#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u4q n ASN 1663N 0.00 1.52 -0.08 0.00 4.13 -1.26 -4.94 115.26 114.63 1u4q n ASN 1663Ca 0.00 -1.86 -0.02 0.00 1.68 0.00 0.00 54.58 54.38 1u4q n ASN 1663Cb 0.00 0.33 -0.02 0.00 -1.54 0.00 0.00 39.78 38.55 1u4q n ASN 1663CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1u4q n LYS 1664N -0.40 -0.08 -0.27 3.52 2.85 -1.26 0.38 118.16 122.89 1u4q n LYS 1664Ca -0.04 1.05 -0.08 0.00 -1.05 0.00 0.00 58.31 58.19 1u4q n LYS 1664Cb 0.24 -1.56 -0.07 0.00 -0.65 0.00 0.00 35.03 32.99 1u4q n LYS 1664CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 177.40 177.72 1u4q h GLN 1665N 0.00 -0.02 -0.42 -1.58 5.75 -1.98 1.50 115.11 118.36 1u4q h GLN 1665Ca 0.03 0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1u4q h GLN 1665Cb 0.07 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.60 1u4q h GLN 1665CO -0.17 -0.02 0.22 -0.56 -2.65 0.00 0.00 178.83 175.66 1u4q h GLN 1666N -0.03 0.44 0.35 1.69 -0.00 -1.94 -2.81 115.11 112.82 1u4q h GLN 1666Ca 0.10 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.72 1u4q h GLN 1666Cb 0.29 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.48 27.65 1u4q h GLN 1666CO -0.62 0.29 -0.36 -0.91 -0.00 0.00 0.00 178.83 177.23 1u4q h ASN 1667N 0.45 -0.98 -0.16 0.06 -0.26 0.36 0.58 115.58 115.63 1u4q h ASN 1667Ca 0.17 0.09 0.05 0.00 -0.56 0.00 0.00 56.30 56.04 1u4q h ASN 1667Cb 0.05 0.33 -0.05 0.00 -1.06 0.00 0.00 38.32 37.59 1u4q h ASN 1667CO -0.10 -0.50 -0.16 0.15 -1.06 0.00 0.00 177.43 175.75 1u4q h PHE 1668N -0.74 -0.41 -0.73 1.19 3.57 0.19 0.39 116.94 120.40 1u4q h PHE 1668Ca -0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1u4q h PHE 1668Cb 0.67 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 1u4q h PHE 1668CO -0.21 -0.23 0.48 -0.91 -2.23 0.00 0.00 178.31 175.21 1u4q h ASN 1669N -0.19 0.83 -0.35 0.41 2.35 -1.40 0.37 115.58 117.61 1u4q h ASN 1669Ca 0.10 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1u4q h ASN 1669Cb 0.34 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1u4q h ASN 1669CO -0.27 0.60 0.18 0.74 -1.65 0.00 0.00 177.43 177.03 1u4q h THR 1670N 0.98 1.16 -0.49 2.81 2.02 -0.30 -1.27 112.91 117.82 1u4q h THR 1670Ca 0.27 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1u4q h THR 1670Cb -0.11 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1u4q h THR 1670CO -0.06 0.16 0.31 1.23 0.37 0.00 0.00 175.52 177.53 1u4q h GLY 1671N 0.43 0.70 0.98 2.16 0.00 0.44 -2.18 103.07 105.61 1u4q h GLY 1671Ca 0.12 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.18 1u4q h GLY 1671CO -0.02 0.27 0.51 -2.22 0.00 0.00 0.00 176.54 175.09 1u4q h ILE 1672N 0.66 1.19 -0.54 2.60 1.08 -0.01 -0.83 117.51 121.65 1u4q h ILE 1672Ca 0.18 -0.36 -0.07 0.00 -0.39 0.00 0.00 64.86 64.22 1u4q h ILE 1672Cb -0.03 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 33.74 1u4q h ILE 1672CO -0.04 0.19 0.05 0.11 -0.69 0.00 0.00 178.15 177.78 1u4q h LYS 1673N 1.04 0.88 -0.36 2.37 1.57 -0.96 0.37 116.57 121.47 1u4q h LYS 1673Ca 0.29 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1u4q h LYS 1673Cb -0.10 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1u4q h LYS 1673CO -0.07 0.84 -0.11 -0.44 -0.57 0.00 0.00 179.45 179.10 1u4q h ASP 1674N 0.82 0.73 -0.51 0.86 3.32 -0.89 -2.25 116.42 118.49 1u4q h ASP 1674Ca 0.17 -0.38 -0.08 0.00 0.02 0.00 0.00 57.03 56.76 1u4q h ASP 1674Cb 0.41 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1u4q h ASP 1674CO 0.01 0.94 0.01 0.15 -1.72 0.00 0.00 179.24 178.64 1u4q h PHE 1675N 0.51 1.01 -0.80 4.55 3.57 -0.96 -2.39 116.94 122.44 1u4q h PHE 1675Ca 0.09 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.47 1u4q h PHE 1675Cb 0.63 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.05 1u4q h PHE 1675CO 0.05 0.90 0.50 -0.44 -2.23 0.00 0.00 178.31 177.10 1u4q h ASP 1676N 0.87 0.82 -0.39 0.41 3.32 -0.82 0.17 116.42 120.81 1u4q h ASP 1676Ca 0.16 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1u4q h ASP 1676Cb 0.49 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1u4q h ASP 1676CO 0.02 0.55 0.22 0.15 -1.72 0.00 0.00 179.24 178.46 1u4q h PHE 1677N 0.96 0.53 -0.57 4.55 3.57 -1.00 -2.06 116.94 122.93 1u4q h PHE 1677Ca 0.33 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.71 1u4q h PHE 1677Cb 0.05 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1u4q h PHE 1677CO -0.03 0.41 -0.07 2.35 -2.23 0.00 0.00 178.31 178.74 1u4q h TRP 1678N 0.50 1.17 0.16 0.41 7.01 -0.99 -2.69 115.95 121.51 1u4q h TRP 1678Ca 0.14 -0.23 0.01 0.00 2.11 0.00 0.00 58.89 60.92 1u4q h TRP 1678Cb 0.05 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 26.80 1u4q h TRP 1678CO -0.03 1.06 -0.17 -0.07 -2.79 0.00 0.00 178.44 176.44 1u4q h LEU 1679N 0.95 -0.45 -0.77 0.65 3.38 -0.70 0.37 115.31 118.74 1u4q h LEU 1679Ca 0.15 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.23 1u4q h LEU 1679Cb 0.64 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.49 1u4q h LEU 1679CO 0.04 -0.25 0.45 0.28 0.09 0.00 0.00 178.44 179.06 1u4q h SER 1680N -0.36 0.70 -0.41 -0.43 0.02 -1.38 0.51 113.55 112.20 1u4q h SER 1680Ca 0.01 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1u4q h SER 1680Cb 0.34 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 1u4q h SER 1680CO -0.05 0.45 0.21 -0.08 -1.14 0.00 0.00 176.83 176.22 1u4q h GLU 1681N 0.83 0.58 -0.61 3.45 4.81 -1.13 0.22 114.58 122.73 1u4q h GLU 1681Ca 0.34 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.40 1u4q h GLU 1681Cb 0.18 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1u4q h GLU 1681CO -0.18 0.49 0.01 0.28 -0.73 0.00 0.00 179.01 178.88 1u4q h VAL 1682N 0.53 1.26 -0.69 0.32 2.07 -0.32 -2.00 116.25 117.42 1u4q h VAL 1682Ca 0.14 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.54 1u4q h VAL 1682Cb 0.09 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1u4q h VAL 1682CO -0.02 0.41 0.46 -0.33 0.02 0.00 0.00 177.57 178.11 1u4q h GLU 1683N 0.97 0.91 -0.60 1.57 5.08 -0.51 0.51 114.58 122.51 1u4q h GLU 1683Ca 0.17 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1u4q h GLU 1683Cb 0.54 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1u4q h GLU 1683CO 0.03 0.60 0.34 0.00 -1.00 0.00 0.00 179.01 178.98 1u4q h ALA 1684N 1.25 0.78 -0.58 3.43 0.00 -0.20 -2.12 119.26 121.82 1u4q h ALA 1684Ca 0.25 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1u4q h ALA 1684Cb -0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1u4q h ALA 1684CO -0.05 0.05 0.15 -0.07 0.00 0.00 0.00 179.25 179.33 1u4q h LEU 1685N 0.67 0.87 0.00 0.00 3.38 -0.67 -1.53 115.31 118.02 1u4q h LEU 1685Ca 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1u4q h LEU 1685Cb 0.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1u4q h LEU 1685CO -0.13 0.86 0.00 0.18 0.09 0.00 0.00 178.44 179.44 1u4q n LEU 1686N -4.39 0.00 -0.23 1.67 4.77 0.11 -1.87 117.00 117.06 1u4q n LEU 1686Ca 0.03 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.15 1u4q n LEU 1686Cb 0.23 0.00 0.65 0.00 -2.33 0.00 0.00 43.42 41.96 1u4q n LEU 1686CO 0.40 0.00 0.91 0.00 -1.33 0.00 0.00 177.39 177.38 1u4q n ALA 1687N -0.72 2.70 -1.76 -1.18 0.00 -0.57 -4.90 120.51 114.08 1u4q n ALA 1687Ca 0.06 -0.32 -0.39 0.00 0.00 0.00 0.00 53.44 52.79 1u4q n ALA 1687Cb 0.03 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 18.21 1u4q n ALA 1687CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u4q s SER 1688N -2.19 5.48 -0.04 0.00 0.15 -0.78 -4.93 113.70 111.40 1u4q s SER 1688Ca 0.37 2.81 0.05 0.00 0.70 0.00 0.00 55.95 59.88 1u4q s SER 1688Cb 0.21 -2.64 0.08 0.00 -1.71 0.00 0.00 66.02 61.96 1u4q s SER 1688CO 0.40 -1.43 0.94 -1.84 1.20 0.00 0.00 173.24 172.50 1u4q n GLU 1689N -0.74 0.87 -3.42 5.44 0.00 -1.26 -5.03 120.64 116.50 1u4q n GLU 1689Ca 0.09 -1.42 -0.38 0.00 0.00 0.00 0.00 57.16 55.45 1u4q n GLU 1689Cb 0.44 -0.86 -0.08 0.00 0.00 0.00 0.00 31.44 30.94 1u4q n GLU 1689CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1u4q s ASP 1690N -1.31 6.42 -0.04 -1.84 -1.08 -1.26 -4.96 116.67 112.60 1u4q s ASP 1690Ca 0.09 0.49 0.06 0.00 -0.52 0.00 0.00 52.55 52.67 1u4q s ASP 1690Cb 0.08 -2.22 0.09 0.00 -1.46 0.00 0.00 42.92 39.41 1u4q s ASP 1690CO 0.01 -0.05 0.96 -1.22 0.52 0.00 0.00 175.17 175.39 1u4q n TYR 1691N 4.39 0.00 0.00 -5.34 4.02 -1.26 -5.06 117.16 113.91 1u4q n TYR 1691Ca -0.09 -0.50 0.00 0.00 -0.01 0.00 0.00 57.90 57.30 1u4q n TYR 1691Cb 0.51 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1u4q n TYR 1691CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u4q n GLY 1692N -0.63 2.26 0.00 2.72 0.00 -1.26 -4.70 105.19 103.57 1u4q n GLY 1692Ca 0.05 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1u4q n GLY 1692CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u4q n LYS 1693N 1.94 0.75 -3.58 1.61 5.02 -1.26 -4.94 118.16 117.70 1u4q n LYS 1693Ca 0.00 -0.12 -0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1u4q n LYS 1693Cb 0.00 -0.51 0.02 0.00 -0.02 0.00 0.00 35.03 34.51 1u4q n LYS 1693CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1u4q n ASP 1694N -0.14 -1.28 -0.19 4.39 5.68 -1.26 -5.05 116.55 118.69 1u4q n ASP 1694Ca 0.00 -1.53 -0.10 0.00 -0.50 0.00 0.00 54.79 52.66 1u4q n ASP 1694Cb 0.10 2.05 0.01 0.00 -1.14 0.00 0.00 41.12 42.14 1u4q n ASP 1694CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1u4q h LEU 1695N 0.00 0.95 -0.13 -2.12 3.38 -1.95 -2.85 115.31 112.60 1u4q h LEU 1695Ca -0.21 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.46 1u4q h LEU 1695Cb 1.01 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 1u4q h LEU 1695CO 0.29 1.04 -0.37 0.00 0.09 0.00 0.00 178.44 179.49 1u4q h ALA 1696N 0.94 -0.73 -0.19 1.53 0.00 -2.00 -0.80 119.26 118.02 1u4q h ALA 1696Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1u4q h ALA 1696Cb 0.57 0.90 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1u4q h ALA 1696CO 0.03 -0.87 0.12 0.66 0.00 0.00 0.00 179.25 179.19 1u4q h SER 1697N -0.37 0.22 -0.64 0.00 4.64 -1.97 -2.32 113.55 113.10 1u4q h SER 1697Ca 0.03 -0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 1u4q h SER 1697Cb 0.45 -0.05 -0.11 0.00 -0.31 0.00 0.00 62.40 62.38 1u4q h SER 1697CO -0.32 0.18 0.02 0.58 -0.87 0.00 0.00 176.83 176.43 1u4q h VAL 1698N 0.24 0.49 -0.68 0.95 2.07 -1.25 0.61 116.25 118.68 1u4q h VAL 1698Ca 0.07 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.59 1u4q h VAL 1698Cb -0.00 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1u4q h VAL 1698CO -0.01 0.02 0.40 0.78 0.02 0.00 0.00 177.57 178.78 1u4q h ASN 1699N 0.14 0.61 -0.48 0.57 2.35 -0.85 0.22 115.58 118.14 1u4q h ASN 1699Ca 0.34 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.09 1u4q h ASN 1699Cb 0.55 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1u4q h ASN 1699CO -0.53 0.41 0.23 0.78 -1.65 0.00 0.00 177.43 176.66 1u4q h ASN 1700N 0.75 0.63 -0.80 5.81 2.35 -0.08 -0.72 115.58 123.51 1u4q h ASN 1700Ca 0.29 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1u4q h ASN 1700Cb 0.13 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 1u4q h ASN 1700CO -0.15 0.59 0.45 -0.07 -1.65 0.00 0.00 177.43 176.59 1u4q h LEU 1701N 0.63 1.00 -0.51 1.61 3.38 0.12 -0.25 115.31 121.29 1u4q h LEU 1701Ca 0.16 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1u4q h LEU 1701Cb 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1u4q h LEU 1701CO -0.02 0.80 -0.02 -0.07 0.09 0.00 0.00 178.44 179.22 1u4q h LEU 1702N 1.11 0.90 -0.62 1.67 3.38 -0.30 0.20 115.31 121.66 1u4q h LEU 1702Ca 0.28 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1u4q h LEU 1702Cb 0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1u4q h LEU 1702CO -0.05 1.00 0.07 0.50 0.09 0.00 0.00 178.44 180.06 1u4q h LYS 1703N 0.78 1.04 -0.61 1.13 3.64 -0.88 -0.39 116.57 121.28 1u4q h LYS 1703Ca 0.14 -0.29 -0.06 0.00 -1.27 0.00 0.00 60.65 59.16 1u4q h LYS 1703Cb 0.55 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 1u4q h LYS 1703CO 0.03 0.98 0.13 -0.22 -2.27 0.00 0.00 179.45 178.10 1u4q h LYS 1704N 0.95 0.97 0.00 1.90 1.63 -0.81 -2.63 116.57 118.57 1u4q h LYS 1704Ca 0.18 -0.23 -0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1u4q h LYS 1704Cb 0.46 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1u4q h LYS 1704CO 0.02 0.88 -0.02 1.25 -3.45 0.00 0.00 179.45 178.12 1u4q h HIS 1705N 0.92 0.00 0.01 1.91 2.76 -0.03 -3.01 115.15 117.71 1u4q h HIS 1705Ca 0.19 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 58.14 1u4q h HIS 1705Cb 0.36 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.32 1u4q h HIS 1705CO 0.02 0.02 -0.95 0.37 -1.30 0.00 0.00 177.93 176.10 1u4q h GLN 1706N 0.00 0.34 -0.22 5.26 4.15 -0.73 -2.10 115.11 121.80 1u4q h GLN 1706Ca -0.00 -0.38 -0.03 0.00 0.77 0.00 0.00 58.65 59.01 1u4q h GLN 1706Cb 0.72 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.51 1u4q h GLN 1706CO 0.00 1.07 0.03 -0.07 -1.93 0.00 0.00 178.83 177.93 1u4q h LEU 1707N 0.18 0.36 -0.38 -2.39 3.38 -1.38 -1.38 115.31 113.71 1u4q h LEU 1707Ca -0.07 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1u4q h LEU 1707Cb 1.59 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.22 1u4q h LEU 1707CO 0.16 0.55 0.19 0.25 0.09 0.00 0.00 178.44 179.68 1u4q h LEU 1708N 0.17 0.49 -1.04 1.67 5.85 -1.54 -0.91 115.31 119.99 1u4q h LEU 1708Ca 0.07 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.71 1u4q h LEU 1708Cb 0.34 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1u4q h LEU 1708CO 0.01 0.46 0.64 -0.33 -0.34 0.00 0.00 178.44 178.88 1u4q h GLU 1709N 0.48 1.22 -0.59 1.25 5.08 -1.31 0.53 114.58 121.24 1u4q h GLU 1709Ca 0.13 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1u4q h GLU 1709Cb 0.09 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 1u4q h GLU 1709CO -0.02 0.81 0.17 0.00 -1.00 0.00 0.00 179.01 178.97 1u4q h ALA 1710N 1.42 0.77 -0.51 3.43 0.00 -0.78 -1.42 119.26 122.17 1u4q h ALA 1710Ca 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1u4q h ALA 1710Cb -0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1u4q h ALA 1710CO -0.11 0.45 0.26 0.22 0.00 0.00 0.00 179.25 180.07 1u4q h ASP 1711N 0.83 0.65 -0.34 0.00 3.58 0.08 -0.33 116.42 120.90 1u4q h ASP 1711Ca 0.19 -0.11 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 1u4q h ASP 1711Cb 0.31 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 1u4q h ASP 1711CO -0.00 0.58 0.01 0.40 -2.88 0.00 0.00 179.24 177.34 1u4q h ILE 1712N 0.68 1.23 -0.58 2.25 2.04 -0.83 -2.30 117.51 120.00 1u4q h ILE 1712Ca 0.18 -0.91 -0.11 0.00 1.00 0.00 0.00 64.86 65.02 1u4q h ILE 1712Cb 0.09 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1u4q h ILE 1712CO -0.03 0.32 -0.06 -1.28 0.00 0.00 0.00 178.15 177.10 1u4q h SER 1713N 0.65 1.05 0.93 1.72 0.87 -0.55 -2.57 113.55 115.66 1u4q h SER 1713Ca 0.13 -0.33 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 1u4q h SER 1713Cb 0.40 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1u4q h SER 1713CO 0.01 1.13 -0.05 0.00 -0.53 0.00 0.00 176.83 177.40 1u4q h ALA 1714N 0.96 1.02 -0.00 6.23 0.00 -0.75 -2.70 119.26 124.01 1u4q h ALA 1714Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1u4q h ALA 1714Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1u4q h ALA 1714CO 0.04 0.07 -0.01 0.72 0.00 0.00 0.00 179.25 180.07 1u4q n HIS 1715N -3.18 0.00 0.17 0.00 -0.00 -0.90 -3.73 115.22 107.58 1u4q n HIS 1715Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.75 1u4q n HIS 1715Cb 0.32 -0.08 0.29 0.00 -0.00 0.00 0.00 29.99 30.52 1u4q n HIS 1715CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 1u4q h GLU 1716N 0.23 0.00 0.42 -0.41 5.08 -1.52 -2.36 114.58 116.02 1u4q h GLU 1716Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1u4q h GLU 1716Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1u4q h GLU 1716CO 0.00 0.46 -0.20 -0.44 -1.00 0.00 0.00 179.01 177.83 1u4q h ASP 1717N 0.00 -0.48 -0.89 1.42 3.32 -1.81 0.11 116.42 118.09 1u4q h ASP 1717Ca -0.00 -0.08 0.18 0.00 0.02 0.00 0.00 57.03 57.14 1u4q h ASP 1717Cb 0.88 0.12 -0.07 0.00 0.22 0.00 0.00 39.33 40.49 1u4q h ASP 1717CO 0.06 -0.19 0.58 -0.09 -1.72 0.00 0.00 179.24 177.88 1u4q h ARG 1718N -0.78 0.52 -0.33 3.56 9.65 -1.78 0.30 114.38 125.53 1u4q h ARG 1718Ca -0.06 -0.03 -0.12 0.00 -1.10 0.00 0.00 59.98 58.67 1u4q h ARG 1718Cb 0.53 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 1u4q h ARG 1718CO 0.10 0.34 -0.29 1.25 2.80 0.00 0.00 179.97 184.17 1u4q h LEU 1719N 0.53 0.72 -0.02 3.80 5.85 -0.93 0.31 115.31 125.56 1u4q h LEU 1719Ca 0.46 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1u4q h LEU 1719Cb 0.96 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1u4q h LEU 1719CO -0.20 0.97 -0.01 0.11 -0.34 0.00 0.00 178.44 178.97 1u4q h LYS 1720N 0.60 0.04 0.29 1.25 1.57 0.20 -2.65 116.57 117.88 1u4q h LYS 1720Ca 0.07 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1u4q h LYS 1720Cb 0.79 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 1u4q h LYS 1720CO 0.07 0.43 -0.27 0.22 -0.57 0.00 0.00 179.45 179.33 1u4q h ASP 1721N -0.35 -0.71 -0.75 0.86 3.58 -0.43 -1.18 116.42 117.44 1u4q h ASP 1721Ca 0.01 0.06 0.20 0.00 0.42 0.00 0.00 57.03 57.71 1u4q h ASP 1721Cb 0.42 0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.67 1u4q h ASP 1721CO 0.00 -0.39 0.53 -0.07 -2.88 0.00 0.00 179.24 176.43 1u4q h LEU 1722N -0.58 0.14 -0.21 2.28 3.38 -0.43 0.44 115.31 120.33 1u4q h LEU 1722Ca -0.01 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1u4q h LEU 1722Cb 0.53 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1u4q h LEU 1722CO -0.04 0.06 -0.66 0.78 0.09 0.00 0.00 178.44 178.67 1u4q h ASN 1723N 0.14 0.00 0.28 -0.43 2.35 -0.99 -2.22 115.58 114.71 1u4q h ASN 1723Ca 0.37 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.10 1u4q h ASN 1723Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 1u4q h ASN 1723CO -0.05 0.66 -0.14 0.28 -1.65 0.00 0.00 177.43 176.53 1u4q h SER 1724N 0.00 -0.32 -0.77 5.81 0.02 0.99 -1.50 113.55 117.79 1u4q h SER 1724Ca -0.01 -0.19 0.15 0.00 -0.84 0.00 0.00 61.79 60.91 1u4q h SER 1724Cb 1.42 0.08 -0.10 0.00 0.14 0.00 0.00 62.40 63.94 1u4q h SER 1724CO 0.09 0.05 0.29 1.56 -1.14 0.00 0.00 176.83 177.67 1u4q h GLN 1725N -0.73 0.40 0.08 3.45 4.20 -1.12 -0.49 115.11 120.91 1u4q h GLN 1725Ca -0.04 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.66 1u4q h GLN 1725Cb 0.49 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 1u4q h GLN 1725CO 0.06 0.27 -0.17 0.00 -0.67 0.00 0.00 178.83 178.32 1u4q h ALA 1726N 1.57 -0.27 -0.64 3.87 0.00 -1.26 -1.78 119.26 120.75 1u4q h ALA 1726Ca 0.43 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.45 1u4q h ALA 1726Cb 0.68 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 1u4q h ALA 1726CO -0.43 -0.69 0.04 -0.44 0.00 0.00 0.00 179.25 177.73 1u4q h ASP 1727N -0.32 -0.20 1.16 0.00 3.32 -0.03 -0.36 116.42 119.98 1u4q h ASP 1727Ca 0.03 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1u4q h ASP 1727Cb 0.35 0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1u4q h ASP 1727CO -0.11 -0.09 0.00 0.77 -1.72 0.00 0.00 179.24 178.09 1u4q h SER 1728N 0.15 0.00 0.99 6.45 4.64 -1.07 -3.02 113.55 121.69 1u4q h SER 1728Ca 0.34 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.48 1u4q h SER 1728Cb 0.55 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.61 1u4q h SER 1728CO -0.52 0.00 -1.07 -0.07 -0.87 0.00 0.00 176.83 174.30 1u4q h LEU 1729N 0.00 0.00 0.00 5.97 3.38 -0.21 -3.19 115.31 121.27 1u4q h LEU 1729Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u4q h LEU 1729Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1u4q h LEU 1729CO 0.00 0.74 0.00 0.23 0.09 0.00 0.00 178.44 179.50 1u4q n MET 1730N -3.15 0.01 -0.65 1.13 2.81 -0.77 -2.88 117.12 113.63 1u4q n MET 1730Ca -0.05 0.14 0.03 0.00 -1.81 0.00 0.00 57.70 56.01 1u4q n MET 1730Cb 0.87 -1.50 0.27 0.00 -0.71 0.00 0.00 33.22 32.15 1u4q n MET 1730CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1u4q n THR 1731N -1.49 1.99 -3.93 2.03 -1.04 -1.20 -4.85 114.28 105.78 1u4q n THR 1731Ca 0.05 -1.01 -0.17 0.00 -2.04 0.00 0.00 64.05 60.89 1u4q n THR 1731Cb 0.24 -0.38 -0.16 0.00 -1.82 0.00 0.00 70.33 68.21 1u4q n THR 1731CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1u4q s SER 1732N -0.54 0.38 0.00 8.00 1.04 -1.14 -5.01 113.70 116.43 1u4q s SER 1732Ca 0.38 -0.03 0.25 0.00 0.48 0.00 0.00 55.95 57.03 1u4q s SER 1732Cb 0.29 -0.19 0.43 0.00 0.10 0.00 0.00 66.02 66.66 1u4q s SER 1732CO 0.11 -0.09 1.37 -1.20 0.98 0.00 0.00 173.24 174.41 1u4q n SER 1733N 4.00 1.75 0.30 7.02 7.64 -1.26 -4.25 113.62 128.81 1u4q n SER 1733Ca -0.26 -1.37 0.13 0.00 1.01 0.00 0.00 58.87 58.39 1u4q n SER 1733Cb 0.51 0.23 0.65 0.00 -1.01 0.00 0.00 64.21 64.58 1u4q n SER 1733CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u4q h ALA 1734N 4.00 1.58 -3.14 -0.43 0.00 -1.96 -3.42 119.26 115.89 1u4q h ALA 1734Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1u4q h ALA 1734Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1u4q h ALA 1734CO 0.00 -0.53 -0.07 1.97 0.00 0.00 0.00 179.25 180.63 1u4q n PHE 1735N -2.90 -0.65 -3.48 0.00 1.16 -1.26 -5.13 117.46 105.19 1u4q n PHE 1735Ca -0.00 -0.77 -0.41 0.00 -1.87 0.00 0.00 57.45 54.40 1u4q n PHE 1735Cb 0.55 0.16 -0.10 0.00 -1.61 0.00 0.00 39.48 38.48 1u4q n PHE 1735CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1u4q s ASP 1736N -1.69 6.10 0.26 5.98 -1.08 -1.26 -4.96 116.67 120.01 1u4q s ASP 1736Ca 0.10 -0.49 -0.05 0.00 -0.52 0.00 0.00 52.55 51.59 1u4q s ASP 1736Cb -0.00 -2.16 0.30 0.00 -1.46 0.00 0.00 42.92 39.60 1u4q s ASP 1736CO 0.07 -0.32 1.89 0.74 0.52 0.00 0.00 175.17 178.08 1u4q h THR 1737N 5.54 1.24 -0.49 1.71 2.02 -1.89 -3.22 112.91 117.83 1u4q h THR 1737Ca -0.30 -0.57 0.14 0.00 0.77 0.00 0.00 66.41 66.46 1u4q h THR 1737Cb 1.15 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1u4q h THR 1737CO 0.67 0.26 0.80 -0.24 0.37 0.00 0.00 175.52 177.39 1u4q n SER 1738N -4.35 0.00 0.14 4.18 2.88 -1.26 -0.33 113.62 114.88 1u4q n SER 1738Ca 0.09 0.47 -0.07 0.00 -1.33 0.00 0.00 58.87 58.03 1u4q n SER 1738Cb 0.08 -0.12 -0.03 0.00 -0.75 0.00 0.00 64.21 63.39 1u4q n SER 1738CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1u4q h GLN 1739N 0.00 -0.42 0.00 -1.46 5.75 -2.00 -3.25 115.11 113.73 1u4q h GLN 1739Ca 0.23 0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.76 1u4q h GLN 1739Cb 1.83 0.10 -0.00 0.00 1.07 0.00 0.00 27.48 30.48 1u4q h GLN 1739CO -0.00 -0.28 -0.01 -0.39 -2.65 0.00 0.00 178.83 175.50 1u4q h VAL 1740N -1.01 0.61 0.13 2.39 -1.51 -0.94 -3.05 116.25 112.87 1u4q h VAL 1740Ca -0.04 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.39 1u4q h VAL 1740Cb 0.33 1.02 -0.02 0.00 -2.13 0.00 0.00 31.29 30.50 1u4q h VAL 1740CO 0.07 0.01 -0.24 0.50 -1.23 0.00 0.00 177.57 176.69 1u4q h LYS 1741N 0.00 -0.38 0.00 5.19 3.11 -1.47 -0.92 116.57 122.10 1u4q h LYS 1741Ca -0.00 0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 57.84 1u4q h LYS 1741Cb 0.02 0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.34 1u4q h LYS 1741CO 0.00 -0.25 -0.13 0.38 -2.81 0.00 0.00 179.45 176.64 1u4q h ASP 1742N -0.39 0.00 0.22 4.20 2.03 -1.58 -2.43 116.42 118.47 1u4q h ASP 1742Ca -0.01 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.28 1u4q h ASP 1742Cb 0.37 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.87 1u4q h ASP 1742CO -0.09 0.13 -0.11 0.11 -1.03 0.00 0.00 179.24 178.25 1u4q h LYS 1743N 0.00 -0.28 -0.96 4.15 1.57 -1.39 0.54 116.57 120.20 1u4q h LYS 1743Ca -0.00 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 1u4q h LYS 1743Cb 0.60 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.90 1u4q h LYS 1743CO 0.02 -0.05 0.61 -0.09 -0.57 0.00 0.00 179.45 179.37 1u4q h ARG 1744N -0.48 0.97 0.00 3.15 2.43 -0.97 -1.03 114.38 118.45 1u4q h ARG 1744Ca -0.03 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1u4q h ARG 1744Cb 0.37 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1u4q h ARG 1744CO 0.05 0.64 -0.00 1.49 -1.51 0.00 0.00 179.97 180.64 1u4q h GLU 1745N 1.00 0.00 0.00 0.20 4.81 -1.08 -2.80 114.58 116.71 1u4q h GLU 1745Ca 0.44 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.63 1u4q h GLU 1745Cb 0.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1u4q h GLU 1745CO -0.20 0.00 -0.25 1.15 -0.73 0.00 0.00 179.01 178.99 1u4q h THR 1746N 0.00 1.15 -0.76 0.32 2.02 0.41 -2.80 112.91 113.24 1u4q h THR 1746Ca -0.00 -1.95 0.01 0.00 0.77 0.00 0.00 66.41 65.24 1u4q h THR 1746Cb 0.74 2.26 -0.04 0.00 -1.74 0.00 0.00 68.15 69.37 1u4q h THR 1746CO 0.00 0.39 0.50 0.16 0.37 0.00 0.00 175.52 176.94 1u4q h ILE 1747N -1.00 1.20 -0.58 3.11 3.07 -1.49 0.59 117.51 122.41 1u4q h ILE 1747Ca -0.06 -0.37 -0.05 0.00 1.55 0.00 0.00 64.86 65.93 1u4q h ILE 1747Cb 0.81 0.08 -0.02 0.00 -0.27 0.00 0.00 36.82 37.41 1u4q h ILE 1747CO -0.04 0.19 0.15 0.78 -1.05 0.00 0.00 178.15 178.19 1u4q h ASN 1748N 1.04 0.87 0.44 2.16 2.35 -1.63 0.69 115.58 121.49 1u4q h ASN 1748Ca 0.28 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1u4q h ASN 1748Cb -0.11 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.03 1u4q h ASN 1748CO -0.06 0.87 -0.21 1.23 -1.65 0.00 0.00 177.43 177.61 1u4q h GLY 1749N 0.83 -0.62 0.57 2.83 0.00 -0.92 -1.59 103.07 104.17 1u4q h GLY 1749Ca 0.18 0.23 0.08 0.00 0.00 0.00 0.00 47.33 47.82 1u4q h GLY 1749CO -0.00 -0.22 0.36 3.21 0.00 0.00 0.00 176.54 179.88 1u4q h ARG 1750N -0.79 0.61 -0.12 4.80 3.08 0.26 -1.45 114.38 120.78 1u4q h ARG 1750Ca -0.06 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 59.98 1u4q h ARG 1750Cb 0.54 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.43 1u4q h ARG 1750CO 0.10 0.41 -0.05 0.35 -1.07 0.00 0.00 179.97 179.70 1u4q h PHE 1751N 0.63 -0.13 -0.82 3.04 3.57 0.47 -1.08 116.94 122.63 1u4q h PHE 1751Ca 0.32 0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.99 1u4q h PHE 1751Cb 0.28 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 1u4q h PHE 1751CO -0.10 -0.09 0.54 0.37 -2.23 0.00 0.00 178.31 176.81 1u4q h GLN 1752N -0.04 0.50 -0.15 1.11 4.15 -0.53 -1.34 115.11 118.80 1u4q h GLN 1752Ca 0.06 -0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.29 1u4q h GLN 1752Cb 0.14 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1u4q h GLN 1752CO -0.14 0.33 -0.59 -0.09 -1.93 0.00 0.00 178.83 176.40 1u4q h ARG 1753N 0.51 0.51 -0.07 1.69 2.43 -0.20 -2.38 114.38 116.87 1u4q h ARG 1753Ca 0.41 -0.34 -0.13 0.00 -0.81 0.00 0.00 59.98 59.11 1u4q h ARG 1753Cb 0.84 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1u4q h ARG 1753CO -0.16 0.95 -0.53 -0.84 -1.51 0.00 0.00 179.97 177.89 1u4q h ILE 1754N 0.38 1.36 0.22 1.20 3.07 -0.60 -0.15 117.51 123.00 1u4q h ILE 1754Ca -0.00 -1.81 -0.01 0.00 1.55 0.00 0.00 64.86 64.59 1u4q h ILE 1754Cb 1.14 1.90 0.00 0.00 -0.27 0.00 0.00 36.82 39.59 1u4q h ILE 1754CO 0.11 0.53 -0.12 0.11 -1.05 0.00 0.00 178.15 177.74 1u4q h LYS 1755N 0.16 -0.30 -0.07 0.16 1.79 -1.33 0.49 116.57 117.47 1u4q h LYS 1755Ca 0.00 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.51 1u4q h LYS 1755Cb 0.99 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.68 1u4q h LYS 1755CO 0.08 -0.20 -0.05 1.03 -1.08 0.00 0.00 179.45 179.22 1u4q h SER 1756N -0.31 -0.17 -0.51 0.86 0.87 -1.24 -0.22 113.55 112.82 1u4q h SER 1756Ca -0.03 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.52 1u4q h SER 1756Cb 0.25 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 1u4q h SER 1756CO 0.04 -0.08 0.14 0.24 -0.53 0.00 0.00 176.83 176.64 1u4q h MET 1757N -0.07 0.82 -0.59 2.24 2.86 -0.85 0.56 114.93 119.90 1u4q h MET 1757Ca 0.05 -0.19 0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1u4q h MET 1757Cb 0.13 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.62 1u4q h MET 1757CO -0.11 0.78 0.28 0.00 1.06 0.00 0.00 176.91 178.92 1u4q h ALA 1758N 1.01 0.78 -0.33 6.32 0.00 0.29 0.45 119.26 127.78 1u4q h ALA 1758Ca 0.16 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1u4q h ALA 1758Cb 0.32 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1u4q h ALA 1758CO -0.00 -0.10 0.18 0.00 0.00 0.00 0.00 179.25 179.34 1u4q h ALA 1759N 1.36 0.41 -0.95 0.00 0.00 -0.59 0.55 119.26 120.03 1u4q h ALA 1759Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1u4q h ALA 1759Cb 0.26 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1u4q h ALA 1759CO -0.23 -0.18 0.61 0.00 0.00 0.00 0.00 179.25 179.46 1u4q h ALA 1760N 1.15 1.21 -0.23 0.00 0.00 0.41 -1.49 119.26 120.32 1u4q h ALA 1760Ca 0.13 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1u4q h ALA 1760Cb 0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1u4q h ALA 1760CO -0.07 0.63 -0.43 -0.09 0.00 0.00 0.00 179.25 179.29 1u4q h ARG 1761N 1.30 0.55 -0.52 0.00 2.43 0.50 -2.60 114.38 116.04 1u4q h ARG 1761Ca 0.35 -0.29 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1u4q h ARG 1761Cb -0.12 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1u4q h ARG 1761CO -0.07 0.87 0.07 -0.09 -1.51 0.00 0.00 179.97 179.24 1u4q h ARG 1762N 0.45 0.83 0.27 0.20 9.65 -0.44 -2.03 114.38 123.30 1u4q h ARG 1762Ca 0.03 -0.20 -0.01 0.00 -1.10 0.00 0.00 59.98 58.70 1u4q h ARG 1762Cb 0.93 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.40 1u4q h ARG 1762CO 0.08 0.79 -0.13 0.00 2.80 0.00 0.00 179.97 183.52 1u4q h ALA 1763N 1.28 -0.36 0.00 2.80 0.00 -1.09 -1.63 119.26 120.27 1u4q h ALA 1763Ca 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1u4q h ALA 1763Cb 0.38 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1u4q h ALA 1763CO 0.01 -0.60 -0.15 0.87 0.00 0.00 0.00 179.25 179.38 1u4q h LYS 1764N -0.55 0.00 -0.10 0.00 1.79 -1.40 -0.64 116.57 115.67 1u4q h LYS 1764Ca -0.04 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.21 1u4q h LYS 1764Cb 0.40 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.06 1u4q h LYS 1764CO 0.06 0.15 -0.82 -0.07 -1.08 0.00 0.00 179.45 177.69 1u4q h LEU 1765N 0.00 0.81 -0.47 2.94 3.38 -1.20 -0.77 115.31 120.01 1u4q h LEU 1765Ca -0.00 -0.56 -0.12 0.00 0.09 0.00 0.00 57.88 57.29 1u4q h LEU 1765Cb 0.31 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1u4q h LEU 1765CO 0.02 1.34 -0.18 0.78 0.09 0.00 0.00 178.44 180.49 1u4q h ASN 1766N 0.44 0.97 0.18 -0.43 2.35 -0.69 -1.01 115.58 117.39 1u4q h ASN 1766Ca -0.06 -0.39 0.01 0.00 -0.55 0.00 0.00 56.30 55.31 1u4q h ASN 1766Cb 1.44 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 39.51 1u4q h ASN 1766CO 0.16 1.14 -0.39 -0.08 -1.65 0.00 0.00 177.43 176.61 1u4q h GLU 1767N 0.79 -0.64 -0.98 0.81 4.81 -1.07 -1.30 114.58 117.01 1u4q h GLU 1767Ca 0.11 0.04 0.17 0.00 -0.13 0.00 0.00 59.36 59.56 1u4q h GLU 1767Cb 0.75 0.14 -0.09 0.00 0.63 0.00 0.00 28.75 30.19 1u4q h GLU 1767CO 0.06 -0.42 0.61 1.03 -0.73 0.00 0.00 179.01 179.56 1u4q h SER 1768N -0.66 0.74 -0.89 1.04 0.87 -0.93 -1.20 113.55 112.53 1u4q h SER 1768Ca 0.01 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1u4q h SER 1768Cb 0.66 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 1u4q h SER 1768CO -0.19 0.31 0.53 -0.74 -0.53 0.00 0.00 176.83 176.21 1u4q h HIS 1769N 0.75 1.17 -0.05 2.24 -0.00 -0.03 -1.35 115.15 117.88 1u4q h HIS 1769Ca 0.54 -0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.72 1u4q h HIS 1769Cb 0.85 -0.38 -0.01 0.00 -0.00 0.00 0.00 27.41 27.87 1u4q h HIS 1769CO -0.00 0.78 -0.76 0.00 -0.00 0.00 0.00 177.93 177.95 1u4q h ARG 1770N 1.22 0.34 0.53 5.26 3.08 -0.77 -1.79 114.38 122.26 1u4q h ARG 1770Ca 0.32 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1u4q h ARG 1770Cb -0.05 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 1u4q h ARG 1770CO -0.06 0.95 -0.33 1.25 -1.07 0.00 0.00 179.97 180.71 1u4q h LEU 1771N 0.22 -0.83 -1.82 3.04 5.85 -0.78 0.50 115.31 121.50 1u4q h LEU 1771Ca -0.03 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1u4q h LEU 1771Cb 1.33 0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.60 1u4q h LEU 1771CO 0.13 -0.50 -0.14 0.45 -0.34 0.00 0.00 178.44 178.03 1u4q h HIS 1772N -0.80 0.00 -0.40 1.25 3.86 -1.34 0.88 115.15 118.60 1u4q h HIS 1772Ca -0.07 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.04 1u4q h HIS 1772Cb 0.64 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 1u4q h HIS 1772CO -0.03 0.14 -0.12 0.37 0.86 0.00 0.00 177.93 179.15 1u4q h GLN 1773N 0.00 0.79 -0.87 2.45 5.75 -1.07 -0.52 115.11 121.64 1u4q h GLN 1773Ca -0.00 -0.31 -0.00 0.00 -0.15 0.00 0.00 58.65 58.18 1u4q h GLN 1773Cb 0.30 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1u4q h GLN 1773CO 0.02 0.93 0.54 0.35 -2.65 0.00 0.00 178.83 178.02 1u4q h PHE 1774N 0.60 1.14 0.00 3.99 3.57 0.23 -0.24 116.94 126.22 1u4q h PHE 1774Ca 0.10 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 1u4q h PHE 1774Cb 0.65 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1u4q h PHE 1774CO 0.05 0.75 -0.30 0.74 -2.23 0.00 0.00 178.31 177.31 1u4q h PHE 1775N 1.20 0.00 0.06 0.41 0.04 -0.75 -0.74 116.94 117.16 1u4q h PHE 1775Ca 0.32 0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.10 1u4q h PHE 1775Cb -0.07 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1u4q h PHE 1775CO 0.00 0.30 -0.12 -0.09 -0.60 0.00 0.00 178.31 177.80 1u4q h ARG 1776N 0.00 -0.23 0.18 1.51 9.65 0.63 -0.40 114.38 125.72 1u4q h ARG 1776Ca -0.00 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 1u4q h ARG 1776Cb 0.80 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.43 1u4q h ARG 1776CO 0.04 -0.15 -0.09 -0.44 2.80 0.00 0.00 179.97 182.13 1u4q h ASP 1777N -0.24 -0.20 -0.97 -3.80 3.32 -1.03 -1.93 116.42 111.57 1u4q h ASP 1777Ca 0.02 -0.07 0.22 0.00 0.02 0.00 0.00 57.03 57.22 1u4q h ASP 1777Cb 0.26 0.05 -0.08 0.00 0.22 0.00 0.00 39.33 39.78 1u4q h ASP 1777CO -0.08 -0.05 0.63 -0.03 -1.72 0.00 0.00 179.24 177.98 1u4q h MET 1778N -0.34 0.46 0.03 3.56 4.05 -1.04 -0.12 114.93 121.54 1u4q h MET 1778Ca -0.02 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1u4q h MET 1778Cb 0.26 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 1u4q h MET 1778CO 0.04 0.30 -0.01 -0.44 0.23 0.00 0.00 176.91 177.03 1u4q h ASP 1779N 0.47 -0.03 -0.66 1.39 3.32 -0.33 -0.42 116.42 120.15 1u4q h ASP 1779Ca 0.53 -0.13 0.14 0.00 0.02 0.00 0.00 57.03 57.60 1u4q h ASP 1779Cb 1.23 0.01 -0.11 0.00 0.22 0.00 0.00 39.33 40.68 1u4q h ASP 1779CO -0.25 0.11 0.05 0.44 -1.72 0.00 0.00 179.24 177.86 1u4q h ASP 1780N -0.17 -0.20 1.59 6.45 3.32 -0.38 0.77 116.42 127.81 1u4q h ASP 1780Ca -0.00 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1u4q h ASP 1780Cb 0.16 0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1u4q h ASP 1780CO 0.01 -0.10 0.00 -0.33 -1.72 0.00 0.00 179.24 177.10 1u4q h GLU 1781N 0.16 0.00 -0.02 3.56 4.39 -1.28 -2.27 114.58 119.13 1u4q h GLU 1781Ca 0.36 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.86 1u4q h GLU 1781Cb 0.59 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 1u4q h GLU 1781CO -0.54 0.00 -0.84 0.93 -1.16 0.00 0.00 179.01 177.40 1u4q h GLU 1782N 0.00 0.29 0.00 2.33 4.39 0.84 -1.52 114.58 120.92 1u4q h GLU 1782Ca 0.00 -0.29 -0.20 0.00 0.34 0.00 0.00 59.36 59.21 1u4q h GLU 1782Cb 0.80 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 1u4q h GLU 1782CO 0.00 0.98 -0.88 0.66 -1.16 0.00 0.00 179.01 178.61 1u4q h SER 1783N 0.17 0.28 -0.27 1.42 4.64 -1.07 -1.85 113.55 116.87 1u4q h SER 1783Ca -0.05 -0.22 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 1u4q h SER 1783Cb 1.45 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.45 1u4q h SER 1783CO 0.14 1.03 0.01 -0.25 -0.87 0.00 0.00 176.83 176.88 1u4q h TRP 1784N 0.12 0.52 -0.04 4.77 7.01 -1.33 -1.53 115.95 125.46 1u4q h TRP 1784Ca -0.05 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 60.87 1u4q h TRP 1784Cb 1.51 -0.14 -0.00 0.00 -2.10 0.00 0.00 29.16 28.44 1u4q h TRP 1784CO 0.03 0.62 0.03 0.82 -2.79 0.00 0.00 178.44 177.15 1u4q h ILE 1785N 0.27 1.01 -0.79 2.65 2.04 -1.28 -2.21 117.51 119.21 1u4q h ILE 1785Ca 0.08 -0.02 0.11 0.00 1.00 0.00 0.00 64.86 66.03 1u4q h ILE 1785Cb 0.41 0.95 -0.08 0.00 -0.74 0.00 0.00 36.82 37.36 1u4q h ILE 1785CO 0.01 0.01 0.41 0.11 0.00 0.00 0.00 178.15 178.69 1u4q h LYS 1786N 0.06 0.63 -0.34 2.37 1.57 -1.23 0.21 116.57 119.83 1u4q h LYS 1786Ca 0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1u4q h LYS 1786Cb -0.01 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1u4q h LYS 1786CO -0.00 0.42 0.23 1.49 -0.57 0.00 0.00 179.45 181.01 1u4q h GLU 1787N 0.65 0.45 -0.19 3.15 4.81 -0.95 -1.54 114.58 120.96 1u4q h GLU 1787Ca 0.40 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.54 1u4q h GLU 1787Cb 0.47 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1u4q h GLU 1787CO -0.30 0.30 -0.16 0.87 -0.73 0.00 0.00 179.01 178.99 1u4q h LYS 1788N 0.47 0.32 -0.48 1.92 1.79 -0.58 -1.31 116.57 118.70 1u4q h LYS 1788Ca 0.13 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 58.47 1u4q h LYS 1788Cb -0.05 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 1u4q h LYS 1788CO -0.03 0.49 0.15 -0.22 -1.08 0.00 0.00 179.45 178.77 1u4q h LYS 1789N 0.30 0.70 -0.51 3.15 3.64 -0.04 -1.42 116.57 122.40 1u4q h LYS 1789Ca 0.06 -0.11 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 1u4q h LYS 1789Cb 0.47 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1u4q h LYS 1789CO 0.03 0.61 0.03 1.25 -2.27 0.00 0.00 179.45 179.10 1u4q h LEU 1790N 0.69 0.85 -0.04 5.20 5.85 -0.26 -2.66 115.31 124.94 1u4q h LEU 1790Ca 0.16 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1u4q h LEU 1790Cb 0.20 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 1u4q h LEU 1790CO -0.01 0.93 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.92 1u4q h LEU 1791N 0.74 0.09 0.00 2.25 3.38 -0.97 -3.14 115.31 117.66 1u4q h LEU 1791Ca 0.15 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1u4q h LEU 1791Cb 0.47 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1u4q h LEU 1791CO 0.02 0.53 0.00 0.52 0.09 0.00 0.00 178.44 179.60 1u4q n VAL 1792N -4.80 1.63 1.42 1.22 0.31 -0.58 -1.79 118.33 115.73 1u4q n VAL 1792Ca -0.08 0.41 0.14 0.00 -0.01 0.00 0.00 64.34 64.79 1u4q n VAL 1792Cb 0.26 -1.33 0.46 0.00 -0.91 0.00 0.00 33.84 32.32 1u4q n VAL 1792CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1u4q n SER 1793N -1.48 1.72 -4.68 4.52 7.64 -1.01 -4.76 113.62 115.57 1u4q n SER 1793Ca 0.01 -1.58 -0.40 0.00 1.01 0.00 0.00 58.87 57.91 1u4q n SER 1793Cb 0.05 -0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.26 1u4q n SER 1793CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1u4q n SER 1794N 0.34 2.07 -0.38 6.43 2.88 -0.74 -4.91 113.62 119.31 1u4q n SER 1794Ca 0.18 1.04 0.05 0.00 -1.33 0.00 0.00 58.87 58.81 1u4q n SER 1794Cb 0.39 -1.46 0.12 0.00 -0.75 0.00 0.00 64.21 62.50 1u4q n SER 1794CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1u4q n GLU 1795N -0.20 2.69 -2.33 -1.46 1.02 -1.26 -4.96 120.64 114.14 1u4q n GLU 1795Ca 0.09 -2.08 -0.43 0.00 -0.02 0.00 0.00 57.16 54.72 1u4q n GLU 1795Cb 0.41 -1.31 -0.02 0.00 -0.02 0.00 0.00 31.44 30.50 1u4q n GLU 1795CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1u4q s ASP 1796N -1.44 6.45 -0.04 1.62 2.15 -1.26 -4.85 116.67 119.30 1u4q s ASP 1796Ca 0.20 1.11 0.10 0.00 0.43 0.00 0.00 52.55 54.39 1u4q s ASP 1796Cb 0.14 -2.54 0.28 0.00 -0.30 0.00 0.00 42.92 40.50 1u4q s ASP 1796CO 0.07 -1.28 1.22 -1.22 -0.17 0.00 0.00 175.17 173.79 1u4q n TYR 1797N 8.36 0.42 -1.04 -5.34 0.53 -1.26 -5.05 117.16 113.78 1u4q n TYR 1797Ca 0.16 -0.61 0.00 0.00 -1.02 0.00 0.00 57.90 56.44 1u4q n TYR 1797Cb 0.47 -0.10 0.00 0.00 -1.03 0.00 0.00 39.34 38.68 1u4q n TYR 1797CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1u4q n GLY 1798N -0.05 -4.06 1.06 2.72 0.00 -1.26 -4.60 105.19 98.99 1u4q n GLY 1798Ca 0.11 -0.87 0.11 0.00 0.00 0.00 0.00 46.02 45.38 1u4q n GLY 1798CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1u4q n ARG 1799N -0.98 2.37 -3.57 1.61 1.85 -1.26 -4.76 116.66 111.92 1u4q n ARG 1799Ca 0.00 -2.08 -0.08 0.00 -1.00 0.00 0.00 57.85 54.69 1u4q n ARG 1799Cb 0.01 -1.49 -0.02 0.00 -1.05 0.00 0.00 32.46 29.91 1u4q n ARG 1799CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 1u4q s ASP 1800N -1.45 -0.35 0.23 2.89 3.84 -1.26 -5.03 116.67 115.53 1u4q s ASP 1800Ca 0.38 -0.12 -0.18 0.00 -0.00 0.00 0.00 52.55 52.63 1u4q s ASP 1800Cb 0.22 0.46 0.23 0.00 -1.38 0.00 0.00 42.92 42.45 1u4q s ASP 1800CO 0.30 -0.78 1.56 0.25 -0.00 0.00 0.00 175.17 176.50 1u4q h LEU 1801N 2.00 -1.40 -0.14 2.11 5.85 -1.93 0.17 115.31 121.98 1u4q h LEU 1801Ca -0.24 0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1u4q h LEU 1801Cb 1.25 0.73 -0.01 0.00 0.37 0.00 0.00 40.66 43.01 1u4q h LEU 1801CO 0.30 -0.29 0.08 0.74 -0.34 0.00 0.00 178.44 178.94 1u4q h THR 1802N -0.02 1.07 -0.52 1.05 2.02 -1.99 -1.73 112.91 112.78 1u4q h THR 1802Ca 0.33 -0.17 0.07 0.00 0.77 0.00 0.00 66.41 67.42 1u4q h THR 1802Cb 0.59 0.93 -0.06 0.00 -1.74 0.00 0.00 68.15 67.87 1u4q h THR 1802CO -0.95 0.06 0.21 1.23 0.37 0.00 0.00 175.52 176.44 1u4q h GLY 1803N 0.15 0.71 0.90 2.16 0.00 -1.46 -1.17 103.07 104.36 1u4q h GLY 1803Ca 0.05 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.27 1u4q h GLY 1803CO -0.01 0.03 0.08 -2.08 0.00 0.00 0.00 176.54 174.56 1u4q h VAL 1804N 0.40 0.99 -0.91 4.60 2.07 -0.49 -1.83 116.25 121.07 1u4q h VAL 1804Ca 0.25 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.79 1u4q h VAL 1804Cb 0.25 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 1u4q h VAL 1804CO -0.23 0.03 0.59 1.56 0.02 0.00 0.00 177.57 179.53 1u4q h GLN 1805N 0.18 0.93 -0.16 1.57 4.20 -0.78 0.33 115.11 121.39 1u4q h GLN 1805Ca 0.07 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 1u4q h GLN 1805Cb 0.02 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1u4q h GLN 1805CO -0.06 0.61 -0.45 -0.91 -0.67 0.00 0.00 178.83 177.35 1u4q h ASN 1806N 0.96 0.41 -0.22 1.46 -0.26 -0.73 0.18 115.58 117.38 1u4q h ASN 1806Ca 0.41 -0.19 -0.16 0.00 -0.56 0.00 0.00 56.30 55.79 1u4q h ASN 1806Cb 0.32 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 37.46 1u4q h ASN 1806CO -0.17 0.81 -0.47 -0.07 -1.06 0.00 0.00 177.43 176.48 1u4q h LEU 1807N 0.31 0.86 -0.43 1.61 3.38 -0.43 -2.15 115.31 118.45 1u4q h LEU 1807Ca 0.02 -0.42 -0.16 0.00 0.09 0.00 0.00 57.88 57.41 1u4q h LEU 1807Cb 0.92 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1u4q h LEU 1807CO 0.08 1.18 -0.37 0.03 0.09 0.00 0.00 178.44 179.45 1u4q h ARG 1808N 0.63 0.91 -0.76 1.13 3.08 -0.74 0.51 114.38 119.14 1u4q h ARG 1808Ca 0.03 -0.47 0.01 0.00 0.07 0.00 0.00 59.98 59.63 1u4q h ARG 1808Cb 1.04 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.06 1u4q h ARG 1808CO 0.10 1.12 0.50 -0.22 -1.07 0.00 0.00 179.97 180.40 1u4q h LYS 1809N 0.74 0.99 -0.02 0.04 3.64 -0.88 0.91 116.57 122.00 1u4q h LYS 1809Ca 0.06 -0.06 -0.23 0.00 -1.27 0.00 0.00 60.65 59.16 1u4q h LYS 1809Cb 0.96 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1u4q h LYS 1809CO 0.09 0.66 -0.93 0.87 -2.27 0.00 0.00 179.45 177.87 1u4q h LYS 1810N 1.02 0.48 -0.14 1.90 1.57 -1.09 -3.17 116.57 117.14 1u4q h LYS 1810Ca 0.28 -0.49 -0.12 0.00 -1.87 0.00 0.00 60.65 58.44 1u4q h LYS 1810Cb -0.11 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1u4q h LYS 1810CO -0.06 1.14 -0.46 1.25 -0.57 0.00 0.00 179.45 180.75 1u4q h HIS 1811N 0.28 0.41 -0.27 -1.35 2.76 -0.16 -2.86 115.15 113.96 1u4q h HIS 1811Ca -0.08 -0.12 -0.06 0.00 -2.20 0.00 0.00 60.37 57.91 1u4q h HIS 1811Cb 1.56 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 30.42 1u4q h HIS 1811CO 0.07 0.74 -0.08 -0.22 -1.30 0.00 0.00 177.93 177.13 1u4q h LYS 1812N 0.28 0.43 0.00 5.26 1.63 -0.86 -1.66 116.57 121.65 1u4q h LYS 1812Ca 0.02 -0.10 -0.04 0.00 -0.85 0.00 0.00 60.65 59.67 1u4q h LYS 1812Cb 0.91 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.48 1u4q h LYS 1812CO 0.08 0.52 -0.19 0.07 -3.45 0.00 0.00 179.45 176.48 1u4q h ARG 1813N 0.41 0.00 -0.08 1.90 0.11 -1.49 -2.71 114.38 112.52 1u4q h ARG 1813Ca 0.08 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 60.01 1u4q h ARG 1813Cb 0.40 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.49 1u4q h ARG 1813CO 0.02 0.19 -0.56 1.25 0.10 0.00 0.00 179.97 180.97 1u4q h LEU 1814N 0.00 0.64 -1.89 0.08 6.46 -1.22 -0.51 115.31 118.87 1u4q h LEU 1814Ca -0.00 -0.66 -0.03 0.00 -0.12 0.00 0.00 57.88 57.07 1u4q h LEU 1814Cb 1.10 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 40.83 1u4q h LEU 1814CO 0.02 1.20 -0.13 -0.33 -0.62 0.00 0.00 178.44 178.59 1u4q h GLU 1815N 0.12 0.00 -0.09 1.25 5.08 -1.28 -1.17 114.58 118.49 1u4q h GLU 1815Ca -0.05 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1u4q h GLU 1815Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1u4q h GLU 1815CO 0.11 0.13 -0.37 0.00 -1.00 0.00 0.00 179.01 177.88 1u4q h ALA 1816N 1.87 0.16 -0.39 3.43 0.00 -1.27 -1.95 119.26 121.12 1u4q h ALA 1816Ca -0.00 -0.45 0.08 0.00 0.00 0.00 0.00 54.91 54.54 1u4q h ALA 1816Cb 0.27 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.96 1u4q h ALA 1816CO 0.02 0.25 -0.28 0.93 0.00 0.00 0.00 179.25 180.16 1u4q h GLU 1817N -0.05 -0.21 -0.67 0.00 5.08 0.06 0.47 114.58 119.26 1u4q h GLU 1817Ca -0.02 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1u4q h GLU 1817Cb 1.01 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 1u4q h GLU 1817CO 0.08 -0.14 0.43 -0.07 -1.00 0.00 0.00 179.01 178.31 1u4q h LEU 1818N -0.22 0.73 -1.08 1.33 3.38 -1.31 -0.10 115.31 118.05 1u4q h LEU 1818Ca 0.18 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1u4q h LEU 1818Cb 0.51 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1u4q h LEU 1818CO -0.52 0.52 0.11 0.00 0.09 0.00 0.00 178.44 178.64 1u4q h ALA 1819N 1.26 1.25 -0.00 1.53 0.00 -0.39 0.16 119.26 123.07 1u4q h ALA 1819Ca 0.25 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1u4q h ALA 1819Cb -0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1u4q h ALA 1819CO -0.07 0.52 -0.43 0.00 0.00 0.00 0.00 179.25 179.27 1u4q h ALA 1820N 1.38 1.29 0.00 0.00 0.00 0.78 -3.15 119.26 119.56 1u4q h ALA 1820Ca 0.16 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1u4q h ALA 1820Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1u4q h ALA 1820CO -0.00 0.54 -0.98 1.58 0.00 0.00 0.00 179.25 180.39 1u4q n HIS 1821N -4.03 0.68 -0.32 0.00 -0.00 -0.14 -4.46 115.22 106.95 1u4q n HIS 1821Ca -0.02 0.20 0.24 0.00 -0.00 0.00 0.00 57.72 58.14 1u4q n HIS 1821Cb 0.45 -0.76 0.45 0.00 -0.00 0.00 0.00 29.99 30.14 1u4q n HIS 1821CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1u4q n GLU 1822N -2.38 -0.06 0.12 1.57 2.13 -0.04 -0.27 120.64 121.70 1u4q n GLU 1822Ca 0.01 1.37 0.03 0.00 0.66 0.00 0.00 57.16 59.22 1u4q n GLU 1822Cb 0.50 -2.34 0.41 0.00 0.27 0.00 0.00 31.44 30.28 1u4q n GLU 1822CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1u4q h PRO 1823N 0.00 0.24 -0.19 5.31 0.11 -1.81 -1.37 132.00 134.29 1u4q h PRO 1823Ca 0.72 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 66.63 1u4q h PRO 1823Cb 1.78 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.85 1u4q h PRO 1823CO -0.80 0.35 -0.51 0.00 -0.21 0.00 0.00 178.00 176.83 1u4q h ALA 1824N 1.67 0.77 -0.37 -0.75 0.00 -0.95 -0.89 119.26 118.74 1u4q h ALA 1824Ca 0.05 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 1u4q h ALA 1824Cb 0.33 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1u4q h ALA 1824CO 0.02 0.68 0.12 0.82 0.00 0.00 0.00 179.25 180.88 1u4q h ILE 1825N 0.40 1.21 -0.56 0.00 1.08 -1.16 -2.35 117.51 116.13 1u4q h ILE 1825Ca 0.02 -0.68 -0.09 0.00 -0.39 0.00 0.00 64.86 63.71 1u4q h ILE 1825Cb 1.03 0.96 -0.02 0.00 -3.07 0.00 0.00 36.82 35.72 1u4q h ILE 1825CO 0.09 0.24 -0.01 -0.61 -0.69 0.00 0.00 178.15 177.17 1u4q h GLN 1826N 0.44 0.98 -0.42 2.37 4.15 -1.20 -2.70 115.11 118.74 1u4q h GLN 1826Ca 0.12 -0.31 0.08 0.00 0.77 0.00 0.00 58.65 59.32 1u4q h GLN 1826Cb 0.25 -0.09 -0.08 0.00 0.21 0.00 0.00 27.48 27.76 1u4q h GLN 1826CO -0.00 0.98 -0.12 0.78 -1.93 0.00 0.00 178.83 178.53 1u4q h GLY 1827N 0.99 0.27 0.44 2.39 0.00 -0.78 0.60 103.07 106.98 1u4q h GLY 1827Ca 0.16 0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.70 1u4q h GLY 1827CO 0.03 -0.17 -0.09 -2.08 0.00 0.00 0.00 176.54 174.24 1u4q h VAL 1828N -0.02 0.69 -0.21 4.60 2.07 -1.19 0.29 116.25 122.49 1u4q h VAL 1828Ca 0.20 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.77 1u4q h VAL 1828Cb 0.33 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 1u4q h VAL 1828CO -0.44 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 177.01 1u4q h LEU 1829N -0.04 -0.25 -0.26 2.57 3.38 -0.65 0.15 115.31 120.22 1u4q h LEU 1829Ca 0.13 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1u4q h LEU 1829Cb 0.23 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1u4q h LEU 1829CO -0.28 -0.09 0.03 0.44 0.09 0.00 0.00 178.44 178.63 1u4q h ASP 1830N -0.03 0.41 -0.84 -0.43 3.32 0.57 -1.06 116.42 118.37 1u4q h ASP 1830Ca 0.10 -0.27 0.07 0.00 0.02 0.00 0.00 57.03 56.95 1u4q h ASP 1830Cb 0.19 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.57 1u4q h ASP 1830CO -0.23 0.58 0.55 0.74 -1.72 0.00 0.00 179.24 179.16 1u4q h THR 1831N 0.23 1.04 -0.03 0.35 2.02 -0.16 -2.46 112.91 113.91 1u4q h THR 1831Ca 0.08 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 1u4q h THR 1831Cb 0.35 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1u4q h THR 1831CO 0.01 0.17 -0.01 1.23 0.37 0.00 0.00 175.52 177.28 1u4q h GLY 1832N 0.91 0.06 0.34 2.16 0.00 -0.26 -3.05 103.07 103.22 1u4q h GLY 1832Ca 0.37 -0.05 0.15 0.00 0.00 0.00 0.00 47.33 47.80 1u4q h GLY 1832CO -0.13 0.05 0.62 0.07 0.00 0.00 0.00 176.54 177.14 1u4q h LYS 1833N -0.33 0.85 -0.42 4.80 2.10 -0.97 -0.51 116.57 122.09 1u4q h LYS 1833Ca 0.01 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.58 1u4q h LYS 1833Cb 0.42 -0.19 -0.02 0.00 -0.90 0.00 0.00 32.23 31.53 1u4q h LYS 1833CO 0.00 0.56 0.16 -0.22 -2.00 0.00 0.00 179.45 177.95 1u4q h LYS 1834N 0.88 0.59 -0.21 0.07 1.63 -1.36 -2.14 116.57 116.03 1u4q h LYS 1834Ca 0.53 -0.08 -0.19 0.00 -0.85 0.00 0.00 60.65 60.05 1u4q h LYS 1834Cb 0.68 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.20 1u4q h LYS 1834CO -0.30 0.50 -0.63 -0.07 -3.45 0.00 0.00 179.45 175.50 1u4q h LEU 1835N 0.59 0.85 -1.97 5.20 3.38 -1.01 -2.63 115.31 119.73 1u4q h LEU 1835Ca 0.14 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 1u4q h LEU 1835Cb 0.14 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1u4q h LEU 1835CO -0.01 1.27 -0.08 -1.28 0.09 0.00 0.00 178.44 178.44 1u4q h SER 1836N 0.55 0.00 0.88 -0.43 0.87 -0.89 -0.81 113.55 113.73 1u4q h SER 1836Ca -0.01 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.34 1u4q h SER 1836Cb 1.23 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.17 1u4q h SER 1836CO 0.13 0.08 -0.99 0.44 -0.53 0.00 0.00 176.83 175.96 1u4q h ASP 1837N 0.00 0.08 -0.54 6.23 5.19 -1.24 -3.20 116.42 122.93 1u4q h ASP 1837Ca -0.00 -0.08 -0.33 0.00 -0.62 0.00 0.00 57.03 56.01 1u4q h ASP 1837Cb 0.15 -0.02 -0.16 0.00 0.18 0.00 0.00 39.33 39.47 1u4q h ASP 1837CO 0.01 1.01 0.42 0.47 -3.12 0.00 0.00 179.24 178.03 1u4q n ASP 1838N -3.44 5.13 -2.49 6.45 8.00 -0.34 -4.88 116.55 124.98 1u4q n ASP 1838Ca -0.01 -3.02 -0.11 0.00 0.71 0.00 0.00 54.79 52.35 1u4q n ASP 1838Cb 0.91 -0.88 -0.02 0.00 -0.02 0.00 0.00 41.12 41.11 1u4q n ASP 1838CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1u4q n ASN 1839N -0.08 -0.32 -4.68 -2.24 5.03 -1.12 -4.70 115.26 107.15 1u4q n ASN 1839Ca 0.33 -0.34 -0.52 0.00 0.87 0.00 0.00 54.58 54.92 1u4q n ASN 1839Cb 0.84 -0.44 -0.06 0.00 -1.02 0.00 0.00 39.78 39.11 1u4q n ASN 1839CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1u4q n THR 1840N -1.60 0.32 0.00 3.41 -1.04 -1.03 -4.68 114.28 109.67 1u4q n THR 1840Ca 0.00 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1u4q n THR 1840Cb 0.14 -1.43 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 1u4q n THR 1840CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1u4q n ILE 1841N 4.36 0.00 -2.87 12.58 5.41 -1.26 -1.63 119.36 135.95 1u4q n ILE 1841Ca 0.23 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.55 1u4q n ILE 1841Cb 0.21 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.15 1u4q n ILE 1841CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1u4q n GLY 1842N -0.63 4.79 0.12 7.39 0.00 -1.26 -4.76 105.19 110.84 1u4q n GLY 1842Ca 0.00 -2.45 -0.15 0.00 0.00 0.00 0.00 46.02 43.42 1u4q n GLY 1842CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1u4q h LYS 1843N 5.83 0.30 -0.79 1.61 3.64 -1.62 -2.84 116.57 122.70 1u4q h LYS 1843Ca 0.26 -0.25 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1u4q h LYS 1843Cb 0.67 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.49 1u4q h LYS 1843CO 1.36 0.89 0.51 0.93 -2.27 0.00 0.00 179.45 180.88 1u4q h GLU 1844N -0.21 0.69 -0.25 1.90 4.39 -1.89 -1.44 114.58 117.78 1u4q h GLU 1844Ca -0.02 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 1u4q h GLU 1844Cb 0.95 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1u4q h GLU 1844CO 0.06 0.46 -0.24 1.49 -1.16 0.00 0.00 179.01 179.62 1u4q h GLU 1845N 0.72 0.60 0.00 2.33 4.57 -1.94 -3.01 114.58 117.85 1u4q h GLU 1845Ca 0.36 -0.31 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1u4q h GLU 1845Cb 0.45 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1u4q h GLU 1845CO -0.14 0.91 -0.28 -0.84 -1.18 0.00 0.00 179.01 177.48 1u4q h ILE 1846N 0.31 0.67 -0.07 2.32 3.07 -1.18 -2.17 117.51 120.46 1u4q h ILE 1846Ca 0.04 -1.31 -0.13 0.00 1.55 0.00 0.00 64.86 65.01 1u4q h ILE 1846Cb 0.80 1.86 -0.01 0.00 -0.27 0.00 0.00 36.82 39.19 1u4q h ILE 1846CO 0.06 0.28 -0.54 1.56 -1.05 0.00 0.00 178.15 178.46 1u4q h GLN 1847N 0.00 0.21 0.07 0.16 1.08 -1.26 -1.55 115.11 113.81 1u4q h GLN 1847Ca -0.00 -0.12 -0.25 0.00 -1.45 0.00 0.00 58.65 56.82 1u4q h GLN 1847Cb 0.83 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.26 1u4q h GLN 1847CO 0.04 0.69 -1.16 1.96 -0.95 0.00 0.00 178.83 179.40 1u4q h GLN 1848N 0.16 0.14 0.02 1.46 4.20 -1.36 -2.91 115.11 116.82 1u4q h GLN 1848Ca 0.00 -0.24 -0.27 0.00 0.06 0.00 0.00 58.65 58.20 1u4q h GLN 1848Cb 1.00 0.09 0.02 0.00 0.30 0.00 0.00 27.48 28.89 1u4q h GLN 1848CO 0.08 1.10 -1.07 0.00 -0.67 0.00 0.00 178.83 178.26 1u4q h ARG 1849N 0.04 0.68 -0.46 1.46 2.47 -1.35 -1.83 114.38 115.39 1u4q h ARG 1849Ca -0.09 -0.76 -0.05 0.00 -1.26 0.00 0.00 59.98 57.83 1u4q h ARG 1849Cb 1.89 0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 30.41 1u4q h ARG 1849CO 0.16 1.33 0.10 -0.07 0.56 0.00 0.00 179.97 182.05 1u4q h LEU 1850N 0.37 0.70 0.05 3.04 3.38 -1.40 0.85 115.31 122.31 1u4q h LEU 1850Ca -0.14 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.61 1u4q h LEU 1850Cb 1.73 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 1u4q h LEU 1850CO 0.21 0.76 -0.12 0.00 0.09 0.00 0.00 178.44 179.38 1u4q h ALA 1851N 0.97 -0.17 -0.62 1.53 0.00 -1.54 -0.67 119.26 118.77 1u4q h ALA 1851Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1u4q h ALA 1851Cb 0.34 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1u4q h ALA 1851CO 0.00 -0.62 0.35 0.37 0.00 0.00 0.00 179.25 179.35 1u4q h GLN 1852N -0.22 0.85 -0.97 0.00 4.15 -0.97 -2.36 115.11 115.59 1u4q h GLN 1852Ca 0.03 -0.09 0.05 0.00 0.77 0.00 0.00 58.65 59.40 1u4q h GLN 1852Cb 0.25 -0.17 -0.06 0.00 0.21 0.00 0.00 27.48 27.71 1u4q h GLN 1852CO -0.08 0.64 0.63 0.35 -1.93 0.00 0.00 178.83 178.43 1u4q h PHE 1853N 0.84 1.17 -0.50 3.99 3.57 0.11 -2.01 116.94 124.11 1u4q h PHE 1853Ca 0.22 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.65 1u4q h PHE 1853Cb 0.03 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 38.36 1u4q h PHE 1853CO -0.01 0.65 -0.08 0.28 -2.23 0.00 0.00 178.31 176.92 1u4q h VAL 1854N 1.19 1.27 -0.65 1.41 2.07 -0.68 -2.76 116.25 118.11 1u4q h VAL 1854Ca 0.40 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 1u4q h VAL 1854Cb 0.06 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1u4q h VAL 1854CO -0.14 0.42 0.29 0.44 0.02 0.00 0.00 177.57 178.60 1u4q h ASP 1855N 0.79 0.87 -0.24 0.57 3.32 -1.03 0.77 116.42 121.46 1u4q h ASP 1855Ca 0.13 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1u4q h ASP 1855Cb 0.63 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1u4q h ASP 1855CO 0.04 0.77 0.08 0.45 -1.72 0.00 0.00 179.24 178.87 1u4q h HIS 1856N 0.90 0.15 0.44 4.55 3.86 -1.25 0.29 115.15 124.09 1u4q h HIS 1856Ca 0.22 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.42 1u4q h HIS 1856Cb 0.15 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1u4q h HIS 1856CO 0.01 0.07 -0.23 2.35 0.86 0.00 0.00 177.93 180.99 1u4q h TRP 1857N 0.19 -0.59 -0.96 2.45 -0.00 -1.20 -0.80 115.95 115.03 1u4q h TRP 1857Ca 0.10 -0.01 0.14 0.00 -0.00 0.00 0.00 58.89 59.12 1u4q h TRP 1857Cb 0.07 0.20 -0.08 0.00 -0.00 0.00 0.00 29.16 29.34 1u4q h TRP 1857CO -0.12 -0.36 0.61 0.87 -0.00 0.00 0.00 178.44 179.44 1u4q h LYS 1858N -0.61 0.82 0.46 2.65 1.57 -0.69 -1.56 116.57 119.21 1u4q h LYS 1858Ca -0.06 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1u4q h LYS 1858Cb 0.48 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1u4q h LYS 1858CO 0.09 0.54 -0.22 1.49 -0.57 0.00 0.00 179.45 180.78 1u4q h GLU 1859N 0.85 -0.60 -0.97 3.15 4.81 -0.45 -0.65 114.58 120.72 1u4q h GLU 1859Ca 0.49 0.04 0.26 0.00 -0.13 0.00 0.00 59.36 60.02 1u4q h GLU 1859Cb 0.64 0.14 -0.13 0.00 0.63 0.00 0.00 28.75 30.02 1u4q h GLU 1859CO -0.26 -0.34 0.51 1.25 -0.73 0.00 0.00 179.01 179.45 1u4q h LEU 1860N -0.75 0.50 -0.43 1.64 5.85 -0.34 0.45 115.31 122.22 1u4q h LEU 1860Ca -0.06 0.16 -0.17 0.00 0.84 0.00 0.00 57.88 58.65 1u4q h LEU 1860Cb 0.54 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1u4q h LEU 1860CO 0.10 -0.01 -0.78 0.11 -0.34 0.00 0.00 178.44 177.53 1u4q h LYS 1861N 0.44 0.12 -0.03 1.25 1.57 -1.03 -1.87 116.57 117.01 1u4q h LYS 1861Ca 0.64 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 59.30 1u4q h LYS 1861Cb 1.31 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 1u4q h LYS 1861CO -0.54 0.84 -0.02 1.96 -0.57 0.00 0.00 179.45 181.12 1u4q h GLN 1862N 0.07 0.06 -0.76 3.15 4.20 0.92 -2.34 115.11 120.40 1u4q h GLN 1862Ca -0.02 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.70 1u4q h GLN 1862Cb 1.37 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.10 1u4q h GLN 1862CO 0.11 0.48 0.50 -0.07 -0.67 0.00 0.00 178.83 179.18 1u4q h LEU 1863N -0.36 0.80 -1.06 1.46 3.38 -0.23 -1.34 115.31 117.95 1u4q h LEU 1863Ca 0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1u4q h LEU 1863Cb 0.46 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1u4q h LEU 1863CO 0.00 0.55 -0.31 0.00 0.09 0.00 0.00 178.44 178.77 1u4q h ALA 1864N 1.56 1.03 0.02 1.53 0.00 -1.27 -2.06 119.26 120.07 1u4q h ALA 1864Ca 0.30 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1u4q h ALA 1864Cb 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1u4q h ALA 1864CO -0.09 0.39 -0.01 0.00 0.00 0.00 0.00 179.25 179.54 1u4q h ALA 1865N 1.69 -0.02 -0.27 0.00 0.00 -0.71 -2.30 119.26 117.66 1u4q h ALA 1865Ca -0.00 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1u4q h ALA 1865Cb 0.81 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1u4q h ALA 1865CO 0.04 -0.19 0.13 0.00 0.00 0.00 0.00 179.25 179.23 1u4q h ALA 1866N 0.28 0.32 -0.01 0.00 0.00 -1.31 -1.84 119.26 116.70 1u4q h ALA 1866Ca -0.00 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1u4q h ALA 1866Cb 0.63 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1u4q h ALA 1866CO 0.00 -0.27 -0.16 -0.09 0.00 0.00 0.00 179.25 178.74 1u4q h ARG 1867N 0.27 -0.24 -0.98 0.00 9.65 -1.46 -0.09 114.38 121.52 1u4q h ARG 1867Ca 0.11 0.02 0.10 0.00 -1.10 0.00 0.00 59.98 59.11 1u4q h ARG 1867Cb 0.04 0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 28.60 1u4q h ARG 1867CO -0.08 -0.16 0.63 0.78 2.80 0.00 0.00 179.97 183.94 1u4q h GLY 1868N -0.25 1.54 1.75 2.80 0.00 -1.12 -1.01 103.07 106.79 1u4q h GLY 1868Ca 0.06 -0.43 -0.20 0.00 0.00 0.00 0.00 47.33 46.75 1u4q h GLY 1868CO -0.16 0.23 -0.90 0.06 0.00 0.00 0.00 176.54 175.76 1u4q h GLN 1869N 1.04 0.22 0.00 4.80 -0.00 -1.03 -2.67 115.11 117.47 1u4q h GLN 1869Ca 0.46 -0.24 -0.08 0.00 -0.00 0.00 0.00 58.65 58.79 1u4q h GLN 1869Cb 0.37 0.07 -0.01 0.00 -0.00 0.00 0.00 27.48 27.91 1u4q h GLN 1869CO -0.22 0.98 -0.36 -0.09 -0.00 0.00 0.00 178.83 179.14 1u4q h ARG 1870N 0.12 0.00 -0.21 0.06 9.65 -0.26 -2.53 114.38 121.22 1u4q h ARG 1870Ca -0.05 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.72 1u4q h ARG 1870Cb 1.54 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 30.12 1u4q h ARG 1870CO 0.14 0.36 -0.31 -0.07 2.80 0.00 0.00 179.97 182.89 1u4q h LEU 1871N 0.00 0.63 -1.21 3.80 3.38 -1.05 -2.48 115.31 118.38 1u4q h LEU 1871Ca -0.00 -0.52 0.05 0.00 0.09 0.00 0.00 57.88 57.49 1u4q h LEU 1871Cb 0.68 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 1u4q h LEU 1871CO 0.05 1.03 0.55 -0.33 0.09 0.00 0.00 178.44 179.82 1u4q h GLU 1872N 0.25 0.97 -0.25 1.13 5.08 -1.24 0.13 114.58 120.64 1u4q h GLU 1872Ca 0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1u4q h GLU 1872Cb 0.89 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1u4q h GLU 1872CO 0.07 0.64 0.14 0.93 -1.00 0.00 0.00 179.01 179.79 1u4q h GLU 1873N 0.99 0.35 -0.45 2.33 5.08 -1.32 0.10 114.58 121.66 1u4q h GLU 1873Ca 0.35 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1u4q h GLU 1873Cb 0.11 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1u4q h GLU 1873CO -0.11 0.30 0.30 0.77 -1.00 0.00 0.00 179.01 179.27 1u4q h SER 1874N 0.30 0.52 0.11 1.42 0.02 -0.77 0.25 113.55 115.40 1u4q h SER 1874Ca 0.09 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1u4q h SER 1874Cb 0.05 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 1u4q h SER 1874CO -0.01 0.38 -0.35 0.25 -1.14 0.00 0.00 176.83 175.95 1u4q h LEU 1875N 0.61 -1.01 -0.73 5.07 5.85 -0.42 0.57 115.31 125.25 1u4q h LEU 1875Ca 0.16 0.12 0.04 0.00 0.84 0.00 0.00 57.88 59.04 1u4q h LEU 1875Cb -0.07 0.38 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 1u4q h LEU 1875CO -0.04 -0.43 0.44 -0.33 -0.34 0.00 0.00 178.44 177.75 1u4q h GLU 1876N -0.57 0.82 0.45 1.25 5.08 -0.44 -0.18 114.58 120.97 1u4q h GLU 1876Ca 0.03 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1u4q h GLU 1876Cb 0.61 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1u4q h GLU 1876CO -0.21 0.54 -0.22 -0.92 -1.00 0.00 0.00 179.01 177.21 1u4q h TYR 1877N 0.84 -0.56 -1.00 4.33 3.20 0.04 -0.86 116.97 122.96 1u4q h TYR 1877Ca 0.30 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.34 1u4q h TYR 1877Cb 0.09 0.18 -0.10 0.00 1.54 0.00 0.00 36.73 38.44 1u4q h TYR 1877CO -0.05 -0.26 0.62 1.96 -1.64 0.00 0.00 178.16 178.79 1u4q h GLN 1878N -0.80 0.76 -0.28 1.82 1.08 0.30 0.46 115.11 118.46 1u4q h GLN 1878Ca -0.06 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.05 1u4q h GLN 1878Cb 0.55 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 1u4q h GLN 1878CO 0.10 0.51 0.01 0.37 -0.95 0.00 0.00 178.83 178.86 1u4q h GLN 1879N 0.79 0.41 0.01 1.46 5.75 -0.75 0.23 115.11 123.01 1u4q h GLN 1879Ca 0.56 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.98 1u4q h GLN 1879Cb 0.84 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.33 1u4q h GLN 1879CO -0.35 0.44 -0.01 0.35 -2.65 0.00 0.00 178.83 176.61 1u4q h PHE 1880N 0.40 -0.02 -0.40 3.99 3.57 0.12 -2.53 116.94 122.07 1u4q h PHE 1880Ca 0.09 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.66 1u4q h PHE 1880Cb 0.26 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 1u4q h PHE 1880CO 0.01 0.58 0.03 0.28 -2.23 0.00 0.00 178.31 176.98 1u4q h VAL 1881N -0.63 0.73 -0.66 1.41 2.07 -0.40 0.05 116.25 118.82 1u4q h VAL 1881Ca -0.00 -0.05 0.11 0.00 0.82 0.00 0.00 66.70 67.58 1u4q h VAL 1881Cb 0.61 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.87 1u4q h VAL 1881CO 0.00 0.03 0.25 0.00 0.02 0.00 0.00 177.57 177.87 1u4q h ALA 1882N 1.34 0.87 -0.40 1.67 0.00 -0.55 -0.87 119.26 121.32 1u4q h ALA 1882Ca 0.20 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 1u4q h ALA 1882Cb 0.27 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1u4q h ALA 1882CO -0.31 -0.20 -0.27 -0.91 0.00 0.00 0.00 179.25 177.56 1u4q h ASN 1883N 0.42 0.87 -0.13 0.00 -0.26 -0.86 -1.94 115.58 113.68 1u4q h ASN 1883Ca 0.34 -0.35 0.01 0.00 -0.56 0.00 0.00 56.30 55.75 1u4q h ASN 1883Cb 0.46 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 1u4q h ASN 1883CO -0.34 1.09 0.04 0.58 -1.06 0.00 0.00 177.43 177.74 1u4q h VAL 1884N 0.72 0.97 -0.08 2.81 2.07 -0.01 -2.08 116.25 120.65 1u4q h VAL 1884Ca 0.09 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1u4q h VAL 1884Cb 0.82 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1u4q h VAL 1884CO 0.07 0.02 -0.04 -0.33 0.02 0.00 0.00 177.57 177.31 1u4q h GLU 1885N 0.11 0.11 -0.60 1.57 5.08 -1.06 -1.91 114.58 117.88 1u4q h GLU 1885Ca 0.06 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1u4q h GLU 1885Cb 0.03 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1u4q h GLU 1885CO -0.06 0.17 0.11 1.49 -1.00 0.00 0.00 179.01 179.72 1u4q h GLU 1886N 0.11 0.95 0.06 2.33 4.81 -0.66 -0.45 114.58 121.73 1u4q h GLU 1886Ca 0.03 -0.22 -0.24 0.00 -0.13 0.00 0.00 59.36 58.79 1u4q h GLU 1886Cb 0.15 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 1u4q h GLU 1886CO 0.01 0.87 -1.07 0.93 -0.73 0.00 0.00 179.01 179.01 1u4q h GLU 1887N 0.90 0.27 -0.19 1.92 4.39 -1.14 -3.20 114.58 117.52 1u4q h GLU 1887Ca 0.19 -0.37 -0.12 0.00 0.34 0.00 0.00 59.36 59.40 1u4q h GLU 1887Cb 0.37 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1u4q h GLU 1887CO 0.01 1.12 -0.39 0.93 -1.16 0.00 0.00 179.01 179.51 1u4q h GLU 1888N 0.11 0.44 -0.56 2.33 5.08 -1.10 -0.87 114.58 120.02 1u4q h GLU 1888Ca -0.09 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 57.99 1u4q h GLU 1888Cb 1.76 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.98 1u4q h GLU 1888CO 0.17 0.76 0.09 0.00 -1.00 0.00 0.00 179.01 179.03 1u4q h ALA 1889N 1.21 1.10 -0.21 3.43 0.00 -1.12 0.13 119.26 123.81 1u4q h ALA 1889Ca 0.03 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.53 1u4q h ALA 1889Cb 0.85 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1u4q h ALA 1889CO 0.07 0.59 -0.58 2.35 0.00 0.00 0.00 179.25 181.67 1u4q h TRP 1890N 0.84 0.85 -0.42 0.00 7.01 -1.50 -2.62 115.95 120.12 1u4q h TRP 1890Ca 0.17 -0.32 -0.08 0.00 2.11 0.00 0.00 58.89 60.78 1u4q h TRP 1890Cb 0.38 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 1u4q h TRP 1890CO 0.02 1.09 -0.05 0.82 -2.79 0.00 0.00 178.44 177.53 1u4q h ILE 1891N 0.51 1.27 -0.94 2.65 2.04 -0.64 -1.88 117.51 120.52 1u4q h ILE 1891Ca 0.00 -1.12 0.04 0.00 1.00 0.00 0.00 64.86 64.78 1u4q h ILE 1891Cb 1.16 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 1u4q h ILE 1891CO 0.12 0.38 0.61 0.78 0.00 0.00 0.00 178.15 180.04 1u4q h ASN 1892N 0.61 1.01 0.87 1.72 2.35 -0.69 0.37 115.58 121.82 1u4q h ASN 1892Ca 0.11 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1u4q h ASN 1892Cb 0.56 -0.23 0.01 0.00 0.05 0.00 0.00 38.32 38.71 1u4q h ASN 1892CO 0.03 0.69 -0.42 -0.08 -1.65 0.00 0.00 177.43 176.00 1u4q h GLU 1893N 1.17 -1.13 -0.96 0.81 4.81 -1.20 -2.87 114.58 115.21 1u4q h GLU 1893Ca 0.37 0.08 0.17 0.00 -0.13 0.00 0.00 59.36 59.85 1u4q h GLU 1893Cb 0.02 0.26 -0.09 0.00 0.63 0.00 0.00 28.75 29.57 1u4q h GLU 1893CO -0.12 -0.75 0.61 0.87 -0.73 0.00 0.00 179.01 178.89 1u4q h LYS 1894N -1.25 0.72 -0.70 1.92 1.79 -0.97 0.22 116.57 118.31 1u4q h LYS 1894Ca -0.12 -0.04 0.17 0.00 -2.18 0.00 0.00 60.65 58.48 1u4q h LYS 1894Cb 0.90 -0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 31.35 1u4q h LYS 1894CO 0.20 0.48 0.48 1.98 -1.08 0.00 0.00 179.45 181.51 1u4q h MET 1895N 0.74 0.19 0.00 3.15 4.05 -0.09 -1.86 114.93 121.11 1u4q h MET 1895Ca 0.52 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.92 1u4q h MET 1895Cb 0.82 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.58 1u4q h MET 1895CO -0.28 0.13 0.00 2.41 0.23 0.00 0.00 176.91 179.39 1u4q n THR 1896N -4.41 0.00 -0.34 -0.77 -1.04 0.77 -3.25 114.28 105.24 1u4q n THR 1896Ca 0.14 0.77 0.18 0.00 -2.04 0.00 0.00 64.05 63.10 1u4q n THR 1896Cb 0.63 -1.70 0.35 0.00 -1.82 0.00 0.00 70.33 67.79 1u4q n THR 1896CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1u4q n LEU 1897N -1.83 -0.03 -0.07 -4.42 4.77 -1.14 0.16 117.00 114.44 1u4q n LEU 1897Ca 0.00 1.67 0.12 0.00 -0.03 0.00 0.00 56.01 57.77 1u4q n LEU 1897Cb 0.00 -0.65 0.51 0.00 -2.33 0.00 0.00 43.42 40.95 1u4q n LEU 1897CO 0.00 -1.73 1.18 0.58 -1.33 0.00 0.00 177.39 176.10 1u4q h VAL 1898N 0.00 0.90 0.00 4.08 2.07 -1.46 -0.96 116.25 120.88 1u4q h VAL 1898Ca 0.64 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 68.03 1u4q h VAL 1898Cb 1.42 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1u4q h VAL 1898CO -0.90 0.07 0.00 0.00 0.02 0.00 0.00 177.57 176.76 1u4q n ALA 1899N -2.52 2.15 -3.45 1.67 0.00 0.42 -4.54 120.51 114.24 1u4q n ALA 1899Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.10 1u4q n ALA 1899Cb 0.36 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 1u4q n ALA 1899CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u4q s SER 1900N -1.11 6.16 -0.00 0.00 0.15 -0.37 -4.93 113.70 113.60 1u4q s SER 1900Ca 0.00 -2.46 -0.21 0.00 0.70 0.00 0.00 55.95 53.98 1u4q s SER 1900Cb 0.00 -2.10 -0.12 0.00 -1.71 0.00 0.00 66.02 62.09 1u4q s SER 1900CO 0.00 -0.59 0.94 -0.33 1.20 0.00 0.00 173.24 174.46 1u4q h GLU 1901N 7.90 -0.74 0.00 5.44 5.08 -1.87 -3.46 114.58 126.93 1u4q h GLU 1901Ca -0.04 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1u4q h GLU 1901Cb 1.04 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1u4q h GLU 1901CO 0.81 -0.49 0.00 -0.40 -1.00 0.00 0.00 179.01 177.92 1u4q n ASP 1902N -5.00 0.00 -1.04 1.42 5.68 -1.26 -4.78 116.55 111.56 1u4q n ASP 1902Ca -0.09 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.21 1u4q n ASP 1902Cb 0.30 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.51 1u4q n ASP 1902CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1u4q n TYR 1903N 0.00 1.06 0.00 2.11 4.02 -1.26 -5.06 117.16 118.03 1u4q n TYR 1903Ca 0.00 -1.26 0.00 0.00 -0.01 0.00 0.00 57.90 56.63 1u4q n TYR 1903Cb 0.00 -0.42 0.00 0.00 -0.02 0.00 0.00 39.34 38.90 1u4q n TYR 1903CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u4q n GLY 1904N -0.86 3.63 0.70 2.72 0.00 -1.26 -4.12 105.19 106.00 1u4q n GLY 1904Ca 0.28 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 1u4q n GLY 1904CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1u4q n ASP 1905N 6.00 -0.39 -3.97 1.61 5.68 -1.26 -5.13 116.55 119.10 1u4q n ASP 1905Ca 0.00 -1.41 -0.11 0.00 -0.50 0.00 0.00 54.79 52.77 1u4q n ASP 1905Cb 0.00 0.11 -0.12 0.00 -1.14 0.00 0.00 41.12 39.97 1u4q n ASP 1905CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1u4q s THR 1906N 0.00 0.19 0.44 2.12 -4.23 -1.26 -5.04 115.64 107.86 1u4q s THR 1906Ca 0.00 -0.65 0.14 0.00 -1.18 0.00 0.00 61.69 60.00 1u4q s THR 1906Cb 0.00 -0.27 0.33 0.00 1.34 0.00 0.00 72.50 73.90 1u4q s THR 1906CO -0.00 -0.30 1.98 0.25 -0.54 0.00 0.00 174.62 176.01 1u4q h LEU 1907N 5.12 0.34 -0.14 4.79 6.46 -2.00 -2.61 115.31 127.26 1u4q h LEU 1907Ca -0.30 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.49 1u4q h LEU 1907Cb 1.21 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 41.05 1u4q h LEU 1907CO 0.44 0.21 -0.00 0.00 -0.62 0.00 0.00 178.44 178.47 1u4q h ALA 1908N 1.70 0.12 0.00 1.25 0.00 -1.96 -2.25 119.26 118.13 1u4q h ALA 1908Ca 0.27 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1u4q h ALA 1908Cb 0.56 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1u4q h ALA 1908CO -0.07 -0.45 -0.05 0.00 0.00 0.00 0.00 179.25 178.67 1u4q h ALA 1909N 1.12 1.33 0.13 0.00 0.00 -1.77 -2.21 119.26 117.87 1u4q h ALA 1909Ca 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1u4q h ALA 1909Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1u4q h ALA 1909CO -0.11 0.07 -0.06 0.82 0.00 0.00 0.00 179.25 179.96 1u4q h ILE 1910N 0.00 0.00 -0.06 0.00 5.03 -1.39 -1.21 117.51 119.87 1u4q h ILE 1910Ca -0.00 -0.04 0.02 0.00 -0.12 0.00 0.00 64.86 64.72 1u4q h ILE 1910Cb 0.17 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 33.96 1u4q h ILE 1910CO 0.01 0.00 0.06 -0.61 -0.68 0.00 0.00 178.15 176.93 1u4q h GLN 1911N -0.21 0.00 -1.00 2.37 5.75 -1.59 1.07 115.11 121.50 1u4q h GLN 1911Ca -0.02 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 1u4q h GLN 1911Cb 0.13 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.62 1u4q h GLN 1911CO 0.03 0.00 0.66 0.78 -2.65 0.00 0.00 178.83 177.64 1u4q h GLY 1912N 0.00 1.47 0.00 2.39 0.00 -1.28 1.94 103.07 107.59 1u4q h GLY 1912Ca 0.03 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 1u4q h GLY 1912CO -0.00 0.42 -0.21 1.41 0.00 0.00 0.00 176.54 178.16 1u4q h LEU 1913N 1.27 0.00 -0.96 3.11 3.38 0.97 -3.00 115.31 120.08 1u4q h LEU 1913Ca 0.40 -0.81 0.16 0.00 0.09 0.00 0.00 57.88 57.72 1u4q h LEU 1913Cb 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.66 1u4q h LEU 1913CO -0.13 1.03 0.57 0.25 0.09 0.00 0.00 178.44 180.25 1u4q h LEU 1914N -1.00 0.76 -0.32 1.67 5.85 0.12 0.63 115.31 123.02 1u4q h LEU 1914Ca -0.06 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1u4q h LEU 1914Cb 0.95 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1u4q h LEU 1914CO -0.03 0.33 0.06 0.50 -0.34 0.00 0.00 178.44 178.96 1u4q h LYS 1915N 0.80 0.52 0.00 1.25 3.64 0.30 0.43 116.57 123.50 1u4q h LYS 1915Ca 0.52 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1u4q h LYS 1915Cb 0.71 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1u4q h LYS 1915CO -0.34 0.60 0.00 0.87 -2.27 0.00 0.00 179.45 178.31 1u4q h LYS 1916N 0.35 0.00 0.08 1.90 1.79 -0.51 -0.95 116.57 119.23 1u4q h LYS 1916Ca 0.10 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.25 1u4q h LYS 1916Cb 0.32 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.95 1u4q h LYS 1916CO 0.00 0.00 -1.72 1.25 -1.08 0.00 0.00 179.45 177.90 1u4q h HIS 1917N 0.00 0.31 -0.24 -1.35 2.76 0.14 -1.29 115.15 115.48 1u4q h HIS 1917Ca 0.00 -0.23 -0.08 0.00 -2.20 0.00 0.00 60.37 57.86 1u4q h HIS 1917Cb 0.30 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 1u4q h HIS 1917CO 0.00 1.38 -0.19 0.93 -1.30 0.00 0.00 177.93 178.75 1u4q h GLU 1918N 0.05 0.43 -0.21 5.26 4.39 0.33 0.21 114.58 125.05 1u4q h GLU 1918Ca -0.31 -0.14 -0.15 0.00 0.34 0.00 0.00 59.36 59.11 1u4q h GLU 1918Cb 2.02 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.63 1u4q h GLU 1918CO 0.11 0.61 -0.44 0.00 -1.16 0.00 0.00 179.01 178.14 1u4q h ALA 1919N 1.41 0.33 -0.04 3.43 0.00 -1.25 -2.81 119.26 120.33 1u4q h ALA 1919Ca 0.07 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1u4q h ALA 1919Cb 0.56 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1u4q h ALA 1919CO 0.04 0.47 0.01 0.35 0.00 0.00 0.00 179.25 180.11 1u4q h PHE 1920N 0.36 0.01 -0.97 0.00 3.57 -0.55 -2.59 116.94 116.77 1u4q h PHE 1920Ca 0.00 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.75 1u4q h PHE 1920Cb 1.04 -0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.66 1u4q h PHE 1920CO 0.09 0.01 0.54 0.93 -2.23 0.00 0.00 178.31 177.64 1u4q h GLU 1921N 0.03 0.51 0.19 1.11 4.39 -0.57 0.40 114.58 120.64 1u4q h GLU 1921Ca 0.02 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1u4q h GLU 1921Cb 0.01 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 1u4q h GLU 1921CO -0.02 0.34 -0.09 1.79 -1.16 0.00 0.00 179.01 179.86 1u4q h THR 1922N 0.52 0.92 -0.79 1.13 1.35 -1.21 -2.60 112.91 112.23 1u4q h THR 1922Ca 0.62 -0.70 0.16 0.00 -0.55 0.00 0.00 66.41 65.94 1u4q h THR 1922Cb 1.19 1.33 -0.10 0.00 -1.73 0.00 0.00 68.15 68.83 1u4q h THR 1922CO -0.49 0.16 0.31 0.44 -0.25 0.00 0.00 175.52 175.69 1u4q h ASP 1923N -0.61 0.27 -0.01 5.36 5.19 -0.88 0.99 116.42 126.73 1u4q h ASP 1923Ca -0.03 0.12 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 1u4q h ASP 1923Cb 0.45 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.06 1u4q h ASP 1923CO 0.04 0.08 -0.02 0.15 -3.12 0.00 0.00 179.24 176.37 1u4q h PHE 1924N 0.43 0.11 -0.06 4.55 3.57 -0.88 -0.06 116.94 124.59 1u4q h PHE 1924Ca 0.45 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.93 1u4q h PHE 1924Cb 0.72 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.43 1u4q h PHE 1924CO -0.17 0.14 -0.04 1.15 -2.23 0.00 0.00 178.31 177.16 1u4q h THR 1925N 0.11 1.34 -0.33 4.41 2.02 -0.42 0.58 112.91 120.62 1u4q h THR 1925Ca 0.03 -1.09 0.04 0.00 0.77 0.00 0.00 66.41 66.15 1u4q h THR 1925Cb 0.12 1.95 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 1u4q h THR 1925CO 0.00 0.30 0.12 0.58 0.37 0.00 0.00 175.52 176.89 1u4q h VAL 1926N -0.27 0.91 -0.04 3.16 2.07 -0.91 -2.71 116.25 118.45 1u4q h VAL 1926Ca 0.01 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1u4q h VAL 1926Cb 0.50 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1u4q h VAL 1926CO 0.01 0.05 0.01 0.45 0.02 0.00 0.00 177.57 178.11 1u4q h HIS 1927N 0.26 0.08 0.00 1.57 -0.00 -0.97 -2.32 115.15 113.77 1u4q h HIS 1927Ca 0.15 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.51 1u4q h HIS 1927Cb 0.12 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.50 1u4q h HIS 1927CO -0.14 0.29 0.00 0.36 -0.00 0.00 0.00 177.93 178.45 1u4q n LYS 1928N -4.92 0.07 0.00 2.45 2.85 0.19 -0.71 118.16 118.09 1u4q n LYS 1928Ca -0.07 0.27 -0.19 0.00 -1.05 0.00 0.00 58.31 57.27 1u4q n LYS 1928Cb 0.15 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 32.89 1u4q n LYS 1928CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1u4q h ASP 1929N 0.00 0.34 0.43 -5.58 1.82 -1.12 -3.05 116.42 109.26 1u4q h ASP 1929Ca 0.00 -0.75 -0.08 0.00 -0.39 0.00 0.00 57.03 55.81 1u4q h ASP 1929Cb 0.07 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 39.96 1u4q h ASP 1929CO 0.00 1.67 -0.36 0.03 -1.61 0.00 0.00 179.24 178.97 1u4q h ARG 1930N 0.06 0.00 -0.54 0.28 3.08 -0.39 -1.89 114.38 114.99 1u4q h ARG 1930Ca -0.39 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.55 1u4q h ARG 1930Cb 2.03 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 32.07 1u4q h ARG 1930CO 0.09 0.36 -0.09 0.28 -1.07 0.00 0.00 179.97 179.55 1u4q h VAL 1931N 0.00 1.27 -0.85 2.04 2.07 -1.15 -0.61 116.25 119.01 1u4q h VAL 1931Ca -0.00 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1u4q h VAL 1931Cb 0.67 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1u4q h VAL 1931CO 0.05 0.44 0.49 0.78 0.02 0.00 0.00 177.57 179.34 1u4q h ASN 1932N 0.88 1.05 -0.42 0.57 2.35 -1.24 -0.26 115.58 118.50 1u4q h ASN 1932Ca 0.14 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1u4q h ASN 1932Cb 0.65 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1u4q h ASN 1932CO 0.04 0.83 0.12 0.44 -1.65 0.00 0.00 177.43 177.21 1u4q h ASP 1933N 1.18 0.63 -1.00 5.81 3.32 -1.11 0.25 116.42 125.50 1u4q h ASP 1933Ca 0.30 -0.22 0.03 0.00 0.02 0.00 0.00 57.03 57.17 1u4q h ASP 1933Cb -0.00 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.32 1u4q h ASP 1933CO -0.05 0.68 0.66 0.58 -1.72 0.00 0.00 179.24 179.38 1u4q h VAL 1934N 0.55 1.19 -0.25 -1.35 2.07 -0.61 0.48 116.25 118.32 1u4q h VAL 1934Ca 0.14 -0.44 -0.20 0.00 0.82 0.00 0.00 66.70 67.02 1u4q h VAL 1934Cb 0.28 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 1u4q h VAL 1934CO -0.00 0.23 -0.61 0.00 0.02 0.00 0.00 177.57 177.21 1u4q h ALA 1936N 0.66 0.49 -0.21 0.00 0.00 0.37 0.86 119.26 121.43 1u4q h ALA 1936Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1u4q h ALA 1936Cb 1.23 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 1u4q h ALA 1936CO 0.13 -0.16 -0.08 -0.97 0.00 0.00 0.00 179.25 178.18 1u4q h ASN 1937N 0.41 -0.26 0.33 0.00 -0.00 0.12 -0.24 115.58 115.94 1u4q h ASN 1937Ca 0.17 0.07 -0.01 0.00 -0.00 0.00 0.00 56.30 56.53 1u4q h ASN 1937Cb 0.07 0.16 -0.00 0.00 -0.00 0.00 0.00 38.32 38.54 1u4q h ASN 1937CO -0.11 -0.10 -0.20 1.23 -0.00 0.00 0.00 177.43 178.25 1u4q h GLY 1938N -0.04 -0.52 -0.31 1.57 0.00 0.14 -2.28 103.07 101.63 1u4q h GLY 1938Ca 0.11 0.22 0.19 0.00 0.00 0.00 0.00 47.33 47.84 1u4q h GLY 1938CO -0.24 -0.20 0.11 0.83 0.00 0.00 0.00 176.54 177.05 1u4q h GLU 1939N -0.50 0.17 -0.94 4.80 4.39 0.12 0.22 114.58 122.83 1u4q h GLU 1939Ca -0.03 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.72 1u4q h GLU 1939Cb 0.41 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.96 1u4q h GLU 1939CO 0.04 0.11 0.60 0.22 -1.16 0.00 0.00 179.01 178.82 1u4q h ASP 1940N 0.17 0.94 -0.63 1.42 1.82 -0.67 0.20 116.42 119.68 1u4q h ASP 1940Ca 0.45 0.02 -0.06 0.00 -0.39 0.00 0.00 57.03 57.05 1u4q h ASP 1940Cb 0.83 -0.18 -0.03 0.00 0.68 0.00 0.00 39.33 40.63 1u4q h ASP 1940CO -0.62 0.59 0.18 -0.07 -1.61 0.00 0.00 179.24 177.71 1u4q h LEU 1941N 1.07 0.95 -0.68 2.28 3.38 -0.05 0.14 115.31 122.41 1u4q h LEU 1941Ca 0.41 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 1u4q h LEU 1941Cb 0.20 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1u4q h LEU 1941CO -0.18 0.90 0.23 0.40 0.09 0.00 0.00 178.44 179.88 1u4q h ILE 1942N 0.97 1.25 -0.13 1.22 1.08 -0.05 -2.30 117.51 119.55 1u4q h ILE 1942Ca 0.21 -0.85 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 1u4q h ILE 1942Cb 0.31 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1u4q h ILE 1942CO -0.00 0.33 0.08 0.50 -0.69 0.00 0.00 178.15 178.37 1u4q h LYS 1943N 0.99 0.17 -0.21 2.37 3.64 0.85 -2.08 116.57 122.30 1u4q h LYS 1943Ca 0.22 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1u4q h LYS 1943Cb 0.28 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1u4q h LYS 1943CO -0.01 0.14 0.00 1.63 -2.27 0.00 0.00 179.45 178.94 1u4q n LYS 1944N -4.98 0.92 -2.88 1.90 5.02 0.35 -4.91 118.16 113.58 1u4q n LYS 1944Ca -0.05 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.17 1u4q n LYS 1944Cb 0.04 -1.11 0.01 0.00 -0.02 0.00 0.00 35.03 33.95 1u4q n LYS 1944CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1u4q n ASN 1945N -0.37 -7.72 -4.85 4.39 5.03 -0.78 -5.00 115.26 105.96 1u4q n ASN 1945Ca 0.00 0.82 -0.34 0.00 0.87 0.00 0.00 54.58 55.93 1u4q n ASN 1945Cb 0.05 -4.85 -0.06 0.00 -1.02 0.00 0.00 39.78 33.90 1u4q n ASN 1945CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1u4q s ASN 1946N -2.05 6.10 0.31 6.41 3.84 -0.90 -5.00 114.94 123.64 1u4q s ASN 1946Ca 0.15 0.29 0.07 0.00 0.21 0.00 0.00 52.86 53.59 1u4q s ASN 1946Cb -0.04 -1.87 0.86 0.00 -0.55 0.00 0.00 41.25 39.65 1u4q s ASN 1946CO 0.74 0.30 1.65 -0.74 -2.79 0.00 0.00 177.10 176.26 1u4q h HIS 1947N 4.18 0.58 -1.26 0.43 -0.00 -1.92 -1.93 115.15 115.23 1u4q h HIS 1947Ca -0.50 0.05 -0.61 0.00 -0.00 0.00 0.00 60.37 59.30 1u4q h HIS 1947Cb 1.19 -0.11 -0.23 0.00 -0.00 0.00 0.00 27.41 28.26 1u4q h HIS 1947CO 0.67 -0.19 0.76 0.72 -0.00 0.00 0.00 177.93 179.89 1u4q n HIS 1948N -5.15 2.50 0.27 5.26 8.25 -1.26 -4.50 115.22 120.59 1u4q n HIS 1948Ca 0.25 -2.38 0.12 0.00 -0.26 0.00 0.00 57.72 55.46 1u4q n HIS 1948Cb 0.80 -1.27 0.76 0.00 1.12 0.00 0.00 29.99 31.40 1u4q n HIS 1948CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1u4q h VAL 1949N 1.56 0.70 0.73 1.59 2.07 -1.72 -1.76 116.25 119.43 1u4q h VAL 1949Ca 0.50 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.73 1u4q h VAL 1949Cb 0.54 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1u4q h VAL 1949CO 1.25 0.06 -0.35 -0.33 0.02 0.00 0.00 177.57 178.22 1u4q h GLU 1950N 0.00 -0.95 -0.37 1.57 4.39 -1.86 -2.77 114.58 114.58 1u4q h GLU 1950Ca -0.00 0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 1u4q h GLU 1950Cb 0.14 0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 1u4q h GLU 1950CO 0.01 -0.61 -0.14 -0.91 -1.16 0.00 0.00 179.01 176.20 1u4q h ASN 1951N -1.17 0.65 -0.25 1.42 2.35 -1.88 -2.89 115.58 113.81 1u4q h ASN 1951Ca -0.10 -0.19 0.05 0.00 -0.55 0.00 0.00 56.30 55.51 1u4q h ASN 1951Cb 0.78 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 38.92 1u4q h ASN 1951CO 0.17 0.81 -0.09 0.40 -1.65 0.00 0.00 177.43 177.07 1u4q h ILE 1952N 0.60 0.69 0.40 2.81 2.04 -1.36 0.70 117.51 123.38 1u4q h ILE 1952Ca 0.10 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.95 1u4q h ILE 1952Cb 0.58 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1u4q h ILE 1952CO 0.04 0.00 -0.49 0.74 0.00 0.00 0.00 178.15 178.43 1u4q h THR 1953N -0.04 0.00 0.00 -0.27 2.02 -1.36 -0.27 112.91 112.99 1u4q h THR 1953Ca 0.13 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.34 1u4q h THR 1953Cb 0.23 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.59 1u4q h THR 1953CO -0.28 0.00 -0.43 0.00 0.37 0.00 0.00 175.52 175.18 1u4q h ALA 1954N -0.86 -0.69 -0.91 6.16 0.00 -1.23 0.21 119.26 121.93 1u4q h ALA 1954Ca -0.05 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.00 1u4q h ALA 1954Cb 0.82 0.76 -0.07 0.00 0.00 0.00 0.00 17.79 19.29 1u4q h ALA 1954CO -0.11 -0.97 0.59 0.87 0.00 0.00 0.00 179.25 179.63 1u4q h LYS 1955N -0.58 0.54 -0.13 0.00 1.79 0.52 -0.46 116.57 118.25 1u4q h LYS 1955Ca 0.04 -0.03 -0.16 0.00 -2.18 0.00 0.00 60.65 58.32 1u4q h LYS 1955Cb 0.66 -0.12 0.01 0.00 -1.58 0.00 0.00 32.23 31.19 1u4q h LYS 1955CO -0.32 0.36 -0.53 0.52 -1.08 0.00 0.00 179.45 178.39 1u4q h MET 1956N 0.56 0.59 -0.49 3.15 2.86 -0.03 -2.08 114.93 119.49 1u4q h MET 1956Ca 0.48 -0.46 0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1u4q h MET 1956Cb 0.98 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.70 1u4q h MET 1956CO -0.22 1.08 0.33 -0.22 1.06 0.00 0.00 176.91 178.94 1u4q h LYS 1957N 0.23 0.58 -0.01 1.72 3.64 0.11 -1.74 116.57 121.09 1u4q h LYS 1957Ca -0.03 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1u4q h LYS 1957Cb 1.17 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1u4q h LYS 1957CO 0.11 0.38 -0.03 0.78 -2.27 0.00 0.00 179.45 178.42 1u4q h GLY 1958N 0.59 0.05 0.16 5.01 0.00 -1.05 -2.50 103.07 105.33 1u4q h GLY 1958Ca 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 1u4q h GLY 1958CO -0.05 0.05 -0.24 -2.00 0.00 0.00 0.00 176.54 174.31 1u4q h LEU 1959N -0.53 -0.68 -0.92 3.11 5.85 -1.07 -1.07 115.31 120.00 1u4q h LEU 1959Ca -0.00 0.06 0.26 0.00 0.84 0.00 0.00 57.88 59.04 1u4q h LEU 1959Cb 0.63 0.24 -0.15 0.00 0.37 0.00 0.00 40.66 41.74 1u4q h LEU 1959CO 0.01 -0.29 0.27 0.11 -0.34 0.00 0.00 178.44 178.20 1u4q h LYS 1960N -0.42 0.18 0.21 1.25 1.79 -1.45 0.11 116.57 118.24 1u4q h LYS 1960Ca -0.02 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1u4q h LYS 1960Cb 0.38 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 1u4q h LYS 1960CO -0.07 0.12 -0.22 0.78 -1.08 0.00 0.00 179.45 178.98 1u4q h GLY 1961N 0.19 -0.47 1.62 3.86 0.00 -0.94 -0.29 103.07 107.05 1u4q h GLY 1961Ca 0.60 0.25 0.04 0.00 0.00 0.00 0.00 47.33 48.22 1u4q h GLY 1961CO -0.69 -0.20 0.14 0.50 0.00 0.00 0.00 176.54 176.29 1u4q h LYS 1962N -0.46 0.00 -0.23 4.80 1.57 0.42 0.25 116.57 122.91 1u4q h LYS 1962Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1u4q h LYS 1962Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1u4q h LYS 1962CO -0.06 0.00 -0.54 0.28 -0.57 0.00 0.00 179.45 178.57 1u4q h VAL 1963N 0.00 1.30 0.01 0.50 2.07 0.58 -1.05 116.25 119.65 1u4q h VAL 1963Ca 0.07 -1.76 -0.00 0.00 0.82 0.00 0.00 66.70 65.84 1u4q h VAL 1963Cb 0.36 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1u4q h VAL 1963CO -0.00 0.56 -0.01 0.28 0.02 0.00 0.00 177.57 178.42 1u4q h SER 1964N 0.53 -0.01 -0.69 0.57 0.02 0.80 0.01 113.55 114.78 1u4q h SER 1964Ca 0.01 -0.37 0.13 0.00 -0.84 0.00 0.00 61.79 60.72 1u4q h SER 1964Cb 1.11 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.56 1u4q h SER 1964CO 0.11 0.36 0.24 0.44 -1.14 0.00 0.00 176.83 176.84 1u4q h ASP 1965N -0.39 0.19 -0.63 3.07 3.32 -0.72 0.56 116.42 121.81 1u4q h ASP 1965Ca -0.00 0.11 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1u4q h ASP 1965Cb 0.38 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1u4q h ASP 1965CO 0.00 0.08 0.07 0.25 -1.72 0.00 0.00 179.24 177.92 1u4q h LEU 1966N 0.39 1.04 -2.08 1.55 6.46 -1.07 -1.66 115.31 119.94 1u4q h LEU 1966Ca 0.37 -0.26 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 1u4q h LEU 1966Cb 0.55 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1u4q h LEU 1966CO -0.39 1.05 -0.05 -0.33 -0.62 0.00 0.00 178.44 178.10 1u4q h GLU 1967N 1.00 0.00 0.05 1.25 4.39 0.17 0.53 114.58 121.97 1u4q h GLU 1967Ca 0.19 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.74 1u4q h GLU 1967Cb 0.48 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1u4q h GLU 1967CO 0.02 0.05 -0.64 -0.22 -1.16 0.00 0.00 179.01 177.07 1u4q h LYS 1968N 0.00 0.34 0.08 2.33 3.64 0.78 -3.28 116.57 120.45 1u4q h LYS 1968Ca -0.00 -0.44 -0.25 0.00 -1.27 0.00 0.00 60.65 58.69 1u4q h LYS 1968Cb 0.11 0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1u4q h LYS 1968CO 0.01 1.14 -1.11 0.00 -2.27 0.00 0.00 179.45 177.21 1u4q h ALA 1969N 0.22 0.21 -0.06 5.00 0.00 -1.12 -3.22 119.26 120.29 1u4q h ALA 1969Ca -0.09 -0.80 -0.01 0.00 0.00 0.00 0.00 54.91 54.01 1u4q h ALA 1969Cb 1.40 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1u4q h ALA 1969CO 0.12 0.88 -0.00 0.00 0.00 0.00 0.00 179.25 180.25 1u4q h ALA 1970N 0.63 1.89 0.06 0.00 0.00 -1.05 -2.47 119.26 118.32 1u4q h ALA 1970Ca -0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1u4q h ALA 1970Cb 1.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1u4q h ALA 1970CO 0.19 0.09 -0.03 0.00 0.00 0.00 0.00 179.25 179.50 1u4q h ALA 1971N 1.92 -0.08 -0.14 0.00 0.00 -1.61 -2.92 119.26 116.43 1u4q h ALA 1971Ca 0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1u4q h ALA 1971Cb 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1u4q h ALA 1971CO 0.00 -0.21 -0.07 -0.56 0.00 0.00 0.00 179.25 178.41 1u4q h GLN 1972N -0.74 0.20 0.17 0.00 3.07 -1.54 0.65 115.11 116.92 1u4q h GLN 1972Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.69 1u4q h GLN 1972Cb 0.61 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.14 1u4q h GLN 1972CO 0.01 0.28 -0.08 -0.09 0.09 0.00 0.00 178.83 179.04 1u4q h ARG 1973N 0.20 -0.22 -0.99 0.06 9.65 -1.53 -1.98 114.38 119.56 1u4q h ARG 1973Ca 0.04 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 59.02 1u4q h ARG 1973Cb 0.25 0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.81 1u4q h ARG 1973CO 0.01 0.03 0.63 -0.22 2.80 0.00 0.00 179.97 183.23 1u4q h LYS 1974N -0.46 1.09 -0.46 0.20 1.63 -1.19 -0.20 116.57 117.19 1u4q h LYS 1974Ca -0.02 -0.07 0.13 0.00 -0.85 0.00 0.00 60.65 59.84 1u4q h LYS 1974Cb 0.35 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 1u4q h LYS 1974CO 0.04 0.72 0.50 0.00 -3.45 0.00 0.00 179.45 177.26 1u4q h ALA 1975N 1.47 2.18 0.00 5.00 0.00 0.10 0.29 119.26 128.30 1u4q h ALA 1975Ca 0.44 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 54.97 1u4q h ALA 1975Cb 0.23 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1u4q h ALA 1975CO -0.19 -0.74 -2.39 1.63 0.00 0.00 0.00 179.25 177.56 1u4q n LYS 1976N -3.67 0.71 0.10 0.00 5.02 -0.22 -4.48 118.16 115.63 1u4q n LYS 1976Ca 0.08 0.05 -0.03 0.00 -2.02 0.00 0.00 58.31 56.39 1u4q n LYS 1976Cb 0.69 -1.51 0.16 0.00 -0.02 0.00 0.00 35.03 34.35 1u4q n LYS 1976CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1u4q h LEU 1977N 0.00 0.19 -3.26 -0.35 3.38 0.26 -3.14 115.31 112.39 1u4q h LEU 1977Ca -0.55 -0.10 -0.19 0.00 0.09 0.00 0.00 57.88 57.13 1u4q h LEU 1977Cb 2.10 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 42.72 1u4q h LEU 1977CO -0.01 0.72 0.24 -0.90 0.09 0.00 0.00 178.44 178.58 1u4q n ASP 1978N -3.88 5.94 -0.71 -0.43 5.75 0.86 -4.90 116.55 119.18 1u4q n ASP 1978Ca -0.02 -2.78 0.09 0.00 -0.01 0.00 0.00 54.79 52.07 1u4q n ASP 1978Cb 0.59 -1.08 0.07 0.00 -1.03 0.00 0.00 41.12 39.68 1u4q n ASP 1978CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30