#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0j s ILE 1483N 0.00 5.12 -0.67 0.52 -1.09 -1.26 -4.71 121.20 119.11 3h0j s ILE 1483Ca 0.00 -0.08 -0.08 0.00 -2.23 0.00 0.00 60.65 58.26 3h0j s ILE 1483Cb 0.00 -3.70 0.01 0.00 -1.58 0.00 0.00 42.46 37.19 3h0j s ILE 1483CO 0.00 -0.16 0.65 0.00 -1.23 0.00 0.00 174.94 174.20 3h0j n ALA 1484N -0.52 -2.66 -2.52 9.38 0.00 -1.26 -5.03 120.51 117.90 3h0j n ALA 1484Ca -0.03 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.29 3h0j n ALA 1484Cb 0.53 -1.79 -0.11 0.00 0.00 0.00 0.00 19.45 18.08 3h0j n ALA 1484CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3h0j s THR 1485N -2.72 3.13 0.17 0.00 -4.23 -1.26 -5.05 115.64 105.67 3h0j s THR 1485Ca 0.10 -1.20 -0.23 0.00 -1.18 0.00 0.00 61.69 59.17 3h0j s THR 1485Cb -0.02 -2.40 0.06 0.00 1.34 0.00 0.00 72.50 71.49 3h0j s THR 1485CO 0.81 0.23 1.58 -0.65 -0.54 0.00 0.00 174.62 176.06 3h0j h PRO 1486N 4.09 -0.23 -5.92 3.99 0.11 -2.01 -3.43 132.00 128.60 3h0j h PRO 1486Ca -0.49 0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.04 3h0j h PRO 1486Cb 1.16 0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.20 3h0j h PRO 1486CO 0.50 -0.15 -0.63 0.71 -0.21 0.00 0.00 178.00 178.21 3h0j s TYR 1487N -5.94 2.49 0.28 0.65 1.51 -1.26 -5.10 117.35 109.98 3h0j s TYR 1487Ca -0.15 -0.51 -0.28 0.00 -1.01 0.00 0.00 57.07 55.12 3h0j s TYR 1487Cb 0.14 -1.52 -0.14 0.00 -0.11 0.00 0.00 41.96 40.33 3h0j s TYR 1487CO 0.67 0.50 1.05 -0.35 -1.11 0.00 0.00 175.55 176.32 3h0j n PRO 1488N -0.91 1.42 -2.37 -1.71 -0.04 -1.26 -4.88 135.00 125.25 3h0j n PRO 1488Ca -0.04 0.50 -0.39 0.00 -0.04 0.00 0.00 63.50 63.52 3h0j n PRO 1488Cb 0.64 -1.90 -0.03 0.00 -0.04 0.00 0.00 33.50 32.16 3h0j n PRO 1488CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3h0j s VAL 1489N -0.97 3.62 0.20 0.52 1.01 -1.26 -4.89 120.40 118.63 3h0j s VAL 1489Ca 0.60 0.13 -0.14 0.00 0.00 0.00 0.00 61.98 62.57 3h0j s VAL 1489Cb -0.70 -4.59 0.21 0.00 0.00 0.00 0.00 36.38 31.30 3h0j s VAL 1489CO 0.59 -1.53 1.63 0.11 0.00 0.00 0.00 175.10 175.90 3h0j h LYS 1490N 11.50 -0.01 0.00 2.72 6.56 -1.97 0.37 116.57 135.74 3h0j h LYS 1490Ca -0.18 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 3h0j h LYS 1490Cb 1.07 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.73 3h0j h LYS 1490CO 1.28 -0.00 0.00 0.39 -2.06 0.00 0.00 179.45 179.05 3h0j n GLU 1491N -5.42 0.01 -0.12 3.15 1.02 -1.26 -2.11 120.64 115.91 3h0j n GLU 1491Ca 0.07 0.36 -0.20 0.00 -0.02 0.00 0.00 57.16 57.37 3h0j n GLU 1491Cb 0.31 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.13 3h0j n GLU 1491CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 3h0j n TRP 1492N -1.37 0.00 -0.10 -0.32 -0.00 0.08 -3.24 117.44 112.49 3h0j n TRP 1492Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.50 57.65 3h0j n TRP 1492Cb 0.01 -0.89 0.54 0.00 -0.00 0.00 0.00 31.31 30.96 3h0j n TRP 1492CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 3h0j h LEU 1493N -0.29 0.31 -6.40 5.87 4.07 -1.00 -3.29 115.31 114.58 3h0j h LEU 1493Ca -0.56 0.01 -0.48 0.00 0.08 0.00 0.00 57.88 56.94 3h0j h LEU 1493Cb 1.72 -0.05 -0.35 0.00 1.08 0.00 0.00 40.66 43.07 3h0j h LEU 1493CO -0.18 0.17 -0.78 -1.58 -1.08 0.00 0.00 178.44 174.99 3h0j s GLN 1494N -5.33 0.65 0.56 1.13 -0.44 -1.00 -5.02 119.66 110.21 3h0j s GLN 1494Ca -0.07 -1.21 0.32 0.00 -2.50 0.00 0.00 55.36 51.90 3h0j s GLN 1494Cb 0.20 -1.02 1.47 0.00 -1.64 0.00 0.00 33.01 32.02 3h0j s GLN 1494CO 0.75 -1.23 1.82 -1.00 0.50 0.00 0.00 175.29 176.13 3h0j h PRO 1495N 6.80 0.00 -0.27 1.67 0.13 -1.63 0.11 132.00 138.81 3h0j h PRO 1495Ca 0.08 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.27 3h0j h PRO 1495Cb 1.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 3h0j h PRO 1495CO 0.24 0.00 0.19 0.87 -0.23 0.00 0.00 178.00 179.07 3h0j h LYS 1496N 0.00 0.09 -0.34 0.86 1.57 -1.94 0.11 116.57 116.92 3h0j h LYS 1496Ca 0.43 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.17 3h0j h LYS 1496Cb 1.86 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 3h0j h LYS 1496CO -0.00 0.06 0.08 -0.09 -0.57 0.00 0.00 179.45 178.92 3h0j h ARG 1497N 0.09 0.49 -0.17 3.15 2.43 -1.26 0.04 114.38 119.15 3h0j h ARG 1497Ca 0.13 -0.08 -0.22 0.00 -0.81 0.00 0.00 59.98 59.00 3h0j h ARG 1497Cb 0.38 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.86 3h0j h ARG 1497CO -0.01 0.46 -0.75 -0.92 -1.51 0.00 0.00 179.97 177.23 3h0j h TYR 1498N 0.48 1.07 -0.91 2.20 -0.00 -0.94 -2.67 116.97 116.20 3h0j h TYR 1498Ca 0.11 -0.46 -0.01 0.00 -0.00 0.00 0.00 58.73 58.37 3h0j h TYR 1498Cb 0.19 -0.17 -0.04 0.00 -0.00 0.00 0.00 36.73 36.71 3h0j h TYR 1498CO 0.01 1.30 0.54 -0.22 -0.00 0.00 0.00 178.16 179.78 3h0j h LYS 1499N 0.55 1.24 0.30 1.82 3.64 -0.49 0.26 116.57 123.90 3h0j h LYS 1499Ca -0.05 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 3h0j h LYS 1499Cb 1.38 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3h0j h LYS 1499CO 0.16 0.87 -0.15 0.00 -2.27 0.00 0.00 179.45 178.06 3h0j h ALA 1500N 1.33 -0.41 -0.40 5.00 0.00 -0.99 -2.54 119.26 121.25 3h0j h ALA 1500Ca 0.33 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3h0j h ALA 1500Cb -0.04 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 3h0j h ALA 1500CO -0.06 -0.69 0.01 0.45 0.00 0.00 0.00 179.25 178.97 3h0j h HIS 1501N -0.49 -0.00 -0.34 0.00 3.86 -1.07 0.27 115.15 117.38 3h0j h HIS 1501Ca -0.04 0.03 0.10 0.00 -1.16 0.00 0.00 60.37 59.30 3h0j h HIS 1501Cb 0.37 0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 3h0j h HIS 1501CO -0.03 -0.07 0.51 -0.07 0.86 0.00 0.00 177.93 179.13 3h0j h LEU 1502N 0.12 0.00 -2.22 2.43 4.07 -0.25 1.15 115.31 120.61 3h0j h LEU 1502Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3h0j h LEU 1502Cb 0.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.02 3h0j h LEU 1502CO -0.32 0.00 0.00 0.23 -1.08 0.00 0.00 178.44 177.27 3h0j n MET 1503N -3.39 2.41 -3.28 1.13 2.81 0.94 -4.95 117.12 112.77 3h0j n MET 1503Ca 0.06 -2.17 -0.17 0.00 -1.81 0.00 0.00 57.70 53.60 3h0j n MET 1503Cb 0.66 -1.48 0.06 0.00 -0.71 0.00 0.00 33.22 31.74 3h0j n MET 1503CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h0j n GLY 1504N 1.47 -0.13 3.23 3.03 0.00 0.39 -4.95 105.19 108.23 3h0j n GLY 1504Ca 0.20 -0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 3h0j n GLY 1504CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h0j s THR 1505N -3.23 0.09 0.31 2.61 -1.32 -1.15 -4.73 115.64 108.23 3h0j s THR 1505Ca 0.42 -0.77 -0.28 0.00 -1.21 0.00 0.00 61.69 59.85 3h0j s THR 1505Cb -0.19 -0.95 -0.10 0.00 -1.51 0.00 0.00 72.50 69.76 3h0j s THR 1505CO 0.52 -0.42 1.15 -0.89 -2.21 0.00 0.00 174.62 172.77 3h0j s THR 1506N -2.62 3.29 0.05 5.08 2.01 -1.26 -3.38 115.64 118.80 3h0j s THR 1506Ca -0.04 1.25 -0.31 0.00 0.31 0.00 0.00 61.69 62.90 3h0j s THR 1506Cb -0.01 -3.77 -0.06 0.00 0.01 0.00 0.00 72.50 68.67 3h0j s THR 1506CO -0.04 0.26 1.24 -0.47 -0.69 0.00 0.00 174.62 174.93 3h0j s TYR 1507N -1.22 3.33 0.11 4.92 6.14 -1.26 -4.95 117.35 124.42 3h0j s TYR 1507Ca 0.48 1.20 -0.22 0.00 0.64 0.00 0.00 57.07 59.17 3h0j s TYR 1507Cb -0.33 -3.48 -0.05 0.00 0.42 0.00 0.00 41.96 38.52 3h0j s TYR 1507CO 0.43 -1.55 1.20 1.33 0.64 0.00 0.00 175.55 177.60 3h0j n VAL 1508N 4.07 -0.47 0.00 3.14 0.24 -1.26 0.23 118.33 124.27 3h0j n VAL 1508Ca 0.10 1.87 0.00 0.00 -2.04 0.00 0.00 64.34 64.27 3h0j n VAL 1508Cb 0.45 -2.33 0.00 0.00 -1.47 0.00 0.00 33.84 30.50 3h0j n VAL 1508CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 3h0j n TYR 1509N -4.70 0.00 0.09 6.34 4.02 -1.26 -0.31 117.16 121.34 3h0j n TYR 1509Ca 0.01 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.02 3h0j n TYR 1509Cb 0.18 -0.35 -0.09 0.00 -0.02 0.00 0.00 39.34 39.07 3h0j n TYR 1509CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3h0j n ASP 1510N -1.33 0.39 -0.37 7.72 10.43 0.14 -4.40 116.55 129.12 3h0j n ASP 1510Ca 0.00 0.10 0.04 0.00 2.57 0.00 0.00 54.79 57.50 3h0j n ASP 1510Cb 0.05 1.30 0.20 0.00 1.84 0.00 0.00 41.12 44.52 3h0j n ASP 1510CO 0.00 0.00 0.00 -0.26 -1.07 0.00 0.00 177.20 175.87 3h0j h PHE 1511N 0.00 1.18 -0.62 1.24 0.05 -0.59 -1.32 116.94 116.88 3h0j h PHE 1511Ca 0.00 0.03 0.11 0.00 3.82 0.00 0.00 57.97 61.93 3h0j h PHE 1511Cb 0.97 -0.38 -0.04 0.00 2.00 0.00 0.00 35.95 38.50 3h0j h PHE 1511CO 0.00 0.56 0.42 -1.35 -0.18 0.00 0.00 178.31 177.75 3h0j h PRO 1512N 1.11 0.39 -0.59 1.51 0.11 -1.77 -0.14 132.00 132.61 3h0j h PRO 1512Ca 0.46 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.52 3h0j h PRO 1512Cb 0.29 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.29 3h0j h PRO 1512CO -0.21 0.25 0.26 1.49 -0.21 0.00 0.00 178.00 179.59 3h0j h GLU 1513N 0.40 0.87 -0.41 1.05 4.57 -1.52 -0.98 114.58 118.55 3h0j h GLU 1513Ca 0.29 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 3h0j h GLU 1513Cb 0.60 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 3h0j h GLU 1513CO -0.08 0.72 0.26 -0.07 -1.18 0.00 0.00 179.01 178.66 3h0j h LEU 1514N 0.81 0.47 -0.28 1.64 3.38 -0.93 0.36 115.31 120.77 3h0j h LEU 1514Ca 0.20 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 3h0j h LEU 1514Cb 0.16 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3h0j h LEU 1514CO -0.02 0.35 -0.42 -0.26 0.09 0.00 0.00 178.44 178.18 3h0j h PHE 1515N 0.56 0.95 -0.66 1.13 -1.00 -0.76 0.57 116.94 117.72 3h0j h PHE 1515Ca 0.15 -0.32 0.02 0.00 2.81 0.00 0.00 57.97 60.63 3h0j h PHE 1515Cb -0.05 -0.19 -0.04 0.00 3.61 0.00 0.00 35.95 39.28 3h0j h PHE 1515CO 0.00 1.11 0.42 -0.09 -1.61 0.00 0.00 178.31 178.14 3h0j h ARG 1516N 0.52 0.80 -0.28 1.51 2.43 -0.43 0.42 114.38 119.36 3h0j h ARG 1516Ca 0.03 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3h0j h ARG 1516Cb 1.01 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 3h0j h ARG 1516CO 0.10 0.53 0.10 1.96 -1.51 0.00 0.00 179.97 181.14 3h0j h GLN 1517N 0.83 0.42 -0.37 0.20 4.20 -0.75 -0.51 115.11 119.13 3h0j h GLN 1517Ca 0.26 -0.08 -0.11 0.00 0.06 0.00 0.00 58.65 58.77 3h0j h GLN 1517Cb -0.01 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3h0j h GLN 1517CO -0.09 0.47 -0.23 0.00 -0.67 0.00 0.00 178.83 178.31 3h0j h ALA 1518N 0.93 0.91 -0.45 3.87 0.00 -0.40 -0.31 119.26 123.80 3h0j h ALA 1518Ca 0.09 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 3h0j h ALA 1518Cb 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3h0j h ALA 1518CO -0.00 0.62 0.02 0.77 0.00 0.00 0.00 179.25 180.66 3h0j h SER 1519N 0.64 0.77 -0.31 0.00 0.02 -0.05 0.67 113.55 115.29 3h0j h SER 1519Ca 0.09 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 3h0j h SER 1519Cb 0.72 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 3h0j h SER 1519CO 0.06 0.87 0.17 -1.28 -1.14 0.00 0.00 176.83 175.50 3h0j h SER 1520N 0.63 0.39 -0.34 3.07 0.87 -0.94 -1.79 113.55 115.45 3h0j h SER 1520Ca 0.13 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3h0j h SER 1520Cb 0.47 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 3h0j h SER 1520CO 0.02 0.38 0.22 -1.28 -0.53 0.00 0.00 176.83 175.63 3h0j h SER 1521N 0.38 0.40 -0.87 6.23 0.87 -0.84 -1.43 113.55 118.30 3h0j h SER 1521Ca 0.11 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 3h0j h SER 1521Cb 0.08 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 3h0j h SER 1521CO -0.02 0.30 0.47 -0.61 -0.53 0.00 0.00 176.83 176.45 3h0j h GLN 1522N 0.47 1.22 -0.31 2.24 4.15 0.01 -2.43 115.11 120.46 3h0j h GLN 1522Ca 0.13 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.31 3h0j h GLN 1522Cb -0.03 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.40 3h0j h GLN 1522CO -0.03 0.89 -0.21 -1.49 -1.93 0.00 0.00 178.83 176.07 3h0j h TRP 1523N 1.22 0.64 -0.48 3.99 4.06 -0.88 -2.79 115.95 121.70 3h0j h TRP 1523Ca 0.31 -0.13 -0.10 0.00 2.06 0.00 0.00 58.89 61.03 3h0j h TRP 1523Cb 0.03 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.02 3h0j h TRP 1523CO 0.01 0.74 -0.10 0.87 -3.56 0.00 0.00 178.44 176.40 3h0j h LYS 1524N 0.51 0.92 0.00 0.49 1.79 -1.15 0.24 116.57 119.37 3h0j h LYS 1524Ca 0.08 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 3h0j h LYS 1524Cb 0.64 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 3h0j h LYS 1524CO 0.05 0.99 0.00 0.09 -1.08 0.00 0.00 179.45 179.50 3h0j n ASN 1525N -4.24 0.43 -0.09 0.86 5.03 -0.95 -2.72 115.26 113.59 3h0j n ASN 1525Ca 0.00 0.59 -0.18 0.00 0.87 0.00 0.00 54.58 55.87 3h0j n ASN 1525Cb 0.38 -0.69 -0.13 0.00 -1.02 0.00 0.00 39.78 38.32 3h0j n ASN 1525CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 3h0j n PHE 1526N -1.96 0.37 -3.15 3.10 -0.00 -0.92 -4.90 117.46 109.99 3h0j n PHE 1526Ca 0.03 0.08 0.04 0.00 -0.00 0.00 0.00 57.45 57.61 3h0j n PHE 1526Cb 0.24 -1.05 -0.00 0.00 -0.00 0.00 0.00 39.48 38.67 3h0j n PHE 1526CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3h0j s SER 1527N -6.55 -1.48 0.40 -2.13 0.15 0.80 -5.04 113.70 99.85 3h0j s SER 1527Ca -0.28 0.11 0.14 0.00 0.70 0.00 0.00 55.95 56.62 3h0j s SER 1527Cb 0.08 1.93 0.99 0.00 -1.71 0.00 0.00 66.02 67.31 3h0j s SER 1527CO 0.67 -0.26 1.87 0.00 1.20 0.00 0.00 173.24 176.72 3h0j h ALA 1528N 7.83 2.06 -0.63 5.45 0.00 -1.69 -3.00 119.26 129.28 3h0j h ALA 1528Ca -0.02 0.02 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 3h0j h ALA 1528Cb 1.19 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.75 3h0j h ALA 1528CO 0.12 -0.32 1.20 -0.25 0.00 0.00 0.00 179.25 180.00 3h0j n ASP 1529N -4.53 7.15 -4.14 0.00 8.00 -1.26 -4.89 116.55 116.88 3h0j n ASP 1529Ca 0.18 -3.24 -0.30 0.00 0.71 0.00 0.00 54.79 52.14 3h0j n ASP 1529Cb 0.59 -1.27 -0.17 0.00 -0.02 0.00 0.00 41.12 40.25 3h0j n ASP 1529CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h0j s VAL 1530N -2.10 1.75 -0.44 2.53 0.11 -1.13 -5.10 120.40 116.02 3h0j s VAL 1530Ca 0.56 -0.82 -0.23 0.00 -2.93 0.00 0.00 61.98 58.56 3h0j s VAL 1530Cb 0.30 -1.54 0.02 0.00 -1.53 0.00 0.00 36.38 33.63 3h0j s VAL 1530CO -0.18 0.49 0.78 -0.54 -3.33 0.00 0.00 175.10 172.32 3h0j s LYS 1531N 0.63 3.46 -0.22 1.54 1.02 -1.26 -5.00 119.74 119.90 3h0j s LYS 1531Ca -0.13 -0.05 -0.10 0.00 0.02 0.00 0.00 55.97 55.71 3h0j s LYS 1531Cb -0.16 -3.92 -0.05 0.00 -0.52 0.00 0.00 37.83 33.18 3h0j s LYS 1531CO 0.04 -1.07 0.14 -0.51 -0.92 0.00 0.00 175.35 173.02 3h0j s LEU 1532N 3.25 4.11 0.52 3.17 1.43 -1.26 -5.08 118.68 124.82 3h0j s LEU 1532Ca 0.30 0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 53.55 3h0j s LEU 1532Cb -0.12 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.03 3h0j s LEU 1532CO 0.22 0.12 0.75 -0.89 0.23 0.00 0.00 176.35 176.77 3h0j s THR 1533N 0.74 3.29 -1.27 5.49 2.01 -1.26 -4.97 115.64 119.67 3h0j s THR 1533Ca 0.07 -0.53 0.21 0.00 0.31 0.00 0.00 61.69 61.76 3h0j s THR 1533Cb -0.12 -3.24 0.29 0.00 0.01 0.00 0.00 72.50 69.44 3h0j s THR 1533CO 0.02 -0.18 1.66 0.47 -0.69 0.00 0.00 174.62 175.90 3h0j n ASP 1534N -2.27 0.00 -0.79 3.53 10.43 -1.26 -2.99 116.55 123.19 3h0j n ASP 1534Ca 0.05 0.17 0.04 0.00 2.57 0.00 0.00 54.79 57.62 3h0j n ASP 1534Cb 0.59 -0.36 0.15 0.00 1.84 0.00 0.00 41.12 43.34 3h0j n ASP 1534CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3h0j n ASP 1535N -1.36 2.23 0.05 -2.24 3.85 -1.26 -3.46 116.55 114.37 3h0j n ASP 1535Ca 0.08 -2.17 0.12 0.00 -0.71 0.00 0.00 54.79 52.12 3h0j n ASP 1535Cb 0.19 -0.36 0.27 0.00 -1.35 0.00 0.00 41.12 39.86 3h0j n ASP 1535CO 0.00 0.00 0.00 2.22 -1.01 0.00 0.00 177.20 178.41 3h0j n PHE 1536N 0.35 0.49 -3.72 2.11 1.16 -1.16 -4.75 117.46 111.95 3h0j n PHE 1536Ca 0.11 0.14 -0.21 0.00 -1.87 0.00 0.00 57.45 55.62 3h0j n PHE 1536Cb 0.43 -0.63 -0.18 0.00 -1.61 0.00 0.00 39.48 37.48 3h0j n PHE 1536CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 3h0j s PHE 1537N -3.11 0.32 -0.03 2.97 2.19 -1.22 -0.67 117.98 118.42 3h0j s PHE 1537Ca 0.08 0.08 0.05 0.00 0.33 0.00 0.00 56.93 57.47 3h0j s PHE 1537Cb 0.14 -0.61 -0.01 0.00 -1.31 0.00 0.00 43.02 41.23 3h0j s PHE 1537CO 0.68 -0.25 -0.17 0.42 1.83 0.00 0.00 175.22 177.73 3h0j s ILE 1538N 2.07 1.40 -0.08 3.12 1.01 -0.22 -5.00 121.20 123.50 3h0j s ILE 1538Ca 0.05 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.99 3h0j s ILE 1538Cb -0.12 -1.18 0.02 0.00 0.01 0.00 0.00 42.46 41.18 3h0j s ILE 1538CO -0.04 0.40 -0.11 -0.55 0.00 0.00 0.00 174.94 174.64 3h0j s SER 1539N -0.16 1.93 -0.15 3.58 0.15 -1.26 -1.32 113.70 116.47 3h0j s SER 1539Ca 0.01 -0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.36 3h0j s SER 1539Cb -0.09 -0.84 0.02 0.00 -1.71 0.00 0.00 66.02 63.40 3h0j s SER 1539CO 0.01 -0.02 -0.16 0.20 1.20 0.00 0.00 173.24 174.46 3h0j s ASN 1540N 1.06 2.75 0.41 5.45 0.01 -1.07 -4.94 114.94 118.61 3h0j s ASN 1540Ca -0.07 -0.51 -0.26 0.00 -0.71 0.00 0.00 52.86 51.31 3h0j s ASN 1540Cb -0.15 -1.24 -0.09 0.00 0.41 0.00 0.00 41.25 40.19 3h0j s ASN 1540CO -0.01 -0.02 1.31 -0.70 -1.51 0.00 0.00 177.10 176.16 3h0j s GLU 1541N 1.32 3.93 -0.12 -0.60 2.12 -1.19 -0.81 118.70 123.34 3h0j s GLU 1541Ca 0.02 2.16 -0.00 0.00 0.36 0.00 0.00 54.97 57.51 3h0j s GLU 1541Cb -0.13 -2.73 -0.02 0.00 0.26 0.00 0.00 34.13 31.51 3h0j s GLU 1541CO -0.09 -0.53 -0.12 -0.51 -0.54 0.00 0.00 175.26 173.48 3h0j s LEU 1542N -2.48 2.81 0.10 2.70 1.43 0.15 -0.94 118.68 122.44 3h0j s LEU 1542Ca 0.58 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 53.40 3h0j s LEU 1542Cb -0.38 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3h0j s LEU 1542CO 0.49 0.19 0.01 0.27 0.23 0.00 0.00 176.35 177.54 3h0j s ILE 1543N 0.19 0.27 0.13 -0.59 -4.36 -0.48 -4.10 121.20 112.27 3h0j s ILE 1543Ca -0.07 -1.88 -0.24 0.00 -0.26 0.00 0.00 60.65 58.20 3h0j s ILE 1543Cb -0.15 -1.82 -0.07 0.00 1.25 0.00 0.00 42.46 41.67 3h0j s ILE 1543CO 0.05 -0.71 0.72 -1.61 0.24 0.00 0.00 174.94 173.62 3h0j s GLU 1544N -3.96 4.46 0.00 0.37 2.02 -1.26 -0.73 118.70 119.59 3h0j s GLU 1544Ca 0.16 1.03 0.00 0.00 0.02 0.00 0.00 54.97 56.18 3h0j s GLU 1544Cb 0.07 -3.26 0.00 0.00 0.10 0.00 0.00 34.13 31.04 3h0j s GLU 1544CO -0.03 0.57 0.00 -0.40 0.02 0.00 0.00 175.26 175.42 3h0j n ASP 1545N 1.72 0.00 -0.05 -0.19 3.85 0.07 -4.84 116.55 117.12 3h0j n ASP 1545Ca -0.07 0.00 -0.06 0.00 -0.71 0.00 0.00 54.79 53.95 3h0j n ASP 1545Cb 0.49 0.00 0.13 0.00 -1.35 0.00 0.00 41.12 40.40 3h0j n ASP 1545CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 3h0j h GLU 1546N 0.00 0.66 0.00 0.11 3.07 -1.98 -2.66 114.58 113.78 3h0j h GLU 1546Ca 0.00 -0.26 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 3h0j h GLU 1546Cb 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 3h0j h GLU 1546CO 0.00 0.84 0.00 0.09 -1.40 0.00 0.00 179.01 178.54 3h0j n ASN 1547N -4.12 0.15 0.00 1.42 3.02 -1.26 -4.88 115.26 109.60 3h0j n ASN 1547Ca -0.00 0.52 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 3h0j n ASN 1547Cb 0.42 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 3h0j n ASN 1547CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h0j n GLY 1548N 1.24 0.64 3.76 7.41 0.00 -1.00 -5.06 105.19 112.17 3h0j n GLY 1548Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3h0j n GLY 1548CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h0j s GLU 1549N -0.77 4.70 0.43 1.61 0.41 -1.26 -4.65 118.70 119.18 3h0j s GLU 1549Ca 0.00 1.33 -0.24 0.00 -0.41 0.00 0.00 54.97 55.64 3h0j s GLU 1549Cb 0.00 -3.29 -0.08 0.00 -1.78 0.00 0.00 34.13 28.98 3h0j s GLU 1549CO 0.00 0.49 1.22 -0.51 -0.49 0.00 0.00 175.26 175.97 3h0j s LEU 1550N -0.96 4.11 -0.04 1.80 1.43 -1.26 -0.75 118.68 123.02 3h0j s LEU 1550Ca 0.39 2.45 -0.25 0.00 -1.03 0.00 0.00 54.13 55.70 3h0j s LEU 1550Cb -0.24 -4.08 0.05 0.00 0.03 0.00 0.00 46.19 41.95 3h0j s LEU 1550CO 0.29 -0.88 0.54 0.28 0.23 0.00 0.00 176.35 176.81 3h0j s THR 1551N -1.41 0.02 0.19 5.49 -1.32 0.09 -4.87 115.64 113.83 3h0j s THR 1551Ca 0.60 -0.17 -0.27 0.00 -1.21 0.00 0.00 61.69 60.64 3h0j s THR 1551Cb -0.33 -0.86 -0.08 0.00 -1.51 0.00 0.00 72.50 69.72 3h0j s THR 1551CO 0.41 -0.10 0.85 -1.61 -2.21 0.00 0.00 174.62 171.96 3h0j s GLU 1552N -1.25 4.69 0.05 7.08 2.02 -1.26 -1.38 118.70 128.64 3h0j s GLU 1552Ca -0.12 1.30 -0.05 0.00 0.02 0.00 0.00 54.97 56.13 3h0j s GLU 1552Cb -0.02 -3.28 -0.02 0.00 0.10 0.00 0.00 34.13 30.91 3h0j s GLU 1552CO 0.08 0.52 0.07 0.14 0.02 0.00 0.00 175.26 176.09 3h0j s VAL 1553N -1.05 0.15 -0.14 2.63 -7.23 -0.12 -4.96 120.40 109.69 3h0j s VAL 1553Ca 0.39 -1.24 0.01 0.00 -1.81 0.00 0.00 61.98 59.32 3h0j s VAL 1553Cb -0.24 -1.04 0.02 0.00 0.56 0.00 0.00 36.38 35.68 3h0j s VAL 1553CO 0.29 -0.69 -0.14 -0.70 -0.31 0.00 0.00 175.10 173.55 3h0j s GLU 1554N -2.96 2.20 0.31 4.82 2.12 -1.26 -3.17 118.70 120.76 3h0j s GLU 1554Ca -0.02 -0.53 -0.09 0.00 0.36 0.00 0.00 54.97 54.69 3h0j s GLU 1554Cb 0.01 -2.00 0.04 0.00 0.26 0.00 0.00 34.13 32.43 3h0j s GLU 1554CO -0.06 -0.20 0.58 2.89 -0.54 0.00 0.00 175.26 177.93 3h0j n ARG 1555N 4.65 0.83 -1.82 4.30 1.85 -1.26 -5.13 116.66 120.08 3h0j n ARG 1555Ca -0.17 -1.89 -0.42 0.00 -1.00 0.00 0.00 57.85 54.37 3h0j n ARG 1555Cb 0.50 2.21 -0.03 0.00 -1.05 0.00 0.00 32.46 34.09 3h0j n ARG 1555CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 3h0j s GLU 1556N -2.20 4.17 0.00 2.89 -1.05 -1.26 -4.84 118.70 116.40 3h0j s GLU 1556Ca 0.15 2.49 0.00 0.00 -0.15 0.00 0.00 54.97 57.47 3h0j s GLU 1556Cb -0.03 -3.11 0.00 0.00 -0.44 0.00 0.00 34.13 30.54 3h0j s GLU 1556CO 0.11 -0.69 0.03 -2.30 0.95 0.00 0.00 175.26 173.36 3h0j n PRO 1557N 3.99 0.02 0.00 -4.83 -0.02 -1.26 -2.24 135.00 130.66 3h0j n PRO 1557Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3h0j n PRO 1557Cb 0.37 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 3h0j n PRO 1557CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h0j n GLY 1558N 1.71 0.76 0.09 -1.23 0.00 -1.26 -4.80 105.19 100.47 3h0j n GLY 1558Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3h0j n GLY 1558CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0j n ALA 1559N 0.00 2.63 -1.85 4.61 0.00 -0.95 -4.92 120.51 120.03 3h0j n ALA 1559Ca 0.00 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 3h0j n ALA 1559Cb 0.34 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 3h0j n ALA 1559CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h0j s ASN 1560N -1.75 6.52 0.11 0.00 4.22 -1.26 -4.90 114.94 117.87 3h0j s ASN 1560Ca 0.36 2.66 0.26 0.00 -2.14 0.00 0.00 52.86 54.00 3h0j s ASN 1560Cb 0.17 -2.58 0.78 0.00 1.28 0.00 0.00 41.25 40.90 3h0j s ASN 1560CO 0.28 -0.91 1.67 0.00 -2.04 0.00 0.00 177.10 176.11 3h0j n ALA 1561N 4.76 2.59 -2.49 3.54 0.00 -1.26 -4.87 120.51 122.78 3h0j n ALA 1561Ca 0.16 -0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.23 3h0j n ALA 1561Cb 0.38 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.37 3h0j n ALA 1561CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3h0j s ILE 1562N -3.08 1.76 -0.34 0.00 -4.36 -1.26 -5.04 121.20 108.88 3h0j s ILE 1562Ca 0.11 -2.10 -0.00 0.00 -0.26 0.00 0.00 60.65 58.39 3h0j s ILE 1562Cb 0.15 -2.63 0.27 0.00 1.25 0.00 0.00 42.46 41.49 3h0j s ILE 1562CO 0.62 -0.18 1.91 0.61 0.24 0.00 0.00 174.94 178.14 3h0j n GLY 1563N -0.71 4.11 3.31 6.27 0.00 -1.26 -4.80 105.19 112.11 3h0j n GLY 1563Ca -0.05 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.77 3h0j n GLY 1563CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h0j s MET 1564N -2.00 0.42 0.09 1.61 -2.45 -1.26 -2.04 119.30 113.67 3h0j s MET 1564Ca 0.34 0.84 0.02 0.00 -1.25 0.00 0.00 55.69 55.63 3h0j s MET 1564Cb 0.27 -0.00 -0.04 0.00 1.25 0.00 0.00 34.83 36.31 3h0j s MET 1564CO 0.01 -0.16 -0.07 0.14 1.05 0.00 0.00 175.02 175.99 3h0j s VAL 1565N 1.45 0.64 -0.00 10.11 -7.23 -0.47 -4.95 120.40 119.95 3h0j s VAL 1565Ca -0.09 -1.77 -0.02 0.00 -1.81 0.00 0.00 61.98 58.29 3h0j s VAL 1565Cb -0.08 -1.47 -0.00 0.00 0.56 0.00 0.00 36.38 35.39 3h0j s VAL 1565CO -0.13 -0.79 0.04 0.00 -0.31 0.00 0.00 175.10 173.91 3h0j s ALA 1566N -3.21 -0.08 0.01 1.32 0.00 -1.26 -1.02 121.76 117.53 3h0j s ALA 1566Ca 0.07 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 51.95 3h0j s ALA 1566Cb 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 3h0j s ALA 1566CO -0.04 -0.10 -0.19 -0.06 0.00 0.00 0.00 175.76 175.37 3h0j s PHE 1567N -0.68 1.69 -0.43 0.00 0.40 -0.23 0.30 117.98 119.03 3h0j s PHE 1567Ca -0.08 -0.34 -0.11 0.00 -0.60 0.00 0.00 56.93 55.80 3h0j s PHE 1567Cb -0.05 -1.05 0.07 0.00 0.51 0.00 0.00 43.02 42.50 3h0j s PHE 1567CO -0.00 0.02 0.29 0.21 0.70 0.00 0.00 175.22 176.44 3h0j s LYS 1568N -0.76 2.74 0.28 0.44 2.36 0.01 -1.51 119.74 123.31 3h0j s LYS 1568Ca 0.07 -1.38 -0.14 0.00 -2.55 0.00 0.00 55.97 51.96 3h0j s LYS 1568Cb -0.08 -3.88 -0.08 0.00 -1.05 0.00 0.00 37.83 32.74 3h0j s LYS 1568CO 0.00 -0.94 0.69 0.42 1.55 0.00 0.00 175.35 177.07 3h0j s ILE 1569N 1.51 4.72 -0.23 5.43 -1.09 -0.66 -2.61 121.20 128.27 3h0j s ILE 1569Ca 0.03 0.89 -0.03 0.00 -2.23 0.00 0.00 60.65 59.31 3h0j s ILE 1569Cb -0.23 -3.65 0.10 0.00 -1.58 0.00 0.00 42.46 37.10 3h0j s ILE 1569CO 0.04 -0.09 0.21 -0.89 -1.23 0.00 0.00 174.94 172.98 3h0j s THR 1570N -1.87 -0.29 0.12 2.92 2.01 -0.44 -2.52 115.64 115.58 3h0j s THR 1570Ca 0.51 -0.26 0.10 0.00 0.31 0.00 0.00 61.69 62.34 3h0j s THR 1570Cb -0.11 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 3h0j s THR 1570CO 0.19 -0.32 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.86 3h0j s VAL 1571N 2.29 2.03 -0.36 3.82 1.01 -0.56 -1.05 120.40 127.58 3h0j s VAL 1571Ca 0.07 -1.67 -0.13 0.00 0.00 0.00 0.00 61.98 60.25 3h0j s VAL 1571Cb -0.15 -1.82 -0.00 0.00 0.00 0.00 0.00 36.38 34.41 3h0j s VAL 1571CO -0.18 0.03 0.25 -0.54 0.00 0.00 0.00 175.10 174.66 3h0j s LYS 1572N -1.99 3.28 0.33 2.72 1.02 0.16 -0.44 119.74 124.82 3h0j s LYS 1572Ca 0.11 -0.79 0.09 0.00 0.02 0.00 0.00 55.97 55.39 3h0j s LYS 1572Cb -0.10 -3.83 -0.05 0.00 -0.52 0.00 0.00 37.83 33.33 3h0j s LYS 1572CO 0.05 -0.55 0.06 0.95 -0.92 0.00 0.00 175.35 174.94 3h0j s THR 1573N 1.69 2.92 0.34 2.17 -4.23 -1.02 -4.89 115.64 112.62 3h0j s THR 1573Ca 0.05 -1.85 0.12 0.00 -1.18 0.00 0.00 61.69 58.84 3h0j s THR 1573Cb -0.18 -2.88 0.34 0.00 1.34 0.00 0.00 72.50 71.12 3h0j s THR 1573CO 0.10 -0.22 1.75 -0.65 -0.54 0.00 0.00 174.62 175.05 3h0j h PRO 1574N 1.71 0.52 0.00 3.99 0.11 -1.94 0.17 132.00 136.56 3h0j h PRO 1574Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3h0j h PRO 1574Cb 1.25 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3h0j h PRO 1574CO 0.64 0.35 -0.48 -0.85 -0.21 0.00 0.00 178.00 177.45 3h0j n GLU 1575N -4.79 0.25 -3.15 1.05 0.00 -1.26 -4.23 120.64 108.51 3h0j n GLU 1575Ca 0.26 0.10 -0.22 0.00 0.00 0.00 0.00 57.16 57.30 3h0j n GLU 1575Cb 0.77 -1.68 -0.04 0.00 0.00 0.00 0.00 31.44 30.49 3h0j n GLU 1575CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3h0j n TYR 1576N -2.06 1.22 -0.32 -1.84 4.02 0.38 -4.78 117.16 113.78 3h0j n TYR 1576Ca 0.04 -3.84 0.23 0.00 -0.01 0.00 0.00 57.90 54.31 3h0j n TYR 1576Cb 0.42 -0.43 0.43 0.00 -0.02 0.00 0.00 39.34 39.74 3h0j n TYR 1576CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 3h0j n PRO 1577N 0.36 -0.07 0.00 -0.72 -0.02 0.07 0.80 135.00 135.42 3h0j n PRO 1577Ca 0.26 1.37 0.14 0.00 -2.02 0.00 0.00 63.50 63.25 3h0j n PRO 1577Cb 0.56 -2.32 0.53 0.00 -0.02 0.00 0.00 33.50 32.25 3h0j n PRO 1577CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h0j n ARG 1578N -5.29 0.69 0.00 -0.52 1.74 -1.26 -4.60 116.66 107.42 3h0j n ARG 1578Ca 0.30 -0.29 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3h0j n ARG 1578Cb 0.99 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.94 3h0j n ARG 1578CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0j n GLY 1579N 1.31 3.62 3.20 -0.13 0.00 0.24 -4.89 105.19 108.54 3h0j n GLY 1579Ca 0.13 -1.63 -0.11 0.00 0.00 0.00 0.00 46.02 44.41 3h0j n GLY 1579CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h0j s ARG 1580N -4.17 0.70 0.26 1.61 1.70 0.42 -4.92 118.95 114.55 3h0j s ARG 1580Ca 0.00 -0.53 0.07 0.00 -0.47 0.00 0.00 55.73 54.79 3h0j s ARG 1580Cb 0.00 0.30 -0.05 0.00 -0.57 0.00 0.00 34.95 34.62 3h0j s ARG 1580CO 0.00 -0.21 -0.07 -0.65 -1.08 0.00 0.00 175.30 173.29 3h0j s GLN 1581N -2.33 1.49 0.12 3.89 -0.21 -1.26 -1.49 119.66 119.86 3h0j s GLN 1581Ca -0.07 -1.73 -0.26 0.00 0.02 0.00 0.00 55.36 53.32 3h0j s GLN 1581Cb -0.02 -1.10 0.07 0.00 1.00 0.00 0.00 33.01 32.96 3h0j s GLN 1581CO -0.02 0.06 0.92 -0.59 -2.12 0.00 0.00 175.29 173.54 3h0j s PHE 1582N -3.04 -0.20 0.02 0.91 -0.12 -1.05 -4.30 117.98 110.20 3h0j s PHE 1582Ca 0.28 -0.07 0.07 0.00 -0.05 0.00 0.00 56.93 57.16 3h0j s PHE 1582Cb 0.03 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 43.01 3h0j s PHE 1582CO 0.11 -0.77 -0.20 0.08 -0.05 0.00 0.00 175.22 174.39 3h0j s VAL 1583N -3.28 2.65 -0.12 -2.49 1.01 -0.19 -1.66 120.40 116.32 3h0j s VAL 1583Ca 0.10 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 60.99 3h0j s VAL 1583Cb -0.01 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 3h0j s VAL 1583CO -0.01 0.42 -0.19 -0.69 0.00 0.00 0.00 175.10 174.63 3h0j s VAL 1584N -0.83 2.47 -0.01 2.92 1.01 -0.57 0.47 120.40 125.87 3h0j s VAL 1584Ca 0.13 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3h0j s VAL 1584Cb -0.10 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 3h0j s VAL 1584CO 0.03 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.80 3h0j s VAL 1585N 0.39 1.45 -0.01 2.92 1.01 0.62 -1.07 120.40 125.71 3h0j s VAL 1585Ca -0.15 -0.80 -0.21 0.00 0.00 0.00 0.00 61.98 60.82 3h0j s VAL 1585Cb -0.17 -1.21 0.04 0.00 0.00 0.00 0.00 36.38 35.05 3h0j s VAL 1585CO 0.07 0.39 0.46 0.00 0.00 0.00 0.00 175.10 176.02 3h0j s ALA 1586N -0.45 -1.16 0.21 5.51 0.00 -0.19 0.63 121.76 126.31 3h0j s ALA 1586Ca 0.07 0.64 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 3h0j s ALA 1586Cb -0.07 0.13 -0.08 0.00 0.00 0.00 0.00 23.12 23.10 3h0j s ALA 1586CO -0.01 -0.35 0.92 -0.80 0.00 0.00 0.00 175.76 175.52 3h0j s ASN 1587N -1.47 7.59 -0.60 0.00 0.01 -1.14 -1.37 114.94 117.96 3h0j s ASN 1587Ca -0.10 1.88 -0.20 0.00 -0.71 0.00 0.00 52.86 53.73 3h0j s ASN 1587Cb -0.02 -2.59 0.09 0.00 0.41 0.00 0.00 41.25 39.13 3h0j s ASN 1587CO 0.04 0.14 0.77 -0.62 -1.51 0.00 0.00 177.10 175.92 3h0j s ASP 1588N -1.02 6.19 0.14 -1.22 2.15 -0.87 -4.70 116.67 117.34 3h0j s ASP 1588Ca 0.41 -1.21 0.09 0.00 0.43 0.00 0.00 52.55 52.27 3h0j s ASP 1588Cb -0.25 -2.34 0.48 0.00 -0.30 0.00 0.00 42.92 40.51 3h0j s ASP 1588CO 0.31 -1.18 1.26 0.00 -0.17 0.00 0.00 175.17 175.38 3h0j n ILE 1589N 5.68 1.54 0.50 4.11 0.13 -1.26 -0.96 119.36 129.10 3h0j n ILE 1589Ca -0.07 0.60 0.12 0.00 -1.10 0.00 0.00 62.75 62.30 3h0j n ILE 1589Cb 0.44 -1.60 0.13 0.00 -0.84 0.00 0.00 39.64 37.77 3h0j n ILE 1589CO 0.00 0.00 0.00 0.71 2.80 0.00 0.00 176.55 180.06 3h0j h THR 1590N 0.00 0.00 -3.07 9.51 1.35 -1.92 -3.13 112.91 115.65 3h0j h THR 1590Ca 0.00 -0.56 -0.66 0.00 -0.55 0.00 0.00 66.41 64.64 3h0j h THR 1590Cb 0.04 1.11 -0.16 0.00 -1.73 0.00 0.00 68.15 67.41 3h0j h THR 1590CO 0.00 0.00 0.27 0.12 -0.25 0.00 0.00 175.52 175.66 3h0j s PHE 1591N -3.20 2.91 -1.41 4.73 5.36 -0.13 -4.37 117.98 121.87 3h0j s PHE 1591Ca 0.05 -0.49 -0.08 0.00 -0.96 0.00 0.00 56.93 55.46 3h0j s PHE 1591Cb 0.13 -3.88 0.01 0.00 -0.34 0.00 0.00 43.02 38.93 3h0j s PHE 1591CO 0.74 -1.27 0.32 1.63 -1.46 0.00 0.00 175.22 175.18 3h0j n LYS 1592N 6.79 -1.66 -4.12 10.12 5.02 -1.26 -0.48 118.16 132.57 3h0j n LYS 1592Ca -0.05 0.23 -0.34 0.00 -2.02 0.00 0.00 58.31 56.13 3h0j n LYS 1592Cb 0.45 -3.78 -0.01 0.00 -0.02 0.00 0.00 35.03 31.67 3h0j n LYS 1592CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 3h0j n ILE 1593N -4.57 -1.41 -3.51 -0.18 -5.35 -1.25 -1.24 119.36 101.86 3h0j n ILE 1593Ca -0.27 -0.02 -0.26 0.00 -0.27 0.00 0.00 62.75 61.93 3h0j n ILE 1593Cb 0.66 -2.09 0.01 0.00 -1.74 0.00 0.00 39.64 36.48 3h0j n ILE 1593CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h0j n GLY 1594N -1.51 -0.49 3.80 3.28 0.00 0.37 -2.79 105.19 107.85 3h0j n GLY 1594Ca 0.06 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 3h0j n GLY 1594CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0j s SER 1595N -2.89 5.07 -0.49 1.61 1.04 -0.38 -2.77 113.70 114.90 3h0j s SER 1595Ca 0.48 1.63 -0.16 0.00 0.48 0.00 0.00 55.95 58.38 3h0j s SER 1595Cb -0.24 -2.46 0.08 0.00 0.10 0.00 0.00 66.02 63.50 3h0j s SER 1595CO 0.59 -1.64 0.43 -0.36 0.98 0.00 0.00 173.24 173.23 3h0j s PHE 1596N -3.02 3.23 0.27 5.02 0.40 0.52 -4.85 117.98 119.55 3h0j s PHE 1596Ca 0.59 -0.96 0.08 0.00 -0.60 0.00 0.00 56.93 56.04 3h0j s PHE 1596Cb -0.15 -3.29 -0.04 0.00 0.51 0.00 0.00 43.02 40.05 3h0j s PHE 1596CO 0.55 -0.85 0.11 0.20 0.70 0.00 0.00 175.22 175.93 3h0j s GLY 1597N 2.77 1.59 0.24 4.36 0.00 -1.26 -1.01 107.32 114.01 3h0j s GLY 1597Ca 0.05 -1.58 -0.06 0.00 0.00 0.00 0.00 44.72 43.12 3h0j s GLY 1597CO 0.06 -1.61 1.33 -1.05 0.00 0.00 0.00 173.10 171.83 3h0j n PRO 1598N -1.06 -0.08 -0.12 2.90 -0.02 -1.26 -0.84 135.00 134.52 3h0j n PRO 1598Ca -0.06 1.32 -0.10 0.00 -2.02 0.00 0.00 63.50 62.64 3h0j n PRO 1598Cb 0.59 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 32.07 3h0j n PRO 1598CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3h0j h GLN 1599N 0.00 0.57 -0.90 -0.52 4.20 -1.97 -1.22 115.11 115.27 3h0j h GLN 1599Ca 0.41 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 59.01 3h0j h GLN 1599Cb 0.64 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 3h0j h GLN 1599CO -0.87 0.62 0.59 0.93 -0.67 0.00 0.00 178.83 179.43 3h0j h GLU 1600N 0.42 1.13 -0.04 1.46 3.07 -1.37 0.09 114.58 119.34 3h0j h GLU 1600Ca 0.11 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 58.90 3h0j h GLU 1600Cb 0.31 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3h0j h GLU 1600CO 0.00 0.75 0.01 -0.44 -1.40 0.00 0.00 179.01 177.93 3h0j h ASP 1601N 1.16 0.07 -0.26 1.42 3.45 -0.98 0.77 116.42 122.06 3h0j h ASP 1601Ca 0.35 -0.21 -0.04 0.00 0.43 0.00 0.00 57.03 57.56 3h0j h ASP 1601Cb -0.04 -0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 38.70 3h0j h ASP 1601CO -0.11 0.26 0.04 1.05 -1.57 0.00 0.00 179.24 178.91 3h0j h GLU 1602N -0.13 0.53 -0.39 3.56 -0.00 -0.90 -0.11 114.58 117.14 3h0j h GLU 1602Ca 0.01 -0.10 -0.13 0.00 -0.00 0.00 0.00 59.36 59.15 3h0j h GLU 1602Cb 0.22 -0.08 -0.01 0.00 -0.00 0.00 0.00 28.75 28.87 3h0j h GLU 1602CO -0.00 0.53 -0.26 0.35 -0.00 0.00 0.00 179.01 179.63 3h0j h PHE 1603N 0.51 0.93 -0.45 2.06 3.57 -0.65 0.38 116.94 123.29 3h0j h PHE 1603Ca 0.12 -0.23 -0.06 0.00 3.53 0.00 0.00 57.97 61.33 3h0j h PHE 1603Cb 0.28 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 3h0j h PHE 1603CO 0.01 0.98 0.02 0.35 -2.23 0.00 0.00 178.31 177.44 3h0j h PHE 1604N 0.70 0.75 -0.04 0.41 3.57 -0.03 -1.87 116.94 120.43 3h0j h PHE 1604Ca 0.09 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 3h0j h PHE 1604Cb 0.79 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.32 3h0j h PHE 1604CO 0.04 0.69 -0.14 -0.97 -2.23 0.00 0.00 178.31 175.70 3h0j h ASN 1605N 0.68 0.19 -0.82 0.41 -0.73 -0.63 -2.45 115.58 112.23 3h0j h ASN 1605Ca 0.14 -0.64 0.11 0.00 1.87 0.00 0.00 56.30 57.79 3h0j h ASN 1605Cb 0.38 -0.06 -0.06 0.00 0.27 0.00 0.00 38.32 38.86 3h0j h ASN 1605CO 0.01 0.79 0.53 0.50 -0.37 0.00 0.00 177.43 178.90 3h0j h LYS 1606N -0.40 0.68 -0.18 6.67 1.63 -0.77 -1.67 116.57 122.53 3h0j h LYS 1606Ca -0.01 -0.04 -0.12 0.00 -0.85 0.00 0.00 60.65 59.63 3h0j h LYS 1606Cb 0.78 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 3h0j h LYS 1606CO 0.03 0.45 -0.36 0.28 -3.45 0.00 0.00 179.45 176.40 3h0j h VAL 1607N 0.70 1.34 -0.91 2.00 2.07 -1.35 -2.11 116.25 118.00 3h0j h VAL 1607Ca 0.39 -1.60 0.03 0.00 0.82 0.00 0.00 66.70 66.33 3h0j h VAL 1607Cb 0.54 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.19 3h0j h VAL 1607CO -0.16 0.49 0.59 0.74 0.02 0.00 0.00 177.57 179.26 3h0j h THR 1608N 0.21 1.18 -0.44 2.57 2.02 -0.88 -1.99 112.91 115.58 3h0j h THR 1608Ca 0.00 -0.40 -0.13 0.00 0.77 0.00 0.00 66.41 66.65 3h0j h THR 1608Cb 0.96 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3h0j h THR 1608CO 0.08 0.21 -0.25 -0.33 0.37 0.00 0.00 175.52 175.60 3h0j h GLU 1609N 1.17 0.92 -0.78 6.66 5.08 -1.33 -1.28 114.58 125.02 3h0j h GLU 1609Ca 0.35 -0.40 0.13 0.00 -1.00 0.00 0.00 59.36 58.44 3h0j h GLU 1609Cb -0.05 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.09 3h0j h GLU 1609CO -0.10 1.06 0.37 -0.92 -1.00 0.00 0.00 179.01 178.42 3h0j h TYR 1610N 0.79 0.65 -0.19 4.33 3.20 -0.68 0.32 116.97 125.38 3h0j h TYR 1610Ca 0.10 0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.82 3h0j h TYR 1610Cb 0.81 -0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.92 3h0j h TYR 1610CO 0.05 0.15 -0.58 0.00 -1.64 0.00 0.00 178.16 176.15 3h0j h ALA 1611N 1.52 0.32 -0.33 1.82 0.00 -1.15 -2.91 119.26 118.54 3h0j h ALA 1611Ca 0.42 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3h0j h ALA 1611Cb 0.57 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 3h0j h ALA 1611CO -0.35 0.56 0.11 0.00 0.00 0.00 0.00 179.25 179.56 3h0j h ARG 1612N 0.43 0.24 -0.65 0.00 2.47 0.02 0.87 114.38 117.75 3h0j h ARG 1612Ca -0.02 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.69 3h0j h ARG 1612Cb 1.20 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.43 3h0j h ARG 1612CO 0.12 0.16 0.43 -0.22 0.56 0.00 0.00 179.97 181.02 3h0j h LYS 1613N 0.24 0.86 -0.00 0.04 3.11 -0.47 -2.03 116.57 118.32 3h0j h LYS 1613Ca 0.15 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.94 3h0j h LYS 1613Cb 0.13 -0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.16 3h0j h LYS 1613CO -0.16 0.57 -0.14 0.54 -2.81 0.00 0.00 179.45 177.45 3h0j n ARG 1614N -4.63 0.43 -3.58 1.90 1.74 -0.82 -4.92 116.66 106.77 3h0j n ARG 1614Ca 0.05 -0.13 -0.24 0.00 -0.77 0.00 0.00 57.85 56.76 3h0j n ARG 1614Cb 0.02 -1.50 0.07 0.00 -1.02 0.00 0.00 32.46 30.03 3h0j n ARG 1614CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0j n GLY 1615N 1.36 -0.55 3.72 -0.13 0.00 0.28 -4.75 105.19 105.13 3h0j n GLY 1615Ca 0.12 0.25 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 3h0j n GLY 1615CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h0j s ILE 1616N -3.31 4.35 0.75 -0.61 1.09 -0.16 -0.92 121.20 122.40 3h0j s ILE 1616Ca 0.58 -0.63 -0.15 0.00 -1.10 0.00 0.00 60.65 59.35 3h0j s ILE 1616Cb -0.26 -3.00 0.05 0.00 -1.06 0.00 0.00 42.46 38.20 3h0j s ILE 1616CO 0.71 0.29 1.24 -2.84 -0.10 0.00 0.00 174.94 174.25 3h0j s PRO 1617N -1.84 1.95 -0.29 2.79 0.02 -1.26 -4.55 135.00 131.82 3h0j s PRO 1617Ca 0.23 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.15 3h0j s PRO 1617Cb -0.12 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.68 3h0j s PRO 1617CO 0.14 -2.01 -0.05 0.50 -0.33 0.00 0.00 177.00 175.25 3h0j s ARG 1618N -3.87 2.00 -0.20 5.54 3.52 -0.18 -1.03 118.95 124.75 3h0j s ARG 1618Ca 0.77 -1.52 -0.10 0.00 -0.13 0.00 0.00 55.73 54.74 3h0j s ARG 1618Cb -0.32 -3.00 -0.05 0.00 -1.56 0.00 0.00 34.95 30.02 3h0j s ARG 1618CO 0.47 -0.69 0.14 0.42 -0.81 0.00 0.00 175.30 174.83 3h0j s ILE 1619N 1.04 5.40 -0.13 4.11 1.09 0.18 -2.76 121.20 130.13 3h0j s ILE 1619Ca -0.02 0.22 0.03 0.00 -1.10 0.00 0.00 60.65 59.77 3h0j s ILE 1619Cb -0.20 -3.48 0.01 0.00 -1.06 0.00 0.00 42.46 37.73 3h0j s ILE 1619CO -0.06 0.44 -0.22 -0.47 -0.10 0.00 0.00 174.94 174.53 3h0j s TYR 1620N 0.35 2.63 -0.37 3.97 6.04 -0.44 -0.28 117.35 129.25 3h0j s TYR 1620Ca 0.09 -1.29 -0.14 0.00 0.04 0.00 0.00 57.07 55.77 3h0j s TYR 1620Cb -0.11 -1.79 -0.00 0.00 -1.04 0.00 0.00 41.96 39.02 3h0j s TYR 1620CO -0.01 -0.58 0.26 -0.51 -1.54 0.00 0.00 175.55 173.17 3h0j s LEU 1621N 0.75 4.76 -0.19 6.97 1.43 0.21 -0.53 118.68 132.08 3h0j s LEU 1621Ca -0.09 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.24 3h0j s LEU 1621Cb -0.16 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 3h0j s LEU 1621CO -0.00 -0.33 0.32 0.00 0.23 0.00 0.00 176.35 176.57 3h0j s ALA 1622N 1.70 3.58 -0.39 4.21 0.00 0.86 -2.90 121.76 128.81 3h0j s ALA 1622Ca 0.05 -0.54 0.07 0.00 0.00 0.00 0.00 51.96 51.54 3h0j s ALA 1622Cb -0.18 -2.49 0.17 0.00 0.00 0.00 0.00 23.12 20.62 3h0j s ALA 1622CO 0.10 -0.12 0.56 0.00 0.00 0.00 0.00 175.76 176.31 3h0j s ALA 1623N 0.92 -1.88 0.29 0.00 0.00 -1.26 -0.87 121.76 118.95 3h0j s ALA 1623Ca 0.16 -0.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.00 3h0j s ALA 1623Cb -0.14 -2.55 -0.00 0.00 0.00 0.00 0.00 23.12 20.42 3h0j s ALA 1623CO 0.06 -2.18 0.45 0.54 0.00 0.00 0.00 175.76 174.63 3h0j s ASN 1624N 1.79 0.35 0.00 0.00 4.22 -0.21 -4.21 114.94 116.88 3h0j s ASN 1624Ca 0.16 -1.22 0.07 0.00 -2.14 0.00 0.00 52.86 49.73 3h0j s ASN 1624Cb -0.07 0.60 0.13 0.00 1.28 0.00 0.00 41.25 43.19 3h0j s ASN 1624CO -0.07 -1.19 0.97 -1.20 -2.04 0.00 0.00 177.10 173.57 3h0j n SER 1625N -0.83 2.14 0.00 3.54 7.64 -1.11 -3.66 113.62 121.34 3h0j n SER 1625Ca -0.00 -1.70 0.00 0.00 1.01 0.00 0.00 58.87 58.18 3h0j n SER 1625Cb 0.62 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 3h0j n SER 1625CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h0j n GLY 1626N 0.23 -1.32 3.76 0.23 0.00 -1.25 -4.78 105.19 102.06 3h0j n GLY 1626Ca 0.06 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 3h0j n GLY 1626CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0j s ALA 1627N -1.35 3.02 0.37 4.61 0.00 -1.26 0.19 121.76 127.34 3h0j s ALA 1627Ca 0.00 1.29 -0.24 0.00 0.00 0.00 0.00 51.96 53.01 3h0j s ALA 1627Cb 0.00 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.49 3h0j s ALA 1627CO 0.00 -1.14 1.00 0.50 0.00 0.00 0.00 175.76 176.12 3h0j s ARG 1628N -2.66 4.33 0.14 0.00 3.52 -0.18 -4.58 118.95 119.53 3h0j s ARG 1628Ca 0.65 1.40 0.06 0.00 -0.13 0.00 0.00 55.73 57.71 3h0j s ARG 1628Cb -0.39 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.36 3h0j s ARG 1628CO 0.48 0.03 -0.13 0.96 -0.81 0.00 0.00 175.30 175.84 3h0j s ILE 1629N -1.71 1.34 0.00 4.11 -4.36 -1.25 -4.49 121.20 114.84 3h0j s ILE 1629Ca 0.55 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 59.06 3h0j s ILE 1629Cb -0.19 -1.69 0.00 0.00 1.25 0.00 0.00 42.46 41.83 3h0j s ILE 1629CO 0.24 -0.53 0.00 0.61 0.24 0.00 0.00 174.94 175.50 3h0j n GLY 1630N 0.21 0.40 3.29 6.27 0.00 -0.71 -4.84 105.19 109.81 3h0j n GLY 1630Ca -0.13 -0.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 3h0j n GLY 1630CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h0j s MET 1631N -2.00 1.21 -1.17 1.61 -1.94 -1.26 -4.64 119.30 111.12 3h0j s MET 1631Ca 0.00 -1.58 -0.23 0.00 -1.71 0.00 0.00 55.69 52.18 3h0j s MET 1631Cb 0.00 -0.59 -0.09 0.00 2.01 0.00 0.00 34.83 36.16 3h0j s MET 1631CO 0.00 -0.03 1.93 0.00 -0.01 0.00 0.00 175.02 176.91 3h0j n ALA 1632N -0.32 1.90 -0.21 3.03 0.00 -1.26 -4.75 120.51 118.90 3h0j n ALA 1632Ca -0.07 -3.04 0.27 0.00 0.00 0.00 0.00 53.44 50.60 3h0j n ALA 1632Cb 0.63 -3.49 0.67 0.00 0.00 0.00 0.00 19.45 17.26 3h0j n ALA 1632CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3h0j h GLU 1633N 9.59 0.11 0.00 0.00 4.39 -1.99 0.14 114.58 126.81 3h0j h GLU 1633Ca 0.23 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.92 3h0j h GLU 1633Cb 0.92 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 3h0j h GLU 1633CO 1.26 0.07 0.00 1.05 -1.16 0.00 0.00 179.01 180.23 3h0j h GLU 1634N 0.11 0.00 -0.01 2.33 9.09 -2.02 -1.84 114.58 122.24 3h0j h GLU 1634Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.86 3h0j h GLU 1634Cb 1.61 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.71 3h0j h GLU 1634CO -0.06 0.00 -0.76 -0.89 0.05 0.00 0.00 179.01 177.34 3h0j n ILE 1635N -3.03 0.00 -0.18 -1.06 2.08 0.47 -4.46 119.36 113.18 3h0j n ILE 1635Ca -0.01 -0.10 -0.06 0.00 0.56 0.00 0.00 62.75 63.14 3h0j n ILE 1635Cb 0.17 1.05 0.04 0.00 -0.75 0.00 0.00 39.64 40.15 3h0j n ILE 1635CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3h0j h VAL 1636N 0.95 1.09 0.08 1.39 2.07 -1.28 -3.25 116.25 117.30 3h0j h VAL 1636Ca 0.00 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 3h0j h VAL 1636Cb 0.60 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 3h0j h VAL 1636CO 0.00 0.12 -0.04 1.55 0.02 0.00 0.00 177.57 179.22 3h0j h PRO 1637N 0.67 -0.11 -0.99 1.57 0.13 -1.78 -3.38 132.00 128.11 3h0j h PRO 1637Ca 0.21 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.32 3h0j h PRO 1637Cb -0.02 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.12 3h0j h PRO 1637CO -0.07 0.42 0.04 1.47 -0.23 0.00 0.00 178.00 179.62 3h0j n LEU 1638N -4.81 2.83 -4.65 1.56 -0.00 -1.25 -4.88 117.00 105.80 3h0j n LEU 1638Ca -0.07 -1.43 -0.35 0.00 -0.00 0.00 0.00 56.01 54.16 3h0j n LEU 1638Cb 0.28 -0.52 -0.10 0.00 -0.00 0.00 0.00 43.42 43.08 3h0j n LEU 1638CO 0.24 0.48 -0.30 0.72 -0.00 0.00 0.00 177.39 178.53 3h0j s PHE 1639N -0.43 3.16 0.08 1.47 -0.12 -1.23 -4.57 117.98 116.35 3h0j s PHE 1639Ca 0.04 0.10 0.06 0.00 -0.05 0.00 0.00 56.93 57.08 3h0j s PHE 1639Cb 0.03 -1.86 -0.04 0.00 -0.63 0.00 0.00 43.02 40.53 3h0j s PHE 1639CO 0.01 0.35 -0.07 -0.65 -0.05 0.00 0.00 175.22 174.81 3h0j s GLN 1640N -0.52 2.30 0.04 1.99 1.11 0.61 -4.95 119.66 120.24 3h0j s GLN 1640Ca 0.09 -0.92 -0.07 0.00 0.01 0.00 0.00 55.36 54.47 3h0j s GLN 1640Cb -0.12 -2.39 -0.05 0.00 -1.01 0.00 0.00 33.01 29.44 3h0j s GLN 1640CO 0.02 0.53 0.31 0.08 0.01 0.00 0.00 175.29 176.24 3h0j s VAL 1641N -1.19 5.24 -0.85 1.09 1.01 -1.26 -0.09 120.40 124.36 3h0j s VAL 1641Ca 0.21 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.41 3h0j s VAL 1641Cb -0.11 -3.59 0.28 0.00 0.00 0.00 0.00 36.38 32.95 3h0j s VAL 1641CO 0.13 0.31 1.10 0.00 0.00 0.00 0.00 175.10 176.65 3h0j n ALA 1642N 0.94 4.62 -1.00 5.51 0.00 -0.98 -4.94 120.51 124.67 3h0j n ALA 1642Ca -0.09 -4.79 0.00 0.00 0.00 0.00 0.00 53.44 48.55 3h0j n ALA 1642Cb 0.52 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3h0j n ALA 1642CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 3h0j n TRP 1643N 1.03 -1.43 -0.68 0.00 7.02 -1.26 -0.10 117.44 122.02 3h0j n TRP 1643Ca 0.28 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.83 3h0j n TRP 1643Cb 0.37 0.00 0.13 0.00 -2.42 0.00 0.00 31.31 29.39 3h0j n TRP 1643CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 3h0j n ASN 1644N -2.08 2.59 0.00 -0.99 5.03 -1.02 -4.35 115.26 114.45 3h0j n ASN 1644Ca 0.00 -2.68 0.00 0.00 0.87 0.00 0.00 54.58 52.77 3h0j n ASN 1644Cb 0.00 -0.32 0.00 0.00 -1.02 0.00 0.00 39.78 38.44 3h0j n ASN 1644CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3h0j n ASP 1645N -0.83 0.00 -0.24 6.41 4.64 -1.26 -5.04 116.55 120.23 3h0j n ASP 1645Ca 0.12 0.00 -0.03 0.00 -1.38 0.00 0.00 54.79 53.51 3h0j n ASP 1645Cb 0.56 0.00 0.04 0.00 -1.04 0.00 0.00 41.12 40.67 3h0j n ASP 1645CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3h0j h ALA 1646N 0.00 0.15 -2.31 -1.67 0.00 -1.98 -3.36 119.26 110.08 3h0j h ALA 1646Ca 0.00 0.22 -0.49 0.00 0.00 0.00 0.00 54.91 54.64 3h0j h ALA 1646Cb 0.00 0.74 0.05 0.00 0.00 0.00 0.00 17.79 18.58 3h0j h ALA 1646CO 0.00 -0.59 0.19 0.00 0.00 0.00 0.00 179.25 178.85 3h0j s ALA 1647N -6.07 3.31 -1.16 0.00 0.00 -1.26 -4.24 121.76 112.34 3h0j s ALA 1647Ca -0.14 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 51.29 3h0j s ALA 1647Cb 0.18 -2.68 -0.02 0.00 0.00 0.00 0.00 23.12 20.60 3h0j s ALA 1647CO 0.71 -0.57 0.94 0.09 0.00 0.00 0.00 175.76 176.94 3h0j n ASN 1648N -2.46 -3.46 -0.20 0.00 3.02 -1.26 -4.89 115.26 106.01 3h0j n ASN 1648Ca 0.03 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.91 3h0j n ASN 1648Cb 0.56 -5.02 0.10 0.00 -0.61 0.00 0.00 39.78 34.80 3h0j n ASN 1648CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3h0j h PRO 1649N -1.65 0.15 -1.92 3.52 0.11 -1.74 -2.56 132.00 127.92 3h0j h PRO 1649Ca -0.60 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.50 3h0j h PRO 1649Cb 1.33 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3h0j h PRO 1649CO 0.49 0.10 0.00 -0.40 -0.21 0.00 0.00 178.00 177.97 3h0j n ASP 1650N -5.24 0.69 -0.16 -2.05 5.75 -1.26 -2.01 116.55 112.27 3h0j n ASP 1650Ca 0.08 -0.78 0.02 0.00 -0.01 0.00 0.00 54.79 54.10 3h0j n ASP 1650Cb 0.34 -0.13 0.04 0.00 -1.03 0.00 0.00 41.12 40.33 3h0j n ASP 1650CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3h0j n LYS 1651N 1.42 2.38 0.00 0.11 4.76 -0.96 -5.10 118.16 120.77 3h0j n LYS 1651Ca 0.00 -1.49 0.00 0.00 -2.87 0.00 0.00 58.31 53.95 3h0j n LYS 1651Cb 0.08 -1.07 0.00 0.00 -1.84 0.00 0.00 35.03 32.20 3h0j n LYS 1651CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h0j n GLY 1652N -0.16 1.40 3.31 0.72 0.00 -0.85 -4.79 105.19 104.81 3h0j n GLY 1652Ca 0.03 -2.06 -0.10 0.00 0.00 0.00 0.00 46.02 43.89 3h0j n GLY 1652CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h0j s PHE 1653N -1.79 0.48 -0.13 1.61 -0.71 -1.26 -2.42 117.98 113.75 3h0j s PHE 1653Ca 0.00 -0.84 0.08 0.00 -1.04 0.00 0.00 56.93 55.13 3h0j s PHE 1653Cb 0.00 -0.13 -0.23 0.00 -1.21 0.00 0.00 43.02 41.45 3h0j s PHE 1653CO 0.00 -0.69 0.31 1.04 -1.34 0.00 0.00 175.22 174.54 3h0j n GLN 1654N -0.20 0.68 -3.20 1.99 1.13 0.85 -4.89 117.38 113.75 3h0j n GLN 1654Ca -0.07 0.19 0.00 0.00 -1.94 0.00 0.00 57.00 55.18 3h0j n GLN 1654Cb 0.63 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 29.32 3h0j n GLN 1654CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 3h0j n TYR 1655N -3.09 0.00 -5.14 1.08 0.18 -1.26 -5.02 117.16 103.92 3h0j n TYR 1655Ca -0.29 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.20 3h0j n TYR 1655Cb 1.07 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.87 3h0j n TYR 1655CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3h0j s LEU 1656N 0.00 2.04 0.29 -3.48 1.02 -1.26 -2.32 118.68 114.96 3h0j s LEU 1656Ca 0.00 -0.43 0.04 0.00 0.02 0.00 0.00 54.13 53.76 3h0j s LEU 1656Cb 0.00 -1.20 -0.03 0.00 0.02 0.00 0.00 46.19 44.98 3h0j s LEU 1656CO 0.00 0.26 0.21 -0.72 0.02 0.00 0.00 176.35 176.13 3h0j s TYR 1657N -0.41 1.54 -0.06 0.29 1.13 0.87 -1.36 117.35 119.35 3h0j s TYR 1657Ca 0.05 -1.53 0.04 0.00 -1.41 0.00 0.00 57.07 54.23 3h0j s TYR 1657Cb -0.10 -0.69 -0.00 0.00 -1.10 0.00 0.00 41.96 40.07 3h0j s TYR 1657CO 0.00 -0.74 -0.20 -0.51 -2.51 0.00 0.00 175.55 171.59 3h0j s LEU 1658N -3.31 1.95 0.50 -3.49 1.02 0.33 -0.29 118.68 115.40 3h0j s LEU 1658Ca 0.39 -0.43 -0.20 0.00 0.02 0.00 0.00 54.13 53.91 3h0j s LEU 1658Cb 0.04 -1.15 -0.07 0.00 0.02 0.00 0.00 46.19 45.03 3h0j s LEU 1658CO 0.21 0.16 1.08 0.42 0.02 0.00 0.00 176.35 178.24 3h0j s THR 1659N 0.15 3.51 0.54 5.49 -4.23 -1.26 -1.88 115.64 117.95 3h0j s THR 1659Ca -0.09 0.97 0.36 0.00 -1.18 0.00 0.00 61.69 61.75 3h0j s THR 1659Cb -0.14 -3.41 0.54 0.00 1.34 0.00 0.00 72.50 70.83 3h0j s THR 1659CO 0.04 -0.17 1.81 -1.28 -0.54 0.00 0.00 174.62 174.48 3h0j h SER 1660N 1.54 0.02 -0.29 3.99 0.87 -1.99 1.09 113.55 118.77 3h0j h SER 1660Ca -0.50 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 59.91 3h0j h SER 1660Cb 1.24 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 3h0j h SER 1660CO 0.59 0.00 -0.43 -0.08 -0.53 0.00 0.00 176.83 176.38 3h0j h GLU 1661N 0.02 0.86 -0.08 2.24 4.81 -1.94 -3.05 114.58 117.43 3h0j h GLU 1661Ca 0.55 -0.47 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3h0j h GLU 1661Cb 2.19 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 31.60 3h0j h GLU 1661CO -0.02 1.11 -0.05 0.78 -0.73 0.00 0.00 179.01 180.10 3h0j h GLY 1662N 0.82 0.19 1.34 1.92 0.00 0.81 -2.20 103.07 105.94 3h0j h GLY 1662Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.20 3h0j h GLY 1662CO 0.10 0.16 0.25 -0.33 0.00 0.00 0.00 176.54 176.72 3h0j h MET 1663N -0.22 0.00 0.03 4.80 2.86 -1.06 0.98 114.93 122.32 3h0j h MET 1663Ca 0.02 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.37 3h0j h MET 1663Cb 0.52 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 3h0j h MET 1663CO 0.01 0.00 -1.59 0.39 1.06 0.00 0.00 176.91 176.78 3h0j n GLU 1664N -2.12 0.62 -0.28 1.72 -0.58 -1.00 -3.30 120.64 115.70 3h0j n GLU 1664Ca -0.01 0.46 0.10 0.00 -0.42 0.00 0.00 57.16 57.29 3h0j n GLU 1664Cb 0.27 -1.71 0.25 0.00 -0.57 0.00 0.00 31.44 29.68 3h0j n GLU 1664CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 3h0j h THR 1665N -0.69 0.45 0.62 2.62 2.02 -0.21 0.49 112.91 118.20 3h0j h THR 1665Ca -0.41 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 66.64 3h0j h THR 1665Cb 1.54 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 68.08 3h0j h THR 1665CO -0.15 0.05 -0.30 -0.07 0.37 0.00 0.00 175.52 175.43 3h0j h LEU 1666N 0.30 -0.70 -1.98 2.58 4.07 -1.60 -2.01 115.31 115.96 3h0j h LEU 1666Ca 0.50 0.02 0.24 0.00 0.08 0.00 0.00 57.88 58.72 3h0j h LEU 1666Cb 0.92 0.18 -0.03 0.00 1.08 0.00 0.00 40.66 42.81 3h0j h LEU 1666CO -0.56 -0.43 0.62 0.11 -1.08 0.00 0.00 178.44 177.10 3h0j h LYS 1667N -0.98 0.00 -0.45 1.13 1.57 -1.39 0.21 116.57 116.66 3h0j h LYS 1667Ca -0.08 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 3h0j h LYS 1667Cb 0.63 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 3h0j h LYS 1667CO 0.14 0.00 0.05 -0.22 -0.57 0.00 0.00 179.45 178.85 3h0j h LYS 1668N 0.00 0.77 -0.25 3.15 3.64 0.26 -2.60 116.57 121.54 3h0j h LYS 1668Ca 0.39 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3h0j h LYS 1668Cb 1.62 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.36 3h0j h LYS 1668CO -0.00 0.80 0.00 1.19 -2.27 0.00 0.00 179.45 179.16 3h0j n PHE 1669N -4.44 0.32 -3.06 1.91 0.99 0.49 -4.96 117.46 108.71 3h0j n PHE 1669Ca 0.00 -0.16 -0.00 0.00 -0.00 0.00 0.00 57.45 57.29 3h0j n PHE 1669Cb 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.74 3h0j n PHE 1669CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 3h0j n ASP 1670N 0.54 -7.80 -2.72 4.37 2.03 0.23 -4.97 116.55 108.23 3h0j n ASP 1670Ca 0.16 -0.07 -0.03 0.00 0.52 0.00 0.00 54.79 55.37 3h0j n ASP 1670Cb 0.36 -5.31 0.10 0.00 -0.72 0.00 0.00 41.12 35.55 3h0j n ASP 1670CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3h0j n LYS 1671N -1.78 1.42 0.19 -0.67 5.02 -0.90 -4.95 118.16 116.49 3h0j n LYS 1671Ca -0.00 -2.00 0.03 0.00 -2.02 0.00 0.00 58.31 54.32 3h0j n LYS 1671Cb 0.50 -0.25 0.36 0.00 -0.02 0.00 0.00 35.03 35.62 3h0j n LYS 1671CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3h0j h GLU 1672N 1.66 0.00 0.00 1.97 5.08 -1.91 -2.29 114.58 119.10 3h0j h GLU 1672Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3h0j h GLU 1672Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 3h0j h GLU 1672CO -0.04 0.37 0.00 0.27 -1.00 0.00 0.00 179.01 178.61 3h0j n ASN 1673N -4.10 0.00 0.14 1.42 0.23 -1.26 -3.66 115.26 108.03 3h0j n ASN 1673Ca -0.02 -1.61 0.13 0.00 -0.53 0.00 0.00 54.58 52.54 3h0j n ASN 1673Cb 0.40 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.59 3h0j n ASN 1673CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 3h0j h SER 1674N 0.00 0.00 -5.09 0.53 0.02 -1.71 -3.41 113.55 103.89 3h0j h SER 1674Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 3h0j h SER 1674Cb 0.00 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.38 3h0j h SER 1674CO 0.00 0.00 -0.32 0.68 -1.14 0.00 0.00 176.83 176.05 3h0j s VAL 1675N -3.31 0.11 -0.23 2.27 -7.23 -1.24 -1.21 120.40 109.56 3h0j s VAL 1675Ca 0.05 -0.90 -0.03 0.00 -1.81 0.00 0.00 61.98 59.29 3h0j s VAL 1675Cb 0.10 -1.08 0.01 0.00 0.56 0.00 0.00 36.38 35.97 3h0j s VAL 1675CO 0.44 -0.50 -0.06 -0.76 -0.31 0.00 0.00 175.10 173.91 3h0j s LEU 1676N -2.39 2.99 0.26 1.32 1.43 0.17 -4.91 118.68 117.55 3h0j s LEU 1676Ca -0.01 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 3h0j s LEU 1676Cb 0.01 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 3h0j s LEU 1676CO -0.07 -0.07 0.02 0.42 0.23 0.00 0.00 176.35 176.87 3h0j s THR 1677N 1.40 1.08 -0.06 5.49 -4.23 -1.26 0.57 115.64 118.62 3h0j s THR 1677Ca 0.03 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 3h0j s THR 1677Cb -0.15 -2.48 0.03 0.00 1.34 0.00 0.00 72.50 71.23 3h0j s THR 1677CO -0.05 -0.22 0.01 -1.61 -0.54 0.00 0.00 174.62 172.22 3h0j s GLU 1678N -3.87 0.47 0.45 3.99 2.02 -1.03 -4.94 118.70 115.80 3h0j s GLU 1678Ca 0.31 0.14 -0.22 0.00 0.02 0.00 0.00 54.97 55.22 3h0j s GLU 1678Cb 0.06 -0.84 -0.08 0.00 0.10 0.00 0.00 34.13 33.38 3h0j s GLU 1678CO 0.11 -0.28 1.10 -0.98 0.02 0.00 0.00 175.26 175.23 3h0j s ARG 1679N 1.86 3.87 -0.06 1.61 1.70 -1.26 -2.23 118.95 124.43 3h0j s ARG 1679Ca 0.03 1.58 -0.24 0.00 -0.47 0.00 0.00 55.73 56.63 3h0j s ARG 1679Cb -0.12 -2.35 0.05 0.00 -0.57 0.00 0.00 34.95 31.96 3h0j s ARG 1679CO -0.04 -0.41 0.53 -0.08 -1.08 0.00 0.00 175.30 174.22 3h0j s THR 1680N -1.69 0.02 -0.13 4.99 -1.32 0.13 -4.95 115.64 112.68 3h0j s THR 1680Ca 0.63 -0.17 -0.02 0.00 -1.21 0.00 0.00 61.69 60.93 3h0j s THR 1680Cb -0.23 -0.83 -0.02 0.00 -1.51 0.00 0.00 72.50 69.90 3h0j s THR 1680CO 0.28 -0.09 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.84 3h0j s VAL 1681N -1.03 3.58 -0.35 5.08 1.01 -1.26 0.86 120.40 128.29 3h0j s VAL 1681Ca -0.10 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.42 3h0j s VAL 1681Cb -0.02 -2.53 0.10 0.00 0.00 0.00 0.00 36.38 33.93 3h0j s VAL 1681CO 0.07 0.52 0.08 -0.63 0.00 0.00 0.00 175.10 175.14 3h0j s ILE 1682N 0.12 2.52 -0.30 2.22 -1.09 0.12 -4.89 121.20 119.91 3h0j s ILE 1682Ca -0.03 -2.23 -0.26 0.00 -2.23 0.00 0.00 60.65 55.89 3h0j s ILE 1682Cb -0.14 -2.80 0.04 0.00 -1.58 0.00 0.00 42.46 37.98 3h0j s ILE 1682CO 0.03 -0.59 0.44 -0.46 -1.23 0.00 0.00 174.94 173.14 3h0j n ASN 1683N 4.34 -3.66 0.00 3.58 0.23 -1.26 -0.56 115.26 117.94 3h0j n ASN 1683Ca 0.01 -0.11 0.00 0.00 -0.53 0.00 0.00 54.58 53.96 3h0j n ASN 1683Cb 0.42 -1.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.06 3h0j n ASN 1683CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h0j n GLY 1684N -0.10 2.93 3.90 4.83 0.00 -1.26 -5.00 105.19 110.49 3h0j n GLY 1684Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 3h0j n GLY 1684CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h0j s GLU 1685N -0.04 3.62 -0.36 1.61 2.12 0.28 -5.07 118.70 120.86 3h0j s GLU 1685Ca 0.00 -0.08 -0.09 0.00 0.36 0.00 0.00 54.97 55.15 3h0j s GLU 1685Cb 0.00 -2.88 0.03 0.00 0.26 0.00 0.00 34.13 31.54 3h0j s GLU 1685CO 0.00 0.49 0.17 -2.00 -0.54 0.00 0.00 175.26 173.39 3h0j s GLU 1686N -2.53 2.74 -0.13 4.30 2.12 -1.26 0.15 118.70 124.09 3h0j s GLU 1686Ca 0.39 -1.12 -0.02 0.00 0.36 0.00 0.00 54.97 54.58 3h0j s GLU 1686Cb -0.12 -3.64 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 3h0j s GLU 1686CO 0.24 -0.69 -0.06 1.03 -0.54 0.00 0.00 175.26 175.23 3h0j s ARG 1687N 1.50 3.46 -0.50 4.30 0.52 0.25 -4.03 118.95 124.45 3h0j s ARG 1687Ca 0.01 -0.55 -0.06 0.00 -0.52 0.00 0.00 55.73 54.61 3h0j s ARG 1687Cb -0.19 -2.81 0.13 0.00 0.52 0.00 0.00 34.95 32.60 3h0j s ARG 1687CO 0.05 0.32 0.33 -0.06 0.02 0.00 0.00 175.30 175.96 3h0j s PHE 1688N 0.13 3.50 -0.10 -0.53 0.08 -0.79 0.17 117.98 120.45 3h0j s PHE 1688Ca -0.02 -2.28 -0.30 0.00 0.12 0.00 0.00 56.93 54.45 3h0j s PHE 1688Cb -0.14 -3.34 -0.03 0.00 -0.57 0.00 0.00 43.02 38.94 3h0j s PHE 1688CO 0.03 -0.95 1.27 0.54 -0.10 0.00 0.00 175.22 176.01 3h0j s VAL 1689N 0.90 4.18 -0.30 -0.44 0.11 -0.95 0.12 120.40 124.03 3h0j s VAL 1689Ca 0.10 1.48 -0.29 0.00 -2.93 0.00 0.00 61.98 60.34 3h0j s VAL 1689Cb -0.23 -3.95 -0.00 0.00 -1.53 0.00 0.00 36.38 30.67 3h0j s VAL 1689CO -0.03 -0.07 1.39 -0.63 -3.33 0.00 0.00 175.10 172.43 3h0j s ILE 1690N 2.89 4.00 -0.07 7.04 1.01 -0.47 -2.46 121.20 133.15 3h0j s ILE 1690Ca 0.57 1.12 0.14 0.00 0.00 0.00 0.00 60.65 62.48 3h0j s ILE 1690Cb -0.24 -4.06 -0.15 0.00 0.01 0.00 0.00 42.46 38.02 3h0j s ILE 1690CO 0.19 -0.47 0.91 0.11 0.00 0.00 0.00 174.94 175.69 3h0j h LYS 1691N 9.83 0.00 -1.89 2.79 1.79 -0.20 -3.45 116.57 125.43 3h0j h LYS 1691Ca -0.28 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.17 3h0j h LYS 1691Cb 1.11 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.54 3h0j h LYS 1691CO 1.03 0.46 0.23 0.99 -1.08 0.00 0.00 179.45 181.08 3h0j s THR 1692N -2.80 0.00 -0.31 -0.16 2.01 -1.09 -4.98 115.64 108.31 3h0j s THR 1692Ca -0.02 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 61.89 3h0j s THR 1692Cb 0.08 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.60 3h0j s THR 1692CO 0.81 0.00 0.13 -0.63 -0.69 0.00 0.00 174.62 174.23 3h0j s ILE 1693N 0.08 4.35 -0.16 1.82 1.01 -1.26 -0.66 121.20 126.38 3h0j s ILE 1693Ca -0.01 -0.55 -0.13 0.00 0.00 0.00 0.00 60.65 59.96 3h0j s ILE 1693Cb -0.04 -3.24 -0.09 0.00 0.01 0.00 0.00 42.46 39.10 3h0j s ILE 1693CO 0.01 0.06 -0.02 0.40 0.00 0.00 0.00 174.94 175.39 3h0j h ILE 1694N 5.75 0.34 0.00 2.92 1.08 -1.41 -3.48 117.51 122.70 3h0j h ILE 1694Ca -0.32 -1.42 0.00 0.00 -0.39 0.00 0.00 64.86 62.74 3h0j h ILE 1694Cb 1.14 0.80 0.00 0.00 -3.07 0.00 0.00 36.82 35.69 3h0j h ILE 1694CO 0.61 0.12 0.00 0.61 -0.69 0.00 0.00 178.15 178.80 3h0j n GLY 1695N 1.57 1.45 0.13 5.37 0.00 -0.67 -4.83 105.19 108.20 3h0j n GLY 1695Ca -0.15 -1.54 0.09 0.00 0.00 0.00 0.00 46.02 44.42 3h0j n GLY 1695CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h0j h SER 1696N 0.00 0.00 -3.33 1.61 4.64 -1.91 -3.44 113.55 111.12 3h0j h SER 1696Ca 0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 3h0j h SER 1696Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 3h0j h SER 1696CO 0.00 0.13 -0.05 -0.70 -0.87 0.00 0.00 176.83 175.35 3h0j s GLU 1697N -3.24 4.35 0.12 4.77 2.12 -1.26 -5.06 118.70 120.50 3h0j s GLU 1697Ca 0.00 0.64 -0.23 0.00 0.36 0.00 0.00 54.97 55.74 3h0j s GLU 1697Cb 0.09 -3.41 -0.07 0.00 0.26 0.00 0.00 34.13 30.99 3h0j s GLU 1697CO 0.78 0.19 0.70 0.34 -0.54 0.00 0.00 175.26 176.72 3h0j s ASP 1698N 0.46 7.25 0.00 -1.70 2.15 -1.26 -4.32 116.67 119.24 3h0j s ASP 1698Ca 0.30 1.48 0.00 0.00 0.43 0.00 0.00 52.55 54.76 3h0j s ASP 1698Cb -0.17 -2.44 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 3h0j s ASP 1698CO 0.14 0.21 0.00 0.61 -0.17 0.00 0.00 175.17 175.96 3h0j n GLY 1699N 1.74 1.96 0.14 2.66 0.00 -1.26 -4.93 105.19 105.50 3h0j n GLY 1699Ca -0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 3h0j n GLY 1699CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h0j h LEU 1700N 0.00 0.44 0.00 0.99 4.07 -1.83 -3.35 115.31 115.64 3h0j h LEU 1700Ca 0.00 -0.94 0.00 0.00 0.08 0.00 0.00 57.88 57.02 3h0j h LEU 1700Cb 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.60 3h0j h LEU 1700CO 0.00 1.83 0.00 0.61 -1.08 0.00 0.00 178.44 179.80 3h0j n GLY 1701N 1.97 2.64 0.55 0.83 0.00 -1.26 -1.74 105.19 108.18 3h0j n GLY 1701Ca -0.30 0.01 0.39 0.00 0.00 0.00 0.00 46.02 46.11 3h0j n GLY 1701CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3h0j h VAL 1702N 0.00 0.26 0.00 1.61 -1.51 -1.97 1.25 116.25 115.90 3h0j h VAL 1702Ca 0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.45 3h0j h VAL 1702Cb 0.00 0.18 0.00 0.00 -2.13 0.00 0.00 31.29 29.34 3h0j h VAL 1702CO 0.00 0.01 0.00 1.05 -1.23 0.00 0.00 177.57 177.40 3h0j h GLU 1703N 0.07 0.00 0.09 5.19 9.09 -1.97 0.42 114.58 127.48 3h0j h GLU 1703Ca 0.72 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 59.83 3h0j h GLU 1703Cb 2.61 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.70 3h0j h GLU 1703CO -0.13 0.00 -1.52 0.00 0.05 0.00 0.00 179.01 177.40 3h0j h LEU 1705N 0.05 0.27 -0.31 0.00 3.38 -0.95 -1.61 115.31 116.15 3h0j h LEU 1705Ca -0.23 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 3h0j h LEU 1705Cb 1.99 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.66 3h0j h LEU 1705CO 0.15 0.76 -0.05 -0.09 0.09 0.00 0.00 178.44 179.29 3h0j h ARG 1706N 0.19 0.58 -0.09 1.13 2.43 -1.09 -2.38 114.38 115.16 3h0j h ARG 1706Ca 0.00 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 58.90 3h0j h ARG 1706Cb 1.01 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 3h0j h ARG 1706CO 0.08 0.76 -0.20 0.78 -1.51 0.00 0.00 179.97 179.88 3h0j h GLY 1707N 0.36 0.16 0.86 2.80 0.00 -1.39 -1.84 103.07 104.02 3h0j h GLY 1707Ca 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 3h0j h GLY 1707CO 0.03 0.10 0.06 1.76 0.00 0.00 0.00 176.54 178.48 3h0j h SER 1708N 0.14 0.29 -0.81 0.19 0.02 -0.99 -2.60 113.55 109.79 3h0j h SER 1708Ca 0.03 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3h0j h SER 1708Cb 0.44 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 3h0j h SER 1708CO 0.03 0.43 0.53 1.23 -1.14 0.00 0.00 176.83 177.91 3h0j h GLY 1709N 0.14 1.14 0.44 -3.77 0.00 -1.06 -0.35 103.07 99.61 3h0j h GLY 1709Ca 0.06 -0.43 0.09 0.00 0.00 0.00 0.00 47.33 47.05 3h0j h GLY 1709CO -0.00 0.42 0.29 -2.00 0.00 0.00 0.00 176.54 175.26 3h0j h LEU 1710N 1.09 0.35 0.00 3.11 5.85 -1.12 -0.57 115.31 124.02 3h0j h LEU 1710Ca 0.29 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.08 3h0j h LEU 1710Cb -0.12 0.01 0.00 0.00 0.37 0.00 0.00 40.66 40.93 3h0j h LEU 1710CO -0.06 0.20 -0.33 2.30 -0.34 0.00 0.00 178.44 180.21 3h0j n ILE 1711N -4.92 0.01 0.15 4.05 -5.35 -0.98 -1.68 119.36 110.63 3h0j n ILE 1711Ca 0.10 -0.01 -0.07 0.00 -0.27 0.00 0.00 62.75 62.50 3h0j n ILE 1711Cb 0.27 -0.02 -0.03 0.00 -1.74 0.00 0.00 39.64 38.12 3h0j n ILE 1711CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0j h ALA 1712N 2.98 -0.46 -0.26 -1.28 0.00 0.29 -2.40 119.26 118.14 3h0j h ALA 1712Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.89 3h0j h ALA 1712Cb 0.51 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3h0j h ALA 1712CO 0.00 -0.43 0.19 0.78 0.00 0.00 0.00 179.25 179.79 3h0j h GLY 1713N -1.12 0.00 0.93 0.00 0.00 -1.24 0.11 103.07 101.75 3h0j h GLY 1713Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 3h0j h GLY 1713CO 0.08 0.00 0.11 0.00 0.00 0.00 0.00 176.54 176.73 3h0j h ALA 1714N 1.87 0.49 -0.27 3.60 0.00 -1.31 -1.78 119.26 121.85 3h0j h ALA 1714Ca 0.12 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3h0j h ALA 1714Cb 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3h0j h ALA 1714CO -0.00 0.13 -0.08 1.15 0.00 0.00 0.00 179.25 180.45 3h0j h THR 1715N 0.45 1.29 -0.68 0.00 2.02 -0.68 -0.75 112.91 114.56 3h0j h THR 1715Ca 0.12 -1.13 0.14 0.00 0.77 0.00 0.00 66.41 66.31 3h0j h THR 1715Cb 0.26 1.46 -0.13 0.00 -1.74 0.00 0.00 68.15 68.00 3h0j h THR 1715CO -0.00 0.36 -0.14 -1.28 0.37 0.00 0.00 175.52 174.82 3h0j h SER 1716N 0.29 -0.58 -0.02 4.18 0.87 -0.86 0.11 113.55 117.54 3h0j h SER 1716Ca 0.07 0.20 -0.00 0.00 -1.23 0.00 0.00 61.79 60.82 3h0j h SER 1716Cb 0.57 0.40 -0.00 0.00 -0.44 0.00 0.00 62.40 62.93 3h0j h SER 1716CO 0.03 -0.21 -0.00 0.03 -0.53 0.00 0.00 176.83 176.15 3h0j h ARG 1717N 0.02 0.04 -0.99 2.24 3.08 -1.06 -3.08 114.38 114.63 3h0j h ARG 1717Ca 0.33 -0.01 0.24 0.00 0.07 0.00 0.00 59.98 60.61 3h0j h ARG 1717Cb 0.52 -0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.44 3h0j h ARG 1717CO -0.68 0.35 0.57 0.00 -1.07 0.00 0.00 179.97 179.14 3h0j h ALA 1718N 0.69 1.75 -0.61 0.04 0.00 0.22 -1.39 119.26 119.97 3h0j h ALA 1718Ca 0.01 0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.12 3h0j h ALA 1718Cb 0.33 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3h0j h ALA 1718CO 0.00 -0.28 0.40 -0.92 0.00 0.00 0.00 179.25 178.45 3h0j h TYR 1719N 0.56 0.55 0.00 0.00 5.03 -0.75 -0.07 116.97 122.28 3h0j h TYR 1719Ca 0.64 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.96 3h0j h TYR 1719Cb 1.21 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 39.31 3h0j h TYR 1719CO -0.02 0.28 -0.23 0.72 -1.32 0.00 0.00 178.16 177.59 3h0j n HIS 1720N -4.48 0.65 -0.10 -3.82 8.25 -0.54 -3.94 115.22 111.25 3h0j n HIS 1720Ca 0.09 0.19 -0.17 0.00 -0.26 0.00 0.00 57.72 57.57 3h0j n HIS 1720Cb 0.28 -0.76 -0.09 0.00 1.12 0.00 0.00 29.99 30.54 3h0j n HIS 1720CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3h0j n ASP 1721N -2.08 2.17 -4.11 0.41 4.64 -0.43 -4.45 116.55 112.70 3h0j n ASP 1721Ca 0.05 -0.01 -0.20 0.00 -1.38 0.00 0.00 54.79 53.26 3h0j n ASP 1721Cb 0.42 -0.41 -0.09 0.00 -1.04 0.00 0.00 41.12 39.99 3h0j n ASP 1721CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 3h0j s ILE 1722N -2.41 0.49 -0.09 5.18 -4.36 -0.17 -4.70 121.20 115.14 3h0j s ILE 1722Ca -0.28 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 57.81 3h0j s ILE 1722Cb 0.08 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 41.23 3h0j s ILE 1722CO 0.45 0.00 1.20 0.12 0.24 0.00 0.00 174.94 176.95 3h0j s PHE 1723N -3.54 3.12 0.05 1.37 5.36 -1.26 -4.07 117.98 119.01 3h0j s PHE 1723Ca 0.34 1.18 0.09 0.00 -0.96 0.00 0.00 56.93 57.58 3h0j s PHE 1723Cb 0.05 -3.43 -0.03 0.00 -0.34 0.00 0.00 43.02 39.28 3h0j s PHE 1723CO 0.16 -1.35 -0.24 0.95 -1.46 0.00 0.00 175.22 173.28 3h0j s THR 1724N 2.58 1.95 -0.19 0.12 -4.23 -1.26 -1.01 115.64 113.60 3h0j s THR 1724Ca 0.55 -1.33 -0.27 0.00 -1.18 0.00 0.00 61.69 59.46 3h0j s THR 1724Cb -0.23 -1.68 0.07 0.00 1.34 0.00 0.00 72.50 72.00 3h0j s THR 1724CO 0.19 0.28 0.69 -0.51 -0.54 0.00 0.00 174.62 174.73 3h0j s ILE 1725N -0.82 0.00 -0.00 2.99 2.07 -1.11 -4.29 121.20 120.04 3h0j s ILE 1725Ca 0.10 -0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.36 3h0j s ILE 1725Cb -0.09 -0.98 -0.01 0.00 0.13 0.00 0.00 42.46 41.51 3h0j s ILE 1725CO 0.02 -0.00 -0.09 0.28 -1.91 0.00 0.00 174.94 173.24 3h0j s THR 1726N -0.19 0.69 -0.18 4.00 -1.32 -0.67 -1.33 115.64 116.64 3h0j s THR 1726Ca -0.04 -0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 60.00 3h0j s THR 1726Cb -0.03 -0.59 -0.02 0.00 -1.51 0.00 0.00 72.50 70.36 3h0j s THR 1726CO 0.04 0.17 -0.06 -0.22 -2.21 0.00 0.00 174.62 172.33 3h0j s LEU 1727N -0.28 2.94 -0.40 9.08 2.96 0.30 -0.94 118.68 132.35 3h0j s LEU 1727Ca 0.03 -0.31 -0.17 0.00 -0.22 0.00 0.00 54.13 53.46 3h0j s LEU 1727Cb -0.04 -1.72 0.01 0.00 0.50 0.00 0.00 46.19 44.95 3h0j s LEU 1727CO -0.00 0.08 0.45 -0.69 -1.32 0.00 0.00 176.35 174.87 3h0j s VAL 1728N 0.89 5.07 -0.30 1.68 1.01 -0.20 -0.10 120.40 128.45 3h0j s VAL 1728Ca -0.01 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 61.80 3h0j s VAL 1728Cb -0.15 -4.01 0.09 0.00 0.00 0.00 0.00 36.38 32.31 3h0j s VAL 1728CO 0.01 -0.37 0.06 0.28 0.00 0.00 0.00 175.10 175.08 3h0j s THR 1729N 2.21 1.42 0.00 3.92 -1.32 -0.05 -2.16 115.64 119.65 3h0j s THR 1729Ca 0.14 -1.65 0.00 0.00 -1.21 0.00 0.00 61.69 58.97 3h0j s THR 1729Cb -0.17 -2.00 0.00 0.00 -1.51 0.00 0.00 72.50 68.83 3h0j s THR 1729CO 0.14 -0.55 0.00 0.00 -2.21 0.00 0.00 174.62 172.00 3h0j n ARG 1731N 0.20 0.00 -3.91 0.00 1.85 -1.26 -4.16 116.66 109.38 3h0j n ARG 1731Ca 0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.57 3h0j n ARG 1731Cb 0.00 0.00 -0.16 0.00 -1.05 0.00 0.00 32.46 31.25 3h0j n ARG 1731CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 3h0j s SER 1732N 0.00 2.78 0.27 2.89 0.15 -0.30 -1.04 113.70 118.46 3h0j s SER 1732Ca 0.00 -0.62 0.11 0.00 0.70 0.00 0.00 55.95 56.13 3h0j s SER 1732Cb 0.00 -0.95 -0.05 0.00 -1.71 0.00 0.00 66.02 63.31 3h0j s SER 1732CO 0.00 -0.16 -0.10 -0.69 1.20 0.00 0.00 173.24 173.49 3h0j s VAL 1733N 1.61 2.98 0.00 4.45 1.01 -1.24 -1.69 120.40 127.52 3h0j s VAL 1733Ca 0.01 -2.15 0.00 0.00 0.00 0.00 0.00 61.98 59.84 3h0j s VAL 1733Cb -0.15 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.65 3h0j s VAL 1733CO -0.08 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.24 3h0j n GLY 1734N -0.76 2.21 0.32 4.51 0.00 -0.71 0.19 105.19 110.95 3h0j n GLY 1734Ca -0.06 0.36 0.20 0.00 0.00 0.00 0.00 46.02 46.52 3h0j n GLY 1734CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3h0j h ILE 1735N 0.00 0.00 -0.09 -0.61 -0.00 -1.93 0.27 117.51 115.15 3h0j h ILE 1735Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 64.86 64.69 3h0j h ILE 1735Cb 0.00 0.86 -0.01 0.00 -0.00 0.00 0.00 36.82 37.68 3h0j h ILE 1735CO 0.00 0.00 -0.67 1.23 -0.00 0.00 0.00 178.15 178.71 3h0j h GLY 1736N 0.00 0.42 1.24 8.18 0.00 0.17 -2.10 103.07 110.97 3h0j h GLY 1736Ca 0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 47.33 46.62 3h0j h GLY 1736CO 0.00 0.50 -0.39 0.00 0.00 0.00 0.00 176.54 176.65 3h0j h ALA 1737N 1.01 0.66 -0.51 3.60 0.00 -0.35 -3.08 119.26 120.58 3h0j h ALA 1737Ca -0.02 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 3h0j h ALA 1737Cb 1.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3h0j h ALA 1737CO 0.11 0.67 -0.12 1.88 0.00 0.00 0.00 179.25 181.80 3h0j h TYR 1738N 0.69 1.11 -0.15 0.00 0.05 -1.42 -2.05 116.97 115.19 3h0j h TYR 1738Ca 0.06 -0.24 0.04 0.00 0.05 0.00 0.00 58.73 58.65 3h0j h TYR 1738Cb 0.96 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.42 3h0j h TYR 1738CO 0.06 1.05 0.12 -0.07 -1.05 0.00 0.00 178.16 178.26 3h0j h LEU 1739N 0.85 0.00 0.59 3.88 3.38 -1.35 0.42 115.31 123.08 3h0j h LEU 1739Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3h0j h LEU 1739Cb 0.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.44 3h0j h LEU 1739CO 0.05 0.00 -0.28 0.58 0.09 0.00 0.00 178.44 178.88 3h0j h VAL 1740N 0.00 0.13 -0.74 1.22 2.07 -1.29 -2.61 116.25 115.03 3h0j h VAL 1740Ca 0.07 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 3h0j h VAL 1740Cb 0.31 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 3h0j h VAL 1740CO -0.00 0.02 0.41 -0.09 0.02 0.00 0.00 177.57 177.94 3h0j h ARG 1741N -1.15 1.01 -0.01 1.57 9.65 -1.07 -2.85 114.38 121.53 3h0j h ARG 1741Ca -0.08 -0.10 -0.11 0.00 -1.10 0.00 0.00 59.98 58.59 3h0j h ARG 1741Cb 0.65 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 29.00 3h0j h ARG 1741CO 0.13 0.73 -0.50 -0.07 2.80 0.00 0.00 179.97 183.06 3h0j h LEU 1742N 1.02 0.04 0.00 3.80 3.38 -0.25 -1.23 115.31 122.07 3h0j h LEU 1742Ca 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3h0j h LEU 1742Cb 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3h0j h LEU 1742CO -0.04 0.54 0.00 0.61 0.09 0.00 0.00 178.44 179.63 3h0j n GLY 1743N -0.07 -1.41 5.12 0.83 0.00 -0.98 -4.51 105.19 104.17 3h0j n GLY 1743Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3h0j n GLY 1743CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0j n GLN 1744N -1.49 0.00 -2.08 1.61 1.13 -0.46 -4.41 117.38 111.68 3h0j n GLN 1744Ca 0.07 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.70 3h0j n GLN 1744Cb 0.31 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.63 3h0j n GLN 1744CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3h0j s ARG 1745N 0.00 4.10 -0.01 -1.09 0.52 -1.26 -4.81 118.95 116.40 3h0j s ARG 1745Ca 0.00 2.02 0.01 0.00 -0.52 0.00 0.00 55.73 57.24 3h0j s ARG 1745Cb 0.00 -3.97 0.01 0.00 0.52 0.00 0.00 34.95 31.50 3h0j s ARG 1745CO 0.00 -0.93 -0.03 0.00 0.02 0.00 0.00 175.30 174.36 3h0j s ALA 1746N 4.25 0.38 -0.18 2.13 0.00 -1.26 -1.67 121.76 125.40 3h0j s ALA 1746Ca 0.71 -0.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 3h0j s ALA 1746Cb -0.30 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.64 3h0j s ALA 1746CO 0.28 0.04 -0.11 0.42 0.00 0.00 0.00 175.76 176.39 3h0j s ILE 1747N 0.26 2.91 -0.26 0.00 1.01 -0.11 0.04 121.20 125.05 3h0j s ILE 1747Ca -0.03 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 59.87 3h0j s ILE 1747Cb -0.06 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 3h0j s ILE 1747CO -0.00 0.48 0.11 -1.58 0.00 0.00 0.00 174.94 173.95 3h0j s GLN 1748N 1.11 3.76 0.10 2.79 0.74 -0.05 -1.03 119.66 127.07 3h0j s GLN 1748Ca 0.01 -0.42 -0.30 0.00 0.05 0.00 0.00 55.36 54.69 3h0j s GLN 1748Cb -0.14 -3.45 -0.06 0.00 1.10 0.00 0.00 33.01 30.45 3h0j s GLN 1748CO -0.03 -0.19 1.19 0.08 -0.55 0.00 0.00 175.29 175.79 3h0j s VAL 1749N 1.67 3.92 0.30 1.34 1.01 -0.92 -0.81 120.40 126.91 3h0j s VAL 1749Ca 0.07 1.44 -0.28 0.00 0.00 0.00 0.00 61.98 63.20 3h0j s VAL 1749Cb -0.15 -3.92 -0.14 0.00 0.00 0.00 0.00 36.38 32.17 3h0j s VAL 1749CO 0.06 0.15 1.11 -0.62 0.00 0.00 0.00 175.10 175.80 3h0j n GLU 1750N 3.51 1.60 0.00 2.72 1.02 0.16 -1.95 120.64 127.71 3h0j n GLU 1750Ca 0.08 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 3h0j n GLU 1750Cb 0.46 -2.01 0.00 0.00 -0.02 0.00 0.00 31.44 29.87 3h0j n GLU 1750CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h0j n GLY 1751N 1.14 2.12 3.46 0.62 0.00 -1.26 -4.95 105.19 106.31 3h0j n GLY 1751Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 3h0j n GLY 1751CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h0j s GLN 1752N -0.36 2.97 0.50 1.61 -1.52 -0.82 -4.88 119.66 117.15 3h0j s GLN 1752Ca 0.00 -1.02 -0.20 0.00 -1.95 0.00 0.00 55.36 52.19 3h0j s GLN 1752Cb 0.00 -3.97 -0.08 0.00 -0.22 0.00 0.00 33.01 28.74 3h0j s GLN 1752CO 0.00 -0.75 1.05 -1.25 -0.25 0.00 0.00 175.29 174.09 3h0j s PRO 1753N 1.68 3.73 -0.30 2.91 0.04 -1.26 -4.73 135.00 137.06 3h0j s PRO 1753Ca 0.05 1.38 0.04 0.00 0.04 0.00 0.00 61.00 62.51 3h0j s PRO 1753Cb -0.19 -2.08 0.08 0.00 0.04 0.00 0.00 34.50 32.35 3h0j s PRO 1753CO 0.10 -0.50 -0.02 0.42 0.04 0.00 0.00 177.00 177.04 3h0j s ILE 1754N -1.98 2.22 0.13 0.56 1.01 0.22 -1.14 121.20 122.22 3h0j s ILE 1754Ca 0.68 -2.02 -0.00 0.00 0.00 0.00 0.00 60.65 59.30 3h0j s ILE 1754Cb -0.17 -2.50 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 3h0j s ILE 1754CO 0.21 -0.34 0.03 0.27 0.00 0.00 0.00 174.94 175.11 3h0j s ILE 1755N 0.99 0.27 0.00 2.92 -4.36 -0.68 -3.70 121.20 116.64 3h0j s ILE 1755Ca 0.02 -1.91 0.00 0.00 -0.26 0.00 0.00 60.65 58.50 3h0j s ILE 1755Cb -0.19 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.55 3h0j s ILE 1755CO -0.07 -0.56 0.00 0.18 0.24 0.00 0.00 174.94 174.73 3h0j n LEU 1756N -0.09 0.00 -4.75 0.37 4.77 -1.26 -1.74 117.00 114.29 3h0j n LEU 1756Ca -0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.51 3h0j n LEU 1756Cb 0.63 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.67 3h0j n LEU 1756CO 0.31 0.00 0.49 -0.89 -1.33 0.00 0.00 177.39 175.96 3h0j s THR 1757N 0.40 4.68 0.47 -5.08 2.01 -1.26 -4.11 115.64 112.75 3h0j s THR 1757Ca 0.00 1.67 -0.20 0.00 0.31 0.00 0.00 61.69 63.48 3h0j s THR 1757Cb 0.00 -4.13 -0.09 0.00 0.01 0.00 0.00 72.50 68.28 3h0j s THR 1757CO 0.00 0.37 0.99 -0.83 -0.69 0.00 0.00 174.62 174.46 3h0j s GLY 1758N -0.14 2.35 0.21 4.40 0.00 -1.26 -4.86 107.32 108.02 3h0j s GLY 1758Ca 0.39 0.42 -0.21 0.00 0.00 0.00 0.00 44.72 45.32 3h0j s GLY 1758CO 0.24 0.71 1.55 0.00 0.00 0.00 0.00 173.10 175.60 3h0j h ALA 1759N 1.54 -0.01 -0.83 3.20 0.00 -1.92 -1.65 119.26 119.59 3h0j h ALA 1759Ca -0.49 0.24 0.18 0.00 0.00 0.00 0.00 54.91 54.84 3h0j h ALA 1759Cb 1.19 1.08 -0.15 0.00 0.00 0.00 0.00 17.79 19.91 3h0j h ALA 1759CO 0.60 -0.71 -0.13 -1.35 0.00 0.00 0.00 179.25 177.67 3h0j h PRO 1760N -0.01 0.02 -0.20 0.00 0.11 -1.94 0.18 132.00 130.17 3h0j h PRO 1760Ca 0.30 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 3h0j h PRO 1760Cb 0.56 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3h0j h PRO 1760CO -0.96 0.02 -0.06 0.00 -0.21 0.00 0.00 178.00 176.78 3h0j h ALA 1761N 1.82 0.28 -0.87 -0.75 0.00 -1.70 -2.13 119.26 115.91 3h0j h ALA 1761Ca 0.43 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 55.16 3h0j h ALA 1761Cb 0.71 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 3h0j h ALA 1761CO -0.82 0.07 0.56 0.82 0.00 0.00 0.00 179.25 179.88 3h0j h ILE 1762N 0.11 0.98 0.12 0.00 2.04 -0.74 0.51 117.51 120.53 3h0j h ILE 1762Ca 0.05 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3h0j h ILE 1762Cb 0.52 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3h0j h ILE 1762CO 0.02 0.16 -0.06 0.78 0.00 0.00 0.00 178.15 179.05 3h0j h ASN 1763N 0.87 -0.14 -0.22 1.72 -0.26 -0.53 -2.95 115.58 114.07 3h0j h ASN 1763Ca 0.40 0.00 0.06 0.00 -0.56 0.00 0.00 56.30 56.21 3h0j h ASN 1763Cb 0.38 0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.67 3h0j h ASN 1763CO -0.16 -0.09 0.54 0.50 -1.06 0.00 0.00 177.43 177.16 3h0j h LYS 1764N -0.18 0.00 -1.96 0.81 3.64 -1.21 0.40 116.57 118.07 3h0j h LYS 1764Ca -0.02 0.00 -0.75 0.00 -1.27 0.00 0.00 60.65 58.61 3h0j h LYS 1764Cb 0.13 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 31.66 3h0j h LYS 1764CO 0.03 0.00 0.90 -0.12 -2.27 0.00 0.00 179.45 177.99 3h0j n MET 1765N -3.12 2.82 0.00 1.90 1.56 0.15 -3.82 117.12 116.61 3h0j n MET 1765Ca 0.03 -3.61 0.00 0.00 -0.27 0.00 0.00 57.70 53.85 3h0j n MET 1765Cb 0.64 -2.27 0.00 0.00 2.15 0.00 0.00 33.22 33.75 3h0j n MET 1765CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 3h0j n LEU 1766N -0.53 0.00 0.00 -0.89 4.77 0.13 -4.86 117.00 115.62 3h0j n LEU 1766Ca 0.53 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3h0j n LEU 1766Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3h0j n LEU 1766CO 0.49 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3h0j n GLY 1767N 0.00 2.03 3.68 -0.72 0.00 -0.61 -4.96 105.19 104.60 3h0j n GLY 1767Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 3h0j n GLY 1767CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h0j s ARG 1768N 0.00 1.04 -1.09 1.61 3.52 -1.26 -4.70 118.95 118.07 3h0j s ARG 1768Ca 0.00 1.21 -0.09 0.00 -0.13 0.00 0.00 55.73 56.72 3h0j s ARG 1768Cb 0.00 -1.75 0.27 0.00 -1.56 0.00 0.00 34.95 31.91 3h0j s ARG 1768CO 0.00 -2.50 1.08 -2.00 -0.81 0.00 0.00 175.30 171.07 3h0j s GLU 1769N -4.73 4.14 -0.01 5.12 2.12 -1.26 -4.45 118.70 119.63 3h0j s GLU 1769Ca 0.65 -3.17 -0.24 0.00 0.36 0.00 0.00 54.97 52.57 3h0j s GLU 1769Cb -0.21 -4.54 -0.19 0.00 0.26 0.00 0.00 34.13 29.46 3h0j s GLU 1769CO 0.58 -1.25 1.25 0.28 -0.54 0.00 0.00 175.26 175.59 3h0j h VAL 1770N 3.76 1.40 -3.33 3.70 2.07 -1.92 -3.46 116.25 118.47 3h0j h VAL 1770Ca 0.17 -1.31 -0.67 0.00 0.82 0.00 0.00 66.70 65.71 3h0j h VAL 1770Cb 0.89 2.17 -0.14 0.00 -1.52 0.00 0.00 31.29 32.68 3h0j h VAL 1770CO 0.99 0.36 -0.63 -0.31 0.02 0.00 0.00 177.57 178.00 3h0j s TYR 1771N -4.10 3.13 -0.16 1.57 1.51 -1.26 -4.86 117.35 113.18 3h0j s TYR 1771Ca -0.15 0.15 0.15 0.00 -1.01 0.00 0.00 57.07 56.21 3h0j s TYR 1771Cb 0.03 -1.74 -0.24 0.00 -0.11 0.00 0.00 41.96 39.89 3h0j s TYR 1771CO 0.71 0.47 0.20 0.25 -1.11 0.00 0.00 175.55 176.06 3h0j n THR 1772N 1.84 1.45 -3.94 -0.71 -2.24 -1.26 -4.82 114.28 104.60 3h0j n THR 1772Ca -0.17 -0.83 -0.11 0.00 -2.27 0.00 0.00 64.05 60.68 3h0j n THR 1772Cb 0.53 -0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 67.97 3h0j n THR 1772CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3h0j s SER 1773N -5.71 0.18 0.59 3.42 0.15 -1.26 -5.01 113.70 106.06 3h0j s SER 1773Ca -0.10 -0.26 0.29 0.00 0.70 0.00 0.00 55.95 56.59 3h0j s SER 1773Cb 0.07 0.04 1.74 0.00 -1.71 0.00 0.00 66.02 66.16 3h0j s SER 1773CO 0.82 -0.14 2.17 0.78 1.20 0.00 0.00 173.24 178.07 3h0j h ASN 1774N 5.39 0.00 -0.30 5.45 2.35 -1.99 -0.62 115.58 125.86 3h0j h ASN 1774Ca -0.28 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.55 3h0j h ASN 1774Cb 1.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 3h0j h ASN 1774CO 0.46 0.00 0.30 -0.07 -1.65 0.00 0.00 177.43 176.47 3h0j h LEU 1775N 0.00 0.00 -1.40 1.61 3.38 -1.94 0.49 115.31 117.45 3h0j h LEU 1775Ca 0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3h0j h LEU 1775Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3h0j h LEU 1775CO -0.00 0.00 -0.20 1.56 0.09 0.00 0.00 178.44 179.89 3h0j h GLN 1776N 0.00 0.00 0.00 1.13 4.20 -1.51 -1.39 115.11 117.54 3h0j h GLN 1776Ca 0.14 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 3h0j h GLN 1776Cb 0.74 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 3h0j h GLN 1776CO -0.00 0.20 -0.69 1.28 -0.67 0.00 0.00 178.83 178.95 3h0j n LEU 1777N -3.48 1.82 -1.50 1.46 4.32 0.16 -4.76 117.00 115.02 3h0j n LEU 1777Ca -0.01 0.59 -0.06 0.00 -0.02 0.00 0.00 56.01 56.51 3h0j n LEU 1777Cb 0.37 -0.89 0.10 0.00 -1.62 0.00 0.00 43.42 41.38 3h0j n LEU 1777CO 0.32 -0.31 0.21 0.61 -1.22 0.00 0.00 177.39 177.00 3h0j n GLY 1778N 1.57 4.74 3.93 -0.72 0.00 -0.65 -4.82 105.19 109.24 3h0j n GLY 1778Ca -0.13 -1.74 -0.28 0.00 0.00 0.00 0.00 46.02 43.87 3h0j n GLY 1778CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h0j s GLY 1779N -3.29 1.71 0.61 -0.02 0.00 -0.53 -0.61 107.32 105.19 3h0j s GLY 1779Ca 0.41 -1.04 0.37 0.00 0.00 0.00 0.00 44.72 44.46 3h0j s GLY 1779CO -0.04 -0.43 2.24 -0.91 0.00 0.00 0.00 173.10 173.96 3h0j h THR 1780N -1.20 0.19 0.00 0.90 1.35 -1.86 0.81 112.91 113.11 3h0j h THR 1780Ca -0.44 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 3h0j h THR 1780Cb 1.28 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 3h0j h THR 1780CO 0.50 0.02 0.00 0.00 -0.25 0.00 0.00 175.52 175.79 3h0j n GLN 1781N -3.32 0.36 -0.03 4.72 0.00 -1.26 -1.59 117.38 116.26 3h0j n GLN 1781Ca -0.02 0.05 -0.05 0.00 0.00 0.00 0.00 57.00 56.98 3h0j n GLN 1781Cb 0.14 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 28.86 3h0j n GLN 1781CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 3h0j n ILE 1782N -1.28 1.32 0.03 -0.39 2.08 0.17 -4.53 119.36 116.75 3h0j n ILE 1782Ca 0.12 0.25 -0.08 0.00 0.56 0.00 0.00 62.75 63.59 3h0j n ILE 1782Cb 0.19 -2.01 0.07 0.00 -0.75 0.00 0.00 39.64 37.14 3h0j n ILE 1782CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 3h0j h MET 1783N -0.58 0.47 0.00 0.38 2.86 -1.35 -0.84 114.93 115.88 3h0j h MET 1783Ca 0.00 -0.31 -0.14 0.00 -2.06 0.00 0.00 59.70 57.19 3h0j h MET 1783Cb 0.58 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 3h0j h MET 1783CO 0.00 0.91 -0.68 -0.92 1.06 0.00 0.00 176.91 177.28 3h0j h TYR 1784N 0.36 0.00 0.00 -0.22 3.20 -1.51 -1.52 116.97 117.27 3h0j h TYR 1784Ca 0.00 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.75 3h0j h TYR 1784Cb 1.10 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.36 3h0j h TYR 1784CO 0.04 0.68 -0.66 -0.91 -1.64 0.00 0.00 178.16 175.67 3h0j h ASN 1785N 0.00 0.00 -0.11 -2.11 4.21 -1.60 -3.28 115.58 112.70 3h0j h ASN 1785Ca -0.01 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.40 3h0j h ASN 1785Cb 1.28 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.46 3h0j h ASN 1785CO 0.09 0.57 -0.28 -1.13 -1.29 0.00 0.00 177.43 175.40 3h0j h ASN 1786N 0.00 0.58 0.00 5.81 -0.73 -0.75 -3.37 115.58 117.11 3h0j h ASN 1786Ca -0.02 -0.21 0.00 0.00 1.87 0.00 0.00 56.30 57.94 3h0j h ASN 1786Cb 1.46 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.89 3h0j h ASN 1786CO 0.07 0.83 0.00 0.61 -0.37 0.00 0.00 177.43 178.57 3h0j n GLY 1787N -0.27 0.55 0.15 1.57 0.00 -0.87 -4.92 105.19 101.41 3h0j n GLY 1787Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 3h0j n GLY 1787CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h0j h VAL 1788N 0.00 1.39 -3.61 1.61 2.07 -1.70 -3.41 116.25 112.62 3h0j h VAL 1788Ca 0.00 -2.52 -0.70 0.00 0.82 0.00 0.00 66.70 64.31 3h0j h VAL 1788Cb 0.00 2.51 -0.22 0.00 -1.52 0.00 0.00 31.29 32.06 3h0j h VAL 1788CO 0.00 0.75 -0.50 -0.44 0.02 0.00 0.00 177.57 177.40 3h0j s SER 1789N -7.14 5.80 0.38 0.57 0.01 -0.64 -4.41 113.70 108.27 3h0j s SER 1789Ca -0.06 -0.77 0.11 0.00 1.31 0.00 0.00 55.95 56.54 3h0j s SER 1789Cb 0.08 -2.06 0.75 0.00 0.21 0.00 0.00 66.02 65.00 3h0j s SER 1789CO 0.88 -0.32 1.87 0.45 0.41 0.00 0.00 173.24 176.53 3h0j h HIS 1790N 8.46 0.15 -3.59 2.43 3.86 -0.62 -3.41 115.15 122.42 3h0j h HIS 1790Ca -0.28 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 58.84 3h0j h HIS 1790Cb 1.13 -0.04 -0.12 0.00 1.06 0.00 0.00 27.41 29.44 3h0j h HIS 1790CO 0.60 0.38 -0.16 -0.51 0.86 0.00 0.00 177.93 179.09 3h0j s LEU 1791N -8.51 0.62 0.27 2.43 2.01 -1.14 -0.12 118.68 114.23 3h0j s LEU 1791Ca -0.04 -0.62 0.12 0.00 0.01 0.00 0.00 54.13 53.60 3h0j s LEU 1791Cb 0.15 1.61 -0.05 0.00 0.01 0.00 0.00 46.19 47.91 3h0j s LEU 1791CO 0.73 -0.92 -0.20 0.42 1.01 0.00 0.00 176.35 177.39 3h0j s THR 1792N -3.90 2.44 0.06 5.49 -4.23 -1.26 -0.87 115.64 113.37 3h0j s THR 1792Ca 0.11 -2.36 0.03 0.00 -1.18 0.00 0.00 61.69 58.28 3h0j s THR 1792Cb 0.02 -2.27 -0.03 0.00 1.34 0.00 0.00 72.50 71.56 3h0j s THR 1792CO -0.04 -0.38 -0.09 0.00 -0.54 0.00 0.00 174.62 173.57 3h0j s ALA 1793N -2.43 0.78 -0.09 3.99 0.00 0.01 -4.85 121.76 119.17 3h0j s ALA 1793Ca 0.29 -0.91 0.15 0.00 0.00 0.00 0.00 51.96 51.49 3h0j s ALA 1793Cb -0.05 0.03 0.15 0.00 0.00 0.00 0.00 23.12 23.24 3h0j s ALA 1793CO 0.14 -0.01 1.48 -0.39 0.00 0.00 0.00 175.76 176.98 3h0j h VAL 1794N 4.21 0.93 -2.88 0.00 -1.51 -1.93 0.45 116.25 115.51 3h0j h VAL 1794Ca -0.37 -2.20 0.06 0.00 -1.23 0.00 0.00 66.70 62.97 3h0j h VAL 1794Cb 1.20 2.38 -0.07 0.00 -2.13 0.00 0.00 31.29 32.66 3h0j h VAL 1794CO 0.44 0.51 0.27 1.51 -1.23 0.00 0.00 177.57 179.07 3h0j s ASP 1795N -6.47 -0.33 0.23 4.19 1.47 -1.26 -4.61 116.67 109.89 3h0j s ASP 1795Ca 0.03 -0.41 -0.08 0.00 1.18 0.00 0.00 52.55 53.27 3h0j s ASP 1795Cb 0.08 0.65 0.38 0.00 -0.34 0.00 0.00 42.92 43.70 3h0j s ASP 1795CO 0.74 -1.17 1.67 0.44 0.68 0.00 0.00 175.17 177.53 3h0j h ASP 1796N 2.00 -0.15 -0.49 2.11 3.32 -1.97 0.40 116.42 121.64 3h0j h ASP 1796Ca -0.23 0.15 0.05 0.00 0.02 0.00 0.00 57.03 57.02 3h0j h ASP 1796Cb 1.26 0.24 -0.05 0.00 0.22 0.00 0.00 39.33 41.01 3h0j h ASP 1796CO 0.27 -0.08 0.22 0.25 -1.72 0.00 0.00 179.24 178.18 3h0j h LEU 1797N 0.19 0.30 -0.43 1.55 6.46 -1.97 0.13 115.31 121.53 3h0j h LEU 1797Ca 0.37 0.04 0.08 0.00 -0.12 0.00 0.00 57.88 58.25 3h0j h LEU 1797Cb 0.62 -0.01 -0.07 0.00 -0.73 0.00 0.00 40.66 40.47 3h0j h LEU 1797CO -0.53 0.21 0.02 0.00 -0.62 0.00 0.00 178.44 177.52 3h0j h ALA 1798N 1.28 0.42 -0.12 1.25 0.00 -1.39 -1.14 119.26 119.57 3h0j h ALA 1798Ca 0.22 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.28 3h0j h ALA 1798Cb 0.16 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3h0j h ALA 1798CO -0.18 -0.38 -0.04 0.78 0.00 0.00 0.00 179.25 179.44 3h0j h GLY 1799N 0.13 0.07 1.25 0.00 0.00 0.33 -1.27 103.07 103.57 3h0j h GLY 1799Ca 0.22 0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.61 3h0j h GLY 1799CO -0.34 -0.06 0.50 -2.08 0.00 0.00 0.00 176.54 174.56 3h0j h VAL 1800N -0.02 1.18 -0.47 4.60 2.07 -0.49 -1.22 116.25 121.91 3h0j h VAL 1800Ca 0.06 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3h0j h VAL 1800Cb 0.11 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 3h0j h VAL 1800CO -0.13 0.18 0.20 -0.33 0.02 0.00 0.00 177.57 177.51 3h0j h GLU 1801N 1.01 0.69 -0.53 1.57 5.08 -0.80 -0.77 114.58 120.83 3h0j h GLU 1801Ca 0.28 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.58 3h0j h GLU 1801Cb -0.10 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 28.98 3h0j h GLU 1801CO -0.06 0.62 0.23 0.87 -1.00 0.00 0.00 179.01 179.66 3h0j h LYS 1802N 0.61 0.42 0.91 2.33 1.79 -0.19 0.23 116.57 122.68 3h0j h LYS 1802Ca 0.16 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.56 3h0j h LYS 1802Cb 0.18 -0.10 0.01 0.00 -1.58 0.00 0.00 32.23 30.74 3h0j h LYS 1802CO -0.01 0.28 -0.44 0.82 -1.08 0.00 0.00 179.45 179.02 3h0j h ILE 1803N 0.44 0.10 -1.01 1.86 2.04 -0.95 0.28 117.51 120.27 3h0j h ILE 1803Ca 0.25 -0.01 0.26 0.00 1.00 0.00 0.00 64.86 66.36 3h0j h ILE 1803Cb 0.24 0.10 -0.08 0.00 -0.74 0.00 0.00 36.82 36.33 3h0j h ILE 1803CO -0.22 0.00 0.67 0.58 0.00 0.00 0.00 178.15 179.17 3h0j h VAL 1804N -1.23 0.56 -0.08 1.67 2.07 -0.86 0.22 116.25 118.59 3h0j h VAL 1804Ca -0.13 -0.12 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 3h0j h VAL 1804Cb 0.94 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3h0j h VAL 1804CO 0.21 0.07 -0.41 -0.08 0.02 0.00 0.00 177.57 177.37 3h0j h GLU 1805N 0.36 0.41 -0.42 1.57 4.81 -0.14 -3.07 114.58 118.11 3h0j h GLU 1805Ca 0.56 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3h0j h GLU 1805Cb 1.48 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.91 3h0j h GLU 1805CO -0.24 0.98 0.26 2.35 -0.73 0.00 0.00 179.01 181.63 3h0j h TRP 1806N -0.05 0.54 -0.06 0.92 2.91 0.19 -2.86 115.95 117.55 3h0j h TRP 1806Ca -0.03 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.01 3h0j h TRP 1806Cb 1.06 -0.18 -0.00 0.00 -0.51 0.00 0.00 29.16 29.53 3h0j h TRP 1806CO 0.12 0.37 0.07 0.52 -1.03 0.00 0.00 178.44 178.50 3h0j h MET 1807N 0.56 0.00 0.00 2.65 2.86 -0.70 -2.66 114.93 117.63 3h0j h MET 1807Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3h0j h MET 1807Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3h0j h MET 1807CO -0.03 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 176.81 3h0j n SER 1808N -3.71 0.58 -0.24 1.22 3.41 -1.08 -0.77 113.62 113.03 3h0j n SER 1808Ca -0.02 0.72 0.11 0.00 -0.26 0.00 0.00 58.87 59.43 3h0j n SER 1808Cb 0.16 -0.81 0.09 0.00 -0.26 0.00 0.00 64.21 63.39 3h0j n SER 1808CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3h0j n TYR 1809N -2.23 0.00 -3.79 7.33 4.02 -1.00 -4.86 117.16 116.64 3h0j n TYR 1809Ca -0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 3h0j n TYR 1809Cb 0.11 -0.06 -0.06 0.00 -0.02 0.00 0.00 39.34 39.31 3h0j n TYR 1809CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3h0j s VAL 1810N -2.69 5.38 0.65 -0.72 1.01 0.05 -4.66 120.40 119.41 3h0j s VAL 1810Ca 0.16 0.34 -0.18 0.00 0.00 0.00 0.00 61.98 62.30 3h0j s VAL 1810Cb 0.18 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 3h0j s VAL 1810CO 0.66 0.58 1.13 -2.65 0.00 0.00 0.00 175.10 174.81 3h0j n PRO 1811N 1.84 0.92 -0.21 2.72 -0.02 -1.26 -4.70 135.00 134.29 3h0j n PRO 1811Ca -0.18 0.37 0.18 0.00 -2.02 0.00 0.00 63.50 61.85 3h0j n PRO 1811Cb 0.54 -2.36 0.52 0.00 -0.02 0.00 0.00 33.50 32.19 3h0j n PRO 1811CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h0j h ALA 1812N 0.36 2.20 -1.81 3.55 0.00 -1.90 -3.43 119.26 118.23 3h0j h ALA 1812Ca -0.50 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.44 3h0j h ALA 1812Cb 1.35 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.90 3h0j h ALA 1812CO 0.51 -0.45 0.38 -1.59 0.00 0.00 0.00 179.25 178.10 3h0j s LYS 1813N -5.40 0.82 -0.28 0.00 -2.85 -1.26 -4.57 119.74 106.20 3h0j s LYS 1813Ca -0.08 0.17 -0.29 0.00 -1.00 0.00 0.00 55.97 54.77 3h0j s LYS 1813Cb 0.22 0.39 -0.13 0.00 -2.06 0.00 0.00 37.83 36.25 3h0j s LYS 1813CO 0.78 -0.26 0.98 -2.13 0.10 0.00 0.00 175.35 174.81 3h0j n ARG 1814N 0.75 0.00 -0.69 1.78 0.63 -0.09 -1.15 116.66 117.89 3h0j n ARG 1814Ca -0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.79 3h0j n ARG 1814Cb 0.58 -0.95 0.00 0.00 0.45 0.00 0.00 32.46 32.54 3h0j n ARG 1814CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3h0j n ASN 1815N 2.35 0.00 -4.83 6.15 5.03 -1.26 -5.01 115.26 117.69 3h0j n ASN 1815Ca 0.19 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.33 3h0j n ASN 1815Cb -0.03 0.00 0.05 0.00 -1.02 0.00 0.00 39.78 38.78 3h0j n ASN 1815CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3h0j s MET 1816N -0.06 2.85 0.68 3.52 -1.94 -0.30 -4.99 119.30 119.06 3h0j s MET 1816Ca 0.00 0.78 -0.16 0.00 -1.71 0.00 0.00 55.69 54.59 3h0j s MET 1816Cb 0.00 -1.99 0.01 0.00 2.01 0.00 0.00 34.83 34.86 3h0j s MET 1816CO 0.00 -1.12 1.21 -2.14 -0.01 0.00 0.00 175.02 172.96 3h0j s PRO 1817N -5.14 2.42 0.56 2.03 0.02 -1.26 -4.85 135.00 128.78 3h0j s PRO 1817Ca 0.58 1.78 -0.21 0.00 0.02 0.00 0.00 61.00 63.18 3h0j s PRO 1817Cb -0.13 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.47 3h0j s PRO 1817CO 0.54 -1.62 1.21 1.33 -0.33 0.00 0.00 177.00 178.13 3h0j n VAL 1818N -2.35 3.74 -2.50 3.83 0.24 -1.26 -4.69 118.33 115.33 3h0j n VAL 1818Ca 0.14 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.52 3h0j n VAL 1818Cb 0.50 -1.46 -0.03 0.00 -1.47 0.00 0.00 33.84 31.39 3h0j n VAL 1818CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3h0j s PRO 1819N -2.79 3.30 0.57 7.34 0.04 -1.26 -4.97 135.00 137.22 3h0j s PRO 1819Ca 0.73 0.11 -0.18 0.00 0.04 0.00 0.00 61.00 61.70 3h0j s PRO 1819Cb -0.43 -4.12 -0.05 0.00 0.04 0.00 0.00 34.50 29.94 3h0j s PRO 1819CO 0.49 -1.97 1.08 0.42 0.04 0.00 0.00 177.00 177.06 3h0j s ILE 1820N 5.69 3.54 -0.45 0.56 -1.09 -1.26 -4.39 121.20 123.79 3h0j s ILE 1820Ca 0.43 0.84 0.06 0.00 -2.23 0.00 0.00 60.65 59.75 3h0j s ILE 1820Cb -0.09 -3.32 0.18 0.00 -1.58 0.00 0.00 42.46 37.65 3h0j s ILE 1820CO 0.21 -0.33 0.60 -0.22 -1.23 0.00 0.00 174.94 173.97 3h0j s LEU 1821N -4.14 -0.91 0.25 2.97 2.96 -0.88 -4.75 118.68 114.18 3h0j s LEU 1821Ca 0.67 -1.59 -0.30 0.00 -0.22 0.00 0.00 54.13 52.70 3h0j s LEU 1821Cb -0.19 1.42 -0.10 0.00 0.50 0.00 0.00 46.19 47.83 3h0j s LEU 1821CO 0.31 -0.13 1.32 -0.70 -1.32 0.00 0.00 176.35 175.82 3h0j s GLU 1822N 1.16 4.38 0.27 1.98 2.56 -1.26 -4.29 118.70 123.49 3h0j s GLU 1822Ca 0.24 2.13 0.03 0.00 0.00 0.00 0.00 54.97 57.37 3h0j s GLU 1822Cb -0.03 -3.14 -0.06 0.00 2.00 0.00 0.00 34.13 32.90 3h0j s GLU 1822CO -0.07 -0.23 0.05 0.95 -0.56 0.00 0.00 175.26 175.41 3h0j s THR 1823N -0.38 0.90 0.06 -1.70 -4.23 -1.26 -5.01 115.64 104.01 3h0j s THR 1823Ca 0.54 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 59.01 3h0j s THR 1823Cb -0.38 -2.59 0.09 0.00 1.34 0.00 0.00 72.50 70.96 3h0j s THR 1823CO 0.44 -0.11 0.40 2.29 -0.54 0.00 0.00 174.62 177.10 3h0j n LYS 1824N -0.51 -0.04 -2.08 3.99 2.85 -1.26 -3.74 118.16 117.36 3h0j n LYS 1824Ca -0.02 0.39 -0.30 0.00 -1.05 0.00 0.00 58.31 57.33 3h0j n LYS 1824Cb 0.66 -0.59 -0.05 0.00 -0.65 0.00 0.00 35.03 34.40 3h0j n LYS 1824CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 3h0j s ASP 1825N -5.08 5.26 0.69 -5.58 3.68 -1.26 -4.98 116.67 109.40 3h0j s ASP 1825Ca -0.04 -0.55 -0.11 0.00 2.13 0.00 0.00 52.55 53.98 3h0j s ASP 1825Cb 0.06 -2.56 0.01 0.00 -1.45 0.00 0.00 42.92 38.98 3h0j s ASP 1825CO 0.19 -2.60 1.07 0.42 0.13 0.00 0.00 175.17 174.38 3h0j s THR 1826N 9.56 3.92 0.27 1.71 -4.23 -1.25 -4.65 115.64 120.97 3h0j s THR 1826Ca 0.68 0.62 -0.02 0.00 -1.18 0.00 0.00 61.69 61.79 3h0j s THR 1826Cb -0.07 -3.51 0.27 0.00 1.34 0.00 0.00 72.50 70.53 3h0j s THR 1826CO 0.02 -0.81 1.91 4.11 -0.54 0.00 0.00 174.62 179.31 3h0j h TRP 1827N -0.65 1.17 -0.73 3.99 5.08 -1.93 -3.39 115.95 119.48 3h0j h TRP 1827Ca -0.45 0.03 -0.45 0.00 1.08 0.00 0.00 58.89 59.10 3h0j h TRP 1827Cb 1.23 -0.39 -0.06 0.00 -3.00 0.00 0.00 29.16 26.94 3h0j h TRP 1827CO 0.57 0.65 1.33 0.34 -1.28 0.00 0.00 178.44 180.05 3h0j s ASP 1828N -6.01 5.74 -0.21 0.11 3.68 -1.26 -4.31 116.67 114.41 3h0j s ASP 1828Ca -0.12 -1.57 -0.29 0.00 2.13 0.00 0.00 52.55 52.70 3h0j s ASP 1828Cb 0.19 -2.58 0.14 0.00 -1.45 0.00 0.00 42.92 39.23 3h0j s ASP 1828CO 0.81 -2.27 1.10 0.00 0.13 0.00 0.00 175.17 174.94 3h0j s ARG 1829N 5.81 0.44 0.80 4.34 1.70 -1.26 -5.12 118.95 125.66 3h0j s ARG 1829Ca 0.61 0.19 -0.11 0.00 -0.47 0.00 0.00 55.73 55.95 3h0j s ARG 1829Cb -0.01 0.21 0.07 0.00 -0.57 0.00 0.00 34.95 34.65 3h0j s ARG 1829CO 0.04 -0.12 1.09 -1.25 -1.08 0.00 0.00 175.30 173.98 3h0j s PRO 1830N -0.80 2.04 -0.25 3.89 0.04 -1.26 -4.53 135.00 134.12 3h0j s PRO 1830Ca 0.02 0.74 -0.20 0.00 0.04 0.00 0.00 61.00 61.60 3h0j s PRO 1830Cb -0.02 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 3h0j s PRO 1830CO -0.03 -1.68 0.62 0.08 0.04 0.00 0.00 177.00 176.03 3h0j s VAL 1831N -3.08 5.00 -0.01 -0.36 1.01 -0.84 -4.91 120.40 117.21 3h0j s VAL 1831Ca 0.61 1.11 -0.01 0.00 0.00 0.00 0.00 61.98 63.69 3h0j s VAL 1831Cb -0.15 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 3h0j s VAL 1831CO 0.55 0.04 0.21 0.44 0.00 0.00 0.00 175.10 176.34 3h0j h ASP 1832N 7.87 -0.02 -2.88 3.32 3.45 -1.32 -3.43 116.42 123.41 3h0j h ASP 1832Ca -0.27 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.60 3h0j h ASP 1832Cb 1.13 0.00 0.12 0.00 -0.56 0.00 0.00 39.33 40.02 3h0j h ASP 1832CO 0.77 0.02 0.26 0.33 -1.57 0.00 0.00 179.24 179.04 3h0j n PHE 1833N -2.23 1.57 -3.82 4.55 7.35 -1.10 -4.96 117.46 118.81 3h0j n PHE 1833Ca -0.00 0.62 -0.13 0.00 -0.76 0.00 0.00 57.45 57.18 3h0j n PHE 1833Cb 0.01 -2.30 -0.13 0.00 0.35 0.00 0.00 39.48 37.41 3h0j n PHE 1833CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 3h0j s THR 1834N -1.13 -0.01 0.41 -2.13 2.01 -1.26 -4.95 115.64 108.59 3h0j s THR 1834Ca 0.59 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 62.44 3h0j s THR 1834Cb -0.62 -0.18 -0.09 0.00 0.01 0.00 0.00 72.50 71.61 3h0j s THR 1834CO 0.60 0.01 0.88 -2.16 -0.69 0.00 0.00 174.62 173.26 3h0j s PRO 1835N 0.23 4.07 0.00 4.92 0.04 -1.26 -5.06 135.00 137.93 3h0j s PRO 1835Ca -0.01 0.90 0.05 0.00 0.04 0.00 0.00 61.00 61.98 3h0j s PRO 1835Cb -0.02 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 3h0j s PRO 1835CO -0.01 -0.03 -0.15 0.99 0.04 0.00 0.00 177.00 177.84 3h0j s THR 1836N -2.23 2.99 0.66 1.26 2.01 -1.26 -4.88 115.64 114.18 3h0j s THR 1836Ca 0.58 -0.96 0.45 0.00 0.31 0.00 0.00 61.69 62.07 3h0j s THR 1836Cb -0.10 -2.23 0.45 0.00 0.01 0.00 0.00 72.50 70.64 3h0j s THR 1836CO 0.20 0.45 2.37 0.78 -0.69 0.00 0.00 174.62 177.72 3h0j h ASN 1837N 4.86 0.00 -2.69 3.53 2.35 -1.96 -3.23 115.58 118.43 3h0j h ASN 1837Ca -0.47 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 54.68 3h0j h ASN 1837Cb 1.15 0.00 -0.39 0.00 0.05 0.00 0.00 38.32 39.13 3h0j h ASN 1837CO 0.49 0.00 -0.84 1.51 -1.65 0.00 0.00 177.43 176.94 3h0j s ASP 1838N -5.17 2.62 0.00 5.81 3.84 -1.26 -4.95 116.67 117.55 3h0j s ASP 1838Ca -0.05 -3.10 0.00 0.00 -0.00 0.00 0.00 52.55 49.41 3h0j s ASP 1838Cb 0.13 -0.77 0.00 0.00 -1.38 0.00 0.00 42.92 40.90 3h0j s ASP 1838CO 0.41 -0.18 0.00 1.21 -0.00 0.00 0.00 175.17 176.62 3h0j n GLU 1839N 2.86 0.00 -1.75 2.11 0.00 -1.22 -5.13 120.64 117.51 3h0j n GLU 1839Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.97 3h0j n GLU 1839Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.83 3h0j n GLU 1839CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3h0j s THR 1840N 0.00 2.09 0.38 6.31 -4.23 -1.26 -4.35 115.64 114.58 3h0j s THR 1840Ca 0.00 0.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.58 3h0j s THR 1840Cb 0.00 -3.04 -0.00 0.00 1.34 0.00 0.00 72.50 70.80 3h0j s THR 1840CO 0.00 0.01 0.01 0.00 -0.54 0.00 0.00 174.62 174.10 3h0j n TYR 1841N 3.88 0.81 -4.01 3.99 0.18 -1.26 -5.08 117.16 115.67 3h0j n TYR 1841Ca 0.15 -1.90 -0.34 0.00 1.88 0.00 0.00 57.90 57.70 3h0j n TYR 1841Cb 0.36 -0.23 -0.15 0.00 -0.38 0.00 0.00 39.34 38.94 3h0j n TYR 1841CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 3h0j s ASP 1842N -3.08 4.06 0.51 9.48 -1.08 -1.26 -4.59 116.67 120.70 3h0j s ASP 1842Ca 0.02 -0.89 0.36 0.00 -0.52 0.00 0.00 52.55 51.51 3h0j s ASP 1842Cb 0.00 -1.60 1.51 0.00 -1.46 0.00 0.00 42.92 41.37 3h0j s ASP 1842CO 0.01 -0.10 1.72 0.58 0.52 0.00 0.00 175.17 177.90 3h0j h VAL 1843N 6.18 0.29 -0.65 1.11 2.07 -1.99 0.72 116.25 123.98 3h0j h VAL 1843Ca -0.34 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.24 3h0j h VAL 1843Cb 1.11 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3h0j h VAL 1843CO 0.57 0.01 0.43 0.03 0.02 0.00 0.00 177.57 178.63 3h0j h ARG 1844N 0.07 0.54 -0.74 1.57 3.08 -1.93 -0.01 114.38 116.95 3h0j h ARG 1844Ca 0.70 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.69 3h0j h ARG 1844Cb 2.56 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 32.45 3h0j h ARG 1844CO -0.11 0.36 0.35 -1.49 -1.07 0.00 0.00 179.97 178.00 3h0j h TRP 1845N 0.55 1.07 0.00 3.04 6.55 0.32 0.10 115.95 127.59 3h0j h TRP 1845Ca 0.29 -0.05 -0.05 0.00 0.95 0.00 0.00 58.89 60.03 3h0j h TRP 1845Cb 0.42 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 28.38 3h0j h TRP 1845CO -0.00 0.79 -0.22 0.52 -1.05 0.00 0.00 178.44 178.48 3h0j h MET 1846N 1.04 0.00 0.00 0.49 2.86 -1.08 -0.78 114.93 117.46 3h0j h MET 1846Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 3h0j h MET 1846Cb 0.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.78 3h0j h MET 1846CO -0.03 0.22 -0.31 0.82 1.06 0.00 0.00 176.91 178.66 3h0j h ILE 1847N 0.00 0.00 -0.08 -1.22 2.04 -0.44 -0.94 117.51 116.87 3h0j h ILE 1847Ca -0.00 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3h0j h ILE 1847Cb 0.48 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3h0j h ILE 1847CO 0.03 0.00 0.00 -1.84 0.00 0.00 0.00 178.15 176.34 3h0j n GLU 1848N -4.67 2.28 0.00 2.37 0.28 0.27 -1.15 120.64 120.02 3h0j n GLU 1848Ca -0.04 -1.87 0.00 0.00 -0.16 0.00 0.00 57.16 55.09 3h0j n GLU 1848Cb 0.16 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.56 3h0j n GLU 1848CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3h0j n GLY 1849N 1.35 -2.45 3.20 -1.84 0.00 -0.30 -4.24 105.19 100.91 3h0j n GLY 1849Ca 0.15 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.00 3h0j n GLY 1849CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h0j s ARG 1850N -0.29 0.40 -0.13 1.61 3.52 0.11 -4.07 118.95 120.09 3h0j s ARG 1850Ca 0.00 0.34 -0.22 0.00 -0.13 0.00 0.00 55.73 55.72 3h0j s ARG 1850Cb 0.00 0.19 -0.03 0.00 -1.56 0.00 0.00 34.95 33.55 3h0j s ARG 1850CO 0.00 -0.06 0.65 -2.00 -0.81 0.00 0.00 175.30 173.08 3h0j s GLU 1851N -0.05 4.32 0.11 5.12 2.56 -1.26 -0.85 118.70 128.66 3h0j s GLU 1851Ca -0.02 0.72 0.04 0.00 0.00 0.00 0.00 54.97 55.72 3h0j s GLU 1851Cb -0.03 -3.51 -0.04 0.00 2.00 0.00 0.00 34.13 32.56 3h0j s GLU 1851CO 0.01 -0.07 -0.11 -0.08 -0.56 0.00 0.00 175.26 174.44 3h0j s THR 1852N 1.32 1.05 0.25 -1.70 -1.32 -0.10 -4.95 115.64 110.20 3h0j s THR 1852Ca 0.32 -1.70 -0.08 0.00 -1.21 0.00 0.00 61.69 59.03 3h0j s THR 1852Cb -0.16 -1.44 0.30 0.00 -1.51 0.00 0.00 72.50 69.68 3h0j s THR 1852CO 0.13 -0.54 1.62 -0.33 -2.21 0.00 0.00 174.62 173.29 3h0j h GLU 1853N 3.48 0.05 -1.00 7.08 4.39 -2.04 -1.87 114.58 124.68 3h0j h GLU 1853Ca -0.38 -0.00 -0.68 0.00 0.34 0.00 0.00 59.36 58.64 3h0j h GLU 1853Cb 1.19 -0.01 -0.29 0.00 -0.10 0.00 0.00 28.75 29.54 3h0j h GLU 1853CO 0.53 0.04 0.85 -1.13 -1.16 0.00 0.00 179.01 178.14 3h0j n SER 1854N -5.42 7.67 0.00 1.42 3.41 -1.26 -5.02 113.62 114.42 3h0j n SER 1854Ca 0.13 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 54.95 3h0j n SER 1854Cb 0.47 -0.97 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 3h0j n SER 1854CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0j n GLY 1855N -0.92 0.59 3.32 5.00 0.00 -0.70 -5.02 105.19 107.46 3h0j n GLY 1855Ca 0.63 -2.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.02 3h0j n GLY 1855CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h0j s PHE 1856N -0.60 2.96 -0.39 1.61 5.36 -1.26 -0.92 117.98 124.74 3h0j s PHE 1856Ca 0.00 -0.89 -0.24 0.00 -0.96 0.00 0.00 56.93 54.84 3h0j s PHE 1856Cb 0.00 -2.10 0.01 0.00 -0.34 0.00 0.00 43.02 40.59 3h0j s PHE 1856CO 0.00 -0.52 0.84 -1.21 -1.46 0.00 0.00 175.22 172.87 3h0j s GLU 1857N 1.44 3.71 0.30 10.12 2.02 -0.03 -4.93 118.70 131.33 3h0j s GLU 1857Ca 0.05 0.31 -0.29 0.00 0.02 0.00 0.00 54.97 55.06 3h0j s GLU 1857Cb -0.14 -3.84 -0.10 0.00 0.10 0.00 0.00 34.13 30.15 3h0j s GLU 1857CO -0.03 -0.95 1.21 0.71 0.02 0.00 0.00 175.26 176.22 3h0j s TYR 1858N 3.30 3.29 0.00 1.61 1.51 -1.26 0.05 117.35 125.86 3h0j s TYR 1858Ca 0.34 1.54 0.00 0.00 -1.01 0.00 0.00 57.07 57.93 3h0j s TYR 1858Cb -0.12 -3.50 0.00 0.00 -0.11 0.00 0.00 41.96 38.23 3h0j s TYR 1858CO 0.19 -1.27 0.00 0.41 -1.11 0.00 0.00 175.55 173.78 3h0j n GLY 1859N 1.02 1.36 0.16 0.71 0.00 -1.26 -0.98 105.19 106.20 3h0j n GLY 1859Ca -0.00 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.03 3h0j n GLY 1859CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h0j h LEU 1860N 0.00 0.60 -9.82 0.99 5.85 -1.11 -3.43 115.31 108.39 3h0j h LEU 1860Ca 0.00 -0.51 -0.53 0.00 0.84 0.00 0.00 57.88 57.69 3h0j h LEU 1860Cb 0.00 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 3h0j h LEU 1860CO 0.00 1.32 -0.54 -0.36 -0.34 0.00 0.00 178.44 178.51 3h0j s PHE 1861N -3.18 2.87 0.04 1.25 0.40 -0.30 -4.74 117.98 114.33 3h0j s PHE 1861Ca -0.06 -0.24 -0.36 0.00 -0.60 0.00 0.00 56.93 55.67 3h0j s PHE 1861Cb 0.08 -1.48 -0.19 0.00 0.51 0.00 0.00 43.02 41.94 3h0j s PHE 1861CO 0.88 0.44 0.92 -0.25 0.70 0.00 0.00 175.22 177.91 3h0j n ASP 1862N -1.14 -0.28 -4.68 1.36 8.00 0.28 -4.69 116.55 115.39 3h0j n ASP 1862Ca -0.05 1.12 -0.45 0.00 0.71 0.00 0.00 54.79 56.12 3h0j n ASP 1862Cb 0.59 -0.90 -0.03 0.00 -0.02 0.00 0.00 41.12 40.76 3h0j n ASP 1862CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3h0j n LYS 1863N 1.35 2.21 -1.92 -1.24 4.81 -1.26 -1.85 118.16 120.26 3h0j n LYS 1863Ca 0.19 0.79 -0.17 0.00 -0.87 0.00 0.00 58.31 58.26 3h0j n LYS 1863Cb 0.11 -2.53 -0.04 0.00 0.02 0.00 0.00 35.03 32.59 3h0j n LYS 1863CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h0j n GLY 1864N 2.92 0.65 0.00 3.14 0.00 -1.26 -4.89 105.19 105.76 3h0j n GLY 1864Ca 0.14 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 46.06 3h0j n GLY 1864CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h0j n SER 1865N -0.98 0.77 -4.65 1.61 3.41 -0.77 -4.94 113.62 108.07 3h0j n SER 1865Ca -0.19 -0.50 -0.43 0.00 -0.26 0.00 0.00 58.87 57.50 3h0j n SER 1865Cb 0.60 1.40 -0.03 0.00 -0.26 0.00 0.00 64.21 65.93 3h0j n SER 1865CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3h0j s PHE 1866N -3.01 2.12 -0.64 7.33 5.99 -1.26 -4.01 117.98 124.50 3h0j s PHE 1866Ca 0.00 0.43 -0.03 0.00 0.00 0.00 0.00 56.93 57.33 3h0j s PHE 1866Cb 0.13 -3.89 0.16 0.00 0.00 0.00 0.00 43.02 39.43 3h0j s PHE 1866CO 0.77 -3.26 0.46 0.12 -0.00 0.00 0.00 175.22 173.31 3h0j s PHE 1867N 4.47 3.42 0.34 10.12 5.36 0.17 -4.95 117.98 136.90 3h0j s PHE 1867Ca 0.71 -2.70 -0.27 0.00 -0.96 0.00 0.00 56.93 53.70 3h0j s PHE 1867Cb -0.29 -3.22 -0.09 0.00 -0.34 0.00 0.00 43.02 39.08 3h0j s PHE 1867CO 0.28 -0.84 1.11 -2.00 -1.46 0.00 0.00 175.22 172.31 3h0j s GLU 1868N -0.09 4.38 0.19 10.12 2.12 -1.26 -1.03 118.70 133.12 3h0j s GLU 1868Ca 0.17 1.76 0.03 0.00 0.36 0.00 0.00 54.97 57.29 3h0j s GLU 1868Cb -0.20 -2.91 -0.05 0.00 0.26 0.00 0.00 34.13 31.24 3h0j s GLU 1868CO -0.04 -0.02 -0.01 0.95 -0.54 0.00 0.00 175.26 175.61 3h0j s THR 1869N -1.34 0.84 -1.40 -1.70 -4.23 0.15 -4.78 115.64 103.18 3h0j s THR 1869Ca 0.51 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 3h0j s THR 1869Cb -0.30 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.39 3h0j s THR 1869CO 0.38 -0.47 0.00 0.18 -0.54 0.00 0.00 174.62 174.17 3h0j n LEU 1870N -0.29 -1.47 0.00 4.79 4.77 0.83 -4.34 117.00 121.29 3h0j n LEU 1870Ca -0.07 0.13 0.05 0.00 -0.03 0.00 0.00 56.01 56.09 3h0j n LEU 1870Cb 0.63 -2.48 0.22 0.00 -2.33 0.00 0.00 43.42 39.46 3h0j n LEU 1870CO 0.34 -0.23 0.66 -1.54 -1.33 0.00 0.00 177.39 175.30 3h0j n SER 1871N -1.80 0.00 -1.24 -1.43 3.41 -1.25 -2.50 113.62 108.81 3h0j n SER 1871Ca -0.19 0.50 0.11 0.00 -0.26 0.00 0.00 58.87 59.03 3h0j n SER 1871Cb 0.63 -0.50 0.29 0.00 -0.26 0.00 0.00 64.21 64.37 3h0j n SER 1871CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0j n GLY 1872N -0.44 2.38 3.02 5.00 0.00 -1.25 -4.89 105.19 109.00 3h0j n GLY 1872Ca 0.02 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 3h0j n GLY 1872CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h0j s TRP 1873N -1.08 0.48 -0.84 1.61 -0.00 -1.04 -3.87 118.94 114.20 3h0j s TRP 1873Ca 0.44 -0.45 -0.09 0.00 -0.00 0.00 0.00 56.10 56.01 3h0j s TRP 1873Cb 0.24 -0.30 0.01 0.00 -0.00 0.00 0.00 33.47 33.41 3h0j s TRP 1873CO 0.31 -0.11 0.56 0.00 -0.00 0.00 0.00 176.95 177.71 3h0j n ALA 1874N 1.71 -2.58 1.18 5.86 0.00 -1.26 -4.78 120.51 120.63 3h0j n ALA 1874Ca -0.22 -0.33 0.06 0.00 0.00 0.00 0.00 53.44 52.95 3h0j n ALA 1874Cb 0.55 -1.07 0.38 0.00 0.00 0.00 0.00 19.45 19.31 3h0j n ALA 1874CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3h0j n LYS 1875N -3.05 0.59 0.20 0.00 5.02 -1.26 -3.08 118.16 116.59 3h0j n LYS 1875Ca -0.24 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.11 3h0j n LYS 1875Cb 0.59 -1.34 0.42 0.00 -0.02 0.00 0.00 35.03 34.68 3h0j n LYS 1875CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3h0j h GLY 1876N 3.14 0.00 -4.63 0.72 0.00 -1.90 -3.43 103.07 96.97 3h0j h GLY 1876Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 3h0j h GLY 1876CO 0.00 0.00 -0.80 0.54 0.00 0.00 0.00 176.54 176.28 3h0j s VAL 1877N -3.89 2.83 -0.22 4.60 0.11 -1.18 -0.46 120.40 122.19 3h0j s VAL 1877Ca -0.01 -1.01 -0.04 0.00 -2.93 0.00 0.00 61.98 57.98 3h0j s VAL 1877Cb 0.12 -2.15 -0.01 0.00 -1.53 0.00 0.00 36.38 32.82 3h0j s VAL 1877CO 0.68 0.45 -0.03 -0.69 -3.33 0.00 0.00 175.10 172.17 3h0j s VAL 1878N -0.83 3.45 -0.05 2.04 1.01 0.13 -4.88 120.40 121.28 3h0j s VAL 1878Ca 0.13 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.69 3h0j s VAL 1878Cb -0.10 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 3h0j s VAL 1878CO 0.03 0.42 -0.17 -0.69 0.00 0.00 0.00 175.10 174.69 3h0j s VAL 1879N 1.46 2.80 0.00 2.92 1.01 -1.26 -0.92 120.40 126.42 3h0j s VAL 1879Ca 0.06 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.21 3h0j s VAL 1879Cb -0.14 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.16 3h0j s VAL 1879CO -0.03 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3h0j n GLY 1880N 2.40 0.55 3.95 4.51 0.00 -0.91 0.33 105.19 116.01 3h0j n GLY 1880Ca -0.17 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.79 3h0j n GLY 1880CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h0j s ARG 1881N -2.00 3.32 0.13 1.61 1.81 -0.20 0.19 118.95 123.82 3h0j s ARG 1881Ca 0.00 -0.41 -0.25 0.00 -1.72 0.00 0.00 55.73 53.35 3h0j s ARG 1881Cb 0.00 -2.63 0.08 0.00 -0.45 0.00 0.00 34.95 31.95 3h0j s ARG 1881CO 0.00 -0.01 1.04 0.00 -0.68 0.00 0.00 175.30 175.64 3h0j s ALA 1882N -2.41 -1.74 0.12 2.13 0.00 -0.63 0.43 121.76 119.66 3h0j s ALA 1882Ca 0.43 0.08 0.10 0.00 0.00 0.00 0.00 51.96 52.57 3h0j s ALA 1882Cb -0.10 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 3h0j s ALA 1882CO 0.37 -1.05 -0.25 1.03 0.00 0.00 0.00 175.76 175.85 3h0j s ARG 1883N -2.83 1.34 -0.36 0.00 0.52 -1.26 -0.70 118.95 115.65 3h0j s ARG 1883Ca 0.15 -1.28 0.01 0.00 -0.52 0.00 0.00 55.73 54.09 3h0j s ARG 1883Cb -0.01 -1.76 0.12 0.00 0.52 0.00 0.00 34.95 33.82 3h0j s ARG 1883CO 0.02 0.42 0.15 -1.17 0.02 0.00 0.00 175.30 174.74 3h0j s LEU 1884N -1.97 2.47 -0.83 2.53 0.20 0.41 -0.56 118.68 120.93 3h0j s LEU 1884Ca 0.12 -2.07 0.00 0.00 0.69 0.00 0.00 54.13 52.87 3h0j s LEU 1884Cb -0.10 -0.94 0.00 0.00 -0.43 0.00 0.00 46.19 44.72 3h0j s LEU 1884CO 0.05 -0.35 0.00 0.61 -0.29 0.00 0.00 176.35 176.37 3h0j n GLY 1885N 4.28 0.96 0.00 7.98 0.00 -1.26 -2.49 105.19 114.66 3h0j n GLY 1885Ca 0.03 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3h0j n GLY 1885CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0j n GLY 1886N -1.99 3.00 3.68 -0.02 0.00 -1.26 -4.62 105.19 103.98 3h0j n GLY 1886Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 3h0j n GLY 1886CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h0j s ILE 1887N -2.88 3.51 0.31 -0.61 1.01 -1.04 -2.08 121.20 119.41 3h0j s ILE 1887Ca 0.00 0.88 -0.27 0.00 0.00 0.00 0.00 60.65 61.26 3h0j s ILE 1887Cb 0.00 -3.57 -0.09 0.00 0.01 0.00 0.00 42.46 38.81 3h0j s ILE 1887CO 0.00 -0.01 1.00 -2.16 0.00 0.00 0.00 174.94 173.77 3h0j s PRO 1888N 2.67 4.58 0.10 2.79 0.04 -1.26 -0.44 135.00 143.47 3h0j s PRO 1888Ca 0.68 1.51 -0.21 0.00 0.04 0.00 0.00 61.00 63.01 3h0j s PRO 1888Cb -0.34 -2.95 0.05 0.00 0.04 0.00 0.00 34.50 31.30 3h0j s PRO 1888CO 0.28 0.24 0.51 -0.48 0.04 0.00 0.00 177.00 177.60 3h0j s LEU 1889N -1.82 -0.10 0.26 -3.56 2.34 0.12 -4.56 118.68 111.36 3h0j s LEU 1889Ca 0.48 0.01 -0.21 0.00 0.06 0.00 0.00 54.13 54.47 3h0j s LEU 1889Cb -0.24 2.19 -0.09 0.00 -0.56 0.00 0.00 46.19 47.49 3h0j s LEU 1889CO 0.30 -0.82 0.79 -0.83 -1.06 0.00 0.00 176.35 174.74 3h0j s GLY 1890N -2.38 2.65 -0.01 -3.48 0.00 -0.17 -1.61 107.32 102.32 3h0j s GLY 1890Ca -0.02 0.27 0.03 0.00 0.00 0.00 0.00 44.72 45.01 3h0j s GLY 1890CO -0.07 0.64 -0.11 0.14 0.00 0.00 0.00 173.10 173.70 3h0j s VAL 1891N -1.58 0.88 -0.12 1.40 1.01 0.13 -1.09 120.40 121.03 3h0j s VAL 1891Ca 0.46 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 3h0j s VAL 1891Cb -0.17 -0.74 0.03 0.00 0.00 0.00 0.00 36.38 35.51 3h0j s VAL 1891CO 0.21 0.25 -0.02 -0.63 0.00 0.00 0.00 175.10 174.92 3h0j s ILE 1892N -0.25 0.65 0.29 2.22 1.01 -0.30 -2.13 121.20 122.69 3h0j s ILE 1892Ca 0.04 -0.20 0.10 0.00 0.00 0.00 0.00 60.65 60.59 3h0j s ILE 1892Cb -0.04 -0.84 -0.06 0.00 0.01 0.00 0.00 42.46 41.53 3h0j s ILE 1892CO -0.00 0.18 -0.14 -0.83 0.00 0.00 0.00 174.94 174.15 3h0j s GLY 1893N 1.85 1.90 -0.14 6.18 0.00 -0.09 -0.74 107.32 116.27 3h0j s GLY 1893Ca 0.03 -1.92 -0.07 0.00 0.00 0.00 0.00 44.72 42.77 3h0j s GLY 1893CO -0.07 -1.94 0.11 0.14 0.00 0.00 0.00 173.10 171.35 3h0j s VAL 1894N -2.69 5.25 -0.53 1.40 1.01 -1.26 0.19 120.40 123.77 3h0j s VAL 1894Ca 0.30 0.12 -0.24 0.00 0.00 0.00 0.00 61.98 62.16 3h0j s VAL 1894Cb -0.01 -3.32 0.04 0.00 0.00 0.00 0.00 36.38 33.10 3h0j s VAL 1894CO 0.14 0.55 0.91 -0.70 0.00 0.00 0.00 175.10 176.00 3h0j s GLU 1895N -0.50 3.34 0.35 2.72 2.56 0.39 -4.60 118.70 122.97 3h0j s GLU 1895Ca 0.12 -0.25 0.10 0.00 0.00 0.00 0.00 54.97 54.93 3h0j s GLU 1895Cb -0.12 -4.03 0.66 0.00 2.00 0.00 0.00 34.13 32.64 3h0j s GLU 1895CO 0.02 -1.41 1.82 1.79 -0.56 0.00 0.00 175.26 176.92 3h0j h THR 1896N 6.01 1.25 -4.06 -1.70 1.35 -1.85 -3.25 112.91 110.66 3h0j h THR 1896Ca -0.26 -1.17 -0.47 0.00 -0.55 0.00 0.00 66.41 63.97 3h0j h THR 1896Cb 1.08 1.51 0.02 0.00 -1.73 0.00 0.00 68.15 69.03 3h0j h THR 1896CO 1.06 0.35 0.38 -0.13 -0.25 0.00 0.00 175.52 176.93 3h0j s ARG 1897N -4.38 3.87 0.30 4.72 0.52 -1.26 -4.11 118.95 118.62 3h0j s ARG 1897Ca -0.04 1.36 -0.29 0.00 -0.52 0.00 0.00 55.73 56.23 3h0j s ARG 1897Cb 0.14 -2.15 -0.10 0.00 0.52 0.00 0.00 34.95 33.37 3h0j s ARG 1897CO 0.74 -0.37 1.22 0.99 0.02 0.00 0.00 175.30 177.91 3h0j s THR 1898N -1.96 3.05 -0.09 0.02 2.01 -1.26 -4.13 115.64 113.27 3h0j s THR 1898Ca 0.66 1.05 -0.12 0.00 0.31 0.00 0.00 61.69 63.59 3h0j s THR 1898Cb -0.16 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.63 3h0j s THR 1898CO 0.20 0.25 0.28 -0.69 -0.69 0.00 0.00 174.62 173.97 3h0j s VAL 1899N -1.09 5.28 -1.05 3.82 1.01 -0.33 -4.91 120.40 123.13 3h0j s VAL 1899Ca 0.47 0.53 -0.04 0.00 0.00 0.00 0.00 61.98 62.94 3h0j s VAL 1899Cb -0.36 -3.58 0.29 0.00 0.00 0.00 0.00 36.38 32.73 3h0j s VAL 1899CO 0.47 0.53 1.30 -0.62 0.00 0.00 0.00 175.10 176.79 3h0j n GLU 1900N 2.42 4.02 -2.37 2.72 -0.58 -1.26 -1.14 120.64 124.44 3h0j n GLU 1900Ca -0.15 -4.54 -0.42 0.00 -0.42 0.00 0.00 57.16 51.63 3h0j n GLU 1900Cb 0.53 -2.50 -0.02 0.00 -0.57 0.00 0.00 31.44 28.88 3h0j n GLU 1900CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 3h0j s ASN 1901N -0.98 6.18 -0.45 1.62 2.47 -0.50 -4.88 114.94 118.40 3h0j s ASN 1901Ca 0.31 0.47 -0.17 0.00 0.42 0.00 0.00 52.86 53.90 3h0j s ASN 1901Cb 0.01 -2.54 0.04 0.00 -1.45 0.00 0.00 41.25 37.31 3h0j s ASN 1901CO 0.04 -1.63 0.43 -0.22 -3.72 0.00 0.00 177.10 172.01 3h0j s LEU 1902N 5.90 5.13 -0.14 3.21 2.96 -1.26 0.53 118.68 135.00 3h0j s LEU 1902Ca 0.56 -0.93 -0.26 0.00 -0.22 0.00 0.00 54.13 53.28 3h0j s LEU 1902Cb -0.12 -2.30 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 3h0j s LEU 1902CO 0.28 -0.63 0.84 -0.63 -1.32 0.00 0.00 176.35 174.89 3h0j s ILE 1903N 2.01 4.89 0.73 6.68 1.09 0.32 -4.93 121.20 131.99 3h0j s ILE 1903Ca 0.09 1.67 -0.14 0.00 -1.10 0.00 0.00 60.65 61.17 3h0j s ILE 1903Cb -0.20 -4.15 0.04 0.00 -1.06 0.00 0.00 42.46 37.09 3h0j s ILE 1903CO 0.11 0.06 1.14 -2.84 -0.10 0.00 0.00 174.94 173.31 3h0j s PRO 1904N 1.93 2.28 0.38 2.79 0.02 -1.26 -0.04 135.00 141.10 3h0j s PRO 1904Ca 0.40 1.49 -0.19 0.00 0.02 0.00 0.00 61.00 62.72 3h0j s PRO 1904Cb -0.17 -1.88 -0.10 0.00 0.02 0.00 0.00 34.50 32.37 3h0j s PRO 1904CO 0.14 -1.67 0.86 0.00 -0.33 0.00 0.00 177.00 176.00 3h0j s ALA 1905N -2.36 3.17 -0.44 -1.55 0.00 -1.26 -4.69 121.76 114.63 3h0j s ALA 1905Ca 0.68 0.25 -0.19 0.00 0.00 0.00 0.00 51.96 52.71 3h0j s ALA 1905Cb -0.23 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 19.93 3h0j s ALA 1905CO 0.47 0.22 0.55 0.34 0.00 0.00 0.00 175.76 177.34 3h0j s ASP 1906N -2.18 6.25 0.38 0.00 2.15 -1.26 -4.95 116.67 117.06 3h0j s ASP 1906Ca 0.58 -0.56 0.18 0.00 0.43 0.00 0.00 52.55 53.18 3h0j s ASP 1906Cb -0.10 -2.27 1.11 0.00 -0.30 0.00 0.00 42.92 41.35 3h0j s ASP 1906CO 0.15 -0.71 1.73 -0.65 -0.17 0.00 0.00 175.17 175.53 3h0j h PRO 1907N 8.83 0.37 -0.07 4.34 0.11 -1.95 0.82 132.00 144.45 3h0j h PRO 1907Ca -0.26 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 3h0j h PRO 1907Cb 1.10 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3h0j h PRO 1907CO 0.86 0.24 -0.13 0.00 -0.21 0.00 0.00 178.00 178.77 3h0j h ALA 1908N 1.66 1.66 -2.41 -0.75 0.00 -1.92 -3.39 119.26 114.12 3h0j h ALA 1908Ca 0.65 -0.16 -0.70 0.00 0.00 0.00 0.00 54.91 54.71 3h0j h ALA 1908Cb 1.62 -0.05 -0.19 0.00 0.00 0.00 0.00 17.79 19.17 3h0j h ALA 1908CO -0.38 0.25 -0.24 1.21 0.00 0.00 0.00 179.25 180.09 3h0j s ASN 1909N -6.95 6.18 0.34 0.00 3.04 0.28 -4.96 114.94 112.87 3h0j s ASN 1909Ca -0.05 -0.67 0.02 0.00 0.04 0.00 0.00 52.86 52.19 3h0j s ASN 1909Cb 0.16 -2.21 0.60 0.00 -1.54 0.00 0.00 41.25 38.26 3h0j s ASN 1909CO 0.71 -0.55 1.99 -0.65 -3.04 0.00 0.00 177.10 175.57 3h0j h PRO 1910N 8.70 0.88 -1.21 0.43 0.11 -1.80 -2.98 132.00 136.12 3h0j h PRO 1910Ca -0.27 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.22 3h0j h PRO 1910Cb 1.11 -0.20 -0.24 0.00 0.11 0.00 0.00 31.00 31.78 3h0j h PRO 1910CO 0.78 0.59 0.73 0.27 -0.21 0.00 0.00 178.00 180.16 3h0j n ASN 1911N -4.44 7.30 -4.33 -2.05 6.94 -1.26 -4.94 115.26 112.48 3h0j n ASN 1911Ca 0.08 -3.56 -0.30 0.00 -0.02 0.00 0.00 54.58 50.78 3h0j n ASN 1911Cb 0.06 -1.01 -0.15 0.00 -2.36 0.00 0.00 39.78 36.32 3h0j n ASN 1911CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 3h0j s SER 1912N -1.14 3.09 0.03 0.53 0.15 -1.13 -5.13 113.70 110.10 3h0j s SER 1912Ca 0.54 -0.56 0.03 0.00 0.70 0.00 0.00 55.95 56.65 3h0j s SER 1912Cb 0.42 -0.29 -0.02 0.00 -1.71 0.00 0.00 66.02 64.42 3h0j s SER 1912CO -0.03 0.26 -0.09 0.00 1.20 0.00 0.00 173.24 174.59 3h0j s ALA 1913N -0.77 0.73 0.72 5.45 0.00 -1.26 -4.77 121.76 121.85 3h0j s ALA 1913Ca 0.11 -0.63 -0.17 0.00 0.00 0.00 0.00 51.96 51.28 3h0j s ALA 1913Cb -0.10 -0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.85 3h0j s ALA 1913CO 0.02 0.10 0.07 -0.85 0.00 0.00 0.00 175.76 175.09 3h0j n GLU 1914N 2.04 0.14 -4.44 0.00 0.28 -1.26 -4.70 120.64 112.70 3h0j n GLU 1914Ca -0.18 0.07 -0.21 0.00 -0.16 0.00 0.00 57.16 56.68 3h0j n GLU 1914Cb 0.56 -1.42 -0.15 0.00 1.43 0.00 0.00 31.44 31.85 3h0j n GLU 1914CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 3h0j s THR 1915N -1.97 0.84 -0.20 3.84 2.01 0.95 -4.94 115.64 116.18 3h0j s THR 1915Ca 0.58 -0.40 -0.07 0.00 0.31 0.00 0.00 61.69 62.10 3h0j s THR 1915Cb -0.36 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.38 3h0j s THR 1915CO 0.65 0.26 0.06 -0.22 -0.69 0.00 0.00 174.62 174.68 3h0j s LEU 1916N 0.11 3.71 -0.17 4.42 2.96 -1.26 0.12 118.68 128.57 3h0j s LEU 1916Ca -0.02 0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 53.89 3h0j s LEU 1916Cb -0.08 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 3h0j s LEU 1916CO 0.00 0.13 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.41 3h0j s ILE 1917N 0.66 2.94 -0.08 6.68 1.09 0.19 -4.98 121.20 127.71 3h0j s ILE 1917Ca 0.03 -0.67 -0.25 0.00 -1.10 0.00 0.00 60.65 58.66 3h0j s ILE 1917Cb -0.13 -2.27 -0.03 0.00 -1.06 0.00 0.00 42.46 38.97 3h0j s ILE 1917CO 0.02 0.50 0.79 -1.10 -0.10 0.00 0.00 174.94 175.05 3h0j s GLN 1918N 0.86 4.43 -0.42 2.79 -1.52 -1.26 -1.42 119.66 123.13 3h0j s GLN 1918Ca -0.03 1.03 0.04 0.00 -1.95 0.00 0.00 55.36 54.44 3h0j s GLN 1918Cb -0.15 -3.48 0.12 0.00 -0.22 0.00 0.00 33.01 29.28 3h0j s GLN 1918CO -0.00 -0.05 0.16 -1.21 -0.25 0.00 0.00 175.29 173.93 3h0j s GLU 1919N 1.16 1.63 0.22 2.91 2.02 -0.29 -4.96 118.70 121.38 3h0j s GLU 1919Ca 0.41 -2.15 -0.32 0.00 0.02 0.00 0.00 54.97 52.93 3h0j s GLU 1919Cb -0.18 -3.11 -0.14 0.00 0.10 0.00 0.00 34.13 30.81 3h0j s GLU 1919CO 0.19 -1.03 1.44 -0.35 0.02 0.00 0.00 175.26 175.52 3h0j n PRO 1920N 3.75 2.01 -0.53 0.39 -0.04 -1.26 -1.19 135.00 138.14 3h0j n PRO 1920Ca 0.04 0.72 -0.29 0.00 -0.04 0.00 0.00 63.50 63.93 3h0j n PRO 1920Cb 0.37 -2.40 0.24 0.00 -0.04 0.00 0.00 33.50 31.67 3h0j n PRO 1920CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h0j n GLY 1921N 2.42 -1.80 2.07 0.55 0.00 -1.26 -3.29 105.19 103.88 3h0j n GLY 1921Ca 0.13 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.96 3h0j n GLY 1921CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0j n GLN 1922N -4.59 -1.57 -4.48 1.61 6.02 -1.23 -4.91 117.38 108.23 3h0j n GLN 1922Ca 0.04 0.65 -0.23 0.00 -0.01 0.00 0.00 57.00 57.45 3h0j n GLN 1922Cb 0.54 -4.98 -0.16 0.00 1.02 0.00 0.00 30.24 26.66 3h0j n GLN 1922CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3h0j s VAL 1923N -2.17 0.96 0.30 5.09 1.01 -1.21 0.11 120.40 124.50 3h0j s VAL 1923Ca 0.00 -0.41 -0.26 0.00 0.00 0.00 0.00 61.98 61.32 3h0j s VAL 1923Cb 0.00 -0.88 -0.10 0.00 0.00 0.00 0.00 36.38 35.40 3h0j s VAL 1923CO 0.00 0.31 0.92 0.26 0.00 0.00 0.00 175.10 176.59 3h0j s TRP 1924N 0.53 3.72 0.36 5.22 0.51 -0.26 -4.91 118.94 124.11 3h0j s TRP 1924Ca -0.10 1.76 0.03 0.00 -2.12 0.00 0.00 56.10 55.67 3h0j s TRP 1924Cb -0.13 -2.90 -0.04 0.00 -0.81 0.00 0.00 33.47 29.59 3h0j s TRP 1924CO 0.02 0.25 0.10 -1.01 -0.51 0.00 0.00 176.95 175.81 3h0j s HIS 1925N -1.56 1.81 0.21 -1.98 3.76 -1.26 -1.69 115.29 114.58 3h0j s HIS 1925Ca 0.48 -1.17 -0.09 0.00 -0.15 0.00 0.00 55.06 54.13 3h0j s HIS 1925Cb -0.19 -1.15 0.28 0.00 1.11 0.00 0.00 32.58 32.62 3h0j s HIS 1925CO 0.24 -0.21 1.75 -1.35 -0.85 0.00 0.00 174.74 174.32 3h0j h PRO 1926N 1.98 0.41 -0.48 8.40 0.11 -1.88 -0.05 132.00 140.49 3h0j h PRO 1926Ca -0.37 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.67 3h0j h PRO 1926Cb 1.26 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 3h0j h PRO 1926CO 0.61 0.27 0.13 -2.95 -0.21 0.00 0.00 178.00 175.85 3h0j h ASN 1927N 0.42 0.72 0.83 -2.05 7.08 -1.95 -0.34 115.58 120.29 3h0j h ASN 1927Ca 0.31 -0.23 -0.07 0.00 -3.08 0.00 0.00 56.30 53.23 3h0j h ASN 1927Cb 0.37 -0.19 -0.01 0.00 -2.08 0.00 0.00 38.32 36.42 3h0j h ASN 1927CO -0.30 0.76 -0.33 0.77 -2.08 0.00 0.00 177.43 176.25 3h0j h SER 1928N 0.65 0.00 -0.04 6.14 4.64 -1.77 0.17 113.55 123.34 3h0j h SER 1928Ca 0.15 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.44 3h0j h SER 1928Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3h0j h SER 1928CO -0.00 0.33 -0.12 0.00 -0.87 0.00 0.00 176.83 176.17 3h0j h ALA 1929N 1.67 0.06 -0.08 5.18 0.00 -0.79 -1.01 119.26 124.29 3h0j h ALA 1929Ca -0.00 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.58 3h0j h ALA 1929Cb 0.83 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 3h0j h ALA 1929CO 0.04 -0.04 -0.08 0.35 0.00 0.00 0.00 179.25 179.53 3h0j h PHE 1930N -0.41 -0.19 -0.71 0.00 -0.00 -0.81 -1.72 116.94 113.10 3h0j h PHE 1930Ca -0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 57.97 57.98 3h0j h PHE 1930Cb 0.74 0.10 -0.03 0.00 -0.00 0.00 0.00 35.95 36.75 3h0j h PHE 1930CO 0.13 -0.12 0.43 -0.22 -0.00 0.00 0.00 178.31 178.53 3h0j h LYS 1931N -0.10 0.95 0.29 1.11 3.64 -0.70 -0.02 116.57 121.75 3h0j h LYS 1931Ca 0.06 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3h0j h LYS 1931Cb 0.18 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3h0j h LYS 1931CO -0.14 0.66 -0.14 1.15 -2.27 0.00 0.00 179.45 178.71 3h0j h THR 1932N 0.97 0.74 -0.32 1.00 2.02 -0.71 -0.10 112.91 116.51 3h0j h THR 1932Ca 0.26 -0.21 0.06 0.00 0.77 0.00 0.00 66.41 67.28 3h0j h THR 1932Cb -0.05 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 3h0j h THR 1932CO -0.05 0.05 -0.01 0.00 0.37 0.00 0.00 175.52 175.88 3h0j h ALA 1933N 0.18 0.28 -0.20 6.16 0.00 -1.02 -0.92 119.26 123.74 3h0j h ALA 1933Ca -0.04 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.02 3h0j h ALA 1933Cb 0.37 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 3h0j h ALA 1933CO 0.07 -0.41 -0.25 0.37 0.00 0.00 0.00 179.25 179.03 3h0j h GLN 1934N 0.09 -0.27 -0.67 0.00 5.75 -0.86 0.31 115.11 119.46 3h0j h GLN 1934Ca 0.15 0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.73 3h0j h GLN 1934Cb 0.21 0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.77 3h0j h GLN 1934CO -0.26 -0.18 0.37 0.00 -2.65 0.00 0.00 178.83 176.11 3h0j h ALA 1935N 0.72 0.89 0.06 3.38 0.00 -0.48 -0.35 119.26 123.49 3h0j h ALA 1935Ca 0.12 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h0j h ALA 1935Cb 0.47 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3h0j h ALA 1935CO -0.36 0.05 -0.03 0.82 0.00 0.00 0.00 179.25 179.72 3h0j h ILE 1936N 0.68 0.94 -0.67 0.00 2.04 -0.19 -1.10 117.51 119.22 3h0j h ILE 1936Ca 0.30 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 66.17 3h0j h ILE 1936Cb 0.19 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 3h0j h ILE 1936CO -0.18 0.00 0.42 0.78 0.00 0.00 0.00 178.15 179.17 3h0j h ASN 1937N -0.09 0.68 0.72 1.72 2.35 -0.41 -1.95 115.58 118.61 3h0j h ASN 1937Ca -0.01 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 3h0j h ASN 1937Cb 0.07 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 3h0j h ASN 1937CO 0.01 0.47 -0.16 0.44 -1.65 0.00 0.00 177.43 176.54 3h0j h ASP 1938N 0.81 0.00 0.89 5.81 3.32 -0.80 0.19 116.42 126.64 3h0j h ASP 1938Ca 0.27 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.14 3h0j h ASP 1938Cb 0.02 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 3h0j h ASP 1938CO -0.11 0.16 -0.86 -0.26 -1.72 0.00 0.00 179.24 176.46 3h0j h PHE 1939N 0.00 0.00 0.00 4.55 0.05 -0.69 -3.37 116.94 117.48 3h0j h PHE 1939Ca -0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 3h0j h PHE 1939Cb 0.57 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.52 3h0j h PHE 1939CO 0.00 0.86 -0.10 -0.97 -0.18 0.00 0.00 178.31 177.92 3h0j h ASN 1940N 0.00 0.00 -3.88 2.17 -1.24 -0.56 -0.46 115.58 111.61 3h0j h ASN 1940Ca -0.01 -0.36 -0.49 0.00 0.71 0.00 0.00 56.30 56.15 3h0j h ASN 1940Cb 1.53 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.59 3h0j h ASN 1940CO 0.11 0.74 0.42 0.20 -1.29 0.00 0.00 177.43 177.61 3h0j s ASN 1941N -5.85 7.08 0.00 1.15 -0.87 0.58 -2.47 114.94 114.55 3h0j s ASN 1941Ca -0.09 2.08 0.00 0.00 -1.57 0.00 0.00 52.86 53.28 3h0j s ASN 1941Cb -0.01 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.62 3h0j s ASN 1941CO 0.28 -0.26 0.00 0.61 -2.57 0.00 0.00 177.10 175.15 3h0j n GLY 1942N 0.75 0.56 0.34 0.66 0.00 -1.25 -4.00 105.19 102.26 3h0j n GLY 1942Ca 0.02 0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.23 3h0j n GLY 1942CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0j h GLU 1943N 0.00 0.49 -6.88 1.61 5.08 -1.75 -3.39 114.58 109.74 3h0j h GLU 1943Ca 0.00 -0.03 -0.57 0.00 -1.00 0.00 0.00 59.36 57.76 3h0j h GLU 1943Cb 0.00 -0.11 -0.26 0.00 0.50 0.00 0.00 28.75 28.88 3h0j h GLU 1943CO 0.00 0.33 -0.86 1.04 -1.00 0.00 0.00 179.01 178.52 3h0j n GLN 1944N -4.47 -2.40 -3.66 2.33 6.02 -0.78 -4.39 117.38 110.03 3h0j n GLN 1944Ca 0.08 0.30 -0.24 0.00 -0.01 0.00 0.00 57.00 57.13 3h0j n GLN 1944Cb 0.26 -4.92 -0.02 0.00 1.02 0.00 0.00 30.24 26.57 3h0j n GLN 1944CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h0j s LEU 1945N -7.26 4.17 0.89 1.08 1.43 -0.25 -4.91 118.68 113.83 3h0j s LEU 1945Ca 0.72 0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 53.99 3h0j s LEU 1945Cb -0.40 -3.13 0.15 0.00 0.03 0.00 0.00 46.19 42.84 3h0j s LEU 1945CO 0.96 -0.15 1.25 -2.16 0.23 0.00 0.00 176.35 176.48 3h0j s PRO 1946N -3.93 1.22 -0.01 1.29 0.04 -1.26 -4.61 135.00 127.73 3h0j s PRO 1946Ca 0.38 -0.21 -0.15 0.00 0.04 0.00 0.00 61.00 61.05 3h0j s PRO 1946Cb -0.10 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.56 3h0j s PRO 1946CO 0.32 -2.05 0.31 1.41 0.04 0.00 0.00 177.00 177.03 3h0j s MET 1947N -5.74 0.68 -0.07 4.56 1.75 -0.63 -1.00 119.30 118.85 3h0j s MET 1947Ca 0.69 -0.21 0.02 0.00 -1.25 0.00 0.00 55.69 54.94 3h0j s MET 1947Cb -0.07 0.30 0.01 0.00 2.84 0.00 0.00 34.83 37.92 3h0j s MET 1947CO 0.51 -0.19 -0.13 1.41 -0.65 0.00 0.00 175.02 175.97 3h0j s MET 1948N -1.42 1.85 -0.22 4.11 1.75 -0.25 -1.28 119.30 123.84 3h0j s MET 1948Ca -0.13 -0.46 -0.03 0.00 -1.25 0.00 0.00 55.69 53.82 3h0j s MET 1948Cb -0.05 -1.52 0.00 0.00 2.84 0.00 0.00 34.83 36.11 3h0j s MET 1948CO 0.04 0.03 -0.07 0.42 -0.65 0.00 0.00 175.02 174.79 3h0j s ILE 1949N 0.67 3.08 -1.34 10.11 1.01 -0.62 -1.15 121.20 132.96 3h0j s ILE 1949Ca -0.14 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 3h0j s ILE 1949Cb -0.16 -2.44 0.12 0.00 0.01 0.00 0.00 42.46 39.99 3h0j s ILE 1949CO 0.04 0.37 1.98 0.18 0.00 0.00 0.00 174.94 177.51 3h0j n LEU 1950N 4.74 6.59 -4.68 2.97 4.77 0.08 -1.40 117.00 130.08 3h0j n LEU 1950Ca -0.18 -4.42 -0.52 0.00 -0.03 0.00 0.00 56.01 50.86 3h0j n LEU 1950Cb 0.50 -1.56 -0.06 0.00 -2.33 0.00 0.00 43.42 39.97 3h0j n LEU 1950CO 0.28 1.20 1.33 0.00 -1.33 0.00 0.00 177.39 178.86 3h0j n ALA 1951N 4.97 0.28 -2.73 -1.18 0.00 -1.07 -4.17 120.51 116.61 3h0j n ALA 1951Ca 0.45 0.37 -0.09 0.00 0.00 0.00 0.00 53.44 54.16 3h0j n ALA 1951Cb 0.38 -2.32 0.09 0.00 0.00 0.00 0.00 19.45 17.60 3h0j n ALA 1951CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h0j n ASN 1952N 5.31 -2.31 -4.40 0.00 5.15 -1.24 -4.04 115.26 113.74 3h0j n ASN 1952Ca 0.23 -3.66 -0.32 0.00 -0.60 0.00 0.00 54.58 50.23 3h0j n ASN 1952Cb 0.22 1.89 -0.14 0.00 -0.53 0.00 0.00 39.78 41.21 3h0j n ASN 1952CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 3h0j s TRP 1953N 0.25 2.59 -0.09 1.20 0.51 -0.60 -4.56 118.94 118.24 3h0j s TRP 1953Ca 0.22 -0.36 0.13 0.00 -2.12 0.00 0.00 56.10 53.97 3h0j s TRP 1953Cb 0.29 -1.62 -0.00 0.00 -0.81 0.00 0.00 33.47 31.33 3h0j s TRP 1953CO -0.05 0.03 1.40 0.00 -0.51 0.00 0.00 176.95 177.82 3h0j h ARG 1954N 5.65 0.00 0.00 4.98 3.08 0.53 -2.96 114.38 125.65 3h0j h ARG 1954Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.64 3h0j h ARG 1954Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3h0j h ARG 1954CO 0.50 0.63 0.00 0.41 -1.07 0.00 0.00 179.97 180.43 3h0j n GLY 1955N 1.25 -0.06 3.82 0.04 0.00 -1.24 -4.22 105.19 104.77 3h0j n GLY 1955Ca 0.01 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 3h0j n GLY 1955CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0j s PHE 1956N -2.54 3.71 -0.40 1.61 0.08 -1.26 -1.10 117.98 118.08 3h0j s PHE 1956Ca 0.00 1.01 -0.27 0.00 0.12 0.00 0.00 56.93 57.79 3h0j s PHE 1956Cb 0.00 -2.35 -0.05 0.00 -0.57 0.00 0.00 43.02 40.05 3h0j s PHE 1956CO 0.00 0.57 2.25 0.45 -0.10 0.00 0.00 175.22 178.39 3h0j s SER 1957N -0.84 4.96 0.00 1.36 0.15 -0.68 -4.81 113.70 113.84 3h0j s SER 1957Ca 0.24 1.31 0.17 0.00 0.70 0.00 0.00 55.95 58.37 3h0j s SER 1957Cb -0.17 -2.51 0.99 0.00 -1.71 0.00 0.00 66.02 62.63 3h0j s SER 1957CO 0.13 -2.44 1.62 0.61 1.20 0.00 0.00 173.24 174.36 3h0j n GLY 1958N 5.85 -0.97 3.44 9.45 0.00 -1.26 -4.41 105.19 117.30 3h0j n GLY 1958Ca 0.32 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 3h0j n GLY 1958CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0j n GLY 1959N 0.72 -1.79 0.31 -0.02 0.00 -1.26 -4.72 105.19 98.44 3h0j n GLY 1959Ca 0.12 -0.78 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 3h0j n GLY 1959CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3h0j h GLN 1960N -1.81 1.03 0.20 1.61 -0.00 -1.99 -1.46 115.11 112.70 3h0j h GLN 1960Ca -0.47 -0.28 -0.01 0.00 -0.00 0.00 0.00 58.65 57.89 3h0j h GLN 1960Cb 1.30 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 28.66 3h0j h GLN 1960CO 0.37 0.97 -0.09 -0.09 0.00 0.00 0.00 178.83 179.99 3h0j h ARG 1961N 0.96 -0.26 -0.55 1.69 2.43 -1.96 -1.22 114.38 115.48 3h0j h ARG 1961Ca 0.19 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.29 3h0j h ARG 1961Cb 0.46 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 3h0j h ARG 1961CO 0.02 0.01 0.03 -0.44 -1.51 0.00 0.00 179.97 178.08 3h0j h ASP 1962N -0.51 0.89 -0.20 -3.80 3.32 -1.85 0.41 116.42 114.68 3h0j h ASP 1962Ca -0.03 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 3h0j h ASP 1962Cb 0.39 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3h0j h ASP 1962CO 0.04 0.94 0.11 0.24 -1.72 0.00 0.00 179.24 178.85 3h0j h MET 1963N 0.86 0.27 -0.53 3.56 2.86 -1.26 -1.19 114.93 119.50 3h0j h MET 1963Ca 0.16 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3h0j h MET 1963Cb 0.47 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 3h0j h MET 1963CO 0.02 0.25 0.33 0.35 1.06 0.00 0.00 176.91 178.92 3h0j h PHE 1964N 0.22 0.69 -0.13 -0.22 3.57 -0.80 -0.12 116.94 120.15 3h0j h PHE 1964Ca 0.07 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3h0j h PHE 1964Cb 0.06 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 3h0j h PHE 1964CO -0.04 0.46 0.07 0.09 -2.23 0.00 0.00 178.31 176.66 3h0j n ASN 1965N -4.43 2.72 -3.72 0.41 3.02 0.14 -4.88 115.26 108.52 3h0j n ASN 1965Ca 0.05 -2.21 -0.24 0.00 -0.03 0.00 0.00 54.58 52.15 3h0j n ASN 1965Cb 0.07 -0.54 0.04 0.00 -0.61 0.00 0.00 39.78 38.74 3h0j n ASN 1965CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3h0j n GLU 1966N 0.21 -5.65 0.27 3.52 1.02 -0.06 -4.84 120.64 115.11 3h0j n GLU 1966Ca 0.08 0.66 0.13 0.00 -0.02 0.00 0.00 57.16 58.01 3h0j n GLU 1966Cb 0.60 -5.43 0.75 0.00 -0.02 0.00 0.00 31.44 27.34 3h0j n GLU 1966CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 3h0j h VAL 1967N -2.03 0.54 -0.13 2.62 3.04 -1.48 -2.00 116.25 116.81 3h0j h VAL 1967Ca -0.60 -0.46 -0.09 0.00 -1.01 0.00 0.00 66.70 64.54 3h0j h VAL 1967Cb 1.36 1.30 -0.01 0.00 -2.01 0.00 0.00 31.29 31.93 3h0j h VAL 1967CO 0.59 0.10 -0.34 -0.07 -1.01 0.00 0.00 177.57 176.84 3h0j h LEU 1968N 0.00 0.27 0.16 3.16 3.38 -1.86 -1.82 115.31 118.59 3h0j h LEU 1968Ca -0.00 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3h0j h LEU 1968Cb 0.29 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3h0j h LEU 1968CO 0.01 0.60 -0.08 0.11 0.09 0.00 0.00 178.44 179.17 3h0j h LYS 1969N 0.23 -0.21 -0.24 1.13 1.57 -1.75 -1.95 116.57 115.35 3h0j h LYS 1969Ca 0.03 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 3h0j h LYS 1969Cb 0.72 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 3h0j h LYS 1969CO 0.05 0.05 -0.18 1.88 -0.57 0.00 0.00 179.45 180.69 3h0j h TYR 1970N -0.46 0.44 -0.38 -1.35 0.05 -1.56 -1.88 116.97 111.84 3h0j h TYR 1970Ca -0.02 -0.07 -0.04 0.00 0.05 0.00 0.00 58.73 58.64 3h0j h TYR 1970Cb 0.36 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 3h0j h TYR 1970CO 0.01 0.57 0.06 0.78 -1.05 0.00 0.00 178.16 178.53 3h0j h GLY 1971N 0.94 0.67 1.40 3.88 0.00 -1.31 -2.47 103.07 106.18 3h0j h GLY 1971Ca 0.07 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 46.98 3h0j h GLY 1971CO 0.03 0.41 0.35 1.76 0.00 0.00 0.00 176.54 179.10 3h0j h SER 1972N 0.47 0.54 -0.26 0.19 0.02 -0.97 -0.59 113.55 112.95 3h0j h SER 1972Ca 0.11 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.09 3h0j h SER 1972Cb 0.36 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3h0j h SER 1972CO 0.01 0.38 0.18 -0.26 -1.14 0.00 0.00 176.83 175.99 3h0j h PHE 1973N 0.63 0.22 -0.76 3.45 0.05 -0.87 -0.48 116.94 119.19 3h0j h PHE 1973Ca 0.21 0.01 -0.04 0.00 3.82 0.00 0.00 57.97 61.96 3h0j h PHE 1973Cb 0.05 -0.07 -0.03 0.00 2.00 0.00 0.00 35.95 37.89 3h0j h PHE 1973CO -0.00 0.13 0.30 0.82 -0.18 0.00 0.00 178.31 179.37 3h0j h ILE 1974N 0.23 1.25 -0.38 -0.55 2.04 -1.00 -0.77 117.51 118.34 3h0j h ILE 1974Ca 0.11 -0.81 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 3h0j h ILE 1974Cb 0.15 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 3h0j h ILE 1974CO -0.02 0.33 -0.02 0.58 0.00 0.00 0.00 178.15 179.02 3h0j h VAL 1975N 1.10 1.26 -0.88 1.67 2.07 -1.11 -1.83 116.25 118.53 3h0j h VAL 1975Ca 0.25 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 3h0j h VAL 1975Cb 0.22 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 3h0j h VAL 1975CO -0.02 0.35 0.46 0.44 0.02 0.00 0.00 177.57 178.82 3h0j h ASP 1976N 0.50 1.11 -0.11 0.57 3.45 -1.10 -1.27 116.42 119.57 3h0j h ASP 1976Ca 0.10 -0.11 -0.09 0.00 0.43 0.00 0.00 57.03 57.37 3h0j h ASP 1976Cb 0.50 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 3h0j h ASP 1976CO 0.02 0.91 -0.19 0.00 -1.57 0.00 0.00 179.24 178.41 3h0j h ALA 1977N 1.25 1.15 -0.12 3.45 0.00 -0.90 -2.60 119.26 121.49 3h0j h ALA 1977Ca 0.31 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 3h0j h ALA 1977Cb 0.06 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3h0j h ALA 1977CO -0.05 0.54 -0.68 -0.07 0.00 0.00 0.00 179.25 178.99 3h0j h LEU 1978N 0.46 0.57 -1.52 0.00 3.38 -0.85 -2.66 115.31 114.70 3h0j h LEU 1978Ca 0.08 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 3h0j h LEU 1978Cb 0.60 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3h0j h LEU 1978CO 0.04 1.09 -0.20 0.58 0.09 0.00 0.00 178.44 180.04 3h0j h VAL 1979N 0.35 1.16 0.00 1.22 2.07 -0.99 -2.73 116.25 117.34 3h0j h VAL 1979Ca -0.02 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3h0j h VAL 1979Cb 1.26 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3h0j h VAL 1979CO 0.12 0.22 -0.53 -0.78 0.02 0.00 0.00 177.57 176.63 3h0j h ASP 1980N 0.06 0.00 -3.22 0.57 1.82 -1.31 -3.48 116.42 110.86 3h0j h ASP 1980Ca 0.01 -0.12 -0.57 0.00 -0.39 0.00 0.00 57.03 55.95 3h0j h ASP 1980Cb 0.39 0.00 0.12 0.00 0.68 0.00 0.00 39.33 40.52 3h0j h ASP 1980CO 0.03 0.06 0.38 0.00 -1.61 0.00 0.00 179.24 178.10 3h0j n TYR 1981N -2.32 1.86 -1.01 0.28 9.36 -1.02 -4.94 117.16 119.37 3h0j n TYR 1981Ca 0.03 0.56 0.04 0.00 3.32 0.00 0.00 57.90 61.85 3h0j n TYR 1981Cb 0.46 -2.34 0.05 0.00 -0.63 0.00 0.00 39.34 36.89 3h0j n TYR 1981CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3h0j n LYS 1982N 0.33 1.22 -4.23 2.98 5.02 -1.26 -4.94 118.16 117.28 3h0j n LYS 1982Ca 0.07 -1.65 -0.13 0.00 -2.02 0.00 0.00 58.31 54.57 3h0j n LYS 1982Cb 0.37 -1.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.28 3h0j n LYS 1982CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3h0j s GLN 1983N -1.35 1.01 0.16 1.97 1.11 -1.26 -5.10 119.66 116.21 3h0j s GLN 1983Ca 0.12 -1.44 -0.33 0.00 0.01 0.00 0.00 55.36 53.72 3h0j s GLN 1983Cb 0.11 -0.45 -0.16 0.00 -1.01 0.00 0.00 33.01 31.50 3h0j s GLN 1983CO 0.01 0.01 1.24 -2.30 0.01 0.00 0.00 175.29 174.26 3h0j n PRO 1984N -0.17 1.27 -4.78 2.91 -0.02 -1.26 -4.77 135.00 128.19 3h0j n PRO 1984Ca -0.10 0.45 -0.29 0.00 -2.02 0.00 0.00 63.50 61.55 3h0j n PRO 1984Cb 0.61 -2.00 -0.14 0.00 -0.02 0.00 0.00 33.50 31.94 3h0j n PRO 1984CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h0j s ILE 1985N -0.00 2.01 -0.12 4.25 1.01 -0.72 -1.60 121.20 126.03 3h0j s ILE 1985Ca 0.75 -1.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 3h0j s ILE 1985Cb -0.85 -1.74 0.04 0.00 0.01 0.00 0.00 42.46 39.93 3h0j s ILE 1985CO 0.50 0.29 0.02 -0.63 0.00 0.00 0.00 174.94 175.13 3h0j s ILE 1986N -0.83 0.37 -0.13 2.92 1.01 -0.40 -3.09 121.20 121.04 3h0j s ILE 1986Ca 0.11 -0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.48 3h0j s ILE 1986Cb -0.10 -0.70 -0.05 0.00 0.01 0.00 0.00 42.46 41.62 3h0j s ILE 1986CO 0.02 0.03 0.30 -0.63 0.00 0.00 0.00 174.94 174.67 3h0j s ILE 1987N 1.95 5.28 -0.19 2.92 -1.09 0.10 -1.58 121.20 128.60 3h0j s ILE 1987Ca 0.03 0.57 -0.04 0.00 -2.23 0.00 0.00 60.65 58.97 3h0j s ILE 1987Cb -0.14 -3.62 0.08 0.00 -1.58 0.00 0.00 42.46 37.19 3h0j s ILE 1987CO -0.07 0.45 0.17 -0.47 -1.23 0.00 0.00 174.94 173.79 3h0j s TYR 1988N 0.01 -0.10 -0.42 3.97 6.04 -0.49 0.07 117.35 126.43 3h0j s TYR 1988Ca 0.18 0.03 -0.29 0.00 0.04 0.00 0.00 57.07 57.02 3h0j s TYR 1988Cb -0.14 -0.49 0.02 0.00 -1.04 0.00 0.00 41.96 40.32 3h0j s TYR 1988CO 0.06 -0.56 1.14 0.42 -1.54 0.00 0.00 175.55 175.07 3h0j s ILE 1989N 2.25 4.27 0.80 3.14 1.01 0.98 -2.60 121.20 131.05 3h0j s ILE 1989Ca 0.05 1.36 -0.11 0.00 0.00 0.00 0.00 60.65 61.94 3h0j s ILE 1989Cb -0.16 -4.51 0.07 0.00 0.01 0.00 0.00 42.46 37.87 3h0j s ILE 1989CO -0.11 -0.82 1.09 -2.16 0.00 0.00 0.00 174.94 172.94 3h0j s PRO 1990N 4.25 2.08 0.33 2.79 0.04 -1.26 -0.85 135.00 142.37 3h0j s PRO 1990Ca 0.48 0.86 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 3h0j s PRO 1990Cb -0.09 -1.90 -0.12 0.00 0.04 0.00 0.00 34.50 32.43 3h0j s PRO 1990CO 0.27 -1.68 1.44 -0.35 0.04 0.00 0.00 177.00 176.71 3h0j n PRO 1991N -3.51 2.41 -0.19 0.56 -0.04 -1.26 -0.72 135.00 132.25 3h0j n PRO 1991Ca 0.08 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.38 3h0j n PRO 1991Cb 0.55 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 3h0j n PRO 1991CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3h0j n THR 1992N 1.01 0.00 -2.71 0.52 -2.24 -0.45 -4.82 114.28 105.59 3h0j n THR 1992Ca 0.06 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.60 3h0j n THR 1992Cb 0.36 -0.04 0.03 0.00 -2.10 0.00 0.00 70.33 68.58 3h0j n THR 1992CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3h0j s GLY 1993N -2.00 1.64 0.25 3.38 0.00 0.10 -4.97 107.32 105.72 3h0j s GLY 1993Ca 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 44.72 43.65 3h0j s GLY 1993CO 0.00 -0.77 0.35 -1.83 0.00 0.00 0.00 173.10 170.84 3h0j s GLU 1994N -4.76 1.50 -0.24 2.90 -1.05 -1.26 -2.75 118.70 113.04 3h0j s GLU 1994Ca 0.52 -1.50 -0.03 0.00 -0.15 0.00 0.00 54.97 53.81 3h0j s GLU 1994Cb -0.10 0.39 0.13 0.00 -0.44 0.00 0.00 34.13 34.10 3h0j s GLU 1994CO 0.40 -0.58 0.34 -1.17 0.95 0.00 0.00 175.26 175.21 3h0j s LEU 1995N -3.12 -0.52 0.02 1.83 2.96 -1.03 -1.56 118.68 117.26 3h0j s LEU 1995Ca 0.30 0.13 0.02 0.00 -0.22 0.00 0.00 54.13 54.36 3h0j s LEU 1995Cb 0.02 0.96 -0.04 0.00 0.50 0.00 0.00 46.19 47.64 3h0j s LEU 1995CO 0.13 -0.31 0.01 -0.13 -1.32 0.00 0.00 176.35 174.73 3h0j s ARG 1996N 2.50 2.76 0.00 1.98 1.81 -1.12 -2.84 118.95 124.04 3h0j s ARG 1996Ca 0.11 -0.66 0.00 0.00 -1.72 0.00 0.00 55.73 53.47 3h0j s ARG 1996Cb -0.15 -2.66 0.00 0.00 -0.45 0.00 0.00 34.95 31.69 3h0j s ARG 1996CO -0.15 0.60 0.00 0.41 -0.68 0.00 0.00 175.30 175.48 3h0j n GLY 1997N 1.12 0.00 0.32 -3.53 0.00 -0.58 -0.94 105.19 101.59 3h0j n GLY 1997Ca -0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.97 3h0j n GLY 1997CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h0j h GLY 1998N 0.00 0.93 2.00 -0.02 0.00 -1.86 0.14 103.07 104.25 3h0j h GLY 1998Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3h0j h GLY 1998CO 0.00 -0.40 0.00 -1.14 0.00 0.00 0.00 176.54 175.00 3h0j n SER 1999N -5.49 0.65 0.07 0.19 3.41 -0.11 -3.15 113.62 109.18 3h0j n SER 1999Ca 0.17 0.59 -0.21 0.00 -0.26 0.00 0.00 58.87 59.17 3h0j n SER 1999Cb 0.58 -0.75 -0.15 0.00 -0.26 0.00 0.00 64.21 63.63 3h0j n SER 1999CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 3h0j h TRP 2000N 0.00 0.63 0.00 7.33 2.91 -0.53 -3.33 115.95 122.96 3h0j h TRP 2000Ca 0.00 -0.46 0.00 0.00 1.13 0.00 0.00 58.89 59.56 3h0j h TRP 2000Cb 0.57 -0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.20 3h0j h TRP 2000CO 0.00 1.37 0.26 -0.39 -1.03 0.00 0.00 178.44 178.65 3h0j h VAL 2001N -0.27 0.00 -0.35 2.65 -1.51 -1.38 -1.51 116.25 113.88 3h0j h VAL 2001Ca -0.17 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.30 3h0j h VAL 2001Cb 1.75 0.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 3h0j h VAL 2001CO 0.17 0.00 0.00 1.33 -1.23 0.00 0.00 177.57 177.84 3h0j n VAL 2002N -2.41 0.61 -0.70 7.19 0.24 -1.25 -4.45 118.33 117.57 3h0j n VAL 2002Ca -0.01 -0.80 0.00 0.00 -2.04 0.00 0.00 64.34 61.48 3h0j n VAL 2002Cb 0.29 0.84 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 3h0j n VAL 2002CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 3h0j n VAL 2003N 1.07 0.16 -1.78 3.34 0.24 -0.60 -4.55 118.33 116.21 3h0j n VAL 2003Ca 0.15 -0.23 -0.41 0.00 -2.04 0.00 0.00 64.34 61.82 3h0j n VAL 2003Cb 0.50 1.25 0.01 0.00 -1.47 0.00 0.00 33.84 34.13 3h0j n VAL 2003CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3h0j s ASP 2004N -0.16 6.16 0.59 -1.34 2.15 -1.04 -4.87 116.67 118.16 3h0j s ASP 2004Ca 0.00 3.03 0.29 0.00 0.43 0.00 0.00 52.55 56.30 3h0j s ASP 2004Cb 0.00 -2.66 1.76 0.00 -0.30 0.00 0.00 42.92 41.71 3h0j s ASP 2004CO 0.00 -1.00 2.22 -0.65 -0.17 0.00 0.00 175.17 175.57 3h0j h PRO 2005N 2.75 0.00 0.00 4.34 0.11 -1.91 -2.14 132.00 135.15 3h0j h PRO 2005Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h0j h PRO 2005Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3h0j h PRO 2005CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 3h0j n THR 2006N -3.88 0.94 0.00 -1.15 -2.24 -1.26 -1.91 114.28 104.79 3h0j n THR 2006Ca -0.02 0.33 0.03 0.00 -2.27 0.00 0.00 64.05 62.11 3h0j n THR 2006Cb 0.13 -1.25 0.38 0.00 -2.10 0.00 0.00 70.33 67.50 3h0j n THR 2006CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3h0j h ILE 2007N 0.00 1.14 -1.47 2.28 2.04 -1.75 -3.35 117.51 116.40 3h0j h ILE 2007Ca 0.00 -0.41 -0.27 0.00 1.00 0.00 0.00 64.86 65.18 3h0j h ILE 2007Cb 0.27 0.67 -0.24 0.00 -0.74 0.00 0.00 36.82 36.78 3h0j h ILE 2007CO 0.00 0.16 -0.63 0.21 0.00 0.00 0.00 178.15 177.90 3h0j s ASN 2008N -6.71 -0.37 0.50 1.72 3.84 -0.80 -4.67 114.94 108.46 3h0j s ASN 2008Ca -0.08 -1.85 0.21 0.00 0.21 0.00 0.00 52.86 51.35 3h0j s ASN 2008Cb 0.17 1.16 1.30 0.00 -0.55 0.00 0.00 41.25 43.33 3h0j s ASN 2008CO 0.74 -0.13 2.07 0.00 -2.79 0.00 0.00 177.10 177.00 3h0j h ALA 2009N 5.82 1.57 -0.58 1.71 0.00 -1.61 0.52 119.26 126.69 3h0j h ALA 2009Ca 0.10 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h0j h ALA 2009Cb 1.07 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3h0j h ALA 2009CO 0.14 0.15 0.38 -0.44 0.00 0.00 0.00 179.25 179.47 3h0j h ASP 2010N 0.00 0.66 0.00 0.00 5.19 -1.95 -3.35 116.42 116.98 3h0j h ASP 2010Ca -0.00 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.37 3h0j h ASP 2010Cb 0.24 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.58 3h0j h ASP 2010CO 0.02 0.48 -1.13 0.00 -3.12 0.00 0.00 179.24 175.48 3h0j n GLN 2011N -4.45 1.87 -3.12 3.56 1.13 -1.04 -5.01 117.38 110.32 3h0j n GLN 2011Ca 0.06 -0.01 -0.31 0.00 -1.94 0.00 0.00 57.00 54.80 3h0j n GLN 2011Cb 0.05 -1.06 -0.04 0.00 0.11 0.00 0.00 30.24 29.29 3h0j n GLN 2011CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 3h0j s MET 2012N -2.11 3.82 -0.08 -1.09 -1.94 0.15 -1.75 119.30 116.29 3h0j s MET 2012Ca -0.01 0.41 -0.09 0.00 -1.71 0.00 0.00 55.69 54.28 3h0j s MET 2012Cb 0.01 -2.49 0.02 0.00 2.01 0.00 0.00 34.83 34.38 3h0j s MET 2012CO 0.10 0.13 0.25 -1.21 -0.01 0.00 0.00 175.02 174.28 3h0j s GLU 2013N -3.36 0.35 -0.00 2.03 2.02 -1.18 -4.83 118.70 113.73 3h0j s GLU 2013Ca 0.50 0.25 0.06 0.00 0.02 0.00 0.00 54.97 55.80 3h0j s GLU 2013Cb -0.10 0.17 -0.03 0.00 0.10 0.00 0.00 34.13 34.26 3h0j s GLU 2013CO 0.25 -0.06 -0.19 1.41 0.02 0.00 0.00 175.26 176.70 3h0j s MET 2014N -0.12 2.21 -0.02 1.61 -2.45 -1.26 0.03 119.30 119.29 3h0j s MET 2014Ca -0.02 -0.88 -0.00 0.00 -1.25 0.00 0.00 55.69 53.53 3h0j s MET 2014Cb -0.03 -2.21 0.02 0.00 1.25 0.00 0.00 34.83 33.87 3h0j s MET 2014CO 0.01 0.57 0.04 0.71 1.05 0.00 0.00 175.02 177.40 3h0j s TYR 2015N -0.78 0.00 -0.11 4.11 1.51 0.11 -0.65 117.35 121.53 3h0j s TYR 2015Ca 0.12 0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 56.32 3h0j s TYR 2015Cb -0.10 -0.16 -0.02 0.00 -0.11 0.00 0.00 41.96 41.56 3h0j s TYR 2015CO 0.02 -0.08 -0.08 0.00 -1.11 0.00 0.00 175.55 174.31 3h0j s ALA 2016N 0.82 2.88 0.54 3.71 0.00 -1.14 -0.01 121.76 128.56 3h0j s ALA 2016Ca -0.07 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 50.84 3h0j s ALA 2016Cb -0.10 -1.32 -0.06 0.00 0.00 0.00 0.00 23.12 21.64 3h0j s ALA 2016CO -0.03 0.36 1.07 0.34 0.00 0.00 0.00 175.76 177.51 3h0j s ASP 2017N -0.10 5.93 0.62 0.00 2.15 -0.03 -1.27 116.67 123.98 3h0j s ASP 2017Ca 0.01 1.97 0.36 0.00 0.43 0.00 0.00 52.55 55.31 3h0j s ASP 2017Cb -0.13 -2.56 2.07 0.00 -0.30 0.00 0.00 42.92 42.00 3h0j s ASP 2017CO 0.03 -1.07 2.30 0.58 -0.17 0.00 0.00 175.17 176.85 3h0j h VAL 2018N 1.04 0.31 -0.78 1.11 2.07 -0.77 -1.06 116.25 118.18 3h0j h VAL 2018Ca -0.49 0.00 -0.47 0.00 0.82 0.00 0.00 66.70 66.56 3h0j h VAL 2018Cb 1.23 0.99 -0.26 0.00 -1.52 0.00 0.00 31.29 31.74 3h0j h VAL 2018CO 0.58 0.00 0.31 0.59 0.02 0.00 0.00 177.57 179.07 3h0j n ASN 2019N -3.53 4.62 -4.71 0.57 3.02 -1.26 -4.68 115.26 109.29 3h0j n ASN 2019Ca -0.03 -3.73 -0.24 0.00 -0.03 0.00 0.00 54.58 50.55 3h0j n ASN 2019Cb 0.08 -0.76 -0.07 0.00 -0.61 0.00 0.00 39.78 38.43 3h0j n ASN 2019CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h0j s ALA 2020N -3.47 3.46 0.06 5.41 0.00 -0.40 -1.34 121.76 125.47 3h0j s ALA 2020Ca 0.55 -1.94 0.03 0.00 0.00 0.00 0.00 51.96 50.60 3h0j s ALA 2020Cb 0.46 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 3h0j s ALA 2020CO 0.03 -0.02 -0.09 1.03 0.00 0.00 0.00 175.76 176.71 3h0j s ARG 2021N -3.83 0.67 -0.01 0.00 3.00 -1.11 -4.18 118.95 113.48 3h0j s ARG 2021Ca 0.38 -0.91 -0.22 0.00 0.00 0.00 0.00 55.73 54.98 3h0j s ARG 2021Cb -0.00 -0.44 0.05 0.00 0.00 0.00 0.00 34.95 34.55 3h0j s ARG 2021CO 0.22 0.08 0.49 0.00 0.00 0.00 0.00 175.30 176.08 3h0j s ALA 2022N -1.70 -1.24 0.00 2.13 0.00 -0.90 -2.47 121.76 117.57 3h0j s ALA 2022Ca -0.04 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3h0j s ALA 2022Cb -0.08 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.18 3h0j s ALA 2022CO 0.00 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 175.81 3h0j n GLY 2023N 0.91 2.84 0.20 0.00 0.00 -1.13 -4.32 105.19 103.68 3h0j n GLY 2023Ca -0.20 -0.84 -0.02 0.00 0.00 0.00 0.00 46.02 44.96 3h0j n GLY 2023CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h0j h VAL 2024N 0.95 0.58 -3.26 1.61 2.07 -1.93 -1.55 116.25 114.72 3h0j h VAL 2024Ca 0.00 -0.03 -0.45 0.00 0.82 0.00 0.00 66.70 67.04 3h0j h VAL 2024Cb 0.00 0.49 -0.17 0.00 -1.52 0.00 0.00 31.29 30.09 3h0j h VAL 2024CO 0.00 0.02 -0.75 -0.76 0.02 0.00 0.00 177.57 176.09 3h0j s LEU 2025N -10.61 2.47 0.63 2.57 1.02 -1.26 -2.26 118.68 111.24 3h0j s LEU 2025Ca -0.14 -0.91 -0.10 0.00 0.02 0.00 0.00 54.13 53.01 3h0j s LEU 2025Cb 0.16 -0.65 -0.01 0.00 0.02 0.00 0.00 46.19 45.71 3h0j s LEU 2025CO 0.72 -0.14 1.01 -1.61 0.02 0.00 0.00 176.35 176.35 3h0j s GLU 2026N -3.11 3.20 0.14 1.70 2.02 -1.26 -4.74 118.70 116.65 3h0j s GLU 2026Ca 0.16 0.46 -0.32 0.00 0.02 0.00 0.00 54.97 55.29 3h0j s GLU 2026Cb -0.03 -2.12 -0.09 0.00 0.10 0.00 0.00 34.13 31.99 3h0j s GLU 2026CO 0.05 -0.73 1.54 -1.35 0.02 0.00 0.00 175.26 174.79 3h0j h PRO 2027N -0.37 -0.23 -0.86 0.39 0.11 -1.92 0.18 132.00 129.31 3h0j h PRO 2027Ca -0.45 0.02 0.22 0.00 0.11 0.00 0.00 66.00 65.90 3h0j h PRO 2027Cb 1.23 0.05 -0.14 0.00 0.11 0.00 0.00 31.00 32.25 3h0j h PRO 2027CO 0.62 -0.16 0.18 1.96 -0.21 0.00 0.00 178.00 180.40 3h0j h GLN 2028N -0.24 0.18 0.02 1.05 7.50 -1.94 0.13 115.11 121.80 3h0j h GLN 2028Ca 0.11 -0.01 -0.22 0.00 0.50 0.00 0.00 58.65 59.02 3h0j h GLN 2028Cb 0.52 -0.04 -0.00 0.00 0.05 0.00 0.00 27.48 28.01 3h0j h GLN 2028CO -0.72 0.12 -0.96 0.78 -1.50 0.00 0.00 178.83 176.54 3h0j h GLY 2029N 0.18 0.34 1.45 3.46 0.00 -1.63 -3.12 103.07 103.75 3h0j h GLY 2029Ca 0.52 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 3h0j h GLY 2029CO -0.66 0.57 -0.02 1.98 0.00 0.00 0.00 176.54 178.40 3h0j h MET 2030N 0.16 0.68 0.44 4.80 -1.53 0.17 -3.18 114.93 116.47 3h0j h MET 2030Ca -0.07 -0.18 -0.02 0.00 -3.44 0.00 0.00 59.70 55.99 3h0j h MET 2030Cb 1.61 -0.08 0.00 0.00 -0.55 0.00 0.00 31.60 32.58 3h0j h MET 2030CO 0.16 0.71 -0.21 0.28 0.14 0.00 0.00 176.91 177.99 3h0j h VAL 2031N 0.64 0.00 0.00 -5.77 2.07 -0.94 -1.70 116.25 110.54 3h0j h VAL 2031Ca 0.13 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3h0j h VAL 2031Cb 0.43 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 3h0j h VAL 2031CO 0.02 0.00 0.48 0.61 0.02 0.00 0.00 177.57 178.70 3h0j n GLY 2032N -0.53 -0.12 0.00 2.17 0.00 -1.18 0.13 105.19 105.66 3h0j n GLY 2032Ca -0.07 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3h0j n GLY 2032CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3h0j n ILE 2033N -1.22 0.00 -0.84 -0.61 5.41 -1.14 -4.78 119.36 116.18 3h0j n ILE 2033Ca -0.00 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.73 3h0j n ILE 2033Cb 0.48 0.43 0.00 0.00 -0.71 0.00 0.00 39.64 39.85 3h0j n ILE 2033CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3h0j n LYS 2034N -1.55 0.66 -2.76 0.38 4.76 0.65 -4.87 118.16 115.44 3h0j n LYS 2034Ca -0.00 -0.77 -0.09 0.00 -2.87 0.00 0.00 58.31 54.58 3h0j n LYS 2034Cb 0.04 -0.62 0.08 0.00 -1.84 0.00 0.00 35.03 32.69 3h0j n LYS 2034CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3h0j n PHE 2035N -0.13 -1.79 -0.41 2.13 7.35 0.12 -4.98 117.46 119.76 3h0j n PHE 2035Ca 0.00 -2.31 -0.17 0.00 -0.76 0.00 0.00 57.45 54.21 3h0j n PHE 2035Cb 0.46 1.11 0.15 0.00 0.35 0.00 0.00 39.48 41.55 3h0j n PHE 2035CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3h0j n ARG 2036N -0.13 -3.00 0.00 -4.13 1.74 -1.25 -4.64 116.66 105.26 3h0j n ARG 2036Ca 0.05 -0.86 0.12 0.00 -0.77 0.00 0.00 57.85 56.38 3h0j n ARG 2036Cb 0.78 -0.98 0.66 0.00 -1.02 0.00 0.00 32.46 31.91 3h0j n ARG 2036CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 3h0j n ARG 2037N -3.77 0.63 -0.07 5.56 0.63 -1.26 -2.03 116.66 116.36 3h0j n ARG 2037Ca 0.08 0.02 -0.05 0.00 -0.92 0.00 0.00 57.85 56.98 3h0j n ARG 2037Cb 0.32 -1.50 -0.02 0.00 0.45 0.00 0.00 32.46 31.72 3h0j n ARG 2037CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3h0j h GLU 2038N 0.00 0.00 0.00 -0.14 4.22 -2.01 -3.30 114.58 113.35 3h0j h GLU 2038Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.44 3h0j h GLU 2038Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3h0j h GLU 2038CO 0.00 0.05 -0.01 -0.22 -2.18 0.00 0.00 179.01 176.65 3h0j h LYS 2039N -1.00 0.00 0.00 1.92 3.64 -1.90 -1.63 116.57 117.61 3h0j h LYS 2039Ca -0.02 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 3h0j h LYS 2039Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3h0j h LYS 2039CO -0.01 0.01 -0.25 1.25 -2.27 0.00 0.00 179.45 178.18 3h0j h LEU 2040N 0.00 0.00 0.22 5.20 5.85 -1.57 -3.14 115.31 121.86 3h0j h LEU 2040Ca -0.00 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.39 3h0j h LEU 2040Cb 0.34 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.40 3h0j h LEU 2040CO 0.00 0.25 -1.49 -0.07 -0.34 0.00 0.00 178.44 176.79 3h0j h LEU 2041N 0.00 0.72 -1.54 2.25 4.07 -1.37 -2.29 115.31 117.15 3h0j h LEU 2041Ca -0.00 -0.82 0.09 0.00 0.08 0.00 0.00 57.88 57.22 3h0j h LEU 2041Cb 0.87 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 42.34 3h0j h LEU 2041CO 0.03 1.65 0.43 0.44 -1.08 0.00 0.00 178.44 179.91 3h0j h ASP 2042N 0.13 0.47 0.30 -0.43 5.19 -1.50 0.62 116.42 121.20 3h0j h ASP 2042Ca -0.25 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 3h0j h ASP 2042Cb 2.12 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 41.54 3h0j h ASP 2042CO 0.25 0.29 -0.26 0.35 -3.12 0.00 0.00 179.24 176.75 3h0j n THR 2043N -4.48 0.00 0.34 0.35 -2.24 -1.20 -3.18 114.28 103.87 3h0j n THR 2043Ca 0.10 -0.10 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 3h0j n THR 2043Cb 0.32 0.29 0.53 0.00 -2.10 0.00 0.00 70.33 69.37 3h0j n THR 2043CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 3h0j n MET 2044N -0.81 0.19 -2.01 -0.78 0.00 0.22 -4.09 117.12 109.84 3h0j n MET 2044Ca 0.12 0.49 -0.31 0.00 0.00 0.00 0.00 57.70 57.99 3h0j n MET 2044Cb 0.34 -1.92 -0.06 0.00 0.00 0.00 0.00 33.22 31.58 3h0j n MET 2044CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3h0j n ASN 2045N -2.29 3.17 -0.18 6.12 3.02 -1.18 -3.45 115.26 120.48 3h0j n ASN 2045Ca 0.01 -2.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.85 3h0j n ASN 2045Cb 0.19 -1.68 0.00 0.00 -0.61 0.00 0.00 39.78 37.68 3h0j n ASN 2045CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3h0j n ARG 2046N 8.14 0.00 0.00 3.52 0.63 -1.26 -5.12 116.66 122.57 3h0j n ARG 2046Ca 0.46 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.39 3h0j n ARG 2046Cb 0.46 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.37 3h0j n ARG 2046CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 3h0j n LEU 2047N 0.00 0.00 0.00 6.15 -0.00 -1.22 -5.25 117.00 116.68 3h0j n LEU 2047Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 55.98 3h0j n LEU 2047Cb 0.25 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.69 3h0j n LEU 2047CO 0.00 0.00 0.09 -0.62 -0.00 0.00 0.00 177.39 176.86 3h0j n GLU 2081N 0.00 0.15 -0.02 1.96 -0.58 -1.26 -5.24 120.64 115.65 3h0j n GLU 2081Ca 0.00 -0.30 0.01 0.00 -0.42 0.00 0.00 57.16 56.45 3h0j n GLU 2081Cb 0.00 -0.14 0.02 0.00 -0.57 0.00 0.00 31.44 30.75 3h0j n GLU 2081CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 3h0j n LEU 2082N 0.00 1.79 -0.26 -4.62 -0.00 -1.26 -4.78 117.00 107.87 3h0j n LEU 2082Ca 0.02 -1.65 0.02 0.00 -0.00 0.00 0.00 56.01 54.41 3h0j n LEU 2082Cb 0.08 -0.02 0.11 0.00 -0.00 0.00 0.00 43.42 43.58 3h0j n LEU 2082CO 0.05 0.44 0.74 0.25 -0.00 0.00 0.00 177.39 178.88 3h0j h LEU 2083N 0.32 -0.60 0.00 1.47 5.85 -2.03 -1.19 115.31 119.12 3h0j h LEU 2083Ca 0.00 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3h0j h LEU 2083Cb 0.37 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.83 3h0j h LEU 2083CO 0.00 -0.23 0.00 -2.65 -0.34 0.00 0.00 178.44 175.22 3h0j n PRO 2084N -5.46 0.00 0.00 5.25 -0.02 -1.26 -1.42 135.00 132.09 3h0j n PRO 2084Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 3h0j n PRO 2084Cb 0.41 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3h0j n PRO 2084CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3h0j n ILE 2085N -0.90 0.00 1.33 4.25 2.08 -0.48 -4.59 119.36 121.06 3h0j n ILE 2085Ca 0.00 0.00 0.14 0.00 0.56 0.00 0.00 62.75 63.45 3h0j n ILE 2085Cb 0.00 -0.15 0.51 0.00 -0.75 0.00 0.00 39.64 39.25 3h0j n ILE 2085CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 3h0j n TYR 2086N -1.09 0.00 1.01 1.39 4.02 -0.78 -2.73 117.16 118.97 3h0j n TYR 2086Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 3h0j n TYR 2086Cb 0.14 -0.16 -0.06 0.00 -0.02 0.00 0.00 39.34 39.25 3h0j n TYR 2086CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h0j n GLY 2087N 1.31 -0.80 0.12 2.72 0.00 -0.51 -3.60 105.19 104.42 3h0j n GLY 2087Ca 0.13 -0.59 0.05 0.00 0.00 0.00 0.00 46.02 45.62 3h0j n GLY 2087CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3h0j h GLN 2088N 0.51 0.00 -0.14 1.61 5.75 -1.76 -3.21 115.11 117.87 3h0j h GLN 2088Ca 0.00 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.39 3h0j h GLN 2088Cb 0.55 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.10 3h0j h GLN 2088CO 0.00 0.20 -0.36 0.82 -2.65 0.00 0.00 178.83 176.84 3h0j h ILE 2089N 0.00 1.36 -0.22 2.39 1.08 -1.63 -2.48 117.51 118.01 3h0j h ILE 2089Ca -0.07 -1.64 0.06 0.00 -0.39 0.00 0.00 64.86 62.83 3h0j h ILE 2089Cb 1.31 2.04 -0.01 0.00 -3.07 0.00 0.00 36.82 37.09 3h0j h ILE 2089CO 0.03 0.49 0.20 0.77 -0.69 0.00 0.00 178.15 178.96 3h0j h SER 2090N 0.11 0.00 0.02 1.72 4.64 -1.62 0.13 113.55 118.56 3h0j h SER 2090Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3h0j h SER 2090Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3h0j h SER 2090CO 0.08 0.00 -0.01 -0.07 -0.87 0.00 0.00 176.83 175.96 3h0j h LEU 2091N 0.00 -0.03 -1.40 5.97 3.38 -1.52 -3.02 115.31 118.70 3h0j h LEU 2091Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3h0j h LEU 2091Cb 0.51 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3h0j h LEU 2091CO -0.00 0.15 0.32 1.56 0.09 0.00 0.00 178.44 180.56 3h0j h GLN 2092N -0.38 0.00 0.12 1.13 1.08 -1.23 0.28 115.11 116.12 3h0j h GLN 2092Ca -0.00 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.01 3h0j h GLN 2092Cb 0.03 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.48 3h0j h GLN 2092CO 0.01 0.00 -0.82 0.35 -0.95 0.00 0.00 178.83 177.41 3h0j h PHE 2093N 0.00 0.59 -0.11 2.96 3.57 -0.83 -3.14 116.94 119.98 3h0j h PHE 2093Ca 0.00 -0.41 -0.19 0.00 3.53 0.00 0.00 57.97 60.90 3h0j h PHE 2093Cb 0.65 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 3h0j h PHE 2093CO 0.00 1.30 -0.72 0.00 -2.23 0.00 0.00 178.31 176.66 3h0j h ALA 2094N 0.14 0.53 0.00 2.41 0.00 -0.44 -3.16 119.26 118.74 3h0j h ALA 2094Ca -0.14 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3h0j h ALA 2094Cb 1.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.36 3h0j h ALA 2094CO 0.16 0.73 0.00 0.22 0.00 0.00 0.00 179.25 180.36 3h0j h ASP 2095N 0.37 0.00 1.10 0.00 1.82 -0.89 -2.19 116.42 116.63 3h0j h ASP 2095Ca -0.03 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.61 3h0j h ASP 2095Cb 1.31 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.32 3h0j h ASP 2095CO 0.13 0.00 0.00 0.18 -1.61 0.00 0.00 179.24 177.94 3h0j n LEU 2096N -3.02 0.43 0.03 2.28 4.77 -1.19 -2.75 117.00 117.56 3h0j n LEU 2096Ca -0.01 0.56 -0.10 0.00 -0.03 0.00 0.00 56.01 56.42 3h0j n LEU 2096Cb 0.16 -0.44 -0.13 0.00 -2.33 0.00 0.00 43.42 40.68 3h0j n LEU 2096CO 0.22 -0.18 -0.23 0.45 -1.33 0.00 0.00 177.39 176.32 3h0j h HIS 2097N 0.00 0.13 0.00 -1.77 3.86 -1.56 -3.35 115.15 112.45 3h0j h HIS 2097Ca 0.00 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.12 3h0j h HIS 2097Cb 0.55 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.02 3h0j h HIS 2097CO 0.00 1.11 0.00 -0.25 0.86 0.00 0.00 177.93 179.65 3h0j n ASP 2098N -3.27 0.77 -4.92 2.45 10.43 -1.11 -4.72 116.55 116.18 3h0j n ASP 2098Ca -0.11 -1.58 -0.27 0.00 2.57 0.00 0.00 54.79 55.41 3h0j n ASP 2098Cb 1.01 -0.39 -0.03 0.00 1.84 0.00 0.00 41.12 43.56 3h0j n ASP 2098CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3h0j s ARG 2099N -1.02 3.57 0.30 -1.24 1.81 -1.26 -2.13 118.95 118.98 3h0j s ARG 2099Ca 0.00 -0.16 0.04 0.00 -1.72 0.00 0.00 55.73 53.89 3h0j s ARG 2099Cb 0.00 -2.69 0.64 0.00 -0.45 0.00 0.00 34.95 32.44 3h0j s ARG 2099CO 0.00 0.24 1.83 0.66 -0.68 0.00 0.00 175.30 177.35 3h0j h SER 2100N 1.53 0.86 -0.88 0.23 4.64 -1.84 -1.52 113.55 116.57 3h0j h SER 2100Ca -0.48 0.06 0.20 0.00 -0.47 0.00 0.00 61.79 61.09 3h0j h SER 2100Cb 1.20 -0.11 -0.11 0.00 -0.31 0.00 0.00 62.40 63.06 3h0j h SER 2100CO 0.65 0.42 0.41 0.28 -0.87 0.00 0.00 176.83 177.72 3h0j h SER 2101N 0.90 0.39 -0.09 4.97 0.02 -1.93 0.37 113.55 118.18 3h0j h SER 2101Ca 0.51 0.13 -0.15 0.00 -0.84 0.00 0.00 61.79 61.44 3h0j h SER 2101Cb 0.62 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 3h0j h SER 2101CO -0.28 0.07 -0.48 -0.09 -1.14 0.00 0.00 176.83 174.91 3h0j h ARG 2102N 0.47 0.65 -0.78 3.45 2.43 -1.57 -1.98 114.38 117.05 3h0j h ARG 2102Ca 0.53 -0.37 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 3h0j h ARG 2102Cb 0.93 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.47 3h0j h ARG 2102CO -0.48 0.98 0.36 0.52 -1.51 0.00 0.00 179.97 179.84 3h0j h MET 2103N 0.51 1.13 -0.23 0.20 2.86 -0.18 0.41 114.93 119.63 3h0j h MET 2103Ca 0.03 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.45 3h0j h MET 2103Cb 1.02 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.48 3h0j h MET 2103CO 0.10 0.89 -0.02 0.28 1.06 0.00 0.00 176.91 179.22 3h0j h VAL 2104N 1.10 1.26 -0.30 -2.22 2.07 -0.68 -1.43 116.25 116.06 3h0j h VAL 2104Ca 0.26 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3h0j h VAL 2104Cb 0.14 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 3h0j h VAL 2104CO -0.03 0.29 0.16 0.00 0.02 0.00 0.00 177.57 178.01 3h0j h ALA 2105N 0.79 0.38 0.00 1.67 0.00 -1.06 -2.00 119.26 119.03 3h0j h ALA 2105Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h0j h ALA 2105Cb 0.44 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3h0j h ALA 2105CO 0.01 -0.09 0.00 1.63 0.00 0.00 0.00 179.25 180.80 3h0j n LYS 2106N -4.82 0.27 -1.81 0.00 4.76 0.14 -4.90 118.16 111.81 3h0j n LYS 2106Ca -0.02 0.10 -0.10 0.00 -2.87 0.00 0.00 58.31 55.43 3h0j n LYS 2106Cb 0.08 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.75 3h0j n LYS 2106CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h0j n GLY 2107N 0.36 0.44 0.58 0.72 0.00 -0.75 -4.94 105.19 101.61 3h0j n GLY 2107Ca 0.09 -0.53 0.12 0.00 0.00 0.00 0.00 46.02 45.70 3h0j n GLY 2107CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3h0j n VAL 2108N -3.48 0.00 -4.04 1.61 0.24 -0.61 -4.92 118.33 107.14 3h0j n VAL 2108Ca -0.11 -0.30 -0.10 0.00 -2.04 0.00 0.00 64.34 61.79 3h0j n VAL 2108Cb 0.47 1.10 -0.11 0.00 -1.47 0.00 0.00 33.84 33.83 3h0j n VAL 2108CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 3h0j s ILE 2109N -2.30 0.28 0.23 1.34 -4.36 -1.23 -4.80 121.20 110.36 3h0j s ILE 2109Ca 0.24 -1.23 0.08 0.00 -0.26 0.00 0.00 60.65 59.48 3h0j s ILE 2109Cb 0.19 -0.73 -0.07 0.00 1.25 0.00 0.00 42.46 43.10 3h0j s ILE 2109CO 0.46 -0.61 1.53 0.28 0.24 0.00 0.00 174.94 176.84 3h0j h SER 2110N 4.14 0.10 -4.44 4.36 0.02 -1.24 -3.43 113.55 113.05 3h0j h SER 2110Ca -0.34 -0.06 0.18 0.00 -0.84 0.00 0.00 61.79 60.73 3h0j h SER 2110Cb 1.19 -0.03 -0.17 0.00 0.14 0.00 0.00 62.40 63.53 3h0j h SER 2110CO 0.48 0.76 0.64 -0.54 -1.14 0.00 0.00 176.83 177.03 3h0j s LYS 2111N -3.49 0.58 -0.14 3.45 1.02 -1.26 -5.09 119.74 114.81 3h0j s LYS 2111Ca -0.02 -0.21 -0.06 0.00 0.02 0.00 0.00 55.97 55.70 3h0j s LYS 2111Cb 0.12 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.66 3h0j s LYS 2111CO 0.79 -0.25 0.07 -1.83 -0.92 0.00 0.00 175.35 173.21 3h0j s GLU 2112N -2.76 3.62 0.41 1.68 -1.05 -1.26 -2.87 118.70 116.46 3h0j s GLU 2112Ca 0.07 -0.29 0.05 0.00 -0.15 0.00 0.00 54.97 54.65 3h0j s GLU 2112Cb -0.01 -3.13 -0.06 0.00 -0.44 0.00 0.00 34.13 30.49 3h0j s GLU 2112CO -0.07 0.52 0.03 -0.51 0.95 0.00 0.00 175.26 176.17 3h0j s LEU 2113N -0.31 2.58 -0.30 1.83 1.43 -0.39 -4.86 118.68 118.66 3h0j s LEU 2113Ca 0.09 -1.44 -0.03 0.00 -1.03 0.00 0.00 54.13 51.73 3h0j s LEU 2113Cb -0.12 -0.72 0.04 0.00 0.03 0.00 0.00 46.19 45.43 3h0j s LEU 2113CO 0.01 -0.58 0.01 -1.61 0.23 0.00 0.00 176.35 174.42 3h0j s GLU 2114N -3.78 2.53 0.25 1.70 2.02 -1.26 -0.01 118.70 120.15 3h0j s GLU 2114Ca 0.30 -1.20 0.11 0.00 0.02 0.00 0.00 54.97 54.19 3h0j s GLU 2114Cb 0.08 -3.21 0.83 0.00 0.10 0.00 0.00 34.13 31.93 3h0j s GLU 2114CO 0.15 -0.59 1.11 1.87 0.02 0.00 0.00 175.26 177.82 3h0j n TRP 2115N 4.67 0.71 0.16 1.61 -0.00 -1.26 0.20 117.44 123.53 3h0j n TRP 2115Ca -0.13 0.84 0.03 0.00 -0.00 0.00 0.00 57.50 58.24 3h0j n TRP 2115Cb 0.44 -1.19 0.42 0.00 -0.00 0.00 0.00 31.31 30.98 3h0j n TRP 2115CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 177.69 178.84 3h0j h THR 2116N 0.00 1.17 -0.24 5.87 2.02 -1.94 -2.38 112.91 117.41 3h0j h THR 2116Ca 0.55 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.94 3h0j h THR 2116Cb 1.37 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 3h0j h THR 2116CO -0.58 0.24 0.00 -0.62 0.37 0.00 0.00 175.52 174.93 3h0j n GLU 2117N -4.27 2.39 -0.05 6.66 -0.58 0.53 -1.98 120.64 123.35 3h0j n GLU 2117Ca -0.01 -2.12 -0.08 0.00 -0.42 0.00 0.00 57.16 54.52 3h0j n GLU 2117Cb 0.28 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.64 3h0j n GLU 2117CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h0j h ALA 2118N 4.50 0.17 -0.28 0.62 0.00 -0.74 -1.65 119.26 121.88 3h0j h ALA 2118Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3h0j h ALA 2118Cb 0.98 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 3h0j h ALA 2118CO 0.00 -0.44 -0.16 -0.09 0.00 0.00 0.00 179.25 178.56 3h0j h ARG 2119N 0.04 -0.12 -0.69 0.00 2.43 -1.80 0.17 114.38 114.41 3h0j h ARG 2119Ca 0.10 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.31 3h0j h ARG 2119Cb 0.14 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 3h0j h ARG 2119CO -0.19 -0.08 0.43 0.00 -1.51 0.00 0.00 179.97 178.62 3h0j h ARG 2120N -0.13 0.81 0.64 0.20 3.08 -1.68 -0.79 114.38 116.52 3h0j h ARG 2120Ca 0.15 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 3h0j h ARG 2120Cb 0.36 -0.18 0.01 0.00 0.08 0.00 0.00 29.97 30.23 3h0j h ARG 2120CO -0.36 0.54 -0.31 0.35 -1.07 0.00 0.00 179.97 179.12 3h0j h PHE 2121N 0.84 -0.80 -0.76 3.04 3.57 -0.35 -3.17 116.94 119.31 3h0j h PHE 2121Ca 0.28 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.86 3h0j h PHE 2121Cb 0.02 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 3h0j h PHE 2121CO -0.04 -0.50 0.50 0.74 -2.23 0.00 0.00 178.31 176.78 3h0j h PHE 2122N -1.05 0.71 -0.42 0.41 0.05 -0.69 -0.28 116.94 115.68 3h0j h PHE 2122Ca -0.09 0.02 0.03 0.00 3.82 0.00 0.00 57.97 61.75 3h0j h PHE 2122Cb 0.66 -0.23 -0.04 0.00 2.00 0.00 0.00 35.95 38.34 3h0j h PHE 2122CO 0.03 0.33 0.21 0.35 -0.18 0.00 0.00 178.31 179.05 3h0j h PHE 2123N 0.67 0.38 0.04 -0.55 3.57 -1.19 0.97 116.94 120.83 3h0j h PHE 2123Ca 0.35 0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.63 3h0j h PHE 2123Cb 0.47 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.11 3h0j h PHE 2123CO -0.00 0.20 -1.03 -1.49 -2.23 0.00 0.00 178.31 173.76 3h0j h TRP 2124N 0.42 0.57 -0.11 0.41 4.06 -1.34 -2.00 115.95 117.96 3h0j h TRP 2124Ca 0.18 -0.34 -0.00 0.00 2.06 0.00 0.00 58.89 60.79 3h0j h TRP 2124Cb 0.09 -0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.19 3h0j h TRP 2124CO -0.10 1.18 0.07 -0.09 -3.56 0.00 0.00 178.44 175.94 3h0j h ARG 2125N 0.18 0.15 -0.03 0.49 9.65 -0.87 0.24 114.38 124.18 3h0j h ARG 2125Ca -0.10 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.77 3h0j h ARG 2125Cb 1.69 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 30.24 3h0j h ARG 2125CO 0.17 0.13 0.02 1.25 2.80 0.00 0.00 179.97 184.34 3h0j h LEU 2126N 0.12 0.04 -0.86 3.80 5.85 -0.86 0.22 115.31 123.62 3h0j h LEU 2126Ca 0.04 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.73 3h0j h LEU 2126Cb 0.02 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 3h0j h LEU 2126CO -0.01 0.13 0.53 -0.09 -0.34 0.00 0.00 178.44 178.66 3h0j h ARG 2127N -0.06 0.90 0.15 1.25 9.65 -1.22 0.13 114.38 125.19 3h0j h ARG 2127Ca 0.01 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 3h0j h ARG 2127Cb 0.10 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.48 3h0j h ARG 2127CO -0.00 0.60 -0.07 -0.09 2.80 0.00 0.00 179.97 183.21 3h0j h ARG 2128N 0.93 -0.19 -0.10 0.20 1.12 -0.09 -2.21 114.38 114.04 3h0j h ARG 2128Ca 0.39 0.01 0.04 0.00 -1.11 0.00 0.00 59.98 59.31 3h0j h ARG 2128Cb 0.24 0.04 -0.05 0.00 -0.01 0.00 0.00 29.97 30.20 3h0j h ARG 2128CO -0.20 0.07 -0.19 0.00 -3.11 0.00 0.00 179.97 176.54 3h0j h ARG 2129N -0.44 -0.24 -0.30 0.20 2.47 0.03 -1.08 114.38 115.03 3h0j h ARG 2129Ca -0.02 0.02 0.05 0.00 -1.26 0.00 0.00 59.98 58.76 3h0j h ARG 2129Cb 0.35 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.68 3h0j h ARG 2129CO 0.03 -0.16 0.04 -0.07 0.56 0.00 0.00 179.97 180.37 3h0j h LEU 2130N -0.25 -0.03 -0.88 3.04 3.38 -0.79 0.13 115.31 119.91 3h0j h LEU 2130Ca 0.09 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.17 3h0j h LEU 2130Cb 0.38 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 3h0j h LEU 2130CO -0.25 0.02 0.55 0.78 0.09 0.00 0.00 178.44 179.63 3h0j h ASN 2131N 0.14 0.89 0.23 -0.43 -0.26 -1.06 0.99 115.58 116.07 3h0j h ASN 2131Ca 0.14 0.01 -0.13 0.00 -0.56 0.00 0.00 56.30 55.76 3h0j h ASN 2131Cb 0.17 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 3h0j h ASN 2131CO -0.21 0.58 -0.49 -0.33 -1.06 0.00 0.00 177.43 175.93 3h0j h GLU 2132N 1.03 0.30 -0.28 0.81 5.08 -0.40 -2.23 114.58 118.89 3h0j h GLU 2132Ca 0.37 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.47 3h0j h GLU 2132Cb 0.12 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3h0j h GLU 2132CO -0.16 0.73 -0.20 0.93 -1.00 0.00 0.00 179.01 179.31 3h0j h GLU 2133N 0.24 0.63 -0.96 2.33 4.39 0.32 -0.69 114.58 120.84 3h0j h GLU 2133Ca 0.01 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3h0j h GLU 2133Cb 0.95 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.55 3h0j h GLU 2133CO 0.08 0.89 0.60 -0.92 -1.16 0.00 0.00 179.01 178.50 3h0j h TYR 2134N 0.36 1.24 -0.57 4.33 5.03 -0.79 -0.18 116.97 126.39 3h0j h TYR 2134Ca 0.05 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.27 3h0j h TYR 2134Cb 0.74 -0.41 -0.02 0.00 1.55 0.00 0.00 36.73 38.59 3h0j h TYR 2134CO 0.07 0.81 -0.04 -0.07 -1.32 0.00 0.00 178.16 177.60 3h0j h LEU 2135N 1.31 1.03 -0.70 2.82 3.38 -1.23 0.14 115.31 122.07 3h0j h LEU 2135Ca 0.35 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3h0j h LEU 2135Cb -0.09 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.34 3h0j h LEU 2135CO -0.07 1.11 0.39 0.40 0.09 0.00 0.00 178.44 180.36 3h0j h ILE 2136N 0.93 1.21 0.13 1.22 2.04 -0.36 -1.04 117.51 121.64 3h0j h ILE 2136Ca 0.16 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 3h0j h ILE 2136Cb 0.61 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3h0j h ILE 2136CO 0.04 0.23 -0.06 0.11 0.00 0.00 0.00 178.15 178.47 3h0j h LYS 2137N 0.96 -0.17 -0.32 2.37 1.57 -0.80 0.20 116.57 120.38 3h0j h LYS 2137Ca 0.25 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.13 3h0j h LYS 2137Cb 0.03 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3h0j h LYS 2137CO -0.04 0.05 0.48 0.00 -0.57 0.00 0.00 179.45 179.37 3h0j h ARG 2138N -0.38 0.00 0.00 3.15 3.08 -0.66 -0.78 114.38 118.79 3h0j h ARG 2138Ca -0.02 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 3h0j h ARG 2138Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 3h0j h ARG 2138CO 0.03 0.00 -0.46 1.25 -1.07 0.00 0.00 179.97 179.72 3h0j h LEU 2139N 0.00 0.00 -1.97 3.04 5.85 0.03 -3.17 115.31 119.09 3h0j h LEU 2139Ca 0.15 -0.64 0.07 0.00 0.84 0.00 0.00 57.88 58.30 3h0j h LEU 2139Cb 1.11 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 3h0j h LEU 2139CO -0.00 1.09 0.40 0.28 -0.34 0.00 0.00 178.44 179.87 3h0j h SER 2140N -1.00 0.00 0.20 1.25 0.02 0.73 0.69 113.55 115.45 3h0j h SER 2140Ca -0.12 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.54 3h0j h SER 2140Cb 0.95 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.51 3h0j h SER 2140CO -0.07 0.00 -1.36 -0.74 -1.14 0.00 0.00 176.83 173.51 3h0j h HIS 2141N 0.00 0.77 0.00 3.45 2.76 -1.41 -3.25 115.15 117.47 3h0j h HIS 2141Ca 0.11 -0.56 0.00 0.00 -2.20 0.00 0.00 60.37 57.72 3h0j h HIS 2141Cb 0.91 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.84 3h0j h HIS 2141CO 0.00 1.53 0.00 0.94 -1.30 0.00 0.00 177.93 179.10 3h0j n GLN 2142N -3.82 0.00 -1.48 5.26 -0.06 0.24 -4.25 117.38 113.26 3h0j n GLN 2142Ca -0.19 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.39 3h0j n GLN 2142Cb 1.01 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 27.16 3h0j n GLN 2142CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 3h0j n VAL 2143N 0.00 2.75 -3.38 1.69 0.31 -1.25 -4.87 118.33 113.58 3h0j n VAL 2143Ca 0.00 -2.40 -0.42 0.00 -0.01 0.00 0.00 64.34 61.51 3h0j n VAL 2143Cb 0.00 -2.49 -0.09 0.00 -0.91 0.00 0.00 33.84 30.35 3h0j n VAL 2143CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3h0j s GLY 2144N 3.97 1.91 0.00 2.92 0.00 -1.23 -4.71 107.32 110.18 3h0j s GLY 2144Ca 0.51 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.86 3h0j s GLY 2144CO -0.00 1.04 0.00 -1.84 0.00 0.00 0.00 173.10 172.30 3h0j n GLU 2145N 5.44 0.00 -4.15 2.90 0.00 -1.26 -4.92 120.64 118.65 3h0j n GLU 2145Ca -0.09 0.00 -0.16 0.00 0.00 0.00 0.00 57.16 56.91 3h0j n GLU 2145Cb 0.48 0.00 -0.12 0.00 0.00 0.00 0.00 31.44 31.80 3h0j n GLU 2145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3h0j s ALA 2146N 0.00 0.87 0.99 -1.84 0.00 -1.26 -5.14 121.76 115.37 3h0j s ALA 2146Ca 0.00 -0.83 -0.16 0.00 0.00 0.00 0.00 51.96 50.97 3h0j s ALA 2146Cb 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 23.12 22.99 3h0j s ALA 2146CO 0.00 0.09 -0.41 0.45 0.00 0.00 0.00 175.76 175.89 3h0j n SER 2147N 1.54 -4.55 0.11 0.00 2.88 -1.26 -4.72 113.62 107.61 3h0j n SER 2147Ca -0.21 0.22 -0.13 0.00 -1.33 0.00 0.00 58.87 57.42 3h0j n SER 2147Cb 0.55 -0.91 -0.08 0.00 -0.75 0.00 0.00 64.21 63.02 3h0j n SER 2147CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3h0j h ARG 2148N -1.21 -0.28 -0.87 -1.46 2.43 -2.00 -2.47 114.38 108.52 3h0j h ARG 2148Ca -0.44 0.02 0.23 0.00 -0.81 0.00 0.00 59.98 58.98 3h0j h ARG 2148Cb 1.30 0.06 -0.14 0.00 -0.42 0.00 0.00 29.97 30.77 3h0j h ARG 2148CO 0.27 0.04 0.25 1.25 -1.51 0.00 0.00 179.97 180.27 3h0j h LEU 2149N -0.63 0.04 -1.03 3.80 7.12 -2.00 0.21 115.31 122.83 3h0j h LEU 2149Ca -0.03 0.19 -0.08 0.00 0.13 0.00 0.00 57.88 58.09 3h0j h LEU 2149Cb 0.45 0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.81 3h0j h LEU 2149CO 0.05 -0.13 -0.18 -0.33 -0.13 0.00 0.00 178.44 177.72 3h0j h GLU 2150N 0.23 0.48 0.04 1.25 5.08 -1.87 -2.03 114.58 117.77 3h0j h GLU 2150Ca 0.54 -0.16 -0.24 0.00 -1.00 0.00 0.00 59.36 58.50 3h0j h GLU 2150Cb 1.07 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.28 3h0j h GLU 2150CO -0.63 0.65 -1.04 0.87 -1.00 0.00 0.00 179.01 177.86 3h0j h LYS 2151N 0.44 0.39 -0.43 2.33 1.57 -0.18 -2.34 116.57 118.34 3h0j h LYS 2151Ca 0.07 -0.47 -0.07 0.00 -1.87 0.00 0.00 60.65 58.31 3h0j h LYS 2151Cb 0.57 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 3h0j h LYS 2151CO 0.04 1.15 -0.00 0.82 -0.57 0.00 0.00 179.45 180.89 3h0j h ILE 2152N 0.19 1.26 -0.19 1.86 2.04 -1.01 -2.24 117.51 119.42 3h0j h ILE 2152Ca -0.10 -1.04 0.03 0.00 1.00 0.00 0.00 64.86 64.75 3h0j h ILE 2152Cb 1.70 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.83 3h0j h ILE 2152CO 0.18 0.36 0.03 0.00 0.00 0.00 0.00 178.15 178.71 3h0j h ALA 2153N 0.90 0.18 -0.78 1.87 0.00 -1.37 0.33 119.26 120.39 3h0j h ALA 2153Ca 0.12 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3h0j h ALA 2153Cb 0.49 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3h0j h ALA 2153CO 0.02 -0.41 0.52 -0.09 0.00 0.00 0.00 179.25 179.29 3h0j h ARG 2154N 0.10 0.96 0.03 0.00 1.12 -1.31 0.37 114.38 115.66 3h0j h ARG 2154Ca 0.09 -0.06 -0.00 0.00 -1.11 0.00 0.00 59.98 58.90 3h0j h ARG 2154Cb 0.09 -0.22 0.00 0.00 -0.01 0.00 0.00 29.97 29.83 3h0j h ARG 2154CO -0.12 0.64 -0.01 0.82 -3.11 0.00 0.00 179.97 178.18 3h0j h ILE 2155N 0.99 1.37 -0.92 1.20 2.04 -0.77 -3.25 117.51 118.17 3h0j h ILE 2155Ca 0.30 -1.32 0.14 0.00 1.00 0.00 0.00 64.86 64.98 3h0j h ILE 2155Cb -0.01 2.24 -0.09 0.00 -0.74 0.00 0.00 36.82 38.22 3h0j h ILE 2155CO -0.08 0.33 0.54 0.03 0.00 0.00 0.00 178.15 178.97 3h0j h ARG 2156N -0.63 0.78 0.00 2.37 2.47 -0.01 0.97 114.38 120.34 3h0j h ARG 2156Ca -0.00 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 3h0j h ARG 2156Cb 0.58 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 3h0j h ARG 2156CO 0.01 0.51 0.00 -1.13 0.56 0.00 0.00 179.97 179.92 3h0j n SER 2157N -4.75 0.14 0.04 7.04 3.41 0.09 -1.05 113.62 118.55 3h0j n SER 2157Ca 0.18 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 3h0j n SER 2157Cb 0.40 -0.58 0.28 0.00 -0.26 0.00 0.00 64.21 64.06 3h0j n SER 2157CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3h0j n TRP 2158N -1.69 0.37 -2.23 7.33 8.01 0.34 -4.83 117.44 124.74 3h0j n TRP 2158Ca 0.01 0.11 -0.42 0.00 -1.31 0.00 0.00 57.50 55.88 3h0j n TRP 2158Cb 0.05 -0.56 -0.03 0.00 -2.01 0.00 0.00 31.31 28.77 3h0j n TRP 2158CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 3h0j s TYR 2159N -3.09 3.29 0.89 -5.99 4.12 -0.21 -4.98 117.35 111.37 3h0j s TYR 2159Ca 0.09 1.08 -0.12 0.00 0.02 0.00 0.00 57.07 58.14 3h0j s TYR 2159Cb 0.15 -3.61 0.10 0.00 -1.52 0.00 0.00 41.96 37.07 3h0j s TYR 2159CO 0.67 -2.06 0.96 -2.30 0.02 0.00 0.00 175.55 172.84 3h0j n PRO 2160N 3.66 -0.22 0.28 -1.71 -0.02 -1.26 -4.87 135.00 130.86 3h0j n PRO 2160Ca 0.10 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.70 3h0j n PRO 2160Cb 0.43 -2.24 0.80 0.00 -0.02 0.00 0.00 33.50 32.47 3h0j n PRO 2160CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h0j h ALA 2161N -1.48 1.73 -0.04 3.55 0.00 -1.97 -1.70 119.26 119.35 3h0j h ALA 2161Ca -0.44 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 3h0j h ALA 2161Cb 1.28 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3h0j h ALA 2161CO 0.41 0.00 -0.32 0.66 0.00 0.00 0.00 179.25 180.00 3h0j h SER 2162N 0.00 0.07 -3.43 0.00 4.64 -2.02 -3.44 113.55 109.37 3h0j h SER 2162Ca -0.00 -0.02 -0.52 0.00 -0.47 0.00 0.00 61.79 60.78 3h0j h SER 2162Cb 0.00 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3h0j h SER 2162CO 0.00 0.39 0.52 -0.69 -0.87 0.00 0.00 176.83 176.18 3h0j s VAL 2163N -4.32 3.85 -0.57 0.95 1.01 -0.64 -5.00 120.40 115.68 3h0j s VAL 2163Ca -0.04 1.49 -0.20 0.00 0.00 0.00 0.00 61.98 63.23 3h0j s VAL 2163Cb 0.15 -3.95 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3h0j s VAL 2163CO 0.73 0.21 0.76 -0.62 0.00 0.00 0.00 175.10 176.18 3h0j s ASP 2164N 0.33 6.21 0.38 3.32 2.15 -1.26 -4.87 116.67 122.94 3h0j s ASP 2164Ca 0.53 -1.02 0.22 0.00 0.43 0.00 0.00 52.55 52.71 3h0j s ASP 2164Cb -0.30 -2.34 1.30 0.00 -0.30 0.00 0.00 42.92 41.28 3h0j s ASP 2164CO 0.34 -1.12 1.62 0.45 -0.17 0.00 0.00 175.17 176.29 3h0j h HIS 2165N 9.21 0.76 0.00 -5.34 3.86 -1.94 0.46 115.15 122.16 3h0j h HIS 2165Ca -0.28 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 3h0j h HIS 2165Cb 1.08 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 29.37 3h0j h HIS 2165CO 0.84 -0.30 0.00 0.39 0.86 0.00 0.00 177.93 179.72 3h0j n GLU 2166N -5.01 0.04 -3.47 2.45 4.71 -1.26 -4.71 120.64 113.38 3h0j n GLU 2166Ca 0.36 0.13 -0.41 0.00 -0.01 0.00 0.00 57.16 57.23 3h0j n GLU 2166Cb 1.24 -1.55 -0.10 0.00 -1.01 0.00 0.00 31.44 30.02 3h0j n GLU 2166CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3h0j s ASP 2167N -3.23 6.11 0.08 1.62 -1.08 0.16 -4.99 116.67 115.35 3h0j s ASP 2167Ca 0.11 -0.42 -0.32 0.00 -0.52 0.00 0.00 52.55 51.40 3h0j s ASP 2167Cb 0.15 -2.16 -0.15 0.00 -1.46 0.00 0.00 42.92 39.29 3h0j s ASP 2167CO 0.44 -0.31 1.50 0.44 0.52 0.00 0.00 175.17 177.77 3h0j h ASP 2168N 8.51 -1.33 -0.72 -0.34 3.45 -1.84 -1.80 116.42 122.34 3h0j h ASP 2168Ca -0.30 0.12 0.07 0.00 0.43 0.00 0.00 57.03 57.35 3h0j h ASP 2168Cb 1.15 0.46 -0.05 0.00 -0.56 0.00 0.00 39.33 40.33 3h0j h ASP 2168CO 0.67 -0.57 0.47 -0.09 -1.57 0.00 0.00 179.24 178.15 3h0j h ARG 2169N -0.83 0.69 0.48 3.56 2.43 -1.94 0.25 114.38 119.01 3h0j h ARG 2169Ca -0.04 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 3h0j h ARG 2169Cb 0.76 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3h0j h ARG 2169CO -0.13 0.46 -0.23 0.37 -1.51 0.00 0.00 179.97 178.93 3h0j h GLN 2170N 0.71 -0.62 -0.16 0.20 4.15 -1.88 0.12 115.11 117.64 3h0j h GLN 2170Ca 0.32 0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.82 3h0j h GLN 2170Cb 0.32 0.14 -0.07 0.00 0.21 0.00 0.00 27.48 28.08 3h0j h GLN 2170CO -0.11 -0.33 -0.42 0.28 -1.93 0.00 0.00 178.83 176.32 3h0j h VAL 2171N -1.07 0.15 -0.46 2.39 2.07 -1.10 0.28 116.25 118.51 3h0j h VAL 2171Ca -0.07 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.55 3h0j h VAL 2171Cb 0.57 0.15 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 3h0j h VAL 2171CO 0.11 0.00 -0.12 0.00 0.02 0.00 0.00 177.57 177.58 3h0j h ALA 2172N 0.16 0.30 -0.77 1.67 0.00 -0.55 -1.44 119.26 118.63 3h0j h ALA 2172Ca 0.08 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3h0j h ALA 2172Cb 0.62 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3h0j h ALA 2172CO -0.41 -0.45 0.38 1.15 0.00 0.00 0.00 179.25 179.92 3h0j h THR 2173N -0.00 1.24 -0.07 0.00 2.02 0.40 -2.61 112.91 113.89 3h0j h THR 2173Ca 0.22 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 3h0j h THR 2173Cb 0.34 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3h0j h THR 2173CO -0.48 0.28 0.01 -0.25 0.37 0.00 0.00 175.52 175.45 3h0j h TRP 2174N 1.09 0.12 -0.97 3.16 7.01 0.36 -1.04 115.95 125.68 3h0j h TRP 2174Ca 0.27 -0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.34 3h0j h TRP 2174Cb 0.09 -0.03 -0.07 0.00 -2.10 0.00 0.00 29.16 27.05 3h0j h TRP 2174CO 0.01 0.35 0.62 0.82 -2.79 0.00 0.00 178.44 177.45 3h0j h ILE 2175N -0.14 1.02 0.03 2.65 2.04 -1.20 -0.79 117.51 121.12 3h0j h ILE 2175Ca 0.02 -0.36 -0.23 0.00 1.00 0.00 0.00 64.86 65.29 3h0j h ILE 2175Cb 0.30 -0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.24 3h0j h ILE 2175CO 0.00 0.19 -0.98 -0.33 0.00 0.00 0.00 178.15 177.03 3h0j h GLU 2176N 1.06 0.29 -0.00 2.37 5.08 -1.36 -3.22 114.58 118.79 3h0j h GLU 2176Ca 0.44 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3h0j h GLU 2176Cb 0.30 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3h0j h GLU 2176CO -0.19 1.07 -0.12 0.39 -1.00 0.00 0.00 179.01 179.16 3h0j n GLU 2177N -3.66 0.45 -1.54 2.33 1.02 -0.40 -3.77 120.64 115.07 3h0j n GLU 2177Ca -0.06 -0.13 -0.07 0.00 -0.02 0.00 0.00 57.16 56.89 3h0j n GLU 2177Cb 0.87 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.88 3h0j n GLU 2177CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3h0j n ASN 2178N -1.16 2.89 -0.27 1.62 4.13 -0.35 -4.81 115.26 117.30 3h0j n ASN 2178Ca 0.12 -3.40 -0.04 0.00 1.68 0.00 0.00 54.58 52.95 3h0j n ASN 2178Cb 0.29 -0.42 0.12 0.00 -1.54 0.00 0.00 39.78 38.22 3h0j n ASN 2178CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 3h0j h TYR 2179N 1.67 1.14 -0.40 3.10 0.99 -1.64 -1.75 116.97 120.07 3h0j h TYR 2179Ca 0.10 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.82 3h0j h TYR 2179Cb 1.35 -0.35 -0.04 0.00 1.00 0.00 0.00 36.73 38.69 3h0j h TYR 2179CO 0.70 0.82 0.18 -0.22 -0.00 0.00 0.00 178.16 179.64 3h0j h LYS 2180N 1.13 0.36 0.61 4.88 3.11 -1.91 -1.47 116.57 123.28 3h0j h LYS 2180Ca 0.27 -0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 58.07 3h0j h LYS 2180Cb 0.11 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.25 3h0j h LYS 2180CO -0.03 0.24 -0.48 1.15 -2.81 0.00 0.00 179.45 177.52 3h0j h THR 2181N 0.37 0.05 -1.05 1.00 2.02 -1.83 -2.96 112.91 110.52 3h0j h THR 2181Ca 0.17 0.00 0.28 0.00 0.77 0.00 0.00 66.41 67.63 3h0j h THR 2181Cb 0.10 0.05 -0.08 0.00 -1.74 0.00 0.00 68.15 66.49 3h0j h THR 2181CO -0.14 0.00 0.70 -0.07 0.37 0.00 0.00 175.52 176.38 3h0j h LEU 2182N -1.06 0.32 -1.60 2.58 3.38 -0.99 0.20 115.31 118.13 3h0j h LEU 2182Ca -0.08 0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3h0j h LEU 2182Cb 0.89 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 3h0j h LEU 2182CO 0.01 0.07 0.28 0.44 0.09 0.00 0.00 178.44 179.33 3h0j h ASP 2183N 0.28 0.47 0.00 -0.43 3.32 -1.10 -1.95 116.42 117.01 3h0j h ASP 2183Ca 0.57 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.61 3h0j h ASP 2183Cb 1.65 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.09 3h0j h ASP 2183CO -0.21 0.33 -0.00 0.44 -1.72 0.00 0.00 179.24 178.09 3h0j h ASP 2184N 0.55 -0.00 -0.91 6.45 3.45 -0.68 0.13 116.42 125.41 3h0j h ASP 2184Ca 0.16 -0.83 0.25 0.00 0.43 0.00 0.00 57.03 57.04 3h0j h ASP 2184Cb -0.02 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 38.61 3h0j h ASP 2184CO -0.04 0.83 0.34 0.11 -1.57 0.00 0.00 179.24 178.92 3h0j h LYS 2185N -0.84 0.26 -0.03 3.56 6.56 -1.18 0.55 116.57 125.45 3h0j h LYS 2185Ca -0.00 -0.02 -0.23 0.00 -1.06 0.00 0.00 60.65 59.34 3h0j h LYS 2185Cb 0.83 -0.06 0.02 0.00 -0.57 0.00 0.00 32.23 32.45 3h0j h LYS 2185CO 0.00 0.17 -0.89 -0.07 -2.06 0.00 0.00 179.45 176.60 3h0j h LEU 2186N 0.26 0.84 -1.69 2.94 3.38 -1.39 -3.17 115.31 116.49 3h0j h LEU 2186Ca 0.60 -0.72 0.05 0.00 0.09 0.00 0.00 57.88 57.90 3h0j h LEU 2186Cb 1.24 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 3h0j h LEU 2186CO -0.63 1.44 0.50 0.50 0.09 0.00 0.00 178.44 180.35 3h0j h LYS 2187N 0.31 0.00 -5.96 1.13 1.63 0.29 -3.34 116.57 110.63 3h0j h LYS 2187Ca -0.10 0.00 -0.58 0.00 -0.85 0.00 0.00 60.65 59.11 3h0j h LYS 2187Cb 1.55 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 33.07 3h0j h LYS 2187CO 0.18 0.00 0.92 0.20 -3.45 0.00 0.00 179.45 177.29 3h0j s GLY 2188N -3.68 1.14 0.00 5.01 0.00 -0.53 -5.05 107.32 104.21 3h0j s GLY 2188Ca -0.03 -1.69 0.21 0.00 0.00 0.00 0.00 44.72 43.21 3h0j s GLY 2188CO 0.33 2.42 1.66 1.47 0.00 0.00 0.00 173.10 178.98