Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hww_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N THR 181.A OG1 no hydrogen 2.835 N/A ALA 5.A N SER 2.A OG no hydrogen 3.324 N/A PHE 6.A N SER 2.A O no hydrogen 3.058 N/A ASN 7.A N VAL 3.A O no hydrogen 2.853 N/A ASN 7.A ND2 ALA 171.A O no hydrogen 2.711 N/A ARG 8.A N SER 4.A O no hydrogen 3.129 N/A ARG 9.A N PHE 6.A O no hydrogen 2.954 N/A ARG 9.A NE THR 181.A O no hydrogen 2.993 N/A ARG 9.A NH2 ASP 179.A O no hydrogen 2.755 N/A ARG 9.A NH2 THR 181.A O no hydrogen 2.701 N/A TRP 10.A N PHE 6.A O no hydrogen 2.998 N/A ALA 11.A N ASN 7.A O no hydrogen 3.036 N/A ALA 12.A N ARG 8.A O no hydrogen 2.988 N/A VAL 13.A N ARG 9.A O no hydrogen 3.117 N/A VAL 13.A N TRP 10.A O no hydrogen 3.089 N/A ILE 14.A N TRP 10.A O no hydrogen 3.119 N/A LEU 15.A N ALA 11.A O no hydrogen 2.966 N/A GLU 16.A N ALA 12.A O no hydrogen 2.839 N/A ALA 17.A N VAL 13.A O no hydrogen 2.993 N/A LEU 18.A N ILE 14.A O no hydrogen 3.366 N/A THR 19.A N LEU 15.A O no hydrogen 3.426 N/A ARG 20.A N ALA 17.A O no hydrogen 3.153 N/A ARG 20.A NE GLU 16.A OE2 no hydrogen 2.997 N/A ARG 20.A NH1 TRP 192.A O no hydrogen 2.968 N/A ARG 20.A NH1 LYS 197.A O no hydrogen 3.057 N/A ARG 20.A NH2 GLU 16.A OE2 no hydrogen 2.802 N/A ARG 20.A NH2 TRP 192.A O no hydrogen 2.810 N/A HIS 21.A N LEU 18.A O no hydrogen 2.897 N/A HIS 21.A NE2 ASP 153.A OD1 no hydrogen 2.577 N/A VAL 23.A N LEU 18.A O no hydrogen 3.431 N/A HIS 25.A ND1 HIS 50.A NE2 no hydrogen 2.928 N/A ILE 26.A N ILE 48.A O no hydrogen 2.837 N/A CYS 27.A N ALA 74.A O no hydrogen 2.866 N/A ILE 28.A N HIS 50.A O no hydrogen 2.904 N/A ARG 33.A N GLY 31.A O no hydrogen 2.873 N/A ARG 33.A NH2 PHE 170.A O no hydrogen 3.093 N/A ARG 33.A NH2 GLU 172.A OE1 no hydrogen 2.680 N/A SER 34.A N GLY 31.A O no hydrogen 3.242 N/A SER 34.A OG GLY 31.A O no hydrogen 3.330 N/A LEU 37.A N SER 34.A O no hydrogen 2.525 N/A THR 38.A N SER 34.A O no hydrogen 3.063 N/A LEU 39.A N THR 35.A O no hydrogen 2.667 N/A ALA 40.A N LEU 36.A O no hydrogen 2.871 N/A ALA 41.A N LEU 37.A O no hydrogen 2.854 N/A ALA 42.A N THR 38.A O no hydrogen 2.987 N/A GLU 43.A N LEU 39.A O no hydrogen 3.201 N/A ASN 44.A ND2 GLU 16.A OE1 no hydrogen 3.178 N/A ALA 46.A N ASN 44.A OD1 no hydrogen 3.312 N/A PHE 47.A N ASN 44.A O no hydrogen 3.423 N/A ILE 48.A N ARG 24.A O no hydrogen 2.983 N/A HIS 50.A N ILE 26.A O no hydrogen 2.923 N/A HIS 50.A NE2 HIS 25.A ND1 no hydrogen 2.928 N/A GLY 57.A N ASP 54.A OD1 no hydrogen 3.263 N/A LEU 58.A N ASP 54.A O no hydrogen 2.899 N/A GLY 59.A N GLU 55.A O no hydrogen 2.912 N/A HIS 60.A N ARG 56.A O no hydrogen 3.322 N/A HIS 60.A ND1 ARG 56.A O no hydrogen 3.100 N/A LEU 61.A N GLY 57.A O no hydrogen 2.704 N/A ALA 62.A N LEU 58.A O no hydrogen 2.838 N/A LEU 63.A N GLY 59.A O no hydrogen 2.855 N/A GLY 64.A N HIS 60.A O no hydrogen 2.879 N/A LEU 65.A N LEU 61.A O no hydrogen 3.023 N/A ALA 66.A N ALA 62.A O no hydrogen 2.894 N/A LYS 67.A N LEU 63.A O no hydrogen 2.911 N/A LYS 67.A NZ GLU 98.A OE2 no hydrogen 2.936 N/A LYS 67.A NZ SER 411.A O no hydrogen 2.617 N/A LYS 67.A NZ ASN 412.A OD1 no hydrogen 2.714 N/A VAL 68.A N GLY 64.A O no hydrogen 3.115 N/A SER 69.A N LEU 65.A O no hydrogen 2.968 N/A SER 69.A OG LEU 65.A O no hydrogen 2.790 N/A SER 69.A OG GLN 71.A OE1 no hydrogen 3.101 N/A LYS 70.A N ALA 66.A O no hydrogen 2.712 N/A LYS 70.A NZ LYS 67.A O no hydrogen 3.337 N/A VAL 73.A N LYS 99.A O no hydrogen 2.975 N/A ALA 74.A N HIS 25.A O no hydrogen 3.288 N/A VAL 75.A N ILE 101.A O no hydrogen 2.835 N/A ILE 76.A N CYS 27.A O no hydrogen 2.810 N/A VAL 77.A N LEU 103.A O no hydrogen 3.142 N/A SER 79.A OG GLN 118.A O no hydrogen 2.917 N/A GLY 80.A N GLN 122.A OE1 no hydrogen 2.882 N/A VAL 83.A N GLY 80.A O no hydrogen 2.745 N/A ASN 85.A N THR 81.A O no hydrogen 3.201 N/A ASN 85.A ND2 THR 81.A O no hydrogen 2.975 N/A LEU 86.A N VAL 83.A O no hydrogen 2.982 N/A TYR 87.A N ALA 84.A O no hydrogen 3.022 N/A LEU 90.A N LEU 86.A O no hydrogen 2.973 N/A ILE 91.A N TYR 87.A O no hydrogen 2.766 N/A GLU 92.A N PRO 88.A O no hydrogen 2.995 N/A ALA 93.A N ALA 89.A O no hydrogen 3.001 N/A GLY 94.A N LEU 90.A O no hydrogen 3.132 N/A LEU 95.A N ILE 91.A O no hydrogen 3.228 N/A LEU 95.A N GLU 92.A O no hydrogen 2.915 N/A THR 96.A N GLU 92.A O no hydrogen 2.908 N/A THR 96.A OG1 GLU 92.A O no hydrogen 3.151 N/A THR 96.A OG1 GLU 98.A OE1 no hydrogen 2.463 N/A THR 96.A OG1 GLU 98.A OE2 no hydrogen 3.523 N/A GLY 97.A N ALA 93.A O no hydrogen 2.617 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.602 N/A LYS 99.A NZ LEU 159.A O no hydrogen 3.238 N/A ILE 101.A N VAL 73.A O no hydrogen 2.772 N/A LEU 102.A N VAL 164.A O no hydrogen 2.940 N/A LEU 103.A N VAL 75.A O no hydrogen 2.635 N/A THR 104.A N ILE 166.A O no hydrogen 2.993 N/A THR 104.A OG1 HIS 165.A NE2 no hydrogen 2.750 N/A THR 104.A OG1 ASN 167.A OD1 no hydrogen 2.898 N/A ALA 105.A N VAL 77.A O no hydrogen 3.019 N/A ASP 106.A N CYS 168.A O no hydrogen 2.969 N/A ARG 107.A NE ASN 117.A O no hydrogen 2.865 N/A ARG 107.A NH1 GLU 172.A OE1 no hydrogen 2.785 N/A ARG 107.A NH2 ASN 117.A O no hydrogen 3.094 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.719 N/A LEU 111.A N PRO 108.A O no hydrogen 2.878 N/A ILE 112.A N PRO 109.A O no hydrogen 3.249 N/A CYS 114.A SG GLU 110.A O no hydrogen 3.762 N/A CYS 114.A SG ILE 112.A O no hydrogen 3.946 N/A GLN 118.A NE2 THR 78.A OG1 no hydrogen 3.276 N/A GLN 118.A NE2 SER 79.A O no hydrogen 3.350 N/A ARG 121.A NH2 ASP 113.A OD1 no hydrogen 2.858 N/A GLN 122.A NE2 ALA 105.A O no hydrogen 2.896 N/A GLN 122.A NE2 ASN 167.A OD1 no hydrogen 2.771 N/A MET 125.A N GLN 122.A O no hydrogen 3.018 N/A ALA 127.A N GLY 124.A O no hydrogen 2.941 N/A HIS 129.A N PHE 126.A O no hydrogen 3.005 N/A THR 131.A N GLY 163.A O no hydrogen 2.782 N/A THR 131.A OG1 ALA 161.A O no hydrogen 2.497 N/A HIS 132.A N GLY 163.A O no hydrogen 3.469 N/A ILE 134.A N HIS 165.A O no hydrogen 2.821 N/A LEU 136.A N ASN 167.A O no hydrogen 2.885 N/A ARG 138.A NE GLU 110.A OE1 no hydrogen 2.926 N/A ARG 138.A NH2 GLU 110.A OE2 no hydrogen 3.107 N/A ASP 142.A N THR 140.A OG1 no hydrogen 3.038 N/A ILE 143.A N THR 140.A O no hydrogen 3.258 N/A ARG 146.A NH2 ARG 188.A O no hydrogen 3.182 N/A TRP 147.A N PRO 144.A O no hydrogen 2.838 N/A LEU 148.A N PRO 144.A O no hydrogen 3.410 N/A VAL 149.A N ALA 145.A O no hydrogen 2.910 N/A SER 150.A N ARG 146.A O no hydrogen 2.922 N/A SER 150.A OG ARG 146.A O no hydrogen 2.691 N/A THR 151.A N TRP 147.A O no hydrogen 2.815 N/A THR 151.A OG1 TRP 147.A O no hydrogen 3.054 N/A ILE 152.A N LEU 148.A O no hydrogen 3.318 N/A ASP 153.A N VAL 149.A O no hydrogen 2.863 N/A HIS 154.A N SER 150.A O no hydrogen 2.802 N/A HIS 154.A ND1 GLU 202.A OE1 no hydrogen 2.818 N/A ALA 155.A N THR 151.A O no hydrogen 3.251 N/A LEU 156.A N ILE 152.A O no hydrogen 3.028 N/A GLY 157.A N ASP 153.A O no hydrogen 2.887 N/A THR 158.A N HIS 154.A O no hydrogen 3.109 N/A THR 158.A OG1 HIS 132.A NE2 no hydrogen 2.963 N/A THR 158.A OG1 HIS 154.A O no hydrogen 2.755 N/A LEU 159.A N LEU 156.A O no hydrogen 3.363 N/A HIS 160.A NE2 ASP 311.A O no hydrogen 2.530 N/A GLY 162.A N GLY 97.A O no hydrogen 3.250 N/A VAL 164.A N LEU 100.A O no hydrogen 2.839 N/A HIS 165.A N HIS 132.A O no hydrogen 2.981 N/A HIS 165.A NE2 THR 104.A OG1 no hydrogen 2.750 N/A ILE 166.A N LEU 102.A O no hydrogen 2.730 N/A ASN 167.A N ILE 134.A O no hydrogen 2.908 N/A ASN 167.A ND2 ASP 106.A OD2 no hydrogen 2.904 N/A CYS 168.A N THR 104.A O no hydrogen 2.764 N/A CYS 168.A SG ILE 166.A O no hydrogen 3.497 N/A PHE 170.A N ASP 106.A O no hydrogen 3.289 N/A THR 181.A N ASP 179.A OD2 no hydrogen 3.186 N/A THR 181.A OG1 ASP 179.A OD1 no hydrogen 3.355 N/A THR 181.A OG1 ASP 179.A OD2 no hydrogen 2.613 N/A LEU 183.A N ASP 180.A O no hydrogen 2.816 N/A TRP 185.A NE1 ILE 143.A O no hydrogen 2.624 N/A GLN 186.A N GLY 182.A O no hydrogen 3.066 N/A GLN 186.A NE2 ARG 9.A O no hydrogen 3.357 N/A GLN 187.A N LEU 183.A O no hydrogen 3.168 N/A LEU 189.A N GLN 186.A O no hydrogen 3.004 N/A GLY 190.A N GLN 187.A O no hydrogen 3.019 N/A TRP 193.A N GLY 190.A O no hydrogen 3.351 N/A TRP 193.A NE1 GLN 186.A O no hydrogen 2.938 N/A GLN 194.A N ASP 191.A O no hydrogen 3.037 N/A ASP 195.A N TRP 192.A O no hydrogen 2.966 N/A TRP 199.A N ASP 153.A OD2 no hydrogen 2.916 N/A LEU 200.A N ASP 153.A OD2 no hydrogen 2.992 N/A SER 208.A N ILE 327.A O no hydrogen 2.911 N/A GLN 211.A N HIS 337.A NE2 no hydrogen 2.996 N/A GLN 211.A NE2 GLU 209.A O no hydrogen 2.732 N/A TRP 214.A N GLN 211.A O no hydrogen 3.102 N/A TRP 214.A NE1 PRO 338.A O no hydrogen 2.986 N/A PHE 216.A N ASP 213.A O no hydrogen 3.209 N/A TRP 217.A N ASP 213.A O no hydrogen 3.171 N/A ARG 218.A N TRP 214.A O no hydrogen 2.808 N/A ARG 218.A NH2 PRO 338.A O no hydrogen 3.092 N/A GLN 219.A N PHE 216.A O no hydrogen 2.943 N/A LYS 220.A N TRP 217.A O no hydrogen 2.970 N/A ARG 221.A N GLN 280.A OE1 no hydrogen 2.543 N/A ARG 221.A NE GLN 278.A O no hydrogen 2.843 N/A ARG 221.A NH2 GLN 278.A O no hydrogen 3.273 N/A VAL 223.A N ILE 281.A O no hydrogen 3.112 N/A VAL 224.A N PRO 247.A O no hydrogen 3.103 N/A VAL 225.A N VAL 283.A O no hydrogen 3.068 N/A ALA 226.A N ILE 249.A O no hydrogen 2.825 N/A GLY 227.A N LEU 285.A O no hydrogen 2.763 N/A ARG 228.A N SER 287.A O no hydrogen 3.116 N/A SER 230.A N GLU 233.A OE1 no hydrogen 2.749 N/A GLU 233.A N SER 230.A OG no hydrogen 3.105 N/A GLY 234.A N SER 230.A O no hydrogen 2.955 N/A LYS 235.A NZ GLU 232.A OE2 no hydrogen 2.710 N/A LYS 236.A N GLU 232.A O no hydrogen 3.262 N/A VAL 237.A N GLU 233.A O no hydrogen 2.719 N/A ALA 238.A N GLY 234.A O no hydrogen 2.915 N/A LEU 239.A N LYS 235.A O no hydrogen 2.960 N/A TRP 240.A N LYS 236.A O no hydrogen 2.988 N/A TRP 240.A NE1 HIS 337.A O no hydrogen 2.616 N/A ALA 241.A N VAL 237.A O no hydrogen 2.937 N/A GLN 242.A N ALA 238.A O no hydrogen 3.171 N/A THR 243.A N LEU 239.A O no hydrogen 2.886 N/A THR 243.A OG1 LEU 239.A O no hydrogen 2.681 N/A LEU 244.A N TRP 240.A O no hydrogen 2.929 N/A GLY 245.A N GLN 242.A O no hydrogen 2.972 N/A TRP 246.A N ALA 241.A O no hydrogen 3.055 N/A ILE 249.A N VAL 224.A O no hydrogen 2.906 N/A ASP 251.A N ALA 226.A O no hydrogen 3.025 N/A VAL 252.A N ASP 398.A OD1 no hydrogen 3.057 N/A LEU 253.A N ASP 251.A OD2 no hydrogen 2.941 N/A SER 254.A N ASP 251.A O no hydrogen 3.088 N/A SER 254.A OG ASP 251.A O no hydrogen 2.782 N/A SER 254.A OG THR 256.A OG1 no hydrogen 2.912 N/A GLN 255.A NE2 MET 229.A O no hydrogen 2.716 N/A THR 256.A OG1 SER 254.A OG no hydrogen 2.912 N/A GLN 258.A N THR 256.A OG1 no hydrogen 3.356 N/A GLN 258.A NE2 GLY 250.A O no hydrogen 3.087 N/A CYS 262.A SG ALA 399.A O no hydrogen 3.644 N/A LEU 265.A N CYS 262.A O no hydrogen 2.833 N/A TRP 266.A N CYS 262.A O no hydrogen 2.886 N/A TRP 266.A NE1 LEU 260.A O no hydrogen 2.908 N/A LEU 267.A N ALA 263.A O no hydrogen 2.903 N/A GLY 268.A N LEU 265.A O no hydrogen 2.863 N/A ASN 269.A N TRP 266.A O no hydrogen 3.163 N/A ASN 269.A ND2 VAL 536.A O no hydrogen 2.985 N/A LYS 271.A N ASN 269.A OD1 no hydrogen 2.769 N/A LYS 271.A NZ LEU 539.A O no hydrogen 3.096 N/A THR 273.A N ASN 269.A O no hydrogen 2.887 N/A THR 273.A OG1 ASN 269.A O no hydrogen 2.713 N/A SER 274.A N ALA 270.A O no hydrogen 3.035 N/A SER 274.A OG ALA 270.A O no hydrogen 3.058 N/A GLU 275.A N LYS 271.A O no hydrogen 3.142 N/A LEU 276.A N ALA 272.A O no hydrogen 3.159 N/A GLN 277.A N THR 273.A O no hydrogen 3.103 N/A GLN 278.A N GLU 275.A O no hydrogen 2.926 N/A ALA 279.A N LEU 276.A O no hydrogen 2.827 N/A GLN 280.A N ARG 221.A O no hydrogen 2.633 N/A ILE 281.A N ARG 221.A O no hydrogen 3.385 N/A VAL 282.A N GLU 305.A O no hydrogen 2.988 N/A VAL 283.A N VAL 223.A O no hydrogen 2.830 N/A GLN 284.A N TRP 307.A O no hydrogen 2.640 N/A GLN 284.A NE2 TYR 306.A OH no hydrogen 2.666 N/A LEU 285.A N VAL 225.A O no hydrogen 2.768 N/A GLY 286.A N VAL 309.A O no hydrogen 2.871 N/A SER 287.A OG ASP 310.A OD2 no hydrogen 2.721 N/A SER 288.A OG ARG 413.A O no hydrogen 3.291 N/A THR 290.A N ASP 251.A OD1 no hydrogen 2.706 N/A THR 290.A OG1 ASP 251.A OD1 no hydrogen 3.132 N/A THR 290.A OG1 ASP 251.A OD2 no hydrogen 2.616 N/A ARG 293.A N ASP 264.A OD1 no hydrogen 2.804 N/A ARG 293.A NH1 ASP 264.A O no hydrogen 3.228 N/A LEU 295.A N GLY 291.A O no hydrogen 2.730 N/A GLN 296.A N LYS 292.A O no hydrogen 2.855 N/A TRP 297.A N ARG 293.A O no hydrogen 2.866 N/A GLN 298.A N LEU 294.A O no hydrogen 2.806 N/A ALA 299.A N LEU 295.A O no hydrogen 3.126 N/A SER 300.A N TRP 297.A O no hydrogen 2.937 N/A SER 300.A OG GLN 296.A O no hydrogen 3.411 N/A SER 300.A OG TRP 297.A O no hydrogen 3.051 N/A CYS 301.A N TRP 297.A O no hydrogen 2.847 N/A CYS 301.A SG GLN 298.A O no hydrogen 3.173 N/A CYS 301.A SG HIS 321.A NE2 no hydrogen 3.609 N/A GLU 305.A N GLN 280.A O no hydrogen 3.328 N/A TYR 306.A N ARG 322.A O no hydrogen 3.276 N/A TRP 307.A N VAL 282.A O no hydrogen 2.760 N/A TRP 307.A NE1 GLU 305.A OE1 no hydrogen 2.721 N/A ILE 308.A N ARG 324.A O no hydrogen 2.925 N/A VAL 309.A N GLN 284.A O no hydrogen 2.770 N/A ASP 310.A N LEU 326.A O no hydrogen 3.058 N/A ALA 319.A N ASP 317.A OD1 no hydrogen 2.962 N/A HIS 320.A N ASP 317.A O no hydrogen 3.009 N/A HIS 321.A N ASP 317.A OD2 no hydrogen 3.082 N/A HIS 321.A ND1 ASP 317.A OD2 no hydrogen 2.687 N/A HIS 321.A NE2 CYS 301.A O no hydrogen 2.891 N/A ARG 324.A N TYR 306.A O no hydrogen 2.854 N/A ARG 324.A NE GLU 305.A OE1 no hydrogen 2.936 N/A ARG 324.A NH1 ASP 213.A OD2 no hydrogen 2.575 N/A ARG 324.A NH1 GLU 305.A OE1 no hydrogen 3.063 N/A ARG 324.A NH1 GLU 305.A OE2 no hydrogen 3.284 N/A ARG 324.A NH2 GLN 211.A OE1 no hydrogen 3.010 N/A ARG 324.A NH2 ASP 213.A OD1 no hydrogen 2.714 N/A ARG 324.A NH2 ASP 213.A OD2 no hydrogen 3.155 N/A ARG 325.A NE ILE 308.A O no hydrogen 2.925 N/A ARG 325.A NH1 ILE 308.A O no hydrogen 3.521 N/A ARG 325.A NH1 ASP 310.A O no hydrogen 2.896 N/A ARG 325.A NH1 ILE 312.A O no hydrogen 3.123 N/A ARG 325.A NH2 ILE 312.A O no hydrogen 2.686 N/A ARG 325.A NH2 GLY 314.A O no hydrogen 2.616 N/A LEU 326.A N ILE 308.A O no hydrogen 2.743 N/A ILE 327.A N SER 208.A OG no hydrogen 2.941 N/A ALA 328.A N ASP 310.A O no hydrogen 2.976 N/A ASP 332.A N ASN 329.A OD1 no hydrogen 2.855 N/A TRP 333.A N ASN 329.A O no hydrogen 2.864 N/A LEU 334.A N ILE 330.A O no hydrogen 2.988 N/A GLU 335.A N ALA 331.A O no hydrogen 3.192 N/A LEU 336.A N ASP 332.A O no hydrogen 2.864 N/A HIS 337.A N LEU 334.A O no hydrogen 3.309 N/A HIS 337.A ND1 TRP 333.A O no hydrogen 2.866 N/A ARG 342.A N THR 243.A O no hydrogen 3.161 N/A TRP 345.A N GLY 245.A O no hydrogen 3.389 N/A TRP 345.A NE1 GLY 222.A O no hydrogen 2.837 N/A CYS 346.A SG GLU 275.A OE1 no hydrogen 3.314 N/A VAL 347.A N GLU 275.A OE2 no hydrogen 3.075 N/A GLU 348.A N GLU 275.A OE2 no hydrogen 2.801 N/A ILE 349.A N GLU 275.A OE1 no hydrogen 2.955 N/A LEU 352.A N GLU 348.A O no hydrogen 3.146 N/A ALA 353.A N ILE 349.A O no hydrogen 3.015 N/A GLN 355.A N ARG 351.A O no hydrogen 3.028 N/A ALA 356.A N LEU 352.A O no hydrogen 2.871 N/A MET 357.A N ALA 353.A O no hydrogen 3.006 N/A GLN 358.A N GLU 354.A O no hydrogen 2.905 N/A ALA 359.A N GLN 355.A O no hydrogen 2.949 N/A VAL 360.A N ALA 356.A O no hydrogen 3.211 N/A ILE 361.A N MET 357.A O no hydrogen 2.993 N/A ALA 362.A N GLN 358.A O no hydrogen 2.949 N/A ARG 363.A N VAL 360.A O no hydrogen 2.883 N/A ARG 363.A NH1 GLN 531.A OE1 no hydrogen 3.141 N/A ARG 363.A NH2 GLN 531.A OE1 no hydrogen 2.373 N/A ARG 364.A N ILE 361.A O no hydrogen 3.186 N/A GLY 368.A N ALA 366.A O no hydrogen 2.755 N/A GLN 371.A NE2 ARG 363.A O no hydrogen 3.185 N/A LEU 372.A N GLY 368.A O no hydrogen 2.937 N/A ALA 373.A N GLU 369.A O no hydrogen 2.923 N/A HIS 374.A N ALA 370.A O no hydrogen 2.858 N/A HIS 374.A ND1 LEU 400.A O no hydrogen 3.026 N/A ARG 375.A N GLN 371.A O no hydrogen 3.087 N/A ARG 375.A NE ARG 364.A O no hydrogen 2.947 N/A CYS 377.A SG GLN 402.A O no hydrogen 3.779 N/A ASP 378.A N ARG 375.A O no hydrogen 2.818 N/A TYR 379.A N ILE 376.A O no hydrogen 2.849 N/A GLY 384.A N PRO 381.A O no hydrogen 3.004 N/A GLN 385.A N PRO 435.A O no hydrogen 3.143 N/A GLN 385.A NE2 VAL 428.A O no hydrogen 3.404 N/A GLN 385.A NE2 THR 436.A OG1 no hydrogen 3.135 N/A LEU 386.A N PRO 408.A O no hydrogen 2.790 N/A PHE 387.A N LEU 437.A O no hydrogen 2.794 N/A VAL 388.A N TYR 410.A O no hydrogen 3.053 N/A GLY 389.A N ILE 439.A O no hydrogen 2.755 N/A ASN 390.A ND2 ASN 412.A O no hydrogen 3.071 N/A ASN 390.A ND2 GLY 417.A O no hydrogen 2.688 N/A ARG 395.A N SER 391.A O no hydrogen 3.520 N/A LEU 396.A N LEU 392.A O no hydrogen 2.752 N/A ILE 397.A N VAL 393.A O no hydrogen 3.032 N/A ASP 398.A N VAL 394.A O no hydrogen 3.006 N/A ALA 399.A N ARG 395.A O no hydrogen 2.827 N/A LEU 400.A N LEU 396.A O no hydrogen 2.760 N/A SER 401.A N ILE 397.A O no hydrogen 2.975 N/A SER 401.A OG ALA 373.A O no hydrogen 3.473 N/A SER 401.A OG HIS 374.A O no hydrogen 3.358 N/A GLN 402.A NE2 GLY 257.A O no hydrogen 3.588 N/A GLN 402.A NE2 GLN 258.A O no hydrogen 2.951 N/A LEU 403.A N GLN 258.A OE1 no hydrogen 3.015 N/A GLY 406.A N GLN 255.A O no hydrogen 2.916 N/A TYR 407.A N PRO 404.A O no hydrogen 3.120 N/A TYR 407.A OH PRO 381.A O no hydrogen 2.507 N/A VAL 409.A N GLN 255.A OE1 no hydrogen 2.881 N/A TYR 410.A N LEU 386.A O no hydrogen 2.756 N/A ASN 412.A ND2 THR 424.A OG1 no hydrogen 3.014 N/A ARG 413.A NH2 ASN 390.A OD1 no hydrogen 3.232 N/A GLY 414.A N GLU 92.A OE2 no hydrogen 2.761 N/A ALA 415.A N GLU 92.A OE1 no hydrogen 2.789 N/A SER 423.A N ASP 448.A OD2 no hydrogen 2.800 N/A SER 423.A OG GLY 420.A O no hydrogen 3.364 N/A SER 423.A OG ASP 448.A OD2 no hydrogen 2.715 N/A THR 424.A N GLY 420.A O no hydrogen 3.002 N/A THR 424.A OG1 GLY 420.A O no hydrogen 2.692 N/A ALA 425.A N LEU 421.A O no hydrogen 2.950 N/A ALA 426.A N LEU 422.A O no hydrogen 2.903 N/A GLY 427.A N SER 423.A O no hydrogen 2.988 N/A VAL 428.A N THR 424.A O no hydrogen 2.837 N/A GLN 429.A N ALA 425.A O no hydrogen 2.880 N/A GLN 429.A NE2 LYS 434.A O no hydrogen 3.048 N/A GLN 429.A NE2 SER 459.A OG no hydrogen 3.052 N/A ARG 430.A N ALA 426.A O no hydrogen 3.082 N/A ARG 430.A NH1 HIS 50.A ND1 no hydrogen 2.997 N/A ALA 431.A N GLY 427.A O no hydrogen 3.022 N/A SER 432.A OG GLN 385.A OE1 no hydrogen 2.853 N/A GLY 433.A N GLN 429.A O no hydrogen 2.909 N/A LYS 434.A N SER 432.A OG no hydrogen 3.267 N/A THR 436.A N PRO 461.A O no hydrogen 2.891 N/A THR 436.A OG1 LYS 434.A O no hydrogen 2.896 N/A LEU 437.A N GLN 385.A O no hydrogen 3.275 N/A ALA 438.A N VAL 463.A O no hydrogen 2.812 N/A ILE 439.A N PHE 387.A O no hydrogen 2.925 N/A VAL 440.A N ILE 465.A O no hydrogen 3.133 N/A ASP 442.A N VAL 467.A O no hydrogen 2.833 N/A ALA 445.A N ASP 442.A O no hydrogen 3.178 N/A LEU 446.A N ASP 442.A O no hydrogen 2.963 N/A TYR 447.A N LEU 443.A O no hydrogen 2.779 N/A ASP 448.A N SER 444.A O no hydrogen 3.131 N/A LEU 449.A N LEU 446.A O no hydrogen 3.284 N/A ASN 450.A ND2 ASP 54.A OD2 no hydrogen 2.764 N/A ALA 451.A N ASP 448.A O no hydrogen 2.757 N/A LEU 452.A N LEU 449.A O no hydrogen 2.931 N/A ALA 453.A N ASN 450.A O no hydrogen 3.277 N/A LEU 455.A N ALA 451.A O no hydrogen 3.075 N/A LEU 455.A N LEU 452.A O no hydrogen 2.936 N/A ARG 456.A N LEU 452.A O no hydrogen 3.180 N/A ARG 456.A NE PHE 487.A O no hydrogen 3.383 N/A GLN 457.A N LEU 454.A O no hydrogen 3.172 N/A SER 459.A N GLN 429.A OE1 no hydrogen 2.970 N/A SER 459.A OG GLN 429.A OE1 no hydrogen 3.311 N/A LEU 462.A N THR 512.A O no hydrogen 3.139 N/A VAL 463.A N THR 436.A O no hydrogen 2.788 N/A LEU 464.A N THR 514.A O no hydrogen 2.893 N/A ILE 465.A N ALA 438.A O no hydrogen 2.897 N/A VAL 466.A N ILE 516.A O no hydrogen 2.848 N/A VAL 467.A N VAL 440.A O no hydrogen 2.867 N/A ASN 468.A N MET 518.A O no hydrogen 2.829 N/A ASN 468.A ND2 VAL 478.A O no hydrogen 2.924 N/A ASN 468.A ND2 GLU 517.A OE2 no hydrogen 2.641 N/A ASN 469.A N ASP 442.A OD1 no hydrogen 3.191 N/A ASN 470.A N ASN 468.A OD1 no hydrogen 2.967 N/A HIS 479.A ND1 GLU 517.A OE2 no hydrogen 2.928 N/A PHE 480.A N GLU 517.A OE1 no hydrogen 3.113 N/A ALA 484.A N PHE 480.A O no hydrogen 2.800 N/A ALA 485.A N GLU 481.A O no hydrogen 3.060 N/A MET 486.A N HIS 482.A O no hydrogen 2.723 N/A PHE 487.A N ALA 484.A O no hydrogen 2.958 N/A GLU 488.A N ALA 485.A O no hydrogen 3.012 N/A LEU 489.A N ALA 484.A O no hydrogen 3.080 N/A LYS 490.A N THR 513.A O no hydrogen 3.254 N/A LYS 490.A NZ ASP 506.A O no hydrogen 2.881 N/A LYS 490.A NZ THR 510.A OG1 no hydrogen 3.070 N/A TYR 491.A OH GLU 517.A OE1 no hydrogen 2.484 N/A HIS 492.A N VAL 515.A O no hydrogen 2.842 N/A HIS 492.A NE2 ASP 506.A OD2 no hydrogen 3.199 N/A ARG 493.A NE TYR 491.A OH no hydrogen 3.337 N/A GLN 495.A N GLU 499.A OE1 no hydrogen 2.653 N/A GLN 495.A NE2 ARG 493.A O no hydrogen 3.294 N/A TRP 497.A NE1 ASP 365.A O no hydrogen 2.750 N/A GLU 499.A N ASN 496.A OD1 no hydrogen 2.807 N/A LEU 500.A N ASN 496.A O no hydrogen 3.022 N/A GLU 501.A N TRP 497.A O no hydrogen 2.867 N/A THR 502.A N GLN 498.A O no hydrogen 2.972 N/A THR 502.A OG1 GLN 498.A O no hydrogen 2.753 N/A ALA 503.A N GLU 499.A O no hydrogen 2.878 N/A PHE 504.A N LEU 500.A O no hydrogen 2.945 N/A ALA 505.A N GLU 501.A O no hydrogen 3.240 N/A ASP 506.A N THR 502.A O no hydrogen 3.216 N/A ALA 507.A N ALA 503.A O no hydrogen 2.978 N/A TRP 508.A N PHE 504.A O no hydrogen 2.889 N/A ARG 509.A N ASP 506.A O no hydrogen 3.283 N/A THR 512.A N THR 510.A O no hydrogen 3.072 N/A THR 513.A OG1 LEU 455.A O no hydrogen 2.595 N/A THR 514.A N LEU 462.A O no hydrogen 2.965 N/A VAL 515.A N LYS 490.A O no hydrogen 2.793 N/A ILE 516.A N LEU 464.A O no hydrogen 2.827 N/A GLU 517.A N HIS 492.A O no hydrogen 2.763 N/A MET 518.A N VAL 466.A O no hydrogen 2.976 N/A VAL 520.A N ASN 468.A O no hydrogen 2.700 N/A THR 523.A OG1 ASN 521.A OD1 no hydrogen 3.010 N/A GLN 527.A N THR 523.A O no hydrogen 3.031 N/A THR 528.A N ASP 524.A O no hydrogen 2.721 N/A THR 528.A OG1 ASP 524.A O no hydrogen 2.572 N/A LEU 529.A N GLY 525.A O no hydrogen 2.917 N/A GLN 530.A N ALA 526.A O no hydrogen 2.956 N/A GLN 531.A N GLN 527.A O no hydrogen 3.080 N/A GLN 531.A NE2 GLN 527.A OE1 no hydrogen 2.714 N/A LEU 532.A N THR 528.A O no hydrogen 3.074 N/A LEU 533.A N LEU 529.A O no hydrogen 3.065 N/A LEU 533.A N GLN 530.A O no hydrogen 3.220 N/A ALA 534.A N GLN 530.A O no hydrogen 3.019 N/A GLN 535.A N GLN 531.A O no hydrogen 2.868 N/A VAL 536.A N LEU 532.A O no hydrogen 2.962 N/A SER 537.A N LEU 533.A O no hydrogen 2.661 N/A SER 537.A OG LEU 533.A O no hydrogen 3.012 N/A HIS 538.A N GLN 535.A O no hydrogen 3.209 N/A LEU 539.A N VAL 536.A O no hydrogen 3.121 N/A