Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ulu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N ASP 8.A O no hydrogen 3.301 N/A ALA 7.A N VAL 27.A O no hydrogen 2.906 N/A ASP 8.A N VAL 2.A O no hydrogen 3.466 N/A CYS 9.A N ASN 29.A O no hydrogen 2.915 N/A SER 10.A N ASP 8.A OD1 no hydrogen 3.359 N/A SER 10.A OG HIS 11.A ND1 no hydrogen 2.810 N/A SER 10.A OG THR 31.A O no hydrogen 3.479 N/A SER 10.A OG THR 31.A OG1 no hydrogen 2.884 N/A HIS 11.A N THR 31.A O no hydrogen 3.198 N/A HIS 11.A ND1 SER 10.A OG no hydrogen 2.810 N/A LEU 14.A N ASN 33.A OD1 no hydrogen 3.021 N/A THR 26.A N GLU 5.A O no hydrogen 3.382 N/A LEU 28.A N SER 51.A O no hydrogen 2.899 N/A ASN 29.A N ALA 7.A O no hydrogen 2.896 N/A LEU 30.A N ASP 53.A O no hydrogen 2.536 N/A THR 31.A OG1 SER 10.A OG no hydrogen 2.884 N/A THR 31.A OG1 ASN 29.A OD1 no hydrogen 2.839 N/A HIS 32.A N GLY 55.A O no hydrogen 3.061 N/A ASN 33.A ND2 CYS 9.A O no hydrogen 3.457 N/A ASN 33.A ND2 LEU 30.A O no hydrogen 2.913 N/A GLN 34.A N LEU 14.A O no hydrogen 2.987 N/A LEU 35.A N ASN 57.A OD1 no hydrogen 3.379 N/A ALA 40.A N GLU 63.A OE1 no hydrogen 3.271 N/A PHE 43.A N ALA 40.A O no hydrogen 2.911 N/A THR 44.A N ALA 41.A O no hydrogen 2.919 N/A THR 44.A OG1 ALA 40.A O no hydrogen 3.351 N/A THR 44.A OG1 ALA 41.A O no hydrogen 2.930 N/A ARG 45.A NE LEU 21.A O no hydrogen 3.070 N/A TYR 46.A N PHE 43.A O no hydrogen 2.918 N/A TYR 46.A OH PRO 18.A O no hydrogen 2.640 N/A THR 50.A N THR 26.A O no hydrogen 2.646 N/A THR 50.A OG1 THR 26.A O no hydrogen 2.883 N/A SER 51.A N THR 26.A O no hydrogen 3.056 N/A LEU 52.A N VAL 75.A O no hydrogen 2.914 N/A ASP 53.A N LEU 28.A O no hydrogen 2.898 N/A VAL 54.A N ASN 77.A O no hydrogen 3.042 N/A GLY 55.A N ASP 53.A OD1 no hydrogen 3.229 N/A PHE 56.A N GLN 79.A O no hydrogen 2.929 N/A ASN 57.A N HIS 80.A O no hydrogen 3.211 N/A ASN 57.A ND2 LEU 30.A O no hydrogen 3.194 N/A ASN 57.A ND2 VAL 54.A O no hydrogen 2.581 N/A THR 58.A OG1 LEU 35.A O no hydrogen 3.187 N/A LEU 66.A N GLU 63.A O no hydrogen 3.180 N/A CYS 67.A N PRO 64.A O no hydrogen 2.925 N/A CYS 67.A SG THR 90.A O no hydrogen 3.295 N/A GLN 68.A N GLU 65.A O no hydrogen 2.909 N/A LYS 69.A N GLU 65.A O no hydrogen 3.125 N/A LYS 69.A N LEU 66.A O no hydrogen 2.922 N/A LEU 73.A N LEU 70.A O no hydrogen 3.418 N/A LYS 74.A N THR 50.A O no hydrogen 2.626 N/A LYS 74.A NZ ASN 96.A OD1 no hydrogen 3.155 N/A VAL 75.A N THR 50.A O no hydrogen 3.249 N/A LEU 76.A N GLU 99.A O no hydrogen 2.909 N/A ASN 77.A N LEU 52.A O no hydrogen 2.895 N/A LEU 78.A N HIS 101.A O no hydrogen 2.806 N/A GLN 79.A N ASN 77.A OD1 no hydrogen 3.180 N/A HIS 80.A N MET 103.A O no hydrogen 2.532 N/A ASN 81.A N SER 104.A O no hydrogen 3.273 N/A ASN 81.A ND2 LEU 78.A O no hydrogen 2.939 N/A GLU 82.A N ILE 59.A O no hydrogen 3.166 N/A SER 87.A N THR 90.A OG1 no hydrogen 3.104 N/A SER 87.A OG THR 90.A OG1 no hydrogen 2.399 N/A THR 90.A N SER 87.A OG no hydrogen 3.235 N/A THR 90.A OG1 SER 87.A OG no hydrogen 2.399 N/A ALA 92.A N LYS 89.A O no hydrogen 3.140 N/A ASN 96.A ND2 PRO 71.A O no hydrogen 3.184 N/A THR 98.A N LYS 74.A O no hydrogen 2.601 N/A THR 98.A OG1 LYS 74.A O no hydrogen 3.120 N/A GLU 99.A N LYS 74.A O no hydrogen 3.079 N/A LEU 100.A N THR 123.A O no hydrogen 2.914 N/A HIS 101.A N LEU 76.A O no hydrogen 2.913 N/A LEU 102.A N ASP 125.A O no hydrogen 2.852 N/A SER 104.A N SER 127.A O no hydrogen 3.003 N/A ASN 105.A N ASN 129.A OD1 no hydrogen 3.031 N/A ASN 105.A ND2 LEU 78.A O no hydrogen 3.109 N/A SER 106.A OG ASN 105.A O no hydrogen 2.548 N/A ILE 107.A N ASN 129.A OD1 no hydrogen 3.288 N/A GLN 108.A NE2 SER 106.A O no hydrogen 3.598 N/A ASN 113.A N ASP 88.A OD2 no hydrogen 3.285 N/A ASN 113.A ND2 THR 138.A OG1 no hydrogen 2.952 N/A GLN 118.A NE2 PHE 91.A O no hydrogen 2.267 N/A GLN 118.A NE2 CYS 94.A O no hydrogen 3.242 N/A ASN 120.A ND2 THR 95.A O no hydrogen 3.103 N/A LEU 121.A N GLN 118.A O no hydrogen 3.145 N/A ILE 122.A N THR 98.A O no hydrogen 2.603 N/A THR 123.A N THR 98.A O no hydrogen 3.068 N/A THR 123.A OG1 GLU 147.A OE1 no hydrogen 3.222 N/A LEU 124.A N GLU 147.A O no hydrogen 2.910 N/A ASP 125.A N LEU 100.A O no hydrogen 2.916 N/A LEU 126.A N LEU 149.A O no hydrogen 2.738 N/A SER 127.A N ASP 125.A OD1 no hydrogen 3.128 N/A SER 127.A OG ASP 125.A OD1 no hydrogen 2.723 N/A SER 127.A OG SER 151.A OG no hydrogen 2.570 N/A HIS 128.A N SER 151.A O no hydrogen 3.106 N/A ASN 129.A ND2 LEU 102.A O no hydrogen 3.656 N/A ASN 129.A ND2 LEU 126.A O no hydrogen 2.594 N/A GLY 130.A N ILE 107.A O no hydrogen 2.970 N/A LEU 131.A N ASN 153.A OD1 no hydrogen 3.228 N/A LYS 135.A N SER 133.A OG no hydrogen 3.139 N/A THR 138.A N ASN 113.A OD1 no hydrogen 3.003 N/A GLN 141.A NE2 ASN 113.A OD1 no hydrogen 2.888 N/A ASN 144.A ND2 LYS 119.A O no hydrogen 2.519 N/A LEU 145.A N LEU 142.A O no hydrogen 3.328 N/A GLN 146.A N ILE 122.A O no hydrogen 2.831 N/A GLU 147.A N ILE 122.A O no hydrogen 3.047 N/A LEU 148.A N LYS 173.A O no hydrogen 2.922 N/A LEU 149.A N LEU 124.A O no hydrogen 2.895 N/A LEU 150.A N GLU 175.A O no hydrogen 2.818 N/A SER 151.A OG SER 127.A OG no hydrogen 2.570 N/A ASN 152.A N SER 177.A O no hydrogen 2.782 N/A ASN 153.A N ASN 179.A OD1 no hydrogen 3.163 N/A ASN 153.A ND2 LEU 126.A O no hydrogen 3.333 N/A ASN 153.A ND2 LEU 150.A O no hydrogen 2.689 N/A LYS 154.A N LEU 131.A O no hydrogen 3.127 N/A LEU 158.A N GLU 183.A O no hydrogen 3.075 N/A SER 160.A OG GLY 187.A O no hydrogen 3.449 N/A LEU 163.A N SER 160.A O no hydrogen 3.055 N/A ASP 164.A N SER 160.A O no hydrogen 2.932 N/A PHE 166.A N LEU 163.A O no hydrogen 3.262 N/A ALA 167.A N ASP 164.A O no hydrogen 2.985 N/A SER 169.A N PHE 166.A O no hydrogen 2.922 N/A SER 169.A OG LEU 142.A O no hydrogen 2.731 N/A LEU 171.A N ARG 194.A O no hydrogen 2.603 N/A LYS 172.A N GLN 146.A O no hydrogen 2.646 N/A LYS 173.A N GLN 146.A O no hydrogen 3.185 N/A LEU 174.A N GLY 197.A O no hydrogen 2.817 N/A GLU 175.A N LEU 148.A O no hydrogen 2.885 N/A LEU 176.A N PHE 199.A O no hydrogen 2.950 N/A SER 177.A N GLU 175.A OE2 no hydrogen 3.198 N/A SER 177.A OG GLU 175.A OE1 no hydrogen 3.162 N/A SER 177.A OG GLU 175.A OE2 no hydrogen 2.949 N/A SER 177.A OG PHE 199.A O no hydrogen 3.468 N/A SER 178.A N ASN 201.A O no hydrogen 2.803 N/A SER 178.A OG ASN 152.A OD1 no hydrogen 3.263 N/A ASN 179.A ND2 LEU 150.A O no hydrogen 3.123 N/A GLN 180.A NE2 GLN 156.A OE1 no hydrogen 3.585 N/A ILE 181.A N ASN 179.A O no hydrogen 2.857 N/A LYS 182.A N GLN 156.A O no hydrogen 2.739 N/A LYS 182.A NZ GLN 204.A O no hydrogen 3.472 N/A LYS 182.A NZ GLN 204.A OE1 no hydrogen 2.871 N/A SER 185.A N LEU 158.A O no hydrogen 2.900 N/A GLY 187.A N GLU 216.A OE1 no hydrogen 2.767 N/A CYS 188.A N SER 185.A O no hydrogen 3.121 N/A CYS 188.A SG LEU 158.A O no hydrogen 3.653 N/A CYS 188.A SG SER 185.A O no hydrogen 3.101 N/A ILE 192.A N PHE 189.A O no hydrogen 3.338 N/A GLY 193.A N PHE 166.A O no hydrogen 3.254 N/A ARG 194.A N SER 169.A O no hydrogen 3.135 N/A PHE 196.A N LEU 171.A O no hydrogen 2.936 N/A LEU 198.A N ASN 224.A O no hydrogen 2.912 N/A PHE 199.A N LEU 174.A O no hydrogen 3.287 N/A LEU 200.A N SER 226.A O no hydrogen 2.762 N/A ASN 201.A N SER 177.A OG no hydrogen 3.206 N/A ASN 202.A N SER 228.A O no hydrogen 2.719 N/A ASN 202.A ND2 SER 178.A OG no hydrogen 3.334 N/A GLN 204.A NE2 GLN 231.A OE1 no hydrogen 3.216 N/A LEU 205.A N SER 230.A O no hydrogen 3.345 N/A THR 210.A N GLY 206.A O no hydrogen 2.903 N/A THR 210.A OG1 GLY 206.A O no hydrogen 2.362 N/A GLU 211.A N PRO 207.A O no hydrogen 2.910 N/A LYS 212.A N SER 208.A O no hydrogen 2.930 N/A LEU 213.A N LEU 209.A O no hydrogen 2.896 N/A CYS 214.A N THR 210.A O no hydrogen 2.902 N/A CYS 214.A SG THR 210.A O no hydrogen 3.362 N/A CYS 214.A SG THR 239.A O no hydrogen 3.820 N/A LEU 215.A N GLU 211.A O no hydrogen 2.906 N/A GLU 216.A N LYS 212.A O no hydrogen 2.918 N/A LEU 217.A N CYS 214.A O no hydrogen 3.266 N/A ALA 218.A N LEU 215.A O no hydrogen 3.250 N/A ASN 219.A N TRP 245.A O no hydrogen 3.171 N/A THR 220.A OG1 LEU 217.A O no hydrogen 2.372 N/A ARG 223.A N PHE 196.A O no hydrogen 2.631 N/A ASN 224.A N PHE 196.A O no hydrogen 2.730 N/A LEU 225.A N MET 250.A O no hydrogen 2.911 N/A SER 226.A N LEU 198.A O no hydrogen 2.907 N/A LEU 227.A N ASP 252.A O no hydrogen 2.806 N/A SER 228.A N ASN 201.A OD1 no hydrogen 2.830 N/A SER 228.A OG SER 254.A O no hydrogen 3.195 N/A SER 228.A OG SER 254.A OG no hydrogen 3.047 N/A ASN 229.A N SER 254.A O no hydrogen 2.929 N/A ASN 229.A ND2 ASN 202.A OD1 no hydrogen 3.342 N/A SER 230.A N ASN 256.A OD1 no hydrogen 3.033 N/A SER 230.A OG LEU 227.A O no hydrogen 2.737 N/A THR 235.A N VAL 260.A O no hydrogen 3.136 N/A THR 235.A OG1 SER 265.A OG no hydrogen 3.324 N/A SER 236.A N THR 239.A OG1 no hydrogen 2.977 N/A SER 236.A OG THR 238.A OG1 no hydrogen 3.015 N/A SER 236.A OG THR 239.A OG1 no hydrogen 3.007 N/A THR 238.A OG1 GLU 211.A OE1 no hydrogen 3.566 N/A THR 238.A OG1 SER 236.A OG no hydrogen 3.015 N/A THR 239.A N SER 236.A O no hydrogen 3.341 N/A THR 239.A OG1 SER 236.A OG no hydrogen 3.007 N/A LEU 241.A N THR 238.A O no hydrogen 3.340 N/A LYS 244.A N LEU 241.A O no hydrogen 2.920 N/A TRP 245.A N GLY 242.A O no hydrogen 2.939 N/A THR 246.A N LEU 243.A O no hydrogen 3.144 N/A THR 246.A OG1 LEU 243.A O no hydrogen 2.528 N/A THR 249.A N ARG 223.A O no hydrogen 2.844 N/A THR 249.A OG1 ARG 223.A O no hydrogen 3.147 N/A MET 250.A N ARG 223.A O no hydrogen 3.141 N/A LEU 251.A N TYR 274.A O no hydrogen 2.917 N/A ASP 252.A N LEU 225.A O no hydrogen 2.919 N/A LEU 253.A N PHE 276.A O no hydrogen 2.824 N/A SER 254.A OG SER 228.A OG no hydrogen 3.047 N/A SER 254.A OG ASP 252.A OD1 no hydrogen 2.763 N/A TYR 255.A N GLU 278.A O no hydrogen 3.293 N/A TYR 255.A N TYR 279.A O no hydrogen 2.989 N/A ASN 256.A N ASN 280.A OD1 no hydrogen 3.044 N/A ASN 256.A ND2 LEU 227.A O no hydrogen 3.093 N/A LEU 258.A N ASN 280.A OD1 no hydrogen 3.132 N/A ASN 259.A N SER 233.A O no hydrogen 2.603 N/A GLY 262.A N THR 235.A O no hydrogen 3.091 N/A ASP 264.A N HIS 288.A O no hydrogen 2.618 N/A SER 265.A OG THR 235.A OG1 no hydrogen 3.324 N/A SER 265.A OG GLY 262.A O no hydrogen 2.273 N/A TRP 268.A NE1 ASN 237.A O no hydrogen 2.382 N/A LEU 269.A N PHE 266.A O no hydrogen 3.312 N/A GLU 273.A N THR 249.A O no hydrogen 2.700 N/A TYR 274.A N THR 249.A O no hydrogen 2.760 N/A PHE 275.A N TYR 298.A O no hydrogen 2.901 N/A PHE 276.A N LEU 251.A O no hydrogen 2.928 N/A LEU 277.A N ASN 300.A O no hydrogen 2.953 N/A GLU 278.A N GLU 278.A OE2 no hydrogen 2.721 N/A TYR 279.A N LYS 302.A O no hydrogen 2.579 N/A ASN 280.A N ARG 303.A O no hydrogen 2.829 N/A ASN 280.A ND2 LEU 253.A O no hydrogen 3.355 N/A ASN 280.A ND2 LEU 277.A O no hydrogen 3.183 N/A ASN 281.A N LEU 258.A O no hydrogen 3.238 N/A ILE 282.A N SER 304.A O no hydrogen 3.005 N/A GLN 283.A N ASN 259.A O no hydrogen 3.291 N/A GLN 283.A NE2 ASN 259.A OD1 no hydrogen 2.814 N/A HIS 284.A NE2 ASP 319.A OD1 no hydrogen 2.739 N/A LEU 285.A N LYS 317.A O no hydrogen 2.987 N/A SER 289.A OG VAL 261.A O no hydrogen 3.177 N/A SER 289.A OG PHE 286.A O no hydrogen 3.202 N/A HIS 291.A N HIS 288.A O no hydrogen 3.256 N/A ASN 295.A ND2 PRO 270.A O no hydrogen 3.526 N/A VAL 296.A N LEU 293.A O no hydrogen 3.231 N/A ARG 297.A N GLU 273.A O no hydrogen 2.676 N/A ARG 297.A NE GLU 273.A OE2 no hydrogen 3.497 N/A ARG 297.A NH1 GLU 330.A OE2 no hydrogen 3.100 N/A TYR 298.A N GLU 273.A O no hydrogen 3.155 N/A LEU 299.A N HIS 331.A O no hydrogen 2.934 N/A ASN 300.A N PHE 275.A O no hydrogen 2.967 N/A LEU 301.A N ASN 333.A O no hydrogen 2.576 N/A LYS 302.A N ASN 300.A OD1 no hydrogen 3.437 N/A LYS 302.A NZ GLU 335.A OE2 no hydrogen 3.440 N/A ARG 303.A N GLU 335.A O no hydrogen 3.176 N/A SER 304.A N LEU 301.A O no hydrogen 3.223 N/A SER 304.A OG LEU 277.A O no hydrogen 2.288 N/A PHE 305.A N ASN 337.A OD1 no hydrogen 3.212 N/A THR 306.A N ILE 282.A O no hydrogen 2.934 N/A THR 306.A OG1 ASN 281.A OD1 no hydrogen 3.125 N/A THR 306.A OG1 LYS 307.A O no hydrogen 3.336 N/A LYS 307.A NZ ASP 338.A OD1 no hydrogen 2.815 N/A GLN 308.A N ASP 338.A OD2 no hydrogen 3.089 N/A SER 311.A N SER 309.A O no hydrogen 2.430 N/A SER 311.A OG SER 309.A O no hydrogen 3.323 N/A LEU 315.A N ALA 313.A O no hydrogen 3.188 N/A LYS 317.A N GLN 283.A O no hydrogen 3.065 N/A ASP 319.A N LEU 285.A O no hydrogen 3.315 N/A PHE 321.A N ASN 345.A O no hydrogen 2.775 N/A SER 322.A OG ASP 319.A O no hydrogen 2.373 N/A LEU 326.A N PHE 323.A O no hydrogen 3.199 N/A LYS 327.A N TRP 325.A O no hydrogen 2.771 N/A CYS 328.A N PHE 294.A O no hydrogen 3.293 N/A LEU 329.A N LEU 326.A O no hydrogen 3.081 N/A GLU 330.A N ARG 297.A O no hydrogen 2.889 N/A HIS 331.A N ARG 297.A O no hydrogen 3.079 N/A LEU 332.A N TYR 355.A O no hydrogen 2.914 N/A ASN 333.A N LEU 299.A O no hydrogen 2.934 N/A MET 334.A N SER 357.A O no hydrogen 3.141 N/A ASP 336.A N SER 359.A O no hydrogen 2.623 N/A ASN 337.A N ASN 360.A O no hydrogen 2.645 N/A ASN 337.A ND2 LEU 301.A O no hydrogen 3.282 N/A ASN 337.A ND2 MET 334.A O no hydrogen 2.471 N/A ILE 339.A N SER 361.A O no hydrogen 3.103 N/A LYS 343.A NZ ILE 318.A O no hydrogen 3.117 N/A ASN 345.A N ASP 320.A OD1 no hydrogen 3.353 N/A ASN 345.A ND2 SER 344.A OG no hydrogen 3.086 N/A MET 346.A N LYS 343.A O no hydrogen 3.378 N/A THR 348.A OG1 ASN 345.A OD1 no hydrogen 3.291 N/A LEU 350.A N PHE 347.A O no hydrogen 3.466 N/A ASN 352.A ND2 LYS 327.A O no hydrogen 2.933 N/A LEU 353.A N LEU 350.A O no hydrogen 3.399 N/A LYS 354.A N GLU 330.A O no hydrogen 3.024 N/A LYS 354.A NZ ASN 352.A O no hydrogen 3.267 N/A TYR 355.A N GLU 330.A O no hydrogen 3.038 N/A LEU 356.A N ILE 383.A O no hydrogen 2.930 N/A SER 357.A N LEU 332.A O no hydrogen 2.946 N/A SER 357.A OG GLU 335.A OE1 no hydrogen 3.154 N/A LEU 358.A N ASN 385.A O no hydrogen 2.781 N/A SER 359.A OG THR 387.A OG1 no hydrogen 2.873 N/A ASN 360.A N THR 387.A O no hydrogen 2.966 N/A SER 361.A N LEU 358.A O no hydrogen 3.067 N/A SER 361.A OG MET 334.A O no hydrogen 2.490 N/A PHE 362.A N ASN 389.A OD1 no hydrogen 3.434 N/A THR 363.A N ILE 339.A O no hydrogen 2.998 N/A LEU 365.A N ASN 389.A O no hydrogen 3.407 N/A ARG 366.A NH1 GLU 414.A OE2 no hydrogen 2.957 N/A LEU 368.A N LYS 393.A O no hydrogen 2.990 N/A THR 369.A N THR 372.A OG1 no hydrogen 2.910 N/A THR 369.A OG1 THR 372.A OG1 no hydrogen 3.066 N/A GLU 371.A N THR 369.A OG1 no hydrogen 3.330 N/A THR 372.A N THR 369.A O no hydrogen 3.372 N/A THR 372.A OG1 THR 369.A O no hydrogen 3.320 N/A THR 372.A OG1 THR 369.A OG1 no hydrogen 3.066 N/A LEU 376.A N PHE 373.A O no hydrogen 3.282 N/A ALA 377.A N VAL 374.A O no hydrogen 3.258 N/A SER 379.A OG LEU 350.A O no hydrogen 2.943 N/A HIS 382.A N LYS 354.A O no hydrogen 2.840 N/A ILE 383.A N LYS 354.A O no hydrogen 3.071 N/A LEU 384.A N VAL 407.A O no hydrogen 2.907 N/A ASN 385.A N LEU 356.A O no hydrogen 2.942 N/A LEU 386.A N ASP 409.A O no hydrogen 2.881 N/A THR 387.A N ASN 385.A OD1 no hydrogen 3.339 N/A THR 387.A OG1 SER 359.A OG no hydrogen 2.873 N/A THR 387.A OG1 ASN 385.A OD1 no hydrogen 2.958 N/A LYS 388.A N LEU 412.A O no hydrogen 2.957 N/A ASN 389.A N ASN 413.A OD1 no hydrogen 2.925 N/A ASN 389.A ND2 LEU 358.A O no hydrogen 2.744 N/A SER 392.A N ARG 366.A O no hydrogen 3.030 N/A SER 392.A OG ARG 366.A O no hydrogen 2.977 N/A LYS 393.A N ARG 366.A O no hydrogen 2.982 N/A ILE 394.A N GLN 417.A OE1 no hydrogen 2.457 N/A GLU 395.A N LEU 368.A O no hydrogen 3.001 N/A ASP 397.A N GLN 422.A O no hydrogen 2.649 N/A SER 400.A OG ASP 397.A O no hydrogen 3.467 N/A TRP 401.A NE1 ASN 370.A O no hydrogen 2.537 N/A LEU 405.A N LEU 402.A O no hydrogen 3.125 N/A GLU 406.A N HIS 382.A O no hydrogen 2.717 N/A VAL 407.A N HIS 382.A O no hydrogen 2.870 N/A LEU 408.A N GLU 432.A O no hydrogen 2.935 N/A ASP 409.A N LEU 384.A O no hydrogen 2.950 N/A LEU 410.A N TYR 434.A O no hydrogen 2.790 N/A GLY 411.A N ASP 409.A OD1 no hydrogen 3.081 N/A LEU 412.A N SER 436.A O no hydrogen 2.958 N/A ASN 413.A N TYR 437.A O no hydrogen 3.339 N/A ASN 413.A ND2 LEU 386.A O no hydrogen 3.098 N/A ASN 413.A ND2 LEU 410.A O no hydrogen 3.086 N/A ILE 415.A N ASN 438.A OD1 no hydrogen 3.218 N/A GLY 416.A N SER 392.A O no hydrogen 3.353 N/A GLN 417.A N TYR 440.A O no hydrogen 2.931 N/A GLN 417.A NE2 ILE 394.A O no hydrogen 2.944 N/A GLN 417.A NE2 GLU 418.A O no hydrogen 3.643 N/A LEU 419.A N GLN 442.A O no hydrogen 3.049 N/A THR 420.A N GLU 423.A OE2 no hydrogen 3.169 N/A THR 420.A OG1 GLU 423.A OE2 no hydrogen 3.207 N/A GLY 421.A N GLU 423.A OE1 no hydrogen 2.914 N/A GLN 422.A N THR 420.A OG1 no hydrogen 3.237 N/A GLU 423.A N GLU 423.A OE1 no hydrogen 2.791 N/A ARG 425.A N GLN 422.A O no hydrogen 3.473 N/A ARG 425.A NE GLN 422.A OE1 no hydrogen 3.013 N/A ARG 425.A NH2 GLN 422.A OE1 no hydrogen 2.952 N/A LEU 427.A N TRP 424.A O no hydrogen 3.242 N/A PHE 431.A N GLU 406.A O no hydrogen 2.628 N/A GLU 432.A N GLU 406.A O no hydrogen 3.065 N/A ILE 433.A N ARG 456.A O no hydrogen 2.913 N/A TYR 434.A N LEU 408.A O no hydrogen 2.904 N/A TYR 434.A OH GLU 432.A OE1 no hydrogen 2.724 N/A LEU 435.A N MET 458.A O no hydrogen 2.782 N/A TYR 437.A N ARG 460.A O no hydrogen 2.696 N/A ASN 438.A N ARG 461.A O no hydrogen 3.259 N/A ASN 438.A ND2 LEU 435.A O no hydrogen 2.246 N/A LEU 441.A N ALA 463.A O no hydrogen 2.972 N/A GLN 442.A N GLN 417.A O no hydrogen 2.900 N/A LEU 443.A N LYS 465.A O no hydrogen 2.804 N/A THR 444.A N SER 447.A OG no hydrogen 2.726 N/A THR 444.A OG1 LEU 419.A O no hydrogen 2.978 N/A THR 444.A OG1 SER 447.A OG no hydrogen 2.824 N/A ARG 445.A NE ASN 446.A OD1 no hydrogen 3.273 N/A SER 447.A OG LEU 419.A O no hydrogen 2.675 N/A SER 447.A OG THR 444.A O no hydrogen 3.393 N/A SER 447.A OG THR 444.A OG1 no hydrogen 2.824 N/A VAL 451.A N PHE 448.A O no hydrogen 3.429 N/A LEU 454.A N VAL 451.A O no hydrogen 3.309 N/A GLN 455.A N PHE 431.A O no hydrogen 2.811 N/A ARG 456.A N PHE 431.A O no hydrogen 3.061 N/A LEU 457.A N ILE 482.A O no hydrogen 2.897 N/A MET 458.A N ILE 433.A O no hydrogen 2.941 N/A LEU 459.A N ASP 484.A O no hydrogen 2.808 N/A ARG 460.A N SER 436.A OG no hydrogen 3.094 N/A ARG 460.A NE TYR 437.A OH no hydrogen 3.448 N/A ARG 461.A N SER 486.A O no hydrogen 2.844 N/A ARG 461.A NE ARG 461.A O no hydrogen 2.995 N/A VAL 462.A N ASN 488.A OD1 no hydrogen 2.513 N/A ALA 463.A N ASN 488.A OD1 no hydrogen 3.092 N/A LYS 465.A N LEU 441.A O no hydrogen 2.786 N/A ASP 468.A N ASP 468.A OD1 no hydrogen 2.422 N/A SER 469.A OG ASN 466.A O no hydrogen 2.512 N/A SER 472.A OG MET 497.A O no hydrogen 2.625 N/A PHE 474.A N SER 472.A OG no hydrogen 2.994 N/A GLN 475.A N SER 472.A O no hydrogen 3.116 N/A LEU 477.A N PHE 474.A O no hydrogen 2.901 N/A ARG 478.A N PRO 476.A O no hydrogen 2.907 N/A ARG 478.A NE GLY 500.A O no hydrogen 2.973 N/A THR 481.A N GLN 455.A O no hydrogen 2.543 N/A THR 481.A OG1 GLN 455.A O no hydrogen 2.964 N/A ILE 482.A N GLN 455.A O no hydrogen 2.909 N/A LEU 483.A N ILE 506.A O no hydrogen 2.896 N/A ASP 484.A N LEU 457.A O no hydrogen 2.943 N/A LEU 485.A N ASP 508.A O no hydrogen 2.752 N/A SER 486.A N ASP 484.A OD1 no hydrogen 3.048 N/A SER 486.A OG ASP 484.A OD1 no hydrogen 2.677 N/A ASN 487.A N GLN 510.A O no hydrogen 2.895 N/A ASN 488.A ND2 LEU 459.A O no hydrogen 2.884 N/A ASN 489.A N HIS 511.A O no hydrogen 3.353 N/A ILE 490.A N ASN 512.A OD1 no hydrogen 2.728 N/A ASN 494.A ND2 ASP 468.A O no hydrogen 2.677 N/A MET 497.A N ASN 494.A O no hydrogen 3.133 N/A LEU 501.A N LEU 498.A O no hydrogen 3.242 N/A LEU 504.A N LEU 501.A O no hydrogen 3.158 N/A GLU 505.A N THR 481.A O no hydrogen 2.722 N/A ILE 506.A N THR 481.A O no hydrogen 2.966 N/A LEU 507.A N ILE 538.A O no hydrogen 2.886 N/A ASP 508.A N LEU 483.A O no hydrogen 2.937 N/A LEU 509.A N ASN 540.A O no hydrogen 2.991 N/A GLN 510.A N GLN 510.A OE1 no hydrogen 2.614 N/A GLN 510.A NE2 ASP 508.A OD1 no hydrogen 3.531 N/A HIS 511.A N GLU 542.A O no hydrogen 2.980 N/A ASN 512.A ND2 LEU 485.A O no hydrogen 3.275 N/A ASN 512.A ND2 LEU 509.A O no hydrogen 3.025 N/A ASN 513.A N ILE 490.A O no hydrogen 2.920 N/A LEU 517.A N LEU 514.A O no hydrogen 3.222 N/A TRP 518.A N ALA 515.A O no hydrogen 2.912 N/A TRP 518.A NE1 ILE 527.A O no hydrogen 3.202 N/A LYS 519.A NZ ASP 547.A OD2 no hydrogen 3.028 N/A LYS 519.A NZ GLU 548.A OE1 no hydrogen 3.124 N/A HIS 520.A N GLU 548.A OE2 no hydrogen 3.180 N/A HIS 520.A ND1 GLU 548.A OE2 no hydrogen 2.896 N/A ASN 522.A N LYS 519.A O no hydrogen 3.195 N/A ASN 522.A ND2 GLY 525.A O no hydrogen 3.009 N/A GLY 525.A N ASN 522.A O no hydrogen 2.707 N/A ILE 527.A N LEU 517.A O no hydrogen 2.917 N/A SER 534.A N GLY 532.A O no hydrogen 2.827 N/A LEU 536.A N LEU 533.A O no hydrogen 3.305 N/A HIS 537.A N GLU 505.A O no hydrogen 2.672 N/A ILE 538.A N GLU 505.A O no hydrogen 2.768 N/A LEU 539.A N ILE 562.A O no hydrogen 2.898 N/A ASN 540.A N LEU 507.A O no hydrogen 2.931 N/A LEU 541.A N ASP 564.A O no hydrogen 2.730 N/A GLU 542.A N ASN 540.A OD1 no hydrogen 3.144 N/A SER 543.A N GLY 566.A O no hydrogen 3.275 N/A ASN 544.A N ASN 568.A OD1 no hydrogen 2.880 N/A ASN 544.A ND2 LEU 509.A O no hydrogen 3.085 N/A PHE 546.A N ASN 568.A OD1 no hydrogen 3.059 N/A LEU 560.A N LEU 557.A O no hydrogen 3.480 N/A LYS 561.A N HIS 537.A O no hydrogen 2.609 N/A ILE 562.A N HIS 537.A O no hydrogen 2.980 N/A ILE 563.A N SER 586.A O no hydrogen 2.922 N/A ASP 564.A N LEU 539.A O no hydrogen 2.914 N/A LEU 565.A N ASN 588.A O no hydrogen 2.798 N/A LEU 567.A N GLN 590.A O no hydrogen 2.745 N/A ASN 568.A ND2 LEU 541.A O no hydrogen 3.442 N/A ASN 568.A ND2 LEU 565.A O no hydrogen 2.835 N/A ASN 569.A N PHE 546.A O no hydrogen 2.803 N/A LEU 570.A N ASN 592.A OD1 no hydrogen 3.421 N/A SER 576.A N LYS 600.A O no hydrogen 3.147 N/A SER 576.A OG ASN 579.A OD1 no hydrogen 3.081 N/A ASN 580.A ND2 LYS 555.A O no hydrogen 3.065 N/A GLN 581.A N PHE 578.A O no hydrogen 3.184 N/A GLN 581.A NE2 PHE 554.A O no hydrogen 2.446 N/A GLN 581.A NE2 LEU 557.A O no hydrogen 2.883 N/A SER 583.A OG PHE 558.A O no hydrogen 3.303 N/A LYS 585.A N LYS 561.A O no hydrogen 2.711 N/A LYS 585.A NZ ASN 608.A O no hydrogen 3.177 N/A SER 586.A N LYS 561.A O no hydrogen 3.142 N/A LEU 587.A N GLU 611.A O no hydrogen 2.922 N/A ASN 588.A N ILE 563.A O no hydrogen 2.917 N/A LEU 589.A N ASP 613.A O no hydrogen 2.700 N/A GLN 590.A N GLN 590.A OE1 no hydrogen 2.624 N/A GLN 590.A NE2 GLU 542.A OE2 no hydrogen 3.115 N/A ASN 592.A ND2 LEU 565.A O no hydrogen 3.493 N/A ASN 592.A ND2 LEU 589.A O no hydrogen 2.873 N/A LEU 593.A N LEU 570.A O no hydrogen 3.229 N/A THR 595.A OG1 ASN 571.A OD1 no hydrogen 3.402 N/A VAL 597.A N SER 625.A O no hydrogen 3.201 N/A PHE 602.A N GLU 598.A O no hydrogen 3.113 N/A PHE 606.A N PHE 602.A O no hydrogen 3.186 N/A ARG 607.A NH1 ARG 607.A O no hydrogen 3.352 N/A THR 610.A N LYS 585.A O no hydrogen 3.003 N/A THR 610.A OG1 LYS 585.A O no hydrogen 2.879 N/A GLU 611.A N LYS 585.A O no hydrogen 3.017 N/A ASP 613.A N LEU 587.A O no hydrogen 2.897 N/A MET 614.A N TYR 647.A OH no hydrogen 2.984 N/A ASN 617.A ND2 LEU 589.A O no hydrogen 3.436 N/A ASN 617.A ND2 MET 614.A O no hydrogen 2.959 N/A PHE 619.A N ASN 617.A O no hydrogen 2.990 N/A ASP 620.A N THR 595.A O no hydrogen 2.758 N/A CYS 621.A N THR 651.A O no hydrogen 2.545 N/A THR 622.A N ASP 620.A O no hydrogen 3.051 N/A THR 622.A OG1 ASP 620.A OD2 no hydrogen 3.394 N/A GLU 624.A N GLU 624.A OE1 no hydrogen 2.790 N/A SER 625.A N THR 622.A O no hydrogen 3.373 N/A SER 625.A OG ASP 620.A OD2 no hydrogen 3.411 N/A SER 625.A OG THR 622.A OG1 no hydrogen 3.177 N/A ILE 626.A N THR 622.A O no hydrogen 3.020 N/A ILE 626.A N CYS 623.A O no hydrogen 3.265 N/A ALA 627.A N CYS 623.A O no hydrogen 2.935 N/A VAL 630.A N ILE 626.A O no hydrogen 2.905 N/A ASN 631.A N ALA 627.A O no hydrogen 2.919 N/A TRP 632.A N TRP 628.A O no hydrogen 2.914 N/A ILE 633.A N PHE 629.A O no hydrogen 2.899 N/A ASN 634.A N VAL 630.A O no hydrogen 2.934 N/A GLU 635.A N TRP 632.A O no hydrogen 3.322 N/A THR 636.A N ILE 633.A O no hydrogen 3.464 N/A THR 638.A N THR 636.A OG1 no hydrogen 2.955 N/A THR 638.A OG1 LEU 609.A O no hydrogen 2.550 N/A THR 638.A OG1 THR 636.A OG1 no hydrogen 3.066 N/A ASN 639.A N THR 610.A O no hydrogen 3.243 N/A HIS 646.A N GLU 642.A O no hydrogen 3.293 N/A HIS 646.A ND1 GLU 642.A OE1 no hydrogen 2.476 N/A CYS 649.A N PHE 658.A O no hydrogen 2.993 N/A CYS 649.A SG PHE 658.A O no hydrogen 3.621 N/A ASN 650.A N PHE 619.A O no hydrogen 3.106 N/A THR 651.A OG1 ASP 620.A OD1 no hydrogen 3.474 N/A TYR 655.A N PRO 652.A O no hydrogen 2.917 N/A HIS 656.A N PRO 653.A O no hydrogen 3.369 N/A GLY 657.A N CYS 649.A O no hydrogen 2.964 N/A PHE 658.A N TYR 655.A O no hydrogen 3.040 N/A