091N -0.57 -1.12 -1.78 5.07 4.07 -1.14 0.75 115.31 120.58 1uyt h LEU 2091Ca -0.02 0.13 0.18 0.00 0.08 0.00 0.00 57.88 58.25 1uyt h LEU 2091Cb 0.43 0.43 -0.04 0.00 1.08 0.00 0.00 40.66 42.56 1uyt h LEU 2091CO 0.04 -0.33 0.51 -0.61 -1.08 0.00 0.00 178.44 176.97 1uyt h GLN 2092N -0.41 0.19 -0.12 1.13 5.75 -1.37 0.60 115.11 120.89 1uyt h GLN 2092Ca 0.02 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1uyt h GLN 2092Cb 0.46 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.96 1uyt h GLN 2092CO -0.27 0.13 0.04 0.35 -2.65 0.00 0.00 178.83 176.43 1uyt h PHE 2093N 0.20 0.19 -0.24 3.99 3.57 0.13 -2.50 116.94 122.27 1uyt h PHE 2093Ca 0.36 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1uyt h PHE 2093Cb 1.13 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 1uyt h PHE 2093CO -0.00 0.31 0.04 0.00 -2.23 0.00 0.00 178.31 176.43 1uyt h ALA 2094N 0.85 0.32 0.00 2.41 0.00 0.65 -2.61 119.26 120.89 1uyt h ALA 2094Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1uyt h ALA 2094Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1uyt h ALA 2094CO -0.00 -0.00 0.18 0.22 0.00 0.00 0.00 179.25 179.64 1uyt h ASP 2095N 0.20 0.00 0.57 0.00 3.58 -0.85 0.22 116.42 120.14 1uyt h ASP 2095Ca 0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1uyt h ASP 2095Cb 0.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1uyt h ASP 2095CO 0.01 0.00 -0.01 0.18 -2.88 0.00 0.00 179.24 176.54 1uyt n LEU 2096N -2.37 0.02 -0.07 2.28 4.77 -0.95 -3.31 117.00 117.37 1uyt n LEU 2096Ca -0.01 0.28 -0.16 0.00 -0.03 0.00 0.00 56.01 56.08 1uyt n LEU 2096Cb 0.21 -0.28 -0.14 0.00 -2.33 0.00 0.00 43.42 40.88 1uyt n LEU 2096CO 0.10 0.00 -1.02 1.41 -1.33 0.00 0.00 177.39 176.55 1uyt n HIS 2097N -1.28 0.53 -0.39 -1.77 8.25 0.78 -4.46 115.22 116.89 1uyt n HIS 2097Ca 0.14 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 1uyt n HIS 2097Cb 0.24 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.28 1uyt n HIS 2097CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1uyt n ASP 2098N -3.18 4.95 -4.81 0.41 8.00 -1.21 -4.71 116.55 115.99 1uyt n ASP 2098Ca -0.34 -2.31 -0.32 0.00 0.71 0.00 0.00 54.79 52.52 1uyt n ASP 2098Cb 1.05 -1.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.05 1uyt n ASP 2098CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1uyt s ARG 2099N 0.09 3.08 0.49 -1.24 1.81 -1.26 -2.40 118.95 119.52 1uyt s ARG 2099Ca 0.00 -0.54 0.24 0.00 -1.72 0.00 0.00 55.73 53.71 1uyt s ARG 2099Cb 0.00 -2.86 1.30 0.00 -0.45 0.00 0.00 34.95 32.95 1uyt s ARG 2099CO 0.00 0.61 1.91 0.66 -0.68 0.00 0.00 175.30 177.81 1uyt h SER 2100N 3.60 0.15 -0.68 0.23 4.64 -1.82 0.22 113.55 119.90 1uyt h SER 2100Ca -0.47 0.01 0.03 0.00 -0.47 0.00 0.00 61.79 60.89 1uyt h SER 2100Cb 1.17 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 63.20 1uyt h SER 2100CO 0.66 0.07 0.42 0.28 -0.87 0.00 0.00 176.83 177.39 1uyt h SER 2101N 0.16 0.68 -0.62 4.97 0.02 -1.94 -0.38 113.55 116.44 1uyt h SER 2101Ca 0.38 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.27 1uyt h SER 2101Cb 1.27 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 1uyt h SER 2101CO -0.06 0.46 0.12 -0.09 -1.14 0.00 0.00 176.83 176.12 1uyt h ARG 2102N 0.81 1.01 -0.81 3.45 2.43 -1.24 -0.97 114.38 119.06 1uyt h ARG 2102Ca 0.28 -0.26 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1uyt h ARG 2102Cb 0.05 -0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 29.40 1uyt h ARG 2102CO -0.12 0.94 0.45 0.52 -1.51 0.00 0.00 179.97 180.25 1uyt h MET 2103N 0.93 0.73 -0.18 0.20 2.86 -1.02 0.38 114.93 118.82 1uyt h MET 2103Ca 0.19 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.73 1uyt h MET 2103Cb 0.40 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.90 1uyt h MET 2103CO 0.01 0.49 -0.12 0.28 1.06 0.00 0.00 176.91 178.62 1uyt h VAL 2104N 0.76 1.32 -0.79 -2.22 2.07 -0.74 -1.24 116.25 115.41 1uyt h VAL 2104Ca 0.40 -1.22 0.02 0.00 0.82 0.00 0.00 66.70 66.72 1uyt h VAL 2104Cb 0.38 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 1uyt h VAL 2104CO -0.26 0.37 0.52 0.00 0.02 0.00 0.00 177.57 178.22 1uyt h ALA 2105N 0.67 1.47 0.00 1.67 0.00 -0.22 -1.99 119.26 120.86 1uyt h ALA 2105Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uyt h ALA 2105Cb 0.63 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1uyt h ALA 2105CO 0.03 0.47 0.00 0.87 0.00 0.00 0.00 179.25 180.63 1uyt h LYS 2106N 1.03 0.00 0.00 0.00 1.79 -0.22 -3.48 116.57 115.69 1uyt h LYS 2106Ca 0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 1uyt h LYS 2106Cb -0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1uyt h LYS 2106CO -0.08 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.70 1uyt n GLY 2107N 1.09 0.51 0.11 3.86 0.00 -0.54 -4.96 105.19 105.26 1uyt n GLY 2107Ca 0.04 -0.88 0.12 0.00 0.00 0.00 0.00 46.02 45.31 1uyt n GLY 2107CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uyt n VAL 2108N -3.26 0.00 -4.20 1.61 0.24 -0.77 -4.90 118.33 107.05 1uyt n VAL 2108Ca 0.00 -0.06 -0.12 0.00 -2.04 0.00 0.00 64.34 62.12 1uyt n VAL 2108Cb 0.22 0.42 -0.10 0.00 -1.47 0.00 0.00 33.84 32.91 1uyt n VAL 2108CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1uyt s ILE 2109N -2.80 0.89 0.07 1.34 -4.36 -1.25 -4.81 121.20 110.28 1uyt s ILE 2109Ca 0.16 -1.97 -0.10 0.00 -0.26 0.00 0.00 60.65 58.48 1uyt s ILE 2109Cb 0.18 -1.73 -0.28 0.00 1.25 0.00 0.00 42.46 41.88 1uyt s ILE 2109CO 0.65 -0.81 1.14 0.28 0.24 0.00 0.00 174.94 176.44 1uyt h SER 2110N 2.92 0.67 -4.56 4.36 0.02 -0.93 -3.45 113.55 112.57 1uyt h SER 2110Ca -0.36 -0.64 0.05 0.00 -0.84 0.00 0.00 61.79 59.99 1uyt h SER 2110Cb 1.18 -0.21 -0.19 0.00 0.14 0.00 0.00 62.40 63.32 1uyt h SER 2110CO 0.64 1.47 0.41 -0.54 -1.14 0.00 0.00 176.83 177.67 1uyt s LYS 2111N -2.88 0.84 0.13 3.45 1.02 -1.26 -5.09 119.74 115.94 1uyt s LYS 2111Ca -0.07 -0.01 -0.07 0.00 0.02 0.00 0.00 55.97 55.85 1uyt s LYS 2111Cb 0.06 0.39 -0.06 0.00 -0.52 0.00 0.00 37.83 37.71 1uyt s LYS 2111CO 0.91 -0.30 0.39 -1.83 -0.92 0.00 0.00 175.35 173.59 1uyt s GLU 2112N -1.94 3.67 0.21 1.68 -1.05 -1.26 -2.91 118.70 117.10 1uyt s GLU 2112Ca -0.02 0.01 0.01 0.00 -0.15 0.00 0.00 54.97 54.82 1uyt s GLU 2112Cb -0.01 -2.88 -0.05 0.00 -0.44 0.00 0.00 34.13 30.76 1uyt s GLU 2112CO -0.01 0.49 0.05 -0.51 0.95 0.00 0.00 175.26 176.23 1uyt s LEU 2113N -2.44 1.83 -0.26 1.83 1.43 -0.36 -4.89 118.68 115.81 1uyt s LEU 2113Ca 0.39 -1.29 -0.05 0.00 -1.03 0.00 0.00 54.13 52.15 1uyt s LEU 2113Cb -0.13 0.01 0.00 0.00 0.03 0.00 0.00 46.19 46.11 1uyt s LEU 2113CO 0.22 -0.66 0.03 -1.61 0.23 0.00 0.00 176.35 174.56 1uyt s GLU 2114N -3.99 3.20 0.25 1.70 2.02 -1.26 -0.31 118.70 120.32 1uyt s GLU 2114Ca 0.31 -0.76 -0.07 0.00 0.02 0.00 0.00 54.97 54.47 1uyt s GLU 2114Cb 0.07 -3.23 0.42 0.00 0.10 0.00 0.00 34.13 31.49 1uyt s GLU 2114CO 0.09 -0.34 1.41 1.87 0.02 0.00 0.00 175.26 178.31 1uyt n TRP 2115N 4.83 0.33 -0.04 1.61 -0.00 -1.26 -0.57 117.44 122.33 1uyt n TRP 2115Ca -0.16 1.11 0.06 0.00 -0.00 0.00 0.00 57.50 58.50 1uyt n TRP 2115Cb 0.49 -1.03 0.42 0.00 -0.00 0.00 0.00 31.31 31.19 1uyt n TRP 2115CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 177.69 179.48 1uyt h THR 2116N 0.00 1.06 -0.05 5.87 1.35 -1.96 -1.72 112.91 117.46 1uyt h THR 2116Ca 0.44 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 66.10 1uyt h THR 2116Cb 0.67 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1uyt h THR 2116CO -0.93 0.10 0.00 -0.62 -0.25 0.00 0.00 175.52 173.82 1uyt n GLU 2117N -4.47 1.95 -0.14 4.72 -0.58 0.26 -0.16 120.64 122.21 1uyt n GLU 2117Ca 0.05 -1.38 -0.05 0.00 -0.42 0.00 0.00 57.16 55.37 1uyt n GLU 2117Cb 0.13 -1.47 0.04 0.00 -0.57 0.00 0.00 31.44 29.58 1uyt n GLU 2117CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1uyt h ALA 2118N 4.46 0.55 -0.51 0.62 0.00 -0.41 -2.10 119.26 121.88 1uyt h ALA 2118Ca 0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1uyt h ALA 2118Cb 0.70 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1uyt h ALA 2118CO 0.00 -0.19 0.28 -0.09 0.00 0.00 0.00 179.25 179.25 1uyt h ARG 2119N 0.38 0.53 -0.26 0.00 2.43 -1.79 0.48 114.38 116.15 1uyt h ARG 2119Ca 0.20 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1uyt h ARG 2119Cb 0.16 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1uyt h ARG 2119CO -0.18 0.35 0.09 0.00 -1.51 0.00 0.00 179.97 178.72 1uyt h ARG 2120N 0.55 0.40 0.23 0.20 3.08 -1.72 -2.20 114.38 114.92 1uyt h ARG 2120Ca 0.22 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1uyt h ARG 2120Cb 0.08 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1uyt h ARG 2120CO -0.13 0.45 -0.11 0.35 -1.07 0.00 0.00 179.97 179.46 1uyt h PHE 2121N 0.26 -0.29 -0.25 3.04 3.57 -1.02 -3.11 116.94 119.14 1uyt h PHE 2121Ca 0.09 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1uyt h PHE 2121Cb 0.21 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1uyt h PHE 2121CO -0.00 -0.12 -0.12 0.74 -2.23 0.00 0.00 178.31 176.58 1uyt h PHE 2122N -0.38 0.44 -0.02 0.41 0.05 -0.94 -0.77 116.94 115.73 1uyt h PHE 2122Ca -0.03 -0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.70 1uyt h PHE 2122Cb 0.29 -0.12 -0.00 0.00 2.00 0.00 0.00 35.95 38.12 1uyt h PHE 2122CO -0.04 0.53 0.02 0.35 -0.18 0.00 0.00 178.31 178.98 1uyt h PHE 2123N 0.39 0.03 -0.17 -0.55 3.57 -1.37 0.34 116.94 119.18 1uyt h PHE 2123Ca 0.08 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.41 1uyt h PHE 2123Cb 0.45 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.17 1uyt h PHE 2123CO 0.01 0.03 -0.58 -1.49 -2.23 0.00 0.00 178.31 174.05 1uyt h TRP 2124N 0.02 0.71 0.08 0.41 4.06 -1.47 -1.52 115.95 118.24 1uyt h TRP 2124Ca 0.01 -0.26 -0.00 0.00 2.06 0.00 0.00 58.89 60.69 1uyt h TRP 2124Cb 0.01 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.04 1uyt h TRP 2124CO -0.07 1.00 -0.04 -0.09 -3.56 0.00 0.00 178.44 175.68 1uyt h ARG 2125N 0.42 -0.11 -0.53 0.49 9.65 -0.86 0.12 114.38 123.57 1uyt h ARG 2125Ca 0.00 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1uyt h ARG 2125Cb 1.14 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.72 1uyt h ARG 2125CO 0.11 0.08 0.35 1.25 2.80 0.00 0.00 179.97 184.55 1uyt h LEU 2126N -0.27 0.61 -0.59 3.80 5.85 -0.32 -0.87 115.31 123.51 1uyt h LEU 2126Ca -0.01 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1uyt h LEU 2126Cb 0.23 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1uyt h LEU 2126CO 0.02 0.44 0.34 -0.09 -0.34 0.00 0.00 178.44 178.81 1uyt h ARG 2127N 0.71 0.81 -0.38 1.25 2.43 -1.17 0.76 114.38 118.80 1uyt h ARG 2127Ca 0.19 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1uyt h ARG 2127Cb -0.08 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 1uyt h ARG 2127CO -0.04 0.60 0.25 -0.09 -1.51 0.00 0.00 179.97 179.18 1uyt h ARG 2128N 0.80 0.49 -0.53 0.20 1.12 -0.35 -2.21 114.38 113.90 1uyt h ARG 2128Ca 0.21 -0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.99 1uyt h ARG 2128Cb 0.01 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 29.84 1uyt h ARG 2128CO -0.04 0.33 0.10 0.00 -3.11 0.00 0.00 179.97 177.25 1uyt h ARG 2129N 0.51 0.87 -0.34 0.20 3.08 -0.65 -1.60 114.38 116.46 1uyt h ARG 2129Ca 0.14 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1uyt h ARG 2129Cb -0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1uyt h ARG 2129CO -0.03 0.85 0.21 -0.07 -1.07 0.00 0.00 179.97 179.86 1uyt h LEU 2130N 0.76 0.39 -0.23 3.04 3.38 -0.68 0.17 115.31 122.14 1uyt h LEU 2130Ca 0.16 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 1uyt h LEU 2130Cb 0.39 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1uyt h LEU 2130CO 0.01 0.29 -0.51 0.78 0.09 0.00 0.00 178.44 179.10 1uyt h ASN 2131N 0.46 0.85 0.01 -0.43 4.21 -0.88 -2.45 115.58 117.33 1uyt h ASN 2131Ca 0.12 -0.56 -0.14 0.00 1.21 0.00 0.00 56.30 56.93 1uyt h ASN 2131Cb -0.04 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 36.91 1uyt h ASN 2131CO -0.03 1.25 -0.46 -0.33 -1.29 0.00 0.00 177.43 176.57 1uyt h GLU 2132N 0.48 0.54 -0.12 0.81 5.08 -0.58 -2.82 114.58 117.96 1uyt h GLU 2132Ca 0.00 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1uyt h GLU 2132Cb 1.12 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1uyt h GLU 2132CO 0.11 0.89 0.04 0.93 -1.00 0.00 0.00 179.01 179.98 1uyt h GLU 2133N 0.43 0.10 -0.83 2.33 4.39 -0.68 0.43 114.58 120.74 1uyt h GLU 2133Ca 0.03 -0.01 0.15 0.00 0.34 0.00 0.00 59.36 59.87 1uyt h GLU 2133Cb 0.97 -0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 29.50 1uyt h GLU 2133CO 0.09 0.07 0.41 -0.92 -1.16 0.00 0.00 179.01 177.50 1uyt h TYR 2134N 0.10 0.72 -0.27 4.33 3.20 -1.32 -0.11 116.97 123.62 1uyt h TYR 2134Ca 0.05 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.81 1uyt h TYR 2134Cb 0.03 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1uyt h TYR 2134CO -0.10 0.15 -0.41 -0.07 -1.64 0.00 0.00 178.16 176.09 1uyt h LEU 2135N 0.58 0.71 -0.64 2.82 4.07 -1.11 -2.41 115.31 119.33 1uyt h LEU 2135Ca 0.46 -0.32 -0.03 0.00 0.08 0.00 0.00 57.88 58.06 1uyt h LEU 2135Cb 0.66 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.18 1uyt h LEU 2135CO -0.37 1.03 0.27 0.40 -1.08 0.00 0.00 178.44 178.68 1uyt h ILE 2136N 0.54 1.23 -0.18 1.22 2.04 0.77 -2.52 117.51 120.60 1uyt h ILE 2136Ca 0.04 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 1uyt h ILE 2136Cb 0.94 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 1uyt h ILE 2136CO 0.08 0.28 0.05 0.11 0.00 0.00 0.00 178.15 178.68 1uyt h LYS 2137N 0.89 0.29 -0.68 2.37 1.57 -1.04 -0.95 116.57 119.01 1uyt h LYS 2137Ca 0.21 -0.06 0.19 0.00 -1.87 0.00 0.00 60.65 59.12 1uyt h LYS 2137Cb 0.18 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1uyt h LYS 2137CO -0.02 0.40 0.48 0.00 -0.57 0.00 0.00 179.45 179.75 1uyt h ARG 2138N 0.12 0.08 0.15 3.15 2.47 -1.28 -0.21 114.38 118.85 1uyt h ARG 2138Ca 0.06 -0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.47 1uyt h ARG 2138Cb 0.24 -0.02 0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1uyt h ARG 2138CO -0.00 0.05 -1.42 -0.07 0.56 0.00 0.00 179.97 179.09 1uyt h LEU 2139N 0.08 0.49 -0.34 3.04 3.38 -1.00 -3.33 115.31 117.62 1uyt h LEU 2139Ca 0.33 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1uyt h LEU 2139Cb 1.20 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1uyt h LEU 2139CO -0.03 1.47 0.27 -1.20 0.09 0.00 0.00 178.44 179.04 1uyt n SER 2140N -3.53 0.13 -3.60 -0.43 7.64 -0.09 -3.36 113.62 110.38 1uyt n SER 2140Ca -0.14 0.39 -0.37 0.00 1.01 0.00 0.00 58.87 59.76 1uyt n SER 2140Cb 1.05 -0.36 -0.01 0.00 -1.01 0.00 0.00 64.21 63.88 1uyt n SER 2140CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1uyt n HIS 2141N -1.60 2.96 0.00 1.43 8.25 -1.24 -4.23 115.22 120.80 1uyt n HIS 2141Ca -0.00 -3.06 0.00 0.00 -0.26 0.00 0.00 57.72 54.39 1uyt n HIS 2141Cb 0.28 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.40 1uyt n HIS 2141CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1uyt n GLN 2142N 0.48 0.00 0.11 -0.41 0.00 -1.22 -4.96 117.38 111.38 1uyt n GLN 2142Ca 0.35 0.00 -0.17 0.00 -0.00 0.00 0.00 57.00 57.18 1uyt n GLN 2142Cb 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 30.24 30.44 1uyt n GLN 2142CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1uyt h VAL 2143N 0.00 1.46 -0.10 1.69 3.04 -1.85 -3.47 116.25 117.02 1uyt h VAL 2143Ca 0.00 -2.94 -0.02 0.00 -1.01 0.00 0.00 66.70 62.73 1uyt h VAL 2143Cb 0.00 2.91 -0.01 0.00 -2.01 0.00 0.00 31.29 32.18 1uyt h VAL 2143CO 0.00 0.86 -0.02 0.61 -1.01 0.00 0.00 177.57 178.02 1uyt n GLY 2144N 1.50 0.08 0.08 3.17 0.00 -1.26 -4.61 105.19 104.15 1uyt n GLY 2144Ca -0.10 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.94 1uyt n GLY 2144CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uyt n GLU 2145N 0.43 1.21 -3.94 1.61 1.02 -1.26 -5.05 120.64 114.65 1uyt n GLU 2145Ca -0.01 -1.18 -0.35 0.00 -0.02 0.00 0.00 57.16 55.60 1uyt n GLU 2145Cb 0.31 -0.80 -0.06 0.00 -0.02 0.00 0.00 31.44 30.87 1uyt n GLU 2145CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1uyt s ALA 2146N -0.71 3.84 0.68 0.62 0.00 -1.26 -5.10 121.76 119.82 1uyt s ALA 2146Ca 0.04 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.17 1uyt s ALA 2146Cb 0.04 -1.87 -0.00 0.00 0.00 0.00 0.00 23.12 21.29 1uyt s ALA 2146CO 0.00 0.67 1.07 -1.54 0.00 0.00 0.00 175.76 175.96 1uyt s SER 2147N -1.42 5.66 0.30 0.00 1.04 -1.26 -4.82 113.70 113.20 1uyt s SER 2147Ca 0.20 1.30 0.05 0.00 0.48 0.00 0.00 55.95 57.98 1uyt s SER 2147Cb -0.12 -2.19 0.71 0.00 0.10 0.00 0.00 66.02 64.51 1uyt s SER 2147CO 0.10 -1.22 1.77 -0.09 0.98 0.00 0.00 173.24 174.78 1uyt h ARG 2148N -0.57 0.70 -0.21 4.02 2.43 -1.99 0.19 114.38 118.96 1uyt h ARG 2148Ca -0.45 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.71 1uyt h ARG 2148Cb 1.23 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 1uyt h ARG 2148CO 0.62 0.46 0.01 1.25 -1.51 0.00 0.00 179.97 180.80 1uyt h LEU 2149N 0.72 -0.06 -1.29 3.80 5.85 -1.99 -0.46 115.31 121.88 1uyt h LEU 2149Ca 0.56 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 59.25 1uyt h LEU 2149Cb 0.88 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1uyt h LEU 2149CO -0.39 -0.00 -0.35 -0.33 -0.34 0.00 0.00 178.44 177.03 1uyt h GLU 2150N 0.08 0.00 -0.08 1.25 5.08 -1.45 -1.69 114.58 117.77 1uyt h GLU 2150Ca 0.10 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.27 1uyt h GLU 2150Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1uyt h GLU 2150CO -0.16 0.35 -0.68 0.87 -1.00 0.00 0.00 179.01 178.39 1uyt h LYS 2151N 0.00 0.60 -0.03 2.33 1.57 -0.29 -2.84 116.57 117.91 1uyt h LYS 2151Ca -0.00 -0.54 -0.18 0.00 -1.87 0.00 0.00 60.65 58.05 1uyt h LYS 2151Cb 0.64 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1uyt h LYS 2151CO 0.05 1.16 -0.79 0.97 -0.57 0.00 0.00 179.45 180.27 1uyt h ILE 2152N 0.23 1.44 -0.62 1.86 6.09 -1.06 -2.72 117.51 122.74 1uyt h ILE 2152Ca -0.06 -2.37 -0.05 0.00 -1.37 0.00 0.00 64.86 61.01 1uyt h ILE 2152Cb 1.33 2.29 -0.03 0.00 0.47 0.00 0.00 36.82 40.89 1uyt h ILE 2152CO 0.14 0.70 0.21 0.00 -3.07 0.00 0.00 178.15 176.13 1uyt h ALA 2153N 1.01 0.81 -0.52 0.18 0.00 -1.37 0.21 119.26 119.58 1uyt h ALA 2153Ca -0.03 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 1uyt h ALA 2153Cb 1.38 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1uyt h ALA 2153CO 0.12 0.46 -0.11 -0.09 0.00 0.00 0.00 179.25 179.64 1uyt h ARG 2154N 0.88 0.97 -0.38 0.00 2.43 -1.50 -1.80 114.38 114.99 1uyt h ARG 2154Ca 0.20 -0.35 -0.08 0.00 -0.81 0.00 0.00 59.98 58.94 1uyt h ARG 2154Cb 0.26 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1uyt h ARG 2154CO -0.01 1.02 -0.08 0.82 -1.51 0.00 0.00 179.97 180.22 1uyt h ILE 2155N 0.87 1.27 0.00 1.20 2.04 -1.13 -2.77 117.51 118.99 1uyt h ILE 2155Ca 0.14 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.85 1uyt h ILE 2155Cb 0.66 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1uyt h ILE 2155CO 0.05 0.38 0.00 0.03 0.00 0.00 0.00 178.15 178.61 1uyt h ARG 2156N 0.53 0.00 0.00 2.37 3.08 -0.49 -1.97 114.38 117.90 1uyt h ARG 2156Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1uyt h ARG 2156Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1uyt h ARG 2156CO 0.03 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.80 1uyt n SER 2157N -2.57 0.36 0.10 7.04 3.41 -0.69 -2.53 113.62 118.74 1uyt n SER 2157Ca 0.02 0.55 0.06 0.00 -0.26 0.00 0.00 58.87 59.24 1uyt n SER 2157Cb 0.29 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1uyt n SER 2157CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1uyt h TRP 2158N 0.00 0.00 -3.81 7.33 6.55 -1.36 -3.47 115.95 121.19 1uyt h TRP 2158Ca 0.00 0.00 -0.55 0.00 0.95 0.00 0.00 58.89 59.29 1uyt h TRP 2158Cb 0.50 0.00 0.12 0.00 -0.86 0.00 0.00 29.16 28.92 1uyt h TRP 2158CO 0.00 0.28 0.68 0.66 -1.05 0.00 0.00 178.44 179.01 1uyt n TYR 2159N -2.90 2.70 -1.75 0.49 0.53 -1.05 -4.89 117.16 110.29 1uyt n TYR 2159Ca -0.02 0.46 -0.42 0.00 -1.02 0.00 0.00 57.90 56.90 1uyt n TYR 2159Cb 0.67 -2.47 -0.01 0.00 -1.03 0.00 0.00 39.34 36.50 1uyt n TYR 2159CO 0.00 0.00 0.00 -2.30 -1.02 0.00 0.00 176.86 173.54 1uyt n PRO 2160N 0.19 2.54 -0.36 -0.72 -0.02 -1.26 -4.85 135.00 130.52 1uyt n PRO 2160Ca 0.04 0.90 0.27 0.00 -2.02 0.00 0.00 63.50 62.68 1uyt n PRO 2160Cb 0.39 -2.60 0.54 0.00 -0.02 0.00 0.00 33.50 31.81 1uyt n PRO 2160CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uyt h ALA 2161N 3.25 2.33 0.00 3.55 0.00 -1.94 0.39 119.26 126.85 1uyt h ALA 2161Ca -0.49 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1uyt h ALA 2161Cb 1.25 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1uyt h ALA 2161CO 0.67 -0.83 0.00 0.43 0.00 0.00 0.00 179.25 179.52 1uyt n SER 2162N -4.70 0.74 -4.73 0.00 7.64 -1.26 -4.75 113.62 106.55 1uyt n SER 2162Ca 0.30 0.64 -0.41 0.00 1.01 0.00 0.00 58.87 60.40 1uyt n SER 2162Cb 1.05 -0.81 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1uyt n SER 2162CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1uyt s VAL 2163N -3.24 3.71 -0.46 0.44 1.01 0.14 -4.99 120.40 117.02 1uyt s VAL 2163Ca 0.07 1.40 -0.20 0.00 0.00 0.00 0.00 61.98 63.24 1uyt s VAL 2163Cb 0.10 -3.89 0.03 0.00 0.00 0.00 0.00 36.38 32.62 1uyt s VAL 2163CO 0.47 0.20 0.64 -0.62 0.00 0.00 0.00 175.10 175.80 1uyt s ASP 2164N 0.27 6.30 0.60 3.32 3.68 -1.26 -4.91 116.67 124.66 1uyt s ASP 2164Ca 0.53 -0.47 0.29 0.00 2.13 0.00 0.00 52.55 55.03 1uyt s ASP 2164Cb -0.31 -2.31 1.48 0.00 -1.45 0.00 0.00 42.92 40.33 1uyt s ASP 2164CO 0.35 -0.81 1.90 0.45 0.13 0.00 0.00 175.17 177.19 1uyt h HIS 2165N 8.91 0.00 0.00 -5.34 3.86 -1.95 0.24 115.15 120.87 1uyt h HIS 2165Ca -0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.95 1uyt h HIS 2165Cb 1.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.57 1uyt h HIS 2165CO 0.73 0.00 -0.10 0.39 0.86 0.00 0.00 177.93 179.81 1uyt n GLU 2166N -3.65 0.08 -2.85 2.45 1.02 -1.26 -4.70 120.64 111.74 1uyt n GLU 2166Ca 0.07 0.06 -0.43 0.00 -0.02 0.00 0.00 57.16 56.84 1uyt n GLU 2166Cb 0.64 -1.59 -0.04 0.00 -0.02 0.00 0.00 31.44 30.43 1uyt n GLU 2166CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1uyt s ASP 2167N -3.46 6.27 0.11 1.62 -1.08 0.85 -4.92 116.67 116.06 1uyt s ASP 2167Ca 0.12 -0.59 -0.21 0.00 -0.52 0.00 0.00 52.55 51.35 1uyt s ASP 2167Cb 0.17 -2.43 -0.09 0.00 -1.46 0.00 0.00 42.92 39.11 1uyt s ASP 2167CO 0.58 -1.31 1.76 0.44 0.52 0.00 0.00 175.17 177.16 1uyt h ASP 2168N 9.41 0.10 -0.20 -0.34 3.32 -1.84 -1.27 116.42 125.60 1uyt h ASP 2168Ca -0.27 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1uyt h ASP 2168Cb 1.07 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1uyt h ASP 2168CO 1.12 0.08 0.10 -0.09 -1.72 0.00 0.00 179.24 178.73 1uyt h ARG 2169N 0.14 0.29 0.70 3.56 2.43 -1.92 -1.08 114.38 118.51 1uyt h ARG 2169Ca 0.05 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1uyt h ARG 2169Cb 0.00 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1uyt h ARG 2169CO -0.03 0.30 -0.46 0.37 -1.51 0.00 0.00 179.97 178.65 1uyt h GLN 2170N 0.20 -1.05 -0.72 0.20 4.15 -1.89 0.11 115.11 116.10 1uyt h GLN 2170Ca 0.07 0.07 0.16 0.00 0.77 0.00 0.00 58.65 59.72 1uyt h GLN 2170Cb 0.11 0.24 -0.12 0.00 0.21 0.00 0.00 27.48 27.92 1uyt h GLN 2170CO -0.01 -0.70 0.08 0.28 -1.93 0.00 0.00 178.83 176.55 1uyt h VAL 2171N -1.09 0.43 -0.44 2.39 2.07 -1.22 0.13 116.25 118.52 1uyt h VAL 2171Ca -0.09 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 1uyt h VAL 2171Cb 0.88 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1uyt h VAL 2171CO 0.08 0.03 0.09 0.00 0.02 0.00 0.00 177.57 177.79 1uyt h ALA 2172N 1.64 0.58 -0.76 1.67 0.00 -1.04 -1.86 119.26 119.50 1uyt h ALA 2172Ca 0.40 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1uyt h ALA 2172Cb 0.69 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1uyt h ALA 2172CO -0.58 0.28 0.33 1.15 0.00 0.00 0.00 179.25 180.43 1uyt h THR 2173N 0.58 1.25 -0.16 0.00 2.02 0.92 -1.51 112.91 116.02 1uyt h THR 2173Ca 0.14 -0.74 -0.06 0.00 0.77 0.00 0.00 66.41 66.51 1uyt h THR 2173Cb 0.35 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1uyt h THR 2173CO 0.00 0.31 -0.14 -0.25 0.37 0.00 0.00 175.52 175.81 1uyt h TRP 2174N 1.09 0.45 -0.61 3.16 7.01 -0.68 -2.82 115.95 123.54 1uyt h TRP 2174Ca 0.26 -0.13 0.02 0.00 2.11 0.00 0.00 58.89 61.14 1uyt h TRP 2174Cb 0.17 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 1uyt h TRP 2174CO 0.02 0.75 0.39 0.82 -2.79 0.00 0.00 178.44 177.63 1uyt h ILE 2175N 0.03 1.12 0.00 2.65 2.04 -1.19 -1.44 117.51 120.72 1uyt h ILE 2175Ca 0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1uyt h ILE 2175Cb 0.66 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1uyt h ILE 2175CO 0.04 0.14 0.00 -0.33 0.00 0.00 0.00 178.15 178.00 1uyt h GLU 2176N 0.79 0.00 -0.00 2.37 5.08 -1.28 -1.89 114.58 119.65 1uyt h GLU 2176Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1uyt h GLU 2176Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1uyt h GLU 2176CO -0.07 0.00 -0.64 0.39 -1.00 0.00 0.00 179.01 177.69 1uyt n GLU 2177N -2.81 0.28 -0.64 2.33 1.02 -0.59 -4.37 120.64 115.86 1uyt n GLU 2177Ca -0.00 -0.20 0.06 0.00 -0.02 0.00 0.00 57.16 56.99 1uyt n GLU 2177Cb 0.19 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.24 1uyt n GLU 2177CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1uyt n ASN 2178N -1.18 1.49 -0.15 1.62 3.02 -0.73 -4.87 115.26 114.46 1uyt n ASN 2178Ca 0.06 -3.03 -0.07 0.00 -0.03 0.00 0.00 54.58 51.51 1uyt n ASN 2178Cb 0.35 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 39.10 1uyt n ASN 2178CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1uyt h TYR 2179N 0.60 -0.95 -0.68 3.10 0.99 -1.69 0.56 116.97 118.91 1uyt h TYR 2179Ca -0.05 0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.70 1uyt h TYR 2179Cb 1.24 0.49 -0.03 0.00 1.00 0.00 0.00 36.73 39.43 1uyt h TYR 2179CO 0.35 -0.39 0.23 0.87 -0.00 0.00 0.00 178.16 179.22 1uyt h LYS 2180N -0.23 1.03 -0.42 4.88 1.79 -1.91 0.46 116.57 122.17 1uyt h LYS 2180Ca 0.19 -0.20 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 1uyt h LYS 2180Cb 0.55 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 1uyt h LYS 2180CO -0.60 0.86 0.04 1.15 -1.08 0.00 0.00 179.45 179.83 1uyt h THR 2181N 0.99 1.25 -0.53 -0.16 2.02 -1.54 -0.61 112.91 114.33 1uyt h THR 2181Ca 0.22 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.36 1uyt h THR 2181Cb 0.25 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1uyt h THR 2181CO -0.01 0.32 -0.05 -0.07 0.37 0.00 0.00 175.52 176.09 1uyt h LEU 2182N 0.55 0.92 0.24 2.58 3.38 0.49 -2.69 115.31 120.78 1uyt h LEU 2182Ca 0.12 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1uyt h LEU 2182Cb 0.42 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1uyt h LEU 2182CO 0.01 1.01 -0.27 -0.78 0.09 0.00 0.00 178.44 178.50 1uyt h ASP 2183N 0.86 -0.73 -0.87 -0.43 -0.00 0.36 -0.33 116.42 115.27 1uyt h ASP 2183Ca 0.15 0.07 0.15 0.00 -0.00 0.00 0.00 57.03 57.40 1uyt h ASP 2183Cb 0.57 0.26 -0.10 0.00 -0.00 0.00 0.00 39.33 40.06 1uyt h ASP 2183CO 0.03 -0.38 0.46 0.44 -0.00 0.00 0.00 179.24 179.79 1uyt h ASP 2184N -0.55 0.56 0.23 2.28 3.32 -1.02 -0.18 116.42 121.06 1uyt h ASP 2184Ca -0.00 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1uyt h ASP 2184Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1uyt h ASP 2184CO -0.08 0.23 -0.11 0.50 -1.72 0.00 0.00 179.24 178.06 1uyt h LYS 2185N 0.64 -0.30 0.21 3.56 3.64 -1.05 -2.17 116.57 121.11 1uyt h LYS 2185Ca 0.48 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.89 1uyt h LYS 2185Cb 0.69 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 1uyt h LYS 2185CO -0.37 -0.20 -0.48 -0.07 -2.27 0.00 0.00 179.45 176.07 1uyt h LEU 2186N -0.31 -1.39 -1.68 5.20 3.38 0.13 0.34 115.31 120.98 1uyt h LEU 2186Ca -0.03 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1uyt h LEU 2186Cb 0.24 0.50 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1uyt h LEU 2186CO 0.05 -0.55 0.00 2.29 0.09 0.00 0.00 178.44 180.32 1uyt n LYS 2187N -5.50 0.60 0.00 1.13 2.85 -0.20 -0.63 118.16 116.42 1uyt n LYS 2187Ca -0.09 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.18 1uyt n LYS 2187Cb 0.41 -1.23 -0.00 0.00 -0.65 0.00 0.00 35.03 33.56 1uyt n LYS 2187CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1uyt n GLY 2188N 0.54 0.06 1.22 2.58 0.00 0.12 -4.43 105.19 105.27 1uyt n GLY 2188Ca 0.00 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1uyt n GLY 2188CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uyt n LEU 2189N -0.62 3.55 -0.05 0.99 4.32 0.20 -4.12 117.00 121.27 1uyt n LEU 2189Ca 0.00 -1.78 0.01 0.00 -0.02 0.00 0.00 56.01 54.22 1uyt n LEU 2189Cb 0.03 -0.45 0.31 0.00 -1.62 0.00 0.00 43.42 41.68 1uyt n LEU 2189CO 0.02 0.74 1.04 0.11 -1.22 0.00 0.00 177.39 178.08 1uyt h LYS 2190N 3.42 0.63 -0.11 3.23 1.79 -1.78 0.96 116.57 124.72 1uyt h LYS 2190Ca 0.00 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1uyt h LYS 2190Cb 1.00 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1uyt h LYS 2190CO 0.09 0.54 0.00 -0.11 -1.08 0.00 0.00 179.45 178.89 1uyt n LEU 2191N -4.35 0.11 -1.11 2.94 7.94 -1.26 0.15 117.00 121.41 1uyt n LEU 2191Ca 0.03 -0.06 -0.01 0.00 -1.11 0.00 0.00 56.01 54.87 1uyt n LEU 2191Cb 0.16 -0.06 0.22 0.00 0.53 0.00 0.00 43.42 44.28 1uyt n LEU 2191CO 0.38 0.03 0.73 1.21 -1.11 0.00 0.00 177.39 178.62 1uyt n GLU 2192N -0.29 2.22 0.36 1.96 2.13 0.33 -4.49 120.64 122.86 1uyt n GLU 2192Ca 0.00 -3.05 -0.19 0.00 0.66 0.00 0.00 57.16 54.58 1uyt n GLU 2192Cb 0.03 -1.84 -0.10 0.00 0.27 0.00 0.00 31.44 29.80 1uyt n GLU 2192CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1uyt h SER 2193N 1.26 -1.28 0.00 4.31 0.87 0.12 -3.45 113.55 115.37 1uyt h SER 2193Ca 0.17 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1uyt h SER 2193Cb 1.65 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 64.01 1uyt h SER 2193CO 0.37 -0.70 0.00 0.33 -0.53 0.00 0.00 176.83 176.30 1uyt n PHE 2194N -5.59 0.00 -3.87 2.24 7.35 -1.26 -4.57 117.46 111.76 1uyt n PHE 2194Ca -0.13 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.35 1uyt n PHE 2194Cb 0.48 0.02 -0.03 0.00 0.35 0.00 0.00 39.48 40.30 1uyt n PHE 2194CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1uyt s ALA 2195N -1.95 3.84 0.00 3.13 0.00 -1.26 -5.20 121.76 120.33 1uyt s ALA 2195Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.49 1uyt s ALA 2195Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 23.12 21.72 1uyt s ALA 2195CO 0.00 0.12 0.00 0.00 0.00 0.00 0.00 175.76 175.88