Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vfu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N LEU 2.A O no hydrogen 3.272 N/A ILE 6.A N LEU 3.A O no hydrogen 3.144 N/A PHE 7.A N ARG 28.A O no hydrogen 2.586 N/A LYS 11.A N GLU 9.A O no hydrogen 2.336 N/A LYS 11.A NZ GLU 9.A OE1 no hydrogen 3.134 N/A SER 13.A OG LEU 404.A O no hydrogen 3.020 N/A TYR 14.A N LYS 11.A O no hydrogen 2.866 N/A TYR 16.A N ARG 24.A O no hydrogen 3.226 N/A TYR 16.A OH GLU 407.A OE1 no hydrogen 2.765 N/A ILE 18.A N GLN 22.A O no hydrogen 3.301 N/A GLN 22.A N SER 19.A OG no hydrogen 3.150 N/A GLN 22.A NE2 SER 19.A OG no hydrogen 3.068 N/A LEU 23.A N LEU 73.A O no hydrogen 2.956 N/A ARG 24.A N TYR 16.A O no hydrogen 2.692 N/A VAL 25.A N ALA 71.A O no hydrogen 3.298 N/A ARG 26.A N TYR 14.A O no hydrogen 2.961 N/A ARG 26.A NE SER 13.A O no hydrogen 3.388 N/A LEU 27.A N PHE 69.A O no hydrogen 3.044 N/A ARG 28.A N PHE 7.A O no hydrogen 3.040 N/A ARG 28.A NH1 TYR 14.A OH no hydrogen 2.872 N/A ALA 29.A N ASP 67.A O no hydrogen 3.422 N/A LYS 31.A N ARG 65.A O no hydrogen 2.933 N/A LYS 31.A NZ ASP 63.A O no hydrogen 3.558 N/A GLY 32.A N ASP 67.A OD1 no hydrogen 2.594 N/A VAL 35.A N THR 87.A O no hydrogen 2.946 N/A ARG 36.A NH1 LEU 85.A O no hydrogen 3.207 N/A GLU 38.A N LEU 85.A O no hydrogen 3.266 N/A VAL 39.A N ALA 55.A O no hydrogen 2.849 N/A LEU 40.A N VAL 83.A O no hydrogen 2.967 N/A TYR 41.A N ALA 53.A O no hydrogen 3.060 N/A TYR 41.A OH GLU 74.A O no hydrogen 3.313 N/A ALA 42.A N LYS 81.A O no hydrogen 3.399 N/A ARG 44.A NE GLN 112.A OE1 no hydrogen 3.101 N/A ARG 44.A NH2 ALA 114.A O no hydrogen 2.714 N/A ALA 46.A N ASP 43.A O no hydrogen 2.926 N/A ALA 53.A N TYR 41.A O no hydrogen 2.599 N/A ALA 55.A N GLU 38.A OE1 no hydrogen 3.239 N/A ALA 57.A N CYS 37.A O no hydrogen 3.047 N/A ALA 60.A N TYR 68.A O no hydrogen 2.764 N/A SER 62.A OG ASP 67.A OD2 no hydrogen 3.072 N/A ARG 65.A N ASP 63.A OD2 no hydrogen 3.201 N/A PHE 66.A N ASP 63.A OD2 no hydrogen 2.655 N/A ASP 67.A N ALA 29.A O no hydrogen 2.927 N/A TYR 68.A N GLY 61.A O no hydrogen 2.678 N/A TYR 68.A OH ASP 63.A OD1 no hydrogen 2.743 N/A PHE 69.A N LEU 27.A O no hydrogen 2.995 N/A GLU 70.A N GLY 58.A O no hydrogen 2.635 N/A ALA 71.A N VAL 25.A O no hydrogen 3.162 N/A LEU 73.A N LEU 23.A O no hydrogen 3.001 N/A GLU 74.A N TYR 41.A OH no hydrogen 2.860 N/A CYS 75.A N THR 21.A O no hydrogen 2.770 N/A CYS 75.A SG LEU 73.A O no hydrogen 3.864 N/A THR 77.A OG1 ASP 43.A OD1 no hydrogen 2.615 N/A THR 77.A OG1 ARG 79.A O no hydrogen 3.092 N/A ARG 79.A NE ASP 43.A OD1 no hydrogen 3.267 N/A ARG 79.A NH2 ASP 43.A OD1 no hydrogen 3.368 N/A ARG 79.A NH2 ASP 43.A OD2 no hydrogen 2.533 N/A LYS 81.A N ALA 42.A O no hydrogen 3.121 N/A LYS 81.A NZ ARG 44.A O no hydrogen 2.749 N/A TYR 82.A N PHE 111.A O no hydrogen 3.031 N/A VAL 83.A N LEU 40.A O no hydrogen 2.762 N/A PHE 84.A N PHE 96.A O no hydrogen 2.842 N/A LEU 86.A N VAL 94.A O no hydrogen 2.989 N/A THR 87.A N ARG 36.A O no hydrogen 2.759 N/A GLN 90.A N GLU 92.A OE2 no hydrogen 3.123 N/A GLU 92.A N GLU 92.A OE2 no hydrogen 2.557 N/A TYR 95.A N SER 102.A O no hydrogen 2.897 N/A PHE 96.A N PHE 84.A O no hydrogen 3.150 N/A GLY 97.A N GLY 100.A O no hydrogen 3.404 N/A THR 99.A N ALA 108.A O no hydrogen 3.399 N/A THR 99.A OG1 LYS 107.A O no hydrogen 3.454 N/A THR 99.A OG1 ALA 108.A O no hydrogen 2.359 N/A GLY 100.A N GLY 97.A O no hydrogen 2.902 N/A SER 102.A N TYR 95.A O no hydrogen 3.059 N/A GLU 104.A N SER 102.A OG no hydrogen 3.310 N/A ALA 108.A N GLU 104.A O no hydrogen 3.192 N/A ALA 108.A N ARG 105.A O no hydrogen 3.092 N/A GLY 109.A N SER 106.A O no hydrogen 2.963 N/A TYR 113.A N VAL 80.A O no hydrogen 3.041 N/A ILE 116.A N LYS 78.A O no hydrogen 2.943 N/A GLU 120.A N HIS 117.A O no hydrogen 2.652 N/A THR 123.A OG1 VAL 121.A O no hydrogen 3.318 N/A TRP 127.A NE1 ASP 348.A O no hydrogen 2.762 N/A LYS 129.A N PRO 125.A O no hydrogen 3.408 N/A LYS 129.A NZ THR 124.A OG1 no hydrogen 2.842 N/A LYS 129.A NZ PRO 125.A O no hydrogen 3.506 N/A LYS 129.A NZ GLU 126.A OE1 no hydrogen 3.075 N/A GLU 130.A N TRP 127.A O no hydrogen 3.131 N/A ALA 131.A N ALA 128.A O no hydrogen 3.164 N/A ILE 133.A N PRO 450.A O no hydrogen 3.084 N/A TYR 134.A N ALA 189.A O no hydrogen 3.029 N/A TYR 134.A OH GLU 457.A OE1 no hydrogen 3.243 N/A TYR 134.A OH GLU 457.A OE2 no hydrogen 2.520 N/A GLN 135.A N ILE 452.A O no hydrogen 2.807 N/A ILE 136.A N TYR 191.A O no hydrogen 2.779 N/A ARG 140.A N PHE 137.A O no hydrogen 2.754 N/A ARG 140.A NE ARG 469.A O no hydrogen 2.662 N/A ARG 140.A NH1 GLU 139.A OE2 no hydrogen 2.489 N/A ASN 143.A ND2 ASP 149.A OD1 no hydrogen 3.149 N/A ASN 143.A ND2 ASP 149.A OD2 no hydrogen 3.120 N/A ASN 143.A ND2 TYR 168.A O no hydrogen 3.137 N/A GLY 144.A N ASP 171.A OD1 no hydrogen 2.858 N/A GLY 144.A N ASP 171.A OD2 no hydrogen 3.161 N/A ASP 145.A N ASN 143.A OD1 no hydrogen 3.243 N/A ASP 145.A N ASP 171.A OD2 no hydrogen 3.103 N/A SER 147.A N ASP 145.A OD1 no hydrogen 2.992 N/A SER 147.A OG ASP 145.A OD1 no hydrogen 2.458 N/A SER 147.A OG ASP 145.A OD2 no hydrogen 2.942 N/A ASN 148.A ND2 ASP 145.A OD2 no hydrogen 2.985 N/A ASN 148.A ND2 ASP 171.A OD2 no hydrogen 3.410 N/A THR 153.A OG1 PRO 150.A O no hydrogen 2.319 N/A GLN 155.A NE2 THR 153.A O no hydrogen 3.455 N/A TRP 156.A NE1 MET 472.A O no hydrogen 3.316 N/A LYS 158.A NZ GLU 478.A OE2 no hydrogen 3.519 N/A ALA 160.A N ALA 157.A O no hydrogen 3.018 N/A ARG 161.A NH2 LYS 158.A O no hydrogen 3.322 N/A ARG 161.A NH2 ALA 160.A O no hydrogen 2.523 N/A ARG 163.A N SER 166.A OG no hydrogen 3.200 N/A SER 166.A N ARG 163.A O no hydrogen 3.003 N/A SER 166.A OG GLU 154.A OE1 no hydrogen 3.082 N/A SER 166.A OG GLU 154.A OE2 no hydrogen 3.459 N/A SER 166.A OG ARG 163.A O no hydrogen 3.465 N/A TYR 168.A N GLU 139.A OE1 no hydrogen 2.293 N/A GLY 169.A N GLU 139.A OE1 no hydrogen 3.065 N/A ASP 171.A N ALA 142.A O no hydrogen 3.093 N/A LEU 172.A N PHE 216.A O no hydrogen 2.795 N/A LYS 173.A NZ ASP 177.A OD1 no hydrogen 3.253 N/A LYS 173.A NZ ASP 177.A OD2 no hydrogen 3.149 N/A GLY 174.A N ASP 171.A OD1 no hydrogen 2.732 N/A ILE 176.A N LEU 172.A O no hydrogen 3.028 N/A ASP 177.A N LYS 173.A O no hydrogen 3.000 N/A ARG 178.A N GLY 174.A O no hydrogen 2.889 N/A ARG 178.A N VAL 175.A O no hydrogen 3.301 N/A LEU 179.A N ILE 176.A O no hydrogen 3.000 N/A TYR 181.A OH GLU 457.A OE2 no hydrogen 2.928 N/A LEU 182.A N ARG 178.A O no hydrogen 3.061 N/A GLU 183.A N LEU 179.A O no hydrogen 2.721 N/A GLU 184.A N PRO 180.A O no hydrogen 2.869 N/A LEU 185.A N TYR 181.A O no hydrogen 2.897 N/A GLY 186.A N LEU 182.A O no hydrogen 3.226 N/A THR 188.A N VAL 132.A O no hydrogen 2.987 N/A THR 188.A OG1 VAL 132.A O no hydrogen 3.558 N/A LEU 190.A N LYS 235.A O no hydrogen 2.821 N/A TYR 191.A N TYR 134.A O no hydrogen 3.272 N/A TYR 191.A OH ASP 239.A OD1 no hydrogen 2.875 N/A PHE 192.A N ILE 237.A O no hydrogen 2.959 N/A THR 193.A N ILE 136.A O no hydrogen 3.265 N/A THR 193.A OG1 ILE 136.A O no hydrogen 3.439 N/A ALA 197.A N ALA 211.A O no hydrogen 2.679 N/A SER 198.A N ASP 213.A OD2 no hydrogen 3.250 N/A SER 198.A OG SER 200.A OG no hydrogen 3.199 N/A SER 198.A OG ASP 205.A O no hydrogen 3.027 N/A SER 200.A OG SER 198.A OG no hydrogen 3.199 N/A SER 200.A OG ASP 205.A OD1 no hydrogen 2.838 N/A SER 200.A OG ASP 205.A OD2 no hydrogen 3.213 N/A LYS 203.A N SER 200.A OG no hydrogen 2.983 N/A LYS 203.A NZ SER 200.A O no hydrogen 2.347 N/A TYR 204.A N HIS 202.A ND1 no hydrogen 3.090 N/A TYR 204.A OH HIS 420.A NE2 no hydrogen 3.056 N/A ALA 207.A N ALA 197.A O no hydrogen 2.559 N/A ASP 208.A N ALA 197.A O no hydrogen 3.097 N/A TYR 209.A OH VAL 241.A O no hydrogen 2.942 N/A ALA 211.A N ASP 208.A O no hydrogen 2.900 N/A ASP 213.A N ILE 195.A O no hydrogen 2.822 N/A PHE 216.A N ASP 213.A O no hydrogen 3.203 N/A GLY 217.A N ASP 213.A O no hydrogen 3.373 N/A THR 221.A N ASP 218.A OD1 no hydrogen 2.579 N/A THR 221.A OG1 ASP 218.A OD1 no hydrogen 2.801 N/A THR 221.A OG1 ASP 218.A OD2 no hydrogen 3.392 N/A PHE 222.A N ASP 218.A O no hydrogen 2.765 N/A ARG 223.A N LEU 219.A O no hydrogen 3.022 N/A ARG 223.A NE GLN 317.A O no hydrogen 3.248 N/A ARG 223.A NH1 ASP 227.A OD2 no hydrogen 2.484 N/A ARG 223.A NH2 GLN 317.A O no hydrogen 2.838 N/A ARG 224.A N PRO 220.A O no hydrogen 2.831 N/A LEU 225.A N THR 221.A O no hydrogen 2.760 N/A VAL 226.A N PHE 222.A O no hydrogen 2.678 N/A ASP 227.A N ARG 223.A O no hydrogen 2.801 N/A GLU 228.A N ARG 224.A O no hydrogen 2.717 N/A ALA 229.A N LEU 225.A O no hydrogen 2.725 N/A HIS 230.A N VAL 226.A O no hydrogen 2.922 N/A HIS 230.A NE2 ASP 320.A OD1 no hydrogen 3.046 N/A HIS 230.A NE2 ASP 320.A OD2 no hydrogen 3.067 N/A ARG 231.A N ASP 227.A O no hydrogen 3.217 N/A ARG 231.A NH1 GLU 228.A OE2 no hydrogen 3.124 N/A ARG 232.A N ALA 229.A O no hydrogen 3.046 N/A ARG 232.A NH2 GLU 228.A O no hydrogen 3.484 N/A ARG 232.A NH2 GLU 228.A OE1 no hydrogen 3.344 N/A GLY 233.A N HIS 230.A O no hydrogen 2.698 N/A ILE 234.A N ALA 229.A O no hydrogen 3.156 N/A LYS 235.A N THR 188.A O no hydrogen 2.975 N/A ILE 236.A N ASP 320.A OD2 no hydrogen 2.472 N/A ILE 237.A N LEU 190.A O no hydrogen 2.935 N/A LEU 238.A N GLY 321.A O no hydrogen 3.026 N/A ALA 240.A N ARG 323.A O no hydrogen 3.174 N/A HIS 244.A ND1 ALA 245.A O no hydrogen 3.292 N/A ALA 245.A N PRO 294.A O no hydrogen 3.228 N/A ASP 247.A N ALA 292.A O no hydrogen 3.286 N/A PHE 249.A N GLY 246.A O no hydrogen 2.744 N/A ARG 253.A N PHE 249.A O no hydrogen 3.014 N/A ARG 253.A NE GLN 248.A O no hydrogen 3.553 N/A ASP 254.A N PHE 250.A O no hydrogen 3.338 N/A ASP 254.A N ALA 251.A O no hydrogen 3.333 N/A LEU 256.A N PHE 252.A O no hydrogen 3.198 N/A GLN 257.A N ARG 253.A O no hydrogen 3.198 N/A LYS 258.A NZ ASP 254.A OD1 no hydrogen 2.821 N/A SER 262.A N GLY 259.A O no hydrogen 2.845 N/A SER 262.A OG ASP 254.A OD2 no hydrogen 2.697 N/A TYR 264.A N SER 262.A OG no hydrogen 2.986 N/A LYS 265.A NZ ASP 266.A OD1 no hydrogen 3.122 N/A LYS 265.A NZ ASP 266.A OD2 no hydrogen 2.901 N/A TRP 267.A NE1 GLU 302.A OE1 no hydrogen 3.031 N/A GLU 271.A N ASN 282.A O no hydrogen 3.390 N/A SER 276.A OG TYR 283.A OH no hydrogen 2.600 N/A THR 281.A OG1 GLN 289.A OE1 no hydrogen 3.535 N/A TYR 283.A OH SER 276.A OG no hydrogen 2.600 N/A GLU 284.A N PHE 269.A O no hydrogen 2.539 N/A THR 285.A OG1 VAL 290.A O no hydrogen 2.637 N/A THR 285.A OG1 MET 293.A O no hydrogen 3.267 N/A PHE 286.A N MET 293.A O no hydrogen 3.301 N/A LYS 295.A N GLU 284.A O no hydrogen 2.868 N/A LYS 295.A NZ ASN 243.A OD1 no hydrogen 3.377 N/A LYS 295.A NZ GLU 329.A O no hydrogen 3.169 N/A LEU 296.A N ASN 243.A O no hydrogen 3.028 N/A ARG 297.A N TRP 267.A O no hydrogen 3.108 N/A ARG 297.A NE PHE 268.A O no hydrogen 3.376 N/A ARG 297.A NH2 PHE 268.A O no hydrogen 3.378 N/A THR 298.A OG1 ASP 331.A OD1 no hydrogen 2.960 N/A ASN 300.A N ARG 297.A O no hydrogen 3.183 N/A GLU 302.A N ASN 300.A OD1 no hydrogen 2.748 N/A LYS 304.A N ASN 300.A O no hydrogen 2.831 N/A LYS 304.A NZ GLU 337.A OE1 no hydrogen 2.350 N/A LYS 304.A NZ GLU 337.A OE2 no hydrogen 2.865 N/A GLU 305.A N PRO 301.A O no hydrogen 3.183 N/A TYR 306.A N GLU 302.A O no hydrogen 2.952 N/A LEU 307.A N VAL 303.A O no hydrogen 3.164 N/A PHE 308.A N LYS 304.A O no hydrogen 2.970 N/A ASP 309.A N GLU 305.A O no hydrogen 2.826 N/A VAL 310.A N TYR 306.A O no hydrogen 2.794 N/A ALA 311.A N LEU 307.A O no hydrogen 2.686 N/A ARG 312.A N PHE 308.A O no hydrogen 2.926 N/A ARG 312.A NH1 GLU 305.A OE2 no hydrogen 3.397 N/A ARG 312.A NH2 GLU 305.A OE2 no hydrogen 3.198 N/A PHE 313.A N ASP 309.A O no hydrogen 2.779 N/A TRP 314.A N VAL 310.A O no hydrogen 3.511 N/A TRP 314.A NE1 TYR 209.A O no hydrogen 2.707 N/A MET 315.A N ALA 311.A O no hydrogen 3.271 N/A GLU 316.A N ARG 312.A O no hydrogen 3.231 N/A GLU 316.A N PHE 313.A O no hydrogen 2.906 N/A GLN 317.A N TRP 314.A O no hydrogen 3.311 N/A GLN 317.A NE2 PHE 313.A O no hydrogen 3.175 N/A GLY 318.A N MET 315.A O no hydrogen 2.882 N/A ASP 320.A N ILE 236.A O no hydrogen 3.044 N/A TRP 322.A N LEU 350.A O no hydrogen 2.595 N/A ARG 323.A N LEU 238.A O no hydrogen 2.985 N/A LEU 324.A N VAL 352.A O no hydrogen 2.557 N/A ASN 325.A N ALA 240.A O no hydrogen 3.158 N/A ASN 325.A ND2 ASP 239.A OD2 no hydrogen 3.530 N/A ASN 328.A ND2 HIS 357.A NE2 no hydrogen 3.376 N/A GLU 329.A N VAL 326.A O no hydrogen 3.251 N/A VAL 330.A N ALA 327.A O no hydrogen 3.178 N/A PHE 334.A N ASP 331.A OD2 no hydrogen 3.228 N/A TRP 335.A N ASP 331.A O no hydrogen 3.018 N/A TRP 335.A NE1 ALA 327.A O no hydrogen 2.738 N/A ARG 336.A N HIS 332.A O no hydrogen 2.683 N/A ARG 336.A NE ASP 366.A OD2 no hydrogen 2.524 N/A GLU 337.A N ALA 333.A O no hydrogen 2.949 N/A PHE 338.A N PHE 334.A O no hydrogen 2.731 N/A ARG 339.A N TRP 335.A O no hydrogen 3.333 N/A ARG 339.A NH1 ASP 369.A OD1 no hydrogen 2.791 N/A ARG 339.A NH2 GLN 367.A O no hydrogen 2.774 N/A ARG 339.A NH2 ASP 369.A OD1 no hydrogen 3.001 N/A ARG 340.A N ARG 336.A O no hydrogen 3.173 N/A LEU 341.A N GLU 337.A O no hydrogen 2.922 N/A VAL 342.A N PHE 338.A O no hydrogen 2.889 N/A LYS 343.A N ARG 339.A O no hydrogen 2.608 N/A LYS 343.A NZ ASP 369.A OD1 no hydrogen 3.448 N/A LYS 343.A NZ ASP 369.A OD2 no hydrogen 3.242 N/A SER 344.A N ARG 340.A O no hydrogen 2.985 N/A SER 344.A N LEU 341.A O no hydrogen 2.779 N/A SER 344.A OG ARG 340.A O no hydrogen 3.290 N/A SER 344.A OG LEU 341.A O no hydrogen 2.951 N/A LEU 345.A N LEU 341.A O no hydrogen 2.954 N/A ASN 346.A N LYS 343.A O no hydrogen 3.259 N/A ALA 349.A N ASN 346.A O no hydrogen 3.428 N/A LEU 350.A N ASP 320.A O no hydrogen 3.006 N/A ILE 351.A N ASP 369.A OD2 no hydrogen 3.135 N/A VAL 352.A N TRP 322.A O no hydrogen 2.753 N/A GLY 353.A N SER 370.A O no hydrogen 2.587 N/A GLU 354.A N LEU 324.A O no hydrogen 3.134 N/A ALA 359.A N TYR 405.A OH no hydrogen 3.095 N/A SER 360.A N ASP 358.A OD2 no hydrogen 2.797 N/A SER 360.A OG ASP 358.A OD2 no hydrogen 3.518 N/A TRP 362.A N ALA 359.A O no hydrogen 3.015 N/A LEU 363.A N SER 360.A O no hydrogen 2.983 N/A GLN 367.A NE2 ASP 366.A OD1 no hydrogen 3.003 N/A GLN 367.A NE2 ASP 366.A OD2 no hydrogen 3.372 N/A PHE 368.A N TRP 362.A O no hydrogen 3.245 N/A ASP 369.A N ILE 351.A O no hydrogen 2.707 N/A SER 370.A OG GLY 412.A O no hydrogen 3.016 N/A MET 372.A N GLY 353.A O no hydrogen 2.866 N/A ASN 373.A N TRP 414.A O no hydrogen 3.002 N/A ASN 373.A ND2 ASN 415.A OD1 no hydrogen 2.909 N/A TYR 374.A N MET 372.A O no hydrogen 2.920 N/A PHE 376.A N ASN 373.A OD1 no hydrogen 3.155 N/A ARG 377.A NE LEU 417.A O no hydrogen 2.770 N/A GLU 378.A N TYR 374.A O no hydrogen 3.417 N/A SER 379.A N LEU 375.A O no hydrogen 3.172 N/A SER 379.A OG GLU 397.A OE1 no hydrogen 2.650 N/A VAL 380.A N PHE 376.A O no hydrogen 2.923 N/A ILE 381.A N ARG 377.A O no hydrogen 2.795 N/A ARG 382.A N GLU 378.A O no hydrogen 2.999 N/A ARG 382.A NH1 GLU 397.A OE2 no hydrogen 2.339 N/A ARG 382.A NH2 GLU 397.A OE1 no hydrogen 3.065 N/A PHE 383.A N VAL 380.A O no hydrogen 3.305 N/A PHE 384.A N VAL 380.A O no hydrogen 2.970 N/A ALA 385.A N ILE 381.A O no hydrogen 3.089 N/A THR 386.A N ILE 381.A O no hydrogen 3.000 N/A THR 386.A OG1 ILE 381.A O no hydrogen 3.334 N/A THR 386.A OG1 GLU 388.A OE2 no hydrogen 3.004 N/A GLU 388.A N THR 386.A OG1 no hydrogen 3.338 N/A ILE 389.A N ARG 382.A O no hydrogen 3.053 N/A ARG 393.A N HIS 390.A O no hydrogen 3.169 N/A PHE 394.A N HIS 390.A O no hydrogen 2.981 N/A ASP 395.A N ALA 391.A O no hydrogen 3.217 N/A ALA 396.A N GLU 392.A O no hydrogen 3.060 N/A GLU 397.A N ARG 393.A O no hydrogen 2.833 N/A LEU 398.A N PHE 394.A O no hydrogen 3.296 N/A THR 399.A N ASP 395.A O no hydrogen 2.995 N/A THR 399.A OG1 ASP 395.A O no hydrogen 2.454 N/A THR 399.A OG1 ASP 395.A OD2 no hydrogen 3.486 N/A ARG 400.A N ALA 396.A O no hydrogen 2.856 N/A ALA 401.A N GLU 397.A O no hydrogen 3.206 N/A ARG 402.A N LEU 398.A O no hydrogen 3.031 N/A ARG 402.A NH1 ALA 60.A O no hydrogen 3.315 N/A ARG 402.A NH2 ALA 60.A O no hydrogen 3.104 N/A LEU 404.A N ALA 401.A O no hydrogen 3.070 N/A TYR 405.A OH ASP 358.A OD2 no hydrogen 3.397 N/A GLU 407.A N TYR 16.A OH no hydrogen 2.933 N/A GLN 408.A N GLN 408.A OE1 no hydrogen 2.459 N/A GLN 408.A NE2 PRO 17.A O no hydrogen 3.383 N/A GLN 408.A NE2 PHE 122.A O no hydrogen 3.427 N/A ALA 409.A N PRO 406.A O no hydrogen 2.905 N/A ALA 410.A N PRO 406.A O no hydrogen 2.951 N/A GLN 411.A N GLU 407.A O no hydrogen 2.823 N/A GLN 411.A NE2 GLN 408.A O no hydrogen 2.904 N/A GLY 412.A N ALA 409.A O no hydrogen 2.706 N/A LEU 413.A N ALA 410.A O no hydrogen 3.447 N/A TRP 414.A N VAL 371.A O no hydrogen 3.469 N/A ASN 415.A N THR 449.A O no hydrogen 2.661 N/A ASN 415.A ND2 LEU 447.A O no hydrogen 2.894 N/A SER 419.A N THR 422.A OG1 no hydrogen 3.185 N/A HIS 420.A N HIS 420.A ND1 no hydrogen 2.631 N/A HIS 420.A NE2 TYR 204.A OH no hydrogen 3.056 N/A ASN 421.A N SER 419.A OG no hydrogen 2.734 N/A ASN 421.A ND2 ASP 465.A OD2 no hydrogen 3.517 N/A THR 422.A N SER 419.A O no hydrogen 3.413 N/A THR 422.A OG1 GLU 423.A O no hydrogen 3.199 N/A ARG 424.A N GLY 462.A O no hydrogen 2.929 N/A ARG 424.A NE CYS 468.A O no hydrogen 2.941 N/A ARG 424.A NH1 TYR 454.A O no hydrogen 2.605 N/A ARG 424.A NH2 TYR 454.A O no hydrogen 3.122 N/A ARG 424.A NH2 CYS 468.A O no hydrogen 2.897 N/A PHE 425.A N ASP 418.A OD2 no hydrogen 2.679 N/A THR 427.A N ARG 424.A O no hydrogen 3.259 N/A THR 427.A OG1 GLY 462.A O no hydrogen 3.465 N/A SER 428.A N ARG 424.A O no hydrogen 3.057 N/A SER 428.A OG GLU 423.A OE1 no hydrogen 2.561 N/A SER 428.A OG ARG 424.A O no hydrogen 3.323 N/A CYS 429.A N PHE 425.A O no hydrogen 2.767 N/A GLY 430.A N THR 427.A O no hydrogen 2.516 N/A ASN 432.A N CYS 429.A O no hydrogen 3.175 N/A GLU 433.A N GLY 431.A O no hydrogen 2.674 N/A ALA 434.A N ASN 432.A OD1 no hydrogen 3.126 N/A LYS 435.A N ASN 432.A O no hydrogen 2.584 N/A PHE 436.A N ASN 432.A O no hydrogen 3.424 N/A ARG 437.A N GLU 433.A O no hydrogen 2.892 N/A ARG 437.A NE GLU 433.A OE2 no hydrogen 2.463 N/A LEU 438.A N ALA 434.A O no hydrogen 3.242 N/A ALA 439.A N LYS 435.A O no hydrogen 3.038 N/A VAL 440.A N PHE 436.A O no hydrogen 2.982 N/A LEU 441.A N ARG 437.A O no hydrogen 2.880 N/A PHE 442.A N LEU 438.A O no hydrogen 3.038 N/A GLN 443.A N ALA 439.A O no hydrogen 2.770 N/A GLN 443.A NE2 ASN 415.A O no hydrogen 2.787 N/A GLN 443.A NE2 LEU 451.A O no hydrogen 3.404 N/A MET 444.A N VAL 440.A O no hydrogen 2.700 N/A THR 445.A N PHE 442.A O no hydrogen 2.924 N/A THR 445.A OG1 LEU 441.A O no hydrogen 2.632 N/A THR 445.A OG1 PHE 442.A O no hydrogen 2.931 N/A TYR 446.A N PHE 442.A O no hydrogen 2.620 N/A THR 449.A N LEU 413.A O no hydrogen 2.724 N/A LEU 451.A N ASN 415.A O no hydrogen 2.943 N/A ILE 452.A N ILE 133.A O no hydrogen 2.768 N/A TYR 454.A N GLN 135.A O no hydrogen 3.227 N/A TYR 454.A OH ARG 470.A O no hydrogen 2.536 N/A GLY 455.A N TYR 134.A OH no hydrogen 3.376 N/A GLY 455.A N GLU 457.A OE1 no hydrogen 2.662 N/A ASP 456.A N TYR 453.A O no hydrogen 3.175 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.852 N/A ILE 458.A N GLY 455.A O no hydrogen 2.760 N/A GLY 459.A N GLY 455.A O no hydrogen 3.199 N/A GLY 459.A N ASP 456.A O no hydrogen 3.362 N/A MET 460.A N GLY 455.A O no hydrogen 3.481 N/A GLY 462.A N THR 427.A OG1 no hydrogen 2.752 N/A ALA 463.A N ASP 467.A OD1 no hydrogen 3.331 N/A ASP 467.A N THR 464.A O no hydrogen 3.017 N/A CYS 468.A SG SER 419.A O no hydrogen 3.881 N/A CYS 468.A SG HIS 420.A O no hydrogen 2.902 N/A CYS 468.A SG THR 422.A O no hydrogen 3.335 N/A ARG 469.A N PRO 466.A O no hydrogen 3.204 N/A ARG 470.A NE ASP 467.A OD2 no hydrogen 2.752 N/A ARG 470.A NH1 ASP 467.A OD1 no hydrogen 2.679 N/A ARG 470.A NH1 ASP 467.A OD2 no hydrogen 3.224 N/A MET 472.A N ARG 140.A O no hydrogen 2.916 N/A TRP 474.A NE1 PHE 141.A O no hydrogen 2.846 N/A GLN 479.A NE2 ILE 473.A O no hydrogen 2.586 N/A ASN 480.A N ILE 458.A O no hydrogen 2.639 N/A ASN 480.A ND2 GLU 433.A OE1 no hydrogen 3.140 N/A ARG 481.A N GLN 479.A O no hydrogen 2.731 N/A ARG 481.A NH2 GLN 479.A OE1 no hydrogen 2.997 N/A LEU 483.A N ASN 480.A OD1 no hydrogen 2.749 N/A PHE 484.A N ASN 480.A O no hydrogen 3.010 N/A GLU 485.A N ARG 481.A O no hydrogen 2.754 N/A PHE 486.A N GLY 482.A O no hydrogen 2.798 N/A TYR 487.A N LEU 483.A O no hydrogen 2.746 N/A LYS 488.A N PHE 484.A O no hydrogen 3.013 N/A LYS 488.A NZ GLU 184.A OE2 no hydrogen 2.864 N/A LYS 488.A NZ GLU 485.A OE1 no hydrogen 2.931 N/A GLU 489.A N GLU 485.A O no hydrogen 3.202 N/A LEU 490.A N PHE 486.A O no hydrogen 3.217 N/A ILE 491.A N TYR 487.A O no hydrogen 2.807 N/A ARG 492.A N LYS 488.A O no hydrogen 2.725 N/A LEU 493.A N GLU 489.A O no hydrogen 2.578 N/A ARG 494.A N LEU 490.A O no hydrogen 2.678 N/A ARG 494.A NH1 MET 444.A O no hydrogen 2.711 N/A ARG 494.A NH1 TYR 446.A O no hydrogen 3.545 N/A ARG 494.A NH2 TYR 446.A O no hydrogen 3.451 N/A HIS 495.A N ILE 491.A O no hydrogen 3.125 N/A ARG 496.A N ARG 492.A O no hydrogen 2.886 N/A LEU 497.A N LEU 493.A O no hydrogen 3.192 N/A LEU 500.A N LEU 497.A O no hydrogen 2.715 N/A THR 501.A OG1 ARG 494.A O no hydrogen 3.529 N/A ARG 502.A NE GLU 130.A OE2 no hydrogen 3.174 N/A ARG 502.A NH1 GLU 126.A OE2 no hydrogen 3.553 N/A ARG 502.A NH2 GLU 126.A OE2 no hydrogen 2.738 N/A ARG 502.A NH2 GLU 130.A OE1 no hydrogen 3.004 N/A ARG 506.A NH2 VAL 505.A O no hydrogen 2.667 N/A SER 507.A OG ASP 395.A OD1 no hydrogen 3.553 N/A SER 507.A OG ASP 395.A OD2 no hydrogen 2.483 N/A SER 507.A OG TYR 517.A OH no hydrogen 3.268 N/A TRP 508.A N ALA 518.A O no hydrogen 2.741 N/A TRP 508.A NE1 GLN 544.A O no hydrogen 3.140 N/A HIS 509.A N ALA 518.A O no hydrogen 3.052 N/A ASP 511.A N LEU 516.A O no hydrogen 2.913 N/A LYS 512.A N GLU 392.A OE1 no hydrogen 3.410 N/A ALA 514.A N ASP 511.A OD1 no hydrogen 2.687 N/A ASN 515.A N ASP 511.A O no hydrogen 2.562 N/A ASN 515.A ND2 ASN 534.A O no hydrogen 2.631 N/A TYR 517.A N LEU 532.A O no hydrogen 3.110 N/A TYR 517.A OH ASP 395.A OD2 no hydrogen 3.132 N/A TYR 517.A OH SER 507.A OG no hydrogen 3.268 N/A PHE 519.A N VAL 530.A O no hydrogen 3.307 N/A VAL 520.A N ARG 506.A O no hydrogen 2.772 N/A ARG 521.A N VAL 528.A O no hydrogen 3.095 N/A ARG 521.A NE ASN 504.A O no hydrogen 2.879 N/A ARG 521.A NH1 GLY 503.A O no hydrogen 3.197 N/A ARG 521.A NH2 THR 445.A O no hydrogen 2.737 N/A ARG 521.A NH2 LEU 500.A O no hydrogen 3.407 N/A VAL 523.A N GLN 526.A O no hydrogen 3.371 N/A HIS 527.A N ASN 583.A OD1 no hydrogen 2.618 N/A VAL 528.A N ARG 521.A O no hydrogen 3.207 N/A GLY 529.A N LEU 581.A O no hydrogen 2.635 N/A VAL 530.A N PHE 519.A O no hydrogen 3.216 N/A VAL 531.A N MET 579.A O no hydrogen 2.709 N/A LEU 532.A N TYR 517.A O no hydrogen 3.053 N/A ASN 533.A N GLN 577.A O no hydrogen 3.143 N/A ASN 533.A ND2 GLU 537.A O no hydrogen 3.324 N/A ASN 533.A ND2 ARG 574.A O no hydrogen 3.390 N/A ASN 534.A ND2 PHE 383.A O no hydrogen 2.918 N/A ARG 535.A N ASN 533.A O no hydrogen 3.038 N/A GLN 539.A N LEU 573.A O no hydrogen 3.400 N/A GLN 539.A NE2 ALA 514.A O no hydrogen 3.010 N/A GLN 539.A NE2 ASN 533.A OD1 no hydrogen 3.340 N/A THR 540.A OG1 THR 572.A OG1 no hydrogen 2.824 N/A VAL 541.A N LEU 571.A O no hydrogen 2.701 N/A LEU 543.A N LEU 569.A O no hydrogen 2.734 N/A VAL 545.A N GLY 567.A O no hydrogen 2.732 N/A SER 548.A OG PRO 546.A O no hydrogen 3.007 N/A THR 552.A OG1 LYS 551.A O no hydrogen 2.829 N/A THR 552.A OG1 HIS 563.A ND1 no hydrogen 3.143 N/A TRP 553.A N VAL 562.A O no hydrogen 2.599 N/A LEU 554.A N TRP 582.A O no hydrogen 3.085 N/A ASP 555.A N GLU 560.A O no hydrogen 2.755 N/A CYS 556.A N ILE 580.A O no hydrogen 2.918 N/A LEU 557.A N ASP 555.A OD2 no hydrogen 3.229 N/A THR 558.A OG1 ASP 555.A OD1 no hydrogen 2.713 N/A VAL 562.A N TRP 553.A O no hydrogen 2.904 N/A GLY 564.A N LYS 551.A O no hydrogen 2.658 N/A GLY 567.A N GLU 547.A OE1 no hydrogen 3.011 N/A GLN 568.A N LYS 565.A O no hydrogen 2.888 N/A LEU 569.A N LEU 543.A O no hydrogen 2.932 N/A LEU 571.A N VAL 541.A O no hydrogen 2.922 N/A THR 572.A OG1 THR 540.A OG1 no hydrogen 2.824 N/A LEU 573.A N GLN 539.A O no hydrogen 2.981 N/A ARG 574.A N GLN 577.A OE1 no hydrogen 2.772 N/A TYR 576.A N ARG 535.A O no hydrogen 3.212 N/A GLN 577.A N ARG 574.A O no hydrogen 3.085 N/A MET 579.A N VAL 531.A O no hydrogen 2.747 N/A ILE 580.A N ASP 555.A OD2 no hydrogen 3.448 N/A LEU 581.A N GLY 529.A O no hydrogen 2.871 N/A TRP 582.A N LEU 554.A O no hydrogen 2.983 N/A TRP 582.A NE1 ARG 585.A OXT no hydrogen 3.106 N/A ASN 583.A N HIS 527.A O no hydrogen 3.086 N/A ASN 583.A ND2 ASP 525.A O no hydrogen 3.422 N/A ARG 585.A N ASN 583.A O no hydrogen 2.690 N/A ARG 585.A NH1 ASP 525.A O no hydrogen 3.153 N/A