Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vnc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 GLU 50.A OE1 no hydrogen 3.490 N/A ARG 2.A NH1 GLU 50.A OE2 no hydrogen 3.172 N/A ARG 2.A NH2 PRO 67.A O no hydrogen 2.701 N/A LEU 4.A N ARG 2.A O no hydrogen 2.621 N/A ARG 5.A N PHE 65.A O no hydrogen 3.342 N/A ASP 8.A N ASN 24.A OD1 no hydrogen 2.802 N/A GLY 13.A N SER 26.A O no hydrogen 2.838 N/A SER 14.A OG TYR 75.A OH no hydrogen 3.379 N/A ASN 15.A N ASN 24.A O no hydrogen 2.650 N/A ILE 17.A N GLY 22.A O no hydrogen 2.971 N/A ASP 21.A N GLU 18.A O no hydrogen 3.120 N/A VAL 23.A N VAL 66.A O no hydrogen 3.253 N/A ASN 24.A N ASN 15.A O no hydrogen 2.830 N/A ASN 24.A ND2 ASP 8.A O no hydrogen 2.748 N/A PHE 25.A N VAL 64.A O no hydrogen 2.946 N/A SER 26.A N GLY 13.A O no hydrogen 2.838 N/A SER 26.A OG PRO 9.A O no hydrogen 3.177 N/A SER 26.A OG PRO 11.A O no hydrogen 2.686 N/A SER 26.A OG GLY 13.A O no hydrogen 3.170 N/A LEU 27.A N TRP 62.A O no hydrogen 2.953 N/A SER 29.A N ASP 60.A O no hydrogen 2.931 N/A SER 29.A OG ILE 299.A O no hydrogen 3.045 N/A GLU 30.A N ASP 300.A OD2 no hydrogen 3.240 N/A ASN 31.A N ASP 300.A OD2 no hydrogen 3.129 N/A GLU 33.A N TYR 80.A O no hydrogen 2.626 N/A LYS 34.A NZ GLU 36.A OE2 no hydrogen 3.333 N/A GLU 36.A N ARG 78.A O no hydrogen 2.936 N/A LEU 37.A N ILE 52.A O no hydrogen 2.769 N/A LEU 38.A N ALA 76.A O no hydrogen 2.851 N/A LEU 39.A N GLU 50.A O no hydrogen 3.096 N/A TYR 40.A N LEU 74.A O no hydrogen 2.950 N/A ASN 44.A N SER 41.A O no hydrogen 2.924 N/A GLN 45.A NE2 LEU 42.A O no hydrogen 3.452 N/A GLU 50.A N LEU 39.A O no hydrogen 3.314 N/A ILE 52.A N LEU 37.A O no hydrogen 2.831 N/A VAL 54.A N VAL 35.A O no hydrogen 2.877 N/A THR 58.A N ILE 61.A O no hydrogen 2.857 N/A ILE 61.A N THR 58.A O no hydrogen 3.102 N/A TRP 62.A N LEU 27.A O no hydrogen 2.923 N/A TRP 62.A NE1 SER 29.A O no hydrogen 2.979 N/A HIS 63.A N ASN 56.A O no hydrogen 2.998 N/A VAL 64.A N PHE 25.A O no hydrogen 3.016 N/A PHE 65.A N ARG 5.A O no hydrogen 2.680 N/A VAL 66.A N VAL 23.A O no hydrogen 3.109 N/A GLY 68.A N ASP 21.A O no hydrogen 3.021 N/A GLY 72.A N VAL 143.A O no hydrogen 2.644 N/A GLN 73.A N ARG 70.A O no hydrogen 2.949 N/A TYR 75.A N SER 141.A O no hydrogen 2.823 N/A TYR 75.A OH ASP 99.A OD1 no hydrogen 2.626 N/A ALA 76.A N LEU 38.A O no hydrogen 2.764 N/A TYR 77.A N LEU 97.A O no hydrogen 3.382 N/A ARG 78.A N GLU 36.A O no hydrogen 2.981 N/A ARG 78.A NE PRO 93.A O no hydrogen 2.798 N/A ARG 78.A NH1 ASP 133.A OD2 no hydrogen 3.133 N/A ARG 78.A NH2 ASP 133.A OD2 no hydrogen 2.613 N/A TYR 80.A N LYS 34.A O no hydrogen 2.814 N/A TYR 80.A OH GLU 36.A OE1 no hydrogen 2.908 N/A TYR 83.A OH THR 128.A O no hydrogen 2.475 N/A LEU 87.A N LYS 84.A O no hydrogen 2.859 N/A GLY 88.A N PRO 85.A O no hydrogen 2.887 N/A LEU 89.A N LYS 84.A O no hydrogen 3.050 N/A PHE 91.A N PRO 82.A O no hydrogen 3.394 N/A LYS 95.A N ASN 92.A O no hydrogen 2.823 N/A LYS 95.A NZ ALA 114.A O no hydrogen 2.544 N/A VAL 96.A N SER 134.A OG no hydrogen 2.539 N/A LEU 97.A N TYR 77.A O no hydrogen 2.866 N/A ILE 98.A N LEU 294.A O no hydrogen 2.728 N/A ASP 99.A N SER 141.A OG no hydrogen 3.043 N/A TYR 101.A N ASP 99.A OD2 no hydrogen 3.258 N/A TYR 101.A OH ASP 338.A OD1 no hydrogen 2.464 N/A ALA 102.A N ASP 99.A O no hydrogen 3.149 N/A LYS 103.A NZ TYR 101.A O no hydrogen 3.517 N/A ASN 106.A N LYS 140.A O no hydrogen 2.963 N/A GLY 107.A N ILE 105.A O no hydrogen 3.059 N/A ILE 110.A N TYR 137.A O no hydrogen 2.920 N/A TRP 111.A NE1 ASP 221.A O no hydrogen 2.643 N/A VAL 115.A N ASN 112.A O no hydrogen 3.059 N/A TYR 118.A OH LEU 290.A O no hydrogen 2.555 N/A LYS 119.A N THR 128.A OG1 no hydrogen 3.019 N/A ASP 122.A N LYS 119.A O no hydrogen 3.472 N/A ASN 124.A N ASP 122.A OD1 no hydrogen 2.862 N/A LEU 127.A N ASN 124.A O no hydrogen 3.113 N/A THR 128.A N GLN 125.A O no hydrogen 3.074 N/A THR 128.A OG1 LYS 119.A O no hydrogen 3.529 N/A THR 128.A OG1 GLN 125.A O no hydrogen 2.457 N/A ASP 130.A N GLY 117.A O no hydrogen 3.171 N/A ARG 132.A N ASP 130.A OD1 no hydrogen 3.147 N/A ARG 132.A NE ASP 130.A OD1 no hydrogen 2.808 N/A ARG 132.A NE ASP 130.A OD2 no hydrogen 3.245 N/A ARG 132.A NH2 ASP 130.A OD2 no hydrogen 3.015 N/A SER 134.A N ASN 94.A O no hydrogen 3.166 N/A TYR 137.A N SER 134.A O no hydrogen 2.890 N/A LYS 140.A NZ GLN 45.A O no hydrogen 3.085 N/A LYS 140.A NZ GLY 135.A O no hydrogen 2.507 N/A LYS 140.A NZ VAL 138.A O no hydrogen 3.260 N/A VAL 142.A N ALA 104.A O no hydrogen 2.877 N/A VAL 143.A N GLN 73.A O no hydrogen 2.897 N/A TYR 147.A N ASN 145.A OD1 no hydrogen 3.329 N/A ASP 151.A N ASN 266.A OD1 no hydrogen 3.353 N/A ILE 156.A N ASP 152.A O no hydrogen 3.073 N/A LYS 160.A NZ ASP 350.A OD1 no hydrogen 3.240 N/A ASP 165.A N PRO 162.A O no hydrogen 3.010 N/A THR 166.A N LEU 163.A O no hydrogen 3.372 N/A THR 166.A OG1 PRO 162.A O no hydrogen 2.449 N/A VAL 167.A N THR 209.A OG1 no hydrogen 3.037 N/A ILE 168.A N PRO 530.A O no hydrogen 3.088 N/A TYR 169.A OH GLU 537.A OE2 no hydrogen 3.021 N/A GLU 170.A N ILE 532.A O no hydrogen 2.854 N/A VAL 171.A N GLU 212.A O no hydrogen 2.887 N/A HIS 172.A NE2 TYR 233.A O no hydrogen 2.746 N/A LYS 174.A N HIS 172.A ND1 no hydrogen 3.113 N/A LYS 174.A NZ ASP 552.A OD1 no hydrogen 3.332 N/A LYS 174.A NZ ASP 552.A OD2 no hydrogen 2.902 N/A GLY 175.A N HIS 172.A ND1 no hydrogen 3.395 N/A PHE 176.A N HIS 172.A O no hydrogen 3.183 N/A ARG 180.A N THR 177.A O no hydrogen 3.399 N/A ARG 180.A NH1 ASP 182.A OD1 no hydrogen 3.222 N/A ARG 180.A NH1 ASP 182.A OD2 no hydrogen 3.262 N/A LEU 183.A N ARG 180.A O no hydrogen 3.150 N/A ILE 187.A N PRO 184.A O no hydrogen 3.120 N/A ARG 188.A N GLU 185.A O no hydrogen 2.906 N/A ARG 188.A NE LEU 183.A O no hydrogen 2.511 N/A ARG 188.A NH2 LEU 181.A O no hydrogen 2.580 N/A ARG 188.A NH2 LEU 183.A O no hydrogen 2.753 N/A GLY 189.A N THR 177.A OG1 no hydrogen 2.916 N/A THR 190.A OG1 ILE 187.A O no hydrogen 2.675 N/A TYR 191.A N TYR 248.A O no hydrogen 2.920 N/A TYR 191.A OH GLU 245.A O no hydrogen 2.745 N/A GLY 193.A N THR 190.A OG1 no hydrogen 3.138 N/A LEU 194.A N THR 190.A O no hydrogen 2.953 N/A LEU 194.A N TYR 191.A O no hydrogen 3.247 N/A ALA 195.A N TYR 191.A O no hydrogen 3.319 N/A ALA 195.A N GLU 192.A O no hydrogen 3.254 N/A SER 196.A OG GLY 193.A O no hydrogen 3.056 N/A GLN 198.A N GLN 198.A OE1 no hydrogen 2.706 N/A GLN 198.A NE2 ASP 182.A OD1 no hydrogen 3.359 N/A ILE 200.A N SER 196.A O no hydrogen 2.896 N/A SER 201.A N GLU 197.A O no hydrogen 3.208 N/A SER 201.A OG GLU 197.A O no hydrogen 3.118 N/A SER 201.A OG GLN 198.A O no hydrogen 2.747 N/A TYR 202.A N GLN 198.A O no hydrogen 2.831 N/A TYR 202.A OH GLU 537.A OE2 no hydrogen 2.677 N/A LEU 203.A N MET 199.A O no hydrogen 2.938 N/A LYS 204.A N ILE 200.A O no hydrogen 2.927 N/A LYS 204.A NZ ALA 271.A O no hydrogen 3.019 N/A ASP 205.A N SER 201.A O no hydrogen 2.683 N/A LEU 206.A N TYR 202.A O no hydrogen 2.748 N/A GLY 207.A N LEU 203.A O no hydrogen 3.193 N/A THR 209.A N VAL 167.A O no hydrogen 3.059 N/A THR 209.A OG1 VAL 167.A O no hydrogen 3.403 N/A THR 209.A OG1 THR 210.A OG1 no hydrogen 2.955 N/A THR 210.A N VAL 167.A O no hydrogen 2.942 N/A THR 210.A OG1 THR 209.A OG1 no hydrogen 2.955 N/A THR 210.A OG1 GLU 274.A OE1 no hydrogen 3.167 N/A VAL 211.A N GLU 274.A O no hydrogen 2.993 N/A GLU 212.A N TYR 169.A O no hydrogen 2.741 N/A LEU 213.A N ILE 276.A O no hydrogen 2.921 N/A MET 214.A N VAL 171.A O no hydrogen 3.250 N/A PHE 219.A N GLU 245.A OE2 no hydrogen 3.121 N/A GLN 222.A N GLN 222.A OE1 no hydrogen 2.582 N/A GLN 222.A NE2 ASN 232.A OD1 no hydrogen 3.653 N/A LEU 225.A N GLN 222.A O no hydrogen 2.943 N/A THR 226.A N GLN 222.A O no hydrogen 3.063 N/A THR 226.A OG1 GLN 222.A O no hydrogen 3.336 N/A THR 226.A OG1 ARG 223.A O no hydrogen 3.200 N/A ASP 227.A N ARG 223.A O no hydrogen 2.875 N/A LYS 228.A NZ PHE 224.A O no hydrogen 3.028 N/A GLY 229.A N THR 226.A O no hydrogen 2.869 N/A LEU 230.A N LEU 225.A O no hydrogen 2.841 N/A ASN 232.A N ASP 221.A OD2 no hydrogen 2.602 N/A ASN 232.A ND2 PHE 549.A O no hydrogen 3.645 N/A TYR 233.A N PHE 549.A O no hydrogen 2.846 N/A TRP 234.A N PHE 549.A O no hydrogen 3.142 N/A TYR 236.A OH ASP 278.A OD2 no hydrogen 2.882 N/A ILE 239.A N HIS 218.A O no hydrogen 2.915 N/A ASN 240.A ND2 ASP 99.A O no hydrogen 3.175 N/A ASN 240.A ND2 ALA 102.A O no hydrogen 3.288 N/A PHE 242.A N ASN 240.A OD1 no hydrogen 2.778 N/A SER 243.A OG ALA 102.A O no hydrogen 2.514 N/A SER 243.A OG ASN 240.A OD1 no hydrogen 2.754 N/A GLU 245.A N VAL 216.A O no hydrogen 2.669 N/A ARG 247.A NH1 ASP 221.A OD2 no hydrogen 3.020 N/A ARG 247.A NH2 ASP 221.A OD2 no hydrogen 3.164 N/A TYR 248.A N GLU 245.A O no hydrogen 3.492 N/A TYR 248.A OH HIS 172.A NE2 no hydrogen 3.189 N/A TYR 248.A OH TYR 233.A O no hydrogen 3.368 N/A SER 249.A N CYS 246.A O no hydrogen 3.129 N/A SER 249.A OG GLY 252.A O no hydrogen 2.873 N/A SER 249.A OG SER 260.A OG no hydrogen 3.403 N/A SER 250.A OG GLU 192.A OE1 no hydrogen 3.264 N/A CYS 253.A SG CYS 246.A O no hydrogen 3.418 N/A LEU 259.A N GLY 255.A O no hydrogen 2.824 N/A SER 260.A N GLY 256.A O no hydrogen 2.834 N/A SER 260.A OG SER 249.A OG no hydrogen 3.403 N/A SER 260.A OG GLY 256.A O no hydrogen 2.339 N/A PHE 261.A N GLN 257.A O no hydrogen 3.115 N/A LYS 262.A N VAL 258.A O no hydrogen 2.995 N/A LYS 262.A NZ PRO 146.A O no hydrogen 3.281 N/A LYS 262.A NZ GLU 346.A O no hydrogen 3.151 N/A LYS 263.A N LEU 259.A O no hydrogen 2.761 N/A MET 264.A N SER 260.A O no hydrogen 2.676 N/A VAL 265.A N PHE 261.A O no hydrogen 2.869 N/A ASN 266.A N LYS 262.A O no hydrogen 3.141 N/A ASN 266.A ND2 ASP 151.A OD1 no hydrogen 2.924 N/A GLU 267.A N LYS 263.A O no hydrogen 3.069 N/A LEU 268.A N MET 264.A O no hydrogen 3.107 N/A HIS 269.A N VAL 265.A O no hydrogen 2.915 N/A HIS 269.A NE2 HIS 348.A O no hydrogen 2.732 N/A ASN 270.A N ASN 266.A O no hydrogen 3.069 N/A ALA 271.A N GLU 267.A O no hydrogen 3.016 N/A GLY 272.A N HIS 269.A O no hydrogen 2.814 N/A ILE 273.A N LEU 268.A O no hydrogen 2.922 N/A GLU 274.A N THR 209.A O no hydrogen 3.053 N/A VAL 275.A N ASP 350.A OD2 no hydrogen 2.756 N/A ILE 276.A N VAL 211.A O no hydrogen 2.780 N/A ILE 277.A N GLY 351.A O no hydrogen 3.167 N/A ASP 278.A N LEU 213.A O no hydrogen 2.918 N/A VAL 279.A N ARG 353.A O no hydrogen 2.825 N/A TYR 281.A OH SER 339.A OG no hydrogen 2.581 N/A ASN 282.A ND2 ASP 355.A O no hydrogen 3.038 N/A HIS 283.A ND1 THR 284.A O no hydrogen 3.312 N/A THR 284.A N ASN 323.A OD1 no hydrogen 2.723 N/A THR 284.A OG1 TYR 305.A OH no hydrogen 2.547 N/A ALA 285.A N PRO 238.A O no hydrogen 2.927 N/A GLY 287.A N THR 284.A O no hydrogen 3.254 N/A GLY 291.A N ASN 288.A O no hydrogen 2.946 N/A THR 293.A N VAL 115.A O no hydrogen 3.046 N/A THR 293.A OG1 PHE 116.A O no hydrogen 3.104 N/A LEU 294.A N GLU 286.A OE1 no hydrogen 2.969 N/A SER 295.A N GLU 286.A OE1 no hydrogen 2.809 N/A SER 295.A OG ILE 98.A O no hydrogen 2.820 N/A ARG 297.A N GLU 286.A OE1 no hydrogen 3.195 N/A ARG 297.A N GLU 286.A OE2 no hydrogen 2.697 N/A ARG 297.A NE PRO 292.A O no hydrogen 3.319 N/A ARG 297.A NH1 TYR 315.A OH no hydrogen 2.855 N/A ARG 297.A NH2 GLU 286.A O no hydrogen 2.446 N/A ARG 297.A NH2 PRO 292.A O no hydrogen 2.817 N/A ILE 299.A N SER 295.A O no hydrogen 2.818 N/A ASP 300.A N PHE 296.A O no hydrogen 2.896 N/A ASN 301.A ND2 GLY 88.A O no hydrogen 2.534 N/A THR 302.A OG1 GLY 88.A O no hydrogen 3.246 N/A ALA 303.A N ASP 300.A OD1 no hydrogen 3.068 N/A TYR 305.A N ASN 301.A O no hydrogen 3.230 N/A TYR 305.A N ALA 303.A O no hydrogen 2.737 N/A TYR 305.A OH THR 284.A OG1 no hydrogen 2.547 N/A TYR 305.A OH GLU 286.A OE2 no hydrogen 2.656 N/A MET 306.A N THR 324.A O no hydrogen 2.936 N/A GLN 308.A N TYR 314.A O no hydrogen 2.924 N/A ASN 311.A N GLN 308.A O no hydrogen 3.095 N/A ARG 313.A NE ASP 126.A OD2 no hydrogen 2.964 N/A ARG 313.A NH2 ASP 126.A OD1 no hydrogen 2.840 N/A ARG 313.A NH2 ASP 126.A OD2 no hydrogen 3.009 N/A TYR 314.A N ASN 311.A O no hydrogen 3.010 N/A TYR 315.A OH ASN 301.A OD1 no hydrogen 2.321 N/A LEU 316.A N MET 306.A O no hydrogen 2.789 N/A THR 319.A N ASP 317.A OD1 no hydrogen 3.128 N/A THR 319.A OG1 ASP 317.A OD1 no hydrogen 3.239 N/A THR 319.A OG1 THR 321.A OG1 no hydrogen 3.154 N/A GLY 320.A N ASP 317.A OD1 no hydrogen 2.529 N/A THR 321.A N ASP 317.A OD1 no hydrogen 2.934 N/A THR 321.A N THR 319.A OG1 no hydrogen 3.218 N/A THR 321.A OG1 THR 319.A OG1 no hydrogen 3.154 N/A ASN 323.A ND2 THR 284.A O no hydrogen 3.340 N/A ASN 323.A ND2 THR 284.A OG1 no hydrogen 2.934 N/A THR 324.A OG1 LEU 316.A O no hydrogen 3.055 N/A ASN 326.A N TYR 304.A O no hydrogen 2.544 N/A SER 328.A OG ASN 326.A OD1 no hydrogen 2.599 N/A HIS 329.A N ASN 326.A O no hydrogen 2.985 N/A ARG 331.A N HIS 329.A ND1 no hydrogen 3.197 N/A ARG 331.A NE ASP 60.A OD1 no hydrogen 3.116 N/A ILE 333.A N HIS 329.A O no hydrogen 3.210 N/A GLN 334.A N PRO 330.A O no hydrogen 2.954 N/A MET 335.A N ARG 331.A O no hydrogen 2.755 N/A VAL 336.A N VAL 332.A O no hydrogen 3.127 N/A LEU 337.A N ILE 333.A O no hydrogen 3.141 N/A ASP 338.A N GLN 334.A O no hydrogen 2.597 N/A SER 339.A N MET 335.A O no hydrogen 2.673 N/A SER 339.A OG PHE 241.A O no hydrogen 2.895 N/A SER 339.A OG TYR 281.A OH no hydrogen 2.581 N/A LEU 340.A N VAL 336.A O no hydrogen 2.985 N/A ARG 341.A N LEU 337.A O no hydrogen 2.944 N/A ARG 341.A NH1 ASP 380.A OD2 no hydrogen 3.012 N/A ARG 341.A NH2 ASP 338.A OD2 no hydrogen 2.832 N/A TYR 342.A N ASP 338.A O no hydrogen 2.837 N/A TRP 343.A N SER 339.A O no hydrogen 3.085 N/A TRP 343.A NE1 PHE 241.A O no hydrogen 2.812 N/A VAL 344.A N ARG 341.A O no hydrogen 3.269 N/A THR 345.A N ARG 341.A O no hydrogen 3.057 N/A THR 345.A OG1 ARG 341.A O no hydrogen 2.813 N/A GLU 346.A N TYR 342.A O no hydrogen 2.853 N/A HIS 348.A ND1 ASP 152.A OD2 no hydrogen 2.958 N/A VAL 349.A N TRP 343.A O no hydrogen 2.998 N/A ASP 350.A N VAL 275.A O no hydrogen 2.759 N/A PHE 352.A N LYS 387.A O no hydrogen 2.796 N/A ARG 353.A N ILE 277.A O no hydrogen 3.013 N/A ARG 353.A NH1 ASP 278.A OD1 no hydrogen 3.209 N/A ARG 353.A NH1 ASP 278.A OD2 no hydrogen 2.926 N/A ARG 353.A NH1 ASP 355.A OD2 no hydrogen 3.290 N/A PHE 354.A N ILE 389.A O no hydrogen 2.849 N/A ASP 355.A N VAL 279.A O no hydrogen 3.094 N/A ALA 358.A N GLU 391.A OE2 no hydrogen 2.706 N/A LEU 360.A N LEU 356.A O no hydrogen 2.888 N/A ALA 361.A N ALA 357.A O no hydrogen 2.833 N/A ARG 362.A N ALA 358.A O no hydrogen 2.928 N/A ARG 362.A NH2 ARG 362.A O no hydrogen 3.198 N/A GLU 363.A N ALA 359.A O no hydrogen 2.782 N/A LEU 364.A N LEU 360.A O no hydrogen 2.977 N/A TYR 365.A N ALA 361.A O no hydrogen 2.829 N/A SER 366.A N ARG 362.A O no hydrogen 2.877 N/A VAL 367.A N LEU 364.A O no hydrogen 3.134 N/A ASN 368.A N TYR 365.A O no hydrogen 2.981 N/A MET 369.A N LEU 364.A O no hydrogen 3.013 N/A THR 372.A OG1 MET 369.A O no hydrogen 3.305 N/A PHE 373.A N MET 369.A O no hydrogen 2.569 N/A PHE 374.A N LEU 370.A O no hydrogen 3.034 N/A ILE 375.A N ASN 371.A O no hydrogen 2.964 N/A ALA 376.A N THR 372.A O no hydrogen 2.877 N/A LEU 377.A N PHE 373.A O no hydrogen 3.268 N/A GLN 378.A N PHE 374.A O no hydrogen 3.209 N/A GLN 378.A N ILE 375.A O no hydrogen 3.158 N/A GLN 379.A N ILE 375.A O no hydrogen 3.027 N/A GLN 379.A NE2 ALA 376.A O no hydrogen 2.967 N/A ASP 380.A N ALA 376.A O no hydrogen 3.202 N/A ILE 382.A N ASP 380.A OD1 no hydrogen 2.813 N/A LEU 383.A N ASP 380.A OD1 no hydrogen 2.663 N/A SER 384.A N ASP 380.A O no hydrogen 3.184 N/A SER 384.A OG ASP 380.A O no hydrogen 2.943 N/A GLN 385.A N ILE 382.A O no hydrogen 3.349 N/A LYS 387.A N ASP 350.A O no hydrogen 2.980 N/A LYS 387.A NZ VAL 161.A O no hydrogen 3.051 N/A LEU 388.A N GLN 408.A O no hydrogen 3.013 N/A ILE 389.A N PHE 352.A O no hydrogen 2.759 N/A ALA 390.A N ALA 410.A O no hydrogen 2.683 N/A TYR 400.A OH GLU 411.A OE1 no hydrogen 3.000 N/A GLN 401.A N GLY 399.A O no hydrogen 2.300 N/A GLY 403.A N ASN 371.A OD1 no hydrogen 2.970 N/A TRP 409.A N PRO 406.A O no hydrogen 3.099 N/A TRP 409.A NE1 GLU 411.A OE2 no hydrogen 2.980 N/A ALA 410.A N LEU 388.A O no hydrogen 2.992 N/A GLU 411.A N ALA 454.A O no hydrogen 2.625 N/A TRP 412.A N ALA 390.A O no hydrogen 2.610 N/A ASN 413.A N ILE 456.A O no hydrogen 3.047 N/A TYR 416.A OH SER 526.A OG no hydrogen 2.990 N/A ARG 417.A N ASN 413.A O no hydrogen 3.319 N/A ARG 417.A NH1 GLY 414.A O no hydrogen 2.991 N/A ASP 418.A N GLY 414.A O no hydrogen 2.996 N/A SER 419.A N LYS 415.A O no hydrogen 2.915 N/A SER 419.A OG LYS 415.A O no hydrogen 2.882 N/A SER 419.A OG GLU 433.A OE1 no hydrogen 2.832 N/A ILE 420.A N TYR 416.A O no hydrogen 3.044 N/A ARG 421.A N ARG 417.A O no hydrogen 2.860 N/A ARG 421.A NE VAL 459.A O no hydrogen 2.914 N/A ARG 421.A NH1 ASN 492.A O no hydrogen 2.916 N/A ARG 421.A NH2 VAL 459.A O no hydrogen 2.700 N/A ARG 422.A N ASP 418.A O no hydrogen 2.919 N/A ARG 422.A NH1 GLU 427.A OE2 no hydrogen 2.633 N/A PHE 423.A N SER 419.A O no hydrogen 2.883 N/A TRP 424.A N ILE 420.A O no hydrogen 3.268 N/A ARG 425.A N ARG 421.A O no hydrogen 3.131 N/A ARG 425.A N ARG 422.A O no hydrogen 3.179 N/A ARG 425.A NE SER 494.A O no hydrogen 2.858 N/A ARG 425.A NH1 GLU 427.A OE1 no hydrogen 2.640 N/A ARG 425.A NH2 SER 494.A O no hydrogen 3.316 N/A GLY 426.A N PHE 423.A O no hydrogen 2.900 N/A GLU 427.A N ARG 422.A O no hydrogen 3.163 N/A LEU 429.A N THR 613.A O no hydrogen 2.958 N/A TYR 431.A N SER 611.A O no hydrogen 3.331 N/A TYR 431.A OH TYR 597.A O no hydrogen 2.884 N/A SER 432.A N TRP 609.A O no hydrogen 2.898 N/A ILE 434.A N PRO 430.A O no hydrogen 3.108 N/A ALA 435.A N TYR 431.A O no hydrogen 2.952 N/A ASN 436.A N SER 432.A O no hydrogen 2.924 N/A ASN 436.A ND2 SER 432.A O no hydrogen 2.676 N/A ARG 437.A N GLU 433.A O no hydrogen 3.304 N/A ARG 437.A NH1 ASP 443.A OD1 no hydrogen 3.446 N/A ARG 437.A NH2 ASP 443.A OD2 no hydrogen 3.233 N/A LEU 438.A N ILE 434.A O no hydrogen 3.432 N/A LEU 439.A N ALA 435.A O no hydrogen 2.941 N/A GLY 440.A N ARG 437.A O no hydrogen 3.175 N/A SER 441.A N ASN 436.A O no hydrogen 2.732 N/A SER 441.A OG ASN 413.A OD1 no hydrogen 3.042 N/A ILE 444.A N SER 441.A O no hydrogen 3.307 N/A TYR 445.A N SER 441.A O no hydrogen 3.165 N/A ASN 449.A ND2 PRO 406.A O no hydrogen 3.696 N/A ASN 449.A ND2 ASN 448.A O no hydrogen 3.282 N/A PHE 453.A N THR 451.A OG1 no hydrogen 3.000 N/A ALA 454.A N THR 451.A O no hydrogen 3.452 N/A SER 455.A N PRO 452.A O no hydrogen 3.101 N/A SER 455.A OG ASN 413.A OD1 no hydrogen 2.904 N/A ILE 456.A N GLU 411.A O no hydrogen 2.717 N/A ASN 457.A N THR 529.A O no hydrogen 3.014 N/A THR 460.A OG1 ASP 536.A OD1 no hydrogen 2.566 N/A HIS 462.A N GLU 170.A OE2 no hydrogen 2.698 N/A HIS 462.A ND1 GLU 170.A OE2 no hydrogen 2.958 N/A ASP 463.A N SER 461.A OG no hydrogen 3.381 N/A THR 466.A OG1 ARG 540.A O no hydrogen 2.446 N/A LEU 467.A N ASP 536.A OD2 no hydrogen 3.172 N/A ASP 469.A N THR 466.A OG1 no hydrogen 3.312 N/A LEU 470.A N THR 466.A O no hydrogen 2.798 N/A VAL 471.A N GLU 468.A O no hydrogen 3.344 N/A SER 472.A N ASP 469.A O no hydrogen 3.374 N/A SER 472.A OG GLU 468.A O no hydrogen 2.057 N/A ASN 474.A N GLU 500.A OE1 no hydrogen 3.240 N/A ASN 474.A N GLU 500.A OE2 no hydrogen 2.978 N/A GLN 475.A N GLU 500.A OE1 no hydrogen 3.418 N/A LYS 476.A NZ ASP 487.A O no hydrogen 3.140 N/A LYS 476.A NZ GLY 488.A O no hydrogen 2.787 N/A LYS 476.A NZ ASN 490.A OD1 no hydrogen 2.602 N/A HIS 477.A N GLY 544.A O no hydrogen 2.799 N/A ASN 478.A ND2 ASP 487.A O no hydrogen 2.994 N/A ASN 478.A ND2 ASN 546.A OD1 no hydrogen 2.607 N/A ASN 481.A N ASN 478.A O no hydrogen 3.088 N/A ASN 481.A ND2 ASN 545.A OD1 no hydrogen 2.889 N/A ASN 481.A ND2 GLN 551.A OE1 no hydrogen 2.864 N/A GLY 482.A N GLU 479.A O no hydrogen 2.939 N/A GLN 486.A N PHE 483.A O no hydrogen 2.872 N/A GLN 486.A NE2 PHE 483.A O no hydrogen 3.551 N/A ASN 492.A ND2 MET 489.A O no hydrogen 2.784 N/A SER 494.A OG TYR 473.A O no hydrogen 2.668 N/A TRP 495.A N LEU 470.A O no hydrogen 3.265 N/A ASN 496.A N ASN 474.A OD1 no hydrogen 3.049 N/A ASN 496.A ND2 GLU 500.A OE2 no hydrogen 2.890 N/A CYS 497.A SG VAL 471.A O no hydrogen 3.866 N/A GLY 498.A N ASN 496.A OD1 no hydrogen 3.037 N/A GLY 501.A N SER 472.A O no hydrogen 2.925 N/A ASN 507.A N ASP 505.A OD1 no hydrogen 2.609 N/A VAL 508.A N ASP 505.A OD1 no hydrogen 3.270 N/A VAL 509.A N ASP 505.A O no hydrogen 3.146 N/A ILE 510.A N GLN 506.A O no hydrogen 3.180 N/A CYS 511.A N ASN 507.A O no hydrogen 3.185 N/A ARG 512.A N VAL 508.A O no hydrogen 3.037 N/A ARG 512.A NE ASN 496.A O no hydrogen 3.314 N/A ARG 512.A NH1 GLY 501.A O no hydrogen 3.173 N/A ARG 512.A NH2 ASN 496.A O no hydrogen 3.311 N/A ARG 512.A NH2 ALA 499.A O no hydrogen 2.761 N/A ARG 512.A NH2 GLY 501.A O no hydrogen 2.578 N/A GLU 513.A N VAL 509.A O no hydrogen 2.842 N/A LYS 514.A N ILE 510.A O no hydrogen 3.085 N/A LYS 514.A NZ SER 666.A O no hydrogen 3.280 N/A LYS 514.A NZ THR 690.A OG1 no hydrogen 3.396 N/A GLN 515.A N CYS 511.A O no hydrogen 2.872 N/A GLN 515.A NE2 TRP 424.A O no hydrogen 3.216 N/A LYS 516.A N ARG 512.A O no hydrogen 2.857 N/A LYS 516.A NZ GLU 468.A OE1 no hydrogen 2.784 N/A LYS 516.A NZ GLU 513.A OE1 no hydrogen 2.799 N/A LYS 516.A NZ GLU 513.A OE2 no hydrogen 3.131 N/A LYS 516.A NZ SER 539.A OG no hydrogen 3.029 N/A ARG 517.A N GLU 513.A O no hydrogen 3.320 N/A ARG 517.A NE GLU 513.A O no hydrogen 2.962 N/A ARG 517.A NH2 GLU 513.A OE2 no hydrogen 2.732 N/A ASN 518.A N LYS 514.A O no hydrogen 3.100 N/A ASN 518.A ND2 GLN 515.A OE1 no hydrogen 3.593 N/A ASN 518.A ND2 ARG 689.A O no hydrogen 2.964 N/A PHE 519.A N GLN 515.A O no hydrogen 3.084 N/A MET 520.A N LYS 516.A O no hydrogen 2.952 N/A ILE 521.A N ARG 517.A O no hydrogen 3.072 N/A THR 522.A N ASN 518.A O no hydrogen 2.953 N/A THR 522.A OG1 ASN 518.A O no hydrogen 2.493 N/A LEU 523.A N PHE 519.A O no hydrogen 2.850 N/A LEU 524.A N MET 520.A O no hydrogen 3.274 N/A SER 526.A OG TYR 416.A OH no hydrogen 2.990 N/A SER 526.A OG THR 522.A O no hydrogen 2.678 N/A GLN 527.A N LEU 438.A O no hydrogen 2.728 N/A GLN 527.A NE2 ALA 585.A O no hydrogen 3.476 N/A THR 529.A OG1 THR 166.A O no hydrogen 3.368 N/A MET 531.A N ASN 457.A O no hydrogen 2.854 N/A ILE 532.A N ILE 168.A O no hydrogen 2.894 N/A GLY 534.A N GLU 170.A O no hydrogen 2.816 N/A ASP 536.A N LEU 533.A O no hydrogen 2.812 N/A SER 539.A N ASP 536.A O no hydrogen 3.134 N/A ARG 540.A N GLY 535.A O no hydrogen 2.832 N/A ARG 540.A NE THR 556.A O no hydrogen 3.113 N/A ARG 540.A NH2 GLN 542.A OE1 no hydrogen 2.795 N/A ARG 540.A NH2 THR 556.A O no hydrogen 3.140 N/A THR 541.A OG1 ASP 469.A OD2 no hydrogen 2.931 N/A GLN 542.A N ASP 469.A OD1 no hydrogen 2.937 N/A GLN 542.A NE2 ASN 545.A O no hydrogen 2.902 N/A ARG 543.A N THR 541.A OG1 no hydrogen 2.713 N/A ARG 543.A NH1 GLU 554.A OE1 no hydrogen 2.834 N/A ARG 543.A NH2 GLU 554.A OE1 no hydrogen 3.496 N/A GLY 544.A N ASP 469.A OD1 no hydrogen 3.007 N/A ASN 545.A N GLN 542.A O no hydrogen 3.112 N/A ASN 545.A ND2 ASN 481.A OD1 no hydrogen 3.419 N/A ASN 546.A N ASN 478.A OD1 no hydrogen 2.774 N/A ASN 546.A ND2 MET 489.A O no hydrogen 2.720 N/A ASN 546.A ND2 ASN 492.A OD1 no hydrogen 2.986 N/A ASN 547.A ND2 ASP 487.A OD1 no hydrogen 3.366 N/A PHE 549.A N ASN 547.A O no hydrogen 2.771 N/A CYS 550.A SG GLN 551.A OE1 no hydrogen 4.040 N/A GLN 551.A N ALA 548.A O no hydrogen 3.485 N/A GLN 551.A NE2 ASN 553.A OD1 no hydrogen 2.646 N/A THR 556.A N ASN 553.A O no hydrogen 3.240 N/A THR 556.A OG1 GLN 551.A O no hydrogen 2.404 N/A THR 556.A OG1 ASN 553.A O no hydrogen 3.409 N/A TRP 557.A N ASN 553.A O no hydrogen 3.167 N/A PHE 558.A N GLY 175.A O no hydrogen 2.917 N/A TRP 560.A NE1 PHE 176.A O no hydrogen 3.029 N/A ASN 561.A ND2 ASP 559.A OD1 no hydrogen 2.954 N/A ARG 565.A N ASP 563.A OD1 no hydrogen 2.777 N/A ARG 565.A NH1 GLU 513.A OE1 no hydrogen 3.092 N/A LYS 566.A NZ ASP 559.A OD1 no hydrogen 3.496 N/A SER 567.A N ASP 563.A O no hydrogen 2.705 N/A LYS 568.A N GLU 564.A O no hydrogen 2.908 N/A PHE 569.A N ARG 565.A O no hydrogen 3.284 N/A PHE 569.A N LYS 566.A O no hydrogen 3.041 N/A LEU 570.A N LYS 566.A O no hydrogen 3.031 N/A GLU 571.A N SER 567.A O no hydrogen 3.010 N/A PHE 572.A N LYS 568.A O no hydrogen 3.183 N/A VAL 573.A N PHE 569.A O no hydrogen 2.817 N/A LYS 574.A N LEU 570.A O no hydrogen 3.173 N/A LYS 575.A N GLU 571.A O no hydrogen 3.106 N/A MET 576.A N PHE 572.A O no hydrogen 2.941 N/A ILE 577.A N VAL 573.A O no hydrogen 2.901 N/A GLN 578.A N LYS 574.A O no hydrogen 3.060 N/A GLN 578.A NE2 LEU 206.A O no hydrogen 3.069 N/A GLN 578.A NE2 LYS 574.A O no hydrogen 3.043 N/A PHE 579.A N LYS 575.A O no hydrogen 3.022 N/A TYR 580.A N MET 576.A O no hydrogen 2.841 N/A ARG 581.A N ILE 577.A O no hydrogen 2.910 N/A ARG 581.A NE GLY 207.A O no hydrogen 2.883 N/A ARG 581.A NH2 GLY 207.A O no hydrogen 3.233 N/A ALA 582.A N GLN 578.A O no hydrogen 2.877 N/A HIS 583.A N TYR 580.A O no hydrogen 3.274 N/A HIS 583.A ND1 PHE 579.A O no hydrogen 3.165 N/A ALA 585.A N ASP 637.A OD1 no hydrogen 2.649 N/A PHE 586.A N HIS 583.A O no hydrogen 3.315 N/A ARG 587.A NE LYS 164.A O no hydrogen 3.224 N/A ARG 587.A NH1 TYR 580.A O no hydrogen 3.235 N/A ARG 587.A NH1 ARG 581.A O no hydrogen 2.541 N/A ARG 587.A NH2 ASP 165.A OD1 no hydrogen 2.941 N/A ARG 588.A N GLN 527.A OE1 no hydrogen 3.223 N/A TYR 591.A OH ASP 593.A OD2 no hydrogen 2.950 N/A THR 595.A N VAL 619.A O no hydrogen 3.161 N/A TYR 597.A N ILE 617.A O no hydrogen 2.849 N/A THR 598.A N ARG 602.A O no hydrogen 3.012 N/A THR 598.A OG1 GLU 600.A OE2 no hydrogen 2.920 N/A GLY 601.A N THR 598.A O no hydrogen 3.183 N/A ARG 602.A N THR 598.A OG1 no hydrogen 3.326 N/A ARG 602.A NE GLU 600.A OE2 no hydrogen 2.892 N/A ARG 602.A NH2 GLU 600.A OE2 no hydrogen 3.519 N/A THR 608.A OG1 ASP 605.A O no hydrogen 2.953 N/A TRP 609.A N ASP 605.A O no hydrogen 3.085 N/A SER 610.A N LYS 607.A O no hydrogen 2.976 N/A SER 611.A N LYS 607.A O no hydrogen 2.614 N/A SER 611.A OG LYS 607.A O no hydrogen 2.670 N/A THR 613.A N LEU 429.A O no hydrogen 2.695 N/A THR 613.A OG1 LEU 615.A O no hydrogen 2.841 N/A LEU 615.A N THR 613.A OG1 no hydrogen 2.802 N/A VAL 616.A N LEU 644.A O no hydrogen 2.916 N/A ILE 617.A N TYR 431.A OH no hydrogen 3.410 N/A PHE 618.A N ILE 642.A O no hydrogen 2.917 N/A VAL 619.A N THR 595.A O no hydrogen 2.903 N/A LEU 620.A N PHE 640.A O no hydrogen 2.773 N/A GLU 621.A N ASP 593.A O no hydrogen 2.761 N/A SER 623.A OG ASP 637.A O no hydrogen 2.805 N/A MET 625.A N ILE 635.A O no hydrogen 3.266 N/A GLU 627.A N ILE 628.A O no hydrogen 3.000 N/A SER 639.A OG LEU 620.A O no hydrogen 3.041 N/A SER 639.A OG GLY 622.A O no hydrogen 3.483 N/A PHE 640.A N LEU 620.A O no hydrogen 3.232 N/A LEU 641.A N TYR 694.A O no hydrogen 2.647 N/A ILE 642.A N PHE 618.A O no hydrogen 2.720 N/A ILE 643.A N LEU 692.A O no hydrogen 2.822 N/A LEU 644.A N VAL 616.A O no hydrogen 2.705 N/A ASN 645.A N THR 690.A O no hydrogen 2.711 N/A ASN 645.A ND2 ASN 649.A O no hydrogen 3.411 N/A ASN 645.A ND2 GLU 687.A O no hydrogen 2.830 N/A ALA 646.A N GLN 614.A O no hydrogen 2.920 N/A ASN 647.A N GLN 614.A O no hydrogen 3.177 N/A ASN 649.A ND2 ASN 647.A OD1 no hydrogen 3.468 N/A VAL 651.A N ILE 686.A O no hydrogen 2.614 N/A VAL 653.A N LEU 684.A O no hydrogen 2.911 N/A LYS 654.A N LEU 599.A O no hydrogen 3.310 N/A LYS 659.A N GLU 698.A O no hydrogen 3.098 N/A LYS 659.A NZ GLU 679.A OE1 no hydrogen 3.121 N/A TRP 660.A N ILE 678.A O no hydrogen 2.773 N/A TRP 660.A NE1 PRO 656.A O no hydrogen 3.052 N/A GLU 661.A N ARG 695.A O no hydrogen 2.858 N/A LEU 662.A N ARG 676.A O no hydrogen 3.048 N/A VAL 663.A N VAL 693.A O no hydrogen 2.821 N/A SER 666.A N ALA 691.A O no hydrogen 3.102 N/A SER 666.A OG ASN 518.A OD1 no hydrogen 2.684 N/A SER 666.A OG ALA 691.A O no hydrogen 3.212 N/A TYR 667.A N SER 665.A OG no hydrogen 3.188 N/A ARG 669.A NH1 GLU 670.A O no hydrogen 2.633 N/A ARG 669.A NH1 GLU 675.A OE1 no hydrogen 2.867 N/A ARG 669.A NH2 GLU 675.A OE1 no hydrogen 3.088 N/A ARG 669.A NH2 GLU 675.A OE2 no hydrogen 2.884 N/A LYS 672.A N GLU 675.A OE1 no hydrogen 3.175 N/A GLU 674.A N GLU 674.A OE2 no hydrogen 2.940 N/A GLU 675.A N LYS 672.A O no hydrogen 2.580 N/A ILE 678.A N TRP 660.A O no hydrogen 2.926 N/A LYS 682.A N GLU 679.A O no hydrogen 3.475 N/A LEU 684.A N VAL 653.A O no hydrogen 3.005 N/A ILE 686.A N VAL 651.A O no hydrogen 2.611 N/A GLU 687.A N TYR 667.A OH no hydrogen 3.212 N/A ARG 689.A N ASN 647.A O no hydrogen 3.168 N/A THR 690.A N ASN 645.A O no hydrogen 2.803 N/A THR 690.A OG1 GLU 687.A O no hydrogen 3.061 N/A THR 690.A OG1 GLY 688.A O no hydrogen 3.150 N/A ALA 691.A N SER 666.A OG no hydrogen 2.569 N/A LEU 692.A N ILE 643.A O no hydrogen 2.757 N/A VAL 693.A N ILE 664.A O no hydrogen 3.117 N/A TYR 694.A N LEU 641.A O no hydrogen 2.796 N/A TYR 694.A OH GLU 675.A O no hydrogen 3.091 N/A ARG 695.A N GLU 661.A O no hydrogen 3.099 N/A ARG 695.A NH2 HIS 583.A NE2 no hydrogen 3.479 N/A ARG 696.A N SER 639.A O no hydrogen 2.950 N/A ILE 697.A N LYS 659.A O no hydrogen 3.057 N/A