#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 5.20 -0.69 4.25 1.10 -1.26 -4.66 121.20 125.14 1uyt s ILE 1483Ca 0.00 0.23 -0.01 0.00 -0.51 0.00 0.00 60.65 60.36 1uyt s ILE 1483Cb 0.00 -3.61 0.00 0.00 0.15 0.00 0.00 42.46 39.00 1uyt s ILE 1483CO 0.00 0.27 0.67 0.00 -2.11 0.00 0.00 174.94 173.76 1uyt n ALA 1484N 0.81 -2.50 -2.63 1.50 0.00 -1.26 -5.05 120.51 111.38 1uyt n ALA 1484Ca -0.08 0.09 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1uyt n ALA 1484Cb 0.52 -1.61 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 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 -2.97 3.68 0.17 0.00 -4.23 -1.26 -5.05 115.64 105.99 1uyt s THR 1485Ca 0.02 -1.18 -0.22 0.00 -1.18 0.00 0.00 61.69 59.13 1uyt s THR 1485Cb -0.01 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 71.17 1uyt s THR 1485CO 0.72 0.08 1.60 -0.65 -0.54 0.00 0.00 174.62 175.83 1uyt h PRO 1486N 3.40 -0.20 -5.64 3.99 0.11 -2.01 -3.44 132.00 128.21 1uyt h PRO 1486Ca -0.48 0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.02 1uyt h PRO 1486Cb 1.17 0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.21 1uyt h PRO 1486CO 0.56 -0.13 -0.56 0.71 -0.21 0.00 0.00 178.00 178.37 1uyt s TYR 1487N -6.01 2.41 0.02 0.65 1.51 -1.26 -5.09 117.35 109.58 1uyt s TYR 1487Ca -0.15 -0.70 -0.35 0.00 -1.01 0.00 0.00 57.07 54.86 1uyt s TYR 1487Cb 0.14 -1.79 -0.14 0.00 -0.11 0.00 0.00 41.96 40.07 1uyt s TYR 1487CO 0.69 0.34 1.68 -2.30 -1.11 0.00 0.00 175.55 174.85 1uyt n PRO 1488N -1.09 1.96 -1.62 -1.71 -0.02 -1.26 -4.83 135.00 126.43 1uyt n PRO 1488Ca -0.06 0.71 -0.29 0.00 -2.02 0.00 0.00 63.50 61.84 1uyt n PRO 1488Cb 0.66 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 1uyt n PRO 1488CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1uyt s VAL 1489N 2.31 3.05 0.26 -1.45 -7.23 -1.26 -4.84 120.40 111.24 1uyt s VAL 1489Ca 0.86 0.00 -0.02 0.00 -1.81 0.00 0.00 61.98 61.02 1uyt s VAL 1489Cb -0.75 -3.12 0.24 0.00 0.56 0.00 0.00 36.38 33.31 1uyt s VAL 1489CO 0.47 -0.12 1.71 0.50 -0.31 0.00 0.00 175.10 177.35 1uyt h LYS 1490N 16.94 0.38 0.00 4.82 1.63 -1.95 -0.46 116.57 137.93 1uyt h LYS 1490Ca -0.16 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.62 1uyt h LYS 1490Cb 1.17 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1uyt h LYS 1490CO 1.12 0.25 0.00 0.93 -3.45 0.00 0.00 179.45 178.30 1uyt h GLU 1491N 0.39 0.00 0.09 1.90 5.08 -1.89 -2.89 114.58 117.26 1uyt h GLU 1491Ca 0.46 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.49 1uyt h GLU 1491Cb 0.77 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1uyt h GLU 1491CO -0.47 0.00 -1.79 1.87 -1.00 0.00 0.00 179.01 177.62 1uyt n TRP 1492N -3.00 1.16 0.30 4.33 -0.00 -0.27 -1.71 117.44 118.25 1uyt n TRP 1492Ca 0.00 0.31 0.19 0.00 -0.00 0.00 0.00 57.50 58.01 1uyt n TRP 1492Cb 0.27 -1.14 1.03 0.00 -0.00 0.00 0.00 31.31 31.47 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 -0.27 0.00 -6.10 5.87 3.38 -1.32 -3.33 115.31 113.54 1uyt h LEU 1493Ca -0.41 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.49 1uyt h LEU 1493Cb 1.81 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 42.33 1uyt h LEU 1493CO -0.01 0.00 -0.46 -1.58 0.09 0.00 0.00 178.44 176.48 1uyt s GLN 1494N -4.34 0.60 0.57 1.13 2.00 -1.10 -5.03 119.66 113.49 1uyt s GLN 1494Ca -0.05 0.15 0.34 0.00 -2.00 0.00 0.00 55.36 53.80 1uyt s GLN 1494Cb 0.13 0.02 1.84 0.00 0.80 0.00 0.00 33.01 35.80 1uyt s GLN 1494CO 0.45 -1.09 2.03 -1.35 -0.50 0.00 0.00 175.29 174.82 1uyt h PRO 1495N 7.72 0.00 -0.26 1.67 0.11 -1.46 -2.32 132.00 137.47 1uyt h PRO 1495Ca -0.01 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1uyt h PRO 1495Cb 1.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1uyt h PRO 1495CO 0.17 0.00 0.04 0.87 -0.21 0.00 0.00 178.00 178.87 1uyt h LYS 1496N 0.00 0.37 -0.37 1.05 1.57 -1.94 -1.71 116.57 115.54 1uyt h LYS 1496Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1uyt h LYS 1496Cb 0.21 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1uyt h LYS 1496CO 0.00 0.36 0.18 -0.09 -0.57 0.00 0.00 179.45 179.33 1uyt h ARG 1497N 0.37 0.54 -0.53 3.15 2.43 -1.69 -1.53 114.38 117.11 1uyt h ARG 1497Ca 0.09 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1uyt h ARG 1497Cb 0.18 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1uyt h ARG 1497CO -0.00 0.48 0.28 -0.92 -1.51 0.00 0.00 179.97 178.30 1uyt h TYR 1498N 0.46 0.74 -0.75 2.20 -0.00 -1.59 -1.82 116.97 116.21 1uyt h TYR 1498Ca 0.13 -0.02 0.04 0.00 -0.00 0.00 0.00 58.73 58.87 1uyt h TYR 1498Cb 0.12 -0.23 -0.05 0.00 -0.00 0.00 0.00 36.73 36.57 1uyt h TYR 1498CO -0.01 0.55 0.46 -0.22 -0.00 0.00 0.00 178.16 178.94 1uyt h LYS 1499N 0.71 0.87 -0.36 1.82 3.64 -0.97 -0.10 116.57 122.17 1uyt h LYS 1499Ca 0.19 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1uyt h LYS 1499Cb 0.06 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1uyt h LYS 1499CO -0.03 0.57 -0.02 0.00 -2.27 0.00 0.00 179.45 177.71 1uyt h ALA 1500N 1.33 0.49 -0.62 5.00 0.00 -1.04 -2.82 119.26 121.60 1uyt h ALA 1500Ca 0.31 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1uyt h ALA 1500Cb 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1uyt h ALA 1500CO -0.13 0.28 0.41 0.45 0.00 0.00 0.00 179.25 180.26 1uyt h HIS 1501N 0.46 0.70 -0.01 0.00 3.86 -0.75 0.19 115.15 119.61 1uyt h HIS 1501Ca 0.10 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.30 1uyt h HIS 1501Cb 0.49 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.72 1uyt h HIS 1501CO 0.04 0.41 -0.11 -0.07 0.86 0.00 0.00 177.93 179.06 1uyt h LEU 1502N 0.73 0.02 -0.55 2.43 4.07 -0.78 -1.46 115.31 119.77 1uyt h LEU 1502Ca 0.25 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1uyt h LEU 1502Cb 0.09 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.82 1uyt h LEU 1502CO -0.07 0.13 -0.09 0.23 -1.08 0.00 0.00 178.44 177.56 1uyt n MET 1503N -4.40 1.14 -2.05 1.13 2.81 0.02 -4.93 117.12 110.84 1uyt n MET 1503Ca -0.02 -0.55 0.00 0.00 -1.81 0.00 0.00 57.70 55.31 1uyt n MET 1503Cb 0.19 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 1uyt n MET 1503CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1uyt n GLY 1504N 1.22 0.61 3.16 3.03 0.00 -0.55 -4.95 105.19 107.70 1uyt n GLY 1504Ca 0.17 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.29 0.17 0.49 2.61 -1.32 -1.09 -4.82 115.64 109.39 1uyt s THR 1505Ca 0.00 -1.55 -0.20 0.00 -1.21 0.00 0.00 61.69 58.73 1uyt s THR 1505Cb 0.00 -1.52 -0.08 0.00 -1.51 0.00 0.00 72.50 69.39 1uyt s THR 1505CO 0.00 -0.77 1.02 -0.89 -2.21 0.00 0.00 174.62 171.77 1uyt s THR 1506N -3.91 3.94 0.22 5.08 2.01 -1.26 -3.30 115.64 118.42 1uyt s THR 1506Ca 0.08 1.15 -0.30 0.00 0.31 0.00 0.00 61.69 62.94 1uyt s THR 1506Cb 0.06 -3.48 -0.09 0.00 0.01 0.00 0.00 72.50 69.01 1uyt s THR 1506CO -0.09 -0.32 1.17 -0.47 -0.69 0.00 0.00 174.62 174.23 1uyt s TYR 1507N -2.11 3.45 0.16 4.92 6.04 -1.26 -4.92 117.35 123.63 1uyt s TYR 1507Ca 0.65 1.51 -0.27 0.00 0.04 0.00 0.00 57.07 59.01 1uyt s TYR 1507Cb -0.15 -3.40 0.01 0.00 -1.04 0.00 0.00 41.96 37.38 1uyt s TYR 1507CO 0.22 -1.03 1.57 -0.39 -1.54 0.00 0.00 175.55 174.37 1uyt h VAL 1508N 3.50 0.09 0.00 3.14 -1.51 -1.95 0.21 116.25 119.72 1uyt h VAL 1508Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1uyt h VAL 1508Cb 1.21 0.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.46 1uyt h VAL 1508CO 0.71 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.83 1uyt n TYR 1509N -5.40 0.00 1.06 5.19 4.02 -1.26 -0.89 117.16 119.87 1uyt n TYR 1509Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.01 1uyt n TYR 1509Cb 0.35 -0.48 0.19 0.00 -0.02 0.00 0.00 39.34 39.38 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 -1.48 0.87 -0.17 7.72 10.43 0.74 -4.29 116.55 130.36 1uyt n ASP 1510Ca 0.00 -0.67 -0.09 0.00 2.57 0.00 0.00 54.79 56.61 1uyt n ASP 1510Cb 0.01 0.38 0.05 0.00 1.84 0.00 0.00 41.12 43.41 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 0.53 1.08 -0.94 1.24 -1.00 -0.96 -2.91 116.94 113.98 1uyt h PHE 1511Ca 0.00 -0.20 0.14 0.00 2.81 0.00 0.00 57.97 60.72 1uyt h PHE 1511Cb 0.53 -0.28 -0.09 0.00 3.61 0.00 0.00 35.95 39.72 1uyt h PHE 1511CO 0.00 0.99 0.56 -1.35 -1.61 0.00 0.00 178.31 176.90 1uyt h PRO 1512N 0.88 0.80 -0.23 1.51 0.11 -1.76 0.17 132.00 133.48 1uyt h PRO 1512Ca 0.15 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 1uyt h PRO 1512Cb 0.61 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1uyt h PRO 1512CO 0.04 0.53 0.03 1.49 -0.21 0.00 0.00 178.00 179.88 1uyt h GLU 1513N 0.82 0.32 -0.05 1.05 4.57 -1.78 -0.14 114.58 119.37 1uyt h GLU 1513Ca 0.50 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.52 1uyt h GLU 1513Cb 0.61 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1uyt h GLU 1513CO -0.32 0.33 -0.48 -0.07 -1.18 0.00 0.00 179.01 177.29 1uyt h LEU 1514N 0.32 0.14 -0.40 1.64 3.38 -0.64 -1.16 115.31 118.58 1uyt h LEU 1514Ca 0.08 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.81 1uyt h LEU 1514Cb 0.17 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1uyt h LEU 1514CO -0.00 0.60 -0.80 -0.26 0.09 0.00 0.00 178.44 178.07 1uyt h PHE 1515N 0.10 0.15 -0.56 1.13 -1.00 -0.47 -0.95 116.94 115.34 1uyt h PHE 1515Ca 0.00 -0.08 -0.07 0.00 2.81 0.00 0.00 57.97 60.63 1uyt h PHE 1515Cb 0.89 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.41 1uyt h PHE 1515CO 0.01 0.86 0.06 -0.09 -1.61 0.00 0.00 178.31 177.54 1uyt h ARG 1516N 0.06 0.95 -0.25 1.51 2.43 -0.68 -0.05 114.38 118.35 1uyt h ARG 1516Ca -0.02 -0.27 -0.07 0.00 -0.81 0.00 0.00 59.98 58.81 1uyt h ARG 1516Cb 1.40 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1uyt h ARG 1516CO 0.11 0.92 -0.11 1.96 -1.51 0.00 0.00 179.97 181.35 1uyt h GLN 1517N 0.84 0.51 -0.82 0.20 4.20 -1.07 -0.94 115.11 118.03 1uyt h GLN 1517Ca 0.17 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1uyt h GLN 1517Cb 0.46 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 1uyt h GLN 1517CO 0.02 0.76 0.52 0.00 -0.67 0.00 0.00 178.83 179.46 1uyt h ALA 1518N 0.73 1.38 -0.42 3.87 0.00 -1.05 -0.68 119.26 123.09 1uyt h ALA 1518Ca 0.06 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1uyt h ALA 1518Cb 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1uyt h ALA 1518CO 0.03 0.56 -0.21 0.77 0.00 0.00 0.00 179.25 180.40 1uyt h SER 1519N 1.11 0.91 -0.45 0.00 0.02 -0.83 -2.21 113.55 112.11 1uyt h SER 1519Ca 0.30 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1uyt h SER 1519Cb -0.09 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 1uyt h SER 1519CO -0.06 1.12 0.26 -1.28 -1.14 0.00 0.00 176.83 175.73 1uyt h SER 1520N 0.70 0.42 -0.76 3.07 0.87 -0.53 -2.08 113.55 115.24 1uyt h SER 1520Ca 0.09 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1uyt h SER 1520Cb 0.78 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 1uyt h SER 1520CO 0.06 0.30 0.51 0.28 -0.53 0.00 0.00 176.83 177.45 1uyt h SER 1521N 0.52 0.86 -0.75 6.23 0.02 -0.95 -2.15 113.55 117.34 1uyt h SER 1521Ca 0.18 -0.02 0.09 0.00 -0.84 0.00 0.00 61.79 61.20 1uyt h SER 1521Cb 0.02 -0.21 -0.07 0.00 0.14 0.00 0.00 62.40 62.28 1uyt h SER 1521CO -0.09 0.62 0.40 1.56 -1.14 0.00 0.00 176.83 178.18 1uyt h GLN 1522N 1.02 0.66 -0.11 3.45 4.20 -0.75 -1.62 115.11 121.96 1uyt h GLN 1522Ca 0.29 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 1uyt h GLN 1522Cb -0.09 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.54 1uyt h GLN 1522CO -0.07 0.44 0.02 -1.49 -0.67 0.00 0.00 178.83 177.06 1uyt h TRP 1523N 0.68 0.19 -0.21 2.96 4.06 -1.24 -1.89 115.95 120.49 1uyt h TRP 1523Ca 0.36 -0.03 0.06 0.00 2.06 0.00 0.00 58.89 61.35 1uyt h TRP 1523Cb 0.35 -0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.45 1uyt h TRP 1523CO -0.09 0.37 0.16 0.87 -3.56 0.00 0.00 178.44 176.20 1uyt h LYS 1524N -0.05 0.00 0.00 0.49 1.79 -1.08 0.46 116.57 118.18 1uyt h LYS 1524Ca 0.03 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.30 1uyt h LYS 1524Cb 0.29 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 1uyt h LYS 1524CO 0.00 0.00 -1.03 -0.91 -1.08 0.00 0.00 179.45 176.44 1uyt h ASN 1525N 0.00 0.00 0.30 0.86 -0.26 -1.10 -2.98 115.58 112.40 1uyt h ASN 1525Ca 0.10 0.00 -0.33 0.00 -0.56 0.00 0.00 56.30 55.51 1uyt h ASN 1525Cb 0.43 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.70 1uyt h ASN 1525CO -0.00 0.93 -1.62 0.15 -1.06 0.00 0.00 177.43 175.83 1uyt h PHE 1526N 0.00 0.69 -1.23 1.19 3.04 -0.30 -3.44 116.94 116.89 1uyt h PHE 1526Ca -0.04 -0.50 -0.10 0.00 3.98 0.00 0.00 57.97 61.31 1uyt h PHE 1526Cb 1.75 -0.03 -0.22 0.00 2.56 0.00 0.00 35.95 40.00 1uyt h PHE 1526CO 0.00 1.55 -0.48 0.45 -2.02 0.00 0.00 178.31 177.82 1uyt s SER 1527N -7.26 -0.93 0.24 0.41 0.15 0.15 -5.05 113.70 101.42 1uyt s SER 1527Ca -0.12 -0.60 -0.06 0.00 0.70 0.00 0.00 55.95 55.87 1uyt s SER 1527Cb 0.06 1.67 0.45 0.00 -1.71 0.00 0.00 66.02 66.49 1uyt s SER 1527CO 0.87 -0.24 1.65 0.00 1.20 0.00 0.00 173.24 176.73 1uyt h ALA 1528N 7.41 0.85 0.00 5.45 0.00 -1.68 -1.99 119.26 129.29 1uyt h ALA 1528Ca 0.02 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1uyt h ALA 1528Cb 1.16 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1uyt h ALA 1528CO 0.15 -0.40 0.00 -0.25 0.00 0.00 0.00 179.25 178.75 1uyt n ASP 1529N -5.27 5.08 -4.79 0.00 8.00 -1.26 -4.85 116.55 113.45 1uyt n ASP 1529Ca 0.14 -2.35 -0.36 0.00 0.71 0.00 0.00 54.79 52.93 1uyt n ASP 1529Cb 0.47 -1.06 -0.07 0.00 -0.02 0.00 0.00 41.12 40.44 1uyt n ASP 1529CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1uyt s VAL 1530N 0.04 5.44 -0.52 2.53 0.11 -0.75 -5.06 120.40 122.19 1uyt s VAL 1530Ca 0.00 0.19 -0.15 0.00 -2.93 0.00 0.00 61.98 59.09 1uyt s VAL 1530Cb 0.00 -3.43 0.12 0.00 -1.53 0.00 0.00 36.38 31.54 1uyt s VAL 1530CO 0.00 0.52 0.47 -0.54 -3.33 0.00 0.00 175.10 172.21 1uyt s LYS 1531N -0.23 2.92 0.12 1.54 3.01 -1.26 -5.00 119.74 120.84 1uyt s LYS 1531Ca 0.11 -1.68 -0.20 0.00 -1.01 0.00 0.00 55.97 53.20 1uyt s LYS 1531Cb -0.11 -4.23 -0.07 0.00 -1.01 0.00 0.00 37.83 32.41 1uyt s LYS 1531CO 0.01 -1.28 0.62 -0.51 0.51 0.00 0.00 175.35 174.70 1uyt s LEU 1532N 1.57 4.49 0.00 3.17 1.43 -1.26 -5.06 118.68 123.02 1uyt s LEU 1532Ca 0.03 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.46 1uyt s LEU 1532Cb -0.29 -3.11 0.00 0.00 0.03 0.00 0.00 46.19 42.82 1uyt s LEU 1532CO 0.03 0.21 0.00 0.41 0.23 0.00 0.00 176.35 177.23 1uyt n THR 1533N 1.43 0.00 0.00 5.49 -1.04 -1.26 -5.04 114.28 113.86 1uyt n THR 1533Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1uyt n THR 1533Cb 0.51 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.02 1uyt n THR 1533CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1uyt n ASP 1534N 0.00 0.00 -0.13 8.00 -0.08 -1.26 -4.80 116.55 118.28 1uyt n ASP 1534Ca 0.00 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.36 1uyt n ASP 1534Cb 0.00 0.00 0.41 0.00 2.34 0.00 0.00 41.12 43.87 1uyt n ASP 1534CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1uyt n ASP 1535N -0.09 0.38 0.20 1.67 5.75 -1.26 -2.93 116.55 120.27 1uyt n ASP 1535Ca 0.00 -1.59 0.13 0.00 -0.01 0.00 0.00 54.79 53.32 1uyt n ASP 1535Cb 0.00 -0.03 0.29 0.00 -1.03 0.00 0.00 41.12 40.35 1uyt n ASP 1535CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 1uyt h PHE 1536N 0.49 0.00 -3.38 2.11 -5.15 -1.92 -3.43 116.94 105.66 1uyt h PHE 1536Ca 0.00 0.00 -0.37 0.00 -0.20 0.00 0.00 57.97 57.40 1uyt h PHE 1536Cb 0.11 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 35.91 1uyt h PHE 1536CO 0.03 0.00 -0.75 0.12 -2.00 0.00 0.00 178.31 175.71 1uyt s PHE 1537N -3.25 0.29 0.05 6.09 2.19 -1.15 -0.68 117.98 121.53 1uyt s PHE 1537Ca 0.07 0.06 0.05 0.00 0.33 0.00 0.00 56.93 57.44 1uyt s PHE 1537Cb 0.07 -0.51 -0.03 0.00 -1.31 0.00 0.00 43.02 41.24 1uyt s PHE 1537CO 0.63 -0.19 -0.15 0.42 1.83 0.00 0.00 175.22 177.75 1uyt s ILE 1538N 1.63 1.20 -0.11 3.12 1.01 -0.55 -4.97 121.20 122.53 1uyt s ILE 1538Ca -0.01 -1.15 -0.03 0.00 0.00 0.00 0.00 60.65 59.45 1uyt s ILE 1538Cb -0.13 -1.11 0.05 0.00 0.01 0.00 0.00 42.46 41.29 1uyt s ILE 1538CO -0.03 -0.06 0.14 -0.55 0.00 0.00 0.00 174.94 174.44 1uyt s SER 1539N -1.39 1.22 -0.11 3.58 0.15 -1.26 -2.05 113.70 113.83 1uyt s SER 1539Ca 0.01 0.02 0.02 0.00 0.70 0.00 0.00 55.95 56.71 1uyt s SER 1539Cb -0.09 0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.33 1uyt s SER 1539CO 0.02 -0.28 -0.20 0.20 1.20 0.00 0.00 173.24 174.18 1uyt s ASN 1540N 2.25 3.44 0.64 5.45 0.01 -0.88 -4.95 114.94 120.90 1uyt s ASN 1540Ca 0.04 -0.47 -0.16 0.00 -0.71 0.00 0.00 52.86 51.56 1uyt s ASN 1540Cb -0.13 -1.47 -0.01 0.00 0.41 0.00 0.00 41.25 40.05 1uyt s ASN 1540CO -0.07 0.17 1.13 -0.70 -1.51 0.00 0.00 177.10 176.12 1uyt s GLU 1541N 0.32 2.84 -0.06 -0.60 2.12 -1.20 -0.84 118.70 121.28 1uyt s GLU 1541Ca -0.15 1.51 0.06 0.00 0.36 0.00 0.00 54.97 56.74 1uyt s GLU 1541Cb -0.17 -1.95 -0.01 0.00 0.26 0.00 0.00 34.13 32.26 1uyt s GLU 1541CO 0.08 -1.24 -0.24 -0.51 -0.54 0.00 0.00 175.26 172.81 1uyt s LEU 1542N -4.63 2.06 0.10 2.70 1.43 -0.42 -1.63 118.68 118.29 1uyt s LEU 1542Ca 0.70 -0.50 -0.09 0.00 -1.03 0.00 0.00 54.13 53.20 1uyt s LEU 1542Cb -0.23 -1.34 -0.00 0.00 0.03 0.00 0.00 46.19 44.65 1uyt s LEU 1542CO 0.38 0.23 0.21 0.27 0.23 0.00 0.00 176.35 177.68 1uyt s ILE 1543N -0.13 0.13 0.24 -0.59 -4.36 -1.01 -4.34 121.20 111.15 1uyt s ILE 1543Ca -0.04 -1.18 -0.18 0.00 -0.26 0.00 0.00 60.65 58.98 1uyt s ILE 1543Cb -0.14 -1.40 -0.08 0.00 1.25 0.00 0.00 42.46 42.08 1uyt s ILE 1543CO 0.04 -0.58 0.72 -1.61 0.24 0.00 0.00 174.94 173.74 1uyt s GLU 1544N -3.87 4.17 0.00 0.37 2.02 -1.26 -1.25 118.70 118.88 1uyt s GLU 1544Ca 0.07 0.79 0.00 0.00 0.02 0.00 0.00 54.97 55.85 1uyt s GLU 1544Cb 0.05 -2.77 0.00 0.00 0.10 0.00 0.00 34.13 31.51 1uyt s GLU 1544CO -0.09 0.34 0.00 -0.40 0.02 0.00 0.00 175.26 175.12 1uyt n ASP 1545N 0.44 0.00 0.16 -0.19 3.85 -0.59 -4.84 116.55 115.39 1uyt n ASP 1545Ca -0.01 0.00 0.01 0.00 -0.71 0.00 0.00 54.79 54.08 1uyt n ASP 1545Cb 0.52 0.00 0.28 0.00 -1.35 0.00 0.00 41.12 40.56 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 0.01 -0.08 0.11 3.07 -1.98 -2.93 114.58 112.78 1uyt h GLU 1546Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1uyt h GLU 1546Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1uyt h GLU 1546CO 0.00 0.48 0.00 0.09 -1.40 0.00 0.00 179.01 178.18 1uyt n ASN 1547N -3.98 2.31 0.00 1.42 3.02 -1.26 -4.93 115.26 111.84 1uyt n ASN 1547Ca -0.02 -1.77 0.00 0.00 -0.03 0.00 0.00 54.58 52.76 1uyt n ASN 1547Cb 0.49 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1uyt n ASN 1547CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uyt n GLY 1548N 1.27 1.19 3.72 7.41 0.00 -1.11 -5.03 105.19 112.65 1uyt n GLY 1548Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.46 4.44 0.21 1.61 0.41 -1.26 -4.53 118.70 119.12 1uyt s GLU 1549Ca 0.00 1.86 -0.30 0.00 -0.41 0.00 0.00 54.97 56.12 1uyt s GLU 1549Cb 0.00 -3.29 -0.09 0.00 -1.78 0.00 0.00 34.13 28.98 1uyt s GLU 1549CO 0.00 -0.21 1.21 -0.51 -0.49 0.00 0.00 175.26 175.26 1uyt s LEU 1550N 0.53 4.46 -0.06 1.80 1.43 -1.26 -1.54 118.68 124.05 1uyt s LEU 1550Ca 0.57 2.30 -0.14 0.00 -1.03 0.00 0.00 54.13 55.84 1uyt s LEU 1550Cb -0.32 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.32 1uyt s LEU 1550CO 0.32 -0.38 0.32 0.28 0.23 0.00 0.00 176.35 177.13 1uyt s THR 1551N -0.27 0.04 0.39 5.49 -1.32 -0.38 -4.94 115.64 114.65 1uyt s THR 1551Ca 0.52 -0.30 -0.25 0.00 -1.21 0.00 0.00 61.69 60.45 1uyt s THR 1551Cb -0.34 -0.57 -0.09 0.00 -1.51 0.00 0.00 72.50 70.00 1uyt s THR 1551CO 0.39 -0.16 1.16 -1.61 -2.21 0.00 0.00 174.62 172.18 1uyt s GLU 1552N -0.77 4.10 0.32 7.08 2.02 -1.26 -2.39 118.70 127.81 1uyt s GLU 1552Ca -0.09 1.82 -0.06 0.00 0.02 0.00 0.00 54.97 56.67 1uyt s GLU 1552Cb -0.04 -2.70 0.01 0.00 0.10 0.00 0.00 34.13 31.49 1uyt s GLU 1552CO 0.03 -0.27 0.50 0.14 0.02 0.00 0.00 175.26 175.67 1uyt s VAL 1553N -1.41 0.00 -0.31 2.63 -7.23 -0.65 -4.97 120.40 108.46 1uyt s VAL 1553Ca 0.56 -1.51 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 1uyt s VAL 1553Cb -0.30 -2.57 0.13 0.00 0.56 0.00 0.00 36.38 34.19 1uyt s VAL 1553CO 0.38 0.00 0.23 -0.70 -0.31 0.00 0.00 175.10 174.70 1uyt s GLU 1554N -3.21 0.36 0.26 4.82 2.12 -1.26 -3.23 118.70 118.57 1uyt s GLU 1554Ca 0.27 -0.64 0.00 0.00 0.36 0.00 0.00 54.97 54.96 1uyt s GLU 1554Cb -0.01 -0.99 -0.00 0.00 0.26 0.00 0.00 34.13 33.39 1uyt s GLU 1554CO 0.17 -1.09 0.01 2.89 -0.54 0.00 0.00 175.26 176.70 1uyt n ARG 1555N 4.87 1.29 -2.04 4.30 0.00 -1.26 -5.08 116.66 118.74 1uyt n ARG 1555Ca 0.01 -1.95 -0.43 0.00 -0.00 0.00 0.00 57.85 55.48 1uyt n ARG 1555Cb 0.42 0.57 -0.03 0.00 -0.00 0.00 0.00 32.46 33.43 1uyt n ARG 1555CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1uyt s GLU 1556N -2.96 3.40 -0.89 2.89 2.02 -1.26 -4.86 118.70 117.05 1uyt s GLU 1556Ca 0.01 1.40 -0.24 0.00 0.02 0.00 0.00 54.97 56.16 1uyt s GLU 1556Cb 0.00 -4.17 -0.22 0.00 0.10 0.00 0.00 34.13 29.85 1uyt s GLU 1556CO 0.01 -1.77 2.49 -2.30 0.02 0.00 0.00 175.26 173.70 1uyt n PRO 1557N 8.33 0.23 0.00 0.39 -0.02 -1.26 -1.14 135.00 141.54 1uyt n PRO 1557Ca 0.22 -0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1uyt n PRO 1557Cb 0.47 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 6.19 0.73 1.51 -1.23 0.00 -1.26 -5.02 105.19 106.12 1uyt n GLY 1558Ca 0.60 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.70 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 0.00 3.16 -1.90 4.61 0.00 -0.29 -4.98 120.51 121.11 1uyt n ALA 1559Ca 0.00 -1.70 -0.42 0.00 0.00 0.00 0.00 53.44 51.32 1uyt n ALA 1559Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 1uyt n ALA 1559CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1uyt s ASN 1560N -1.00 6.57 0.00 0.00 4.22 -1.26 -4.88 114.94 118.59 1uyt s ASN 1560Ca 0.49 2.56 0.29 0.00 -2.14 0.00 0.00 52.86 54.06 1uyt s ASN 1560Cb 0.33 -2.57 1.19 0.00 1.28 0.00 0.00 41.25 41.48 1uyt s ASN 1560CO 0.21 -0.89 1.84 0.00 -2.04 0.00 0.00 177.10 176.23 1uyt n ALA 1561N 5.13 2.76 -2.31 3.54 0.00 -1.26 -4.86 120.51 123.51 1uyt n ALA 1561Ca 0.16 -0.25 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 1uyt n ALA 1561Cb 0.40 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.40 1uyt n ALA 1561CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1uyt s ILE 1562N -2.59 1.11 -0.65 0.00 -4.36 -1.26 -5.05 121.20 108.40 1uyt s ILE 1562Ca 0.26 -2.05 0.03 0.00 -0.26 0.00 0.00 60.65 58.62 1uyt s ILE 1562Cb 0.20 -2.21 0.18 0.00 1.25 0.00 0.00 42.46 41.88 1uyt s ILE 1562CO 0.50 -0.44 0.89 0.61 0.24 0.00 0.00 174.94 176.74 1uyt n GLY 1563N -0.36 2.02 2.80 6.27 0.00 -1.26 -4.77 105.19 109.90 1uyt n GLY 1563Ca -0.06 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.26 -0.02 0.13 1.61 -2.45 -1.26 -1.17 119.30 114.88 1uyt s MET 1564Ca 0.13 0.12 0.06 0.00 -1.25 0.00 0.00 55.69 54.75 1uyt s MET 1564Cb 0.10 -0.17 -0.04 0.00 1.25 0.00 0.00 34.83 35.97 1uyt s MET 1564CO 0.03 -0.11 -0.14 0.14 1.05 0.00 0.00 175.02 176.00 1uyt s VAL 1565N 0.72 1.34 0.01 10.11 -7.23 0.09 -4.97 120.40 120.48 1uyt s VAL 1565Ca -0.06 -1.78 -0.04 0.00 -1.81 0.00 0.00 61.98 58.28 1uyt s VAL 1565Cb -0.09 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 1uyt s VAL 1565CO -0.02 -0.46 0.07 0.00 -0.31 0.00 0.00 175.10 174.38 1uyt s ALA 1566N -2.31 -0.13 0.04 1.32 0.00 -1.26 -0.04 121.76 119.38 1uyt s ALA 1566Ca 0.11 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.76 1uyt s ALA 1566Cb -0.04 0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1uyt s ALA 1566CO 0.03 -0.20 -0.13 -0.06 0.00 0.00 0.00 175.76 175.40 1uyt s PHE 1567N -1.56 1.13 -0.32 0.00 0.40 0.69 -1.30 117.98 117.03 1uyt s PHE 1567Ca -0.14 -0.37 -0.06 0.00 -0.60 0.00 0.00 56.93 55.77 1uyt s PHE 1567Cb -0.08 -0.67 0.03 0.00 0.51 0.00 0.00 43.02 42.82 1uyt s PHE 1567CO -0.00 0.02 0.08 0.21 0.70 0.00 0.00 175.22 176.24 1uyt s LYS 1568N -1.19 2.68 -0.11 0.44 2.20 -0.02 -0.83 119.74 122.91 1uyt s LYS 1568Ca 0.00 -1.13 -0.07 0.00 -0.36 0.00 0.00 55.97 54.41 1uyt s LYS 1568Cb -0.08 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.81 1uyt s LYS 1568CO 0.01 -0.61 0.15 0.42 -0.36 0.00 0.00 175.35 174.96 1uyt s ILE 1569N 1.40 5.49 -0.20 5.43 -1.09 -0.36 -2.07 121.20 129.80 1uyt s ILE 1569Ca -0.01 0.21 -0.01 0.00 -2.23 0.00 0.00 60.65 58.61 1uyt s ILE 1569Cb -0.19 -3.42 0.05 0.00 -1.58 0.00 0.00 42.46 37.32 1uyt s ILE 1569CO 0.02 0.60 -0.02 -0.89 -1.23 0.00 0.00 174.94 173.42 1uyt s THR 1570N -1.05 1.00 0.08 2.92 2.01 -0.87 -2.13 115.64 117.59 1uyt s THR 1570Ca 0.16 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.45 1uyt s THR 1570Cb -0.12 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 1uyt s THR 1570CO 0.05 -0.08 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.02 1uyt s VAL 1571N 1.65 1.57 -0.23 3.82 1.01 -0.45 -1.48 120.40 126.29 1uyt s VAL 1571Ca -0.02 -1.36 -0.11 0.00 0.00 0.00 0.00 61.98 60.49 1uyt s VAL 1571Cb -0.17 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1uyt s VAL 1571CO -0.07 0.01 0.19 -0.54 0.00 0.00 0.00 175.10 174.68 1uyt s LYS 1572N -1.60 4.10 0.27 2.72 1.02 0.14 0.33 119.74 126.72 1uyt s LYS 1572Ca 0.05 -0.21 0.05 0.00 0.02 0.00 0.00 55.97 55.88 1uyt s LYS 1572Cb -0.09 -3.53 -0.06 0.00 -0.52 0.00 0.00 37.83 33.63 1uyt s LYS 1572CO 0.03 0.07 -0.01 0.95 -0.92 0.00 0.00 175.35 175.48 1uyt s THR 1573N 1.01 1.28 0.30 2.17 -4.23 -0.67 -4.92 115.64 110.59 1uyt s THR 1573Ca 0.09 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 58.60 1uyt s THR 1573Cb -0.13 -2.48 0.30 0.00 1.34 0.00 0.00 72.50 71.52 1uyt s THR 1573CO 0.04 -0.24 1.79 -0.65 -0.54 0.00 0.00 174.62 175.02 1uyt h PRO 1574N 2.32 0.79 0.00 3.99 0.11 -1.96 0.11 132.00 137.36 1uyt h PRO 1574Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1uyt h PRO 1574Cb 1.23 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1uyt h PRO 1574CO 0.67 0.52 -0.14 1.05 -0.21 0.00 0.00 178.00 179.89 1uyt h GLU 1575N 0.81 0.00 -1.93 1.05 9.09 -1.92 -3.37 114.58 118.31 1uyt h GLU 1575Ca 0.56 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 59.42 1uyt h GLU 1575Cb 0.81 0.00 -0.37 0.00 -1.65 0.00 0.00 28.75 27.53 1uyt h GLU 1575CO -0.35 0.00 -1.06 0.66 0.05 0.00 0.00 179.01 178.31 1uyt n TYR 1576N -2.50 -0.61 -0.28 2.06 4.02 0.02 -4.80 117.16 115.08 1uyt n TYR 1576Ca 0.05 -3.43 0.20 0.00 -0.01 0.00 0.00 57.90 54.71 1uyt n TYR 1576Cb 0.47 -0.17 0.50 0.00 -0.02 0.00 0.00 39.34 40.11 1uyt n TYR 1576CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1uyt h PRO 1577N 4.19 0.42 -0.03 -0.72 0.11 -1.07 0.46 132.00 135.36 1uyt h PRO 1577Ca 0.08 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1uyt h PRO 1577Cb 0.89 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1uyt h PRO 1577CO 0.44 0.28 0.00 0.54 -0.21 0.00 0.00 178.00 179.05 1uyt n ARG 1578N -4.55 1.32 0.00 1.05 1.74 -1.26 -4.57 116.66 110.39 1uyt n ARG 1578Ca 0.21 -0.47 0.00 0.00 -0.77 0.00 0.00 57.85 56.82 1uyt n ARG 1578Cb 0.74 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 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 1.05 2.39 3.08 -0.13 0.00 0.15 -4.89 105.19 106.85 1uyt n GLY 1579Ca 0.20 -1.73 -0.08 0.00 0.00 0.00 0.00 46.02 44.41 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 -4.06 0.59 0.25 1.61 1.70 0.15 -4.93 118.95 114.26 1uyt s ARG 1580Ca 0.00 -1.13 0.10 0.00 -0.47 0.00 0.00 55.73 54.24 1uyt s ARG 1580Cb 0.00 0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 34.45 1uyt s ARG 1580CO 0.00 -0.08 -0.18 -0.65 -1.08 0.00 0.00 175.30 173.31 1uyt s GLN 1581N -3.46 1.55 -0.02 3.89 -0.21 -1.26 -1.34 119.66 118.81 1uyt s GLN 1581Ca 0.04 -1.70 -0.29 0.00 0.02 0.00 0.00 55.36 53.42 1uyt s GLN 1581Cb 0.04 -1.53 0.10 0.00 1.00 0.00 0.00 33.01 32.63 1uyt s GLN 1581CO -0.08 0.28 0.95 -0.59 -2.12 0.00 0.00 175.29 173.73 1uyt s PHE 1582N -2.66 -0.29 0.09 0.91 -0.12 -0.91 -4.18 117.98 110.83 1uyt s PHE 1582Ca 0.27 0.15 0.07 0.00 -0.05 0.00 0.00 56.93 57.37 1uyt s PHE 1582Cb -0.04 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 1uyt s PHE 1582CO 0.12 -0.51 -0.12 0.54 -0.05 0.00 0.00 175.22 175.20 1uyt s VAL 1583N -3.01 3.27 -0.12 -2.49 0.11 -0.53 -1.22 120.40 116.40 1uyt s VAL 1583Ca 0.06 -1.26 0.02 0.00 -2.93 0.00 0.00 61.98 57.88 1uyt s VAL 1583Cb -0.01 -2.50 0.01 0.00 -1.53 0.00 0.00 36.38 32.35 1uyt s VAL 1583CO -0.07 0.15 -0.19 -0.69 -3.33 0.00 0.00 175.10 170.97 1uyt s VAL 1584N -1.16 1.76 -0.01 2.04 1.01 -0.01 -0.29 120.40 123.74 1uyt s VAL 1584Ca 0.20 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.45 1uyt s VAL 1584Cb -0.11 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1uyt s VAL 1584CO 0.12 0.49 -0.23 -0.69 0.00 0.00 0.00 175.10 174.79 1uyt s VAL 1585N 0.87 2.33 -0.03 2.92 1.01 0.30 -0.22 120.40 127.58 1uyt s VAL 1585Ca -0.08 -1.09 -0.19 0.00 0.00 0.00 0.00 61.98 60.63 1uyt s VAL 1585Cb -0.15 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.40 1uyt s VAL 1585CO -0.01 0.52 0.41 0.00 0.00 0.00 0.00 175.10 176.03 1uyt s ALA 1586N -0.70 -1.06 0.54 5.51 0.00 0.95 -0.30 121.76 126.71 1uyt s ALA 1586Ca 0.11 0.65 -0.15 0.00 0.00 0.00 0.00 51.96 52.56 1uyt s ALA 1586Cb -0.10 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.95 1uyt s ALA 1586CO 0.00 -0.28 1.00 -0.80 0.00 0.00 0.00 175.76 175.68 1uyt s ASN 1587N -1.17 6.46 -0.46 0.00 0.01 -1.18 -0.73 114.94 117.87 1uyt s ASN 1587Ca -0.12 1.57 -0.09 0.00 -0.71 0.00 0.00 52.86 53.51 1uyt s ASN 1587Cb -0.04 -2.50 0.11 0.00 0.41 0.00 0.00 41.25 39.23 1uyt s ASN 1587CO 0.05 -0.70 0.32 -0.62 -1.51 0.00 0.00 177.10 174.64 1uyt s ASP 1588N -3.25 5.68 0.65 -1.22 -1.08 -0.31 -4.79 116.67 112.34 1uyt s ASP 1588Ca 0.59 -1.81 0.37 0.00 -0.52 0.00 0.00 52.55 51.18 1uyt s ASP 1588Cb -0.11 -2.00 2.06 0.00 -1.46 0.00 0.00 42.92 41.42 1uyt s ASP 1588CO 0.36 -0.65 2.21 -0.29 0.52 0.00 0.00 175.17 177.32 1uyt h ILE 1589N 6.12 0.13 0.00 4.11 6.09 -1.88 -0.86 117.51 131.23 1uyt h ILE 1589Ca -0.21 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.28 1uyt h ILE 1589Cb 1.07 0.90 0.00 0.00 0.47 0.00 0.00 36.82 39.26 1uyt h ILE 1589CO 0.83 0.00 -0.41 0.71 -3.07 0.00 0.00 178.15 176.21 1uyt h THR 1590N 0.00 0.00 -2.92 2.19 1.35 -1.91 -3.07 112.91 108.55 1uyt h THR 1590Ca 0.01 -0.83 -0.66 0.00 -0.55 0.00 0.00 66.41 64.39 1uyt h THR 1590Cb 0.24 1.60 -0.16 0.00 -1.73 0.00 0.00 68.15 68.10 1uyt h THR 1590CO -0.00 0.00 0.32 0.12 -0.25 0.00 0.00 175.52 175.71 1uyt s PHE 1591N -3.23 2.86 -1.27 4.73 5.36 -0.35 -4.30 117.98 121.78 1uyt s PHE 1591Ca 0.05 -0.60 -0.11 0.00 -0.96 0.00 0.00 56.93 55.32 1uyt s PHE 1591Cb 0.09 -4.03 -0.00 0.00 -0.34 0.00 0.00 43.02 38.74 1uyt s PHE 1591CO 0.70 -1.38 0.61 1.63 -1.46 0.00 0.00 175.22 175.32 1uyt n LYS 1592N 6.96 -2.40 -3.36 10.12 5.02 -1.26 -1.32 118.16 131.92 1uyt n LYS 1592Ca -0.05 0.43 -0.20 0.00 -2.02 0.00 0.00 58.31 56.46 1uyt n LYS 1592Cb 0.45 -4.32 -0.02 0.00 -0.02 0.00 0.00 35.03 31.11 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 -4.32 -0.36 -3.75 -0.18 -5.35 -1.22 -1.59 119.36 102.59 1uyt n ILE 1593Ca -0.21 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 61.99 1uyt n ILE 1593Cb 0.64 -0.84 0.03 0.00 -1.74 0.00 0.00 39.64 37.73 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 -0.90 -0.51 3.84 3.28 0.00 -0.43 -2.59 105.19 107.88 1uyt n GLY 1594Ca 0.02 0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.20 5.74 -0.51 1.61 1.04 -0.62 -2.25 113.70 115.51 1uyt s SER 1595Ca 0.61 1.54 -0.16 0.00 0.48 0.00 0.00 55.95 58.41 1uyt s SER 1595Cb -0.30 -2.48 0.09 0.00 0.10 0.00 0.00 66.02 63.43 1uyt s SER 1595CO 0.75 -1.20 0.48 -0.36 0.98 0.00 0.00 173.24 173.89 1uyt s PHE 1596N -3.10 3.20 0.41 5.02 0.40 0.11 -4.79 117.98 119.24 1uyt s PHE 1596Ca 0.57 -0.98 0.08 0.00 -0.60 0.00 0.00 56.93 55.99 1uyt s PHE 1596Cb -0.13 -3.46 0.00 0.00 0.51 0.00 0.00 43.02 39.94 1uyt s PHE 1596CO 0.54 -0.93 0.51 0.20 0.70 0.00 0.00 175.22 176.24 1uyt s GLY 1597N 2.98 1.98 0.28 4.36 0.00 -1.26 -1.22 107.32 114.43 1uyt s GLY 1597Ca 0.06 -1.72 0.01 0.00 0.00 0.00 0.00 44.72 43.07 1uyt s GLY 1597CO 0.06 -1.54 1.80 -2.55 0.00 0.00 0.00 173.10 170.87 1uyt h PRO 1598N 0.77 0.79 -0.63 2.90 0.11 -1.90 -1.01 132.00 133.03 1uyt h PRO 1598Ca -0.41 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1uyt h PRO 1598Cb 1.27 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1uyt h PRO 1598CO 0.49 0.52 0.25 1.96 -0.21 0.00 0.00 178.00 181.01 1uyt h GLN 1599N 0.82 0.94 -0.42 1.05 4.20 -1.97 0.33 115.11 120.06 1uyt h GLN 1599Ca 0.50 -0.17 -0.13 0.00 0.06 0.00 0.00 58.65 58.91 1uyt h GLN 1599Cb 0.63 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1uyt h GLN 1599CO -0.32 0.80 -0.23 0.93 -0.67 0.00 0.00 178.83 179.34 1uyt h GLU 1600N 0.88 0.90 -0.32 1.46 3.07 -1.77 -1.21 114.58 117.59 1uyt h GLU 1600Ca 0.21 -0.41 -0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1uyt h GLU 1600Cb 0.21 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1uyt h GLU 1600CO -0.02 1.06 0.19 -0.44 -1.40 0.00 0.00 179.01 178.40 1uyt h ASP 1601N 0.72 0.39 -0.57 1.42 3.45 -0.94 0.13 116.42 121.03 1uyt h ASP 1601Ca 0.09 -0.07 0.03 0.00 0.43 0.00 0.00 57.03 57.51 1uyt h ASP 1601Cb 0.81 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 39.44 1uyt h ASP 1601CO 0.07 0.35 0.34 -0.08 -1.57 0.00 0.00 179.24 178.34 1uyt h GLU 1602N 0.41 0.65 -0.47 3.56 4.57 -0.21 -1.45 114.58 121.63 1uyt h GLU 1602Ca 0.11 -0.04 -0.12 0.00 -1.18 0.00 0.00 59.36 58.13 1uyt h GLU 1602Cb 0.03 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1uyt h GLU 1602CO -0.02 0.43 -0.19 0.35 -1.18 0.00 0.00 179.01 178.40 1uyt h PHE 1603N 0.67 1.08 -0.21 0.92 3.57 -0.79 -1.67 116.94 120.51 1uyt h PHE 1603Ca 0.24 -0.25 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1uyt h PHE 1603Cb 0.04 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 1uyt h PHE 1603CO -0.06 1.05 0.10 0.35 -2.23 0.00 0.00 178.31 177.52 1uyt h PHE 1604N 0.83 0.19 -0.41 0.41 3.57 -0.31 0.31 116.94 121.53 1uyt h PHE 1604Ca 0.11 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1uyt h PHE 1604Cb 0.75 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1uyt h PHE 1604CO 0.05 0.11 0.26 -0.97 -2.23 0.00 0.00 178.31 175.53 1uyt h ASN 1605N 0.22 0.47 -0.81 0.41 -0.73 -1.17 0.15 115.58 114.13 1uyt h ASN 1605Ca 0.08 -0.03 -0.00 0.00 1.87 0.00 0.00 56.30 58.22 1uyt h ASN 1605Cb 0.02 -0.12 -0.04 0.00 0.27 0.00 0.00 38.32 38.45 1uyt h ASN 1605CO -0.06 0.36 0.48 0.50 -0.37 0.00 0.00 177.43 178.34 1uyt h LYS 1606N 0.55 1.10 -0.36 6.67 1.63 -0.99 -1.03 116.57 124.14 1uyt h LYS 1606Ca 0.15 -0.10 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 1uyt h LYS 1606Cb -0.04 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.34 1uyt h LYS 1606CO -0.03 0.77 0.05 0.28 -3.45 0.00 0.00 179.45 177.08 1uyt h VAL 1607N 1.11 1.24 -0.28 2.00 2.07 -0.52 -1.60 116.25 120.27 1uyt h VAL 1607Ca 0.29 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.96 1uyt h VAL 1607Cb -0.04 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1uyt h VAL 1607CO -0.05 0.29 0.15 0.74 0.02 0.00 0.00 177.57 178.71 1uyt h THR 1608N 0.45 1.01 -0.27 2.57 2.02 -0.43 -2.00 112.91 116.26 1uyt h THR 1608Ca 0.11 -0.11 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1uyt h THR 1608Cb 0.37 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1uyt h THR 1608CO 0.01 0.06 -0.10 -0.33 0.37 0.00 0.00 175.52 175.52 1uyt h GLU 1609N 0.31 0.43 -0.41 6.66 5.08 -1.16 -1.96 114.58 123.54 1uyt h GLU 1609Ca 0.11 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1uyt h GLU 1609Cb 0.02 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1uyt h GLU 1609CO -0.07 0.54 0.22 -0.92 -1.00 0.00 0.00 179.01 177.78 1uyt h TYR 1610N 0.41 0.40 -0.07 4.33 3.20 -0.73 -0.74 116.97 123.77 1uyt h TYR 1610Ca 0.08 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.81 1uyt h TYR 1610Cb 0.43 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1uyt h TYR 1610CO 0.01 0.22 -0.64 0.00 -1.64 0.00 0.00 178.16 176.11 1uyt h ALA 1611N 1.20 0.78 -0.20 1.82 0.00 -0.87 -3.09 119.26 118.90 1uyt h ALA 1611Ca 0.17 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 1uyt h ALA 1611Cb 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1uyt h ALA 1611CO -0.10 0.75 -0.06 0.00 0.00 0.00 0.00 179.25 179.83 1uyt h ARG 1612N 0.19 0.40 -0.81 0.00 3.08 -1.08 0.19 114.38 116.35 1uyt h ARG 1612Ca -0.01 -0.16 0.17 0.00 0.07 0.00 0.00 59.98 60.05 1uyt h ARG 1612Cb 1.16 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.14 1uyt h ARG 1612CO 0.10 0.66 0.54 -0.22 -1.07 0.00 0.00 179.97 179.99 1uyt h LYS 1613N 0.11 0.38 -0.00 0.04 3.11 -1.16 -0.26 116.57 118.78 1uyt h LYS 1613Ca 0.05 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.87 1uyt h LYS 1613Cb 0.52 -0.09 0.00 0.00 -1.00 0.00 0.00 32.23 31.67 1uyt h LYS 1613CO 0.02 0.25 -0.67 0.54 -2.81 0.00 0.00 179.45 176.78 1uyt n ARG 1614N -4.48 0.27 -1.12 1.90 1.74 -0.95 -4.95 116.66 109.07 1uyt n ARG 1614Ca 0.16 -0.20 -0.04 0.00 -0.77 0.00 0.00 57.85 57.01 1uyt n ARG 1614Cb 0.61 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.54 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 1.47 0.69 3.85 -0.13 0.00 0.44 -4.71 105.19 106.80 1uyt n GLY 1615Ca 0.06 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.06 4.90 0.57 -0.61 1.09 0.12 -0.59 121.20 124.63 1uyt s ILE 1616Ca 0.00 0.73 -0.20 0.00 -1.10 0.00 0.00 60.65 60.08 1uyt s ILE 1616Cb 0.00 -3.71 -0.05 0.00 -1.06 0.00 0.00 42.46 37.65 1uyt s ILE 1616CO 0.00 0.22 1.19 -2.65 -0.10 0.00 0.00 174.94 173.60 1uyt n PRO 1617N 0.72 1.31 -4.04 2.79 -0.02 -1.26 -4.50 135.00 129.99 1uyt n PRO 1617Ca -0.05 0.49 -0.32 0.00 -2.02 0.00 0.00 63.50 61.60 1uyt n PRO 1617Cb 0.52 -2.40 -0.15 0.00 -0.02 0.00 0.00 33.50 31.45 1uyt n PRO 1617CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1uyt s ARG 1618N -2.86 1.96 -0.25 -0.52 3.52 -0.29 -1.45 118.95 119.06 1uyt s ARG 1618Ca 0.74 -1.55 -0.13 0.00 -0.13 0.00 0.00 55.73 54.66 1uyt s ARG 1618Cb -0.42 -3.03 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 1uyt s ARG 1618CO 0.47 -0.72 0.26 0.42 -0.81 0.00 0.00 175.30 174.93 1uyt s ILE 1619N 1.03 5.28 -0.16 4.11 1.09 0.61 -2.71 121.20 130.44 1uyt s ILE 1619Ca -0.01 0.37 -0.04 0.00 -1.10 0.00 0.00 60.65 59.87 1uyt s ILE 1619Cb -0.20 -3.60 -0.02 0.00 -1.06 0.00 0.00 42.46 37.58 1uyt s ILE 1619CO -0.06 0.26 -0.04 -0.47 -0.10 0.00 0.00 174.94 174.54 1uyt s TYR 1620N 1.49 3.01 -0.38 3.97 6.04 -0.29 -0.54 117.35 130.65 1uyt s TYR 1620Ca 0.11 -0.38 -0.07 0.00 0.04 0.00 0.00 57.07 56.77 1uyt s TYR 1620Cb -0.15 -1.98 0.06 0.00 -1.04 0.00 0.00 41.96 38.86 1uyt s TYR 1620CO 0.08 -0.11 0.18 -0.51 -1.54 0.00 0.00 175.55 173.65 1uyt s LEU 1621N 0.52 4.75 -0.22 6.97 1.43 0.60 -0.82 118.68 131.90 1uyt s LEU 1621Ca -0.03 -1.38 -0.23 0.00 -1.03 0.00 0.00 54.13 51.46 1uyt s LEU 1621Cb -0.14 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 1uyt s LEU 1621CO 0.03 -0.43 0.74 0.00 0.23 0.00 0.00 176.35 176.91 1uyt s ALA 1622N 1.38 3.59 -0.37 4.21 0.00 0.21 -3.12 121.76 127.67 1uyt s ALA 1622Ca 0.01 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 51.84 1uyt s ALA 1622Cb -0.21 -3.14 0.18 0.00 0.00 0.00 0.00 23.12 19.95 1uyt s ALA 1622CO 0.02 -0.75 0.59 0.00 0.00 0.00 0.00 175.76 175.61 1uyt s ALA 1623N 2.39 -2.19 0.34 0.00 0.00 -1.25 -1.60 121.76 119.46 1uyt s ALA 1623Ca 0.32 0.38 -0.11 0.00 0.00 0.00 0.00 51.96 52.55 1uyt s ALA 1623Cb -0.16 -2.60 0.03 0.00 0.00 0.00 0.00 23.12 20.39 1uyt s ALA 1623CO 0.09 -2.07 0.63 0.54 0.00 0.00 0.00 175.76 174.95 1uyt s ASN 1624N 2.15 0.30 -0.08 0.00 4.22 -0.49 -4.04 114.94 117.00 1uyt s ASN 1624Ca 0.14 -1.19 0.12 0.00 -2.14 0.00 0.00 52.86 49.78 1uyt s ASN 1624Cb -0.07 0.74 0.23 0.00 1.28 0.00 0.00 41.25 43.43 1uyt s ASN 1624CO -0.14 -1.45 1.15 -1.20 -2.04 0.00 0.00 177.10 173.42 1uyt n SER 1625N -1.20 2.52 0.00 3.54 7.64 -0.95 -4.05 113.62 121.12 1uyt n SER 1625Ca -0.04 -2.60 0.00 0.00 1.01 0.00 0.00 58.87 57.24 1uyt n SER 1625Cb 0.61 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 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 -0.78 -1.92 3.76 0.23 0.00 -1.21 -4.85 105.19 100.41 1uyt n GLY 1626Ca 0.11 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.32 3.04 0.42 4.61 0.00 -1.26 0.07 121.76 127.33 1uyt s ALA 1627Ca 0.00 1.32 -0.24 0.00 0.00 0.00 0.00 51.96 53.04 1uyt s ALA 1627Cb 0.00 -3.54 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 1uyt s ALA 1627CO 0.00 -1.15 1.13 0.50 0.00 0.00 0.00 175.76 176.24 1uyt s ARG 1628N -2.63 3.97 0.28 0.00 3.52 -0.36 -4.59 118.95 119.13 1uyt s ARG 1628Ca 0.65 1.71 0.02 0.00 -0.13 0.00 0.00 55.73 57.98 1uyt s ARG 1628Cb -0.40 -2.52 -0.05 0.00 -1.56 0.00 0.00 34.95 30.42 1uyt s ARG 1628CO 0.49 -0.36 0.10 0.96 -0.81 0.00 0.00 175.30 175.68 1uyt s ILE 1629N -1.54 0.60 0.00 4.11 -4.36 -1.26 -4.60 121.20 114.16 1uyt s ILE 1629Ca 0.60 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.99 1uyt s ILE 1629Cb -0.27 -2.63 0.00 0.00 1.25 0.00 0.00 42.46 40.80 1uyt s ILE 1629CO 0.34 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.13 1uyt n GLY 1630N -0.52 1.80 3.64 6.27 0.00 -1.17 -4.83 105.19 110.40 1uyt n GLY 1630Ca -0.00 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 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 2.03 -0.85 1.61 -1.94 -1.26 -4.68 119.30 112.23 1uyt s MET 1631Ca 0.00 -2.24 -0.25 0.00 -1.71 0.00 0.00 55.69 51.49 1uyt s MET 1631Cb 0.00 -1.27 0.04 0.00 2.01 0.00 0.00 34.83 35.61 1uyt s MET 1631CO 0.00 -0.31 1.33 0.00 -0.01 0.00 0.00 175.02 176.03 1uyt s ALA 1632N -2.97 2.77 0.47 3.03 0.00 -1.26 -4.84 121.76 118.97 1uyt s ALA 1632Ca 0.19 -1.80 0.32 0.00 0.00 0.00 0.00 51.96 50.68 1uyt s ALA 1632Cb 0.04 -4.34 1.73 0.00 0.00 0.00 0.00 23.12 20.56 1uyt s ALA 1632CO 0.10 -3.39 2.17 0.93 0.00 0.00 0.00 175.76 175.57 1uyt h GLU 1633N 9.88 0.00 -0.96 0.00 4.39 -1.99 -2.37 114.58 123.52 1uyt h GLU 1633Ca -0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1uyt h GLU 1633Cb 1.03 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1uyt h GLU 1633CO 1.33 0.06 0.01 -0.85 -1.16 0.00 0.00 179.01 178.39 1uyt n GLU 1634N -3.50 1.39 0.00 2.33 0.00 -1.26 -2.87 120.64 116.73 1uyt n GLU 1634Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 57.16 56.81 1uyt n GLU 1634Cb 0.18 -1.53 0.00 0.00 0.00 0.00 0.00 31.44 30.08 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 0.09 0.00 -0.18 3.84 2.08 -0.90 -4.77 119.36 119.52 1uyt n ILE 1635Ca 0.03 -0.04 -0.06 0.00 0.56 0.00 0.00 62.75 63.24 1uyt n ILE 1635Cb 0.38 0.43 0.03 0.00 -0.75 0.00 0.00 39.64 39.73 1uyt n ILE 1635CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1uyt h VAL 1636N 0.00 1.12 0.00 1.39 2.07 -1.54 -3.20 116.25 116.08 1uyt h VAL 1636Ca 0.00 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1uyt h VAL 1636Cb 0.00 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1uyt h VAL 1636CO 0.00 0.13 -0.04 1.55 0.02 0.00 0.00 177.57 179.23 1uyt h PRO 1637N 0.71 0.00 -1.89 1.57 0.13 -1.89 -3.38 132.00 127.26 1uyt h PRO 1637Ca 0.20 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 65.08 1uyt h PRO 1637Cb -0.06 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 30.97 1uyt h PRO 1637CO -0.06 0.80 0.08 1.47 -0.23 0.00 0.00 178.00 180.06 1uyt n LEU 1638N -4.64 5.85 -4.09 1.56 -0.00 -1.25 -4.84 117.00 109.59 1uyt n LEU 1638Ca -0.09 -3.24 -0.27 0.00 -0.00 0.00 0.00 56.01 52.42 1uyt n LEU 1638Cb 0.39 -1.22 -0.17 0.00 -0.00 0.00 0.00 43.42 42.42 1uyt n LEU 1638CO 0.27 1.43 -0.50 0.72 -0.00 0.00 0.00 177.39 179.31 1uyt s PHE 1639N -0.55 1.76 -0.08 1.47 -0.12 -1.21 -4.78 117.98 114.46 1uyt s PHE 1639Ca 0.41 -0.64 -0.01 0.00 -0.05 0.00 0.00 56.93 56.63 1uyt s PHE 1639Cb 0.24 -1.23 -0.03 0.00 -0.63 0.00 0.00 43.02 41.37 1uyt s PHE 1639CO -0.05 -0.29 -0.02 -0.65 -0.05 0.00 0.00 175.22 174.16 1uyt s GLN 1640N 0.47 2.91 -0.02 1.99 -1.52 -0.75 -5.00 119.66 117.73 1uyt s GLN 1640Ca -0.14 -0.45 -0.15 0.00 -1.95 0.00 0.00 55.36 52.67 1uyt s GLN 1640Cb -0.15 -2.73 -0.05 0.00 -0.22 0.00 0.00 33.01 29.85 1uyt s GLN 1640CO 0.05 0.69 0.40 0.08 -0.25 0.00 0.00 175.29 176.26 1uyt s VAL 1641N -0.88 5.07 -1.06 1.09 1.01 -1.26 -1.27 120.40 123.11 1uyt s VAL 1641Ca 0.13 0.81 -0.08 0.00 0.00 0.00 0.00 61.98 62.85 1uyt s VAL 1641Cb -0.11 -3.71 0.26 0.00 0.00 0.00 0.00 36.38 32.83 1uyt s VAL 1641CO 0.02 0.55 1.03 0.00 0.00 0.00 0.00 175.10 176.70 1uyt s ALA 1642N -0.84 4.62 1.26 5.51 0.00 -1.07 -4.96 121.76 126.29 1uyt s ALA 1642Ca 0.23 -3.82 -0.17 0.00 0.00 0.00 0.00 51.96 48.21 1uyt s ALA 1642Cb -0.16 -3.42 0.32 0.00 0.00 0.00 0.00 23.12 19.85 1uyt s ALA 1642CO 0.12 -2.19 1.00 -1.58 0.00 0.00 0.00 175.76 173.10 1uyt s TRP 1643N -1.21 0.63 -2.05 0.00 0.52 -1.26 -0.84 118.94 114.72 1uyt s TRP 1643Ca 0.29 0.90 0.24 0.00 0.02 0.00 0.00 56.10 57.55 1uyt s TRP 1643Cb -0.10 -3.04 0.21 0.00 -1.15 0.00 0.00 33.47 29.39 1uyt s TRP 1643CO -0.09 -4.28 1.23 0.09 0.02 0.00 0.00 176.95 173.92 1uyt n ASN 1644N -5.17 1.85 -3.15 2.95 3.02 -0.20 -4.61 115.26 109.96 1uyt n ASN 1644Ca 0.07 -1.41 0.05 0.00 -0.03 0.00 0.00 54.58 53.26 1uyt n ASN 1644Cb 0.57 0.35 -0.01 0.00 -0.61 0.00 0.00 39.78 40.08 1uyt n ASN 1644CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1uyt s ASP 1645N -2.44 -0.76 0.22 6.41 3.68 -1.26 -5.05 116.67 117.48 1uyt s ASP 1645Ca 0.21 0.48 -0.18 0.00 2.13 0.00 0.00 52.55 55.19 1uyt s ASP 1645Cb 0.19 1.64 0.22 0.00 -1.45 0.00 0.00 42.92 43.51 1uyt s ASP 1645CO 0.54 -0.14 1.55 0.00 0.13 0.00 0.00 175.17 177.25 1uyt h ALA 1646N 8.00 0.12 -2.30 3.66 0.00 -1.98 -3.34 119.26 123.42 1uyt h ALA 1646Ca -0.17 0.26 -0.50 0.00 0.00 0.00 0.00 54.91 54.51 1uyt h ALA 1646Cb 1.17 1.01 0.05 0.00 0.00 0.00 0.00 17.79 20.02 1uyt h ALA 1646CO 0.02 -0.64 0.39 0.00 0.00 0.00 0.00 179.25 179.02 1uyt s ALA 1647N -5.94 2.97 -0.66 0.00 0.00 -1.26 -4.24 121.76 112.63 1uyt s ALA 1647Ca -0.14 0.09 -0.02 0.00 0.00 0.00 0.00 51.96 51.89 1uyt s ALA 1647Cb 0.20 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1uyt s ALA 1647CO 0.71 -0.65 0.50 0.27 0.00 0.00 0.00 175.76 176.59 1uyt n ASN 1648N -2.33 -3.99 0.00 0.00 0.23 -1.26 -4.78 115.26 103.13 1uyt n ASN 1648Ca 0.07 -0.77 0.04 0.00 -0.53 0.00 0.00 54.58 53.39 1uyt n ASN 1648Cb 0.54 -1.31 0.20 0.00 -2.08 0.00 0.00 39.78 37.12 1uyt n ASN 1648CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1uyt n PRO 1649N -2.13 0.04 0.00 -0.53 -0.04 -1.25 -3.24 135.00 127.84 1uyt n PRO 1649Ca -0.26 0.31 0.01 0.00 -0.04 0.00 0.00 63.50 63.52 1uyt n PRO 1649Cb 0.58 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.61 1uyt n PRO 1649CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1uyt n ASP 1650N -1.44 0.00 0.07 3.54 5.68 -1.26 -1.73 116.55 121.40 1uyt n ASP 1650Ca 0.03 -0.22 -0.17 0.00 -0.50 0.00 0.00 54.79 53.93 1uyt n ASP 1650Cb 0.09 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 39.93 1uyt n ASP 1650CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1uyt h LYS 1651N 0.00 0.25 0.00 0.11 1.57 -1.91 -3.51 116.57 113.09 1uyt h LYS 1651Ca 0.00 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1uyt h LYS 1651Cb 0.00 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1uyt h LYS 1651CO 0.00 1.12 0.00 0.41 -0.57 0.00 0.00 179.45 180.41 1uyt n GLY 1652N 1.66 3.06 3.39 3.86 0.00 -0.71 -4.99 105.19 111.46 1uyt n GLY 1652Ca -0.16 -1.88 -0.20 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.05 1.91 -0.15 1.61 -0.71 -1.26 -1.04 117.98 116.29 1uyt s PHE 1653Ca 0.00 -0.50 0.04 0.00 -1.04 0.00 0.00 56.93 55.42 1uyt s PHE 1653Cb 0.00 -0.88 -0.23 0.00 -1.21 0.00 0.00 43.02 40.70 1uyt s PHE 1653CO 0.00 0.47 0.22 1.04 -1.34 0.00 0.00 175.22 175.61 1uyt n GLN 1654N -0.47 0.69 0.00 1.99 1.13 -0.02 -4.89 117.38 115.81 1uyt n GLN 1654Ca -0.07 0.20 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 1uyt n GLN 1654Cb 0.60 -1.65 0.00 0.00 0.11 0.00 0.00 30.24 29.31 1uyt n GLN 1654CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 1uyt n TYR 1655N -3.21 0.00 -3.81 1.08 0.18 -1.25 -5.04 117.16 105.10 1uyt n TYR 1655Ca -0.33 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.30 1uyt n TYR 1655Cb 1.05 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.85 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 1.07 0.00 -3.48 1.43 -1.26 -2.58 118.68 113.86 1uyt s LEU 1656Ca 0.00 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 1uyt s LEU 1656Cb 0.00 -0.12 -0.01 0.00 0.03 0.00 0.00 46.19 46.09 1uyt s LEU 1656CO 0.00 -0.12 0.08 0.00 0.23 0.00 0.00 176.35 176.54 1uyt n TYR 1657N 4.21 0.54 -3.84 0.29 4.11 -0.39 -0.30 117.16 121.78 1uyt n TYR 1657Ca -0.27 -2.45 -0.21 0.00 -0.00 0.00 0.00 57.90 54.97 1uyt n TYR 1657Cb 0.50 -0.13 -0.17 0.00 -0.00 0.00 0.00 39.34 39.53 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 0.73 0.81 -3.48 1.02 -0.35 -1.82 118.68 115.60 1uyt s LEU 1658Ca 0.12 -0.06 -0.11 0.00 0.02 0.00 0.00 54.13 54.10 1uyt s LEU 1658Cb 0.01 -0.36 0.08 0.00 0.02 0.00 0.00 46.19 45.93 1uyt s LEU 1658CO 0.08 -0.17 1.10 0.42 0.02 0.00 0.00 176.35 177.80 1uyt s THR 1659N 1.68 3.08 0.59 5.49 -4.23 -1.26 -2.52 115.64 118.48 1uyt s THR 1659Ca 0.00 0.35 0.29 0.00 -1.18 0.00 0.00 61.69 61.15 1uyt s THR 1659Cb -0.13 -2.78 0.36 0.00 1.34 0.00 0.00 72.50 71.30 1uyt s THR 1659CO -0.04 -0.46 2.06 -1.28 -0.54 0.00 0.00 174.62 174.36 1uyt h SER 1660N -1.29 0.00 0.04 3.99 0.87 -2.00 0.75 113.55 115.91 1uyt h SER 1660Ca -0.44 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 59.95 1uyt h SER 1660Cb 1.24 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1uyt h SER 1660CO 0.51 0.00 -0.58 -0.08 -0.53 0.00 0.00 176.83 176.15 1uyt h GLU 1661N 0.00 0.55 -0.15 2.24 4.81 -1.98 -2.95 114.58 117.10 1uyt h GLU 1661Ca 0.11 -0.36 -0.05 0.00 -0.13 0.00 0.00 59.36 58.93 1uyt h GLU 1661Cb 0.62 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 1uyt h GLU 1661CO -0.00 0.98 -0.09 0.78 -0.73 0.00 0.00 179.01 179.95 1uyt h GLY 1662N 1.06 0.35 0.23 1.92 0.00 -1.19 -2.87 103.07 102.59 1uyt h GLY 1662Ca 0.00 -0.33 0.20 0.00 0.00 0.00 0.00 47.33 47.20 1uyt h GLY 1662CO 0.11 0.30 0.61 -0.33 0.00 0.00 0.00 176.54 177.22 1uyt h MET 1663N -0.02 0.54 -0.24 4.80 2.86 -1.45 -1.22 114.93 120.21 1uyt h MET 1663Ca 0.03 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1uyt h MET 1663Cb 0.57 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1uyt h MET 1663CO 0.02 0.36 -0.13 0.93 1.06 0.00 0.00 176.91 179.15 1uyt h GLU 1664N 0.56 0.52 -0.82 1.72 4.39 -1.40 -2.89 114.58 116.65 1uyt h GLU 1664Ca 0.51 -0.23 0.06 0.00 0.34 0.00 0.00 59.36 60.04 1uyt h GLU 1664Cb 1.06 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.65 1uyt h GLU 1664CO -0.25 0.79 0.54 1.15 -1.16 0.00 0.00 179.01 180.08 1uyt h THR 1665N 0.24 1.05 0.00 1.13 2.02 -1.02 0.16 112.91 116.49 1uyt h THR 1665Ca 0.05 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1uyt h THR 1665Cb 0.65 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1uyt h THR 1665CO 0.04 0.17 -0.15 -0.07 0.37 0.00 0.00 175.52 175.88 1uyt h LEU 1666N 0.92 0.00 0.00 2.58 4.07 -1.26 -1.78 115.31 119.84 1uyt h LEU 1666Ca 0.35 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.25 1uyt h LEU 1666Cb 0.21 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 1uyt h LEU 1666CO -0.12 0.15 -1.00 0.11 -1.08 0.00 0.00 178.44 176.49 1uyt h LYS 1667N 0.00 0.00 0.00 1.13 1.57 -0.59 0.47 116.57 119.14 1uyt h LYS 1667Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1uyt h LYS 1667Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1uyt h LYS 1667CO 0.02 0.13 -0.17 -0.22 -0.57 0.00 0.00 179.45 178.63 1uyt h LYS 1668N 0.00 0.00 -0.13 3.15 3.64 -0.10 -3.03 116.57 120.11 1uyt h LYS 1668Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1uyt h LYS 1668Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1uyt h LYS 1668CO 0.02 0.17 0.00 1.19 -2.27 0.00 0.00 179.45 178.56 1uyt n PHE 1669N -3.20 0.16 -0.56 1.91 0.99 -0.92 -4.94 117.46 110.90 1uyt n PHE 1669Ca 0.02 -0.17 0.00 0.00 -0.00 0.00 0.00 57.45 57.30 1uyt n PHE 1669Cb 0.51 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 38.99 1uyt n PHE 1669CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1uyt n ASP 1670N 0.58 0.00 -1.74 4.37 -0.08 -0.83 -4.82 116.55 114.04 1uyt n ASP 1670Ca 0.08 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.35 1uyt n ASP 1670Cb 0.33 -1.29 -0.02 0.00 2.34 0.00 0.00 41.12 42.47 1uyt n ASP 1670CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1uyt n LYS 1671N -2.00 0.84 0.07 -0.67 5.02 0.16 -4.35 118.16 117.23 1uyt n LYS 1671Ca 0.00 -0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.03 1uyt n LYS 1671Cb 0.00 -1.28 -0.09 0.00 -0.02 0.00 0.00 35.03 33.64 1uyt n LYS 1671CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1uyt h GLU 1672N 2.28 -0.20 -0.64 1.97 4.81 -1.67 -3.09 114.58 118.03 1uyt h GLU 1672Ca 0.03 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1uyt h GLU 1672Cb 0.77 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1uyt h GLU 1672CO 0.06 0.16 0.00 0.27 -0.73 0.00 0.00 179.01 178.77 1uyt n ASN 1673N -5.01 0.65 0.19 1.04 0.23 -1.26 -3.66 115.26 107.45 1uyt n ASN 1673Ca -0.09 -1.24 0.14 0.00 -0.53 0.00 0.00 54.58 52.86 1uyt n ASN 1673Cb 0.24 -0.31 0.44 0.00 -2.08 0.00 0.00 39.78 38.07 1uyt n ASN 1673CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1uyt h SER 1674N 0.39 0.00 -4.89 0.53 0.02 -1.83 -3.41 113.55 104.35 1uyt h SER 1674Ca 0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 1uyt h SER 1674Cb 0.32 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.65 1uyt h SER 1674CO 0.00 0.00 -0.37 0.68 -1.14 0.00 0.00 176.83 176.00 1uyt s VAL 1675N -3.34 0.06 -0.50 2.27 -7.23 -1.24 -0.36 120.40 110.07 1uyt s VAL 1675Ca 0.06 -0.52 -0.13 0.00 -1.81 0.00 0.00 61.98 59.57 1uyt s VAL 1675Cb 0.09 -0.53 0.12 0.00 0.56 0.00 0.00 36.38 36.62 1uyt s VAL 1675CO 0.55 -0.29 0.42 -0.76 -0.31 0.00 0.00 175.10 174.71 1uyt s LEU 1676N -1.24 5.89 0.47 1.32 1.43 0.95 -4.96 118.68 122.54 1uyt s LEU 1676Ca -0.13 -1.78 0.07 0.00 -1.03 0.00 0.00 54.13 51.26 1uyt s LEU 1676Cb -0.06 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1uyt s LEU 1676CO 0.03 -0.76 0.38 0.42 0.23 0.00 0.00 176.35 176.65 1uyt s THR 1677N 1.50 2.21 -0.10 5.49 -4.23 -1.26 -0.32 115.64 118.94 1uyt s THR 1677Ca 0.04 -1.43 -0.03 0.00 -1.18 0.00 0.00 61.69 59.09 1uyt s THR 1677Cb -0.28 -2.64 0.05 0.00 1.34 0.00 0.00 72.50 70.97 1uyt s THR 1677CO 0.02 0.00 0.14 -0.70 -0.54 0.00 0.00 174.62 173.54 1uyt s GLU 1678N -4.18 0.03 0.35 3.99 2.12 -0.53 -4.89 118.70 115.59 1uyt s GLU 1678Ca 0.43 0.41 -0.29 0.00 0.36 0.00 0.00 54.97 55.88 1uyt s GLU 1678Cb -0.02 -0.60 -0.11 0.00 0.26 0.00 0.00 34.13 33.66 1uyt s GLU 1678CO 0.25 -0.39 1.53 -0.98 -0.54 0.00 0.00 175.26 175.13 1uyt s ARG 1679N 2.25 4.11 -0.28 4.30 1.70 -1.26 -2.59 118.95 127.18 1uyt s ARG 1679Ca 0.04 2.59 -0.10 0.00 -0.47 0.00 0.00 55.73 57.78 1uyt s ARG 1679Cb -0.13 -2.98 0.12 0.00 -0.57 0.00 0.00 34.95 31.39 1uyt s ARG 1679CO -0.06 -0.58 0.61 0.99 -1.08 0.00 0.00 175.30 175.19 1uyt s THR 1680N -0.76 -0.85 -0.35 4.99 2.01 0.06 -4.95 115.64 115.80 1uyt s THR 1680Ca 0.56 0.03 -0.16 0.00 0.31 0.00 0.00 61.69 62.43 1uyt s THR 1680Cb -0.47 -0.94 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 1uyt s THR 1680CO 0.58 0.01 0.41 -0.69 -0.69 0.00 0.00 174.62 174.25 1uyt s VAL 1681N 2.73 5.12 -0.23 3.82 1.01 -1.26 0.60 120.40 132.19 1uyt s VAL 1681Ca -0.06 0.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.96 1uyt s VAL 1681Cb -0.11 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 1uyt s VAL 1681CO -0.18 -0.16 -0.01 -0.63 0.00 0.00 0.00 175.10 174.12 1uyt s ILE 1682N 2.13 3.60 -0.08 2.22 -1.09 0.08 -4.69 121.20 123.38 1uyt s ILE 1682Ca 0.14 -0.46 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1uyt s ILE 1682Cb -0.16 -2.68 0.00 0.00 -1.58 0.00 0.00 42.46 38.04 1uyt s ILE 1682CO 0.12 0.37 0.00 -0.46 -1.23 0.00 0.00 174.94 173.74 1uyt n ASN 1683N 4.83 -1.10 0.00 3.58 0.23 -1.26 0.88 115.26 122.41 1uyt n ASN 1683Ca -0.17 0.43 0.00 0.00 -0.53 0.00 0.00 54.58 54.31 1uyt n ASN 1683Cb 0.51 -1.11 0.00 0.00 -2.08 0.00 0.00 39.78 37.09 1uyt n ASN 1683CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1uyt n GLY 1684N -0.47 0.65 3.19 4.83 0.00 -1.26 -5.07 105.19 107.06 1uyt n GLY 1684Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.67 2.43 -0.50 1.61 0.41 0.25 -5.06 118.70 117.18 1uyt s GLU 1685Ca 0.00 -1.31 -0.28 0.00 -0.41 0.00 0.00 54.97 52.97 1uyt s GLU 1685Cb 0.00 -3.31 -0.01 0.00 -1.78 0.00 0.00 34.13 29.04 1uyt s GLU 1685CO 0.00 -0.69 1.65 -2.00 -0.49 0.00 0.00 175.26 173.73 1uyt s GLU 1686N 1.28 3.15 -0.08 1.61 2.12 -1.26 -0.74 118.70 124.77 1uyt s GLU 1686Ca -0.03 0.82 0.01 0.00 0.36 0.00 0.00 54.97 56.13 1uyt s GLU 1686Cb -0.20 -4.21 -0.03 0.00 0.26 0.00 0.00 34.13 29.95 1uyt s GLU 1686CO -0.00 -2.10 -0.08 1.03 -0.54 0.00 0.00 175.26 173.56 1uyt s ARG 1687N 5.93 2.90 -0.85 4.30 0.52 0.20 -4.54 118.95 127.40 1uyt s ARG 1687Ca 0.65 -0.58 -0.07 0.00 -0.52 0.00 0.00 55.73 55.22 1uyt s ARG 1687Cb -0.15 -2.61 0.22 0.00 0.52 0.00 0.00 34.95 32.93 1uyt s ARG 1687CO 0.27 0.56 0.76 -0.06 0.02 0.00 0.00 175.30 176.84 1uyt s PHE 1688N -0.53 3.81 0.34 -0.53 0.08 -1.05 -0.76 117.98 119.34 1uyt s PHE 1688Ca 0.08 -2.61 -0.28 0.00 0.12 0.00 0.00 56.93 54.24 1uyt s PHE 1688Cb -0.12 -3.50 -0.12 0.00 -0.57 0.00 0.00 43.02 38.70 1uyt s PHE 1688CO 0.02 -0.87 1.24 1.55 -0.10 0.00 0.00 175.22 177.06 1uyt n VAL 1689N 3.12 2.03 -3.37 -0.44 3.14 -1.07 -1.21 118.33 120.53 1uyt n VAL 1689Ca 0.16 -0.50 -0.44 0.00 -2.96 0.00 0.00 64.34 60.61 1uyt n VAL 1689Cb 0.40 -1.47 -0.08 0.00 -1.06 0.00 0.00 33.84 31.63 1uyt n VAL 1689CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1uyt s ILE 1690N -1.10 5.18 0.06 1.55 1.01 0.59 -1.46 121.20 127.04 1uyt s ILE 1690Ca 0.56 -0.78 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 1uyt s ILE 1690Cb -0.59 -4.08 -0.30 0.00 0.01 0.00 0.00 42.46 37.50 1uyt s ILE 1690CO 0.62 -0.51 1.10 0.11 0.00 0.00 0.00 174.94 176.26 1uyt h LYS 1691N 8.74 0.40 -2.36 2.79 1.79 -0.99 -3.45 116.57 123.51 1uyt h LYS 1691Ca -0.28 -0.65 -0.08 0.00 -2.18 0.00 0.00 60.65 57.46 1uyt h LYS 1691Cb 1.11 0.24 -0.22 0.00 -1.58 0.00 0.00 32.23 31.78 1uyt h LYS 1691CO 0.84 1.30 -0.03 0.99 -1.08 0.00 0.00 179.45 181.47 1uyt s THR 1692N -2.71 0.00 -0.17 -0.16 2.01 -1.10 -5.01 115.64 108.52 1uyt s THR 1692Ca -0.06 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.84 1uyt s THR 1692Cb 0.06 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 1uyt s THR 1692CO 0.91 -0.02 0.02 -0.63 -0.69 0.00 0.00 174.62 174.20 1uyt s ILE 1693N -0.02 4.38 -0.04 1.82 1.01 -1.26 -0.03 121.20 127.05 1uyt s ILE 1693Ca -0.03 -0.19 -0.08 0.00 0.00 0.00 0.00 60.65 60.36 1uyt s ILE 1693Cb -0.04 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 1uyt s ILE 1693CO 0.02 0.48 -0.16 -0.38 0.00 0.00 0.00 174.94 174.90 1uyt n ILE 1694N 3.47 1.25 0.00 2.92 5.41 0.52 -4.99 119.36 127.94 1uyt n ILE 1694Ca -0.17 0.27 0.00 0.00 1.00 0.00 0.00 62.75 63.85 1uyt n ILE 1694Cb 0.52 -1.91 0.00 0.00 -0.71 0.00 0.00 39.64 37.54 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 2.46 1.90 0.12 7.39 0.00 -0.38 -4.78 105.19 111.90 1uyt n GLY 1695Ca -0.06 -1.73 -0.18 0.00 0.00 0.00 0.00 46.02 44.04 1uyt n GLY 1695CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1uyt h SER 1696N 0.00 0.35 -2.88 1.61 4.64 -1.91 -3.44 113.55 111.92 1uyt h SER 1696Ca 0.00 -0.68 -0.55 0.00 -0.47 0.00 0.00 61.79 60.09 1uyt h SER 1696Cb 0.00 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1uyt h SER 1696CO 0.00 1.60 0.86 -0.70 -0.87 0.00 0.00 176.83 177.73 1uyt s GLU 1697N -2.58 4.27 0.22 4.77 2.12 -1.26 -5.00 118.70 121.24 1uyt s GLU 1697Ca -0.16 1.97 -0.28 0.00 0.36 0.00 0.00 54.97 56.86 1uyt s GLU 1697Cb 0.07 -3.63 -0.09 0.00 0.26 0.00 0.00 34.13 30.74 1uyt s GLU 1697CO 0.80 -0.61 0.89 0.34 -0.54 0.00 0.00 175.26 176.14 1uyt s ASP 1698N 2.03 7.55 0.00 -1.70 2.15 -1.26 -4.42 116.67 121.03 1uyt s ASP 1698Ca 0.64 1.85 0.00 0.00 0.43 0.00 0.00 52.55 55.47 1uyt s ASP 1698Cb -0.31 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.74 1uyt s ASP 1698CO 0.26 0.16 0.00 0.61 -0.17 0.00 0.00 175.17 176.03 1uyt n GLY 1699N 1.47 1.16 0.13 2.66 0.00 -1.26 -4.97 105.19 104.39 1uyt n GLY 1699Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 2.36 0.00 0.99 4.32 -1.26 -4.05 117.00 119.36 1uyt n LEU 1700Ca 0.00 0.17 0.00 0.00 -0.02 0.00 0.00 56.01 56.16 1uyt n LEU 1700Cb 0.00 -0.90 0.00 0.00 -1.62 0.00 0.00 43.42 40.90 1uyt n LEU 1700CO 0.00 0.69 0.00 0.61 -1.22 0.00 0.00 177.39 177.47 1uyt n GLY 1701N 1.69 2.78 0.56 -0.72 0.00 -1.26 -3.02 105.19 105.21 1uyt n GLY 1701Ca -0.47 -0.21 0.37 0.00 0.00 0.00 0.00 46.02 45.71 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 0.28 0.00 1.61 -1.51 -1.98 0.72 116.25 115.37 1uyt h VAL 1702Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.44 1uyt h VAL 1702Cb 0.00 0.30 -0.00 0.00 -2.13 0.00 0.00 31.29 29.46 1uyt h VAL 1702CO 0.00 0.00 -0.16 1.05 -1.23 0.00 0.00 177.57 177.23 1uyt h GLU 1703N 0.00 0.00 0.03 5.19 9.09 -1.98 -1.02 114.58 125.90 1uyt h GLU 1703Ca 0.60 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.79 1uyt h GLU 1703Cb 2.54 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.63 1uyt h GLU 1703CO -0.01 0.16 -0.99 0.00 0.05 0.00 0.00 179.01 178.23 1uyt h LEU 1705N 0.06 0.73 -0.31 0.00 3.38 -1.18 -1.54 115.31 116.44 1uyt h LEU 1705Ca -0.05 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 1uyt h LEU 1705Cb 1.68 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1uyt h LEU 1705CO 0.15 1.11 0.12 -0.09 0.09 0.00 0.00 178.44 179.82 1uyt h ARG 1706N 0.51 0.46 -0.71 1.13 2.43 -1.26 -1.48 114.38 115.47 1uyt h ARG 1706Ca 0.02 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1uyt h ARG 1706Cb 1.08 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.52 1uyt h ARG 1706CO 0.10 0.48 0.47 0.78 -1.51 0.00 0.00 179.97 180.30 1uyt h GLY 1707N 0.35 1.00 0.93 2.80 0.00 -1.39 -1.31 103.07 105.43 1uyt h GLY 1707Ca 0.10 -0.36 0.01 0.00 0.00 0.00 0.00 47.33 47.08 1uyt h GLY 1707CO -0.01 0.35 0.11 1.76 0.00 0.00 0.00 176.54 178.75 1uyt h SER 1708N 0.94 0.17 -0.46 0.19 0.02 -0.59 -2.45 113.55 111.36 1uyt h SER 1708Ca 0.27 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.14 1uyt h SER 1708Cb -0.07 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1uyt h SER 1708CO -0.06 0.13 0.01 1.23 -1.14 0.00 0.00 176.83 177.00 1uyt h GLY 1709N 0.23 0.94 0.61 -3.77 0.00 -0.71 -2.18 103.07 98.20 1uyt h GLY 1709Ca 0.08 -0.64 0.01 0.00 0.00 0.00 0.00 47.33 46.79 1uyt h GLY 1709CO -0.05 0.59 -0.26 -2.00 0.00 0.00 0.00 176.54 174.82 1uyt h LEU 1710N 0.81 -0.72 -1.29 3.11 5.85 -0.93 -0.93 115.31 121.22 1uyt h LEU 1710Ca 0.16 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1uyt h LEU 1710Cb 0.47 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1uyt h LEU 1710CO 0.02 -0.36 -0.12 0.16 -0.34 0.00 0.00 178.44 177.80 1uyt h ILE 1711N -0.50 0.30 -0.37 4.05 3.07 -1.33 -0.26 117.51 122.47 1uyt h ILE 1711Ca 0.01 -0.82 -0.11 0.00 1.55 0.00 0.00 64.86 65.49 1uyt h ILE 1711Cb 0.50 1.64 -0.01 0.00 -0.27 0.00 0.00 36.82 38.68 1uyt h ILE 1711CO -0.11 0.11 -0.22 0.00 -1.05 0.00 0.00 178.15 176.89 1uyt h ALA 1712N 1.88 0.52 -0.16 0.16 0.00 -0.88 0.07 119.26 120.86 1uyt h ALA 1712Ca -0.00 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.39 1uyt h ALA 1712Cb 0.63 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1uyt h ALA 1712CO 0.02 0.49 -0.52 0.78 0.00 0.00 0.00 179.25 180.02 1uyt h GLY 1713N 0.59 0.50 1.04 0.00 0.00 -0.82 -1.39 103.07 102.99 1uyt h GLY 1713Ca 0.08 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 1uyt h GLY 1713CO 0.06 0.50 -0.04 0.00 0.00 0.00 0.00 176.54 177.07 1uyt h ALA 1714N 1.08 0.69 -0.30 3.60 0.00 -0.84 -2.14 119.26 121.36 1uyt h ALA 1714Ca 0.01 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1uyt h ALA 1714Cb 1.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1uyt h ALA 1714CO 0.09 0.54 -0.13 1.15 0.00 0.00 0.00 179.25 180.90 1uyt h THR 1715N 0.79 1.29 -0.70 0.00 2.02 -0.87 -0.24 112.91 115.20 1uyt h THR 1715Ca 0.14 -1.22 0.06 0.00 0.77 0.00 0.00 66.41 66.17 1uyt h THR 1715Cb 0.57 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.39 1uyt h THR 1715CO 0.03 0.39 0.46 -1.28 0.37 0.00 0.00 175.52 175.49 1uyt h SER 1716N 0.37 0.64 -0.15 4.18 0.87 -1.18 -1.25 113.55 117.03 1uyt h SER 1716Ca 0.07 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.43 1uyt h SER 1716Cb 0.64 -0.13 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1uyt h SER 1716CO 0.04 0.41 -0.68 0.03 -0.53 0.00 0.00 176.83 176.10 1uyt h ARG 1717N 0.72 0.72 -0.66 2.24 3.08 -1.06 -3.26 114.38 116.16 1uyt h ARG 1717Ca 0.30 -0.58 0.03 0.00 0.07 0.00 0.00 59.98 59.80 1uyt h ARG 1717Cb 0.26 0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 1uyt h ARG 1717CO -0.10 1.19 0.44 0.00 -1.07 0.00 0.00 179.97 180.43 1uyt h ALA 1718N 0.53 1.61 -0.85 0.04 0.00 0.05 -2.60 119.26 118.04 1uyt h ALA 1718Ca -0.04 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1uyt h ALA 1718Cb 1.32 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1uyt h ALA 1718CO 0.14 0.33 0.55 -0.92 0.00 0.00 0.00 179.25 179.36 1uyt h TYR 1719N 0.82 0.91 -0.08 0.00 5.03 -1.33 -0.26 116.97 122.05 1uyt h TYR 1719Ca 0.26 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.59 1uyt h TYR 1719Cb 0.03 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.01 1uyt h TYR 1719CO -0.00 0.44 0.00 0.72 -1.32 0.00 0.00 178.16 178.00 1uyt n HIS 1720N -4.51 0.10 0.01 -3.82 8.25 -0.98 -3.81 115.22 110.46 1uyt n HIS 1720Ca 0.14 -0.05 -0.02 0.00 -0.26 0.00 0.00 57.72 57.53 1uyt n HIS 1720Cb 0.28 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 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 0.04 0.63 -4.56 0.41 4.64 -0.55 -4.62 116.55 112.54 1uyt n ASP 1721Ca 0.17 0.09 -0.28 0.00 -1.38 0.00 0.00 54.79 53.39 1uyt n ASP 1721Cb 0.29 -0.21 -0.10 0.00 -1.04 0.00 0.00 41.12 40.07 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 -2.06 1.41 -0.05 5.18 -4.36 -0.22 -4.64 121.20 116.46 1uyt s ILE 1722Ca -0.03 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.06 1uyt s ILE 1722Cb 0.01 -2.63 -0.03 0.00 1.25 0.00 0.00 42.46 41.05 1uyt s ILE 1722CO 0.04 0.00 1.12 0.12 0.24 0.00 0.00 174.94 176.46 1uyt s PHE 1723N -2.95 3.36 0.04 1.37 5.36 -1.26 -4.28 117.98 119.63 1uyt s PHE 1723Ca 0.26 1.38 0.08 0.00 -0.96 0.00 0.00 56.93 57.69 1uyt s PHE 1723Cb 0.06 -3.32 -0.03 0.00 -0.34 0.00 0.00 43.02 39.40 1uyt s PHE 1723CO 0.13 -0.86 -0.22 0.95 -1.46 0.00 0.00 175.22 173.76 1uyt s THR 1724N 1.88 1.75 -0.07 0.12 -4.23 -1.26 -1.13 115.64 112.70 1uyt s THR 1724Ca 0.54 -1.23 -0.27 0.00 -1.18 0.00 0.00 61.69 59.55 1uyt s THR 1724Cb -0.23 -1.51 0.06 0.00 1.34 0.00 0.00 72.50 72.16 1uyt s THR 1724CO 0.22 0.24 0.61 -0.51 -0.54 0.00 0.00 174.62 174.64 1uyt s ILE 1725N -0.80 0.01 -0.01 2.99 2.07 -1.10 -4.23 121.20 120.13 1uyt s ILE 1725Ca 0.08 -0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.25 1uyt s ILE 1725Cb -0.09 -0.92 0.00 0.00 0.13 0.00 0.00 42.46 41.58 1uyt s ILE 1725CO 0.02 -0.04 -0.03 0.42 -1.91 0.00 0.00 174.94 173.39 1uyt s THR 1726N -1.03 0.30 -0.22 4.00 -4.23 -0.44 -1.14 115.64 112.88 1uyt s THR 1726Ca -0.10 -0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 60.23 1uyt s THR 1726Cb -0.01 -0.28 -0.02 0.00 1.34 0.00 0.00 72.50 73.53 1uyt s THR 1726CO 0.08 0.10 0.00 -0.22 -0.54 0.00 0.00 174.62 174.05 1uyt s LEU 1727N 0.13 3.20 -0.77 4.79 2.96 0.00 -0.58 118.68 128.42 1uyt s LEU 1727Ca -0.01 -0.25 -0.20 0.00 -0.22 0.00 0.00 54.13 53.45 1uyt s LEU 1727Cb -0.04 -1.82 0.11 0.00 0.50 0.00 0.00 46.19 44.94 1uyt s LEU 1727CO -0.00 0.02 0.97 -0.69 -1.32 0.00 0.00 176.35 175.32 1uyt s VAL 1728N 1.28 4.67 -1.40 1.68 1.01 -0.17 -0.62 120.40 126.85 1uyt s VAL 1728Ca 0.04 -1.13 0.26 0.00 0.00 0.00 0.00 61.98 61.15 1uyt s VAL 1728Cb -0.15 -4.67 0.17 0.00 0.00 0.00 0.00 36.38 31.73 1uyt s VAL 1728CO 0.01 -1.38 1.53 0.35 0.00 0.00 0.00 175.10 175.61 1uyt n THR 1729N 5.55 0.00 -2.77 3.92 -2.24 -0.63 -2.54 114.28 115.57 1uyt n THR 1729Ca 0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1uyt n THR 1729Cb 0.46 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1uyt n THR 1729CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uyt s ARG 1731N -0.72 2.32 -0.11 0.00 1.70 -1.26 -4.48 118.95 116.40 1uyt s ARG 1731Ca 0.00 1.42 -0.03 0.00 -0.47 0.00 0.00 55.73 56.65 1uyt s ARG 1731Cb 0.00 -1.89 0.04 0.00 -0.57 0.00 0.00 34.95 32.53 1uyt s ARG 1731CO 0.00 -1.63 0.04 0.45 -1.08 0.00 0.00 175.30 173.08 1uyt s SER 1732N -2.70 1.95 0.07 -2.89 0.15 -0.38 -1.40 113.70 108.51 1uyt s SER 1732Ca 0.67 -0.33 0.10 0.00 0.70 0.00 0.00 55.95 57.09 1uyt s SER 1732Cb -0.21 -0.37 -0.03 0.00 -1.71 0.00 0.00 66.02 63.69 1uyt s SER 1732CO 0.48 -0.26 -0.26 -0.69 1.20 0.00 0.00 173.24 173.71 1uyt s VAL 1733N 2.02 2.11 0.00 4.45 1.01 -1.25 -0.74 120.40 128.00 1uyt s VAL 1733Ca 0.03 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.52 1uyt s VAL 1733Cb -0.14 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1uyt s VAL 1733CO -0.06 0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1uyt n GLY 1734N 1.49 4.10 0.29 4.51 0.00 -0.09 -0.44 105.19 115.05 1uyt n GLY 1734Ca -0.17 0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.13 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 0.80 -0.70 -0.61 -0.00 -1.93 0.84 117.51 115.91 1uyt h ILE 1735Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 64.86 64.91 1uyt h ILE 1735Cb 0.00 0.96 -0.05 0.00 -0.00 0.00 0.00 36.82 37.73 1uyt h ILE 1735CO 0.00 0.00 0.41 1.23 -0.00 0.00 0.00 178.15 179.79 1uyt h GLY 1736N 0.00 1.02 1.24 8.18 0.00 -1.09 0.40 103.07 112.82 1uyt h GLY 1736Ca 0.03 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.93 1uyt h GLY 1736CO -0.00 0.21 -0.28 0.00 0.00 0.00 0.00 176.54 176.46 1uyt h ALA 1737N 1.34 0.75 -0.48 3.60 0.00 -0.94 -2.80 119.26 120.72 1uyt h ALA 1737Ca 0.30 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1uyt h ALA 1737Cb 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1uyt h ALA 1737CO -0.16 0.66 0.01 1.88 0.00 0.00 0.00 179.25 181.65 1uyt h TYR 1738N 0.73 0.84 -0.76 0.00 0.05 -0.74 -2.32 116.97 114.76 1uyt h TYR 1738Ca 0.08 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.74 1uyt h TYR 1738Cb 0.84 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 38.31 1uyt h TYR 1738CO 0.05 0.77 0.44 -0.07 -1.05 0.00 0.00 178.16 178.29 1uyt h LEU 1739N 0.74 0.92 0.15 3.88 3.38 -0.76 0.60 115.31 124.22 1uyt h LEU 1739Ca 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1uyt h LEU 1739Cb 0.43 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1uyt h LEU 1739CO 0.02 0.73 -0.07 0.58 0.09 0.00 0.00 178.44 179.78 1uyt h VAL 1740N 1.05 0.87 -0.09 1.22 2.07 -1.18 -1.23 116.25 118.97 1uyt h VAL 1740Ca 0.27 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1uyt h VAL 1740Cb -0.01 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1uyt h VAL 1740CO -0.05 0.02 0.01 -0.09 0.02 0.00 0.00 177.57 177.48 1uyt h ARG 1741N -0.24 0.14 -0.24 1.57 9.65 -0.95 -3.05 114.38 121.27 1uyt h ARG 1741Ca -0.02 -0.04 0.07 0.00 -1.10 0.00 0.00 59.98 58.89 1uyt h ARG 1741Cb 0.19 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 1uyt h ARG 1741CO 0.03 0.37 0.20 -0.07 2.80 0.00 0.00 179.97 183.30 1uyt h LEU 1742N -0.10 0.00 -0.37 3.80 3.38 0.28 0.63 115.31 122.93 1uyt h LEU 1742Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1uyt h LEU 1742Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1uyt h LEU 1742CO 0.00 0.00 -0.07 0.61 0.09 0.00 0.00 178.44 179.07 1uyt n GLY 1743N -1.51 -0.71 5.00 0.83 0.00 -0.47 -4.41 105.19 103.91 1uyt n GLY 1743Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1uyt n GLY 1743CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1uyt n GLN 1744N -0.68 0.00 -2.16 1.61 1.13 0.22 -4.39 117.38 113.12 1uyt n GLN 1744Ca 0.17 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.81 1uyt n GLN 1744Cb 0.27 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.59 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 4.20 -0.05 -1.09 0.52 -1.26 -4.84 118.95 116.43 1uyt s ARG 1745Ca 0.00 2.00 -0.03 0.00 -0.52 0.00 0.00 55.73 57.19 1uyt s ARG 1745Cb 0.00 -3.89 0.03 0.00 0.52 0.00 0.00 34.95 31.61 1uyt s ARG 1745CO 0.00 -0.78 0.11 0.00 0.02 0.00 0.00 175.30 174.65 1uyt s ALA 1746N 3.76 -0.21 -0.19 2.13 0.00 -1.26 -1.33 121.76 124.65 1uyt s ALA 1746Ca 0.67 0.49 -0.04 0.00 0.00 0.00 0.00 51.96 53.08 1uyt s ALA 1746Cb -0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.48 1uyt s ALA 1746CO 0.24 -0.11 -0.04 0.42 0.00 0.00 0.00 175.76 176.27 1uyt s ILE 1747N 0.77 3.59 -0.19 0.00 1.01 0.25 0.14 121.20 126.78 1uyt s ILE 1747Ca -0.06 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.11 1uyt s ILE 1747Cb -0.08 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.77 1uyt s ILE 1747CO -0.03 0.45 -0.04 -1.58 0.00 0.00 0.00 174.94 173.74 1uyt s GLN 1748N 1.02 3.52 0.15 2.79 0.74 -0.88 -1.00 119.66 126.00 1uyt s GLN 1748Ca 0.01 -0.57 -0.30 0.00 0.05 0.00 0.00 55.36 54.54 1uyt s GLN 1748Cb -0.15 -2.97 -0.07 0.00 1.10 0.00 0.00 33.01 30.93 1uyt s GLN 1748CO 0.01 0.02 1.05 0.08 -0.55 0.00 0.00 175.29 175.89 1uyt s VAL 1749N 0.94 4.13 0.25 1.34 1.01 -1.05 -1.19 120.40 125.83 1uyt s VAL 1749Ca -0.00 1.80 -0.31 0.00 0.00 0.00 0.00 61.98 63.47 1uyt s VAL 1749Cb -0.15 -4.15 -0.13 0.00 0.00 0.00 0.00 36.38 31.96 1uyt s VAL 1749CO 0.01 0.29 1.53 -0.62 0.00 0.00 0.00 175.10 176.31 1uyt n GLU 1750N 2.59 2.40 0.00 2.72 1.02 0.13 -1.96 120.64 127.54 1uyt n GLU 1750Ca 0.03 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 1uyt n GLU 1750Cb 0.47 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.30 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 2.42 2.43 3.38 0.62 0.00 -1.26 -4.95 105.19 107.84 1uyt n GLY 1751Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.85 2.85 0.45 1.61 -1.52 -0.83 -4.94 119.66 116.43 1uyt s GLN 1752Ca 0.00 -1.06 -0.21 0.00 -1.95 0.00 0.00 55.36 52.14 1uyt s GLN 1752Cb 0.00 -3.75 -0.10 0.00 -0.22 0.00 0.00 33.01 28.94 1uyt s GLN 1752CO 0.00 -0.69 0.98 -1.25 -0.25 0.00 0.00 175.29 174.07 1uyt s PRO 1753N 1.56 4.09 -0.35 2.91 0.04 -1.26 -4.72 135.00 137.28 1uyt s PRO 1753Ca 0.02 1.18 -0.01 0.00 0.04 0.00 0.00 61.00 62.23 1uyt s PRO 1753Cb -0.19 -2.15 0.08 0.00 0.04 0.00 0.00 34.50 32.28 1uyt s PRO 1753CO 0.07 -0.15 0.09 0.42 0.04 0.00 0.00 177.00 177.47 1uyt s ILE 1754N -2.15 3.00 0.14 0.56 1.01 0.31 -1.24 121.20 122.82 1uyt s ILE 1754Ca 0.63 -1.82 0.01 0.00 0.00 0.00 0.00 60.65 59.47 1uyt s ILE 1754Cb -0.11 -2.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 1uyt s ILE 1754CO 0.16 -0.43 -0.02 0.27 0.00 0.00 0.00 174.94 174.92 1uyt s ILE 1755N 1.15 0.60 -0.26 2.92 -4.36 0.08 -3.98 121.20 117.35 1uyt s ILE 1755Ca 0.03 -1.95 -0.06 0.00 -0.26 0.00 0.00 60.65 58.41 1uyt s ILE 1755Cb -0.21 -1.94 -0.14 0.00 1.25 0.00 0.00 42.46 41.42 1uyt s ILE 1755CO -0.04 -0.63 -0.29 0.18 0.24 0.00 0.00 174.94 174.41 1uyt n LEU 1756N -0.15 2.42 -4.08 0.37 4.77 -1.26 -0.92 117.00 118.16 1uyt n LEU 1756Ca -0.09 0.11 -0.21 0.00 -0.03 0.00 0.00 56.01 55.79 1uyt n LEU 1756Cb 0.62 -0.84 -0.15 0.00 -2.33 0.00 0.00 43.42 40.73 1uyt n LEU 1756CO 0.32 0.74 -0.46 -0.89 -1.33 0.00 0.00 177.39 175.77 1uyt s THR 1757N -2.50 0.96 0.70 -5.08 2.01 -1.26 -3.87 115.64 106.60 1uyt s THR 1757Ca -0.36 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.01 1uyt s THR 1757Cb 0.12 -0.80 0.01 0.00 0.01 0.00 0.00 72.50 71.84 1uyt s THR 1757CO 0.53 0.27 1.06 -0.83 -0.69 0.00 0.00 174.62 174.96 1uyt s GLY 1758N -0.29 1.71 0.10 4.40 0.00 -1.26 -4.87 107.32 107.11 1uyt s GLY 1758Ca 0.05 0.14 -0.23 0.00 0.00 0.00 0.00 44.72 44.67 1uyt s GLY 1758CO -0.00 0.45 1.72 0.00 0.00 0.00 0.00 173.10 175.27 1uyt h ALA 1759N -0.67 -0.04 -0.74 3.20 0.00 -1.94 -0.98 119.26 118.08 1uyt h ALA 1759Ca -0.44 0.00 0.12 0.00 0.00 0.00 0.00 54.91 54.59 1uyt h ALA 1759Cb 1.21 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1uyt h ALA 1759CO 0.56 -0.53 0.35 -1.35 0.00 0.00 0.00 179.25 178.28 1uyt h PRO 1760N -0.07 0.54 -0.47 0.00 0.11 -1.93 0.27 132.00 130.46 1uyt h PRO 1760Ca 0.01 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.01 1uyt h PRO 1760Cb 0.08 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.05 1uyt h PRO 1760CO -0.04 0.36 -0.05 0.00 -0.21 0.00 0.00 178.00 178.06 1uyt h ALA 1761N 1.48 1.04 -0.18 -0.75 0.00 -1.87 -1.92 119.26 117.06 1uyt h ALA 1761Ca 0.39 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1uyt h ALA 1761Cb 0.49 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1uyt h ALA 1761CO -0.32 0.59 -0.65 0.82 0.00 0.00 0.00 179.25 179.69 1uyt h ILE 1762N 0.74 1.30 -0.46 0.00 2.04 0.04 -2.87 117.51 118.31 1uyt h ILE 1762Ca 0.13 -1.89 -0.00 0.00 1.00 0.00 0.00 64.86 64.10 1uyt h ILE 1762Cb 0.52 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1uyt h ILE 1762CO 0.03 0.60 0.28 0.78 0.00 0.00 0.00 178.15 179.83 1uyt h ASN 1763N 0.50 0.54 -0.26 1.72 -0.26 -0.31 -0.72 115.58 116.80 1uyt h ASN 1763Ca -0.02 -0.05 0.02 0.00 -0.56 0.00 0.00 56.30 55.69 1uyt h ASN 1763Cb 1.25 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 38.35 1uyt h ASN 1763CO 0.13 0.43 0.17 0.50 -1.06 0.00 0.00 177.43 177.61 1uyt h LYS 1764N 0.61 0.26 -0.08 0.81 3.64 -1.31 0.14 116.57 120.63 1uyt h LYS 1764Ca 0.16 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.40 1uyt h LYS 1764Cb -0.01 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1uyt h LYS 1764CO -0.03 0.17 -0.46 1.98 -2.27 0.00 0.00 179.45 178.84 1uyt h MET 1765N 0.27 0.46 -0.00 1.90 4.05 -1.10 -3.14 114.93 117.37 1uyt h MET 1765Ca 0.10 -0.38 0.00 0.00 -0.28 0.00 0.00 59.70 59.14 1uyt h MET 1765Cb 0.09 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1uyt h MET 1765CO -0.02 1.02 -0.00 1.28 0.23 0.00 0.00 176.91 179.42 1uyt n LEU 1766N -4.28 0.02 0.00 3.39 4.77 -0.36 -4.94 117.00 115.60 1uyt n LEU 1766Ca -0.08 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1uyt n LEU 1766Cb 0.58 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1uyt n LEU 1766CO 0.45 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1uyt n GLY 1767N 1.12 1.97 3.91 -0.72 0.00 0.42 -4.93 105.19 106.96 1uyt n GLY 1767Ca 0.20 -0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 1uyt n GLY 1767CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uyt s ARG 1768N 0.00 3.59 -0.94 1.61 1.70 -1.25 -4.69 118.95 118.97 1uyt s ARG 1768Ca 0.00 0.04 -0.24 0.00 -0.47 0.00 0.00 55.73 55.06 1uyt s ARG 1768Cb 0.00 -2.54 0.01 0.00 -0.57 0.00 0.00 34.95 31.85 1uyt s ARG 1768CO 0.00 0.05 1.65 -1.21 -1.08 0.00 0.00 175.30 174.71 1uyt s GLU 1769N -4.09 3.13 0.05 3.89 2.02 -1.26 -4.67 118.70 117.77 1uyt s GLU 1769Ca 0.45 -0.68 -0.12 0.00 0.02 0.00 0.00 54.97 54.64 1uyt s GLU 1769Cb -0.10 -5.14 -0.31 0.00 0.10 0.00 0.00 34.13 28.67 1uyt s GLU 1769CO 0.36 -2.68 1.08 0.28 0.02 0.00 0.00 175.26 174.31 1uyt h VAL 1770N 6.94 1.35 -2.19 2.63 2.07 -1.92 -3.47 116.25 121.67 1uyt h VAL 1770Ca 0.12 -2.76 -0.56 0.00 0.82 0.00 0.00 66.70 64.31 1uyt h VAL 1770Cb 1.02 2.93 -0.10 0.00 -1.52 0.00 0.00 31.29 33.62 1uyt h VAL 1770CO 1.33 0.82 -0.66 -0.31 0.02 0.00 0.00 177.57 178.77 1uyt s TYR 1771N -2.71 2.64 0.00 1.57 1.51 -1.26 -4.86 117.35 114.24 1uyt s TYR 1771Ca -0.07 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.74 1uyt s TYR 1771Cb 0.05 -1.18 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 1uyt s TYR 1771CO 0.92 0.63 0.00 0.25 -1.11 0.00 0.00 175.55 176.24 1uyt n THR 1772N -0.87 0.00 -4.00 -0.71 -2.24 -1.26 -4.89 114.28 100.31 1uyt n THR 1772Ca -0.06 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.61 1uyt n THR 1772Cb 0.59 -0.03 -0.12 0.00 -2.10 0.00 0.00 70.33 68.68 1uyt n THR 1772CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1uyt s SER 1773N -1.84 0.39 0.53 3.42 0.15 -1.26 -5.01 113.70 110.07 1uyt s SER 1773Ca 0.00 -0.42 0.34 0.00 0.70 0.00 0.00 55.95 56.58 1uyt s SER 1773Cb 0.00 0.06 1.57 0.00 -1.71 0.00 0.00 66.02 65.94 1uyt s SER 1773CO 0.00 -0.21 2.03 0.78 1.20 0.00 0.00 173.24 177.04 1uyt h ASN 1774N 4.91 0.00 0.40 5.45 2.35 -1.99 -2.29 115.58 124.41 1uyt h ASN 1774Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1uyt h ASN 1774Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1uyt h ASN 1774CO 0.43 0.00 0.00 -0.07 -1.65 0.00 0.00 177.43 176.14 1uyt h LEU 1775N 0.00 0.00 0.00 1.61 3.38 -1.94 0.17 115.31 118.53 1uyt h LEU 1775Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1uyt h LEU 1775Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1uyt h LEU 1775CO 0.00 0.00 -0.17 1.56 0.09 0.00 0.00 178.44 179.92 1uyt h GLN 1776N 0.00 0.00 0.00 1.13 4.20 -1.81 -2.43 115.11 116.21 1uyt h GLN 1776Ca 0.00 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 58.30 1uyt h GLN 1776Cb 0.20 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.91 1uyt h GLN 1776CO 0.00 0.00 -2.48 1.28 -0.67 0.00 0.00 178.83 176.96 1uyt n LEU 1777N -2.91 2.72 -1.53 1.46 4.32 0.43 -4.80 117.00 116.70 1uyt n LEU 1777Ca 0.04 -0.01 0.04 0.00 -0.02 0.00 0.00 56.01 56.05 1uyt n LEU 1777Cb 0.52 -0.89 0.03 0.00 -1.62 0.00 0.00 43.42 41.45 1uyt n LEU 1777CO 0.35 0.85 0.06 0.61 -1.22 0.00 0.00 177.39 178.04 1uyt n GLY 1778N 2.01 1.13 3.92 -0.72 0.00 -0.20 -4.90 105.19 106.43 1uyt n GLY 1778Ca -0.48 -0.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.10 1.71 0.41 -0.02 0.00 -0.91 -0.53 107.32 105.88 1uyt s GLY 1779Ca 0.34 -1.00 0.08 0.00 0.00 0.00 0.00 44.72 44.14 1uyt s GLY 1779CO -0.16 -0.34 2.04 -0.91 0.00 0.00 0.00 173.10 173.72 1uyt h THR 1780N -1.39 1.11 0.00 0.90 1.35 -1.87 -0.03 112.91 112.98 1uyt h THR 1780Ca -0.45 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1uyt h THR 1780Cb 1.27 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1uyt h THR 1780CO 0.49 0.12 0.04 0.00 -0.25 0.00 0.00 175.52 175.92 1uyt n GLN 1781N -4.45 0.00 0.01 4.72 0.00 -1.26 -1.32 117.38 115.09 1uyt n GLN 1781Ca 0.02 0.45 -0.02 0.00 0.00 0.00 0.00 57.00 57.45 1uyt n GLN 1781Cb 0.10 -1.54 -0.01 0.00 0.00 0.00 0.00 30.24 28.79 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 -1.45 1.14 0.25 -0.39 5.41 -0.12 -4.53 119.36 119.66 1uyt n ILE 1782Ca 0.00 0.32 0.12 0.00 1.00 0.00 0.00 62.75 64.19 1uyt n ILE 1782Cb 0.04 -1.69 0.62 0.00 -0.71 0.00 0.00 39.64 37.90 1uyt n ILE 1782CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1uyt h MET 1783N -0.21 0.00 0.11 0.38 2.86 -1.28 0.22 114.93 117.02 1uyt h MET 1783Ca 0.00 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.34 1uyt h MET 1783Cb 0.21 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1uyt h MET 1783CO 0.00 0.15 -1.49 -0.92 1.06 0.00 0.00 176.91 175.71 1uyt h TYR 1784N 0.00 0.43 0.00 -0.22 3.20 -1.41 0.22 116.97 119.19 1uyt h TYR 1784Ca -0.00 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.55 1uyt h TYR 1784Cb 0.54 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.79 1uyt h TYR 1784CO 0.00 1.35 0.00 -0.91 -1.64 0.00 0.00 178.16 176.96 1uyt h ASN 1785N 0.06 0.00 0.30 -2.11 4.21 -1.54 -3.22 115.58 113.28 1uyt h ASN 1785Ca -0.22 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.01 1uyt h ASN 1785Cb 2.00 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 39.22 1uyt h ASN 1785CO 0.16 0.00 -1.16 -1.13 -1.29 0.00 0.00 177.43 174.01 1uyt h ASN 1786N 0.00 0.68 0.00 5.81 -0.00 -0.59 -3.40 115.58 118.07 1uyt h ASN 1786Ca 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 56.30 55.68 1uyt h ASN 1786Cb 0.89 -0.21 0.00 0.00 -0.00 0.00 0.00 38.32 39.00 1uyt h ASN 1786CO 0.00 1.45 0.00 0.61 -0.00 0.00 0.00 177.43 179.49 1uyt n GLY 1787N 1.29 0.70 0.18 1.57 0.00 -1.02 -4.95 105.19 102.96 1uyt n GLY 1787Ca -0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 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 1.33 -3.59 1.61 2.07 -1.45 -3.42 116.25 112.80 1uyt h VAL 1788Ca 0.00 -2.18 -0.62 0.00 0.82 0.00 0.00 66.70 64.72 1uyt h VAL 1788Cb 0.00 2.46 -0.14 0.00 -1.52 0.00 0.00 31.29 32.09 1uyt h VAL 1788CO 0.00 0.66 -0.42 -0.44 0.02 0.00 0.00 177.57 177.39 1uyt s SER 1789N -7.09 6.19 0.05 0.57 0.01 0.64 -4.48 113.70 109.59 1uyt s SER 1789Ca -0.11 0.21 -0.14 0.00 1.31 0.00 0.00 55.95 57.22 1uyt s SER 1789Cb 0.06 -2.14 -0.31 0.00 0.21 0.00 0.00 66.02 63.83 1uyt s SER 1789CO 0.89 0.01 1.07 0.45 0.41 0.00 0.00 173.24 176.06 1uyt h HIS 1790N 7.59 0.93 -3.42 2.43 3.86 -0.56 -3.40 115.15 122.58 1uyt h HIS 1790Ca -0.37 -0.64 -0.40 0.00 -1.16 0.00 0.00 60.37 57.80 1uyt h HIS 1790Cb 1.17 -0.06 -0.14 0.00 1.06 0.00 0.00 27.41 29.44 1uyt h HIS 1790CO 0.68 1.48 -0.60 -0.51 0.86 0.00 0.00 177.93 179.85 1uyt s LEU 1791N -7.66 1.83 0.06 2.43 2.01 -1.15 -0.79 118.68 115.41 1uyt s LEU 1791Ca -0.08 -1.41 0.06 0.00 0.01 0.00 0.00 54.13 52.71 1uyt s LEU 1791Cb 0.05 -0.10 -0.03 0.00 0.01 0.00 0.00 46.19 46.12 1uyt s LEU 1791CO 0.93 -0.71 -0.17 0.28 1.01 0.00 0.00 176.35 177.68 1uyt s THR 1792N -3.57 1.40 0.04 5.49 -1.32 -1.26 -2.06 115.64 114.36 1uyt s THR 1792Ca 0.37 -1.24 0.03 0.00 -1.21 0.00 0.00 61.69 59.64 1uyt s THR 1792Cb 0.08 -1.27 -0.02 0.00 -1.51 0.00 0.00 72.50 69.78 1uyt s THR 1792CO 0.15 0.00 -0.10 0.00 -2.21 0.00 0.00 174.62 172.46 1uyt s ALA 1793N -0.98 0.83 0.18 11.08 0.00 -0.33 -4.89 121.76 127.64 1uyt s ALA 1793Ca 0.04 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1uyt s ALA 1793Cb -0.09 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1uyt s ALA 1793CO 0.02 0.11 1.40 -0.39 0.00 0.00 0.00 175.76 176.90 1uyt h VAL 1794N 4.56 1.52 -3.65 0.00 -1.51 -1.91 0.41 116.25 115.66 1uyt h VAL 1794Ca -0.36 -2.64 -0.08 0.00 -1.23 0.00 0.00 66.70 62.38 1uyt h VAL 1794Cb 1.19 2.46 -0.08 0.00 -2.13 0.00 0.00 31.29 32.73 1uyt h VAL 1794CO 0.43 0.77 -0.09 1.51 -1.23 0.00 0.00 177.57 178.96 1uyt s ASP 1795N -6.89 0.07 0.28 4.19 1.47 -1.26 -4.55 116.67 109.99 1uyt s ASP 1795Ca -0.02 -1.02 0.02 0.00 1.18 0.00 0.00 52.55 52.71 1uyt s ASP 1795Cb 0.11 0.62 0.61 0.00 -0.34 0.00 0.00 42.92 43.92 1uyt s ASP 1795CO 0.82 -1.22 1.80 0.44 0.68 0.00 0.00 175.17 177.69 1uyt h ASP 1796N 2.20 0.78 -0.65 2.11 3.32 -1.93 -1.44 116.42 120.80 1uyt h ASP 1796Ca -0.27 0.08 -0.08 0.00 0.02 0.00 0.00 57.03 56.78 1uyt h ASP 1796Cb 1.25 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.70 1uyt h ASP 1796CO 0.36 0.35 0.11 0.25 -1.72 0.00 0.00 179.24 178.58 1uyt h LEU 1797N 0.82 1.04 -1.36 1.55 6.46 -1.96 -0.02 115.31 121.84 1uyt h LEU 1797Ca 0.52 -0.24 -0.07 0.00 -0.12 0.00 0.00 57.88 57.96 1uyt h LEU 1797Cb 0.67 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.32 1uyt h LEU 1797CO -0.33 1.03 -0.32 0.00 -0.62 0.00 0.00 178.44 178.20 1uyt h ALA 1798N 1.09 1.46 -0.14 1.25 0.00 -1.72 -1.39 119.26 119.80 1uyt h ALA 1798Ca 0.20 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1uyt h ALA 1798Cb 0.43 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1uyt h ALA 1798CO 0.01 0.40 -0.19 0.78 0.00 0.00 0.00 179.25 180.26 1uyt h GLY 1799N 0.98 0.40 0.98 0.00 0.00 -0.38 -2.71 103.07 102.35 1uyt h GLY 1799Ca -0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 1uyt h GLY 1799CO 0.04 0.39 0.28 -2.08 0.00 0.00 0.00 176.54 175.18 1uyt h VAL 1800N -0.03 1.16 -0.88 4.60 2.07 -0.76 -2.29 116.25 120.13 1uyt h VAL 1800Ca 0.02 -0.39 0.07 0.00 0.82 0.00 0.00 66.70 67.22 1uyt h VAL 1800Cb 0.74 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.97 1uyt h VAL 1800CO 0.04 0.17 0.54 -0.33 0.02 0.00 0.00 177.57 178.01 1uyt h GLU 1801N 0.66 0.93 -0.21 1.57 5.08 -1.26 -0.28 114.58 121.07 1uyt h GLU 1801Ca 0.18 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 1uyt h GLU 1801Cb 0.02 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1uyt h GLU 1801CO -0.03 0.61 -0.29 0.87 -1.00 0.00 0.00 179.01 179.17 1uyt h LYS 1802N 0.95 0.42 -0.40 2.33 1.57 -1.23 0.10 116.57 120.31 1uyt h LYS 1802Ca 0.40 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.97 1uyt h LYS 1802Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1uyt h LYS 1802CO -0.20 0.67 0.09 0.82 -0.57 0.00 0.00 179.45 180.26 1uyt h ILE 1803N 0.37 1.23 -0.39 1.86 2.04 -0.67 0.12 117.51 122.07 1uyt h ILE 1803Ca 0.05 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1uyt h ILE 1803Cb 0.70 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1uyt h ILE 1803CO 0.05 0.28 0.13 0.58 0.00 0.00 0.00 178.15 179.19 1uyt h VAL 1804N 0.51 1.21 -0.64 1.67 2.07 -0.60 -1.10 116.25 119.38 1uyt h VAL 1804Ca 0.13 -0.68 -0.06 0.00 0.82 0.00 0.00 66.70 66.91 1uyt h VAL 1804Cb 0.33 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1uyt h VAL 1804CO 0.00 0.24 0.16 -0.08 0.02 0.00 0.00 177.57 177.92 1uyt h GLU 1805N 0.48 1.01 -0.51 1.57 4.81 -0.68 -2.39 114.58 118.87 1uyt h GLU 1805Ca 0.13 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1uyt h GLU 1805Cb 0.24 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1uyt h GLU 1805CO -0.01 0.91 0.23 2.35 -0.73 0.00 0.00 179.01 181.77 1uyt h TRP 1806N 0.94 0.75 0.00 0.92 2.91 -0.55 -2.36 115.95 118.55 1uyt h TRP 1806Ca 0.20 -0.04 -0.00 0.00 1.13 0.00 0.00 58.89 60.18 1uyt h TRP 1806Cb 0.35 -0.23 -0.00 0.00 -0.51 0.00 0.00 29.16 28.76 1uyt h TRP 1806CO 0.03 0.61 -0.01 0.52 -1.03 0.00 0.00 178.44 178.56 1uyt h MET 1807N 0.68 0.00 0.00 2.65 2.86 -0.96 -2.90 114.93 117.26 1uyt h MET 1807Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1uyt h MET 1807Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1uyt h MET 1807CO -0.02 0.01 0.00 -1.13 1.06 0.00 0.00 176.91 176.83 1uyt n SER 1808N -3.11 0.00 -0.31 1.22 3.41 -0.89 -1.12 113.62 112.83 1uyt n SER 1808Ca -0.01 0.38 0.10 0.00 -0.26 0.00 0.00 58.87 59.08 1uyt n SER 1808Cb 0.20 -0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 63.67 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 -1.44 0.00 -3.88 7.33 4.02 -1.09 -4.86 117.16 117.24 1uyt n TYR 1809Ca 0.04 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.59 1uyt n TYR 1809Cb 0.13 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.40 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 -2.46 5.43 0.61 -0.72 1.01 -0.27 -4.57 120.40 119.43 1uyt s VAL 1810Ca 0.14 -0.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.88 1uyt s VAL 1810Cb 0.16 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 1uyt s VAL 1810CO 0.60 0.39 1.33 -2.84 0.00 0.00 0.00 175.10 174.59 1uyt s PRO 1811N -1.72 2.78 0.43 2.72 0.02 -1.26 -4.61 135.00 133.35 1uyt s PRO 1811Ca 0.25 2.16 0.16 0.00 0.02 0.00 0.00 61.00 63.58 1uyt s PRO 1811Cb -0.13 -2.02 1.05 0.00 0.02 0.00 0.00 34.50 33.42 1uyt s PRO 1811CO 0.15 -1.45 1.92 0.00 -0.33 0.00 0.00 177.00 177.30 1uyt h ALA 1812N 0.92 2.11 -2.94 -1.55 0.00 -1.91 -3.44 119.26 112.45 1uyt h ALA 1812Ca -0.51 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1uyt h ALA 1812Cb 1.32 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.96 1uyt h ALA 1812CO 0.55 -0.31 0.13 -1.59 0.00 0.00 0.00 179.25 178.02 1uyt s LYS 1813N -5.41 1.43 -0.01 0.00 -2.85 -1.26 -4.56 119.74 107.08 1uyt s LYS 1813Ca -0.08 -0.77 -0.39 0.00 -1.00 0.00 0.00 55.97 53.73 1uyt s LYS 1813Cb 0.21 0.56 -0.19 0.00 -2.06 0.00 0.00 37.83 36.35 1uyt s LYS 1813CO 0.77 -0.63 1.21 -2.13 0.10 0.00 0.00 175.35 174.67 1uyt n ARG 1814N -0.38 0.42 -0.91 1.78 0.63 0.24 -1.63 116.66 116.82 1uyt n ARG 1814Ca -0.11 0.15 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 1uyt n ARG 1814Cb 0.63 -1.71 0.00 0.00 0.45 0.00 0.00 32.46 31.83 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 2.12 -1.77 -4.89 6.15 5.03 -1.26 -4.98 115.26 115.66 1uyt n ASN 1815Ca 0.20 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.36 1uyt n ASN 1815Cb 0.11 -1.09 0.02 0.00 -1.02 0.00 0.00 39.78 37.80 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 -0.46 3.34 0.82 3.52 -1.94 -0.64 -5.02 119.30 118.91 1uyt s MET 1816Ca 0.00 0.45 -0.13 0.00 -1.71 0.00 0.00 55.69 54.30 1uyt s MET 1816Cb 0.00 -2.17 0.09 0.00 2.01 0.00 0.00 34.83 34.76 1uyt s MET 1816CO 0.00 -0.60 1.20 -2.30 -0.01 0.00 0.00 175.02 173.32 1uyt n PRO 1817N -2.66 0.14 -2.02 2.03 -0.02 -1.26 -4.85 135.00 126.35 1uyt n PRO 1817Ca 0.05 0.12 -0.40 0.00 -2.02 0.00 0.00 63.50 61.25 1uyt n PRO 1817Cb 0.55 -2.44 -0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 -2.16 2.54 -0.85 -1.45 -7.23 -1.26 -4.64 120.40 105.36 1uyt s VAL 1818Ca 0.73 0.50 -0.25 0.00 -1.81 0.00 0.00 61.98 61.15 1uyt s VAL 1818Cb -0.29 -3.30 -0.04 0.00 0.56 0.00 0.00 36.38 33.31 1uyt s VAL 1818CO 0.51 0.08 1.94 -2.16 -0.31 0.00 0.00 175.10 175.16 1uyt s PRO 1819N -2.19 2.55 0.07 4.82 0.04 -1.26 -4.94 135.00 134.10 1uyt s PRO 1819Ca 0.56 -0.12 -0.31 0.00 0.04 0.00 0.00 61.00 61.17 1uyt s PRO 1819Cb -0.39 -4.94 -0.08 0.00 0.04 0.00 0.00 34.50 29.13 1uyt s PRO 1819CO 0.51 -3.28 1.54 0.42 0.04 0.00 0.00 177.00 176.23 1uyt s ILE 1820N 9.98 3.17 -0.32 0.56 -1.09 -1.26 -4.51 121.20 127.73 1uyt s ILE 1820Ca 0.70 0.69 -0.02 0.00 -2.23 0.00 0.00 60.65 59.79 1uyt s ILE 1820Cb -0.08 -3.44 0.11 0.00 -1.58 0.00 0.00 42.46 37.47 1uyt s ILE 1820CO 0.03 0.02 0.15 -0.22 -1.23 0.00 0.00 174.94 173.68 1uyt s LEU 1821N 2.11 1.23 0.13 2.97 2.96 -0.25 -4.85 118.68 122.99 1uyt s LEU 1821Ca 0.69 -1.68 -0.30 0.00 -0.22 0.00 0.00 54.13 52.63 1uyt s LEU 1821Cb -0.38 -0.54 -0.06 0.00 0.50 0.00 0.00 46.19 45.70 1uyt s LEU 1821CO 0.30 -0.39 0.94 -1.61 -1.32 0.00 0.00 176.35 174.27 1uyt s GLU 1822N 1.61 4.71 0.20 1.98 2.02 -1.26 -4.19 118.70 123.76 1uyt s GLU 1822Ca 0.12 1.42 0.00 0.00 0.02 0.00 0.00 54.97 56.54 1uyt s GLU 1822Cb -0.19 -3.36 0.00 0.00 0.10 0.00 0.00 34.13 30.69 1uyt s GLU 1822CO -0.23 0.27 0.03 0.25 0.02 0.00 0.00 175.26 175.61 1uyt n THR 1823N 2.56 0.00 -0.15 3.63 -2.24 -1.26 -5.02 114.28 111.80 1uyt n THR 1823Ca 0.01 -0.90 0.16 0.00 -2.27 0.00 0.00 64.05 61.05 1uyt n THR 1823Cb 0.49 0.09 0.52 0.00 -2.10 0.00 0.00 70.33 69.34 1uyt n THR 1823CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1uyt h LYS 1824N 0.00 0.36 -6.45 -0.78 2.10 -1.97 -3.36 116.57 106.47 1uyt h LYS 1824Ca -0.16 -0.02 -0.55 0.00 -2.00 0.00 0.00 60.65 57.93 1uyt h LYS 1824Cb 0.49 -0.08 -0.07 0.00 -0.90 0.00 0.00 32.23 31.66 1uyt h LYS 1824CO 0.26 0.24 1.05 0.34 -2.00 0.00 0.00 179.45 179.33 1uyt s ASP 1825N -5.96 6.24 0.71 7.07 3.68 -1.26 -5.00 116.67 122.15 1uyt s ASP 1825Ca -0.08 0.01 -0.02 0.00 2.13 0.00 0.00 52.55 54.60 1uyt s ASP 1825Cb 0.21 -2.55 0.12 0.00 -1.45 0.00 0.00 42.92 39.24 1uyt s ASP 1825CO 0.76 -1.68 0.99 0.42 0.13 0.00 0.00 175.17 175.79 1uyt s THR 1826N 5.63 2.19 0.26 1.71 -4.23 -1.26 -4.70 115.64 115.24 1uyt s THR 1826Ca 0.44 -0.56 0.07 0.00 -1.18 0.00 0.00 61.69 60.46 1uyt s THR 1826Cb -0.09 -2.64 -0.02 0.00 1.34 0.00 0.00 72.50 71.09 1uyt s THR 1826CO 0.22 0.00 1.60 4.11 -0.54 0.00 0.00 174.62 180.02 1uyt h TRP 1827N -0.52 0.20 -0.58 3.99 5.08 -1.95 -3.41 115.95 118.77 1uyt h TRP 1827Ca -0.38 -0.07 -0.53 0.00 1.08 0.00 0.00 58.89 58.99 1uyt h TRP 1827Cb 1.27 -0.04 -0.05 0.00 -3.00 0.00 0.00 29.16 27.34 1uyt h TRP 1827CO -0.15 0.70 1.77 -3.47 -1.28 0.00 0.00 178.44 176.00 1uyt n ASP 1828N -3.88 3.91 -3.57 0.11 4.64 -1.26 -4.25 116.55 112.26 1uyt n ASP 1828Ca -0.02 -2.80 -0.11 0.00 -1.38 0.00 0.00 54.79 50.48 1uyt n ASP 1828Cb 0.59 -1.70 -0.05 0.00 -1.04 0.00 0.00 41.12 38.92 1uyt n ASP 1828CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1uyt s ARG 1829N 5.21 0.66 0.93 -0.67 1.70 -1.26 -5.14 118.95 120.38 1uyt s ARG 1829Ca 0.60 0.13 -0.14 0.00 -0.47 0.00 0.00 55.73 55.85 1uyt s ARG 1829Cb 0.03 0.31 0.16 0.00 -0.57 0.00 0.00 34.95 34.88 1uyt s ARG 1829CO 0.10 -0.21 1.22 -2.14 -1.08 0.00 0.00 175.30 173.18 1uyt s PRO 1830N -1.25 0.92 -0.30 3.89 0.02 -1.26 -4.53 135.00 132.49 1uyt s PRO 1830Ca -0.02 -0.07 -0.12 0.00 0.02 0.00 0.00 61.00 60.80 1uyt s PRO 1830Cb -0.00 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 1uyt s PRO 1830CO 0.02 -2.28 0.24 0.08 -0.33 0.00 0.00 177.00 174.74 1uyt s VAL 1831N -3.57 5.27 0.00 3.83 1.01 -0.90 -4.93 120.40 121.11 1uyt s VAL 1831Ca 0.68 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1uyt s VAL 1831Cb -0.09 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.66 1uyt s VAL 1831CO 0.52 0.13 0.40 0.47 0.00 0.00 0.00 175.10 176.62 1uyt n ASP 1832N 5.14 0.00 -4.59 3.32 10.43 -0.12 -4.68 116.55 126.05 1uyt n ASP 1832Ca -0.12 0.47 -0.46 0.00 2.57 0.00 0.00 54.79 57.25 1uyt n ASP 1832Cb 0.51 -0.18 -0.02 0.00 1.84 0.00 0.00 41.12 43.27 1uyt n ASP 1832CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 1uyt n PHE 1833N -1.04 1.31 -3.80 1.24 7.35 -1.03 -4.95 117.46 116.53 1uyt n PHE 1833Ca 0.00 0.68 -0.13 0.00 -0.76 0.00 0.00 57.45 57.25 1uyt n PHE 1833Cb 0.00 -2.27 -0.13 0.00 0.35 0.00 0.00 39.48 37.43 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 -0.77 -0.01 0.90 -2.13 2.01 -1.26 -4.92 115.64 109.46 1uyt s THR 1834Ca 0.63 0.05 -0.11 0.00 0.31 0.00 0.00 61.69 62.57 1uyt s THR 1834Cb -0.74 -0.23 0.13 0.00 0.01 0.00 0.00 72.50 71.67 1uyt s THR 1834CO 0.57 0.02 1.10 -2.84 -0.69 0.00 0.00 174.62 172.78 1uyt s PRO 1835N 0.38 1.20 -0.16 4.92 0.02 -1.26 -5.07 135.00 135.02 1uyt s PRO 1835Ca -0.02 1.10 -0.06 0.00 0.02 0.00 0.00 61.00 62.03 1uyt s PRO 1835Cb -0.04 -1.78 0.07 0.00 0.02 0.00 0.00 34.50 32.77 1uyt s PRO 1835CO -0.02 -2.36 0.36 0.99 -0.33 0.00 0.00 177.00 175.64 1uyt s THR 1836N -2.80 -0.42 0.41 0.99 2.01 -1.26 -4.92 115.64 109.64 1uyt s THR 1836Ca 0.64 0.19 0.20 0.00 0.31 0.00 0.00 61.69 63.03 1uyt s THR 1836Cb -0.20 -0.56 0.41 0.00 0.01 0.00 0.00 72.50 72.15 1uyt s THR 1836CO 0.58 0.08 1.76 0.78 -0.69 0.00 0.00 174.62 177.13 1uyt h ASN 1837N 7.95 0.41 -0.76 3.53 2.35 -1.97 0.23 115.58 127.32 1uyt h ASN 1837Ca -0.21 0.08 -0.44 0.00 -0.55 0.00 0.00 56.30 55.18 1uyt h ASN 1837Cb 1.13 0.02 -0.18 0.00 0.05 0.00 0.00 38.32 39.34 1uyt h ASN 1837CO 0.17 0.06 0.52 0.47 -1.65 0.00 0.00 177.43 177.01 1uyt n ASP 1838N -4.61 6.74 -3.52 5.81 8.00 -1.26 -4.83 116.55 122.88 1uyt n ASP 1838Ca 0.26 -3.26 0.01 0.00 0.71 0.00 0.00 54.79 52.51 1uyt n ASP 1838Cb 0.94 -1.08 -0.05 0.00 -0.02 0.00 0.00 41.12 40.90 1uyt n ASP 1838CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1uyt s GLU 1839N -2.25 0.24 0.46 -1.24 2.12 0.07 -5.15 118.70 112.95 1uyt s GLU 1839Ca 0.44 0.48 -0.22 0.00 0.36 0.00 0.00 54.97 56.03 1uyt s GLU 1839Cb 0.33 0.16 -0.08 0.00 0.26 0.00 0.00 34.13 34.80 1uyt s GLU 1839CO -0.07 -0.06 1.10 0.95 -0.54 0.00 0.00 175.26 176.64 1uyt s THR 1840N 1.68 3.44 0.24 -1.70 -4.23 -1.26 -4.44 115.64 109.37 1uyt s THR 1840Ca -0.06 1.01 -0.07 0.00 -1.18 0.00 0.00 61.69 61.39 1uyt s THR 1840Cb -0.04 -3.48 -0.02 0.00 1.34 0.00 0.00 72.50 70.31 1uyt s THR 1840CO -0.15 -0.08 0.36 -0.72 -0.54 0.00 0.00 174.62 173.49 1uyt s TYR 1841N -1.71 0.72 -0.19 3.99 -0.85 -1.26 -5.03 117.35 113.03 1uyt s TYR 1841Ca 0.64 -1.02 -0.04 0.00 -0.52 0.00 0.00 57.07 56.13 1uyt s TYR 1841Cb -0.23 -0.10 -0.02 0.00 0.38 0.00 0.00 41.96 41.98 1uyt s TYR 1841CO 0.28 -0.89 -0.03 0.34 -1.52 0.00 0.00 175.55 173.74 1uyt s ASP 1842N -3.09 4.64 0.45 -0.18 -1.08 -1.26 -4.52 116.67 111.62 1uyt s ASP 1842Ca 0.29 -0.24 0.21 0.00 -0.52 0.00 0.00 52.55 52.29 1uyt s ASP 1842Cb 0.02 -1.78 1.20 0.00 -1.46 0.00 0.00 42.92 40.90 1uyt s ASP 1842CO 0.11 0.07 1.87 0.58 0.52 0.00 0.00 175.17 178.33 1uyt h VAL 1843N 5.42 0.65 -0.38 1.11 2.07 -1.99 0.15 116.25 123.28 1uyt h VAL 1843Ca -0.35 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.17 1uyt h VAL 1843Cb 1.18 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1uyt h VAL 1843CO 0.61 0.05 0.27 0.03 0.02 0.00 0.00 177.57 178.55 1uyt h ARG 1844N 0.28 0.05 -0.51 1.57 3.08 -1.94 0.78 114.38 117.68 1uyt h ARG 1844Ca 0.45 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.40 1uyt h ARG 1844Cb 1.29 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.31 1uyt h ARG 1844CO -0.13 0.03 -0.04 -1.49 -1.07 0.00 0.00 179.97 177.28 1uyt h TRP 1845N 0.05 0.96 -0.14 3.04 6.55 -0.87 -0.56 115.95 124.99 1uyt h TRP 1845Ca 0.18 -0.16 -0.13 0.00 0.95 0.00 0.00 58.89 59.73 1uyt h TRP 1845Cb 0.65 -0.25 -0.01 0.00 -0.86 0.00 0.00 29.16 28.69 1uyt h TRP 1845CO -0.00 0.89 -0.48 0.52 -1.05 0.00 0.00 178.44 178.32 1uyt h MET 1846N 0.81 0.36 0.30 0.49 2.86 -0.96 0.14 114.93 118.92 1uyt h MET 1846Ca 0.15 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1uyt h MET 1846Cb 0.54 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1uyt h MET 1846CO 0.03 0.76 -0.14 0.82 1.06 0.00 0.00 176.91 179.44 1uyt h ILE 1847N 0.29 0.27 -0.01 -1.22 2.04 -0.81 0.12 117.51 118.18 1uyt h ILE 1847Ca 0.02 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1uyt h ILE 1847Cb 0.95 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1uyt h ILE 1847CO 0.08 0.07 -0.22 -1.84 0.00 0.00 0.00 178.15 176.24 1uyt n GLU 1848N -5.04 2.00 0.00 2.37 0.28 -0.26 -0.80 120.64 119.18 1uyt n GLU 1848Ca -0.07 -0.64 0.00 0.00 -0.16 0.00 0.00 57.16 56.29 1uyt n GLU 1848Cb 0.21 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 31.98 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 0.92 1.00 2.91 -1.84 0.00 0.04 -3.98 105.19 104.22 1uyt n GLY 1849Ca 0.04 -2.10 -0.17 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.47 0.45 0.01 1.61 3.52 0.52 -4.24 118.95 119.34 1uyt s ARG 1850Ca 0.00 -0.10 -0.24 0.00 -0.13 0.00 0.00 55.73 55.26 1uyt s ARG 1850Cb 0.00 -0.49 -0.05 0.00 -1.56 0.00 0.00 34.95 32.85 1uyt s ARG 1850CO 0.00 0.01 0.73 -2.00 -0.81 0.00 0.00 175.30 173.23 1uyt s GLU 1851N 0.37 4.46 0.02 5.12 2.56 -1.26 -0.68 118.70 129.29 1uyt s GLU 1851Ca -0.04 0.98 0.00 0.00 0.00 0.00 0.00 54.97 55.92 1uyt s GLU 1851Cb -0.07 -3.39 -0.00 0.00 2.00 0.00 0.00 34.13 32.67 1uyt s GLU 1851CO -0.00 0.22 0.02 -2.37 -0.56 0.00 0.00 175.26 172.56 1uyt n THR 1852N 3.11 0.00 0.10 -1.70 5.66 0.28 -4.95 114.28 116.79 1uyt n THR 1852Ca -0.02 -0.14 -0.08 0.00 -3.05 0.00 0.00 64.05 60.76 1uyt n THR 1852Cb 0.51 0.07 -0.05 0.00 -1.55 0.00 0.00 70.33 69.31 1uyt n THR 1852CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1uyt h GLU 1853N 0.00 -0.33 0.00 1.09 4.39 -2.03 -3.23 114.58 114.47 1uyt h GLU 1853Ca -0.01 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1uyt h GLU 1853Cb 0.07 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1uyt h GLU 1853CO 0.02 -0.08 0.05 -1.13 -1.16 0.00 0.00 179.01 176.71 1uyt n SER 1854N -5.00 0.46 0.00 1.42 3.41 -1.26 -4.92 113.62 107.73 1uyt n SER 1854Ca -0.06 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.25 1uyt n SER 1854Cb 0.20 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 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 -1.31 0.17 3.04 5.00 0.00 -1.22 -5.07 105.19 105.80 1uyt n GLY 1855Ca -0.01 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.93 2.48 -0.48 1.61 5.36 -1.26 -0.55 117.98 123.20 1uyt s PHE 1856Ca 0.00 -1.53 -0.25 0.00 -0.96 0.00 0.00 56.93 54.19 1uyt s PHE 1856Cb 0.00 -1.72 0.03 0.00 -0.34 0.00 0.00 43.02 40.99 1uyt s PHE 1856CO 0.00 -0.74 0.92 -1.21 -1.46 0.00 0.00 175.22 172.73 1uyt s GLU 1857N 1.38 3.47 0.45 10.12 2.02 0.15 -4.96 118.70 131.33 1uyt s GLU 1857Ca 0.02 0.04 -0.24 0.00 0.02 0.00 0.00 54.97 54.81 1uyt s GLU 1857Cb -0.14 -3.96 -0.07 0.00 0.10 0.00 0.00 34.13 30.05 1uyt s GLU 1857CO -0.10 -1.28 1.27 0.71 0.02 0.00 0.00 175.26 175.88 1uyt s TYR 1858N 3.78 2.72 0.00 1.61 1.51 -1.26 -0.35 117.35 125.36 1uyt s TYR 1858Ca 0.35 1.44 0.00 0.00 -1.01 0.00 0.00 57.07 57.85 1uyt s TYR 1858Cb -0.11 -3.61 0.00 0.00 -0.11 0.00 0.00 41.96 38.13 1uyt s TYR 1858CO 0.24 -2.08 0.00 0.41 -1.11 0.00 0.00 175.55 173.01 1uyt n GLY 1859N 0.61 2.09 0.22 0.71 0.00 -1.26 -0.94 105.19 106.62 1uyt n GLY 1859Ca 0.06 -2.11 -0.07 0.00 0.00 0.00 0.00 46.02 43.90 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 0.62-10.31 0.99 5.85 -0.74 -3.44 115.31 108.29 1uyt h LEU 1860Ca 0.00 -0.07 -0.44 0.00 0.84 0.00 0.00 57.88 58.21 1uyt h LEU 1860Cb 0.00 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1uyt h LEU 1860CO 0.00 0.51 -0.35 -0.36 -0.34 0.00 0.00 178.44 177.90 1uyt s PHE 1861N -5.94 3.08 0.35 1.25 0.40 0.02 -4.69 117.98 112.46 1uyt s PHE 1861Ca -0.13 -0.23 -0.25 0.00 -0.60 0.00 0.00 56.93 55.71 1uyt s PHE 1861Cb 0.12 -2.00 -0.13 0.00 0.51 0.00 0.00 43.02 41.52 1uyt s PHE 1861CO 0.75 -0.02 0.83 -0.25 0.70 0.00 0.00 175.22 177.24 1uyt n ASP 1862N -1.63 0.45 -4.73 1.36 9.92 -0.14 -4.66 116.55 117.11 1uyt n ASP 1862Ca 0.00 1.06 -0.42 0.00 -0.53 0.00 0.00 54.79 54.91 1uyt n ASP 1862Cb 0.58 -1.22 -0.02 0.00 -0.64 0.00 0.00 41.12 39.81 1uyt n ASP 1862CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1uyt s LYS 1863N -1.63 4.12 -1.74 -1.24 2.20 -1.26 -2.20 119.74 118.00 1uyt s LYS 1863Ca 0.62 2.59 0.00 0.00 -0.36 0.00 0.00 55.97 58.81 1uyt s LYS 1863Cb -0.66 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 1uyt s LYS 1863CO 0.58 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 1uyt n GLY 1864N 3.13 1.27 0.00 5.54 0.00 -1.26 -4.86 105.19 109.00 1uyt n GLY 1864Ca 0.12 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.86 0.76 -4.66 1.61 3.41 -0.93 -4.93 113.62 108.02 1uyt n SER 1865Ca -0.18 -0.70 -0.43 0.00 -0.26 0.00 0.00 58.87 57.30 1uyt n SER 1865Cb 0.58 1.26 -0.02 0.00 -0.26 0.00 0.00 64.21 65.77 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 -3.04 2.97 -0.54 7.33 2.19 -1.26 -4.05 117.98 121.58 1uyt s PHE 1866Ca 0.03 1.11 0.01 0.00 0.33 0.00 0.00 56.93 58.41 1uyt s PHE 1866Cb 0.15 -3.45 0.14 0.00 -1.31 0.00 0.00 43.02 38.54 1uyt s PHE 1866CO 0.83 -1.45 0.31 0.12 1.83 0.00 0.00 175.22 176.86 1uyt s PHE 1867N 3.31 3.33 0.38 10.12 5.36 0.14 -4.95 117.98 135.67 1uyt s PHE 1867Ca 0.53 -2.97 -0.26 0.00 -0.96 0.00 0.00 56.93 53.27 1uyt s PHE 1867Cb -0.21 -2.98 -0.09 0.00 -0.34 0.00 0.00 43.02 39.40 1uyt s PHE 1867CO 0.14 -0.80 1.17 -2.00 -1.46 0.00 0.00 175.22 172.27 1uyt s GLU 1868N -0.06 4.14 0.08 10.12 2.12 -1.26 -0.95 118.70 132.88 1uyt s GLU 1868Ca 0.16 1.86 0.01 0.00 0.36 0.00 0.00 54.97 57.36 1uyt s GLU 1868Cb -0.23 -2.75 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 1uyt s GLU 1868CO -0.02 -0.25 -0.06 0.95 -0.54 0.00 0.00 175.26 175.34 1uyt s THR 1869N -1.38 0.56 -1.49 -1.70 -4.23 0.04 -4.79 115.64 102.65 1uyt s THR 1869Ca 0.55 -1.79 -0.05 0.00 -1.18 0.00 0.00 61.69 59.22 1uyt s THR 1869Cb -0.31 -1.50 0.02 0.00 1.34 0.00 0.00 72.50 72.05 1uyt s THR 1869CO 0.40 -0.84 0.50 0.18 -0.54 0.00 0.00 174.62 174.32 1uyt n LEU 1870N 0.19 -2.28 0.01 4.79 4.77 0.03 -4.37 117.00 120.13 1uyt n LEU 1870Ca -0.14 -0.26 0.10 0.00 -0.03 0.00 0.00 56.01 55.68 1uyt n LEU 1870Cb 0.60 -2.74 0.45 0.00 -2.33 0.00 0.00 43.42 39.41 1uyt n LEU 1870CO 0.28 0.16 0.84 -1.54 -1.33 0.00 0.00 177.39 175.81 1uyt n SER 1871N -2.40 0.08 -0.34 -1.43 3.41 -1.24 -3.00 113.62 108.70 1uyt n SER 1871Ca -0.10 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 1uyt n SER 1871Cb 0.61 -0.53 0.28 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.68 -0.37 3.22 5.00 0.00 -1.26 -4.85 105.19 107.61 1uyt n GLY 1872Ca 0.05 -0.48 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 1uyt n GLY 1872CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1uyt s TRP 1873N -2.45 1.46 -1.01 1.61 -0.00 -1.16 -4.01 118.94 113.37 1uyt s TRP 1873Ca 0.24 -0.44 -0.24 0.00 -0.00 0.00 0.00 56.10 55.66 1uyt s TRP 1873Cb 0.19 -0.81 0.03 0.00 -0.00 0.00 0.00 33.47 32.88 1uyt s TRP 1873CO 0.52 0.12 0.60 0.00 -0.00 0.00 0.00 176.95 178.18 1uyt n ALA 1874N 1.25 -2.53 0.37 5.86 0.00 -1.26 -4.77 120.51 119.43 1uyt n ALA 1874Ca -0.20 -0.47 0.03 0.00 0.00 0.00 0.00 53.44 52.80 1uyt n ALA 1874Cb 0.54 -1.86 0.19 0.00 0.00 0.00 0.00 19.45 18.31 1uyt n ALA 1874CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uyt n LYS 1875N -4.12 0.14 0.31 0.00 5.02 -1.26 -2.50 118.16 115.75 1uyt n LYS 1875Ca -0.15 0.14 0.19 0.00 -2.02 0.00 0.00 58.31 56.46 1uyt n LYS 1875Cb 0.54 -1.50 1.01 0.00 -0.02 0.00 0.00 35.03 35.07 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 1.12 0.00 -4.56 0.72 0.00 -1.91 -3.42 103.07 95.01 1uyt h GLY 1876Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1uyt h GLY 1876CO 0.00 0.00 -0.81 0.54 0.00 0.00 0.00 176.54 176.27 1uyt s VAL 1877N -4.21 1.33 -0.19 4.60 0.11 -1.04 -0.89 120.40 120.10 1uyt s VAL 1877Ca -0.04 -1.16 -0.03 0.00 -2.93 0.00 0.00 61.98 57.82 1uyt s VAL 1877Cb 0.13 -1.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.77 1uyt s VAL 1877CO 0.49 0.01 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.52 1uyt s VAL 1878N -0.94 3.34 -0.03 2.04 1.01 -0.51 -4.85 120.40 120.46 1uyt s VAL 1878Ca 0.03 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.57 1uyt s VAL 1878Cb -0.09 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 1uyt s VAL 1878CO 0.02 0.45 -0.26 -0.69 0.00 0.00 0.00 175.10 174.63 1uyt s VAL 1879N 1.11 2.05 -0.04 2.92 1.01 -1.26 -0.79 120.40 125.40 1uyt s VAL 1879Ca 0.01 -1.10 -0.26 0.00 0.00 0.00 0.00 61.98 60.64 1uyt s VAL 1879Cb -0.15 -1.71 0.08 0.00 0.00 0.00 0.00 36.38 34.61 1uyt s VAL 1879CO -0.01 0.58 1.16 0.61 0.00 0.00 0.00 175.10 177.43 1uyt n GLY 1880N 2.58 0.22 3.74 4.51 0.00 -1.00 -0.78 105.19 114.46 1uyt n GLY 1880Ca -0.16 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.01 2.67 0.38 1.61 1.81 -0.13 -0.86 118.95 122.42 1uyt s ARG 1881Ca 0.27 -1.08 -0.14 0.00 -1.72 0.00 0.00 55.73 53.06 1uyt s ARG 1881Cb -0.00 -2.46 0.06 0.00 -0.45 0.00 0.00 34.95 32.09 1uyt s ARG 1881CO -0.01 0.43 0.75 0.00 -0.68 0.00 0.00 175.30 175.79 1uyt n ALA 1882N -0.61 -1.68 -2.63 2.13 0.00 -0.57 0.24 120.51 117.38 1uyt n ALA 1882Ca -0.08 -1.21 -0.20 0.00 0.00 0.00 0.00 53.44 51.94 1uyt n ALA 1882Cb 0.56 0.97 -0.15 0.00 0.00 0.00 0.00 19.45 20.83 1uyt n ALA 1882CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1uyt s ARG 1883N -2.09 0.93 -0.33 0.00 0.52 -1.26 -1.06 118.95 115.67 1uyt s ARG 1883Ca 0.15 -0.48 -0.01 0.00 -0.52 0.00 0.00 55.73 54.88 1uyt s ARG 1883Cb -0.05 -0.90 0.07 0.00 0.52 0.00 0.00 34.95 34.59 1uyt s ARG 1883CO 0.11 0.24 0.04 -1.17 0.02 0.00 0.00 175.30 174.55 1uyt s LEU 1884N -0.44 4.30 -1.45 2.53 0.20 0.19 -0.97 118.68 123.04 1uyt s LEU 1884Ca 0.04 -1.59 -0.11 0.00 0.69 0.00 0.00 54.13 53.15 1uyt s LEU 1884Cb -0.05 -1.71 0.08 0.00 -0.43 0.00 0.00 46.19 44.08 1uyt s LEU 1884CO -0.00 -0.34 0.71 0.61 -0.29 0.00 0.00 176.35 177.04 1uyt n GLY 1885N 4.54 -0.49 0.04 7.98 0.00 -1.26 -0.63 105.19 115.38 1uyt n GLY 1885Ca -0.08 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.42 3.00 3.66 -0.02 0.00 -1.26 -4.76 105.19 104.39 1uyt n GLY 1886Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.84 3.98 0.46 -0.61 1.01 0.20 -1.09 121.20 122.31 1uyt s ILE 1887Ca 0.00 1.18 -0.20 0.00 0.00 0.00 0.00 60.65 61.63 1uyt s ILE 1887Cb 0.00 -3.78 -0.10 0.00 0.01 0.00 0.00 42.46 38.60 1uyt s ILE 1887CO 0.00 -0.12 0.98 -2.16 0.00 0.00 0.00 174.94 173.64 1uyt s PRO 1888N 3.78 4.04 0.11 2.79 0.04 -1.26 0.55 135.00 145.06 1uyt s PRO 1888Ca 0.63 1.16 -0.26 0.00 0.04 0.00 0.00 61.00 62.57 1uyt s PRO 1888Cb -0.26 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.20 1uyt s PRO 1888CO 0.21 -0.20 0.90 -0.48 0.04 0.00 0.00 177.00 177.47 1uyt s LEU 1889N -3.44 -0.26 0.14 -3.56 2.34 -0.22 -4.47 118.68 109.20 1uyt s LEU 1889Ca 0.63 -0.27 -0.13 0.00 0.06 0.00 0.00 54.13 54.42 1uyt s LEU 1889Cb -0.11 2.18 -0.07 0.00 -0.56 0.00 0.00 46.19 47.64 1uyt s LEU 1889CO 0.18 -0.85 0.52 -0.83 -1.06 0.00 0.00 176.35 174.31 1uyt s GLY 1890N -2.79 2.41 -0.01 -3.48 0.00 0.63 -1.51 107.32 102.57 1uyt s GLY 1890Ca 0.09 -0.21 0.04 0.00 0.00 0.00 0.00 44.72 44.65 1uyt s GLY 1890CO -0.02 0.04 -0.14 0.14 0.00 0.00 0.00 173.10 173.12 1uyt s VAL 1891N -1.50 1.12 -0.08 1.40 1.01 -0.04 -1.71 120.40 120.61 1uyt s VAL 1891Ca 0.38 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 1uyt s VAL 1891Cb -0.14 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.32 1uyt s VAL 1891CO 0.19 0.30 -0.02 -0.63 0.00 0.00 0.00 175.10 174.94 1uyt s ILE 1892N -0.36 0.58 0.46 2.22 1.01 -0.73 -2.37 121.20 122.00 1uyt s ILE 1892Ca 0.05 -0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.73 1uyt s ILE 1892Cb -0.06 -0.68 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 1uyt s ILE 1892CO -0.00 0.29 0.02 -0.83 0.00 0.00 0.00 174.94 174.42 1uyt s GLY 1893N 1.80 2.72 -0.15 6.18 0.00 0.03 -0.95 107.32 116.95 1uyt s GLY 1893Ca 0.03 -1.45 0.01 0.00 0.00 0.00 0.00 44.72 43.31 1uyt s GLY 1893CO -0.06 -2.13 -0.16 0.14 0.00 0.00 0.00 173.10 170.89 1uyt s VAL 1894N -2.78 2.62 -0.05 1.40 1.01 -1.26 -1.42 120.40 119.93 1uyt s VAL 1894Ca 0.23 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 1uyt s VAL 1894Cb 0.06 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 1uyt s VAL 1894CO 0.12 0.52 1.35 -0.70 0.00 0.00 0.00 175.10 176.38 1uyt s GLU 1895N 0.76 4.28 -0.07 2.72 2.56 -0.07 -4.61 118.70 124.27 1uyt s GLU 1895Ca -0.06 1.86 0.06 0.00 0.00 0.00 0.00 54.97 56.82 1uyt s GLU 1895Cb -0.15 -3.63 -0.24 0.00 2.00 0.00 0.00 34.13 32.10 1uyt s GLU 1895CO 0.01 -0.58 0.57 0.25 -0.56 0.00 0.00 175.26 174.94 1uyt n THR 1896N 4.83 1.68 -2.38 -1.70 -2.24 -1.26 -2.86 114.28 110.35 1uyt n THR 1896Ca 0.13 -0.75 -0.41 0.00 -2.27 0.00 0.00 64.05 60.76 1uyt n THR 1896Cb 0.44 -1.30 -0.04 0.00 -2.10 0.00 0.00 70.33 67.34 1uyt n THR 1896CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1uyt s ARG 1897N -2.59 4.55 0.42 -0.78 0.52 -1.26 -3.93 118.95 115.88 1uyt s ARG 1897Ca -0.11 1.91 -0.26 0.00 -0.52 0.00 0.00 55.73 56.75 1uyt s ARG 1897Cb 0.07 -3.17 -0.10 0.00 0.52 0.00 0.00 34.95 32.28 1uyt s ARG 1897CO 0.81 0.07 1.47 2.41 0.02 0.00 0.00 175.30 180.07 1uyt n THR 1898N 1.33 2.45 -3.84 0.02 -1.04 -1.26 -4.40 114.28 107.54 1uyt n THR 1898Ca 0.00 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.05 61.15 1uyt n THR 1898Cb 0.44 -1.92 -0.07 0.00 -1.82 0.00 0.00 70.33 66.96 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 -1.16 5.42 -0.94 12.58 1.01 -0.47 -4.93 120.40 131.90 1uyt s VAL 1899Ca 0.58 0.18 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 1uyt s VAL 1899Cb -0.46 -3.40 0.24 0.00 0.00 0.00 0.00 36.38 32.76 1uyt s VAL 1899CO 0.60 0.55 0.89 -1.61 0.00 0.00 0.00 175.10 175.53 1uyt s GLU 1900N -0.46 3.73 -0.57 2.72 0.41 -1.26 -1.12 118.70 122.14 1uyt s GLU 1900Ca 0.12 -2.92 -0.25 0.00 -0.41 0.00 0.00 54.97 51.51 1uyt s GLU 1900Cb -0.12 -4.35 0.04 0.00 -1.78 0.00 0.00 34.13 27.92 1uyt s GLU 1900CO 0.02 -1.26 1.02 1.21 -0.49 0.00 0.00 175.26 175.76 1uyt s ASN 1901N 1.32 6.35 -0.29 -0.19 2.47 0.23 -4.88 114.94 119.95 1uyt s ASN 1901Ca 0.25 -0.28 -0.19 0.00 0.42 0.00 0.00 52.86 53.05 1uyt s ASN 1901Cb -0.10 -2.47 -0.01 0.00 -1.45 0.00 0.00 41.25 37.21 1uyt s ASN 1901CO -0.09 -1.33 0.59 -0.22 -3.72 0.00 0.00 177.10 172.33 1uyt s LEU 1902N 4.29 4.13 -0.25 3.21 2.96 -1.26 0.00 118.68 131.75 1uyt s LEU 1902Ca 0.33 0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 54.59 1uyt s LEU 1902Cb -0.11 -2.75 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1uyt s LEU 1902CO 0.20 -0.41 0.14 -0.63 -1.32 0.00 0.00 176.35 174.33 1uyt s ILE 1903N 2.49 5.00 0.88 6.68 1.01 0.15 -5.00 121.20 132.41 1uyt s ILE 1903Ca 0.24 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.84 1uyt s ILE 1903Cb -0.15 -3.35 0.12 0.00 0.01 0.00 0.00 42.46 39.09 1uyt s ILE 1903CO 0.11 0.31 1.13 -2.84 0.00 0.00 0.00 174.94 173.65 1uyt s PRO 1904N 1.45 1.33 0.39 2.79 0.02 -1.26 -1.38 135.00 138.34 1uyt s PRO 1904Ca 0.07 1.46 -0.20 0.00 0.02 0.00 0.00 61.00 62.35 1uyt s PRO 1904Cb -0.15 -1.77 -0.10 0.00 0.02 0.00 0.00 34.50 32.50 1uyt s PRO 1904CO 0.07 -2.38 0.88 0.00 -0.33 0.00 0.00 177.00 175.24 1uyt s ALA 1905N -2.71 3.14 -0.57 -1.55 0.00 -1.26 -4.73 121.76 114.08 1uyt s ALA 1905Ca 0.65 0.30 -0.28 0.00 0.00 0.00 0.00 51.96 52.63 1uyt s ALA 1905Cb -0.21 -3.04 0.03 0.00 0.00 0.00 0.00 23.12 19.90 1uyt s ALA 1905CO 0.57 0.20 1.19 0.34 0.00 0.00 0.00 175.76 178.06 1uyt s ASP 1906N -2.15 6.47 0.62 0.00 2.15 -1.26 -4.90 116.67 117.60 1uyt s ASP 1906Ca 0.58 0.16 0.27 0.00 0.43 0.00 0.00 52.55 53.99 1uyt s ASP 1906Cb -0.10 -2.55 1.34 0.00 -0.30 0.00 0.00 42.92 41.31 1uyt s ASP 1906CO 0.15 -1.46 1.76 -0.65 -0.17 0.00 0.00 175.17 174.81 1uyt h PRO 1907N 9.51 0.00 -0.01 4.34 0.11 -1.94 0.26 132.00 144.27 1uyt h PRO 1907Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 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 1.18 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 178.85 1uyt n ALA 1908N -2.13 2.82 -4.02 -0.75 0.00 -1.26 -4.66 120.51 110.50 1uyt n ALA 1908Ca 0.06 -0.38 -0.31 0.00 0.00 0.00 0.00 53.44 52.82 1uyt n ALA 1908Cb 0.71 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.80 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 -2.29 4.69 0.20 0.00 3.04 0.92 -4.96 114.94 116.53 1uyt s ASN 1909Ca 0.31 -2.01 0.12 0.00 0.04 0.00 0.00 52.86 51.32 1uyt s ASN 1909Cb 0.20 -1.59 0.64 0.00 -1.54 0.00 0.00 41.25 38.96 1uyt s ASN 1909CO 0.44 -0.35 1.32 -2.65 -3.04 0.00 0.00 177.10 172.82 1uyt n PRO 1910N 4.30 0.08 -0.08 0.43 -0.02 -1.26 -1.31 135.00 137.14 1uyt n PRO 1910Ca 0.01 0.55 -0.06 0.00 -2.02 0.00 0.00 63.50 61.98 1uyt n PRO 1910Cb 0.42 -1.83 -0.15 0.00 -0.02 0.00 0.00 33.50 31.91 1uyt n PRO 1910CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1uyt n ASN 1911N -1.91 0.29 -4.68 2.55 2.85 -1.26 -4.99 115.26 108.11 1uyt n ASN 1911Ca -0.01 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.08 1uyt n ASN 1911Cb 0.10 1.14 0.06 0.00 1.24 0.00 0.00 39.78 42.32 1uyt n ASN 1911CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1uyt n SER 1912N -2.62 1.69 -4.00 1.20 3.41 -0.42 -5.02 113.62 107.85 1uyt n SER 1912Ca -0.26 0.86 -0.09 0.00 -0.26 0.00 0.00 58.87 59.12 1uyt n SER 1912Cb 1.02 -1.49 -0.11 0.00 -0.26 0.00 0.00 64.21 63.37 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 -1.41 0.18 0.12 7.33 0.00 -1.26 -4.71 121.76 122.02 1uyt s ALA 1913Ca 0.77 -0.71 -0.34 0.00 0.00 0.00 0.00 51.96 51.69 1uyt s ALA 1913Cb -0.41 0.18 -0.13 0.00 0.00 0.00 0.00 23.12 22.76 1uyt s ALA 1913CO 0.45 -0.21 1.63 -1.91 0.00 0.00 0.00 175.76 175.73 1uyt n GLU 1914N 1.25 2.19 -4.83 0.00 2.13 -1.26 -4.54 120.64 115.58 1uyt n GLU 1914Ca -0.22 0.79 -0.28 0.00 0.66 0.00 0.00 57.16 58.11 1uyt n GLU 1914Cb 0.56 -2.58 -0.15 0.00 0.27 0.00 0.00 31.44 29.55 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 1.45 1.95 -0.16 6.31 2.01 -0.48 -4.97 115.64 121.74 1uyt s THR 1915Ca 0.81 -1.30 -0.00 0.00 0.31 0.00 0.00 61.69 61.51 1uyt s THR 1915Cb -0.67 -1.67 -0.00 0.00 0.01 0.00 0.00 72.50 70.16 1uyt s THR 1915CO 0.40 0.32 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.29 1uyt s LEU 1916N -1.17 2.57 -0.12 4.42 2.96 -1.26 0.30 118.68 126.37 1uyt s LEU 1916Ca 0.10 -0.44 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1uyt s LEU 1916Cb -0.09 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 1uyt s LEU 1916CO 0.02 0.08 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.37 1uyt s ILE 1917N 0.87 3.11 -0.13 6.68 1.01 0.10 -4.97 121.20 127.87 1uyt s ILE 1917Ca -0.04 -0.65 -0.20 0.00 0.00 0.00 0.00 60.65 59.77 1uyt s ILE 1917Cb -0.15 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 1uyt s ILE 1917CO -0.01 0.53 0.56 -1.10 0.00 0.00 0.00 174.94 174.93 1uyt s GLN 1918N 0.20 4.32 -0.34 2.79 -1.52 -1.26 -0.60 119.66 123.24 1uyt s GLN 1918Ca -0.07 0.57 0.04 0.00 -1.95 0.00 0.00 55.36 53.94 1uyt s GLN 1918Cb -0.15 -3.48 0.10 0.00 -0.22 0.00 0.00 33.01 29.26 1uyt s GLN 1918CO 0.05 0.02 0.06 -1.21 -0.25 0.00 0.00 175.29 173.96 1uyt s GLU 1919N 1.04 1.41 0.27 2.91 2.02 -0.28 -4.97 118.70 121.10 1uyt s GLU 1919Ca 0.29 -1.81 -0.31 0.00 0.02 0.00 0.00 54.97 53.16 1uyt s GLU 1919Cb -0.16 -3.08 -0.12 0.00 0.10 0.00 0.00 34.13 30.86 1uyt s GLU 1919CO 0.12 -0.95 1.53 -2.30 0.02 0.00 0.00 175.26 173.67 1uyt n PRO 1920N 4.28 2.43 -0.91 0.39 -0.02 -1.26 -1.37 135.00 138.55 1uyt n PRO 1920Ca 0.03 0.87 -0.30 0.00 -2.02 0.00 0.00 63.50 62.08 1uyt n PRO 1920Cb 0.42 -2.60 0.18 0.00 -0.02 0.00 0.00 33.50 31.47 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 1.61 -1.36 -1.23 0.00 -1.25 -3.34 107.32 102.19 1uyt s GLY 1921Ca 0.66 0.06 0.00 0.00 0.00 0.00 0.00 44.72 45.44 1uyt s GLY 1921CO 0.48 0.60 0.00 -1.06 0.00 0.00 0.00 173.10 173.12 1uyt n GLN 1922N -4.26 -1.91 -3.78 2.90 6.02 -1.13 -4.89 117.38 110.33 1uyt n GLN 1922Ca 0.07 0.77 -0.20 0.00 -0.01 0.00 0.00 57.00 57.62 1uyt n GLN 1922Cb 0.54 -5.32 -0.17 0.00 1.02 0.00 0.00 30.24 26.31 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 -2.67 0.13 0.13 5.09 1.01 -1.21 0.15 120.40 123.04 1uyt s VAL 1923Ca 0.00 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1uyt s VAL 1923Cb 0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 36.38 36.00 1uyt s VAL 1923CO 0.00 0.19 1.07 0.26 0.00 0.00 0.00 175.10 176.62 1uyt s TRP 1924N 1.76 3.63 0.35 5.22 0.51 -0.33 -4.88 118.94 125.20 1uyt s TRP 1924Ca 0.01 1.62 0.07 0.00 -2.12 0.00 0.00 56.10 55.67 1uyt s TRP 1924Cb -0.13 -3.23 -0.07 0.00 -0.81 0.00 0.00 33.47 29.24 1uyt s TRP 1924CO -0.03 -0.44 -0.02 -1.01 -0.51 0.00 0.00 176.95 174.94 1uyt s HIS 1925N 0.09 2.25 0.20 -1.98 3.76 -1.26 -1.33 115.29 117.01 1uyt s HIS 1925Ca 0.50 -0.71 -0.18 0.00 -0.15 0.00 0.00 55.06 54.53 1uyt s HIS 1925Cb -0.27 -1.44 0.19 0.00 1.11 0.00 0.00 32.58 32.17 1uyt s HIS 1925CO 0.32 0.34 1.59 -1.35 -0.85 0.00 0.00 174.74 174.79 1uyt h PRO 1926N 2.01 -0.10 0.02 8.40 0.11 -1.89 0.17 132.00 140.72 1uyt h PRO 1926Ca -0.42 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 1uyt h PRO 1926Cb 1.24 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1uyt h PRO 1926CO 0.73 -0.06 -0.01 -2.95 -0.21 0.00 0.00 178.00 175.50 1uyt h ASN 1927N -0.10 -0.02 -0.04 -2.05 -1.07 -1.96 -0.69 115.58 109.64 1uyt h ASN 1927Ca 0.28 -0.15 -0.05 0.00 0.07 0.00 0.00 56.30 56.45 1uyt h ASN 1927Cb 0.56 0.01 -0.01 0.00 -2.07 0.00 0.00 38.32 36.80 1uyt h ASN 1927CO -0.75 0.14 -0.11 0.77 0.07 0.00 0.00 177.43 177.55 1uyt h SER 1928N -0.18 0.30 -0.29 6.14 4.64 -1.71 -0.18 113.55 122.27 1uyt h SER 1928Ca -0.00 -0.06 -0.16 0.00 -0.47 0.00 0.00 61.79 61.09 1uyt h SER 1928Cb 0.17 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1uyt h SER 1928CO 0.00 0.45 -0.46 0.00 -0.87 0.00 0.00 176.83 175.95 1uyt h ALA 1929N 1.59 0.45 -0.62 5.18 0.00 -0.58 -2.08 119.26 123.20 1uyt h ALA 1929Ca 0.06 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.50 1uyt h ALA 1929Cb 0.38 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1uyt h ALA 1929CO 0.02 0.60 0.41 0.35 0.00 0.00 0.00 179.25 180.62 1uyt h PHE 1930N 0.59 0.77 -0.27 0.00 -0.00 -0.28 -2.11 116.94 115.64 1uyt h PHE 1930Ca 0.03 0.02 -0.07 0.00 -0.00 0.00 0.00 57.97 57.94 1uyt h PHE 1930Cb 1.06 -0.26 -0.02 0.00 -0.00 0.00 0.00 35.95 36.74 1uyt h PHE 1930CO 0.07 0.48 -0.13 -0.22 -0.00 0.00 0.00 178.31 178.51 1uyt h LYS 1931N 0.83 0.46 -0.33 1.11 3.64 -0.97 -0.10 116.57 121.21 1uyt h LYS 1931Ca 0.23 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 1uyt h LYS 1931Cb -0.08 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1uyt h LYS 1931CO -0.06 0.59 -0.25 1.15 -2.27 0.00 0.00 179.45 178.61 1uyt h THR 1932N 0.42 1.29 -0.54 1.00 2.02 -1.04 0.22 112.91 116.29 1uyt h THR 1932Ca 0.08 -1.41 -0.08 0.00 0.77 0.00 0.00 66.41 65.77 1uyt h THR 1932Cb 0.49 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1uyt h THR 1932CO 0.03 0.46 0.02 0.00 0.37 0.00 0.00 175.52 176.39 1uyt h ALA 1933N 0.74 0.72 0.41 6.16 0.00 -1.09 -0.89 119.26 125.31 1uyt h ALA 1933Ca 0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1uyt h ALA 1933Cb 0.82 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1uyt h ALA 1933CO 0.07 0.53 -0.20 0.37 0.00 0.00 0.00 179.25 180.02 1uyt h GLN 1934N 0.82 -0.53 -0.51 0.00 5.75 -0.87 -1.11 115.11 118.66 1uyt h GLN 1934Ca 0.16 0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.79 1uyt h GLN 1934Cb 0.51 0.12 -0.10 0.00 1.07 0.00 0.00 27.48 29.08 1uyt h GLN 1934CO 0.02 -0.34 -0.15 0.00 -2.65 0.00 0.00 178.83 175.72 1uyt h ALA 1935N 0.02 0.31 -0.11 3.38 0.00 -0.42 0.94 119.26 123.37 1uyt h ALA 1935Ca -0.06 0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.09 1uyt h ALA 1935Cb 0.43 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1uyt h ALA 1935CO 0.09 -0.46 -0.13 0.82 0.00 0.00 0.00 179.25 179.57 1uyt h ILE 1936N -0.02 0.65 -0.43 0.00 2.04 -0.87 -0.53 117.51 118.36 1uyt h ILE 1936Ca 0.24 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.12 1uyt h ILE 1936Cb 0.40 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1uyt h ILE 1936CO -0.54 0.00 0.27 0.78 0.00 0.00 0.00 178.15 178.66 1uyt h ASN 1937N -0.16 0.45 0.41 1.72 2.35 -0.29 -1.01 115.58 119.05 1uyt h ASN 1937Ca 0.08 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1uyt h ASN 1937Cb 0.28 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 1uyt h ASN 1937CO -0.21 0.32 -0.05 0.44 -1.65 0.00 0.00 177.43 176.28 1uyt h ASP 1938N 0.54 0.00 0.50 5.81 3.32 -0.48 0.44 116.42 126.56 1uyt h ASP 1938Ca 0.16 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.92 1uyt h ASP 1938Cb -0.03 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.54 1uyt h ASP 1938CO -0.05 0.05 -1.31 -0.26 -1.72 0.00 0.00 179.24 175.95 1uyt h PHE 1939N 0.00 0.66 0.06 4.55 0.05 -0.30 -3.38 116.94 118.59 1uyt h PHE 1939Ca -0.00 -0.48 -0.00 0.00 3.82 0.00 0.00 57.97 61.31 1uyt h PHE 1939Cb 0.27 -0.03 0.00 0.00 2.00 0.00 0.00 35.95 38.19 1uyt h PHE 1939CO 0.00 1.37 -0.03 -0.97 -0.18 0.00 0.00 178.31 178.50 1uyt h ASN 1940N 0.11 -0.07 -3.39 2.17 -1.24 -0.13 -1.03 115.58 111.99 1uyt h ASN 1940Ca -0.17 -0.29 -0.52 0.00 0.71 0.00 0.00 56.30 56.02 1uyt h ASN 1940Cb 2.02 0.02 0.01 0.00 0.73 0.00 0.00 38.32 41.10 1uyt h ASN 1940CO 0.23 0.55 0.56 0.20 -1.29 0.00 0.00 177.43 177.67 1uyt s ASN 1941N -5.64 7.09 0.00 1.15 -0.87 0.15 -2.27 114.94 114.55 1uyt s ASN 1941Ca -0.07 2.17 0.00 0.00 -1.57 0.00 0.00 52.86 53.39 1uyt s ASN 1941Cb -0.01 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.63 1uyt s ASN 1941CO 0.26 -0.40 0.00 0.61 -2.57 0.00 0.00 177.10 175.00 1uyt n GLY 1942N 2.51 0.61 0.23 0.66 0.00 -1.25 -4.28 105.19 103.67 1uyt n GLY 1942Ca 0.06 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 0.67 -6.36 1.61 5.08 -1.74 -3.36 114.58 110.48 1uyt h GLU 1943Ca 0.00 -0.39 -0.48 0.00 -1.00 0.00 0.00 59.36 57.49 1uyt h GLU 1943Cb 0.00 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 1uyt h GLU 1943CO 0.00 1.00 -0.82 1.04 -1.00 0.00 0.00 179.01 179.23 1uyt n GLN 1944N -4.00 -4.44 -3.96 2.33 6.02 -0.85 -4.41 117.38 108.07 1uyt n GLN 1944Ca -0.03 0.52 -0.21 0.00 -0.01 0.00 0.00 57.00 57.27 1uyt n GLN 1944Cb 0.58 -5.10 -0.02 0.00 1.02 0.00 0.00 30.24 26.72 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 -7.03 4.29 0.77 1.08 1.43 -0.45 -4.90 118.68 113.88 1uyt s LEU 1945Ca 0.31 0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 1uyt s LEU 1945Cb -0.16 -2.84 0.05 0.00 0.03 0.00 0.00 46.19 43.27 1uyt s LEU 1945CO 0.85 -0.08 1.15 -2.84 0.23 0.00 0.00 176.35 175.66 1uyt s PRO 1946N -3.98 2.31 0.01 1.29 0.02 -1.26 -4.66 135.00 128.74 1uyt s PRO 1946Ca 0.34 0.25 -0.02 0.00 0.02 0.00 0.00 61.00 61.59 1uyt s PRO 1946Cb -0.09 -1.98 -0.01 0.00 0.02 0.00 0.00 34.50 32.44 1uyt s PRO 1946CO 0.29 -1.38 0.02 1.41 -0.33 0.00 0.00 177.00 177.01 1uyt s MET 1947N -5.49 0.35 -0.06 5.54 1.75 -0.97 -0.27 119.30 120.15 1uyt s MET 1947Ca 0.60 -0.54 0.02 0.00 -1.25 0.00 0.00 55.69 54.52 1uyt s MET 1947Cb -0.11 0.13 0.02 0.00 2.84 0.00 0.00 34.83 37.71 1uyt s MET 1947CO 0.50 -0.07 -0.08 1.41 -0.65 0.00 0.00 175.02 176.13 1uyt s MET 1948N -1.41 1.26 -0.24 4.11 1.75 -0.69 -0.59 119.30 123.48 1uyt s MET 1948Ca -0.15 -0.25 -0.02 0.00 -1.25 0.00 0.00 55.69 54.01 1uyt s MET 1948Cb -0.09 -1.12 0.02 0.00 2.84 0.00 0.00 34.83 36.47 1uyt s MET 1948CO -0.00 -0.03 -0.06 0.42 -0.65 0.00 0.00 175.02 174.69 1uyt s ILE 1949N 0.82 2.96 -1.37 10.11 1.01 0.66 -1.78 121.20 133.59 1uyt s ILE 1949Ca -0.12 -0.91 -0.14 0.00 0.00 0.00 0.00 60.65 59.48 1uyt s ILE 1949Cb -0.15 -2.46 0.08 0.00 0.01 0.00 0.00 42.46 39.94 1uyt s ILE 1949CO 0.02 0.26 2.01 0.18 0.00 0.00 0.00 174.94 177.40 1uyt n LEU 1950N 4.70 6.36 -4.64 2.97 4.77 -0.12 -0.22 117.00 130.82 1uyt n LEU 1950Ca -0.17 -4.23 -0.51 0.00 -0.03 0.00 0.00 56.01 51.07 1uyt n LEU 1950Cb 0.48 -1.63 -0.06 0.00 -2.33 0.00 0.00 43.42 39.88 1uyt n LEU 1950CO 0.27 0.97 1.53 0.00 -1.33 0.00 0.00 177.39 178.83 1uyt n ALA 1951N 6.00 0.66 -2.84 -1.18 0.00 -0.72 -4.33 120.51 118.10 1uyt n ALA 1951Ca 0.48 0.21 -0.11 0.00 0.00 0.00 0.00 53.44 54.02 1uyt n ALA 1951Cb 0.40 -2.45 0.06 0.00 0.00 0.00 0.00 19.45 17.46 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 7.22 -1.60 -4.39 0.00 5.15 -1.25 -4.05 115.26 116.34 1uyt n ASN 1952Ca 0.28 -3.53 -0.32 0.00 -0.60 0.00 0.00 54.58 50.41 1uyt n ASN 1952Cb 0.24 1.32 -0.15 0.00 -0.53 0.00 0.00 39.78 40.67 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 -0.36 2.55 -0.77 1.20 0.51 -0.94 -4.49 118.94 116.64 1uyt s TRP 1953Ca 0.26 -0.35 0.25 0.00 -2.12 0.00 0.00 56.10 54.15 1uyt s TRP 1953Cb 0.30 -1.59 0.62 0.00 -0.81 0.00 0.00 33.47 31.99 1uyt s TRP 1953CO -0.06 0.04 1.55 0.54 -0.51 0.00 0.00 176.95 178.50 1uyt n ARG 1954N 2.50 0.20 -0.68 4.98 1.74 0.40 -3.45 116.66 122.36 1uyt n ARG 1954Ca -0.17 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1uyt n ARG 1954Cb 0.52 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 1uyt n ARG 1954CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uyt n GLY 1955N 1.38 0.52 3.88 -0.13 0.00 -1.25 -4.43 105.19 105.15 1uyt n GLY 1955Ca 0.05 -1.81 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 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 3.57 -0.05 1.61 0.08 -1.26 -1.19 117.98 118.88 1uyt s PHE 1956Ca 0.00 0.62 -0.30 0.00 0.12 0.00 0.00 56.93 57.37 1uyt s PHE 1956Cb 0.00 -2.03 -0.05 0.00 -0.57 0.00 0.00 43.02 40.36 1uyt s PHE 1956CO 0.00 0.57 1.61 0.45 -0.10 0.00 0.00 175.22 177.75 1uyt s SER 1957N -1.83 6.69 0.00 1.36 0.15 -0.44 -4.87 113.70 114.76 1uyt s SER 1957Ca 0.31 2.21 0.25 0.00 0.70 0.00 0.00 55.95 59.42 1uyt s SER 1957Cb -0.13 -2.54 0.36 0.00 -1.71 0.00 0.00 66.02 62.00 1uyt s SER 1957CO 0.18 -0.90 1.35 0.61 1.20 0.00 0.00 173.24 175.68 1uyt n GLY 1958N 4.06 0.73 3.34 9.45 0.00 -1.26 -4.45 105.19 117.05 1uyt n GLY 1958Ca 0.17 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 1uyt n GLY 1958CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uyt n GLY 1959N 1.32 -2.30 0.19 -0.02 0.00 -1.26 -4.64 105.19 98.47 1uyt n GLY 1959Ca 0.15 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 1uyt n GLY 1959CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1uyt h GLN 1960N -2.17 0.58 0.01 1.61 4.15 -1.98 -1.56 115.11 115.75 1uyt h GLN 1960Ca -0.55 -0.12 0.03 0.00 0.77 0.00 0.00 58.65 58.78 1uyt h GLN 1960Cb 1.35 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.91 1uyt h GLN 1960CO 0.41 0.59 -0.24 -0.09 -1.93 0.00 0.00 178.83 177.57 1uyt h ARG 1961N 0.46 -0.36 -0.18 1.69 1.12 -1.98 0.34 114.38 115.48 1uyt h ARG 1961Ca 0.12 0.02 -0.16 0.00 -1.11 0.00 0.00 59.98 58.86 1uyt h ARG 1961Cb 0.24 0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.28 1uyt h ARG 1961CO -0.00 -0.24 -0.54 -0.44 -3.11 0.00 0.00 179.97 175.63 1uyt h ASP 1962N -0.37 0.58 -0.05 -3.80 3.32 -1.87 -0.37 116.42 113.86 1uyt h ASP 1962Ca 0.06 -0.31 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 1uyt h ASP 1962Cb 0.45 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1uyt h ASP 1962CO -0.21 1.01 -0.27 0.24 -1.72 0.00 0.00 179.24 178.30 1uyt h MET 1963N 0.40 0.49 0.00 3.56 2.86 -1.03 -1.49 114.93 119.73 1uyt h MET 1963Ca 0.01 -0.19 -0.10 0.00 -2.06 0.00 0.00 59.70 57.35 1uyt h MET 1963Cb 1.08 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 1uyt h MET 1963CO 0.10 0.71 -0.50 0.35 1.06 0.00 0.00 176.91 178.64 1uyt h PHE 1964N 0.43 0.00 -0.08 -0.22 3.57 -0.04 -2.48 116.94 118.11 1uyt h PHE 1964Ca 0.06 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1uyt h PHE 1964Cb 0.69 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1uyt h PHE 1964CO 0.02 0.50 0.00 0.09 -2.23 0.00 0.00 178.31 176.69 1uyt n ASN 1965N -3.81 1.25 -2.12 0.41 3.02 -0.17 -4.89 115.26 108.95 1uyt n ASN 1965Ca -0.01 -2.08 -0.17 0.00 -0.03 0.00 0.00 54.58 52.29 1uyt n ASN 1965Cb 0.53 -0.38 0.01 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.02 -2.47 -0.18 3.52 1.02 -0.94 -4.86 120.64 116.72 1uyt n GLU 1966Ca 0.03 0.76 0.29 0.00 -0.02 0.00 0.00 57.16 58.23 1uyt n GLU 1966Cb 0.28 -5.19 0.72 0.00 -0.02 0.00 0.00 31.44 27.23 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 -0.50 0.43 -0.36 2.62 3.04 -1.67 0.26 116.25 120.07 1uyt h VAL 1967Ca -0.40 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.21 1uyt h VAL 1967Cb 1.29 0.49 -0.02 0.00 -2.01 0.00 0.00 31.29 31.04 1uyt h VAL 1967CO 0.45 0.00 -0.11 -0.07 -1.01 0.00 0.00 177.57 176.83 1uyt h LEU 1968N 0.00 0.62 -0.49 3.16 3.38 -1.88 -0.99 115.31 119.12 1uyt h LEU 1968Ca 0.43 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 58.09 1uyt h LEU 1968Cb 1.85 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 1uyt h LEU 1968CO -0.00 0.76 -0.31 0.11 0.09 0.00 0.00 178.44 179.09 1uyt h LYS 1969N 0.58 0.90 0.00 1.13 1.57 -0.86 -2.43 116.57 117.47 1uyt h LYS 1969Ca 0.10 -0.43 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 1uyt h LYS 1969Cb 0.53 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1uyt h LYS 1969CO 0.03 1.08 -0.11 1.88 -0.57 0.00 0.00 179.45 181.77 1uyt h TYR 1970N 0.76 0.00 -0.05 -1.35 0.05 -1.46 -2.65 116.97 112.27 1uyt h TYR 1970Ca 0.08 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.63 1uyt h TYR 1970Cb 0.88 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.63 1uyt h TYR 1970CO 0.05 0.07 -0.90 0.78 -1.05 0.00 0.00 178.16 177.11 1uyt h GLY 1971N 3.94 0.66 1.47 3.88 0.00 -1.10 -3.04 103.07 108.88 1uyt h GLY 1971Ca -0.00 -1.06 -0.11 0.00 0.00 0.00 0.00 47.33 46.16 1uyt h GLY 1971CO 0.01 0.94 -0.26 1.76 0.00 0.00 0.00 176.54 178.98 1uyt h SER 1972N 0.37 0.61 -0.80 0.19 0.02 -1.36 -2.33 113.55 110.25 1uyt h SER 1972Ca -0.08 -0.22 0.19 0.00 -0.84 0.00 0.00 61.79 60.84 1uyt h SER 1972Cb 1.53 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 63.85 1uyt h SER 1972CO 0.17 0.86 0.54 -0.26 -1.14 0.00 0.00 176.83 177.00 1uyt h PHE 1973N 0.53 0.34 -0.45 3.45 0.05 -1.36 0.12 116.94 119.62 1uyt h PHE 1973Ca 0.07 0.01 -0.05 0.00 3.82 0.00 0.00 57.97 61.82 1uyt h PHE 1973Cb 0.73 -0.11 -0.02 0.00 2.00 0.00 0.00 35.95 38.56 1uyt h PHE 1973CO 0.03 0.11 0.07 0.82 -0.18 0.00 0.00 178.31 179.16 1uyt h ILE 1974N 0.27 1.25 -0.27 -0.55 2.04 -1.39 0.20 117.51 119.05 1uyt h ILE 1974Ca 0.40 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.35 1uyt h ILE 1974Cb 1.15 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1uyt h ILE 1974CO -0.10 0.31 0.13 0.58 0.00 0.00 0.00 178.15 179.07 1uyt h VAL 1975N 0.60 1.15 -0.13 1.67 2.07 -0.87 -1.66 116.25 119.08 1uyt h VAL 1975Ca 0.14 -0.43 0.04 0.00 0.82 0.00 0.00 66.70 67.26 1uyt h VAL 1975Cb 0.38 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1uyt h VAL 1975CO 0.01 0.15 -0.12 0.44 0.02 0.00 0.00 177.57 178.07 1uyt h ASP 1976N 0.30 -0.37 -0.47 0.57 3.45 -0.84 -0.97 116.42 118.10 1uyt h ASP 1976Ca 0.09 0.07 0.06 0.00 0.43 0.00 0.00 57.03 57.69 1uyt h ASP 1976Cb 0.12 0.18 -0.05 0.00 -0.56 0.00 0.00 39.33 39.02 1uyt h ASP 1976CO -0.01 -0.16 0.17 0.00 -1.57 0.00 0.00 179.24 177.67 1uyt h ALA 1977N 0.95 0.57 -0.67 3.45 0.00 -0.32 -2.20 119.26 121.03 1uyt h ALA 1977Ca 0.09 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1uyt h ALA 1977Cb 0.26 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1uyt h ALA 1977CO -0.21 -0.23 0.12 -0.07 0.00 0.00 0.00 179.25 178.86 1uyt h LEU 1978N 0.34 1.05 -1.97 0.00 3.38 -1.02 -2.36 115.31 114.73 1uyt h LEU 1978Ca 0.22 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1uyt h LEU 1978Cb 0.23 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1uyt h LEU 1978CO -0.23 1.03 0.15 0.58 0.09 0.00 0.00 178.44 180.07 1uyt h VAL 1979N 1.03 0.91 0.00 1.22 2.07 -0.58 -1.78 116.25 119.12 1uyt h VAL 1979Ca 0.21 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1uyt h VAL 1979Cb 0.42 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1uyt h VAL 1979CO 0.01 0.01 -0.60 -0.67 0.02 0.00 0.00 177.57 176.33 1uyt n ASP 1980N -4.48 0.60 -4.75 0.57 -0.08 -0.93 -4.96 116.55 102.53 1uyt n ASP 1980Ca 0.02 -0.03 -0.42 0.00 -1.51 0.00 0.00 54.79 52.85 1uyt n ASP 1980Cb 0.27 0.24 -0.01 0.00 2.34 0.00 0.00 41.12 43.95 1uyt n ASP 1980CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1uyt n TYR 1981N -1.86 2.80 -0.21 -0.67 9.36 -0.67 -4.94 117.16 120.97 1uyt n TYR 1981Ca 0.04 0.36 0.03 0.00 3.32 0.00 0.00 57.90 61.65 1uyt n TYR 1981Cb 0.40 -2.55 0.06 0.00 -0.63 0.00 0.00 39.34 36.62 1uyt n TYR 1981CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1uyt n LYS 1982N 1.41 2.76 -4.30 2.98 5.02 -1.26 -4.89 118.16 119.87 1uyt n LYS 1982Ca 0.06 -1.80 -0.18 0.00 -2.02 0.00 0.00 58.31 54.37 1uyt n LYS 1982Cb 0.37 -1.15 -0.10 0.00 -0.02 0.00 0.00 35.03 34.12 1uyt n LYS 1982CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1uyt s GLN 1983N -1.31 1.21 0.32 1.97 1.11 -1.26 -5.08 119.66 116.61 1uyt s GLN 1983Ca 0.11 -1.46 -0.28 0.00 0.01 0.00 0.00 55.36 53.73 1uyt s GLN 1983Cb 0.07 -1.01 -0.13 0.00 -1.01 0.00 0.00 33.01 30.94 1uyt s GLN 1983CO 0.04 0.17 1.13 -0.35 0.01 0.00 0.00 175.29 176.29 1uyt n PRO 1984N -0.06 1.69 -4.90 2.91 -0.04 -1.26 -4.78 135.00 128.56 1uyt n PRO 1984Ca -0.11 0.59 -0.26 0.00 -0.04 0.00 0.00 63.50 63.69 1uyt n PRO 1984Cb 0.59 -2.07 -0.15 0.00 -0.04 0.00 0.00 33.50 31.83 1uyt n PRO 1984CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1uyt s ILE 1985N -1.09 1.53 -0.11 0.52 1.01 0.84 -2.30 121.20 121.60 1uyt s ILE 1985Ca 0.57 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 60.38 1uyt s ILE 1985Cb -0.63 -1.28 0.01 0.00 0.01 0.00 0.00 42.46 40.57 1uyt s ILE 1985CO 0.61 0.40 -0.16 -0.63 0.00 0.00 0.00 174.94 175.16 1uyt s ILE 1986N -0.49 1.59 -0.23 2.92 1.01 0.24 -2.58 121.20 123.65 1uyt s ILE 1986Ca 0.07 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 59.98 1uyt s ILE 1986Cb -0.08 -1.44 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 1uyt s ILE 1986CO -0.00 0.46 -0.01 -0.63 0.00 0.00 0.00 174.94 174.76 1uyt s ILE 1987N 0.98 3.67 -0.15 2.92 -1.09 -0.48 -0.25 121.20 126.80 1uyt s ILE 1987Ca -0.06 -0.39 -0.01 0.00 -2.23 0.00 0.00 60.65 57.95 1uyt s ILE 1987Cb -0.15 -2.69 0.04 0.00 -1.58 0.00 0.00 42.46 38.08 1uyt s ILE 1987CO -0.02 0.39 -0.03 -0.47 -1.23 0.00 0.00 174.94 173.58 1uyt s TYR 1988N 1.52 1.44 -0.43 3.97 6.04 0.70 -0.05 117.35 130.54 1uyt s TYR 1988Ca 0.06 -0.90 -0.29 0.00 0.04 0.00 0.00 57.07 55.98 1uyt s TYR 1988Cb -0.15 -1.19 0.03 0.00 -1.04 0.00 0.00 41.96 39.61 1uyt s TYR 1988CO -0.01 -0.57 1.11 0.42 -1.54 0.00 0.00 175.55 174.96 1uyt s ILE 1989N 1.72 4.31 1.01 3.14 1.01 -0.67 -1.76 121.20 129.97 1uyt s ILE 1989Ca 0.01 1.37 -0.13 0.00 0.00 0.00 0.00 60.65 61.90 1uyt s ILE 1989Cb -0.15 -4.54 0.20 0.00 0.01 0.00 0.00 42.46 37.98 1uyt s ILE 1989CO -0.07 -0.83 1.11 -2.16 0.00 0.00 0.00 174.94 172.98 1uyt s PRO 1990N 4.17 0.31 0.46 2.79 0.04 -1.26 -2.08 135.00 139.43 1uyt s PRO 1990Ca 0.47 0.35 -0.25 0.00 0.04 0.00 0.00 61.00 61.61 1uyt s PRO 1990Cb -0.09 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 1uyt s PRO 1990CO 0.26 -2.78 1.36 -2.14 0.04 0.00 0.00 177.00 173.74 1uyt s PRO 1991N -5.11 3.67 0.00 0.56 0.02 -1.26 -1.33 135.00 131.55 1uyt s PRO 1991Ca 0.66 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.93 1uyt s PRO 1991Cb -0.16 -2.59 0.00 0.00 0.02 0.00 0.00 34.50 31.76 1uyt s PRO 1991CO 0.56 -0.77 0.00 0.25 -0.33 0.00 0.00 177.00 176.72 1uyt n THR 1992N -0.27 0.00 -3.39 0.99 -2.24 0.41 -4.80 114.28 104.97 1uyt n THR 1992Ca 0.06 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.65 1uyt n THR 1992Cb 0.43 -0.66 -0.01 0.00 -2.10 0.00 0.00 70.33 68.00 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 -2.00 1.74 0.25 3.38 0.00 -0.44 -4.99 107.32 105.26 1uyt s GLY 1993Ca 0.00 -1.56 -0.10 0.00 0.00 0.00 0.00 44.72 43.06 1uyt s GLY 1993CO 0.00 -1.44 0.43 -1.83 0.00 0.00 0.00 173.10 170.26 1uyt s GLU 1994N -4.20 1.53 -0.22 2.90 -1.05 -1.26 -1.06 118.70 115.34 1uyt s GLU 1994Ca 0.47 -1.35 -0.11 0.00 -0.15 0.00 0.00 54.97 53.83 1uyt s GLU 1994Cb -0.09 0.44 0.07 0.00 -0.44 0.00 0.00 34.13 34.12 1uyt s GLU 1994CO 0.31 -0.62 0.53 -1.17 0.95 0.00 0.00 175.26 175.26 1uyt s LEU 1995N -3.06 -0.53 0.00 1.83 2.96 -0.98 -2.20 118.68 116.70 1uyt s LEU 1995Ca 0.26 1.18 0.00 0.00 -0.22 0.00 0.00 54.13 55.34 1uyt s LEU 1995Cb 0.00 1.79 0.00 0.00 0.50 0.00 0.00 46.19 48.48 1uyt s LEU 1995CO 0.10 -0.22 0.00 0.54 -1.32 0.00 0.00 176.35 175.46 1uyt n ARG 1996N 4.48 2.14 -0.14 1.98 5.12 -1.22 -2.59 116.66 126.43 1uyt n ARG 1996Ca -0.20 0.00 0.15 0.00 -1.93 0.00 0.00 57.85 55.88 1uyt n ARG 1996Cb 0.56 0.00 0.52 0.00 -1.16 0.00 0.00 32.46 32.38 1uyt n ARG 1996CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1uyt h GLY 1997N 0.00 0.62 0.97 -0.13 0.00 -1.22 -0.62 103.07 102.69 1uyt h GLY 1997Ca 0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 47.33 46.84 1uyt h GLY 1997CO 0.00 0.06 -1.73 -1.33 0.00 0.00 0.00 176.54 173.54 1uyt h GLY 1998N 0.38 0.26 0.88 4.60 0.00 -1.84 -3.38 103.07 103.96 1uyt h GLY 1998Ca 0.35 -0.66 -0.27 0.00 0.00 0.00 0.00 47.33 46.75 1uyt h GLY 1998CO -0.10 0.58 -1.22 1.48 0.00 0.00 0.00 176.54 177.27 1uyt h SER 1999N 0.06 0.60 -0.90 0.19 4.64 -1.79 -3.36 113.55 112.99 1uyt h SER 1999Ca -0.32 -0.93 0.17 0.00 -0.47 0.00 0.00 61.79 60.25 1uyt h SER 1999Cb 2.03 -0.19 -0.10 0.00 -0.31 0.00 0.00 62.40 63.82 1uyt h SER 1999CO 0.13 1.58 0.48 -0.25 -0.87 0.00 0.00 176.83 177.90 1uyt h TRP 2000N -0.14 0.84 -0.90 4.77 2.91 -1.33 -2.15 115.95 119.95 1uyt h TRP 2000Ca -0.23 0.04 0.17 0.00 1.13 0.00 0.00 58.89 60.00 1uyt h TRP 2000Cb 1.88 -0.24 -0.07 0.00 -0.51 0.00 0.00 29.16 30.23 1uyt h TRP 2000CO 0.15 0.17 0.58 -0.24 -1.03 0.00 0.00 178.44 178.08 1uyt h VAL 2001N 0.64 0.77 -0.01 2.65 3.04 -1.74 -0.98 116.25 120.61 1uyt h VAL 2001Ca 0.51 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 66.00 1uyt h VAL 2001Cb 0.77 0.13 0.00 0.00 -2.01 0.00 0.00 31.29 30.18 1uyt h VAL 2001CO -0.39 0.11 -0.04 1.33 -1.01 0.00 0.00 177.57 177.56 1uyt n VAL 2002N -4.56 0.00 -1.10 1.51 0.24 -0.81 -4.00 118.33 109.62 1uyt n VAL 2002Ca 0.18 -0.17 0.04 0.00 -2.04 0.00 0.00 64.34 62.36 1uyt n VAL 2002Cb 0.56 0.24 0.06 0.00 -1.47 0.00 0.00 33.84 33.23 1uyt n VAL 2002CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1uyt n VAL 2003N -0.27 1.01 -2.47 3.34 0.24 -0.44 -4.55 118.33 115.18 1uyt n VAL 2003Ca 0.19 -1.17 -0.39 0.00 -2.04 0.00 0.00 64.34 60.92 1uyt n VAL 2003Cb 0.30 0.24 -0.04 0.00 -1.47 0.00 0.00 33.84 32.87 1uyt n VAL 2003CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1uyt s ASP 2004N -1.70 7.06 0.58 -1.34 2.15 -0.78 -4.92 116.67 117.72 1uyt s ASP 2004Ca 0.14 2.22 0.28 0.00 0.43 0.00 0.00 52.55 55.62 1uyt s ASP 2004Cb 0.12 -2.62 1.59 0.00 -0.30 0.00 0.00 42.92 41.71 1uyt s ASP 2004CO 0.01 -0.29 2.05 -0.65 -0.17 0.00 0.00 175.17 176.12 1uyt h PRO 2005N 3.35 0.00 0.00 4.34 0.11 -1.91 -1.81 132.00 136.09 1uyt h PRO 2005Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1uyt h PRO 2005Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1uyt h PRO 2005CO 0.65 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.23 1uyt h THR 2006N 0.00 0.00 -0.70 -1.15 1.35 -1.93 -2.18 112.91 108.31 1uyt h THR 2006Ca 0.12 -0.32 0.02 0.00 -0.55 0.00 0.00 66.41 65.69 1uyt h THR 2006Cb 0.66 1.25 -0.04 0.00 -1.73 0.00 0.00 68.15 68.29 1uyt h THR 2006CO -0.00 0.00 0.46 0.40 -0.25 0.00 0.00 175.52 176.13 1uyt h ILE 2007N 0.00 1.13 -1.39 6.82 2.04 -1.71 -3.34 117.51 121.06 1uyt h ILE 2007Ca 0.00 -0.30 -0.36 0.00 1.00 0.00 0.00 64.86 65.20 1uyt h ILE 2007Cb 0.34 0.18 -0.26 0.00 -0.74 0.00 0.00 36.82 36.34 1uyt h ILE 2007CO 0.00 0.16 -0.73 -3.20 0.00 0.00 0.00 178.15 174.38 1uyt n ASN 2008N -4.45 -1.92 0.25 1.72 2.85 -0.96 -4.63 115.26 108.12 1uyt n ASN 2008Ca 0.08 -2.79 0.16 0.00 -0.11 0.00 0.00 54.58 51.93 1uyt n ASN 2008Cb 0.09 0.71 0.86 0.00 1.24 0.00 0.00 39.78 42.68 1uyt n ASN 2008CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1uyt h ALA 2009N 4.87 1.70 -0.29 5.20 0.00 -1.53 0.25 119.26 129.46 1uyt h ALA 2009Ca 0.09 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1uyt h ALA 2009Cb 1.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1uyt h ALA 2009CO 0.24 -0.16 -0.15 -0.44 0.00 0.00 0.00 179.25 178.74 1uyt h ASP 2010N 0.00 0.50 0.00 0.00 3.32 -1.95 -3.36 116.42 114.93 1uyt h ASP 2010Ca 0.05 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 1uyt h ASP 2010Cb 0.26 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1uyt h ASP 2010CO -0.00 0.68 -1.05 0.00 -1.72 0.00 0.00 179.24 177.15 1uyt n GLN 2011N -4.18 0.37 -3.16 3.56 1.13 -0.73 -4.97 117.38 109.40 1uyt n GLN 2011Ca 0.00 -0.01 -0.31 0.00 -1.94 0.00 0.00 57.00 54.75 1uyt n GLN 2011Cb 0.35 -1.02 -0.04 0.00 0.11 0.00 0.00 30.24 29.63 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 -2.07 3.80 -0.22 -1.09 -1.94 0.81 -0.11 119.30 118.48 1uyt s MET 2012Ca -0.00 0.36 -0.14 0.00 -1.71 0.00 0.00 55.69 54.20 1uyt s MET 2012Cb 0.01 -2.52 0.07 0.00 2.01 0.00 0.00 34.83 34.39 1uyt s MET 2012CO 0.04 0.15 0.54 -1.21 -0.01 0.00 0.00 175.02 174.54 1uyt s GLU 2013N -3.33 0.56 0.10 2.03 2.02 -1.07 -4.78 118.70 114.23 1uyt s GLU 2013Ca 0.49 0.95 0.06 0.00 0.02 0.00 0.00 54.97 56.50 1uyt s GLU 2013Cb -0.11 0.10 -0.04 0.00 0.10 0.00 0.00 34.13 34.19 1uyt s GLU 2013CO 0.25 -0.14 -0.07 1.41 0.02 0.00 0.00 175.26 176.73 1uyt s MET 2014N 1.28 2.24 0.02 1.61 1.75 -1.26 -1.38 119.30 123.56 1uyt s MET 2014Ca -0.08 -0.98 0.00 0.00 -1.25 0.00 0.00 55.69 53.39 1uyt s MET 2014Cb -0.06 -2.37 -0.01 0.00 2.84 0.00 0.00 34.83 35.22 1uyt s MET 2014CO -0.13 0.52 -0.03 0.71 -0.65 0.00 0.00 175.02 175.43 1uyt s TYR 2015N -1.25 0.27 -0.07 4.11 1.51 0.92 -0.89 117.35 121.96 1uyt s TYR 2015Ca 0.23 -0.36 0.04 0.00 -1.01 0.00 0.00 57.07 55.97 1uyt s TYR 2015Cb -0.11 -0.18 0.00 0.00 -0.11 0.00 0.00 41.96 41.56 1uyt s TYR 2015CO 0.15 -0.11 -0.18 0.00 -1.11 0.00 0.00 175.55 174.30 1uyt s ALA 2016N -0.97 1.69 0.37 3.71 0.00 -1.10 -1.67 121.76 123.78 1uyt s ALA 2016Ca -0.10 -0.72 -0.25 0.00 0.00 0.00 0.00 51.96 50.89 1uyt s ALA 2016Cb -0.07 -0.63 -0.09 0.00 0.00 0.00 0.00 23.12 22.33 1uyt s ALA 2016CO -0.00 0.24 1.06 0.34 0.00 0.00 0.00 175.76 177.40 1uyt s ASP 2017N 0.30 6.87 0.36 0.00 2.15 -0.88 -1.73 116.67 123.75 1uyt s ASP 2017Ca -0.12 2.08 0.16 0.00 0.43 0.00 0.00 52.55 55.11 1uyt s ASP 2017Cb -0.15 -2.59 1.08 0.00 -0.30 0.00 0.00 42.92 40.96 1uyt s ASP 2017CO 0.05 -0.41 1.70 0.58 -0.17 0.00 0.00 175.17 176.91 1uyt h VAL 2018N 2.39 0.38 -1.25 1.11 2.07 -1.22 0.89 116.25 120.61 1uyt h VAL 2018Ca -0.48 -0.13 -0.68 0.00 0.82 0.00 0.00 66.70 66.23 1uyt h VAL 2018Cb 1.21 -0.03 -0.27 0.00 -1.52 0.00 0.00 31.29 30.69 1uyt h VAL 2018CO 0.63 0.07 0.89 0.59 0.02 0.00 0.00 177.57 179.77 1uyt n ASN 2019N -4.88 7.56 -4.55 0.57 3.02 -1.26 -4.63 115.26 111.08 1uyt n ASN 2019Ca 0.30 -3.74 -0.26 0.00 -0.03 0.00 0.00 54.58 50.84 1uyt n ASN 2019Cb 0.96 -1.02 -0.11 0.00 -0.61 0.00 0.00 39.78 39.00 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 -3.72 2.98 0.12 5.41 0.00 0.30 -0.45 121.76 126.41 1uyt s ALA 2020Ca 0.59 -2.11 0.05 0.00 0.00 0.00 0.00 51.96 50.49 1uyt s ALA 2020Cb 0.47 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 1uyt s ALA 2020CO -0.13 0.06 -0.12 1.03 0.00 0.00 0.00 175.76 176.60 1uyt s ARG 2021N -3.62 0.97 -0.28 0.00 3.00 -0.22 -4.27 118.95 114.52 1uyt s ARG 2021Ca 0.33 -1.24 -0.21 0.00 0.00 0.00 0.00 55.73 54.61 1uyt s ARG 2021Cb 0.03 -0.74 0.13 0.00 0.00 0.00 0.00 34.95 34.37 1uyt s ARG 2021CO 0.17 0.13 0.97 0.00 0.00 0.00 0.00 175.30 176.57 1uyt s ALA 2022N -2.39 -2.07 0.00 2.13 0.00 -1.13 -2.31 121.76 115.99 1uyt s ALA 2022Ca 0.09 2.05 0.00 0.00 0.00 0.00 0.00 51.96 54.09 1uyt s ALA 2022Cb -0.03 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.56 1uyt s ALA 2022CO 0.02 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1uyt n GLY 2023N 2.94 1.52 0.31 0.00 0.00 -1.07 -4.24 105.19 104.66 1uyt n GLY 2023Ca -0.15 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.70 1uyt n GLY 2023CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1uyt h VAL 2024N 0.82 0.20 -2.27 1.61 2.07 -1.88 -3.13 116.25 113.67 1uyt h VAL 2024Ca 0.00 -0.03 -0.56 0.00 0.82 0.00 0.00 66.70 66.93 1uyt h VAL 2024Cb 0.00 0.10 -0.14 0.00 -1.52 0.00 0.00 31.29 29.74 1uyt h VAL 2024CO 0.00 0.02 -0.67 -0.22 0.02 0.00 0.00 177.57 176.71 1uyt s LEU 2025N -10.85 2.61 0.28 2.57 2.96 -1.26 -1.55 118.68 113.44 1uyt s LEU 2025Ca -0.13 -1.20 -0.05 0.00 -0.22 0.00 0.00 54.13 52.52 1uyt s LEU 2025Cb 0.26 -0.82 -0.05 0.00 0.50 0.00 0.00 46.19 46.07 1uyt s LEU 2025CO 0.77 -0.28 0.55 -0.70 -1.32 0.00 0.00 176.35 175.37 1uyt s GLU 2026N -3.67 3.65 0.18 1.98 2.12 -1.26 -4.81 118.70 116.88 1uyt s GLU 2026Ca 0.31 0.04 -0.22 0.00 0.36 0.00 0.00 54.97 55.46 1uyt s GLU 2026Cb 0.03 -2.65 0.07 0.00 0.26 0.00 0.00 34.13 31.84 1uyt s GLU 2026CO 0.14 0.23 1.40 -2.30 -0.54 0.00 0.00 175.26 174.20 1uyt n PRO 2027N -0.82 -0.31 -0.10 4.30 -0.02 -1.26 -0.06 135.00 136.73 1uyt n PRO 2027Ca -0.01 1.38 -0.07 0.00 -2.02 0.00 0.00 63.50 62.77 1uyt n PRO 2027Cb 0.54 -2.04 -0.01 0.00 -0.02 0.00 0.00 33.50 31.96 1uyt n PRO 2027CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1uyt h GLN 2028N 0.00 -0.24 -0.53 -0.52 1.08 -1.94 -0.06 115.11 112.90 1uyt h GLN 2028Ca 0.23 0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 57.36 1uyt h GLN 2028Cb 0.45 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 1uyt h GLN 2028CO -0.87 -0.16 -0.01 0.78 -0.95 0.00 0.00 178.83 177.62 1uyt h GLY 2029N -0.25 0.98 1.78 3.46 0.00 -1.35 -2.72 103.07 104.97 1uyt h GLY 2029Ca 0.17 -0.69 -0.04 0.00 0.00 0.00 0.00 47.33 46.77 1uyt h GLY 2029CO -0.50 0.64 -0.08 1.98 0.00 0.00 0.00 176.54 178.57 1uyt h MET 2030N 0.84 0.28 0.58 4.80 1.85 0.31 -3.17 114.93 120.41 1uyt h MET 2030Ca 0.15 -0.06 -0.03 0.00 -0.61 0.00 0.00 59.70 59.16 1uyt h MET 2030Cb 0.51 -0.04 0.01 0.00 0.43 0.00 0.00 31.60 32.50 1uyt h MET 2030CO 0.03 0.37 -0.28 0.28 -0.40 0.00 0.00 176.91 176.91 1uyt h VAL 2031N 0.27 0.00 0.00 -5.77 2.07 -0.73 -2.38 116.25 109.71 1uyt h VAL 2031Ca 0.06 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1uyt h VAL 2031Cb 0.31 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1uyt h VAL 2031CO 0.02 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.22 1uyt n GLY 2032N -0.50 0.13 0.56 2.17 0.00 -1.10 -1.42 105.19 105.04 1uyt n GLY 2032Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.46 0.00 -0.43 -0.61 5.41 -1.20 -4.90 119.36 118.10 1uyt n ILE 2033Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.80 1uyt n ILE 2033Cb 0.02 -0.20 0.11 0.00 -0.71 0.00 0.00 39.64 38.86 1uyt n ILE 2033CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1uyt n LYS 2034N -1.86 2.58 -2.72 0.38 4.76 -0.90 -4.76 118.16 115.64 1uyt n LYS 2034Ca 0.00 -2.07 -0.08 0.00 -2.87 0.00 0.00 58.31 53.29 1uyt n LYS 2034Cb 0.04 -1.30 0.09 0.00 -1.84 0.00 0.00 35.03 32.02 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 -0.46 -2.56 -0.35 2.13 7.35 -0.51 -5.01 117.46 118.05 1uyt n PHE 2035Ca 0.09 -1.89 0.00 0.00 -0.76 0.00 0.00 57.45 54.89 1uyt n PHE 2035Cb 0.47 1.57 0.00 0.00 0.35 0.00 0.00 39.48 41.87 1uyt n PHE 2035CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1uyt n ARG 2036N 0.50 0.49 -0.03 -4.13 1.74 -1.23 -4.61 116.66 109.38 1uyt n ARG 2036Ca 0.05 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.09 1uyt n ARG 2036Cb 0.70 0.00 0.19 0.00 -1.02 0.00 0.00 32.46 32.34 1uyt n ARG 2036CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1uyt h ARG 2037N 0.00 0.61 -0.31 5.56 2.43 -1.98 -1.93 114.38 118.75 1uyt h ARG 2037Ca 0.00 -0.19 0.04 0.00 -0.81 0.00 0.00 59.98 59.02 1uyt h ARG 2037Cb 0.00 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1uyt h ARG 2037CO 0.00 0.72 0.10 1.49 -1.51 0.00 0.00 179.97 180.77 1uyt h GLU 2038N 0.55 0.22 -0.00 0.20 4.22 -2.00 -0.66 114.58 117.11 1uyt h GLU 2038Ca 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1uyt h GLU 2038Cb 0.55 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1uyt h GLU 2038CO 0.03 0.14 -0.08 1.17 -2.18 0.00 0.00 179.01 178.10 1uyt n LYS 2039N -5.04 0.59 0.03 1.92 4.81 -1.17 -2.89 118.16 116.42 1uyt n LYS 2039Ca 0.00 -0.15 -0.12 0.00 -0.87 0.00 0.00 58.31 57.17 1uyt n LYS 2039Cb 0.12 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.54 1uyt n LYS 2039CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1uyt h LEU 2040N 0.36 0.19 0.00 3.14 5.85 -0.41 -3.26 115.31 121.17 1uyt h LEU 2040Ca 0.00 -0.28 -0.27 0.00 0.84 0.00 0.00 57.88 58.17 1uyt h LEU 2040Cb 0.33 -0.06 0.02 0.00 0.37 0.00 0.00 40.66 41.32 1uyt h LEU 2040CO 0.00 1.24 -1.08 -0.07 -0.34 0.00 0.00 178.44 178.19 1uyt h LEU 2041N 0.03 0.83 -2.85 2.25 -0.00 -1.13 -1.55 115.31 112.90 1uyt h LEU 2041Ca -0.22 -0.69 0.00 0.00 -0.00 0.00 0.00 57.88 56.97 1uyt h LEU 2041Cb 1.96 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 42.37 1uyt h LEU 2041CO 0.12 1.50 0.01 -0.78 -0.00 0.00 0.00 178.44 179.29 1uyt h ASP 2042N 0.33 0.00 -0.02 -0.43 3.58 -1.64 0.30 116.42 118.54 1uyt h ASP 2042Ca -0.14 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.31 1uyt h ASP 2042Cb 1.74 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.79 1uyt h ASP 2042CO 0.21 0.00 -0.14 0.41 -2.88 0.00 0.00 179.24 176.84 1uyt n THR 2043N -3.27 0.00 0.20 2.25 -1.04 -1.16 -4.35 114.28 106.91 1uyt n THR 2043Ca -0.03 -0.43 0.06 0.00 -2.04 0.00 0.00 64.05 61.61 1uyt n THR 2043Cb 0.08 1.25 0.30 0.00 -1.82 0.00 0.00 70.33 70.14 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 0.40 0.07 -1.57 -2.82 0.00 0.10 -3.73 117.12 109.58 1uyt n MET 2044Ca 0.08 0.48 -0.41 0.00 0.00 0.00 0.00 57.70 57.85 1uyt n MET 2044Cb 0.35 -1.68 -0.01 0.00 0.00 0.00 0.00 33.22 31.88 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 -1.82 6.34 -0.65 6.12 3.02 -1.25 -3.68 115.26 123.34 1uyt n ASN 2045Ca 0.01 -2.74 -0.00 0.00 -0.03 0.00 0.00 54.58 51.82 1uyt n ASN 2045Cb 0.08 -1.60 -0.01 0.00 -0.61 0.00 0.00 39.78 37.64 1uyt n ASN 2045CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1uyt n ARG 2046N 4.70 0.00 0.00 3.52 0.63 -1.24 -5.17 116.66 119.09 1uyt n ARG 2046Ca 0.64 -0.64 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1uyt n ARG 2046Cb 0.31 -0.12 0.00 0.00 0.45 0.00 0.00 32.46 33.10 1uyt n ARG 2046CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1uyt n LEU 2047N 0.04 0.00 -4.74 6.15 -0.00 -1.24 -5.25 117.00 111.97 1uyt n LEU 2047Ca -0.03 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.70 1uyt n LEU 2047Cb 0.65 0.00 0.16 0.00 -0.00 0.00 0.00 43.42 44.23 1uyt n LEU 2047CO -0.02 0.00 0.68 -1.61 -0.00 0.00 0.00 177.39 176.44 1uyt s GLU 2081N 2.98 0.77 0.00 1.96 0.41 -1.26 -5.13 118.70 118.43 1uyt s GLU 2081Ca 0.00 0.36 0.22 0.00 -0.41 0.00 0.00 54.97 55.13 1uyt s GLU 2081Cb 0.00 -1.79 -0.05 0.00 -1.78 0.00 0.00 34.13 30.51 1uyt s GLU 2081CO 0.00 -2.46 1.02 1.47 -0.49 0.00 0.00 175.26 174.80 1uyt n LEU 2082N -3.96 1.78 -0.22 1.80 -0.00 -1.26 -4.44 117.00 110.70 1uyt n LEU 2082Ca 0.06 -0.71 -0.00 0.00 -0.00 0.00 0.00 56.01 55.36 1uyt n LEU 2082Cb 0.59 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 44.12 1uyt n LEU 2082CO 0.57 0.35 1.04 0.25 -0.00 0.00 0.00 177.39 179.60 1uyt h LEU 2083N 1.89 0.40 -1.91 1.47 5.85 -2.04 0.17 115.31 121.14 1uyt h LEU 2083Ca 0.00 0.06 0.19 0.00 0.84 0.00 0.00 57.88 58.96 1uyt h LEU 2083Cb 0.68 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1uyt h LEU 2083CO 0.00 0.24 0.49 -0.65 -0.34 0.00 0.00 178.44 178.19 1uyt h PRO 2084N 0.55 0.08 0.00 5.25 0.11 -2.01 0.37 132.00 136.36 1uyt h PRO 2084Ca 0.31 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.39 1uyt h PRO 2084Cb 0.31 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 1uyt h PRO 2084CO -0.25 0.05 -1.95 -0.89 -0.21 0.00 0.00 178.00 174.76 1uyt n ILE 2085N -4.37 0.18 0.22 4.15 2.08 -0.75 -4.11 119.36 116.76 1uyt n ILE 2085Ca 0.14 -0.54 0.12 0.00 0.56 0.00 0.00 62.75 63.03 1uyt n ILE 2085Cb 0.71 -0.07 0.19 0.00 -0.75 0.00 0.00 39.64 39.71 1uyt n ILE 2085CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 1uyt h TYR 2086N 0.00 0.00 0.00 1.39 -1.99 0.97 -3.12 116.97 114.22 1uyt h TYR 2086Ca -0.05 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.66 1uyt h TYR 2086Cb 1.11 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.84 1uyt h TYR 2086CO 0.00 0.04 -0.08 0.78 -0.00 0.00 0.00 178.16 178.90 1uyt h GLY 2087N 3.83 0.00 1.77 3.88 0.00 -0.50 -3.09 103.07 108.96 1uyt h GLY 2087Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1uyt h GLY 2087CO 0.01 0.00 -0.85 1.46 0.00 0.00 0.00 176.54 177.15 1uyt h GLN 2088N 0.00 0.21 -0.42 4.80 1.08 -1.72 -2.77 115.11 116.29 1uyt h GLN 2088Ca -0.00 -0.22 -0.01 0.00 -1.45 0.00 0.00 58.65 56.97 1uyt h GLN 2088Cb 0.98 0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.45 1uyt h GLN 2088CO 0.01 0.94 0.22 0.82 -0.95 0.00 0.00 178.83 179.87 1uyt h ILE 2089N 0.12 1.14 -0.14 2.54 2.04 -1.60 0.50 117.51 122.10 1uyt h ILE 2089Ca -0.04 -0.36 -0.17 0.00 1.00 0.00 0.00 64.86 65.29 1uyt h ILE 2089Cb 1.47 0.59 0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1uyt h ILE 2089CO 0.13 0.15 -0.58 0.77 0.00 0.00 0.00 178.15 178.63 1uyt h SER 2090N 0.57 0.75 -0.58 1.72 4.64 -1.58 -0.38 113.55 118.69 1uyt h SER 2090Ca 0.15 -0.62 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 1uyt h SER 2090Cb 0.03 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 1uyt h SER 2090CO -0.02 1.25 0.29 -0.07 -0.87 0.00 0.00 176.83 177.40 1uyt h LEU 2091N 0.31 0.75 -0.89 5.97 3.38 -1.04 -1.06 115.31 122.72 1uyt h LEU 2091Ca -0.03 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 1uyt h LEU 2091Cb 1.21 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1uyt h LEU 2091CO 0.12 0.66 -0.48 1.56 0.09 0.00 0.00 178.44 180.39 1uyt h GLN 2092N 0.79 0.16 -0.38 1.13 1.08 -0.03 0.86 115.11 118.72 1uyt h GLN 2092Ca 0.20 -0.09 -0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1uyt h GLN 2092Cb 0.10 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 1uyt h GLN 2092CO -0.03 0.61 0.08 0.35 -0.95 0.00 0.00 178.83 178.90 1uyt h PHE 2093N 0.13 0.66 -0.16 2.96 3.57 -0.55 -2.59 116.94 120.96 1uyt h PHE 2093Ca 0.01 -0.08 -0.10 0.00 3.53 0.00 0.00 57.97 61.32 1uyt h PHE 2093Cb 0.91 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.46 1uyt h PHE 2093CO 0.01 0.65 -0.29 0.00 -2.23 0.00 0.00 178.31 176.45 1uyt h ALA 2094N 0.93 0.25 0.00 2.41 0.00 -1.03 -3.10 119.26 118.72 1uyt h ALA 2094Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1uyt h ALA 2094Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1uyt h ALA 2094CO 0.00 0.26 0.05 0.22 0.00 0.00 0.00 179.25 179.79 1uyt h ASP 2095N 0.10 0.00 0.49 0.00 1.82 -0.76 0.10 116.42 118.17 1uyt h ASP 2095Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1uyt h ASP 2095Cb 0.88 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.89 1uyt h ASP 2095CO 0.07 0.00 -0.11 0.18 -1.61 0.00 0.00 179.24 177.77 1uyt n LEU 2096N -2.39 0.33 -0.02 2.28 4.77 -0.98 -3.40 117.00 117.58 1uyt n LEU 2096Ca -0.02 0.12 -0.18 0.00 -0.03 0.00 0.00 56.01 55.91 1uyt n LEU 2096Cb 0.09 -0.24 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 1uyt n LEU 2096CO 0.11 0.06 -0.84 1.41 -1.33 0.00 0.00 177.39 176.80 1uyt n HIS 2097N -1.13 0.97 0.07 -1.77 8.25 0.35 -4.32 115.22 117.65 1uyt n HIS 2097Ca 0.13 0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 1uyt n HIS 2097Cb 0.28 -1.14 0.00 0.00 1.12 0.00 0.00 29.99 30.25 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 -3.32 3.64 -4.81 0.41 10.43 -1.22 -4.73 116.55 116.95 1uyt n ASP 2098Ca -0.31 -1.96 -0.28 0.00 2.57 0.00 0.00 54.79 54.82 1uyt n ASP 2098Cb 1.05 -0.73 -0.05 0.00 1.84 0.00 0.00 41.12 43.23 1uyt n ASP 2098CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1uyt s ARG 2099N 0.29 2.97 0.37 -1.24 1.81 -1.26 -2.82 118.95 119.08 1uyt s ARG 2099Ca 0.00 -0.76 0.06 0.00 -1.72 0.00 0.00 55.73 53.31 1uyt s ARG 2099Cb 0.00 -2.72 0.77 0.00 -0.45 0.00 0.00 34.95 32.54 1uyt s ARG 2099CO 0.00 0.52 1.97 0.66 -0.68 0.00 0.00 175.30 177.78 1uyt h SER 2100N 2.71 0.63 -0.68 0.23 4.64 -1.82 -1.88 113.55 117.37 1uyt h SER 2100Ca -0.47 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 60.90 1uyt h SER 2100Cb 1.19 -0.14 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 1uyt h SER 2100CO 0.65 0.41 0.39 0.28 -0.87 0.00 0.00 176.83 177.70 1uyt h SER 2101N 0.72 0.61 -0.34 4.97 0.02 -1.94 -0.60 113.55 116.99 1uyt h SER 2101Ca 0.29 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1uyt h SER 2101Cb 0.22 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1uyt h SER 2101CO -0.09 0.40 -0.09 -0.09 -1.14 0.00 0.00 176.83 175.82 1uyt h ARG 2102N 0.74 0.75 -0.74 3.45 2.43 -1.64 0.03 114.38 119.40 1uyt h ARG 2102Ca 0.30 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1uyt h ARG 2102Cb 0.14 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 1uyt h ARG 2102CO -0.16 0.82 0.47 0.52 -1.51 0.00 0.00 179.97 180.11 1uyt h MET 2103N 0.69 0.99 -0.44 0.20 2.86 -0.99 0.64 114.93 118.87 1uyt h MET 2103Ca 0.12 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.61 1uyt h MET 2103Cb 0.55 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1uyt h MET 2103CO 0.03 0.68 -0.01 0.28 1.06 0.00 0.00 176.91 178.95 1uyt h VAL 2104N 1.01 1.26 -0.21 -2.22 2.07 -0.76 -0.62 116.25 116.78 1uyt h VAL 2104Ca 0.27 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.73 1uyt h VAL 2104Cb -0.08 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1uyt h VAL 2104CO -0.05 0.36 0.12 0.00 0.02 0.00 0.00 177.57 178.02 1uyt h ALA 2105N 0.90 0.27 0.00 1.67 0.00 0.04 -1.91 119.26 120.22 1uyt h ALA 2105Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uyt h ALA 2105Cb 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1uyt h ALA 2105CO 0.02 -0.22 0.00 1.63 0.00 0.00 0.00 179.25 180.68 1uyt n LYS 2106N -4.91 0.04 -2.46 0.00 4.76 0.21 -4.91 118.16 110.89 1uyt n LYS 2106Ca -0.03 0.14 -0.09 0.00 -2.87 0.00 0.00 58.31 55.46 1uyt n LYS 2106Cb 0.05 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.75 1uyt n LYS 2106CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1uyt n GLY 2107N 0.59 0.12 0.49 0.72 0.00 -0.34 -4.94 105.19 101.83 1uyt n GLY 2107Ca 0.06 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.85 0.00 -4.09 1.61 0.24 -0.62 -4.92 118.33 106.70 1uyt n VAL 2108Ca -0.07 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.34 61.88 1uyt n VAL 2108Cb 0.56 1.03 -0.11 0.00 -1.47 0.00 0.00 33.84 33.85 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 -2.40 0.45 0.13 1.34 -4.36 -1.25 -4.79 121.20 110.32 1uyt s ILE 2109Ca 0.22 -1.46 -0.08 0.00 -0.26 0.00 0.00 60.65 59.07 1uyt s ILE 2109Cb 0.19 -1.06 -0.15 0.00 1.25 0.00 0.00 42.46 42.69 1uyt s ILE 2109CO 0.51 -0.68 1.34 0.28 0.24 0.00 0.00 174.94 176.63 1uyt h SER 2110N 3.78 0.75 -5.01 4.36 0.02 -1.37 -3.45 113.55 112.63 1uyt h SER 2110Ca -0.35 -0.51 0.12 0.00 -0.84 0.00 0.00 61.79 60.22 1uyt h SER 2110Cb 1.18 -0.22 -0.11 0.00 0.14 0.00 0.00 62.40 63.39 1uyt h SER 2110CO 0.53 1.29 0.43 -0.54 -1.14 0.00 0.00 176.83 177.40 1uyt s LYS 2111N -3.62 1.12 0.08 3.45 1.02 -1.26 -5.10 119.74 115.43 1uyt s LYS 2111Ca -0.08 -0.54 0.05 0.00 0.02 0.00 0.00 55.97 55.43 1uyt s LYS 2111Cb 0.09 0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 37.80 1uyt s LYS 2111CO 0.88 -0.51 -0.05 -1.83 -0.92 0.00 0.00 175.35 172.92 1uyt s GLU 2112N -3.34 2.37 0.22 1.68 -1.05 -1.26 -2.72 118.70 114.60 1uyt s GLU 2112Ca 0.08 -0.89 -0.01 0.00 -0.15 0.00 0.00 54.97 54.00 1uyt s GLU 2112Cb -0.02 -2.44 -0.03 0.00 -0.44 0.00 0.00 34.13 31.20 1uyt s GLU 2112CO -0.03 0.54 0.18 -0.51 0.95 0.00 0.00 175.26 176.39 1uyt s LEU 2113N -2.11 1.14 -0.23 1.83 1.43 -0.71 -4.94 118.68 115.09 1uyt s LEU 2113Ca 0.22 -1.39 -0.04 0.00 -1.03 0.00 0.00 54.13 51.89 1uyt s LEU 2113Cb -0.11 0.55 -0.01 0.00 0.03 0.00 0.00 46.19 46.65 1uyt s LEU 2113CO 0.14 -0.90 -0.02 -1.61 0.23 0.00 0.00 176.35 174.20 1uyt s GLU 2114N -4.05 3.35 0.11 1.70 2.02 -1.26 -0.63 118.70 119.94 1uyt s GLU 2114Ca 0.38 -0.65 -0.08 0.00 0.02 0.00 0.00 54.97 54.63 1uyt s GLU 2114Cb 0.06 -3.09 0.11 0.00 0.10 0.00 0.00 34.13 31.31 1uyt s GLU 2114CO 0.14 -0.24 0.72 1.87 0.02 0.00 0.00 175.26 177.77 1uyt n TRP 2115N 4.81 0.01 -0.31 1.61 -0.00 -1.26 0.13 117.44 122.42 1uyt n TRP 2115Ca -0.17 0.57 0.19 0.00 -0.00 0.00 0.00 57.50 58.09 1uyt n TRP 2115Cb 0.50 -0.67 0.45 0.00 -0.00 0.00 0.00 31.31 31.59 1uyt n TRP 2115CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 177.69 178.84 1uyt h THR 2116N 0.00 0.62 -0.24 5.87 2.02 -1.95 -0.96 112.91 118.26 1uyt h THR 2116Ca 0.16 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1uyt h THR 2116Cb 0.28 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1uyt h THR 2116CO -0.46 0.09 0.00 -0.62 0.37 0.00 0.00 175.52 174.90 1uyt n GLU 2117N -4.65 2.41 -0.15 6.66 -0.58 0.12 -2.11 120.64 122.34 1uyt n GLU 2117Ca 0.23 -2.11 -0.04 0.00 -0.42 0.00 0.00 57.16 54.83 1uyt n GLU 2117Cb 0.74 -1.49 0.05 0.00 -0.57 0.00 0.00 31.44 30.17 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 4.58 0.59 -0.02 0.62 0.00 -0.87 -1.16 119.26 123.01 1uyt h ALA 2118Ca 0.00 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1uyt h ALA 2118Cb 0.97 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1uyt h ALA 2118CO 0.00 -0.20 -0.24 -0.09 0.00 0.00 0.00 179.25 178.71 1uyt h ARG 2119N 0.37 -0.36 -0.22 0.00 2.43 -1.80 0.28 114.38 115.08 1uyt h ARG 2119Ca 0.22 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1uyt h ARG 2119Cb 0.21 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 1uyt h ARG 2119CO -0.22 -0.24 0.10 0.00 -1.51 0.00 0.00 179.97 178.10 1uyt h ARG 2120N -0.37 0.21 0.51 0.20 3.08 -1.69 0.64 114.38 116.96 1uyt h ARG 2120Ca 0.07 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1uyt h ARG 2120Cb 0.46 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1uyt h ARG 2120CO -0.23 0.14 -0.24 0.35 -1.07 0.00 0.00 179.97 178.91 1uyt h PHE 2121N 0.21 -0.63 -0.74 3.04 3.57 -0.78 -3.05 116.94 118.55 1uyt h PHE 2121Ca 0.09 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1uyt h PHE 2121Cb 0.04 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1uyt h PHE 2121CO -0.10 -0.35 0.29 0.74 -2.23 0.00 0.00 178.31 176.66 1uyt h PHE 2122N -0.77 1.12 -0.24 0.41 0.05 -0.42 -0.43 116.94 116.66 1uyt h PHE 2122Ca -0.07 -0.08 0.06 0.00 3.82 0.00 0.00 57.97 61.70 1uyt h PHE 2122Cb 0.56 -0.34 -0.07 0.00 2.00 0.00 0.00 35.95 38.11 1uyt h PHE 2122CO -0.02 0.85 -0.20 0.35 -0.18 0.00 0.00 178.31 179.11 1uyt h PHE 2123N 1.08 -0.52 -0.00 -0.55 3.57 -0.86 0.49 116.94 120.14 1uyt h PHE 2123Ca 0.25 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.63 1uyt h PHE 2123Cb 0.21 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 1uyt h PHE 2123CO 0.02 -0.28 -0.74 -1.49 -2.23 0.00 0.00 178.31 173.59 1uyt h TRP 2124N -0.20 0.01 -0.13 0.41 4.06 -1.41 -1.12 115.95 117.57 1uyt h TRP 2124Ca 0.14 -0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.02 1uyt h TRP 2124Cb 0.41 -0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.56 1uyt h TRP 2124CO -0.36 0.74 -0.15 -0.09 -3.56 0.00 0.00 178.44 175.03 1uyt h ARG 2125N 0.00 0.33 -0.06 0.49 9.65 -0.55 -0.51 114.38 123.73 1uyt h ARG 2125Ca -0.01 -0.18 -0.00 0.00 -1.10 0.00 0.00 59.98 58.69 1uyt h ARG 2125Cb 1.31 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.89 1uyt h ARG 2125CO 0.10 0.74 0.02 1.25 2.80 0.00 0.00 179.97 184.88 1uyt h LEU 2126N -0.05 0.09 -0.91 3.80 5.85 -0.04 0.24 115.31 124.29 1uyt h LEU 2126Ca 0.02 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.63 1uyt h LEU 2126Cb 0.68 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 1uyt h LEU 2126CO 0.04 0.25 0.57 -0.09 -0.34 0.00 0.00 178.44 178.87 1uyt h ARG 2127N -0.07 0.99 -0.02 1.25 9.65 -1.23 0.16 114.38 125.11 1uyt h ARG 2127Ca 0.02 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1uyt h ARG 2127Cb 0.19 -0.22 -0.00 0.00 -1.39 0.00 0.00 29.97 28.54 1uyt h ARG 2127CO -0.00 0.66 0.00 -0.09 2.80 0.00 0.00 179.97 183.34 1uyt h ARG 2128N 1.02 0.03 -0.39 0.20 1.12 -0.82 -1.96 114.38 113.58 1uyt h ARG 2128Ca 0.41 -0.01 0.06 0.00 -1.11 0.00 0.00 59.98 59.33 1uyt h ARG 2128Cb 0.21 -0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.12 1uyt h ARG 2128CO -0.19 0.29 0.07 0.00 -3.11 0.00 0.00 179.97 177.03 1uyt h ARG 2129N -0.24 0.18 -0.19 0.20 2.47 -0.30 -1.28 114.38 115.23 1uyt h ARG 2129Ca 0.00 -0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.73 1uyt h ARG 2129Cb 0.28 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.54 1uyt h ARG 2129CO 0.00 0.12 0.07 -0.07 0.56 0.00 0.00 179.97 180.66 1uyt h LEU 2130N 0.19 0.10 -0.87 3.04 3.38 -0.65 -0.98 115.31 119.52 1uyt h LEU 2130Ca 0.19 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1uyt h LEU 2130Cb 0.23 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1uyt h LEU 2130CO -0.26 0.08 0.54 0.78 0.09 0.00 0.00 178.44 179.67 1uyt h ASN 2131N 0.17 0.84 -0.31 -0.43 -0.26 -0.87 -0.18 115.58 114.54 1uyt h ASN 2131Ca 0.08 0.02 -0.14 0.00 -0.56 0.00 0.00 56.30 55.70 1uyt h ASN 2131Cb 0.04 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.13 1uyt h ASN 2131CO -0.07 0.53 -0.32 -0.33 -1.06 0.00 0.00 177.43 176.17 1uyt h GLU 2132N 0.97 0.84 -0.45 0.81 5.08 -0.88 -2.72 114.58 118.22 1uyt h GLU 2132Ca 0.38 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1uyt h GLU 2132Cb 0.19 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1uyt h GLU 2132CO -0.18 1.04 0.27 0.93 -1.00 0.00 0.00 179.01 180.07 1uyt h GLU 2133N 0.70 0.61 -0.65 2.33 4.39 -0.44 -0.03 114.58 121.49 1uyt h GLU 2133Ca 0.07 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.74 1uyt h GLU 2133Cb 0.88 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 1uyt h GLU 2133CO 0.08 0.45 0.43 -0.92 -1.16 0.00 0.00 179.01 177.88 1uyt h TYR 2134N 0.60 0.79 -0.06 4.33 5.03 -0.98 -0.66 116.97 126.01 1uyt h TYR 2134Ca 0.16 0.02 -0.17 0.00 2.58 0.00 0.00 58.73 61.32 1uyt h TYR 2134Cb -0.01 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 38.00 1uyt h TYR 2134CO -0.03 0.48 -0.71 -0.07 -1.32 0.00 0.00 178.16 176.51 1uyt h LEU 2135N 0.83 0.34 -0.38 2.82 3.38 -1.05 -2.01 115.31 119.25 1uyt h LEU 2135Ca 0.25 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1uyt h LEU 2135Cb -0.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1uyt h LEU 2135CO -0.06 0.94 0.08 0.40 0.09 0.00 0.00 178.44 179.89 1uyt h ILE 2136N 0.20 1.23 0.18 1.22 2.04 -0.06 -2.25 117.51 120.07 1uyt h ILE 2136Ca -0.02 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1uyt h ILE 2136Cb 1.27 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1uyt h ILE 2136CO 0.11 0.28 -0.08 0.11 0.00 0.00 0.00 178.15 178.57 1uyt h LYS 2137N 0.47 -0.23 -0.57 2.37 1.57 -1.09 -0.04 116.57 119.06 1uyt h LYS 2137Ca 0.12 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 59.08 1uyt h LYS 2137Cb 0.33 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1uyt h LYS 2137CO 0.00 -0.07 0.41 0.00 -0.57 0.00 0.00 179.45 179.22 1uyt h ARG 2138N -0.34 0.01 0.02 3.15 3.08 -1.30 0.16 114.38 119.17 1uyt h ARG 2138Ca -0.02 -0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.79 1uyt h ARG 2138Cb 0.26 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1uyt h ARG 2138CO 0.04 0.01 -1.18 1.25 -1.07 0.00 0.00 179.97 179.02 1uyt h LEU 2139N 0.01 0.08 0.00 3.04 5.85 -0.95 -3.20 115.31 120.15 1uyt h LEU 2139Ca 0.27 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1uyt h LEU 2139Cb 1.08 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1uyt h LEU 2139CO -0.01 1.08 0.00 -1.20 -0.34 0.00 0.00 178.44 177.97 1uyt n SER 2140N -3.33 0.00 -0.13 1.25 7.64 0.54 -1.67 113.62 117.91 1uyt n SER 2140Ca -0.05 0.29 -0.27 0.00 1.01 0.00 0.00 58.87 59.85 1uyt n SER 2140Cb 0.97 -0.36 -0.11 0.00 -1.01 0.00 0.00 64.21 63.71 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 -1.36 0.25 -0.04 1.43 8.25 -1.14 -3.10 115.22 119.52 1uyt n HIS 2141Ca 0.03 0.10 -0.09 0.00 -0.26 0.00 0.00 57.72 57.49 1uyt n HIS 2141Cb 0.06 -1.03 -0.03 0.00 1.12 0.00 0.00 29.99 30.12 1uyt n HIS 2141CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1uyt h GLN 2142N -0.92 0.15 -2.74 -0.41 1.08 -1.53 -3.32 115.11 107.41 1uyt h GLN 2142Ca -0.62 -0.01 -0.61 0.00 -1.45 0.00 0.00 58.65 55.97 1uyt h GLN 2142Cb 1.58 -0.03 -0.40 0.00 -0.05 0.00 0.00 27.48 28.57 1uyt h GLN 2142CO -0.35 0.10 -0.74 1.33 -0.95 0.00 0.00 178.83 178.21 1uyt n VAL 2143N -5.05 0.53 -0.87 -0.54 0.24 -0.67 -5.01 118.33 106.95 1uyt n VAL 2143Ca -0.03 -4.32 -0.14 0.00 -2.04 0.00 0.00 64.34 57.82 1uyt n VAL 2143Cb 0.07 -1.98 -0.12 0.00 -1.47 0.00 0.00 33.84 30.34 1uyt n VAL 2143CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1uyt n GLY 2144N 2.22 2.85 2.70 7.63 0.00 -1.18 -4.03 105.19 115.38 1uyt n GLY 2144Ca 0.24 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.15 1uyt n GLY 2144CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1uyt n GLU 2145N 2.78 0.57 -3.76 1.61 0.00 -1.26 -5.05 120.64 115.53 1uyt n GLU 2145Ca 0.41 -1.32 -0.13 0.00 0.00 0.00 0.00 57.16 56.11 1uyt n GLU 2145Cb 0.67 -0.69 -0.09 0.00 0.00 0.00 0.00 31.44 31.33 1uyt n GLU 2145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1uyt s ALA 2146N 0.23 -0.82 0.40 -1.84 0.00 -1.26 -5.14 121.76 113.34 1uyt s ALA 2146Ca 0.23 0.59 -0.27 0.00 0.00 0.00 0.00 51.96 52.52 1uyt s ALA 2146Cb 0.27 -0.19 -0.10 0.00 0.00 0.00 0.00 23.12 23.10 1uyt s ALA 2146CO -0.14 -0.22 1.47 0.45 0.00 0.00 0.00 175.76 177.32 1uyt s SER 2147N -0.71 6.19 0.32 0.00 0.15 -1.26 -4.81 113.70 113.59 1uyt s SER 2147Ca -0.08 3.02 0.05 0.00 0.70 0.00 0.00 55.95 59.64 1uyt s SER 2147Cb -0.04 -2.66 0.68 0.00 -1.71 0.00 0.00 66.02 62.28 1uyt s SER 2147CO 0.03 -0.97 1.87 -0.09 1.20 0.00 0.00 173.24 175.27 1uyt h ARG 2148N 2.79 0.83 -0.17 5.44 2.43 -2.01 0.26 114.38 123.95 1uyt h ARG 2148Ca -0.51 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 58.56 1uyt h ARG 2148Cb 1.25 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 1uyt h ARG 2148CO 0.63 0.55 -0.14 1.25 -1.51 0.00 0.00 179.97 180.75 1uyt h LEU 2149N 0.85 0.26 -0.24 3.80 7.12 -2.00 -1.67 115.31 123.44 1uyt h LEU 2149Ca 0.45 -0.06 -0.21 0.00 0.13 0.00 0.00 57.88 58.20 1uyt h LEU 2149Cb 0.55 -0.07 -0.00 0.00 -0.53 0.00 0.00 40.66 40.60 1uyt h LEU 2149CO -0.22 0.43 -0.90 -0.33 -0.13 0.00 0.00 178.44 177.29 1uyt h GLU 2150N 0.26 0.30 -0.25 1.25 5.08 -0.92 -2.63 114.58 117.66 1uyt h GLU 2150Ca 0.05 -0.32 -0.07 0.00 -1.00 0.00 0.00 59.36 58.02 1uyt h GLU 2150Cb 0.41 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1uyt h GLU 2150CO 0.02 1.02 -0.13 0.87 -1.00 0.00 0.00 179.01 179.79 1uyt h LYS 2151N 0.17 0.54 -0.39 2.33 1.57 -0.55 -1.52 116.57 118.72 1uyt h LYS 2151Ca -0.06 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.41 1uyt h LYS 2151Cb 1.53 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.81 1uyt h LYS 2151CO 0.15 0.80 -0.07 0.82 -0.57 0.00 0.00 179.45 180.58 1uyt h ILE 2152N 0.26 1.24 0.39 1.86 2.04 -1.38 -1.38 117.51 120.54 1uyt h ILE 2152Ca 0.06 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 1uyt h ILE 2152Cb 0.64 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1uyt h ILE 2152CO 0.04 0.35 -0.19 0.00 0.00 0.00 0.00 178.15 178.35 1uyt h ALA 2153N 1.32 -0.52 -0.09 1.87 0.00 -1.35 0.20 119.26 120.70 1uyt h ALA 2153Ca 0.11 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1uyt h ALA 2153Cb 0.48 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 1uyt h ALA 2153CO 0.03 -0.73 -0.29 -0.09 0.00 0.00 0.00 179.25 178.17 1uyt h ARG 2154N -0.65 -0.37 -0.20 0.00 9.65 -1.09 0.22 114.38 121.95 1uyt h ARG 2154Ca -0.05 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.90 1uyt h ARG 2154Cb 0.47 0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 29.09 1uyt h ARG 2154CO 0.09 -0.25 -0.08 0.82 2.80 0.00 0.00 179.97 183.35 1uyt h ILE 2155N -0.38 0.74 0.00 1.20 2.04 -1.18 -0.95 117.51 118.97 1uyt h ILE 2155Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 1uyt h ILE 2155Cb 0.52 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1uyt h ILE 2155CO -0.31 0.00 0.00 0.54 0.00 0.00 0.00 178.15 178.38 1uyt n ARG 2156N -5.23 0.18 0.15 2.37 1.74 0.71 -1.73 116.66 114.85 1uyt n ARG 2156Ca -0.02 0.47 0.12 0.00 -0.77 0.00 0.00 57.85 57.66 1uyt n ARG 2156Cb 0.15 -1.89 0.27 0.00 -1.02 0.00 0.00 32.46 29.98 1uyt n ARG 2156CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1uyt h SER 2157N 0.00 0.00 1.69 0.55 4.64 0.85 -3.09 113.55 118.19 1uyt h SER 2157Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1uyt h SER 2157Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1uyt h SER 2157CO 0.00 0.01 0.00 -0.50 -0.87 0.00 0.00 176.83 175.47 1uyt h TRP 2158N 0.00 0.00 -2.73 4.77 6.55 -1.18 -3.45 115.95 119.91 1uyt h TRP 2158Ca 0.00 0.00 -0.53 0.00 0.95 0.00 0.00 58.89 59.31 1uyt h TRP 2158Cb 0.86 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 29.18 1uyt h TRP 2158CO 0.00 0.00 0.96 0.71 -1.05 0.00 0.00 178.44 179.06 1uyt s TYR 2159N -3.17 2.55 0.77 0.49 4.12 -1.17 -4.96 117.35 115.97 1uyt s TYR 2159Ca 0.08 0.42 -0.15 0.00 0.02 0.00 0.00 57.07 57.44 1uyt s TYR 2159Cb 0.09 -3.92 0.00 0.00 -1.52 0.00 0.00 41.96 36.61 1uyt s TYR 2159CO 0.62 -3.62 0.74 -2.30 0.02 0.00 0.00 175.55 171.01 1uyt n PRO 2160N 5.39 0.26 0.29 -1.71 -0.02 -1.26 -4.86 135.00 133.09 1uyt n PRO 2160Ca 0.15 0.14 0.15 0.00 -2.02 0.00 0.00 63.50 61.92 1uyt n PRO 2160Cb 0.41 -2.04 0.89 0.00 -0.02 0.00 0.00 33.50 32.74 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 -0.59 1.54 0.00 3.55 0.00 -1.96 -1.18 119.26 120.62 1uyt h ALA 2161Ca -0.46 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1uyt h ALA 2161Cb 1.33 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1uyt h ALA 2161CO 0.43 0.01 -0.13 0.66 0.00 0.00 0.00 179.25 180.22 1uyt h SER 2162N 0.00 0.00 -3.35 0.00 4.64 -2.02 -3.43 113.55 109.38 1uyt h SER 2162Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1uyt h SER 2162Cb 0.02 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.04 1uyt h SER 2162CO 0.00 0.13 0.22 -0.69 -0.87 0.00 0.00 176.83 175.62 1uyt s VAL 2163N -3.68 4.97 -0.53 0.95 1.01 -0.45 -5.02 120.40 117.65 1uyt s VAL 2163Ca 0.01 1.49 -0.27 0.00 0.00 0.00 0.00 61.98 63.21 1uyt s VAL 2163Cb 0.10 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 32.44 1uyt s VAL 2163CO 0.60 0.14 1.06 -0.62 0.00 0.00 0.00 175.10 176.28 1uyt s ASP 2164N 1.02 6.47 0.54 3.32 2.15 -1.26 -4.86 116.67 124.03 1uyt s ASP 2164Ca 0.37 0.06 0.39 0.00 0.43 0.00 0.00 52.55 53.79 1uyt s ASP 2164Cb -0.17 -2.50 1.57 0.00 -0.30 0.00 0.00 42.92 41.52 1uyt s ASP 2164CO 0.15 -1.28 1.75 0.45 -0.17 0.00 0.00 175.17 176.07 1uyt h HIS 2165N 9.32 0.05 -0.00 -5.34 3.86 -1.95 0.84 115.15 121.93 1uyt h HIS 2165Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.97 1uyt h HIS 2165Cb 1.07 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.52 1uyt h HIS 2165CO 0.96 -0.00 -0.34 0.39 0.86 0.00 0.00 177.93 179.79 1uyt n GLU 2166N -4.17 0.27 -3.20 2.45 -0.58 -1.26 -4.75 120.64 109.40 1uyt n GLU 2166Ca 0.30 -0.14 -0.43 0.00 -0.42 0.00 0.00 57.16 56.47 1uyt n GLU 2166Cb 1.39 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 30.69 1uyt n GLU 2166CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1uyt s ASP 2167N -2.83 6.26 0.13 1.62 -1.08 0.29 -4.94 116.67 116.12 1uyt s ASP 2167Ca 0.16 -0.56 -0.21 0.00 -0.52 0.00 0.00 52.55 51.42 1uyt s ASP 2167Cb 0.18 -2.28 -0.01 0.00 -1.46 0.00 0.00 42.92 39.36 1uyt s ASP 2167CO 0.61 -0.72 1.67 0.44 0.52 0.00 0.00 175.17 177.70 1uyt h ASP 2168N 8.83 -0.44 -0.60 -0.34 3.45 -1.85 -0.75 116.42 124.72 1uyt h ASP 2168Ca -0.26 0.09 -0.02 0.00 0.43 0.00 0.00 57.03 57.27 1uyt h ASP 2168Cb 1.10 0.22 -0.03 0.00 -0.56 0.00 0.00 39.33 40.06 1uyt h ASP 2168CO 0.86 -0.18 0.30 -0.09 -1.57 0.00 0.00 179.24 178.57 1uyt h ARG 2169N -0.15 0.85 -0.44 3.56 2.43 -1.93 -0.88 114.38 117.83 1uyt h ARG 2169Ca 0.10 -0.12 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 1uyt h ARG 2169Cb 0.30 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1uyt h ARG 2169CO -0.26 0.67 -0.24 0.37 -1.51 0.00 0.00 179.97 179.01 1uyt h GLN 2170N 0.82 0.94 -0.24 0.20 4.15 -1.86 0.15 115.11 119.27 1uyt h GLN 2170Ca 0.21 -0.42 -0.02 0.00 0.77 0.00 0.00 58.65 59.19 1uyt h GLN 2170Cb 0.09 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 1uyt h GLN 2170CO -0.03 1.08 0.09 0.28 -1.93 0.00 0.00 178.83 178.32 1uyt h VAL 2171N 0.77 1.18 -0.16 2.39 2.07 -0.99 0.36 116.25 121.86 1uyt h VAL 2171Ca 0.09 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1uyt h VAL 2171Cb 0.82 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1uyt h VAL 2171CO 0.07 0.18 0.03 0.00 0.02 0.00 0.00 177.57 177.87 1uyt h ALA 2172N 0.92 0.22 -0.56 1.67 0.00 -1.13 -2.62 119.26 117.76 1uyt h ALA 2172Ca 0.08 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1uyt h ALA 2172Cb 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1uyt h ALA 2172CO -0.00 -0.13 0.29 1.15 0.00 0.00 0.00 179.25 180.55 1uyt h THR 2173N 0.06 0.94 -0.22 0.00 2.02 -0.58 -1.71 112.91 113.44 1uyt h THR 2173Ca 0.05 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.08 1uyt h THR 2173Cb 0.28 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1uyt h THR 2173CO 0.00 0.10 0.01 -0.25 0.37 0.00 0.00 175.52 175.75 1uyt h TRP 2174N 0.55 0.00 0.32 3.16 7.01 -0.81 -2.14 115.95 124.04 1uyt h TRP 2174Ca 0.25 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.27 1uyt h TRP 2174Cb 0.17 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.24 1uyt h TRP 2174CO -0.10 -0.02 -0.36 0.82 -2.79 0.00 0.00 178.44 175.99 1uyt h ILE 2175N 0.08 0.27 0.00 2.65 2.04 -1.06 0.80 117.51 122.29 1uyt h ILE 2175Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 1uyt h ILE 2175Cb 0.12 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1uyt h ILE 2175CO -0.17 0.00 0.00 -0.33 0.00 0.00 0.00 178.15 177.65 1uyt h GLU 2176N -0.72 0.00 0.00 2.37 5.08 -1.22 -2.05 114.58 118.05 1uyt h GLU 2176Ca -0.02 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 1uyt h GLU 2176Cb 0.66 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1uyt h GLU 2176CO -0.08 0.00 -1.95 0.39 -1.00 0.00 0.00 179.01 176.37 1uyt n GLU 2177N -3.05 0.66 -1.58 2.33 1.02 -0.82 -4.37 120.64 114.84 1uyt n GLU 2177Ca -0.03 -0.09 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 1uyt n GLU 2177Cb 0.09 -1.57 0.06 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.46 6.24 -0.13 1.62 4.13 0.23 -4.73 115.26 120.17 1uyt n ASN 2178Ca -0.11 -3.77 -0.09 0.00 1.68 0.00 0.00 54.58 52.30 1uyt n ASN 2178Cb 0.73 -0.70 -0.01 0.00 -1.54 0.00 0.00 39.78 38.26 1uyt n ASN 2178CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 1uyt h TYR 2179N 2.00 0.54 -0.28 3.10 0.99 -1.71 -1.75 116.97 119.85 1uyt h TYR 2179Ca 0.50 -0.02 -0.02 0.00 2.00 0.00 0.00 58.73 61.19 1uyt h TYR 2179Cb 1.20 -0.17 -0.02 0.00 1.00 0.00 0.00 36.73 38.74 1uyt h TYR 2179CO 1.19 0.42 0.09 0.87 -0.00 0.00 0.00 178.16 180.74 1uyt h LYS 2180N 0.49 0.40 -0.36 4.88 1.57 -1.91 -0.67 116.57 120.97 1uyt h LYS 2180Ca 0.13 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.71 1uyt h LYS 2180Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1uyt h LYS 2180CO -0.02 0.35 -0.38 1.15 -0.57 0.00 0.00 179.45 179.98 1uyt h THR 2181N 0.40 1.28 -0.18 -0.16 2.02 -1.82 -3.06 112.91 111.39 1uyt h THR 2181Ca 0.10 -1.56 -0.17 0.00 0.77 0.00 0.00 66.41 65.56 1uyt h THR 2181Cb 0.12 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1uyt h THR 2181CO -0.01 0.52 -0.58 -0.07 0.37 0.00 0.00 175.52 175.75 1uyt h LEU 2182N 0.72 0.65 -0.48 2.58 3.38 -0.71 -2.42 115.31 119.02 1uyt h LEU 2182Ca 0.06 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1uyt h LEU 2182Cb 0.96 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1uyt h LEU 2182CO 0.09 1.08 0.31 0.44 0.09 0.00 0.00 178.44 180.46 1uyt h ASP 2183N 0.44 0.56 0.42 -0.43 3.32 -1.12 -1.91 116.42 117.69 1uyt h ASP 2183Ca 0.00 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 1uyt h ASP 2183Cb 1.13 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1uyt h ASP 2183CO 0.11 0.42 -0.49 0.44 -1.72 0.00 0.00 179.24 178.00 1uyt h ASP 2184N 0.65 0.09 -0.45 6.45 3.45 -1.55 0.74 116.42 125.80 1uyt h ASP 2184Ca 0.18 -0.04 0.01 0.00 0.43 0.00 0.00 57.03 57.61 1uyt h ASP 2184Cb -0.06 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 38.66 1uyt h ASP 2184CO -0.04 0.57 0.30 0.50 -1.57 0.00 0.00 179.24 179.00 1uyt h LYS 2185N 0.07 0.55 0.00 3.56 1.63 -0.84 -1.18 116.57 120.36 1uyt h LYS 2185Ca 0.00 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.72 1uyt h LYS 2185Cb 0.89 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.39 1uyt h LYS 2185CO 0.07 0.37 -1.25 1.28 -3.45 0.00 0.00 179.45 176.46 1uyt n LEU 2186N -4.47 0.72 -0.27 5.20 4.77 -0.89 -4.22 117.00 117.83 1uyt n LEU 2186Ca 0.04 0.29 0.01 0.00 -0.03 0.00 0.00 56.01 56.32 1uyt n LEU 2186Cb 0.09 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.24 1uyt n LEU 2186CO 0.35 -0.08 0.69 0.50 -1.33 0.00 0.00 177.39 177.52 1uyt h LYS 2187N 0.00 -0.02 0.00 3.23 3.64 0.44 -3.04 116.57 120.81 1uyt h LYS 2187Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1uyt h LYS 2187Cb 1.15 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1uyt h LYS 2187CO 0.01 -0.01 0.00 0.41 -2.27 0.00 0.00 179.45 177.59 1uyt n GLY 2188N -1.50 -2.60 0.08 5.01 0.00 -1.22 -5.00 105.19 99.95 1uyt n GLY 2188Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1uyt n GLY 2188CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1uyt n LEU 2189N -0.89 -0.08 0.00 0.99 -0.00 -1.15 -5.18 117.00 110.68 1uyt n LEU 2189Ca 0.00 0.25 0.00 0.00 -0.00 0.00 0.00 56.01 56.26 1uyt n LEU 2189Cb 0.00 0.32 0.00 0.00 -0.00 0.00 0.00 43.42 43.74 1uyt n LEU 2189CO 0.00 -0.00 0.00 0.29 -0.00 0.00 0.00 177.39 177.68