#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4l n PRO 1505N 0.00 2.40 -0.09 -2.82 -0.04 -1.26 -4.93 135.00 128.26 1a4l n PRO 1505Ca 0.00 0.84 -0.09 0.00 -0.04 0.00 0.00 63.50 64.21 1a4l n PRO 1505Cb 0.00 -2.52 -0.02 0.00 -0.04 0.00 0.00 33.50 30.92 1a4l n PRO 1505CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a4l h ALA 1506N 2.70 0.39 -3.07 0.55 0.00 -1.90 -3.37 119.26 114.56 1a4l h ALA 1506Ca -0.49 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 53.75 1a4l h ALA 1506Cb 1.26 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.53 1a4l h ALA 1506CO 0.63 -0.09 -0.72 0.12 0.00 0.00 0.00 179.25 179.19 1a4l s PHE 1507N -5.93 2.19 -1.35 0.00 5.36 -1.26 -4.96 117.98 112.03 1a4l s PHE 1507Ca -0.13 -2.54 -0.08 0.00 -0.96 0.00 0.00 56.93 53.22 1a4l s PHE 1507Cb 0.09 -2.05 0.11 0.00 -0.34 0.00 0.00 43.02 40.83 1a4l s PHE 1507CO 0.72 -0.78 2.22 -1.71 -1.46 0.00 0.00 175.22 174.21 1a4l n ASN 1508N 3.51 6.52 -3.93 6.13 5.15 -1.26 -4.88 115.26 126.50 1a4l n ASN 1508Ca 0.08 -3.04 -0.09 0.00 -0.60 0.00 0.00 54.58 50.92 1a4l n ASN 1508Cb 0.34 -1.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.09 1a4l n ASN 1508CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1a4l s LYS 1509N 0.23 1.59 0.18 1.20 1.02 -1.26 -5.14 119.74 117.56 1a4l s LYS 1509Ca 0.49 -1.28 -0.31 0.00 0.02 0.00 0.00 55.97 54.88 1a4l s LYS 1509Cb 0.14 0.48 -0.16 0.00 -0.52 0.00 0.00 37.83 37.77 1a4l s LYS 1509CO -0.05 -0.67 0.97 -2.30 -0.92 0.00 0.00 175.35 172.39 1a4l n PRO 1510N -0.40 0.80 -4.30 -1.68 -0.02 -1.26 -4.89 135.00 123.25 1a4l n PRO 1510Ca -0.02 0.28 -0.17 0.00 -2.02 0.00 0.00 63.50 61.58 1a4l n PRO 1510Cb 0.62 -1.64 -0.10 0.00 -0.02 0.00 0.00 33.50 32.36 1a4l n PRO 1510CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1a4l s LYS 1511N -0.72 1.20 -0.10 -0.52 1.02 -0.83 -4.95 119.74 114.83 1a4l s LYS 1511Ca 0.70 -1.50 0.00 0.00 0.02 0.00 0.00 55.97 55.19 1a4l s LYS 1511Cb -0.89 -0.92 0.02 0.00 -0.52 0.00 0.00 37.83 35.53 1a4l s LYS 1511CO 0.55 0.14 -0.10 0.08 -0.92 0.00 0.00 175.35 175.11 1a4l s VAL 1512N -3.02 1.11 -0.18 3.17 1.01 -1.26 -0.63 120.40 120.60 1a4l s VAL 1512Ca 0.19 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 1a4l s VAL 1512Cb 0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 1a4l s VAL 1512CO 0.04 0.37 -0.08 -0.70 0.00 0.00 0.00 175.10 174.73 1a4l s GLU 1513N 1.38 3.39 -0.00 2.72 2.12 -0.71 -4.77 118.70 122.83 1a4l s GLU 1513Ca -0.01 -0.65 0.10 0.00 0.36 0.00 0.00 54.97 54.78 1a4l s GLU 1513Cb -0.13 -2.84 -0.12 0.00 0.26 0.00 0.00 34.13 31.30 1a4l s GLU 1513CO -0.05 -0.00 0.41 1.28 -0.54 0.00 0.00 175.26 176.36 1a4l n LEU 1514N 4.19 0.42 -3.49 2.70 4.32 -1.26 -1.51 117.00 122.38 1a4l n LEU 1514Ca -0.18 -0.43 -0.28 0.00 -0.02 0.00 0.00 56.01 55.09 1a4l n LEU 1514Cb 0.52 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 42.20 1a4l n LEU 1514CO 0.30 0.11 -0.30 -2.28 -1.22 0.00 0.00 177.39 173.99 1a4l s HIS 1515N -2.08 1.10 -0.04 -1.77 2.46 -1.26 -4.75 115.29 108.95 1a4l s HIS 1515Ca 0.03 -2.02 -0.05 0.00 0.47 0.00 0.00 55.06 53.49 1a4l s HIS 1515Cb 0.08 -1.10 0.01 0.00 -0.13 0.00 0.00 32.58 31.44 1a4l s HIS 1515CO 0.43 -0.81 0.14 0.54 -2.47 0.00 0.00 174.74 172.56 1a4l s VAL 1516N 0.55 0.01 -0.29 0.89 0.11 -1.25 -1.59 120.40 118.83 1a4l s VAL 1516Ca 0.23 -0.11 -0.11 0.00 -2.93 0.00 0.00 61.98 59.06 1a4l s VAL 1516Cb -0.14 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.44 1a4l s VAL 1516CO -0.07 -0.06 0.20 -1.00 -3.33 0.00 0.00 175.10 170.84 1a4l s HIS 1517N -0.15 3.22 0.20 1.54 3.76 0.11 -0.65 115.29 123.30 1a4l s HIS 1517Ca -0.02 0.00 -0.13 0.00 -0.15 0.00 0.00 55.06 54.76 1a4l s HIS 1517Cb -0.02 -2.40 0.23 0.00 1.11 0.00 0.00 32.58 31.50 1a4l s HIS 1517CO 0.00 -0.22 1.68 1.25 -0.85 0.00 0.00 174.74 176.60 1a4l h LEU 1518N 8.39 -0.22 -0.86 0.89 5.85 -1.13 0.37 115.31 128.60 1a4l h LEU 1518Ca -0.34 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1a4l h LEU 1518Cb 1.18 0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.44 1a4l h LEU 1518CO 0.57 -0.08 0.00 -2.24 -0.34 0.00 0.00 178.44 176.35 1a4l h ASP 1519N 0.12 0.00 -0.28 1.25 2.03 -1.94 -1.06 116.42 116.53 1a4l h ASP 1519Ca 0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.58 1a4l h ASP 1519Cb 0.43 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.93 1a4l h ASP 1519CO -0.45 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.37 1a4l n GLY 1520N 0.18 1.31 0.23 7.15 0.00 0.10 -4.15 105.19 110.00 1a4l n GLY 1520Ca 0.02 -0.67 0.09 0.00 0.00 0.00 0.00 46.02 45.46 1a4l n GLY 1520CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l n ALA 1521N 1.23 2.60 -1.85 4.61 0.00 0.44 -0.98 120.51 126.56 1a4l n ALA 1521Ca 0.18 -2.74 -0.33 0.00 0.00 0.00 0.00 53.44 50.55 1a4l n ALA 1521Cb 0.55 -0.38 -0.06 0.00 0.00 0.00 0.00 19.45 19.56 1a4l n ALA 1521CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a4l s ILE 1522N -2.85 4.44 0.04 0.00 1.01 -1.17 -4.80 121.20 117.86 1a4l s ILE 1522Ca 0.32 1.40 -0.26 0.00 0.00 0.00 0.00 60.65 62.12 1a4l s ILE 1522Cb 0.29 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 39.09 1a4l s ILE 1522CO 0.00 -0.37 0.79 -0.54 0.00 0.00 0.00 174.94 174.82 1a4l s LYS 1523N -3.32 4.51 0.50 2.79 1.02 -1.26 -4.74 119.74 119.25 1a4l s LYS 1523Ca 0.61 1.10 0.15 0.00 0.02 0.00 0.00 55.97 57.85 1a4l s LYS 1523Cb -0.09 -3.38 1.21 0.00 -0.52 0.00 0.00 37.83 35.05 1a4l s LYS 1523CO 0.16 0.24 2.13 -1.35 -0.92 0.00 0.00 175.35 175.62 1a4l h PRO 1524N 5.81 0.05 -0.62 -1.68 0.11 -1.96 -0.07 132.00 133.63 1a4l h PRO 1524Ca -0.43 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 1a4l h PRO 1524Cb 1.21 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1a4l h PRO 1524CO 0.72 0.05 0.16 0.93 -0.21 0.00 0.00 178.00 179.65 1a4l h GLU 1525N 0.05 0.99 -0.01 1.05 3.07 -1.92 -2.07 114.58 115.74 1a4l h GLU 1525Ca 0.01 -0.23 -0.18 0.00 -0.50 0.00 0.00 59.36 58.46 1a4l h GLU 1525Cb 0.02 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 1a4l h GLU 1525CO -0.00 0.90 -0.80 1.15 -1.40 0.00 0.00 179.01 178.85 1a4l h THR 1526N 0.91 1.47 0.86 1.13 2.02 -1.59 -2.70 112.91 115.01 1a4l h THR 1526Ca 0.20 -2.46 -0.04 0.00 0.77 0.00 0.00 66.41 64.87 1a4l h THR 1526Cb 0.34 2.35 0.01 0.00 -1.74 0.00 0.00 68.15 69.11 1a4l h THR 1526CO 0.00 0.72 -0.41 0.40 0.37 0.00 0.00 175.52 176.59 1a4l h ILE 1527N 0.12 0.00 -0.79 3.11 2.04 -0.84 -2.21 117.51 118.94 1a4l h ILE 1527Ca -0.03 -0.10 0.14 0.00 1.00 0.00 0.00 64.86 65.86 1a4l h ILE 1527Cb 1.40 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.38 1a4l h ILE 1527CO 0.12 0.00 0.37 0.25 0.00 0.00 0.00 178.15 178.89 1a4l h LEU 1528N -1.26 0.42 -0.18 1.44 5.85 -1.48 -0.36 115.31 119.75 1a4l h LEU 1528Ca -0.12 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1a4l h LEU 1528Cb 0.89 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1a4l h LEU 1528CO 0.19 0.18 -0.15 0.22 -0.34 0.00 0.00 178.44 178.55 1a4l h TYR 1529N 0.55 -0.37 -0.11 1.25 3.20 -1.38 -0.87 116.97 119.24 1a4l h TYR 1529Ca 0.43 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 62.17 1a4l h TYR 1529Cb 0.60 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 1a4l h TYR 1529CO -0.12 -0.21 -0.57 0.74 -1.64 0.00 0.00 178.16 176.36 1a4l h PHE 1530N -0.16 0.44 0.02 -3.82 0.04 -0.76 -0.99 116.94 111.71 1a4l h PHE 1530Ca 0.11 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1a4l h PHE 1530Cb 0.32 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1a4l h PHE 1530CO -0.29 0.84 -0.04 0.78 -0.60 0.00 0.00 178.31 179.01 1a4l h GLY 1531N 1.30 -0.05 1.13 -1.45 0.00 -0.63 0.19 103.07 103.56 1a4l h GLY 1531Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.27 1a4l h GLY 1531CO 0.09 -0.04 -0.06 0.50 0.00 0.00 0.00 176.54 177.03 1a4l h LYS 1532N -0.07 1.03 -0.38 4.80 1.57 -1.15 0.38 116.57 122.74 1a4l h LYS 1532Ca 0.01 -0.35 -0.12 0.00 -1.87 0.00 0.00 60.65 58.31 1a4l h LYS 1532Cb 0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1a4l h LYS 1532CO -0.02 1.04 -0.25 -0.22 -0.57 0.00 0.00 179.45 179.43 1a4l h LYS 1533N 0.93 0.77 0.00 3.15 3.64 -0.96 -3.13 116.57 120.97 1a4l h LYS 1533Ca 0.15 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1a4l h LYS 1533Cb 0.62 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1a4l h LYS 1533CO 0.04 0.94 -0.77 0.00 -2.27 0.00 0.00 179.45 177.39 1a4l h ARG 1534N 0.67 0.00 -0.80 1.90 3.08 -0.53 -3.48 114.38 115.21 1a4l h ARG 1534Ca 0.09 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 1a4l h ARG 1534Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1a4l h ARG 1534CO 0.06 0.00 -0.05 0.41 -1.07 0.00 0.00 179.97 179.32 1a4l n GLY 1535N 1.30 0.56 3.58 0.04 0.00 0.10 -5.05 105.19 105.74 1a4l n GLY 1535Ca 0.02 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 1a4l n GLY 1535CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4l s ILE 1536N -2.55 3.66 0.45 -0.61 1.01 0.41 -5.01 121.20 118.56 1a4l s ILE 1536Ca 0.02 -0.62 -0.25 0.00 0.00 0.00 0.00 60.65 59.81 1a4l s ILE 1536Cb -0.01 -2.54 -0.08 0.00 0.01 0.00 0.00 42.46 39.85 1a4l s ILE 1536CO 0.03 0.51 1.38 0.00 0.00 0.00 0.00 174.94 176.86 1a4l s ALA 1537N -0.89 3.18 0.04 9.38 0.00 -1.26 -4.46 121.76 127.74 1a4l s ALA 1537Ca 0.14 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.50 1a4l s ALA 1537Cb -0.11 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 1a4l s ALA 1537CO 0.04 -1.11 -0.07 -0.51 0.00 0.00 0.00 175.76 174.11 1a4l s LEU 1538N -2.77 2.24 0.00 0.00 1.02 -1.26 -4.88 118.68 113.03 1a4l s LEU 1538Ca 0.61 -0.52 0.14 0.00 0.02 0.00 0.00 54.13 54.38 1a4l s LEU 1538Cb -0.41 -0.14 0.80 0.00 0.02 0.00 0.00 46.19 46.45 1a4l s LEU 1538CO 0.53 -0.20 1.32 -0.81 0.02 0.00 0.00 176.35 177.21 1a4l n PRO 1539N 1.54 0.34 -3.58 1.29 -0.04 -1.26 -4.77 135.00 128.52 1a4l n PRO 1539Ca -0.22 0.07 -0.13 0.00 -0.04 0.00 0.00 63.50 63.18 1a4l n PRO 1539Cb 0.55 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.46 1a4l n PRO 1539CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a4l s ALA 1540N -2.25 -1.21 -0.74 0.55 0.00 -1.26 -4.96 121.76 111.89 1a4l s ALA 1540Ca 0.18 0.37 0.22 0.00 0.00 0.00 0.00 51.96 52.73 1a4l s ALA 1540Cb 0.10 0.52 -0.20 0.00 0.00 0.00 0.00 23.12 23.53 1a4l s ALA 1540CO 0.19 -0.57 0.83 -0.25 0.00 0.00 0.00 175.76 175.97 1a4l n ASP 1541N 0.16 0.71 -4.40 0.00 8.00 -1.26 -4.82 116.55 114.93 1a4l n ASP 1541Ca -0.18 -0.66 -0.23 0.00 0.71 0.00 0.00 54.79 54.44 1a4l n ASP 1541Cb 0.62 1.19 -0.11 0.00 -0.02 0.00 0.00 41.12 42.80 1a4l n ASP 1541CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1a4l s THR 1542N -3.14 2.14 -0.11 -3.53 -4.23 -1.26 -5.02 115.64 100.49 1a4l s THR 1542Ca 0.04 -2.20 0.30 0.00 -1.18 0.00 0.00 61.69 58.65 1a4l s THR 1542Cb 0.15 -2.12 0.35 0.00 1.34 0.00 0.00 72.50 72.23 1a4l s THR 1542CO 0.87 -0.39 1.88 -0.37 -0.54 0.00 0.00 174.62 176.07 1a4l h VAL 1543N 2.68 0.00 0.00 2.29 -1.51 -1.92 -0.44 116.25 117.35 1a4l h VAL 1543Ca -0.41 -0.52 -0.16 0.00 -1.23 0.00 0.00 66.70 64.38 1a4l h VAL 1543Cb 1.23 1.47 -0.02 0.00 -2.13 0.00 0.00 31.29 31.83 1a4l h VAL 1543CO 0.57 0.00 -0.77 -0.08 -1.23 0.00 0.00 177.57 176.06 1a4l h GLU 1544N 0.00 0.00 0.00 5.19 4.57 -1.97 -0.91 114.58 121.46 1a4l h GLU 1544Ca 0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.00 1a4l h GLU 1544Cb 0.55 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1a4l h GLU 1544CO 0.00 0.77 -1.24 0.93 -1.18 0.00 0.00 179.01 178.29 1a4l h GLU 1545N 0.00 0.00 -0.18 1.92 4.39 -1.90 -3.00 114.58 115.81 1a4l h GLU 1545Ca -0.01 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 1a4l h GLU 1545Cb 1.57 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.20 1a4l h GLU 1545CO 0.10 0.42 -0.35 1.25 -1.16 0.00 0.00 179.01 179.27 1a4l h LEU 1546N 0.00 0.39 -0.21 1.33 5.85 -1.02 -1.70 115.31 119.94 1a4l h LEU 1546Ca -0.14 -0.15 -0.21 0.00 0.84 0.00 0.00 57.88 58.22 1a4l h LEU 1546Cb 1.63 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 42.56 1a4l h LEU 1546CO 0.06 0.71 -0.71 0.03 -0.34 0.00 0.00 178.44 178.20 1a4l h ARG 1547N 0.32 0.81 0.00 1.25 3.08 -1.21 -1.97 114.38 116.66 1a4l h ARG 1547Ca 0.04 -0.61 -0.08 0.00 0.07 0.00 0.00 59.98 59.40 1a4l h ARG 1547Cb 0.77 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1a4l h ARG 1547CO 0.06 1.23 -0.36 -0.91 -1.07 0.00 0.00 179.97 178.92 1a4l h ASN 1548N 0.58 0.00 0.17 7.04 2.35 -1.33 -2.47 115.58 121.92 1a4l h ASN 1548Ca -0.03 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.37 1a4l h ASN 1548Cb 1.33 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.65 1a4l h ASN 1548CO 0.15 0.36 -2.12 0.00 -1.65 0.00 0.00 177.43 174.17 1a4l n ILE 1549N -3.93 1.56 0.22 2.81 3.06 -0.67 -4.29 119.36 118.13 1a4l n ILE 1549Ca -0.02 -0.74 0.12 0.00 -2.50 0.00 0.00 62.75 59.61 1a4l n ILE 1549Cb 0.42 -1.10 0.18 0.00 0.54 0.00 0.00 39.64 39.68 1a4l n ILE 1549CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 1a4l h ILE 1550N 0.02 0.05 -2.84 9.51 2.04 -1.43 -3.46 117.51 121.40 1a4l h ILE 1550Ca -0.45 -1.05 -0.49 0.00 1.00 0.00 0.00 64.86 63.87 1a4l h ILE 1550Cb 2.06 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 40.15 1a4l h ILE 1550CO 0.03 0.03 -0.21 -0.83 0.00 0.00 0.00 178.15 177.18 1a4l s GLY 1551N -4.22 1.45 -0.09 5.37 0.00 -0.93 -4.52 107.32 104.37 1a4l s GLY 1551Ca 0.07 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1a4l s GLY 1551CO 0.67 -0.80 -0.08 1.06 0.00 0.00 0.00 173.10 173.95 1a4l s MET 1552N -4.11 2.98 -0.09 2.90 -1.94 0.12 -4.91 119.30 114.26 1a4l s MET 1552Ca 0.40 -0.58 0.10 0.00 -1.71 0.00 0.00 55.69 53.90 1a4l s MET 1552Cb -0.10 -2.63 -0.14 0.00 2.01 0.00 0.00 34.83 33.97 1a4l s MET 1552CO 0.34 0.52 0.07 -3.47 -0.01 0.00 0.00 175.02 172.48 1a4l n ASP 1553N 2.65 2.43 -4.26 3.03 2.03 -1.26 -4.68 116.55 116.49 1a4l n ASP 1553Ca -0.18 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 54.99 1a4l n ASP 1553Cb 0.53 0.89 -0.10 0.00 -0.72 0.00 0.00 41.12 41.72 1a4l n ASP 1553CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1a4l s LYS 1554N -2.35 1.10 0.61 -0.67 1.02 -1.26 -5.07 119.74 113.12 1a4l s LYS 1554Ca -0.05 -1.50 -0.19 0.00 0.02 0.00 0.00 55.97 54.25 1a4l s LYS 1554Cb 0.04 -0.54 -0.03 0.00 -0.52 0.00 0.00 37.83 36.78 1a4l s LYS 1554CO 0.43 0.01 1.30 -2.14 -0.92 0.00 0.00 175.35 174.03 1a4l s PRO 1555N -3.80 2.81 0.00 -1.68 0.02 -1.26 -4.84 135.00 126.26 1a4l s PRO 1555Ca 0.19 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.29 1a4l s PRO 1555Cb 0.04 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.57 1a4l s PRO 1555CO 0.02 -1.40 0.00 -0.11 -0.33 0.00 0.00 177.00 175.18 1a4l n LEU 1556N -1.57 0.00 -3.88 -5.54 0.00 0.05 -4.97 117.00 101.10 1a4l n LEU 1556Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 56.01 56.07 1a4l n LEU 1556Cb 0.47 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 43.88 1a4l n LEU 1556CO 0.48 0.00 0.43 -0.94 0.00 0.00 0.00 177.39 177.36 1a4l s SER 1557N 1.00 -0.15 0.07 1.96 1.04 -1.21 -4.50 113.70 111.91 1a4l s SER 1557Ca 0.00 -0.79 -0.20 0.00 0.48 0.00 0.00 55.95 55.45 1a4l s SER 1557Cb 0.00 0.73 -0.11 0.00 0.10 0.00 0.00 66.02 66.75 1a4l s SER 1557CO 0.00 -1.39 1.49 0.25 0.98 0.00 0.00 173.24 174.57 1a4l h LEU 1558N 2.04 0.35 -0.95 2.42 5.85 -1.93 -0.52 115.31 122.58 1a4l h LEU 1558Ca -0.23 -0.33 -0.07 0.00 0.84 0.00 0.00 57.88 58.09 1a4l h LEU 1558Cb 1.25 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 1a4l h LEU 1558CO 0.29 0.59 -0.04 -0.65 -0.34 0.00 0.00 178.44 178.29 1a4l h PRO 1559N 0.10 0.72 -0.30 5.25 0.11 -1.97 0.12 132.00 136.03 1a4l h PRO 1559Ca 0.05 -0.20 -0.03 0.00 0.11 0.00 0.00 66.00 65.93 1a4l h PRO 1559Cb 0.42 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.43 1a4l h PRO 1559CO 0.01 0.76 0.05 0.78 -0.21 0.00 0.00 178.00 179.39 1a4l h GLY 1560N 0.96 0.47 0.46 -0.55 0.00 -1.92 -2.07 103.07 100.43 1a4l h GLY 1560Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1a4l h GLY 1560CO 0.02 0.23 -0.07 -2.75 0.00 0.00 0.00 176.54 173.98 1a4l h PHE 1561N 0.43 0.11 0.00 5.60 3.57 0.17 -3.28 116.94 123.55 1a4l h PHE 1561Ca 0.10 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1a4l h PHE 1561Cb 0.22 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 1a4l h PHE 1561CO 0.01 0.68 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.67 1a4l h LEU 1562N -0.49 0.00 0.00 0.59 3.38 -0.59 -2.48 115.31 115.72 1a4l h LEU 1562Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1a4l h LEU 1562Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1a4l h LEU 1562CO 0.01 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1a4l n ALA 1563N -2.32 1.87 0.10 1.53 0.00 -0.80 -3.08 120.51 117.81 1a4l n ALA 1563Ca -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.30 1a4l n ALA 1563Cb 0.12 -1.28 0.13 0.00 0.00 0.00 0.00 19.45 18.42 1a4l n ALA 1563CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1a4l h LYS 1564N 0.00 0.17 -0.22 0.00 1.79 -1.62 -3.17 116.57 113.51 1a4l h LYS 1564Ca 0.00 -0.12 0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1a4l h LYS 1564Cb 0.22 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1a4l h LYS 1564CO 0.00 0.73 0.15 0.74 -1.08 0.00 0.00 179.45 179.99 1a4l h PHE 1565N 0.12 0.20 -0.56 -1.35 -1.00 -1.76 -2.18 116.94 110.41 1a4l h PHE 1565Ca -0.01 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.83 1a4l h PHE 1565Cb 1.11 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 40.57 1a4l h PHE 1565CO 0.02 0.12 0.37 -0.44 -1.61 0.00 0.00 178.31 176.76 1a4l h ASP 1566N 0.21 0.47 -0.03 2.17 3.32 -1.77 -0.32 116.42 120.46 1a4l h ASP 1566Ca 0.09 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1a4l h ASP 1566Cb 0.12 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1a4l h ASP 1566CO -0.02 0.31 -0.08 1.88 -1.72 0.00 0.00 179.24 179.61 1a4l h TYR 1567N 0.54 -0.21 0.00 4.55 0.05 -1.58 -3.40 116.97 116.92 1a4l h TYR 1567Ca 0.24 0.01 -0.10 0.00 0.05 0.00 0.00 58.73 58.93 1a4l h TYR 1567Cb 0.26 0.10 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 1a4l h TYR 1567CO -0.00 -0.13 -1.52 2.48 -1.05 0.00 0.00 178.16 177.94 1a4l n TYR 1568N -5.21 0.00 -0.33 4.88 0.18 -1.05 -4.54 117.16 111.08 1a4l n TYR 1568Ca -0.05 0.00 0.15 0.00 1.88 0.00 0.00 57.90 59.88 1a4l n TYR 1568Cb 0.13 -0.34 0.38 0.00 -0.38 0.00 0.00 39.34 39.13 1a4l n TYR 1568CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1a4l h MET 1569N 0.00 0.63 0.00 -3.48 2.86 -1.26 -1.74 114.93 111.94 1a4l h MET 1569Ca -0.15 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1a4l h MET 1569Cb 1.13 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.65 1a4l h MET 1569CO 0.01 0.42 0.16 -1.35 1.06 0.00 0.00 176.91 177.21 1a4l h PRO 1570N 0.65 0.00 0.00 -0.22 0.11 -1.81 0.53 132.00 131.26 1a4l h PRO 1570Ca 0.57 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 66.46 1a4l h PRO 1570Cb 1.03 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1a4l h PRO 1570CO -0.34 0.00 -1.26 0.28 -0.21 0.00 0.00 178.00 176.47 1a4l h VAL 1571N 0.00 1.01 0.03 3.15 2.07 -1.65 -3.38 116.25 117.48 1a4l h VAL 1571Ca 0.00 -2.67 -0.38 0.00 0.82 0.00 0.00 66.70 64.47 1a4l h VAL 1571Cb 0.32 2.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.49 1a4l h VAL 1571CO 0.00 0.58 -2.23 -0.38 0.02 0.00 0.00 177.57 175.55 1a4l n ILE 1572N -3.12 1.58 -1.60 4.57 2.08 -0.45 -4.66 119.36 117.75 1a4l n ILE 1572Ca -0.08 -0.50 -0.45 0.00 0.56 0.00 0.00 62.75 62.28 1a4l n ILE 1572Cb 0.92 -1.65 -0.02 0.00 -0.75 0.00 0.00 39.64 38.14 1a4l n ILE 1572CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a4l n ALA 1573N -3.38 -0.11 -0.37 -1.39 0.00 0.05 -1.86 120.51 113.45 1a4l n ALA 1573Ca -0.42 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1a4l n ALA 1573Cb 0.96 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1a4l n ALA 1573CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a4l n GLY 1574N 1.45 1.58 3.48 0.00 0.00 -0.67 -4.95 105.19 106.08 1a4l n GLY 1574Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1a4l n GLY 1574CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l h ARG 1576N 8.43 -0.53 -0.03 0.00 3.08 -1.93 -0.87 114.38 122.53 1a4l h ARG 1576Ca -0.31 0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1a4l h ARG 1576Cb 1.15 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 1a4l h ARG 1576CO 0.63 -0.35 -0.07 1.05 -1.07 0.00 0.00 179.97 180.16 1a4l h GLU 1577N -0.55 0.04 -0.08 0.04 4.11 -1.96 -1.40 114.58 114.78 1a4l h GLU 1577Ca -0.03 -0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.36 1a4l h GLU 1577Cb 0.47 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1a4l h GLU 1577CO 0.01 0.11 -0.10 0.00 0.07 0.00 0.00 179.01 179.11 1a4l h ALA 1578N 1.90 0.12 -0.58 1.06 0.00 -1.81 0.81 119.26 120.75 1a4l h ALA 1578Ca 0.01 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1a4l h ALA 1578Cb 0.15 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1a4l h ALA 1578CO 0.01 -0.04 0.38 0.82 0.00 0.00 0.00 179.25 180.42 1a4l h ILE 1579N -0.23 1.13 -0.48 0.00 2.04 -0.74 0.20 117.51 119.42 1a4l h ILE 1579Ca 0.01 -0.26 -0.10 0.00 1.00 0.00 0.00 64.86 65.50 1a4l h ILE 1579Cb 0.63 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1a4l h ILE 1579CO 0.02 0.14 -0.10 0.50 0.00 0.00 0.00 178.15 178.71 1a4l h LYS 1580N 0.77 0.92 -0.35 2.37 3.64 -1.27 -3.09 116.57 119.56 1a4l h LYS 1580Ca 0.22 -0.35 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1a4l h LYS 1580Cb -0.07 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1a4l h LYS 1580CO -0.06 1.00 0.12 -0.09 -2.27 0.00 0.00 179.45 178.16 1a4l h ARG 1581N 0.78 0.54 -0.05 1.90 2.43 -0.22 -1.83 114.38 117.93 1a4l h ARG 1581Ca 0.12 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1a4l h ARG 1581Cb 0.66 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1a4l h ARG 1581CO 0.05 0.55 -0.05 -0.84 -1.51 0.00 0.00 179.97 178.17 1a4l h ILE 1582N 0.42 1.06 0.46 1.20 3.07 -1.01 0.11 117.51 122.83 1a4l h ILE 1582Ca 0.12 -0.28 -0.02 0.00 1.55 0.00 0.00 64.86 66.23 1a4l h ILE 1582Cb 0.23 1.08 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 1a4l h ILE 1582CO -0.01 0.08 -0.22 0.00 -1.05 0.00 0.00 178.15 176.96 1a4l h ALA 1583N 1.89 -0.61 0.09 0.16 0.00 -1.38 0.44 119.26 119.85 1a4l h ALA 1583Ca 0.02 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1a4l h ALA 1583Cb 0.13 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1a4l h ALA 1583CO 0.01 -0.63 -0.38 -0.92 0.00 0.00 0.00 179.25 177.33 1a4l h TYR 1584N -1.04 -1.05 -0.94 0.00 5.03 -1.04 -1.85 116.97 116.08 1a4l h TYR 1584Ca -0.06 0.03 0.15 0.00 2.58 0.00 0.00 58.73 61.43 1a4l h TYR 1584Cb 0.56 0.45 -0.08 0.00 1.55 0.00 0.00 36.73 39.21 1a4l h TYR 1584CO 0.02 -0.48 0.60 0.93 -1.32 0.00 0.00 178.16 177.91 1a4l h GLU 1585N -0.59 0.74 -0.18 1.82 5.08 -0.84 -1.54 114.58 119.08 1a4l h GLU 1585Ca 0.03 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1a4l h GLU 1585Cb 0.63 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1a4l h GLU 1585CO -0.24 0.49 0.09 0.35 -1.00 0.00 0.00 179.01 178.70 1a4l h PHE 1586N 0.77 0.16 -0.52 4.33 3.57 -0.08 -2.57 116.94 122.60 1a4l h PHE 1586Ca 0.49 0.01 0.02 0.00 3.53 0.00 0.00 57.97 62.02 1a4l h PHE 1586Cb 0.73 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 1a4l h PHE 1586CO -0.00 0.09 0.31 0.28 -2.23 0.00 0.00 178.31 176.76 1a4l h VAL 1587N 0.19 1.05 -0.57 1.41 2.07 -0.83 -2.10 116.25 117.47 1a4l h VAL 1587Ca 0.08 -0.21 0.10 0.00 0.82 0.00 0.00 66.70 67.49 1a4l h VAL 1587Cb 0.02 0.39 -0.08 0.00 -1.52 0.00 0.00 31.29 30.10 1a4l h VAL 1587CO -0.06 0.11 0.12 -0.08 0.02 0.00 0.00 177.57 177.69 1a4l h GLU 1588N 0.61 0.25 -0.12 1.57 4.81 -1.29 -0.58 114.58 119.83 1a4l h GLU 1588Ca 0.21 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1a4l h GLU 1588Cb 0.03 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1a4l h GLU 1588CO -0.10 0.17 0.03 0.52 -0.73 0.00 0.00 179.01 178.90 1a4l h MET 1589N 0.26 0.20 -0.94 1.92 2.86 -1.17 -2.41 114.93 115.65 1a4l h MET 1589Ca 0.30 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.89 1a4l h MET 1589Cb 0.42 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.01 1a4l h MET 1589CO -0.38 0.38 0.61 0.87 1.06 0.00 0.00 176.91 179.45 1a4l h LYS 1590N -0.01 1.24 -0.73 1.72 1.79 -0.85 -1.37 116.57 118.36 1a4l h LYS 1590Ca 0.04 -0.08 -0.07 0.00 -2.18 0.00 0.00 60.65 58.36 1a4l h LYS 1590Cb 0.27 -0.28 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 1a4l h LYS 1590CO 0.00 0.83 0.20 0.00 -1.08 0.00 0.00 179.45 179.40 1a4l h ALA 1591N 1.34 0.96 -0.38 3.86 0.00 -1.08 -1.95 119.26 122.00 1a4l h ALA 1591Ca 0.34 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1a4l h ALA 1591Cb -0.13 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 1a4l h ALA 1591CO -0.07 0.67 0.12 0.87 0.00 0.00 0.00 179.25 180.83 1a4l h LYS 1592N 1.10 0.55 0.00 0.00 1.57 -0.87 -0.23 116.57 118.69 1a4l h LYS 1592Ca 0.23 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1a4l h LYS 1592Cb 0.35 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1a4l h LYS 1592CO -0.00 0.49 0.00 0.39 -0.57 0.00 0.00 179.45 179.76 1a4l n GLU 1593N -4.35 0.09 -0.49 3.15 1.02 -0.58 -4.88 120.64 114.61 1a4l n GLU 1593Ca 0.02 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1a4l n GLU 1593Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1a4l n GLU 1593CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4l n GLY 1594N 0.28 0.71 3.73 0.62 0.00 -0.10 -4.95 105.19 105.50 1a4l n GLY 1594Ca 0.06 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.15 1a4l n GLY 1594CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4l s VAL 1595N -2.00 4.89 -0.05 1.61 1.01 -0.80 -1.97 120.40 123.10 1a4l s VAL 1595Ca 0.00 1.54 0.22 0.00 0.00 0.00 0.00 61.98 63.74 1a4l s VAL 1595Cb 0.00 -4.08 -0.32 0.00 0.00 0.00 0.00 36.38 31.98 1a4l s VAL 1595CO 0.00 0.31 0.47 1.33 0.00 0.00 0.00 175.10 177.21 1a4l n VAL 1596N 3.27 0.11 -3.74 2.92 0.24 0.20 -4.42 118.33 116.91 1a4l n VAL 1596Ca -0.02 -0.53 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 1a4l n VAL 1596Cb 0.51 -0.04 -0.13 0.00 -1.47 0.00 0.00 33.84 32.70 1a4l n VAL 1596CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1a4l s TYR 1597N -3.45 -0.28 0.01 6.34 5.04 -1.23 -1.31 117.35 122.47 1a4l s TYR 1597Ca -0.08 0.70 0.02 0.00 -2.44 0.00 0.00 57.07 55.26 1a4l s TYR 1597Cb 0.13 0.01 -0.01 0.00 0.35 0.00 0.00 41.96 42.45 1a4l s TYR 1597CO 0.90 -0.21 -0.06 0.08 -1.34 0.00 0.00 175.55 174.92 1a4l s VAL 1598N 1.18 0.46 -0.29 3.14 1.01 -0.19 -1.75 120.40 123.97 1a4l s VAL 1598Ca -0.09 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.36 1a4l s VAL 1598Cb -0.10 -0.45 0.07 0.00 0.00 0.00 0.00 36.38 35.90 1a4l s VAL 1598CO -0.07 -0.08 -0.04 -1.61 0.00 0.00 0.00 175.10 173.29 1a4l s GLU 1599N -0.70 1.88 -0.17 2.72 2.02 -0.57 -1.05 118.70 122.84 1a4l s GLU 1599Ca -0.03 -1.49 -0.14 0.00 0.02 0.00 0.00 54.97 53.33 1a4l s GLU 1599Cb -0.05 -2.95 -0.05 0.00 0.10 0.00 0.00 34.13 31.18 1a4l s GLU 1599CO 0.00 -0.71 0.28 0.08 0.02 0.00 0.00 175.26 174.93 1a4l s VAL 1600N 1.07 5.31 0.30 2.63 1.01 -0.53 -3.80 120.40 126.38 1a4l s VAL 1600Ca -0.01 0.52 0.08 0.00 0.00 0.00 0.00 61.98 62.56 1a4l s VAL 1600Cb -0.19 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1a4l s VAL 1600CO -0.07 0.38 0.15 0.00 0.00 0.00 0.00 175.10 175.56 1a4l s ARG 1601N 0.56 2.56 0.00 2.72 1.70 0.17 -0.74 118.95 125.92 1a4l s ARG 1601Ca 0.16 -1.34 0.00 0.00 -0.47 0.00 0.00 55.73 54.07 1a4l s ARG 1601Cb -0.13 -2.33 0.00 0.00 -0.57 0.00 0.00 34.95 31.93 1a4l s ARG 1601CO 0.04 0.25 0.00 2.48 -1.08 0.00 0.00 175.30 176.98 1a4l n TYR 1602N -1.13 0.00 -3.44 5.89 4.11 -0.86 -0.51 117.16 121.23 1a4l n TYR 1602Ca -0.05 0.00 -0.40 0.00 -0.00 0.00 0.00 57.90 57.45 1a4l n TYR 1602Cb 0.60 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.84 1a4l n TYR 1602CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1a4l s SER 1603N 0.00 6.16 0.34 9.48 0.15 -1.26 -0.99 113.70 127.57 1a4l s SER 1603Ca 0.00 -0.11 0.05 0.00 0.70 0.00 0.00 55.95 56.59 1a4l s SER 1603Cb 0.00 -2.18 0.60 0.00 -1.71 0.00 0.00 66.02 62.73 1a4l s SER 1603CO 0.00 -0.26 1.85 1.55 1.20 0.00 0.00 173.24 177.58 1a4l h PRO 1604N 8.39 0.44 -0.26 5.44 0.13 -1.90 -2.98 132.00 141.27 1a4l h PRO 1604Ca -0.31 -0.11 -0.07 0.00 -0.87 0.00 0.00 66.00 64.64 1a4l h PRO 1604Cb 1.16 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1a4l h PRO 1604CO 0.66 0.54 -0.14 0.45 -0.23 0.00 0.00 178.00 179.28 1a4l h HIS 1605N 0.42 0.48 0.00 1.56 3.86 -1.93 -2.36 115.15 117.18 1a4l h HIS 1605Ca 0.08 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1a4l h HIS 1605Cb 0.42 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1a4l h HIS 1605CO 0.01 0.57 0.00 1.28 0.86 0.00 0.00 177.93 180.65 1a4l n LEU 1606N -4.20 0.00 -0.07 2.43 4.77 -1.12 -1.65 117.00 117.15 1a4l n LEU 1606Ca 0.00 0.46 0.01 0.00 -0.03 0.00 0.00 56.01 56.45 1a4l n LEU 1606Cb 0.32 -0.46 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1a4l n LEU 1606CO 0.40 -0.27 0.44 0.18 -1.33 0.00 0.00 177.39 176.81 1a4l n LEU 1607N -1.46 1.81 -4.95 2.23 4.32 -0.91 -4.82 117.00 113.21 1a4l n LEU 1607Ca 0.03 -1.70 -0.24 0.00 -0.02 0.00 0.00 56.01 54.08 1a4l n LEU 1607Cb 0.13 -0.02 -0.03 0.00 -1.62 0.00 0.00 43.42 41.89 1a4l n LEU 1607CO 0.11 0.45 -0.03 0.00 -1.22 0.00 0.00 177.39 176.69 1a4l s ALA 1608N -0.73 3.91 -0.01 -1.18 0.00 -0.66 -1.67 121.76 121.41 1a4l s ALA 1608Ca 0.02 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.94 1a4l s ALA 1608Cb 0.01 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.33 1a4l s ALA 1608CO 0.02 0.36 0.77 0.27 0.00 0.00 0.00 175.76 177.18 1a4l n ASN 1609N -0.99 0.45 -3.80 0.00 2.04 -0.22 -4.62 115.26 108.12 1a4l n ASN 1609Ca -0.07 -1.61 -0.13 0.00 -0.44 0.00 0.00 54.58 52.33 1a4l n ASN 1609Cb 0.55 -0.10 -0.11 0.00 -2.53 0.00 0.00 39.78 37.59 1a4l n ASN 1609CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 1a4l s SER 1610N -0.67 -0.21 -1.35 0.53 0.15 -0.59 -0.43 113.70 111.13 1a4l s SER 1610Ca 0.03 0.36 -0.03 0.00 0.70 0.00 0.00 55.95 57.01 1a4l s SER 1610Cb 0.02 0.43 0.02 0.00 -1.71 0.00 0.00 66.02 64.78 1a4l s SER 1610CO 0.00 -0.14 0.78 0.29 1.20 0.00 0.00 173.24 175.37 1a4l n LYS 1611N 2.68 -5.16 -3.73 5.44 5.02 -1.26 -4.12 118.16 117.03 1a4l n LYS 1611Ca -0.14 0.63 -0.29 0.00 -2.02 0.00 0.00 58.31 56.49 1a4l n LYS 1611Cb 0.58 -5.27 -0.16 0.00 -0.02 0.00 0.00 35.03 30.16 1a4l n LYS 1611CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1a4l s VAL 1612N -3.58 0.65 0.00 -0.18 1.01 -1.26 -4.71 120.40 112.33 1a4l s VAL 1612Ca 0.15 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 1a4l s VAL 1612Cb -0.07 -1.30 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 1a4l s VAL 1612CO 0.81 -0.43 1.01 -0.78 0.00 0.00 0.00 175.10 175.71 1a4l h ASP 1613N 8.19 -0.03 -2.10 3.32 1.82 -2.00 -3.03 116.42 122.59 1a4l h ASP 1613Ca -0.16 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 55.91 1a4l h ASP 1613Cb 1.07 0.01 -0.10 0.00 0.68 0.00 0.00 39.33 40.99 1a4l h ASP 1613CO 0.40 -0.01 1.06 -2.84 -1.61 0.00 0.00 179.24 176.25 1a4l s PRO 1614N -3.04 3.31 -0.26 0.28 0.02 -1.26 -4.93 135.00 129.11 1a4l s PRO 1614Ca -0.00 -0.68 -0.35 0.00 0.02 0.00 0.00 61.00 60.00 1a4l s PRO 1614Cb 0.00 -4.54 -0.11 0.00 0.02 0.00 0.00 34.50 29.87 1a4l s PRO 1614CO 0.01 -2.08 2.07 -0.12 -0.33 0.00 0.00 177.00 176.55 1a4l n MET 1615N 8.76 1.47 -1.87 5.54 1.56 -1.15 -4.93 117.12 126.50 1a4l n MET 1615Ca 0.11 0.46 -0.36 0.00 -0.27 0.00 0.00 57.70 57.64 1a4l n MET 1615Cb 0.49 -2.57 0.05 0.00 2.15 0.00 0.00 33.22 33.34 1a4l n MET 1615CO 0.00 0.00 0.00 -2.14 -0.73 0.00 0.00 175.97 173.10 1a4l s PRO 1616N 5.42 2.76 -1.81 2.12 0.02 -1.26 -3.91 135.00 138.34 1a4l s PRO 1616Ca 1.03 1.88 -0.20 0.00 0.02 0.00 0.00 61.00 63.73 1a4l s PRO 1616Cb -0.77 -1.89 0.20 0.00 0.02 0.00 0.00 34.50 32.05 1a4l s PRO 1616CO 0.50 -1.39 0.59 0.91 -0.33 0.00 0.00 177.00 177.28 1a4l n TRP 1617N -1.82 -1.32 -2.57 6.54 7.02 -1.26 -1.46 117.44 122.57 1a4l n TRP 1617Ca 0.14 0.71 -0.07 0.00 -1.02 0.00 0.00 57.50 57.26 1a4l n TRP 1617Cb 0.49 -2.24 -0.00 0.00 -2.42 0.00 0.00 31.31 27.14 1a4l n TRP 1617CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1a4l n ASN 1618N -2.55 -2.26 -4.66 -0.99 4.13 -1.25 -4.89 115.26 102.78 1a4l n ASN 1618Ca 0.06 0.30 -0.30 0.00 1.68 0.00 0.00 54.58 56.32 1a4l n ASN 1618Cb 0.49 -2.00 0.17 0.00 -1.54 0.00 0.00 39.78 36.89 1a4l n ASN 1618CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1a4l s GLN 1619N -5.12 0.84 -0.07 3.52 -0.21 -0.53 -5.01 119.66 113.07 1a4l s GLN 1619Ca 0.04 1.10 -0.11 0.00 0.02 0.00 0.00 55.36 56.41 1a4l s GLN 1619Cb -0.02 -1.74 -0.05 0.00 1.00 0.00 0.00 33.01 32.20 1a4l s GLN 1619CO 0.05 -2.61 0.26 0.99 -2.12 0.00 0.00 175.29 171.86 1a4l s THR 1620N -2.74 5.29 -0.27 -0.19 2.01 -1.26 -4.96 115.64 113.52 1a4l s THR 1620Ca 0.65 0.50 -0.40 0.00 0.31 0.00 0.00 61.69 62.75 1a4l s THR 1620Cb -0.21 -3.55 -0.15 0.00 0.01 0.00 0.00 72.50 68.60 1a4l s THR 1620CO 0.59 0.59 1.75 -0.62 -0.69 0.00 0.00 174.62 176.24 1a4l n GLU 1621N 2.00 1.19 0.00 4.92 -0.58 -1.26 -4.92 120.64 121.99 1a4l n GLU 1621Ca -0.17 0.44 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 1a4l n GLU 1621Cb 0.54 -2.12 0.00 0.00 -0.57 0.00 0.00 31.44 29.28 1a4l n GLU 1621CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1a4l n GLY 1622N 4.20 4.64 0.00 0.62 0.00 0.43 -5.02 105.19 110.07 1a4l n GLY 1622Ca 0.26 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1a4l n GLY 1622CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a4l n ASP 1623N 0.00 0.29 -4.58 1.61 5.75 -1.26 -4.61 116.55 113.75 1a4l n ASP 1623Ca 0.00 -0.81 -0.43 0.00 -0.01 0.00 0.00 54.79 53.54 1a4l n ASP 1623Cb 0.00 0.09 -0.02 0.00 -1.03 0.00 0.00 41.12 40.15 1a4l n ASP 1623CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1a4l s VAL 1624N -0.09 4.11 0.42 2.12 1.01 -1.26 -4.83 120.40 121.89 1a4l s VAL 1624Ca 0.00 0.94 -0.03 0.00 0.00 0.00 0.00 61.98 62.88 1a4l s VAL 1624Cb 0.00 -4.67 -0.04 0.00 0.00 0.00 0.00 36.38 31.67 1a4l s VAL 1624CO 0.00 -1.22 0.69 -0.89 0.00 0.00 0.00 175.10 173.68 1a4l s THR 1625N 4.71 4.98 0.38 3.92 2.01 -1.26 -1.06 115.64 129.32 1a4l s THR 1625Ca 0.43 -0.01 0.14 0.00 0.31 0.00 0.00 61.69 62.56 1a4l s THR 1625Cb -0.08 -3.85 0.36 0.00 0.01 0.00 0.00 72.50 68.94 1a4l s THR 1625CO 0.27 -0.71 1.82 -0.65 -0.69 0.00 0.00 174.62 174.66 1a4l h PRO 1626N 0.53 0.50 -0.46 4.92 0.11 -1.81 0.17 132.00 135.96 1a4l h PRO 1626Ca -0.48 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 1a4l h PRO 1626Cb 1.21 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1a4l h PRO 1626CO 0.62 0.33 0.18 0.22 -0.21 0.00 0.00 178.00 179.14 1a4l h ASP 1627N 0.52 0.64 -0.23 -2.05 1.82 -1.93 -2.69 116.42 112.50 1a4l h ASP 1627Ca 0.53 -0.17 -0.05 0.00 -0.39 0.00 0.00 57.03 56.94 1a4l h ASP 1627Cb 1.15 -0.17 -0.02 0.00 0.68 0.00 0.00 39.33 40.97 1a4l h ASP 1627CO -0.26 0.64 0.01 0.44 -1.61 0.00 0.00 179.24 178.46 1a4l h ASP 1628N 0.60 0.48 0.21 2.28 3.32 -1.08 -1.87 116.42 120.37 1a4l h ASP 1628Ca 0.15 -0.09 -0.10 0.00 0.02 0.00 0.00 57.03 57.02 1a4l h ASP 1628Cb 0.20 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1a4l h ASP 1628CO -0.01 0.55 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.32 1a4l h VAL 1629N 0.50 1.29 0.11 -1.35 -1.51 -1.07 0.46 116.25 114.67 1a4l h VAL 1629Ca 0.11 -1.42 -0.01 0.00 -1.23 0.00 0.00 66.70 64.15 1a4l h VAL 1629Cb 0.32 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 1a4l h VAL 1629CO 0.01 0.43 -0.05 0.58 -1.23 0.00 0.00 177.57 177.30 1a4l h VAL 1630N 0.20 1.06 -0.82 7.19 2.07 -1.07 0.14 116.25 125.02 1a4l h VAL 1630Ca 0.02 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 66.93 1a4l h VAL 1630Cb 0.76 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 1a4l h VAL 1630CO 0.06 0.16 0.53 -0.78 0.02 0.00 0.00 177.57 177.56 1a4l h ASP 1631N -0.46 0.81 -0.41 0.57 3.58 -1.18 -0.16 116.42 119.18 1a4l h ASP 1631Ca -0.01 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.30 1a4l h ASP 1631Cb 0.38 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1a4l h ASP 1631CO 0.02 0.53 -0.26 -0.07 -2.88 0.00 0.00 179.24 176.58 1a4l h LEU 1632N 0.92 0.94 -0.27 2.28 -0.00 -0.65 -2.78 115.31 115.75 1a4l h LEU 1632Ca 0.35 -0.43 -0.03 0.00 -0.00 0.00 0.00 57.88 57.77 1a4l h LEU 1632Cb 0.18 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 40.57 1a4l h LEU 1632CO -0.12 1.16 0.04 0.58 -0.00 0.00 0.00 178.44 180.11 1a4l h VAL 1633N 0.72 1.23 -0.87 1.22 2.07 -0.11 -2.82 116.25 117.68 1a4l h VAL 1633Ca 0.08 -0.79 0.13 0.00 0.82 0.00 0.00 66.70 66.94 1a4l h VAL 1633Cb 0.84 1.23 -0.09 0.00 -1.52 0.00 0.00 31.29 31.75 1a4l h VAL 1633CO 0.07 0.25 0.49 0.78 0.02 0.00 0.00 177.57 179.18 1a4l h ASN 1634N 0.26 0.65 0.14 0.57 -0.26 -1.02 -0.78 115.58 115.13 1a4l h ASN 1634Ca 0.08 0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.89 1a4l h ASN 1634Cb 0.34 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.56 1a4l h ASN 1634CO 0.01 0.31 -0.07 1.56 -1.06 0.00 0.00 177.43 178.18 1a4l h GLN 1635N 0.73 -0.18 -0.37 0.81 4.20 -1.40 -0.21 115.11 118.70 1a4l h GLN 1635Ca 0.46 0.01 0.04 0.00 0.06 0.00 0.00 58.65 59.22 1a4l h GLN 1635Cb 0.56 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 1a4l h GLN 1635CO -0.32 0.04 0.15 0.78 -0.67 0.00 0.00 178.83 178.81 1a4l h GLY 1636N -0.39 0.48 0.88 3.46 0.00 -1.18 -0.68 103.07 105.65 1a4l h GLY 1636Ca -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 1a4l h GLY 1636CO 0.03 0.05 0.07 1.41 0.00 0.00 0.00 176.54 178.10 1a4l h LEU 1637N 0.31 0.34 -1.26 3.11 3.38 -1.11 -1.17 115.31 118.90 1a4l h LEU 1637Ca 0.16 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1a4l h LEU 1637Cb 0.12 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1a4l h LEU 1637CO -0.15 0.45 0.01 1.56 0.09 0.00 0.00 178.44 180.40 1a4l h GLN 1638N 0.20 0.51 -0.28 1.13 4.20 -0.89 0.26 115.11 120.25 1a4l h GLN 1638Ca 0.07 -0.10 -0.12 0.00 0.06 0.00 0.00 58.65 58.56 1a4l h GLN 1638Cb 0.23 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1a4l h GLN 1638CO -0.00 0.53 -0.31 0.93 -0.67 0.00 0.00 178.83 179.31 1a4l h GLU 1639N 0.49 0.70 -0.15 1.46 5.08 -0.93 -1.66 114.58 119.59 1a4l h GLU 1639Ca 0.11 -0.38 -0.10 0.00 -1.00 0.00 0.00 59.36 57.98 1a4l h GLU 1639Cb 0.30 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1a4l h GLU 1639CO 0.01 1.00 -0.36 0.78 -1.00 0.00 0.00 179.01 179.44 1a4l h GLY 1640N 0.44 0.33 0.93 -3.84 0.00 -0.88 -0.29 103.07 99.77 1a4l h GLY 1640Ca 0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 1a4l h GLY 1640CO 0.07 0.27 0.06 -2.09 0.00 0.00 0.00 176.54 174.85 1a4l h GLU 1641N 0.26 0.14 -0.67 4.80 4.81 -0.31 0.17 114.58 123.79 1a4l h GLU 1641Ca 0.03 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1a4l h GLU 1641Cb 0.76 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1a4l h GLU 1641CO 0.06 0.18 0.22 1.96 -0.73 0.00 0.00 179.01 180.69 1a4l h GLN 1642N 0.07 1.04 0.01 1.92 7.50 -1.06 -2.63 115.11 121.97 1a4l h GLN 1642Ca 0.04 -0.22 -0.20 0.00 0.50 0.00 0.00 58.65 58.77 1a4l h GLN 1642Cb 0.08 -0.15 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 1a4l h GLN 1642CO -0.01 0.90 -0.92 0.00 -1.50 0.00 0.00 178.83 177.31 1a4l h ALA 1643N 1.09 0.48 -0.02 3.87 0.00 -0.82 -3.37 119.26 120.50 1a4l h ALA 1643Ca 0.22 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1a4l h ALA 1643Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1a4l h ALA 1643CO -0.01 0.98 -0.02 1.19 0.00 0.00 0.00 179.25 181.40 1a4l n PHE 1644N -3.59 0.00 -1.65 0.00 3.01 0.59 -5.02 117.46 110.80 1a4l n PHE 1644Ca -0.03 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.34 1a4l n PHE 1644Cb 0.84 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.29 1a4l n PHE 1644CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1a4l n GLY 1645N 0.78 0.63 3.36 1.37 0.00 -0.99 -4.98 105.19 105.35 1a4l n GLY 1645Ca 0.08 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 1a4l n GLY 1645CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1a4l s ILE 1646N -2.39 1.81 -0.19 -0.61 -4.36 -1.25 -5.03 121.20 109.17 1a4l s ILE 1646Ca 0.00 -2.21 -0.13 0.00 -0.26 0.00 0.00 60.65 58.05 1a4l s ILE 1646Cb 0.00 -2.05 -0.05 0.00 1.25 0.00 0.00 42.46 41.61 1a4l s ILE 1646CO 0.00 -0.56 0.26 -0.75 0.24 0.00 0.00 174.94 174.12 1a4l s LYS 1647N -3.58 4.19 -0.04 0.37 2.20 -0.43 -4.57 119.74 117.88 1a4l s LYS 1647Ca 0.23 -0.01 0.05 0.00 -0.36 0.00 0.00 55.97 55.87 1a4l s LYS 1647Cb -0.01 -3.47 -0.01 0.00 -1.51 0.00 0.00 37.83 32.83 1a4l s LYS 1647CO 0.07 0.16 -0.18 0.08 -0.36 0.00 0.00 175.35 175.12 1a4l s VAL 1648N 0.73 1.50 0.06 4.02 1.01 -1.26 -1.02 120.40 125.44 1a4l s VAL 1648Ca 0.14 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 1a4l s VAL 1648Cb -0.13 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1a4l s VAL 1648CO 0.04 0.43 -0.04 -0.13 0.00 0.00 0.00 175.10 175.39 1a4l s ARG 1649N -0.08 0.61 0.36 2.72 1.81 -0.21 -4.85 118.95 119.30 1a4l s ARG 1649Ca -0.02 -1.12 0.08 0.00 -1.72 0.00 0.00 55.73 52.96 1a4l s ARG 1649Cb -0.11 0.07 -0.05 0.00 -0.45 0.00 0.00 34.95 34.41 1a4l s ARG 1649CO 0.02 -0.07 0.11 -1.54 -0.68 0.00 0.00 175.30 173.13 1a4l s SER 1650N -2.63 4.44 -0.03 0.23 1.04 0.19 -1.45 113.70 115.49 1a4l s SER 1650Ca 0.03 -0.92 0.01 0.00 0.48 0.00 0.00 55.95 55.55 1a4l s SER 1650Cb 0.03 -0.60 0.02 0.00 0.10 0.00 0.00 66.02 65.57 1a4l s SER 1650CO -0.07 -0.33 -0.02 -0.63 0.98 0.00 0.00 173.24 173.17 1a4l s ILE 1651N -2.50 0.29 -0.24 -1.02 1.01 0.08 -0.40 121.20 118.42 1a4l s ILE 1651Ca 0.37 -0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.91 1a4l s ILE 1651Cb -0.00 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 42.08 1a4l s ILE 1651CO 0.21 0.15 0.17 -0.76 0.00 0.00 0.00 174.94 174.72 1a4l s LEU 1652N 0.79 4.12 0.08 2.97 1.43 -0.76 -2.02 118.68 125.29 1a4l s LEU 1652Ca -0.09 0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 52.95 1a4l s LEU 1652Cb -0.12 -2.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.91 1a4l s LEU 1652CO -0.01 0.06 0.61 0.00 0.23 0.00 0.00 176.35 177.24 1a4l s MET 1655N 0.06 4.31 0.23 0.00 -1.94 -1.26 -0.45 119.30 120.25 1a4l s MET 1655Ca 0.10 0.55 -0.07 0.00 -1.71 0.00 0.00 55.69 54.55 1a4l s MET 1655Cb -0.11 -3.40 0.37 0.00 2.01 0.00 0.00 34.83 33.69 1a4l s MET 1655CO -0.01 0.23 1.74 0.00 -0.01 0.00 0.00 175.02 176.97 1a4l h ARG 1656N 6.36 0.43 0.00 2.03 3.08 -0.82 -0.76 114.38 124.71 1a4l h ARG 1656Ca -0.43 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.57 1a4l h ARG 1656Cb 1.19 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.14 1a4l h ARG 1656CO 0.73 0.28 -0.15 1.12 -1.07 0.00 0.00 179.97 180.88 1a4l h HIS 1657N 0.44 0.00 -2.67 3.04 2.07 -1.89 -3.37 115.15 112.77 1a4l h HIS 1657Ca 0.36 0.00 -0.67 0.00 -2.85 0.00 0.00 60.37 57.22 1a4l h HIS 1657Cb 0.49 0.00 -0.38 0.00 2.57 0.00 0.00 27.41 30.09 1a4l h HIS 1657CO -0.17 0.15 -0.21 1.04 -3.07 0.00 0.00 177.93 175.68 1a4l n GLN 1658N -3.29 2.87 0.28 5.12 1.13 -0.29 -4.89 117.38 118.31 1a4l n GLN 1658Ca 0.00 -4.59 0.14 0.00 -1.94 0.00 0.00 57.00 50.61 1a4l n GLN 1658Cb 0.40 -2.34 0.83 0.00 0.11 0.00 0.00 30.24 29.24 1a4l n GLN 1658CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1a4l h PRO 1659N 4.94 0.00 0.00 -1.09 0.11 -1.73 -2.16 132.00 132.06 1a4l h PRO 1659Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1a4l h PRO 1659Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1a4l h PRO 1659CO 0.93 0.06 0.00 0.66 -0.21 0.00 0.00 178.00 179.44 1a4l h SER 1660N 0.00 0.00 0.73 -2.05 4.64 -1.92 -1.70 113.55 113.25 1a4l h SER 1660Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1a4l h SER 1660Cb 0.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1a4l h SER 1660CO 0.01 0.00 -1.37 0.79 -0.87 0.00 0.00 176.83 175.39 1a4l n TRP 1661N -2.58 0.95 -0.12 4.77 8.01 -0.81 -4.58 117.44 123.08 1a4l n TRP 1661Ca -0.01 0.31 -0.05 0.00 -1.31 0.00 0.00 57.50 56.44 1a4l n TRP 1661Cb 0.10 -1.05 0.02 0.00 -2.01 0.00 0.00 31.31 28.36 1a4l n TRP 1661CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1a4l h SER 1662N 0.00 -0.41 0.04 -0.99 0.02 -1.42 -1.74 113.55 109.05 1a4l h SER 1662Ca -0.14 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1a4l h SER 1662Cb 1.48 0.27 -0.00 0.00 0.14 0.00 0.00 62.40 64.29 1a4l h SER 1662CO 0.04 -0.15 -0.04 -0.07 -1.14 0.00 0.00 176.83 175.47 1a4l h LEU 1663N -0.02 0.00 -0.31 5.07 3.38 -1.77 -1.68 115.31 119.98 1a4l h LEU 1663Ca 0.20 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.97 1a4l h LEU 1663Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1a4l h LEU 1663CO -0.43 0.04 -0.82 -0.08 0.09 0.00 0.00 178.44 177.24 1a4l h GLU 1664N 0.00 0.37 -0.50 1.13 4.81 -1.62 -3.04 114.58 115.74 1a4l h GLU 1664Ca -0.00 -0.35 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1a4l h GLU 1664Cb 0.07 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1a4l h GLU 1664CO 0.01 1.01 0.30 0.28 -0.73 0.00 0.00 179.01 179.88 1a4l h VAL 1665N 0.24 1.14 0.11 0.32 2.07 -0.57 -2.30 116.25 117.27 1a4l h VAL 1665Ca -0.05 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1a4l h VAL 1665Cb 1.42 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1a4l h VAL 1665CO 0.14 0.15 -0.05 0.25 0.02 0.00 0.00 177.57 178.07 1a4l h LEU 1666N 0.68 -0.13 -1.99 2.57 5.85 -1.37 -1.70 115.31 119.23 1a4l h LEU 1666Ca 0.18 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.79 1a4l h LEU 1666Cb -0.03 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1a4l h LEU 1666CO -0.03 0.08 0.11 -0.33 -0.34 0.00 0.00 178.44 177.93 1a4l h GLU 1667N -0.33 0.01 -0.19 1.25 4.39 -1.36 0.10 114.58 118.45 1a4l h GLU 1667Ca -0.02 -0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.48 1a4l h GLU 1667Cb 0.27 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1a4l h GLU 1667CO 0.03 0.01 -0.66 -0.07 -1.16 0.00 0.00 179.01 177.15 1a4l h LEU 1668N 0.01 0.92 -0.96 1.33 -0.00 -1.18 -0.57 115.31 114.86 1a4l h LEU 1668Ca 0.07 -0.60 -0.02 0.00 -0.00 0.00 0.00 57.88 57.34 1a4l h LEU 1668Cb 0.28 -0.27 -0.04 0.00 -0.00 0.00 0.00 40.66 40.63 1a4l h LEU 1668CO -0.00 1.36 0.44 0.00 -0.00 0.00 0.00 178.44 180.23 1a4l h LYS 1670N 1.17 -0.40 -0.96 0.00 1.57 -0.84 -0.76 116.57 116.35 1a4l h LYS 1670Ca 0.29 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.18 1a4l h LYS 1670Cb 0.06 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 1a4l h LYS 1670CO -0.04 -0.07 0.61 -0.22 -0.57 0.00 0.00 179.45 179.16 1a4l h LYS 1671N -0.85 1.05 -0.64 3.15 3.64 -1.02 -2.41 116.57 119.49 1a4l h LYS 1671Ca -0.04 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.08 1a4l h LYS 1671Cb 0.52 -0.24 -0.11 0.00 -0.41 0.00 0.00 32.23 31.99 1a4l h LYS 1671CO 0.07 0.69 0.21 0.66 -2.27 0.00 0.00 179.45 178.81 1a4l n TYR 1672N -4.56 2.11 -1.70 1.91 4.01 -0.31 -4.96 117.16 113.65 1a4l n TYR 1672Ca 0.15 -1.23 -0.54 0.00 -0.16 0.00 0.00 57.90 56.13 1a4l n TYR 1672Cb 0.22 -0.62 -0.06 0.00 -0.31 0.00 0.00 39.34 38.56 1a4l n TYR 1672CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1a4l n ASN 1673N -0.35 2.82 0.00 7.72 2.85 -0.29 -1.20 115.26 126.80 1a4l n ASN 1673Ca 0.38 1.03 0.00 0.00 -0.11 0.00 0.00 54.58 55.88 1a4l n ASN 1673Cb 1.29 -1.23 0.00 0.00 1.24 0.00 0.00 39.78 41.08 1a4l n ASN 1673CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1a4l n GLN 1674N 5.92 0.00 -1.64 1.20 1.13 0.14 -4.75 117.38 119.38 1a4l n GLN 1674Ca 0.25 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.93 1a4l n GLN 1674Cb 0.19 -3.71 -0.02 0.00 0.11 0.00 0.00 30.24 26.81 1a4l n GLN 1674CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1a4l n LYS 1675N -2.00 4.04 0.00 -1.09 4.81 -0.34 -4.50 118.16 119.08 1a4l n LYS 1675Ca 0.00 -2.78 0.00 0.00 -0.87 0.00 0.00 58.31 54.66 1a4l n LYS 1675Cb 0.00 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.38 1a4l n LYS 1675CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1a4l n THR 1676N 2.54 0.00 -2.26 3.15 -2.24 -1.26 -4.93 114.28 109.28 1a4l n THR 1676Ca 0.69 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 62.04 1a4l n THR 1676Cb 0.27 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.48 1a4l n THR 1676CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1a4l s VAL 1677N -0.06 3.95 -0.08 2.28 1.01 -1.19 0.53 120.40 126.84 1a4l s VAL 1677Ca 0.00 1.09 0.12 0.00 0.00 0.00 0.00 61.98 63.19 1a4l s VAL 1677Cb 0.00 -3.89 -0.18 0.00 0.00 0.00 0.00 36.38 32.31 1a4l s VAL 1677CO 0.00 -0.30 0.30 1.33 0.00 0.00 0.00 175.10 176.43 1a4l n VAL 1678N 6.05 0.00 -3.83 2.92 0.24 0.46 0.25 118.33 124.41 1a4l n VAL 1678Ca 0.16 -0.27 -0.07 0.00 -2.04 0.00 0.00 64.34 62.12 1a4l n VAL 1678Cb 0.45 0.31 -0.01 0.00 -1.47 0.00 0.00 33.84 33.13 1a4l n VAL 1678CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1a4l s ALA 1679N -2.77 -1.18 0.16 2.33 0.00 -1.24 -3.83 121.76 115.23 1a4l s ALA 1679Ca -0.03 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 51.65 1a4l s ALA 1679Cb 0.08 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 1a4l s ALA 1679CO 0.51 -1.03 -0.09 1.41 0.00 0.00 0.00 175.76 176.56 1a4l s MET 1680N -3.39 2.10 0.12 0.00 1.75 -0.53 -1.83 119.30 117.52 1a4l s MET 1680Ca 0.13 -1.19 -0.01 0.00 -1.25 0.00 0.00 55.69 53.37 1a4l s MET 1680Cb -0.05 -2.21 -0.04 0.00 2.84 0.00 0.00 34.83 35.37 1a4l s MET 1680CO 0.07 0.46 0.04 0.34 -0.65 0.00 0.00 175.02 175.28 1a4l s ASP 1681N -2.65 0.44 -0.13 1.11 2.15 -0.19 -2.06 116.67 115.33 1a4l s ASP 1681Ca 0.24 -1.17 0.00 0.00 0.43 0.00 0.00 52.55 52.05 1a4l s ASP 1681Cb -0.09 0.26 0.02 0.00 -0.30 0.00 0.00 42.92 42.81 1a4l s ASP 1681CO 0.15 -0.69 -0.12 -0.22 -0.17 0.00 0.00 175.17 174.12 1a4l s LEU 1682N -3.04 1.51 0.00 -1.34 2.96 -1.23 0.58 118.68 118.12 1a4l s LEU 1682Ca 0.21 -0.42 0.05 0.00 -0.22 0.00 0.00 54.13 53.75 1a4l s LEU 1682Cb 0.07 -1.06 -0.02 0.00 0.50 0.00 0.00 46.19 45.69 1a4l s LEU 1682CO 0.00 -0.07 0.16 0.00 -1.32 0.00 0.00 176.35 175.12 1a4l n ALA 1683N 4.80 0.60 0.00 5.97 0.00 0.40 -1.91 120.51 130.37 1a4l n ALA 1683Ca -0.15 -2.07 0.00 0.00 0.00 0.00 0.00 53.44 51.21 1a4l n ALA 1683Cb 0.50 1.43 0.00 0.00 0.00 0.00 0.00 19.45 21.38 1a4l n ALA 1683CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a4l n GLY 1684N -0.81 -0.46 3.59 0.00 0.00 -1.26 -0.04 105.19 106.20 1a4l n GLY 1684Ca -0.04 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 1a4l n GLY 1684CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4l s ASP 1685N -4.00 6.18 0.03 1.61 2.15 -1.26 -4.86 116.67 116.52 1a4l s ASP 1685Ca 0.00 0.56 0.20 0.00 0.43 0.00 0.00 52.55 53.73 1a4l s ASP 1685Cb 0.00 -2.54 0.83 0.00 -0.30 0.00 0.00 42.92 40.90 1a4l s ASP 1685CO 0.00 -1.61 1.62 1.21 -0.17 0.00 0.00 175.17 176.22 1a4l n GLU 1686N 8.42 0.03 0.00 4.34 2.13 -1.26 -2.67 120.64 131.62 1a4l n GLU 1686Ca 0.15 0.20 0.15 0.00 0.66 0.00 0.00 57.16 58.31 1a4l n GLU 1686Cb 0.49 -1.54 0.72 0.00 0.27 0.00 0.00 31.44 31.38 1a4l n GLU 1686CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1a4l n THR 1687N -1.59 0.00 -2.18 6.31 -2.24 -1.26 -4.63 114.28 108.69 1a4l n THR 1687Ca 0.04 -0.01 -0.31 0.00 -2.27 0.00 0.00 64.05 61.51 1a4l n THR 1687Cb 0.23 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 67.98 1a4l n THR 1687CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1a4l s ILE 1688N -2.59 3.59 -0.29 2.28 1.01 -1.09 -4.89 121.20 119.21 1a4l s ILE 1688Ca 0.27 -0.57 -0.28 0.00 0.00 0.00 0.00 60.65 60.07 1a4l s ILE 1688Cb 0.20 -4.34 -0.12 0.00 0.01 0.00 0.00 42.46 38.21 1a4l s ILE 1688CO 0.47 -1.21 0.95 -0.62 0.00 0.00 0.00 174.94 174.54 1a4l n GLU 1689N 8.78 0.00 -1.52 2.79 -0.58 -1.26 -1.06 120.64 127.79 1a4l n GLU 1689Ca 0.39 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 57.00 1a4l n GLU 1689Cb 0.48 -0.90 -0.05 0.00 -0.57 0.00 0.00 31.44 30.40 1a4l n GLU 1689CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1a4l n GLY 1690N 2.37 1.12 0.24 0.62 0.00 -1.26 -4.92 105.19 103.35 1a4l n GLY 1690Ca 0.18 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.91 1a4l n GLY 1690CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1a4l h SER 1691N 0.00 0.00 0.58 1.61 4.64 -1.46 -2.53 113.55 116.39 1a4l h SER 1691Ca -0.27 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.96 1a4l h SER 1691Cb 0.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1a4l h SER 1691CO 0.38 0.17 -0.44 0.28 -0.87 0.00 0.00 176.83 176.36 1a4l h SER 1692N 0.00 0.00 -0.39 4.97 0.02 -1.91 -2.89 113.55 113.35 1a4l h SER 1692Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1a4l h SER 1692Cb 0.64 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1a4l h SER 1692CO 0.02 0.44 0.00 0.18 -1.14 0.00 0.00 176.83 176.33 1a4l n LEU 1693N -3.81 2.29 -4.68 5.07 4.32 -0.95 -4.38 117.00 114.85 1a4l n LEU 1693Ca -0.01 -1.15 -0.42 0.00 -0.02 0.00 0.00 56.01 54.41 1a4l n LEU 1693Cb 0.49 -0.30 -0.03 0.00 -1.62 0.00 0.00 43.42 41.96 1a4l n LEU 1693CO 0.39 0.53 1.21 -0.36 -1.22 0.00 0.00 177.39 177.93 1a4l s PHE 1694N -1.52 2.59 0.24 -1.77 0.08 -1.09 -4.83 117.98 111.68 1a4l s PHE 1694Ca 0.27 0.61 -0.10 0.00 0.12 0.00 0.00 56.93 57.83 1a4l s PHE 1694Cb 0.15 -3.75 0.36 0.00 -0.57 0.00 0.00 43.02 39.20 1a4l s PHE 1694CO 0.17 -2.92 1.44 -2.30 -0.10 0.00 0.00 175.22 171.51 1a4l n PRO 1695N 5.91 -0.13 -0.15 0.24 -0.02 -1.26 -0.32 135.00 139.26 1a4l n PRO 1695Ca 0.15 1.44 -0.04 0.00 -2.02 0.00 0.00 63.50 63.03 1a4l n PRO 1695Cb 0.43 -2.14 0.03 0.00 -0.02 0.00 0.00 33.50 31.80 1a4l n PRO 1695CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1a4l h GLY 1696N 0.00 0.26 0.94 -1.23 0.00 -1.91 0.17 103.07 101.30 1a4l h GLY 1696Ca 0.40 0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.91 1a4l h GLY 1696CO -0.94 -0.20 -0.31 0.45 0.00 0.00 0.00 176.54 175.54 1a4l h HIS 1697N -0.05 -0.80 -0.95 5.60 3.86 -0.88 -2.29 115.15 119.63 1a4l h HIS 1697Ca 0.23 -0.02 0.24 0.00 -1.16 0.00 0.00 60.37 59.67 1a4l h HIS 1697Cb 0.41 0.27 -0.13 0.00 1.06 0.00 0.00 27.41 29.02 1a4l h HIS 1697CO -0.45 -0.48 0.49 0.28 0.86 0.00 0.00 177.93 178.63 1a4l h VAL 1698N -0.94 0.47 -0.03 2.45 2.07 -0.54 -1.66 116.25 118.07 1a4l h VAL 1698Ca -0.09 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1a4l h VAL 1698Cb 0.69 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1a4l h VAL 1698CO 0.15 0.08 -0.13 -0.33 0.02 0.00 0.00 177.57 177.36 1a4l h GLU 1699N 0.46 0.14 -0.23 1.57 5.08 -0.59 -2.39 114.58 118.62 1a4l h GLU 1699Ca 0.62 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.92 1a4l h GLU 1699Cb 1.21 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.43 1a4l h GLU 1699CO -0.52 0.76 -0.09 0.00 -1.00 0.00 0.00 179.01 178.15 1a4l h ALA 1700N 0.39 0.11 -0.64 3.43 0.00 -0.81 0.43 119.26 122.16 1a4l h ALA 1700Ca -0.01 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1a4l h ALA 1700Cb 0.78 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1a4l h ALA 1700CO 0.03 -0.51 0.42 1.88 0.00 0.00 0.00 179.25 181.07 1a4l h TYR 1701N -0.05 0.80 -0.05 0.00 -1.99 -1.41 0.32 116.97 114.59 1a4l h TYR 1701Ca 0.12 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.86 1a4l h TYR 1701Cb 0.23 -0.27 -0.00 0.00 2.00 0.00 0.00 36.73 38.69 1a4l h TYR 1701CO -0.27 0.49 0.01 0.93 -0.00 0.00 0.00 178.16 179.33 1a4l h GLU 1702N 0.86 0.07 -0.02 4.88 5.08 -0.84 0.17 114.58 124.78 1a4l h GLU 1702Ca 0.24 -0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 58.42 1a4l h GLU 1702Cb -0.08 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1a4l h GLU 1702CO -0.06 0.07 -0.78 0.78 -1.00 0.00 0.00 179.01 178.02 1a4l h GLY 1703N 0.13 0.22 0.99 -3.84 0.00 0.13 -0.51 103.07 100.20 1a4l h GLY 1703Ca 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1a4l h GLY 1703CO -0.00 0.31 -0.10 0.00 0.00 0.00 0.00 176.54 176.75 1a4l h ALA 1704N 1.06 -0.29 0.20 3.60 0.00 0.23 0.56 119.26 124.63 1a4l h ALA 1704Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1a4l h ALA 1704Cb 1.37 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1a4l h ALA 1704CO 0.12 -0.65 -0.21 0.28 0.00 0.00 0.00 179.25 178.79 1a4l h VAL 1705N -0.30 0.55 -0.55 0.00 2.07 -0.98 0.22 116.25 117.26 1a4l h VAL 1705Ca -0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1a4l h VAL 1705Cb 0.23 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1a4l h VAL 1705CO 0.05 0.00 0.37 0.50 0.02 0.00 0.00 177.57 178.51 1a4l h LYS 1706N -0.45 0.40 -0.46 1.57 3.64 -0.98 -2.49 116.57 117.80 1a4l h LYS 1706Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1a4l h LYS 1706Cb 0.42 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1a4l h LYS 1706CO -0.05 0.26 0.00 0.09 -2.27 0.00 0.00 179.45 177.48 1a4l n ASN 1707N -4.47 3.93 -3.67 4.20 3.02 0.18 -4.99 115.26 113.46 1a4l n ASN 1707Ca 0.08 -2.42 -0.25 0.00 -0.03 0.00 0.00 54.58 51.97 1a4l n ASN 1707Cb 0.32 -0.45 0.06 0.00 -0.61 0.00 0.00 39.78 39.10 1a4l n ASN 1707CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4l n GLY 1708N 0.56 -0.48 3.69 7.41 0.00 0.33 -4.97 105.19 111.72 1a4l n GLY 1708Ca 0.20 0.21 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 1a4l n GLY 1708CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4l s ILE 1709N -3.35 5.20 0.66 -0.61 -1.09 0.50 -5.02 121.20 117.49 1a4l s ILE 1709Ca 0.47 0.12 -0.17 0.00 -2.23 0.00 0.00 60.65 58.84 1a4l s ILE 1709Cb -0.22 -3.37 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 1a4l s ILE 1709CO 0.77 0.44 1.21 -1.00 -1.23 0.00 0.00 174.94 175.13 1a4l s HIS 1710N 0.44 2.23 -0.05 3.97 3.76 -1.25 -4.30 115.29 120.08 1a4l s HIS 1710Ca 0.06 1.55 0.03 0.00 -0.15 0.00 0.00 55.06 56.55 1a4l s HIS 1710Cb -0.12 -3.49 0.01 0.00 1.11 0.00 0.00 32.58 30.09 1a4l s HIS 1710CO -0.01 -2.44 -0.12 1.03 -0.85 0.00 0.00 174.74 172.36 1a4l s ARG 1711N -3.62 1.43 0.04 1.40 0.52 -1.26 -1.45 118.95 116.00 1a4l s ARG 1711Ca 0.76 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 55.57 1a4l s ARG 1711Cb -0.30 -1.24 -0.03 0.00 0.52 0.00 0.00 34.95 33.90 1a4l s ARG 1711CO 0.39 0.10 -0.03 -0.08 0.02 0.00 0.00 175.30 175.69 1a4l s THR 1712N 0.39 0.20 -0.16 0.02 -1.32 -0.88 -1.07 115.64 112.83 1a4l s THR 1712Ca -0.08 -1.28 -0.15 0.00 -1.21 0.00 0.00 61.69 58.96 1a4l s THR 1712Cb -0.12 -0.79 0.04 0.00 -1.51 0.00 0.00 72.50 70.12 1a4l s THR 1712CO 0.02 -0.69 0.43 -0.69 -2.21 0.00 0.00 174.62 171.48 1a4l s VAL 1713N -2.43 -0.00 0.08 5.08 1.01 -1.20 -3.49 120.40 119.44 1a4l s VAL 1713Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.62 1a4l s VAL 1713Cb -0.03 -0.60 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 1a4l s VAL 1713CO -0.04 0.00 1.04 -1.00 0.00 0.00 0.00 175.10 175.10 1a4l s HIS 1714N 0.27 3.64 -0.13 5.22 3.76 -0.80 0.11 115.29 127.36 1a4l s HIS 1714Ca -0.00 1.63 -0.30 0.00 -0.15 0.00 0.00 55.06 56.23 1a4l s HIS 1714Cb -0.03 -3.19 0.11 0.00 1.11 0.00 0.00 32.58 30.58 1a4l s HIS 1714CO 0.00 -0.32 0.93 0.00 -0.85 0.00 0.00 174.74 174.49 1a4l s ALA 1715N 0.51 -1.90 -0.02 -1.40 0.00 -0.69 -4.86 121.76 113.41 1a4l s ALA 1715Ca 0.51 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.99 1a4l s ALA 1715Cb -0.25 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.33 1a4l s ALA 1715CO 0.30 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1a4l n GLY 1716N 0.75 0.23 0.09 0.00 0.00 -1.26 -0.28 105.19 104.72 1a4l n GLY 1716Ca -0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 1a4l n GLY 1716CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1a4l h GLU 1717N 0.42 -0.18 0.00 1.61 4.81 -1.91 -0.25 114.58 119.08 1a4l h GLU 1717Ca -0.00 0.01 -0.26 0.00 -0.13 0.00 0.00 59.36 58.98 1a4l h GLU 1717Cb 0.58 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.95 1a4l h GLU 1717CO 0.01 -0.12 -1.98 1.55 -0.73 0.00 0.00 179.01 177.74 1a4l n VAL 1718N -3.29 0.98 -1.42 0.32 3.14 -1.26 -4.61 118.33 112.18 1a4l n VAL 1718Ca -0.02 -0.55 -0.18 0.00 -2.96 0.00 0.00 64.34 60.62 1a4l n VAL 1718Cb 0.07 -0.74 0.13 0.00 -1.06 0.00 0.00 33.84 32.25 1a4l n VAL 1718CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a4l n GLY 1719N 2.24 -1.63 3.96 7.55 0.00 -1.26 -5.04 105.19 111.01 1a4l n GLY 1719Ca -0.25 -1.65 -0.26 0.00 0.00 0.00 0.00 46.02 43.86 1a4l n GLY 1719CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a4l s SER 1720N -3.90 3.96 0.00 1.61 1.04 -1.26 -4.53 113.70 110.62 1a4l s SER 1720Ca 0.47 0.05 0.10 0.00 0.48 0.00 0.00 55.95 57.04 1a4l s SER 1720Cb -0.02 -0.35 0.42 0.00 0.10 0.00 0.00 66.02 66.17 1a4l s SER 1720CO 0.33 -2.15 1.31 -0.81 0.98 0.00 0.00 173.24 172.90 1a4l n PRO 1721N -3.22 0.00 0.20 4.02 -0.04 -1.25 -2.02 135.00 132.69 1a4l n PRO 1721Ca 0.14 0.33 0.07 0.00 -0.04 0.00 0.00 63.50 64.00 1a4l n PRO 1721Cb 0.60 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.94 1a4l n PRO 1721CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1a4l h GLU 1722N 0.00 0.00 0.00 0.54 4.57 -1.92 0.15 114.58 117.91 1a4l h GLU 1722Ca 0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 1a4l h GLU 1722Cb 0.17 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.72 1a4l h GLU 1722CO 0.00 0.31 -1.06 0.28 -1.18 0.00 0.00 179.01 177.36 1a4l h VAL 1723N 0.00 1.52 -0.19 0.32 2.07 -1.78 -2.14 116.25 116.05 1a4l h VAL 1723Ca -0.00 -3.22 -0.05 0.00 0.82 0.00 0.00 66.70 64.24 1a4l h VAL 1723Cb 0.85 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 33.36 1a4l h VAL 1723CO 0.04 0.87 -0.09 0.58 0.02 0.00 0.00 177.57 178.99 1a4l h VAL 1724N 0.00 1.31 0.13 2.57 2.07 -1.50 -2.33 116.25 118.50 1a4l h VAL 1724Ca -0.05 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.34 1a4l h VAL 1724Cb 1.77 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 33.14 1a4l h VAL 1724CO 0.12 0.35 -0.53 -0.09 0.02 0.00 0.00 177.57 177.44 1a4l h ARG 1725N 0.10 -0.73 -0.62 1.57 2.43 -0.68 -1.69 114.38 114.75 1a4l h ARG 1725Ca 0.04 0.05 0.12 0.00 -0.81 0.00 0.00 59.98 59.38 1a4l h ARG 1725Cb 0.58 0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 30.20 1a4l h ARG 1725CO 0.03 -0.49 0.13 0.93 -1.51 0.00 0.00 179.97 179.06 1a4l h GLU 1726N -0.76 0.24 -0.23 0.20 5.08 -1.39 0.16 114.58 117.90 1a4l h GLU 1726Ca -0.00 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.40 1a4l h GLU 1726Cb 0.76 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.89 1a4l h GLU 1726CO -0.28 0.16 -0.22 0.00 -1.00 0.00 0.00 179.01 177.67 1a4l h ALA 1727N 1.51 -0.10 0.12 3.43 0.00 -0.82 0.19 119.26 123.60 1a4l h ALA 1727Ca 0.33 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1a4l h ALA 1727Cb 0.51 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1a4l h ALA 1727CO -0.43 -0.64 -0.06 0.28 0.00 0.00 0.00 179.25 178.39 1a4l h VAL 1728N -0.23 1.01 0.00 0.00 2.07 -0.62 -1.05 116.25 117.44 1a4l h VAL 1728Ca 0.13 -1.19 -0.16 0.00 0.82 0.00 0.00 66.70 66.30 1a4l h VAL 1728Cb 0.43 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1a4l h VAL 1728CO -0.36 0.26 -0.78 0.44 0.02 0.00 0.00 177.57 177.15 1a4l h ASP 1729N -0.79 0.00 0.00 0.57 3.32 -0.72 -2.98 116.42 115.82 1a4l h ASP 1729Ca -0.02 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1a4l h ASP 1729Cb 0.55 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1a4l h ASP 1729CO 0.03 0.78 -1.17 -0.38 -1.72 0.00 0.00 179.24 176.78 1a4l n ILE 1730N -3.34 1.50 0.32 0.35 2.08 0.58 -4.59 119.36 116.27 1a4l n ILE 1730Ca 0.01 0.08 0.14 0.00 0.56 0.00 0.00 62.75 63.53 1a4l n ILE 1730Cb 0.83 -2.29 0.44 0.00 -0.75 0.00 0.00 39.64 37.88 1a4l n ILE 1730CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1a4l h LEU 1731N -1.00 0.00 -2.07 1.39 4.07 -1.18 -3.47 115.31 113.04 1a4l h LEU 1731Ca -0.09 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 57.60 1a4l h LEU 1731Cb 1.05 0.00 0.17 0.00 1.08 0.00 0.00 40.66 42.97 1a4l h LEU 1731CO -0.05 0.00 -0.76 0.29 -1.08 0.00 0.00 178.44 176.83 1a4l n LYS 1732N -2.86 -4.19 -2.33 1.13 4.76 -0.44 -4.75 118.16 109.48 1a4l n LYS 1732Ca 0.03 0.80 -0.33 0.00 -2.87 0.00 0.00 58.31 55.94 1a4l n LYS 1732Cb 0.39 -5.60 -0.02 0.00 -1.84 0.00 0.00 35.03 27.96 1a4l n LYS 1732CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1a4l s THR 1733N -3.35 3.94 -0.32 -0.18 -4.23 -0.94 -4.83 115.64 105.73 1a4l s THR 1733Ca 0.21 1.04 0.22 0.00 -1.18 0.00 0.00 61.69 61.99 1a4l s THR 1733Cb -0.03 -3.47 -0.20 0.00 1.34 0.00 0.00 72.50 70.14 1a4l s THR 1733CO 0.69 -0.42 0.78 -0.62 -0.54 0.00 0.00 174.62 174.51 1a4l n GLU 1734N -1.48 0.48 -3.84 3.99 1.02 -0.23 -4.82 120.64 115.76 1a4l n GLU 1734Ca 0.08 -0.06 -0.10 0.00 -0.02 0.00 0.00 57.16 57.07 1a4l n GLU 1734Cb 0.53 -1.60 -0.08 0.00 -0.02 0.00 0.00 31.44 30.27 1a4l n GLU 1734CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1a4l s ARG 1735N -3.35 0.76 -0.17 3.49 0.52 -1.19 -4.17 118.95 114.84 1a4l s ARG 1735Ca -0.02 -0.76 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 1a4l s ARG 1735Cb 0.13 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.92 1a4l s ARG 1735CO 0.85 -0.23 -0.16 0.08 0.02 0.00 0.00 175.30 175.86 1a4l s VAL 1736N -3.10 2.51 -0.13 3.52 1.01 -0.31 -3.25 120.40 120.65 1a4l s VAL 1736Ca -0.01 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.86 1a4l s VAL 1736Cb 0.01 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1a4l s VAL 1736CO -0.07 0.52 1.29 -0.83 0.00 0.00 0.00 175.10 176.00 1a4l s GLY 1737N 1.01 1.74 0.00 4.51 0.00 0.31 -0.71 107.32 114.17 1a4l s GLY 1737Ca -0.02 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.25 1a4l s GLY 1737CO -0.04 2.48 0.00 1.42 0.00 0.00 0.00 173.10 176.96 1a4l n HIS 1738N 6.29 0.00 -1.72 1.90 8.25 0.20 -1.70 115.22 128.44 1a4l n HIS 1738Ca 0.13 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.39 1a4l n HIS 1738Cb 0.45 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.48 1a4l n HIS 1738CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a4l n GLY 1739N 0.00 1.62 0.34 -1.41 0.00 0.62 -4.42 105.19 101.95 1a4l n GLY 1739Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1a4l n GLY 1739CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1a4l h TYR 1740N 0.00 0.92 0.00 1.61 0.05 -1.68 -2.46 116.97 115.41 1a4l h TYR 1740Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.35 1a4l h TYR 1740Cb 1.36 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.79 1a4l h TYR 1740CO 0.58 0.61 0.00 0.72 -1.05 0.00 0.00 178.16 179.02 1a4l n HIS 1741N -4.40 0.00 -0.26 4.88 8.25 -0.14 -3.43 115.22 120.12 1a4l n HIS 1741Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1a4l n HIS 1741Cb 0.07 0.00 0.21 0.00 1.12 0.00 0.00 29.99 31.39 1a4l n HIS 1741CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1a4l h THR 1742N 0.00 1.20 0.00 1.59 2.02 -1.69 -2.45 112.91 113.58 1a4l h THR 1742Ca 0.00 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1a4l h THR 1742Cb 0.00 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.41 1a4l h THR 1742CO 0.00 0.20 0.00 2.30 0.37 0.00 0.00 175.52 178.39 1a4l n ILE 1743N -4.42 0.00 0.52 3.11 -5.35 -1.22 -1.95 119.36 110.05 1a4l n ILE 1743Ca 0.10 0.00 0.11 0.00 -0.27 0.00 0.00 62.75 62.68 1a4l n ILE 1743Cb 0.04 -0.25 -0.08 0.00 -1.74 0.00 0.00 39.64 37.61 1a4l n ILE 1743CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1a4l n GLU 1744N -0.16 0.32 -3.94 6.28 1.02 -0.92 -4.62 120.64 118.62 1a4l n GLU 1744Ca 0.00 -0.06 -0.30 0.00 -0.02 0.00 0.00 57.16 56.78 1a4l n GLU 1744Cb 0.06 -1.55 -0.14 0.00 -0.02 0.00 0.00 31.44 29.80 1a4l n GLU 1744CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1a4l s ASP 1745N -3.84 4.27 0.21 1.62 -1.08 -0.82 -5.02 116.67 112.01 1a4l s ASP 1745Ca 0.01 -2.99 -0.18 0.00 -0.52 0.00 0.00 52.55 48.88 1a4l s ASP 1745Cb 0.15 -1.60 0.19 0.00 -1.46 0.00 0.00 42.92 40.20 1a4l s ASP 1745CO 0.86 -0.23 1.58 -0.33 0.52 0.00 0.00 175.17 177.56 1a4l h GLU 1746N 6.52 -0.09 -0.53 4.34 4.39 -1.82 -0.12 114.58 127.27 1a4l h GLU 1746Ca -0.08 0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.72 1a4l h GLU 1746Cb 0.89 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.49 1a4l h GLU 1746CO 0.68 -0.06 0.11 0.00 -1.16 0.00 0.00 179.01 178.57 1a4l h ALA 1747N 1.23 0.60 0.07 3.43 0.00 -1.95 0.89 119.26 123.54 1a4l h ALA 1747Ca 0.29 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 1a4l h ALA 1747Cb 0.57 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1a4l h ALA 1747CO -0.79 -0.31 -0.03 1.25 0.00 0.00 0.00 179.25 179.37 1a4l h LEU 1748N 0.24 -0.08 0.32 0.00 5.85 -1.59 -2.08 115.31 117.98 1a4l h LEU 1748Ca 0.27 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1a4l h LEU 1748Cb 0.37 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1a4l h LEU 1748CO -0.35 0.04 -0.29 0.22 -0.34 0.00 0.00 178.44 177.73 1a4l h TYR 1749N -0.19 -0.76 0.00 1.25 3.20 -0.32 -0.90 116.97 119.25 1a4l h TYR 1749Ca -0.01 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1a4l h TYR 1749Cb 0.16 0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 1a4l h TYR 1749CO -0.04 -0.42 -0.07 -0.91 -1.64 0.00 0.00 178.16 175.08 1a4l h ASN 1750N -0.63 0.00 0.22 -2.11 4.21 -0.87 0.17 115.58 116.57 1a4l h ASN 1750Ca -0.02 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.16 1a4l h ASN 1750Cb 0.56 0.00 0.04 0.00 -1.12 0.00 0.00 38.32 37.80 1a4l h ASN 1750CO -0.03 0.07 -1.41 -0.09 -1.29 0.00 0.00 177.43 174.67 1a4l h ARG 1751N 0.00 0.57 -0.16 0.81 2.43 -1.01 -1.01 114.38 116.01 1a4l h ARG 1751Ca -0.00 -0.91 -0.17 0.00 -0.81 0.00 0.00 59.98 58.09 1a4l h ARG 1751Cb 0.34 0.33 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1a4l h ARG 1751CO 0.01 1.43 -0.61 -0.07 -1.51 0.00 0.00 179.97 179.22 1a4l h LEU 1752N 0.19 0.63 -0.19 3.80 4.07 -0.72 -0.87 115.31 122.22 1a4l h LEU 1752Ca -0.24 -0.36 -0.01 0.00 0.08 0.00 0.00 57.88 57.35 1a4l h LEU 1752Cb 2.10 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 43.65 1a4l h LEU 1752CO 0.27 1.09 0.07 0.25 -1.08 0.00 0.00 178.44 179.04 1a4l h LEU 1753N 0.41 0.26 -2.17 1.67 5.85 -0.73 -1.60 115.31 119.00 1a4l h LEU 1753Ca -0.01 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.56 1a4l h LEU 1753Cb 1.17 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1a4l h LEU 1753CO 0.11 0.36 0.06 0.50 -0.34 0.00 0.00 178.44 179.13 1a4l h LYS 1754N 0.15 0.00 -0.63 1.25 3.64 -0.96 -1.20 116.57 118.82 1a4l h LYS 1754Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1a4l h LYS 1754Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1a4l h LYS 1754CO -0.00 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.57 1a4l n GLU 1755N -4.23 2.72 -3.83 1.90 1.02 -0.35 -4.95 120.64 112.93 1a4l n GLU 1755Ca -0.01 -2.30 -0.29 0.00 -0.02 0.00 0.00 57.16 54.54 1a4l n GLU 1755Cb 0.16 -1.58 0.04 0.00 -0.02 0.00 0.00 31.44 30.04 1a4l n GLU 1755CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1a4l n ASN 1756N 1.20 -5.27 -4.73 1.62 4.05 -0.45 -4.91 115.26 106.76 1a4l n ASN 1756Ca 0.21 -0.71 -0.41 0.00 0.45 0.00 0.00 54.58 54.12 1a4l n ASN 1756Cb 0.60 -4.18 -0.03 0.00 1.23 0.00 0.00 39.78 37.40 1a4l n ASN 1756CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 1a4l s MET 1757N -6.54 4.42 -0.20 1.20 1.75 -0.68 -4.90 119.30 114.35 1a4l s MET 1757Ca 0.65 1.96 -0.20 0.00 -1.25 0.00 0.00 55.69 56.85 1a4l s MET 1757Cb -0.31 -3.24 -0.03 0.00 2.84 0.00 0.00 34.83 34.09 1a4l s MET 1757CO 0.80 -0.22 0.58 -1.58 -0.65 0.00 0.00 175.02 173.94 1a4l s HIS 1758N 0.32 3.37 -0.22 4.11 2.46 -1.24 -4.23 115.29 119.85 1a4l s HIS 1758Ca 0.57 0.85 -0.08 0.00 0.47 0.00 0.00 55.06 56.87 1a4l s HIS 1758Cb -0.34 -2.74 -0.04 0.00 -0.13 0.00 0.00 32.58 29.33 1a4l s HIS 1758CO 0.35 -0.15 0.08 -0.06 -2.47 0.00 0.00 174.74 172.49 1a4l s PHE 1759N 1.81 3.18 -0.70 3.88 0.08 0.34 -1.16 117.98 125.41 1a4l s PHE 1759Ca 0.26 -0.11 -0.22 0.00 0.12 0.00 0.00 56.93 56.99 1a4l s PHE 1759Cb -0.16 -2.17 0.08 0.00 -0.57 0.00 0.00 43.02 40.20 1a4l s PHE 1759CO 0.10 -0.08 0.98 -1.21 -0.10 0.00 0.00 175.22 174.91 1a4l s GLU 1760N 1.00 3.18 -0.06 0.44 2.02 0.11 -1.49 118.70 123.90 1a4l s GLU 1760Ca 0.04 -0.98 -0.19 0.00 0.02 0.00 0.00 54.97 53.86 1a4l s GLU 1760Cb -0.14 -4.34 -0.05 0.00 0.10 0.00 0.00 34.13 29.71 1a4l s GLU 1760CO 0.03 -1.81 0.54 0.08 0.02 0.00 0.00 175.26 174.13 1a4l s VAL 1761N 3.84 5.05 -0.45 2.63 1.01 -0.51 0.58 120.40 132.55 1a4l s VAL 1761Ca 0.23 1.12 0.02 0.00 0.00 0.00 0.00 61.98 63.35 1a4l s VAL 1761Cb -0.15 -3.88 0.14 0.00 0.00 0.00 0.00 36.38 32.48 1a4l s VAL 1761CO 0.07 0.37 0.24 0.00 0.00 0.00 0.00 175.10 175.79 1a4l h PRO 1763N 6.70 -0.32 -0.47 0.00 0.11 -1.94 -0.74 132.00 135.34 1a4l h PRO 1763Ca -0.01 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.16 1a4l h PRO 1763Cb 0.92 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 1a4l h PRO 1763CO 0.50 -0.21 0.24 2.35 -0.21 0.00 0.00 178.00 180.66 1a4l h TRP 1764N -0.33 0.44 -0.37 0.65 -0.00 -1.90 -2.33 115.95 112.11 1a4l h TRP 1764Ca -0.02 0.02 0.07 0.00 -0.00 0.00 0.00 58.89 58.96 1a4l h TRP 1764Cb 0.28 -0.13 -0.06 0.00 -0.00 0.00 0.00 29.16 29.25 1a4l h TRP 1764CO -0.08 0.22 -0.04 1.03 -0.00 0.00 0.00 178.44 179.56 1a4l h SER 1765N 0.47 -0.24 -0.06 2.65 0.87 -1.83 -1.88 113.55 113.52 1a4l h SER 1765Ca 0.20 0.10 0.02 0.00 -1.23 0.00 0.00 61.79 60.88 1a4l h SER 1765Cb 0.11 0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 1a4l h SER 1765CO -0.14 -0.08 0.13 0.77 -0.53 0.00 0.00 176.83 176.98 1a4l h SER 1766N 0.05 0.00 0.08 6.23 4.64 -0.57 -1.23 113.55 122.76 1a4l h SER 1766Ca 0.18 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1a4l h SER 1766Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1a4l h SER 1766CO -0.34 0.00 -0.04 0.22 -0.87 0.00 0.00 176.83 175.80 1a4l h TYR 1767N 0.00 -0.10 -0.43 4.77 3.20 -1.17 0.12 116.97 123.36 1a4l h TYR 1767Ca 0.03 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.97 1a4l h TYR 1767Cb 0.29 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1a4l h TYR 1767CO 0.00 0.13 0.29 -0.07 -1.64 0.00 0.00 178.16 176.87 1a4l h LEU 1768N -1.01 0.23 0.00 2.82 -0.00 -1.12 -0.19 115.31 116.05 1a4l h LEU 1768Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1a4l h LEU 1768Cb 0.28 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.89 1a4l h LEU 1768CO 0.02 0.15 -0.21 0.35 -0.00 0.00 0.00 178.44 178.75 1a4l n THR 1769N -4.47 0.19 -0.83 0.22 -2.24 -0.53 -0.77 114.28 105.86 1a4l n THR 1769Ca 0.06 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1a4l n THR 1769Cb 0.31 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1a4l n THR 1769CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4l n GLY 1770N 1.43 0.63 0.22 3.38 0.00 -0.08 -3.34 105.19 107.42 1a4l n GLY 1770Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 1a4l n GLY 1770CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l h ALA 1771N 0.00 1.35 -3.13 4.61 0.00 -1.54 -3.40 119.26 117.15 1a4l h ALA 1771Ca 0.00 -0.23 -0.67 0.00 0.00 0.00 0.00 54.91 54.02 1a4l h ALA 1771Cb 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 17.79 17.42 1a4l h ALA 1771CO 0.00 0.31 -0.80 -0.46 0.00 0.00 0.00 179.25 178.30 1a4l s TRP 1772N -4.19 2.90 -0.25 0.00 -0.00 -0.05 -4.83 118.94 112.52 1a4l s TRP 1772Ca -0.03 -1.50 -0.29 0.00 -0.00 0.00 0.00 56.10 54.28 1a4l s TRP 1772Cb 0.14 -1.99 -0.02 0.00 -0.00 0.00 0.00 33.47 31.59 1a4l s TRP 1772CO 0.67 -0.74 1.66 0.34 -0.00 0.00 0.00 176.95 178.88 1a4l s ASP 1773N 1.33 6.26 0.09 5.86 -1.08 -1.26 -4.71 116.67 123.16 1a4l s ASP 1773Ca 0.03 1.54 0.09 0.00 -0.52 0.00 0.00 52.55 53.69 1a4l s ASP 1773Cb -0.14 -2.53 0.43 0.00 -1.46 0.00 0.00 42.92 39.22 1a4l s ASP 1773CO -0.09 -1.37 1.28 -0.81 0.52 0.00 0.00 175.17 174.70 1a4l n PRO 1774N 7.86 0.04 0.00 4.34 -0.04 -1.26 -1.18 135.00 144.76 1a4l n PRO 1774Ca 0.20 0.48 0.14 0.00 -0.04 0.00 0.00 63.50 64.27 1a4l n PRO 1774Cb 0.46 -1.63 0.52 0.00 -0.04 0.00 0.00 33.50 32.81 1a4l n PRO 1774CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1a4l n LYS 1775N -1.72 0.78 -4.26 0.54 5.02 -1.26 -4.87 118.16 112.39 1a4l n LYS 1775Ca 0.00 -0.36 -0.27 0.00 -2.02 0.00 0.00 58.31 55.66 1a4l n LYS 1775Cb 0.05 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.48 1a4l n LYS 1775CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1a4l s THR 1776N -2.47 3.31 0.30 -0.18 -4.23 -0.33 -5.09 115.64 106.94 1a4l s THR 1776Ca 0.27 -1.54 -0.29 0.00 -1.18 0.00 0.00 61.69 58.95 1a4l s THR 1776Cb 0.20 -2.62 -0.10 0.00 1.34 0.00 0.00 72.50 71.32 1a4l s THR 1776CO 0.49 -0.06 1.33 0.28 -0.54 0.00 0.00 174.62 176.11 1a4l s THR 1777N -1.60 2.79 0.16 3.99 -1.32 -1.26 -4.85 115.64 113.54 1a4l s THR 1777Ca 0.24 0.74 -0.31 0.00 -1.21 0.00 0.00 61.69 61.16 1a4l s THR 1777Cb -0.09 -3.47 -0.08 0.00 -1.51 0.00 0.00 72.50 67.34 1a4l s THR 1777CO 0.15 0.16 1.36 -2.28 -2.21 0.00 0.00 174.62 171.80 1a4l s HIS 1778N -0.76 3.23 0.34 9.09 2.46 -1.26 -4.91 115.29 123.48 1a4l s HIS 1778Ca 0.52 1.06 0.15 0.00 0.47 0.00 0.00 55.06 57.25 1a4l s HIS 1778Cb -0.40 -3.66 1.11 0.00 -0.13 0.00 0.00 32.58 29.51 1a4l s HIS 1778CO 0.49 -2.22 1.64 0.00 -2.47 0.00 0.00 174.74 172.19 1a4l h ALA 1779N 6.14 1.94 -0.30 1.58 0.00 -1.91 0.15 119.26 126.86 1a4l h ALA 1779Ca -0.43 0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.77 1a4l h ALA 1779Cb 1.21 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1a4l h ALA 1779CO 0.82 -0.65 0.28 -0.24 0.00 0.00 0.00 179.25 179.46 1a4l h VAL 1780N 0.24 0.55 -0.21 0.00 3.04 -1.95 0.15 116.25 118.08 1a4l h VAL 1780Ca 0.75 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 66.41 1a4l h VAL 1780Cb 1.75 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.81 1a4l h VAL 1780CO -0.65 0.00 0.03 0.58 -1.01 0.00 0.00 177.57 176.52 1a4l h VAL 1781N 0.00 1.23 -0.72 1.51 2.07 -1.08 0.31 116.25 119.57 1a4l h VAL 1781Ca 0.14 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.90 1a4l h VAL 1781Cb 0.69 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1a4l h VAL 1781CO -0.00 0.24 0.48 -0.09 0.02 0.00 0.00 177.57 178.22 1a4l h ARG 1782N 0.15 0.95 -0.47 1.57 9.65 -0.86 -0.07 114.38 125.29 1a4l h ARG 1782Ca 0.06 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.90 1a4l h ARG 1782Cb 0.33 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 1a4l h ARG 1782CO 0.01 0.63 0.29 0.74 2.80 0.00 0.00 179.97 184.44 1a4l h PHE 1783N 0.98 0.54 0.14 2.20 0.04 -0.72 0.25 116.94 120.38 1a4l h PHE 1783Ca 0.27 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 1a4l h PHE 1783Cb -0.11 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 37.86 1a4l h PHE 1783CO -0.02 0.32 -0.07 -0.22 -0.60 0.00 0.00 178.31 177.72 1a4l h LYS 1784N 0.58 -0.18 -0.95 1.51 3.64 0.37 0.41 116.57 121.96 1a4l h LYS 1784Ca 0.18 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1a4l h LYS 1784Cb -0.01 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1a4l h LYS 1784CO -0.07 -0.06 0.63 -0.91 -2.27 0.00 0.00 179.45 176.77 1a4l h ASN 1785N -0.25 1.07 -0.28 4.20 2.35 -0.82 -1.75 115.58 120.10 1a4l h ASN 1785Ca -0.02 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1a4l h ASN 1785Cb 0.20 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1a4l h ASN 1785CO 0.03 0.77 0.00 0.47 -1.65 0.00 0.00 177.43 177.05 1a4l n ASP 1786N -4.41 1.82 -3.84 5.81 8.00 0.06 -4.91 116.55 119.08 1a4l n ASP 1786Ca 0.12 -2.07 -0.24 0.00 0.71 0.00 0.00 54.79 53.31 1a4l n ASP 1786Cb 0.04 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.87 1a4l n ASP 1786CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1a4l n LYS 1787N 0.33 -3.79 -2.54 -1.24 4.76 -0.66 -4.95 118.16 110.08 1a4l n LYS 1787Ca 0.10 0.49 -0.32 0.00 -2.87 0.00 0.00 58.31 55.71 1a4l n LYS 1787Cb 0.32 -4.75 -0.04 0.00 -1.84 0.00 0.00 35.03 28.72 1a4l n LYS 1787CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1a4l s ALA 1788N -3.83 3.14 -0.93 7.82 0.00 0.14 -5.01 121.76 123.09 1a4l s ALA 1788Ca 0.02 0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.88 1a4l s ALA 1788Cb -0.01 -3.01 0.11 0.00 0.00 0.00 0.00 23.12 20.21 1a4l s ALA 1788CO 0.86 -0.15 1.20 1.21 0.00 0.00 0.00 175.76 178.87 1a4l s ASN 1789N -3.04 6.56 0.34 0.00 3.04 -1.26 -4.83 114.94 115.76 1a4l s ASN 1789Ca 0.57 -1.82 0.04 0.00 0.04 0.00 0.00 52.86 51.69 1a4l s ASN 1789Cb -0.10 -2.44 -0.04 0.00 -1.54 0.00 0.00 41.25 37.13 1a4l s ASN 1789CO 0.30 -1.21 0.14 -0.72 -3.04 0.00 0.00 177.10 172.58 1a4l s TYR 1790N 3.37 1.71 0.04 0.43 1.13 -1.26 -0.51 117.35 122.27 1a4l s TYR 1790Ca 0.35 -1.31 -0.03 0.00 -1.41 0.00 0.00 57.07 54.68 1a4l s TYR 1790Cb -0.04 -1.00 -0.02 0.00 -1.10 0.00 0.00 41.96 39.79 1a4l s TYR 1790CO -0.08 -0.40 0.02 -1.54 -2.51 0.00 0.00 175.55 171.03 1a4l s SER 1791N -3.47 0.31 -0.19 -0.18 1.04 -0.56 -4.51 113.70 106.15 1a4l s SER 1791Ca 0.32 -0.71 -0.14 0.00 0.48 0.00 0.00 55.95 55.90 1a4l s SER 1791Cb 0.04 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1a4l s SER 1791CO 0.17 -0.50 0.31 -0.76 0.98 0.00 0.00 173.24 173.44 1a4l s LEU 1792N -2.29 4.19 0.12 2.42 1.02 -1.26 -1.43 118.68 121.45 1a4l s LEU 1792Ca -0.03 0.45 0.02 0.00 0.02 0.00 0.00 54.13 54.59 1a4l s LEU 1792Cb 0.00 -2.39 -0.04 0.00 0.02 0.00 0.00 46.19 43.78 1a4l s LEU 1792CO -0.06 0.02 -0.06 0.20 0.02 0.00 0.00 176.35 176.47 1a4l s ASN 1793N 0.80 1.27 -0.05 2.29 -0.87 0.22 -4.73 114.94 113.88 1a4l s ASN 1793Ca 0.16 -1.04 0.06 0.00 -1.57 0.00 0.00 52.86 50.47 1a4l s ASN 1793Cb -0.14 0.08 -0.24 0.00 -0.02 0.00 0.00 41.25 40.93 1a4l s ASN 1793CO 0.06 -0.46 0.65 0.00 -2.57 0.00 0.00 177.10 174.78 1a4l h THR 1794N 2.88 0.88 0.00 1.60 1.03 -1.85 -3.38 112.91 114.07 1a4l h THR 1794Ca -0.36 -2.67 0.00 0.00 -0.01 0.00 0.00 66.41 63.37 1a4l h THR 1794Cb 1.18 2.50 0.00 0.00 -1.07 0.00 0.00 68.15 70.76 1a4l h THR 1794CO 0.64 0.65 0.00 -0.67 -0.01 0.00 0.00 175.52 176.13 1a4l n ASP 1795N -3.21 0.00 -3.38 0.00 2.03 -0.62 -4.19 116.55 107.17 1a4l n ASP 1795Ca -0.19 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 54.88 1a4l n ASP 1795Cb 1.04 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 41.35 1a4l n ASP 1795CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1a4l s ASP 1796N -2.14 1.84 0.34 1.67 1.11 -1.26 0.04 116.67 118.27 1a4l s ASP 1796Ca 0.00 -2.13 0.03 0.00 0.18 0.00 0.00 52.55 50.63 1a4l s ASP 1796Cb 0.00 0.03 0.65 0.00 1.07 0.00 0.00 42.92 44.67 1a4l s ASP 1796CO 0.00 -0.25 1.96 -0.65 1.18 0.00 0.00 175.17 177.40 1a4l h PRO 1797N 6.67 0.84 0.71 8.23 0.11 -1.70 -2.11 132.00 144.75 1a4l h PRO 1797Ca 0.10 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.12 1a4l h PRO 1797Cb 0.99 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1a4l h PRO 1797CO 0.25 0.56 -0.36 1.25 -0.21 0.00 0.00 178.00 179.48 1a4l h LEU 1798N 0.87 -0.87 -0.97 2.35 5.85 -1.34 -0.55 115.31 120.65 1a4l h LEU 1798Ca 0.32 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.96 1a4l h LEU 1798Cb 0.16 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1a4l h LEU 1798CO -0.10 -0.60 -0.51 0.40 -0.34 0.00 0.00 178.44 177.29 1a4l h ILE 1799N -0.98 1.37 -0.13 4.05 2.04 -1.69 -3.01 117.51 119.15 1a4l h ILE 1799Ca -0.10 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.01 1a4l h ILE 1799Cb 0.76 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1a4l h ILE 1799CO 0.14 0.50 0.00 0.49 0.00 0.00 0.00 178.15 179.29 1a4l n PHE 1800N -3.93 0.16 -3.76 1.37 3.72 -0.80 0.15 117.46 114.36 1a4l n PHE 1800Ca -0.01 -0.08 -0.29 0.00 -0.05 0.00 0.00 57.45 57.02 1a4l n PHE 1800Cb 0.53 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.08 1a4l n PHE 1800CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1a4l n LYS 1801N 0.55 -1.11 -3.95 -1.08 5.02 -0.27 -4.83 118.16 112.50 1a4l n LYS 1801Ca 0.17 0.60 -0.12 0.00 -2.02 0.00 0.00 58.31 56.95 1a4l n LYS 1801Cb 0.41 -3.09 -0.01 0.00 -0.02 0.00 0.00 35.03 32.32 1a4l n LYS 1801CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1a4l s SER 1802N -3.22 0.47 0.31 4.39 1.04 -0.86 -5.06 113.70 110.78 1a4l s SER 1802Ca 0.22 -1.32 0.04 0.00 0.48 0.00 0.00 55.95 55.36 1a4l s SER 1802Cb -0.10 0.76 -0.04 0.00 0.10 0.00 0.00 66.02 66.74 1a4l s SER 1802CO 0.89 -1.51 0.17 0.42 0.98 0.00 0.00 173.24 174.19 1a4l s THR 1803N -2.65 0.33 0.19 2.02 -4.23 -1.26 -4.72 115.64 105.32 1a4l s THR 1803Ca 0.23 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 59.07 1a4l s THR 1803Cb -0.03 -2.50 0.34 0.00 1.34 0.00 0.00 72.50 71.66 1a4l s THR 1803CO 0.16 0.00 2.02 0.25 -0.54 0.00 0.00 174.62 176.51 1a4l h LEU 1804N 2.17 0.00 -0.90 4.79 5.85 -1.97 0.28 115.31 125.53 1a4l h LEU 1804Ca -0.33 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 1a4l h LEU 1804Cb 1.25 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 1a4l h LEU 1804CO 0.51 0.00 -0.30 -0.78 -0.34 0.00 0.00 178.44 177.53 1a4l h ASP 1805N 0.00 0.00 -0.16 1.25 3.58 -1.95 -2.87 116.42 116.26 1a4l h ASP 1805Ca 0.00 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.46 1a4l h ASP 1805Cb 0.10 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.14 1a4l h ASP 1805CO 0.00 0.30 0.07 0.74 -2.88 0.00 0.00 179.24 177.47 1a4l h THR 1806N 0.00 0.98 -0.42 2.25 2.02 -1.33 0.09 112.91 116.50 1a4l h THR 1806Ca -0.00 -0.05 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 1a4l h THR 1806Cb 0.87 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 1a4l h THR 1806CO 0.04 0.03 -0.09 0.44 0.37 0.00 0.00 175.52 176.31 1a4l h ASP 1807N 0.16 0.81 -0.70 4.18 5.19 -1.67 -1.50 116.42 122.89 1a4l h ASP 1807Ca 0.07 -0.36 -0.07 0.00 -0.62 0.00 0.00 57.03 56.05 1a4l h ASP 1807Cb 0.02 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.28 1a4l h ASP 1807CO -0.06 0.98 0.16 1.88 -3.12 0.00 0.00 179.24 179.08 1a4l h TYR 1808N 0.63 1.19 -0.13 4.55 -1.99 -1.27 -1.43 116.97 118.52 1a4l h TYR 1808Ca 0.11 -0.15 -0.15 0.00 2.00 0.00 0.00 58.73 60.54 1a4l h TYR 1808Cb 0.62 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 1a4l h TYR 1808CO 0.05 0.97 -0.54 1.96 -0.00 0.00 0.00 178.16 180.60 1a4l h GLN 1809N 1.06 0.39 0.12 4.88 1.08 -0.94 -1.33 115.11 120.38 1a4l h GLN 1809Ca 0.22 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 1a4l h GLN 1809Cb 0.39 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1a4l h GLN 1809CO 0.01 0.84 -0.06 1.98 -0.95 0.00 0.00 178.83 180.64 1a4l h MET 1810N 0.30 -0.16 0.00 1.46 4.05 -1.00 -0.20 114.93 119.38 1a4l h MET 1810Ca 0.01 0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.34 1a4l h MET 1810Cb 1.05 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.87 1a4l h MET 1810CO 0.09 -0.01 -0.46 1.79 0.23 0.00 0.00 176.91 178.55 1a4l h THR 1811N -0.28 1.32 0.27 -0.77 1.35 -1.25 -3.01 112.91 110.54 1a4l h THR 1811Ca -0.02 -1.59 -0.01 0.00 -0.55 0.00 0.00 66.41 64.24 1a4l h THR 1811Cb 0.23 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1a4l h THR 1811CO 0.03 0.45 -0.13 0.50 -0.25 0.00 0.00 175.52 176.12 1a4l h LYS 1812N 0.00 -0.35 0.12 4.72 3.64 -1.06 -0.88 116.57 122.77 1a4l h LYS 1812Ca -0.00 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1a4l h LYS 1812Cb 0.82 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 1a4l h LYS 1812CO 0.06 -0.23 -0.38 0.87 -2.27 0.00 0.00 179.45 177.50 1a4l h LYS 1813N -0.81 -0.54 -6.35 1.90 1.57 -1.14 -3.07 116.57 108.14 1a4l h LYS 1813Ca -0.04 0.04 -0.44 0.00 -1.87 0.00 0.00 60.65 58.34 1a4l h LYS 1813Cb 0.27 0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1a4l h LYS 1813CO 0.06 -0.36 -0.32 -0.51 -0.57 0.00 0.00 179.45 177.75 1a4l s ASP 1814N -3.99 5.95 0.00 0.86 1.01 -1.14 -4.38 116.67 114.99 1a4l s ASP 1814Ca -0.12 -0.16 0.00 0.00 0.71 0.00 0.00 52.55 52.98 1a4l s ASP 1814Cb 0.04 -1.24 0.00 0.00 1.01 0.00 0.00 42.92 42.73 1a4l s ASP 1814CO 0.43 -0.46 0.00 0.23 0.21 0.00 0.00 175.17 175.58 1a4l n MET 1815N -1.68 0.00 -4.16 8.23 2.81 -1.26 -4.15 117.12 116.92 1a4l n MET 1815Ca 0.00 0.00 -0.29 0.00 -1.81 0.00 0.00 57.70 55.61 1a4l n MET 1815Cb 0.58 -2.89 -0.06 0.00 -0.71 0.00 0.00 33.22 30.14 1a4l n MET 1815CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a4l n GLY 1816N -2.00 -0.18 3.81 3.03 0.00 -1.00 -4.88 105.19 103.97 1a4l n GLY 1816Ca 0.00 0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1a4l n GLY 1816CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a4l s PHE 1817N -4.19 3.43 0.36 1.61 0.40 -0.37 -4.97 117.98 114.25 1a4l s PHE 1817Ca 0.01 1.66 0.09 0.00 -0.60 0.00 0.00 56.93 58.08 1a4l s PHE 1817Cb -0.00 -2.87 -0.07 0.00 0.51 0.00 0.00 43.02 40.59 1a4l s PHE 1817CO 0.95 -0.01 -0.04 0.95 0.70 0.00 0.00 175.22 177.77 1a4l s THR 1818N -2.01 2.25 0.31 0.64 -4.23 -1.26 -4.61 115.64 106.73 1a4l s THR 1818Ca 0.58 -2.10 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1a4l s THR 1818Cb -0.12 -2.76 0.28 0.00 1.34 0.00 0.00 72.50 71.24 1a4l s THR 1818CO 0.16 -0.15 1.93 -0.08 -0.54 0.00 0.00 174.62 175.95 1a4l h GLU 1819N 1.91 0.96 -0.84 3.99 4.81 -1.98 0.62 114.58 124.05 1a4l h GLU 1819Ca -0.43 -0.06 0.08 0.00 -0.13 0.00 0.00 59.36 58.83 1a4l h GLU 1819Cb 1.25 -0.22 -0.07 0.00 0.63 0.00 0.00 28.75 30.34 1a4l h GLU 1819CO 0.72 0.63 0.50 1.49 -0.73 0.00 0.00 179.01 181.63 1a4l h GLU 1820N 0.99 0.84 -0.09 1.92 4.81 -1.99 0.68 114.58 121.73 1a4l h GLU 1820Ca 0.36 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.44 1a4l h GLU 1820Cb 0.15 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1a4l h GLU 1820CO -0.12 0.56 -0.33 1.49 -0.73 0.00 0.00 179.01 179.88 1a4l h GLU 1821N 0.86 0.39 -0.84 1.92 4.57 -1.38 -1.90 114.58 118.20 1a4l h GLU 1821Ca 0.39 -0.29 0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1a4l h GLU 1821Cb 0.30 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.89 1a4l h GLU 1821CO -0.22 0.92 0.53 0.74 -1.18 0.00 0.00 179.01 179.80 1a4l h PHE 1822N -0.06 0.99 -0.35 0.92 0.04 -0.59 -0.77 116.94 117.11 1a4l h PHE 1822Ca -0.01 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.75 1a4l h PHE 1822Cb 0.96 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 1a4l h PHE 1822CO 0.12 0.55 0.10 0.87 -0.60 0.00 0.00 178.31 179.35 1a4l h LYS 1823N 1.01 0.55 0.16 1.51 1.57 -0.84 -2.73 116.57 117.81 1a4l h LYS 1823Ca 0.34 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 1a4l h LYS 1823Cb 0.05 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1a4l h LYS 1823CO -0.13 0.59 -0.08 -0.09 -0.57 0.00 0.00 179.45 179.17 1a4l h ARG 1824N 0.41 -0.21 0.00 3.15 2.43 -0.66 -1.78 114.38 117.72 1a4l h ARG 1824Ca 0.11 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1a4l h ARG 1824Cb 0.28 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1a4l h ARG 1824CO -0.00 -0.10 -0.02 1.37 -1.51 0.00 0.00 179.97 179.71 1a4l h LEU 1825N -0.26 0.00 -0.01 3.80 -0.00 -1.22 -0.55 115.31 117.07 1a4l h LEU 1825Ca -0.02 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.63 1a4l h LEU 1825Cb 0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.85 1a4l h LEU 1825CO 0.04 0.02 -1.06 0.78 -0.00 0.00 0.00 178.44 178.21 1a4l h ASN 1826N 0.00 0.21 0.24 0.17 4.21 -1.15 0.12 115.58 119.38 1a4l h ASN 1826Ca -0.00 -0.21 -0.17 0.00 1.21 0.00 0.00 56.30 57.12 1a4l h ASN 1826Cb 0.43 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 1a4l h ASN 1826CO 0.00 1.13 -0.67 0.40 -1.29 0.00 0.00 177.43 177.00 1a4l h ILE 1827N 0.05 1.37 -0.39 2.81 2.04 -0.86 -1.95 117.51 120.58 1a4l h ILE 1827Ca -0.06 -2.05 -0.03 0.00 1.00 0.00 0.00 64.86 63.72 1a4l h ILE 1827Cb 1.79 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 39.88 1a4l h ILE 1827CO 0.16 0.62 0.15 0.78 0.00 0.00 0.00 178.15 179.85 1a4l h ASN 1828N 0.28 0.55 -0.72 1.72 2.35 -0.96 -0.94 115.58 117.86 1a4l h ASN 1828Ca -0.02 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 1a4l h ASN 1828Cb 1.23 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 39.42 1a4l h ASN 1828CO 0.12 0.58 0.45 0.00 -1.65 0.00 0.00 177.43 176.93 1a4l h ALA 1829N 0.99 1.43 -0.10 -0.83 0.00 -0.58 -0.27 119.26 119.91 1a4l h ALA 1829Ca 0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1a4l h ALA 1829Cb 0.21 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1a4l h ALA 1829CO -0.01 0.51 -0.03 0.00 0.00 0.00 0.00 179.25 179.72 1a4l h ALA 1830N 1.51 0.14 -0.92 0.00 0.00 -0.82 -0.92 119.26 118.24 1a4l h ALA 1830Ca 0.26 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1a4l h ALA 1830Cb -0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1a4l h ALA 1830CO -0.05 -0.12 0.61 0.87 0.00 0.00 0.00 179.25 180.56 1a4l h LYS 1831N -0.14 1.21 -0.00 0.00 1.57 -0.82 -2.24 116.57 116.14 1a4l h LYS 1831Ca 0.02 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1a4l h LYS 1831Cb 0.45 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1a4l h LYS 1831CO 0.01 0.80 -0.02 0.43 -0.57 0.00 0.00 179.45 180.10 1a4l n SER 1832N -4.45 0.03 -4.40 0.86 7.64 -0.14 -4.92 113.62 108.24 1a4l n SER 1832Ca 0.11 0.19 -0.30 0.00 1.01 0.00 0.00 58.87 59.87 1a4l n SER 1832Cb 0.02 -0.38 0.21 0.00 -1.01 0.00 0.00 64.21 63.05 1a4l n SER 1832CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1a4l n SER 1833N -1.40 -1.89 -2.03 6.43 3.41 -0.36 -4.90 113.62 112.88 1a4l n SER 1833Ca 0.10 -0.08 -0.11 0.00 -0.26 0.00 0.00 58.87 58.53 1a4l n SER 1833Cb 0.30 -1.15 0.27 0.00 -0.26 0.00 0.00 64.21 63.37 1a4l n SER 1833CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1a4l n PHE 1834N -4.63 2.58 -2.25 7.33 3.72 -1.26 -4.97 117.46 117.97 1a4l n PHE 1834Ca 0.03 -1.39 -0.31 0.00 -0.05 0.00 0.00 57.45 55.73 1a4l n PHE 1834Cb 0.57 -0.75 -0.02 0.00 -0.94 0.00 0.00 39.48 38.34 1a4l n PHE 1834CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1a4l s LEU 1835N -3.09 3.49 0.66 4.37 2.96 -1.26 -4.90 118.68 120.92 1a4l s LEU 1835Ca 0.55 1.45 -0.12 0.00 -0.22 0.00 0.00 54.13 55.79 1a4l s LEU 1835Cb 0.45 -4.43 -0.01 0.00 0.50 0.00 0.00 46.19 42.71 1a4l s LEU 1835CO 0.12 -0.68 1.06 -2.84 -1.32 0.00 0.00 176.35 172.69 1a4l s PRO 1836N -4.50 3.08 0.30 0.98 0.02 -1.26 -4.77 135.00 128.85 1a4l s PRO 1836Ca 0.56 1.02 0.06 0.00 0.02 0.00 0.00 61.00 62.66 1a4l s PRO 1836Cb -0.10 -2.01 0.76 0.00 0.02 0.00 0.00 34.50 33.17 1a4l s PRO 1836CO 0.40 -0.99 1.73 0.93 -0.33 0.00 0.00 177.00 178.75 1a4l h GLU 1837N -0.35 0.55 -0.14 5.54 4.39 -1.97 0.03 114.58 122.64 1a4l h GLU 1837Ca -0.45 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.21 1a4l h GLU 1837Cb 1.21 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 1a4l h GLU 1837CO 0.57 0.37 0.04 0.93 -1.16 0.00 0.00 179.01 179.76 1a4l h GLU 1838N 0.57 0.21 0.00 2.33 3.07 -1.99 0.87 114.58 119.64 1a4l h GLU 1838Ca 0.58 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 59.30 1a4l h GLU 1838Cb 1.04 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.90 1a4l h GLU 1838CO -0.46 0.35 -0.46 0.93 -1.40 0.00 0.00 179.01 177.96 1a4l h GLU 1839N 0.03 0.00 -0.08 2.33 5.08 -1.80 -1.84 114.58 118.30 1a4l h GLU 1839Ca 0.04 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 1a4l h GLU 1839Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1a4l h GLU 1839CO -0.00 0.46 -0.65 -0.22 -1.00 0.00 0.00 179.01 177.61 1a4l h LYS 1840N 0.00 0.32 -0.31 2.33 3.64 -0.69 -1.42 116.57 120.44 1a4l h LYS 1840Ca -0.00 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.05 1a4l h LYS 1840Cb 0.85 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 1a4l h LYS 1840CO 0.06 0.86 -0.13 0.87 -2.27 0.00 0.00 179.45 178.84 1a4l h LYS 1841N 0.23 0.64 -0.86 1.90 1.79 -0.50 -2.14 116.57 117.64 1a4l h LYS 1841Ca -0.01 -0.27 0.07 0.00 -2.18 0.00 0.00 60.65 58.26 1a4l h LYS 1841Cb 1.18 -0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.75 1a4l h LYS 1841CO 0.11 0.85 0.56 0.93 -1.08 0.00 0.00 179.45 180.82 1a4l h GLU 1842N 0.41 0.89 -0.03 3.15 5.08 -1.13 0.86 114.58 123.82 1a4l h GLU 1842Ca 0.07 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1a4l h GLU 1842Cb 0.65 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1a4l h GLU 1842CO 0.04 0.59 -0.01 1.25 -1.00 0.00 0.00 179.01 179.88 1a4l h LEU 1843N 0.92 0.06 -1.30 1.33 6.46 -1.08 -1.81 115.31 119.89 1a4l h LEU 1843Ca 0.38 -0.39 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1a4l h LEU 1843Cb 0.28 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 1a4l h LEU 1843CO -0.14 0.43 0.18 -0.07 -0.62 0.00 0.00 178.44 178.22 1a4l h LEU 1844N -0.32 0.60 -0.44 2.25 3.38 -0.96 -0.52 115.31 119.30 1a4l h LEU 1844Ca 0.01 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1a4l h LEU 1844Cb 0.41 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1a4l h LEU 1844CO 0.00 0.55 0.22 -0.33 0.09 0.00 0.00 178.44 178.97 1a4l h GLU 1845N 0.66 0.63 -0.36 1.13 5.08 -0.68 -0.33 114.58 120.72 1a4l h GLU 1845Ca 0.16 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 1a4l h GLU 1845Cb 0.14 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1a4l h GLU 1845CO -0.01 0.53 -0.09 -0.09 -1.00 0.00 0.00 179.01 178.34 1a4l h ARG 1846N 0.57 0.69 0.29 2.33 2.43 -0.82 -1.16 114.38 118.71 1a4l h ARG 1846Ca 0.15 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1a4l h ARG 1846Cb 0.10 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1a4l h ARG 1846CO -0.02 0.85 -0.14 -0.07 -1.51 0.00 0.00 179.97 179.08 1a4l h LEU 1847N 0.48 -0.33 -1.11 3.80 3.38 -0.98 0.13 115.31 120.68 1a4l h LEU 1847Ca 0.09 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1a4l h LEU 1847Cb 0.60 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.37 1a4l h LEU 1847CO 0.04 -0.20 0.61 1.88 0.09 0.00 0.00 178.44 180.85 1a4l h TYR 1848N -0.42 1.08 0.21 1.13 0.05 -1.04 0.26 116.97 118.23 1a4l h TYR 1848Ca -0.04 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1a4l h TYR 1848Cb 0.32 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.71 1a4l h TYR 1848CO -0.05 0.54 -0.10 -0.09 -1.05 0.00 0.00 178.16 177.42 1a4l h ARG 1849N 1.05 -0.27 0.00 4.88 2.43 -0.94 -3.05 114.38 118.47 1a4l h ARG 1849Ca 0.41 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 1a4l h ARG 1849Cb 0.25 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1a4l h ARG 1849CO -0.17 0.05 0.00 0.39 -1.51 0.00 0.00 179.97 178.74 1a4l n GLU 1850N -5.07 0.42 0.00 0.20 1.02 0.42 -2.50 120.64 115.14 1a4l n GLU 1850Ca -0.09 0.05 0.11 0.00 -0.02 0.00 0.00 57.16 57.21 1a4l n GLU 1850Cb 0.24 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.19 1a4l n GLU 1850CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1a4l n TYR 1851N -1.24 0.00 1.63 -0.32 4.02 0.87 -4.79 117.16 117.33 1a4l n TYR 1851Ca 0.13 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.15 1a4l n TYR 1851Cb 0.18 0.00 0.77 0.00 -0.02 0.00 0.00 39.34 40.27 1a4l n TYR 1851CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89