Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8kbw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N THR 1.A OG1 no hydrogen 3.267 N/A MET 5.A N THR 1.A O no hydrogen 3.476 N/A ILE 6.A N THR 2.A O no hydrogen 3.142 N/A ASP 7.A N THR 3.A O no hydrogen 2.874 N/A GLY 8.A N THR 4.A O no hydrogen 2.537 N/A ILE 9.A N MET 5.A O no hydrogen 3.013 N/A ARG 10.A N ILE 6.A O no hydrogen 2.838 N/A THR 11.A N ASP 7.A O no hydrogen 2.893 N/A THR 11.A OG1 ASP 7.A O no hydrogen 2.999 N/A THR 11.A OG1 GLY 8.A O no hydrogen 3.519 N/A ALA 12.A N GLY 8.A O no hydrogen 3.239 N/A LEU 13.A N ILE 9.A O no hydrogen 2.863 N/A ARG 14.A N ARG 10.A O no hydrogen 2.913 N/A SER 15.A N THR 11.A O no hydrogen 3.331 N/A SER 15.A OG SER 15.A O no hydrogen 2.411 N/A GLU 20.A N GLU 240.A OE2 no hydrogen 2.508 N/A SER 22.A N ARG 424.A O no hydrogen 3.046 N/A SER 24.A N VAL 230.A O no hydrogen 2.745 N/A SER 24.A OG ASP 27.A OD1 no hydrogen 3.404 N/A ASP 27.A N SER 24.A OG no hydrogen 2.735 N/A THR 28.A N SER 24.A O no hydrogen 3.083 N/A THR 28.A OG1 SER 24.A O no hydrogen 2.978 N/A THR 28.A OG1 VAL 230.A O no hydrogen 3.256 N/A SER 29.A N ALA 25.A O no hydrogen 2.951 N/A SER 29.A OG ALA 25.A O no hydrogen 2.542 N/A SER 29.A OG TYR 26.A O no hydrogen 3.412 N/A LEU 30.A N TYR 26.A O no hydrogen 3.090 N/A VAL 31.A N THR 28.A O no hydrogen 2.944 N/A ALA 32.A N THR 28.A O no hydrogen 3.209 N/A LEU 34.A N VAL 31.A O no hydrogen 3.222 N/A ARG 36.A NE ASP 38.A OD2 no hydrogen 2.631 N/A ARG 36.A NH1 GLY 42.A O no hydrogen 3.200 N/A LEU 37.A N GLN 44.A OE1 no hydrogen 3.255 N/A ASP 41.A N ASP 41.A OD1 no hydrogen 2.406 N/A GLN 44.A N LEU 34.A O no hydrogen 2.791 N/A THR 48.A N PHE 45.A O no hydrogen 3.189 N/A THR 48.A OG1 PHE 45.A O no hydrogen 2.777 N/A ASP 50.A N PRO 46.A O no hydrogen 3.020 N/A TRP 51.A N SER 47.A O no hydrogen 3.068 N/A ILE 52.A N THR 48.A O no hydrogen 2.980 N/A VAL 53.A N ILE 49.A O no hydrogen 3.083 N/A GLN 54.A N ASP 50.A O no hydrogen 3.429 N/A ASN 55.A N TRP 51.A O no hydrogen 3.173 N/A ASN 55.A N ILE 52.A O no hydrogen 2.987 N/A LEU 57.A N SER 61.A O no hydrogen 2.910 N/A GLY 60.A N LEU 57.A O no hydrogen 2.771 N/A SER 61.A N ASP 59.A OD1 no hydrogen 3.219 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.429 N/A TRP 62.A N THR 77.A OG1 no hydrogen 2.773 N/A ASP 64.A N ASP 72.A OD2 no hydrogen 3.158 N/A MET 70.A N GLU 111.A OE1 no hydrogen 3.150 N/A GLY 71.A N GLU 111.A OE2 no hydrogen 2.253 N/A ARG 73.A N MET 69.A O no hydrogen 2.916 N/A ARG 73.A NH2 ASP 59.A OD1 no hydrogen 3.518 N/A ILE 74.A N MET 70.A O no hydrogen 3.008 N/A MET 75.A N GLY 71.A O no hydrogen 3.471 N/A SER 76.A N ASP 72.A O no hydrogen 3.252 N/A SER 76.A OG TRP 62.A O no hydrogen 2.459 N/A SER 76.A OG ASP 72.A O no hydrogen 2.810 N/A SER 76.A OG ARG 73.A O no hydrogen 3.485 N/A THR 77.A N ARG 73.A O no hydrogen 2.702 N/A THR 77.A OG1 ARG 73.A O no hydrogen 2.337 N/A LEU 78.A N ILE 74.A O no hydrogen 2.732 N/A ALA 79.A N MET 75.A O no hydrogen 3.054 N/A CYS 80.A N SER 76.A O no hydrogen 3.312 N/A CYS 80.A SG SER 76.A O no hydrogen 3.442 N/A VAL 81.A N THR 77.A O no hydrogen 3.363 N/A VAL 82.A N LEU 78.A O no hydrogen 2.781 N/A ALA 83.A N ALA 79.A O no hydrogen 3.026 N/A LEU 84.A N CYS 80.A O no hydrogen 2.751 N/A LYS 85.A N VAL 81.A O no hydrogen 2.622 N/A TRP 87.A N ALA 83.A O no hydrogen 3.193 N/A TRP 87.A NE1 ALA 32.A O no hydrogen 3.055 N/A ASN 88.A N LYS 85.A O no hydrogen 2.716 N/A ASN 88.A ND2 ASN 88.A O no hydrogen 3.112 N/A ILE 89.A N LEU 84.A O no hydrogen 3.081 N/A LYS 93.A NZ ASP 92.A OD2 no hydrogen 3.327 N/A CYS 94.A N HIS 90.A O no hydrogen 2.799 N/A CYS 94.A SG VAL 81.A O no hydrogen 3.966 N/A GLU 95.A N THR 91.A O no hydrogen 3.078 N/A GLU 95.A N ASP 92.A O no hydrogen 3.203 N/A ARG 96.A N ASP 92.A O no hydrogen 3.320 N/A LEU 99.A N GLU 95.A O no hydrogen 3.074 N/A ILE 101.A N GLY 97.A O no hydrogen 3.266 N/A GLN 102.A N LEU 98.A O no hydrogen 3.070 N/A GLN 102.A NE2 ASP 137.A O no hydrogen 2.945 N/A GLU 103.A N LEU 99.A O no hydrogen 2.760 N/A GLU 103.A N PHE 100.A O no hydrogen 3.205 N/A ASN 104.A N PHE 100.A O no hydrogen 3.005 N/A ASN 104.A ND2 PHE 100.A O no hydrogen 3.585 N/A ARG 107.A N ASN 104.A O no hydrogen 2.969 N/A LEU 108.A N MET 105.A O no hydrogen 3.001 N/A HIS 110.A N ARG 107.A O no hydrogen 3.013 N/A VAL 118.A N GLY 419.A O no hydrogen 2.943 N/A ILE 122.A N GLY 119.A O no hydrogen 3.030 N/A ALA 123.A N GLY 119.A O no hydrogen 2.802 N/A LEU 124.A N PHE 120.A O no hydrogen 3.126 N/A LEU 127.A N LEU 124.A O no hydrogen 2.721 N/A LEU 128.A N LEU 124.A O no hydrogen 3.136 N/A ASP 129.A N PRO 125.A O no hydrogen 3.507 N/A ALA 131.A N LEU 127.A O no hydrogen 2.973 N/A LYS 132.A N LEU 128.A O no hydrogen 2.638 N/A LYS 132.A NZ ASP 129.A OD1 no hydrogen 3.562 N/A ASP 133.A N ASP 129.A O no hydrogen 3.144 N/A LEU 134.A N MET 130.A O no hydrogen 3.338 N/A ASP 135.A N LYS 132.A O no hydrogen 3.010 N/A LEU 136.A N TYR 140.A OH no hydrogen 3.377 N/A TYR 140.A N ILE 138.A O no hydrogen 2.837 N/A TYR 140.A OH LEU 136.A O no hydrogen 2.592 N/A LEU 145.A N GLU 142.A O no hydrogen 2.982 N/A ILE 148.A N LEU 145.A O no hydrogen 2.730 N/A TYR 149.A N LEU 145.A O no hydrogen 2.795 N/A ALA 150.A N LYS 146.A O no hydrogen 3.137 N/A ARG 152.A N TYR 149.A O no hydrogen 2.814 N/A LYS 155.A NZ GLU 121.A OE1 no hydrogen 2.383 N/A LEU 156.A N ARG 152.A O no hydrogen 2.517 N/A LEU 164.A N PRO 160.A O no hydrogen 3.088 N/A HIS 165.A N ARG 161.A O no hydrogen 3.242 N/A SER 166.A OG ASP 162.A O no hydrogen 2.520 N/A SER 166.A OG VAL 163.A O no hydrogen 3.399 N/A THR 170.A N GLU 325.A OE2 no hydrogen 2.954 N/A THR 170.A OG1 GLU 325.A OE1 no hydrogen 3.487 N/A LEU 171.A N THR 169.A OG1 no hydrogen 3.217 N/A LEU 172.A N THR 169.A O no hydrogen 3.194 N/A HIS 173.A N THR 170.A O no hydrogen 2.898 N/A HIS 173.A ND1 HIS 197.A O no hydrogen 2.901 N/A SER 174.A N LEU 171.A O no hydrogen 2.826 N/A LEU 175.A N SER 202.A OG no hydrogen 2.620 N/A ASP 182.A N HIS 165.A NE2 no hydrogen 3.207 N/A TRP 183.A NE1 GLN 209.A OE1 no hydrogen 3.154 N/A LYS 185.A N ASP 182.A O no hydrogen 3.161 N/A LYS 185.A N ASP 182.A OD2 no hydrogen 3.334 N/A LYS 185.A NZ ASP 182.A OD2 no hydrogen 3.438 N/A LEU 186.A N TRP 183.A O no hydrogen 2.842 N/A LEU 187.A N TRP 183.A O no hydrogen 2.851 N/A LEU 189.A N LEU 186.A O no hydrogen 2.886 N/A ARG 190.A NH1 LEU 187.A O no hydrogen 2.601 N/A CYS 191.A N SER 195.A O no hydrogen 2.905 N/A LEU 192.A N ASN 282.A O no hydrogen 3.283 N/A GLY 194.A N CYS 191.A O no hydrogen 2.721 N/A SER 195.A N ASP 193.A OD1 no hydrogen 3.278 N/A SER 195.A OG ASP 193.A OD1 no hydrogen 2.738 N/A PHE 196.A N THR 203.A OG1 no hydrogen 2.807 N/A HIS 197.A ND1 HIS 197.A O no hydrogen 2.881 N/A CYS 198.A N SER 195.A OG no hydrogen 3.139 N/A CYS 198.A SG HIS 279.A NE2 no hydrogen 3.304 N/A SER 199.A N PHE 196.A O no hydrogen 2.989 N/A SER 199.A OG HIS 173.A O no hydrogen 3.128 N/A ALA 201.A N ASP 27.A OD2 no hydrogen 2.871 N/A SER 202.A N SER 199.A OG no hydrogen 3.172 N/A SER 202.A OG LEU 172.A O no hydrogen 3.134 N/A SER 202.A OG HIS 173.A O no hydrogen 2.848 N/A SER 202.A OG GLU 176.A OE1 no hydrogen 2.986 N/A THR 203.A N SER 199.A O no hydrogen 3.112 N/A THR 203.A OG1 SER 199.A O no hydrogen 2.945 N/A ALA 204.A N PRO 200.A O no hydrogen 3.149 N/A THR 205.A N ALA 201.A O no hydrogen 3.147 N/A THR 205.A OG1 GLU 176.A O no hydrogen 3.238 N/A ALA 206.A N SER 202.A O no hydrogen 3.027 N/A PHE 207.A N ALA 204.A O no hydrogen 2.794 N/A GLN 208.A N ALA 204.A O no hydrogen 2.812 N/A GLN 209.A N THR 205.A O no hydrogen 3.397 N/A THR 210.A N PHE 207.A O no hydrogen 2.996 N/A ASP 212.A N THR 210.A O no hydrogen 2.675 N/A CYS 215.A N ASP 212.A O no hydrogen 3.209 N/A CYS 215.A SG GLY 194.A O no hydrogen 3.544 N/A PHE 216.A N ASP 212.A O no hydrogen 2.910 N/A GLU 217.A N GLN 213.A O no hydrogen 3.267 N/A TYR 218.A N CYS 215.A O no hydrogen 3.217 N/A TYR 218.A OH TYR 234.A O no hydrogen 2.962 N/A ASP 220.A N PHE 216.A O no hydrogen 2.823 N/A GLY 221.A N GLU 217.A O no hydrogen 2.710 N/A ILE 222.A N TYR 218.A O no hydrogen 3.081 N/A VAL 223.A N LEU 219.A O no hydrogen 3.052 N/A LYS 224.A N ASP 220.A O no hydrogen 2.872 N/A LYS 224.A NZ GLY 221.A O no hydrogen 3.164 N/A LYS 225.A N GLY 221.A O no hydrogen 3.241 N/A LYS 225.A NZ TYR 234.A OH no hydrogen 3.139 N/A PHE 226.A N ILE 222.A O no hydrogen 2.931 N/A ASN 227.A N LYS 224.A O no hydrogen 3.222 N/A GLY 228.A N VAL 223.A O no hydrogen 3.009 N/A CYS 232.A SG VAL 421.A O no hydrogen 3.893 N/A TYR 234.A N CYS 198.A O no hydrogen 2.975 N/A TYR 234.A OH GLY 19.A O no hydrogen 2.982 N/A LEU 236.A N GLU 18.A O no hydrogen 2.512 N/A VAL 238.A N HIS 279.A O no hydrogen 3.197 N/A TYR 239.A N HIS 279.A O no hydrogen 3.158 N/A GLU 240.A N LEU 236.A O no hydrogen 2.888 N/A ARG 241.A NH1 GLY 17.A O no hydrogen 3.341 N/A ARG 241.A NH1 ASP 237.A O no hydrogen 3.079 N/A LEU 242.A N VAL 238.A O no hydrogen 2.856 N/A TRP 243.A N TYR 239.A O no hydrogen 2.800 N/A ALA 244.A N GLU 240.A O no hydrogen 2.912 N/A VAL 245.A N ARG 241.A O no hydrogen 2.943 N/A ASP 246.A N LEU 242.A O no hydrogen 3.043 N/A ARG 247.A N TRP 243.A O no hydrogen 2.886 N/A ARG 247.A NH1 ASP 246.A OD2 no hydrogen 3.406 N/A LEU 248.A N ALA 244.A O no hydrogen 2.997 N/A THR 249.A N VAL 245.A O no hydrogen 2.739 N/A THR 249.A OG1 VAL 245.A O no hydrogen 3.192 N/A THR 249.A OG1 TYR 301.A OH no hydrogen 2.437 N/A ARG 250.A N ASP 246.A O no hydrogen 2.885 N/A ARG 250.A NH2 TYR 335.A OH no hydrogen 2.583 N/A LEU 251.A N ARG 247.A O no hydrogen 2.758 N/A GLY 252.A N THR 249.A O no hydrogen 2.933 N/A ILE 253.A N LEU 248.A O no hydrogen 3.291 N/A ARG 255.A NH1 GLY 252.A O no hydrogen 2.939 N/A ARG 255.A NH1 ASP 440.A OD2 no hydrogen 2.891 N/A ARG 255.A NH2 ASP 440.A OD1 no hydrogen 2.621 N/A ARG 255.A NH2 ASP 440.A OD2 no hydrogen 3.419 N/A HIS 256.A N ILE 253.A O no hydrogen 3.186 N/A PHE 257.A N SER 254.A O no hydrogen 2.750 N/A THR 258.A OG1 ARG 255.A O no hydrogen 3.425 N/A ILE 261.A N PHE 257.A O no hydrogen 2.819 N/A GLU 262.A N THR 258.A O no hydrogen 3.144 N/A ASP 263.A N SER 259.A O no hydrogen 3.027 N/A ASP 263.A N GLU 260.A O no hydrogen 3.121 N/A CYS 264.A N GLU 260.A O no hydrogen 3.326 N/A CYS 264.A SG GLU 260.A O no hydrogen 3.441 N/A CYS 264.A SG ILE 261.A O no hydrogen 3.830 N/A LEU 265.A N ILE 261.A O no hydrogen 2.677 N/A ASP 266.A N GLU 262.A O no hydrogen 3.381 N/A TYR 267.A N ASP 263.A O no hydrogen 3.201 N/A ILE 268.A N CYS 264.A O no hydrogen 3.141 N/A ILE 268.A N LEU 265.A O no hydrogen 2.988 N/A PHE 269.A N LEU 265.A O no hydrogen 3.056 N/A ARG 270.A N ASP 266.A O no hydrogen 2.919 N/A ASN 271.A N ILE 268.A O no hydrogen 2.851 N/A ASN 271.A ND2 TYR 267.A O no hydrogen 2.757 N/A TRP 272.A N PHE 269.A O no hydrogen 3.320 N/A THR 273.A OG1 GLY 276.A O no hydrogen 2.526 N/A ASP 275.A N THR 273.A OG1 no hydrogen 3.011 N/A GLY 276.A N THR 273.A O no hydrogen 3.196 N/A LEU 277.A N THR 291.A OG1 no hydrogen 2.502 N/A THR 280.A OG1 ASP 237.A OD1 no hydrogen 2.977 N/A THR 280.A OG1 ASP 237.A OD2 no hydrogen 2.944 N/A THR 280.A OG1 ASN 282.A OD1 no hydrogen 3.353 N/A LYS 281.A N ASP 237.A OD1 no hydrogen 2.670 N/A CYS 283.A SG VAL 285.A O no hydrogen 3.771 N/A LYS 286.A NZ CYS 283.A O no hydrogen 3.177 N/A LYS 286.A NZ PRO 284.A O no hydrogen 3.374 N/A ASP 287.A N LEU 277.A O no hydrogen 2.997 N/A ILE 288.A N CYS 321.A O no hydrogen 3.047 N/A ASP 290.A N ASP 287.A OD2 no hydrogen 2.947 N/A THR 291.A N ASP 287.A O no hydrogen 2.876 N/A THR 291.A OG1 LEU 277.A O no hydrogen 3.353 N/A THR 291.A OG1 ASP 287.A O no hydrogen 3.028 N/A ALA 292.A N ILE 288.A O no hydrogen 2.503 N/A MET 293.A N ASP 289.A O no hydrogen 3.098 N/A GLY 294.A N ASP 290.A O no hydrogen 2.876 N/A PHE 295.A N THR 291.A O no hydrogen 3.062 N/A ARG 296.A N ALA 292.A O no hydrogen 3.192 N/A ARG 296.A NH2 ASP 246.A OD1 no hydrogen 2.823 N/A LEU 297.A N MET 293.A O no hydrogen 3.004 N/A LEU 298.A N GLY 294.A O no hydrogen 2.878 N/A ARG 299.A N PHE 295.A O no hydrogen 2.928 N/A ARG 299.A NE LEU 343.A O no hydrogen 2.890 N/A ARG 299.A NH1 VAL 305.A O no hydrogen 2.683 N/A ARG 299.A NH2 ASP 348.A OD1 no hydrogen 2.792 N/A LEU 300.A N ARG 296.A O no hydrogen 2.642 N/A TYR 301.A N LEU 297.A O no hydrogen 3.048 N/A TYR 301.A N LEU 298.A O no hydrogen 3.100 N/A TYR 301.A OH THR 249.A OG1 no hydrogen 2.437 N/A GLY 302.A N ARG 299.A O no hydrogen 3.467 N/A TYR 303.A N LEU 298.A O no hydrogen 3.029 N/A TYR 303.A OH ASP 266.A OD1 no hydrogen 2.483 N/A CYS 308.A N ASP 306.A OD1 no hydrogen 3.219 N/A LEU 310.A N PRO 307.A O no hydrogen 2.754 N/A LYS 311.A N CYS 308.A O no hydrogen 3.340 N/A LYS 311.A NZ ASP 349.A OD2 no hydrogen 3.564 N/A LYS 312.A N VAL 309.A O no hydrogen 3.406 N/A LYS 312.A NZ ASP 275.A OD1 no hydrogen 2.681 N/A PHE 313.A N LEU 310.A O no hydrogen 2.609 N/A GLU 314.A N LYS 311.A O no hydrogen 3.198 N/A LYS 315.A N LYS 318.A O no hydrogen 3.000 N/A LYS 315.A NZ SER 326.A OG no hydrogen 3.420 N/A LYS 318.A N LYS 315.A O no hydrogen 3.222 N/A PHE 320.A N PHE 313.A O no hydrogen 3.276 N/A SER 329.A OG PHE 319.A O no hydrogen 3.319 N/A SER 330.A OG ASP 374.A OD1 no hydrogen 2.699 N/A VAL 331.A N ASP 374.A OD1 no hydrogen 3.180 N/A THR 332.A N ASP 374.A OD1 no hydrogen 2.968 N/A THR 332.A OG1 ASP 374.A OD2 no hydrogen 2.857 N/A TYR 335.A N VAL 331.A O no hydrogen 2.797 N/A ASN 336.A N THR 332.A O no hydrogen 2.771 N/A ASN 336.A ND2 ASP 289.A OD1 no hydrogen 3.033 N/A THR 337.A N PRO 333.A O no hydrogen 3.090 N/A THR 337.A OG1 MET 334.A O no hydrogen 3.402 N/A TYR 338.A N MET 334.A O no hydrogen 2.781 N/A ARG 339.A N TYR 335.A O no hydrogen 2.791 N/A ARG 339.A NE ASN 336.A OD1 no hydrogen 3.205 N/A ARG 339.A NH1 ASP 246.A OD1 no hydrogen 2.903 N/A ARG 339.A NH2 ASP 246.A OD2 no hydrogen 3.122 N/A ARG 339.A NH2 ASN 336.A OD1 no hydrogen 2.757 N/A ALA 340.A N ASN 336.A O no hydrogen 3.291 N/A SER 341.A N THR 337.A O no hydrogen 2.631 N/A SER 341.A OG TYR 338.A O no hydrogen 2.682 N/A GLN 342.A N ARG 339.A O no hydrogen 3.094 N/A LEU 343.A N ALA 340.A O no hydrogen 3.139 N/A LYS 344.A NZ GLU 356.A OE1 no hydrogen 2.934 N/A LYS 344.A NZ GLU 356.A OE2 no hydrogen 3.167 N/A PHE 345.A N ASP 348.A OD2 no hydrogen 3.031 N/A ASP 348.A N PHE 345.A O no hydrogen 3.132 N/A VAL 351.A N ASP 349.A OD1 no hydrogen 3.109 N/A ARG 354.A N GLY 350.A O no hydrogen 3.133 N/A ARG 354.A NH2 GLU 314.A OE2 no hydrogen 2.722 N/A ALA 355.A N VAL 351.A O no hydrogen 2.849 N/A GLU 356.A N LEU 352.A O no hydrogen 3.229 N/A VAL 357.A N GLY 353.A O no hydrogen 3.333 N/A PHE 358.A N ARG 354.A O no hydrogen 2.952 N/A CYS 359.A N ALA 355.A O no hydrogen 2.948 N/A CYS 359.A SG THR 337.A OG1 no hydrogen 3.341 N/A CYS 359.A SG ALA 355.A O no hydrogen 3.525 N/A ARG 360.A N GLU 356.A O no hydrogen 2.935 N/A ARG 360.A NH1 MET 390.A O no hydrogen 2.677 N/A SER 361.A N VAL 357.A O no hydrogen 3.295 N/A PHE 362.A N PHE 358.A O no hydrogen 2.619 N/A LEU 363.A N CYS 359.A O no hydrogen 2.755 N/A GLN 364.A N ARG 360.A O no hydrogen 2.911 N/A ASP 365.A N SER 361.A O no hydrogen 3.037 N/A ARG 366.A N LEU 363.A O no hydrogen 3.233 N/A ARG 367.A N GLN 364.A O no hydrogen 2.972 N/A ARG 367.A NE GLN 364.A OE1 no hydrogen 3.380 N/A ARG 367.A NH1 GLU 387.A OE1 no hydrogen 2.254 N/A ARG 367.A NH2 GLN 364.A OE1 no hydrogen 3.078 N/A SER 369.A N ARG 367.A O no hydrogen 2.928 N/A LYS 373.A NZ ASN 370.A O no hydrogen 2.960 N/A LYS 375.A N SER 330.A OG no hydrogen 3.012 N/A ALA 377.A N ASP 374.A OD2 no hydrogen 3.168 N/A ILE 378.A N VAL 416.A O no hydrogen 2.957 N/A LYS 380.A N ASP 415.A OD1 no hydrogen 3.290 N/A LYS 380.A NZ TYR 410.A O no hydrogen 3.484 N/A GLY 384.A N ASP 381.A OD1 no hydrogen 2.764 N/A VAL 386.A N ILE 382.A O no hydrogen 3.274 N/A GLU 387.A N PRO 383.A O no hydrogen 2.451 N/A TYR 388.A N GLY 384.A O no hydrogen 2.983 N/A TYR 388.A OH SER 397.A OG no hydrogen 2.823 N/A ALA 389.A N GLU 385.A O no hydrogen 3.361 N/A MET 390.A N VAL 386.A O no hydrogen 3.008 N/A MET 390.A N GLU 387.A O no hydrogen 2.932 N/A ASP 391.A N GLU 387.A O no hydrogen 2.743 N/A TYR 392.A N TYR 388.A O no hydrogen 2.617 N/A ALA 396.A N PRO 393.A O no hydrogen 3.181 N/A SER 397.A N TRP 394.A O no hydrogen 3.021 N/A SER 397.A OG TYR 388.A OH no hydrogen 2.823 N/A ARG 400.A N ALA 485.A O no hydrogen 3.210 N/A GLU 402.A N LEU 398.A O no hydrogen 3.088 N/A THR 403.A N PRO 399.A O no hydrogen 3.078 N/A THR 403.A OG1 ARG 250.A O no hydrogen 3.229 N/A THR 403.A OG1 PRO 399.A O no hydrogen 2.616 N/A ARG 404.A N ARG 400.A O no hydrogen 2.859 N/A ARG 404.A NE LYS 682.A O no hydrogen 2.825 N/A ARG 404.A NE GLN 686.A O no hydrogen 3.462 N/A ARG 404.A NH1 ARG 404.A O no hydrogen 2.983 N/A ARG 404.A NH1 ASP 408.A OD2 no hydrogen 3.196 N/A ARG 404.A NH2 GLN 686.A O no hydrogen 2.899 N/A LEU 405.A N ILE 401.A O no hydrogen 2.932 N/A TYR 406.A N GLU 402.A O no hydrogen 2.776 N/A LEU 407.A N THR 403.A O no hydrogen 2.973 N/A LEU 407.A N ARG 404.A O no hydrogen 3.222 N/A ASP 408.A N LEU 405.A O no hydrogen 3.095 N/A GLN 409.A N TYR 406.A O no hydrogen 2.762 N/A TYR 410.A N TYR 406.A O no hydrogen 2.732 N/A TYR 410.A OH PHE 428.A O no hydrogen 2.395 N/A TYR 410.A OH ASN 430.A O no hydrogen 3.274 N/A SER 413.A N ASP 431.A OD1 no hydrogen 3.389 N/A SER 413.A OG ASP 431.A OD1 no hydrogen 3.093 N/A SER 413.A OG ASP 431.A OD2 no hydrogen 2.464 N/A GLY 414.A N GLY 411.A O no hydrogen 3.311 N/A ASP 415.A N GLY 412.A O no hydrogen 3.445 N/A VAL 416.A N ILE 378.A O no hydrogen 3.094 N/A TRP 417.A N HIS 423.A O no hydrogen 2.881 N/A ILE 418.A N TRP 376.A O no hydrogen 3.111 N/A GLY 419.A N VAL 421.A O no hydrogen 2.870 N/A LYS 420.A NZ HIS 173.A O no hydrogen 2.603 N/A LYS 420.A NZ GLU 176.A OE1 no hydrogen 2.410 N/A LYS 420.A NZ SER 199.A OG no hydrogen 3.137 N/A HIS 423.A N TRP 417.A O no hydrogen 2.912 N/A ARG 424.A N SER 22.A OG no hydrogen 3.005 N/A ARG 424.A NE ASP 64.A OD1 no hydrogen 3.295 N/A ARG 424.A NE ASP 64.A OD2 no hydrogen 2.844 N/A CYS 429.A N MET 425.A O no hydrogen 3.106 N/A CYS 429.A SG ASP 415.A OD2 no hydrogen 3.385 N/A TYR 433.A N ASN 430.A OD1 no hydrogen 3.452 N/A LYS 435.A N ASP 431.A O no hydrogen 2.945 N/A ALA 436.A N LEU 432.A O no hydrogen 2.794 N/A ALA 437.A N TYR 433.A O no hydrogen 2.940 N/A LYS 438.A N LEU 434.A O no hydrogen 2.970 N/A ALA 439.A N LYS 435.A O no hydrogen 3.119 N/A ASP 440.A N ALA 436.A O no hydrogen 2.999 N/A PHE 441.A N ALA 437.A O no hydrogen 2.830 N/A SER 442.A N LYS 438.A O no hydrogen 2.831 N/A ASN 443.A N ALA 439.A O no hydrogen 3.158 N/A PHE 444.A N ASP 440.A O no hydrogen 3.304 N/A GLN 445.A N PHE 441.A O no hydrogen 2.934 N/A GLN 445.A NE2 VAL 683.A O no hydrogen 2.687 N/A GLN 445.A NE2 GLN 686.A O no hydrogen 3.688 N/A LYS 446.A N SER 442.A O no hydrogen 2.723 N/A LYS 446.A NZ SER 442.A OG no hydrogen 3.208 N/A GLU 447.A N ASN 443.A O no hydrogen 3.458 N/A CYS 448.A N PHE 444.A O no hydrogen 2.943 N/A CYS 448.A SG PHE 444.A O no hydrogen 3.522 N/A CYS 448.A SG TYR 480.A OH no hydrogen 3.158 N/A ARG 449.A N GLN 445.A O no hydrogen 3.072 N/A ARG 449.A NE ILE 684.A O no hydrogen 3.266 N/A ARG 449.A NH2 ILE 684.A O no hydrogen 3.362 N/A VAL 450.A N LYS 446.A O no hydrogen 3.220 N/A GLU 451.A N GLU 447.A O no hydrogen 3.028 N/A LEU 452.A N CYS 448.A O no hydrogen 2.822 N/A ASN 453.A N ARG 449.A O no hydrogen 2.986 N/A ASN 453.A ND2 ARG 449.A O no hydrogen 3.025 N/A GLY 454.A N VAL 450.A O no hydrogen 3.286 N/A LEU 455.A N GLU 451.A O no hydrogen 2.812 N/A ARG 456.A N LEU 452.A O no hydrogen 2.794 N/A ARG 457.A N ASN 453.A O no hydrogen 2.831 N/A TRP 458.A N GLY 454.A O no hydrogen 2.681 N/A TRP 458.A NE1 LEU 532.A O no hydrogen 2.826 N/A TYR 459.A N LEU 455.A O no hydrogen 2.683 N/A LEU 460.A N ARG 456.A O no hydrogen 3.114 N/A ARG 461.A N ARG 457.A O no hydrogen 2.763 N/A SER 462.A N TRP 458.A O no hydrogen 3.154 N/A SER 462.A OG TRP 458.A O no hydrogen 3.234 N/A SER 462.A OG TYR 459.A O no hydrogen 2.962 N/A ASN 463.A N LEU 460.A O no hydrogen 2.401 N/A LEU 464.A N TYR 459.A O no hydrogen 3.429 N/A LYS 466.A N ASN 463.A O no hydrogen 3.499 N/A PHE 467.A N LEU 464.A O no hydrogen 3.469 N/A GLY 468.A N GLU 465.A O no hydrogen 3.227 N/A THR 474.A N ASP 471.A O no hydrogen 3.349 N/A THR 474.A OG1 ASP 471.A O no hydrogen 3.420 N/A THR 475.A OG1 ASP 471.A O no hydrogen 3.499 N/A LEU 476.A N PRO 472.A O no hydrogen 3.016 N/A MET 477.A N GLN 473.A O no hydrogen 3.341 N/A THR 478.A N THR 474.A O no hydrogen 2.895 N/A THR 478.A OG1 THR 474.A O no hydrogen 3.060 N/A THR 478.A OG1 THR 475.A O no hydrogen 3.459 N/A SER 479.A N THR 475.A O no hydrogen 3.325 N/A TYR 480.A N LEU 476.A O no hydrogen 2.866 N/A TYR 480.A OH GLU 451.A OE1 no hydrogen 2.390 N/A PHE 481.A N MET 477.A O no hydrogen 2.894 N/A LEU 482.A N THR 478.A O no hydrogen 2.671 N/A SER 484.A N TYR 480.A O no hydrogen 2.843 N/A SER 484.A OG TYR 480.A O no hydrogen 3.299 N/A SER 484.A OG PHE 481.A O no hydrogen 3.047 N/A ALA 485.A N PHE 481.A O no hydrogen 2.722 N/A ASN 486.A N ALA 483.A O no hydrogen 3.382 N/A ASN 486.A ND2 LEU 482.A O no hydrogen 2.952 N/A ILE 487.A N ALA 483.A O no hydrogen 2.929 N/A GLU 489.A N GLU 489.A OE1 no hydrogen 2.624 N/A ARG 492.A NE GLU 489.A OE1 no hydrogen 3.565 N/A ARG 492.A NH2 GLU 495.A OE1 no hydrogen 2.625 N/A GLU 495.A N ARG 492.A O no hydrogen 2.937 N/A ARG 496.A N ARG 492.A O no hydrogen 3.161 N/A ARG 496.A NE GLU 451.A OE1 no hydrogen 2.824 N/A ARG 496.A NE GLU 451.A OE2 no hydrogen 3.310 N/A ARG 496.A NH1 ILE 487.A O no hydrogen 2.890 N/A ARG 496.A NH1 GLU 489.A O no hydrogen 3.397 N/A ARG 496.A NH2 GLU 451.A OE2 no hydrogen 2.699 N/A ARG 496.A NH2 GLU 489.A O no hydrogen 3.509 N/A LEU 497.A N ALA 493.A O no hydrogen 3.166 N/A GLY 498.A N ALA 494.A O no hydrogen 3.374 N/A TRP 499.A N GLU 495.A O no hydrogen 2.617 N/A ALA 500.A N ARG 496.A O no hydrogen 2.934 N/A ARG 501.A N LEU 497.A O no hydrogen 2.619 N/A VAL 502.A N GLY 498.A O no hydrogen 2.788 N/A ALA 503.A N TRP 499.A O no hydrogen 2.737 N/A LEU 504.A N ALA 500.A O no hydrogen 2.915 N/A LEU 505.A N ARG 501.A O no hydrogen 2.801 N/A ALA 506.A N VAL 502.A O no hydrogen 2.840 N/A ASP 507.A N ALA 503.A O no hydrogen 2.787 N/A ALA 508.A N LEU 504.A O no hydrogen 2.642 N/A VAL 509.A N LEU 505.A O no hydrogen 2.783 N/A SER 510.A N ALA 506.A O no hydrogen 2.864 N/A SER 510.A OG ALA 506.A O no hydrogen 3.460 N/A SER 511.A N ASP 507.A O no hydrogen 2.789 N/A SER 511.A OG PHE 467.A O no hydrogen 3.212 N/A SER 511.A OG GLY 468.A O no hydrogen 2.952 N/A HIS 512.A N ALA 508.A O no hydrogen 3.087 N/A PHE 513.A N VAL 509.A O no hydrogen 2.632 N/A ARG 514.A N SER 510.A O no hydrogen 2.805 N/A ARG 515.A N SER 511.A O no hydrogen 2.986 N/A ILE 516.A N HIS 512.A O no hydrogen 3.432 N/A GLY 517.A N PHE 513.A O no hydrogen 3.169 N/A GLY 518.A N PHE 513.A O no hydrogen 3.204 N/A ASN 521.A N GLY 518.A O no hydrogen 3.205 N/A SER 522.A N PRO 519.A O no hydrogen 2.900 N/A SER 522.A OG SER 524.A O no hydrogen 3.363 N/A SER 522.A OG SER 524.A OG no hydrogen 2.782 N/A SER 524.A N SER 522.A OG no hydrogen 3.092 N/A SER 524.A OG SER 522.A OG no hydrogen 2.782 N/A LEU 529.A N LEU 526.A O no hydrogen 3.062 N/A SER 531.A N GLU 528.A O no hydrogen 3.401 N/A LEU 532.A N LEU 529.A O no hydrogen 3.044 N/A VAL 533.A N ILE 530.A O no hydrogen 2.505 N/A SER 540.A OG ASP 537.A O no hydrogen 3.379 N/A SER 542.A OG TYR 539.A O no hydrogen 3.469 N/A ARG 544.A N SER 540.A O no hydrogen 3.185 N/A GLU 545.A N GLY 541.A O no hydrogen 3.434 N/A ALA 546.A N SER 542.A O no hydrogen 3.085 N/A TRP 547.A N LEU 543.A O no hydrogen 3.208 N/A TRP 547.A NE1 LEU 526.A O no hydrogen 3.178 N/A LYS 548.A N ARG 544.A O no hydrogen 2.802 N/A GLN 549.A N GLU 545.A O no hydrogen 2.813 N/A TRP 550.A N ALA 546.A O no hydrogen 2.960 N/A LEU 551.A N TRP 547.A O no hydrogen 2.895 N/A MET 552.A N LYS 548.A O no hydrogen 2.966 N/A ALA 553.A N GLN 549.A O no hydrogen 2.974 N/A TRP 554.A N TRP 550.A O no hydrogen 2.990 N/A TRP 554.A NE1 SER 510.A OG no hydrogen 2.953 N/A THR 555.A N LEU 551.A O no hydrogen 2.976 N/A THR 555.A OG1 LEU 551.A O no hydrogen 3.228 N/A THR 555.A OG1 MET 552.A O no hydrogen 2.507 N/A ALA 556.A N MET 552.A O no hydrogen 3.082 N/A ALA 556.A N ALA 553.A O no hydrogen 3.083 N/A LYS 557.A N ALA 553.A O no hydrogen 2.861 N/A LYS 557.A NZ ASP 567.A OD2 no hydrogen 2.450 N/A SER 559.A OG GLU 558.A O no hydrogen 2.453 N/A SER 560.A OG LYS 557.A O no hydrogen 2.735 N/A GLU 565.A N SER 563.A OG no hydrogen 2.955 N/A THR 568.A N ILE 564.A O no hydrogen 2.831 N/A THR 568.A OG1 ILE 564.A O no hydrogen 3.169 N/A THR 568.A OG1 GLU 565.A O no hydrogen 2.927 N/A ALA 569.A N GLU 565.A O no hydrogen 3.086 N/A ILE 570.A N GLY 566.A O no hydrogen 2.854 N/A LEU 571.A N ASP 567.A O no hydrogen 2.704 N/A LEU 572.A N THR 568.A O no hydrogen 2.986 N/A VAL 573.A N ALA 569.A O no hydrogen 2.990 N/A ARG 574.A N ILE 570.A O no hydrogen 2.783 N/A ARG 574.A NE GLU 599.A OE2 no hydrogen 2.991 N/A ARG 574.A NH2 GLU 599.A OE1 no hydrogen 2.994 N/A ALA 575.A N LEU 571.A O no hydrogen 2.691 N/A ILE 576.A N LEU 572.A O no hydrogen 2.619 N/A GLU 577.A N VAL 573.A O no hydrogen 3.060 N/A ILE 578.A N ARG 574.A O no hydrogen 3.202 N/A PHE 579.A N ALA 575.A O no hydrogen 2.956 N/A GLY 580.A N ILE 576.A O no hydrogen 3.040 N/A GLY 580.A N GLU 577.A O no hydrogen 3.184 N/A GLY 581.A N GLU 577.A O no hydrogen 2.799 N/A GLY 581.A N ILE 578.A O no hydrogen 2.973 N/A ARG 582.A NE GLU 577.A OE2 no hydrogen 2.956 N/A ARG 582.A NH1 GLU 495.A OE2 no hydrogen 3.246 N/A ARG 582.A NH2 GLU 495.A OE2 no hydrogen 2.576 N/A ARG 582.A NH2 GLU 577.A OE2 no hydrogen 2.931 N/A ASP 591.A N GLN 588.A O no hydrogen 2.969 N/A TRP 593.A N ARG 589.A O no hydrogen 3.155 N/A GLU 594.A N PRO 590.A O no hydrogen 2.880 N/A TYR 595.A N ASP 591.A O no hydrogen 2.994 N/A TYR 595.A OH GLU 599.A OE2 no hydrogen 2.643 N/A SER 596.A N LEU 592.A O no hydrogen 2.754 N/A GLN 597.A N TRP 593.A O no hydrogen 2.812 N/A LEU 598.A N GLU 594.A O no hydrogen 3.360 N/A GLU 599.A N TYR 595.A O no hydrogen 3.210 N/A GLN 600.A N SER 596.A O no hydrogen 3.044 N/A LEU 601.A N GLN 597.A O no hydrogen 2.775 N/A THR 602.A N LEU 598.A O no hydrogen 2.902 N/A THR 602.A OG1 LEU 598.A O no hydrogen 3.034 N/A SER 603.A N GLU 599.A O no hydrogen 2.941 N/A SER 604.A N GLN 600.A O no hydrogen 2.742 N/A SER 604.A OG GLU 635.A OE1 no hydrogen 2.913 N/A ILE 605.A N LEU 601.A O no hydrogen 2.624 N/A CYS 606.A N THR 602.A O no hydrogen 3.036 N/A CYS 606.A SG THR 602.A O no hydrogen 3.264 N/A CYS 607.A N SER 603.A O no hydrogen 3.016 N/A CYS 607.A SG SER 563.A O no hydrogen 3.696 N/A LYS 608.A N SER 604.A O no hydrogen 3.133 N/A LEU 609.A N ILE 605.A O no hydrogen 2.706 N/A SER 610.A N CYS 606.A O no hydrogen 2.963 N/A SER 610.A OG CYS 606.A O no hydrogen 3.414 N/A SER 610.A OG CYS 607.A O no hydrogen 3.048 N/A ARG 611.A N LYS 608.A O no hydrogen 3.097 N/A ARG 612.A N LYS 608.A O no hydrogen 3.337 N/A ARG 612.A N LEU 609.A O no hydrogen 3.224 N/A ARG 612.A NH1 GLN 616.A OE1 no hydrogen 2.961 N/A ARG 612.A NH2 ASP 629.A OD1 no hydrogen 2.497 N/A VAL 613.A N LEU 609.A O no hydrogen 3.266 N/A ALA 615.A N ARG 611.A O no hydrogen 3.154 N/A GLN 616.A N ARG 612.A O no hydrogen 2.424 N/A ASN 618.A N GLN 616.A O no hydrogen 2.668 N/A ASN 618.A N GLU 620.A OE1 no hydrogen 2.881 N/A ASN 618.A ND2 LEU 614.A O no hydrogen 3.571 N/A VAL 625.A N SER 621.A O no hydrogen 3.256 N/A GLU 626.A N THR 622.A O no hydrogen 2.927 N/A GLU 627.A N GLU 623.A O no hydrogen 3.206 N/A ASP 629.A N VAL 625.A O no hydrogen 2.701 N/A GLN 630.A N GLU 626.A O no hydrogen 2.869 N/A GLN 631.A N GLU 627.A O no hydrogen 3.045 N/A VAL 632.A N ILE 628.A O no hydrogen 2.823 N/A ASP 633.A N ASP 629.A O no hydrogen 2.974 N/A LEU 634.A N GLN 630.A O no hydrogen 2.962 N/A GLU 635.A N GLN 631.A O no hydrogen 3.401 N/A MET 636.A N VAL 632.A O no hydrogen 3.031 N/A GLN 637.A N ASP 633.A O no hydrogen 3.263 N/A GLU 638.A N LEU 634.A O no hydrogen 3.395 N/A LEU 639.A N GLU 635.A O no hydrogen 2.851 N/A THR 640.A N MET 636.A O no hydrogen 2.482 N/A THR 640.A OG1 MET 636.A O no hydrogen 2.703 N/A ARG 641.A N GLN 637.A O no hydrogen 2.684 N/A ARG 641.A NE GLU 638.A OE1 no hydrogen 3.009 N/A ARG 641.A NH1 GLU 638.A OE1 no hydrogen 3.246 N/A ARG 641.A NH1 GLU 638.A OE2 no hydrogen 2.750 N/A ARG 641.A NH2 GLN 645.A OE1 no hydrogen 3.455 N/A ARG 642.A N GLU 638.A O no hydrogen 3.022 N/A VAL 643.A N LEU 639.A O no hydrogen 2.910 N/A LEU 644.A N THR 640.A O no hydrogen 3.132 N/A GLN 645.A N ARG 641.A O no hydrogen 2.965 N/A GLY 646.A N GLY 302.A O no hydrogen 3.230 N/A SER 648.A N GLN 645.A O no hydrogen 3.361 N/A SER 648.A OG ILE 650.A O no hydrogen 3.461 N/A ARG 652.A NH1 GLU 656.A OE2 no hydrogen 3.210 N/A LEU 653.A N ASN 651.A OD1 no hydrogen 3.193 N/A THR 654.A OG1 GLU 577.A OE1 no hydrogen 2.722 N/A ARG 655.A N ASN 651.A O no hydrogen 3.202 N/A ARG 655.A NE VAL 643.A O no hydrogen 2.671 N/A GLU 656.A N ARG 652.A O no hydrogen 2.843 N/A THR 657.A N LEU 653.A O no hydrogen 3.082 N/A THR 657.A OG1 GLU 577.A OE2 no hydrogen 3.311 N/A THR 657.A OG1 LEU 653.A O no hydrogen 2.623 N/A PHE 658.A N THR 654.A O no hydrogen 3.217 N/A LEU 659.A N ARG 655.A O no hydrogen 3.223 N/A HIS 660.A N GLU 656.A O no hydrogen 2.842 N/A VAL 661.A N THR 657.A O no hydrogen 3.083 N/A VAL 662.A N PHE 658.A O no hydrogen 2.951 N/A LYS 663.A N LEU 659.A O no hydrogen 2.606 N/A LYS 663.A NZ SER 397.A O no hydrogen 3.060 N/A SER 664.A N HIS 660.A O no hydrogen 2.930 N/A SER 664.A OG VAL 661.A O no hydrogen 2.848 N/A PHE 665.A N VAL 661.A O no hydrogen 3.107 N/A CYS 666.A N VAL 662.A O no hydrogen 2.980 N/A CYS 666.A SG VAL 662.A O no hydrogen 3.883 N/A TYR 667.A N LYS 663.A O no hydrogen 2.770 N/A TYR 667.A OH HIS 679.A ND1 no hydrogen 2.282 N/A VAL 668.A N SER 664.A O no hydrogen 3.172 N/A ALA 669.A N PHE 665.A O no hydrogen 3.249 N/A TYR 670.A N CYS 666.A O no hydrogen 3.031 N/A TYR 670.A N TYR 667.A O no hydrogen 3.330 N/A TYR 670.A OH ASP 629.A OD1 no hydrogen 2.264 N/A CYS 671.A SG TYR 670.A O no hydrogen 3.317 N/A THR 675.A OG1 SER 672.A O no hydrogen 3.074 N/A ILE 676.A N SER 672.A O no hydrogen 2.852 N/A ASP 677.A N PRO 673.A O no hydrogen 3.302 N/A SER 678.A N GLU 674.A O no hydrogen 3.440 N/A SER 678.A OG THR 675.A O no hydrogen 2.517 N/A HIS 679.A N THR 675.A O no hydrogen 3.087 N/A HIS 679.A ND1 TYR 667.A OH no hydrogen 2.282 N/A ILE 680.A N ILE 676.A O no hydrogen 3.149 N/A ASP 681.A N ASP 677.A O no hydrogen 2.713 N/A LYS 682.A N SER 678.A O no hydrogen 2.837 N/A VAL 683.A N HIS 679.A O no hydrogen 2.709 N/A ILE 684.A N ILE 680.A O no hydrogen 3.115 N/A PHE 685.A N ASP 681.A O no hydrogen 2.999 N/A GLN 686.A N ASP 681.A O no hydrogen 2.688 N/A