Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pmd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 81.A OE2 no hydrogen 3.170 N/A TRP 2.A NE1 PRO 82.A O no hydrogen 3.011 N/A LYS 4.A NZ GLU 283.A OE1 no hydrogen 2.746 N/A GLU 8.A N ARG 87.A O no hydrogen 3.132 N/A ASN 10.A N ASP 111.A OD1 no hydrogen 2.810 N/A ASN 10.A ND2 LEU 109.A O no hydrogen 3.525 N/A ASN 10.A ND2 GLY 292.A O no hydrogen 3.621 N/A ILE 11.A N SER 89.A O no hydrogen 2.786 N/A GLY 12.A N GLY 112.A O no hydrogen 3.182 N/A VAL 13.A N ILE 91.A O no hydrogen 2.648 N/A VAL 14.A N ILE 114.A O no hydrogen 2.710 N/A VAL 17.A N GLN 127.A OE1 no hydrogen 3.313 N/A HIS 19.A NE2 GLU 121.A OE2 no hydrogen 3.022 N/A LYS 21.A NZ ALA 93.A O no hydrogen 2.521 N/A LEU 24.A N GLY 20.A O no hydrogen 2.747 N/A VAL 25.A N LYS 21.A O no hydrogen 2.922 N/A ALA 27.A N THR 23.A O no hydrogen 2.852 N/A ILE 28.A N LEU 24.A O no hydrogen 3.257 N/A ILE 28.A N VAL 25.A O no hydrogen 3.271 N/A THR 29.A N VAL 25.A O no hydrogen 2.877 N/A THR 29.A OG1 VAL 25.A O no hydrogen 2.882 N/A ILE 31.A N THR 29.A OG1 no hydrogen 3.063 N/A THR 33.A OG1 ASP 92.A OD1 no hydrogen 3.030 N/A THR 33.A OG1 ASP 92.A OD2 no hydrogen 3.327 N/A SER 34.A N THR 33.A OG1 no hydrogen 2.702 N/A LYS 41.A NZ ASP 282.A O no hydrogen 3.149 N/A GLY 49.A N ASP 92.A O no hydrogen 2.771 N/A TYR 50.A OH GLU 52.A OE1 no hydrogen 2.432 N/A TYR 50.A OH SER 89.A OG no hydrogen 3.374 N/A ALA 51.A N PHE 90.A O no hydrogen 3.006 N/A THR 53.A N ILE 88.A O no hydrogen 3.126 N/A THR 53.A OG1 ASN 54.A O no hydrogen 3.016 N/A ILE 55.A N ARG 86.A O no hydrogen 2.566 N/A GLY 56.A N VAL 68.A O no hydrogen 2.854 N/A VAL 57.A N LYS 83.A O no hydrogen 2.696 N/A CYS 58.A N ALA 66.A O no hydrogen 2.715 N/A CYS 58.A SG ALA 66.A O no hydrogen 3.749 N/A CYS 58.A SG SER 72.A O no hydrogen 3.906 N/A CYS 61.A SG CYS 76.A O no hydrogen 2.998 N/A LYS 62.A NZ LYS 63.A O no hydrogen 3.338 N/A LYS 63.A NZ TYR 67.A OH no hydrogen 3.314 N/A TYR 67.A N PRO 64.A O no hydrogen 3.048 N/A VAL 68.A N GLY 56.A O no hydrogen 3.227 N/A THR 69.A OG1 GLU 70.A OE1 no hydrogen 3.088 N/A SER 72.A N GLU 70.A O no hydrogen 2.721 N/A LYS 74.A N SER 72.A OG no hydrogen 3.218 N/A CYS 76.A N CYS 73.A O no hydrogen 2.833 N/A CYS 76.A SG CYS 73.A O no hydrogen 3.425 N/A GLY 77.A N LYS 74.A O no hydrogen 3.018 N/A LYS 83.A N VAL 57.A O no hydrogen 2.668 N/A LYS 83.A NZ PHE 84.A O no hydrogen 3.338 N/A LEU 85.A N ILE 55.A O no hydrogen 2.672 N/A ARG 86.A N ILE 55.A O no hydrogen 3.230 N/A ARG 86.A NE GLU 198.A OE1 no hydrogen 2.686 N/A ARG 86.A NH1 ILE 201.A O no hydrogen 3.206 N/A ARG 86.A NH1 THR 203.A OG1 no hydrogen 2.666 N/A ARG 86.A NH2 GLU 198.A OE1 no hydrogen 2.817 N/A ARG 86.A NH2 ILE 201.A O no hydrogen 2.752 N/A ARG 87.A NE GLU 52.A OE2 no hydrogen 2.938 N/A ARG 87.A NH2 GLU 52.A OE2 no hydrogen 3.217 N/A ILE 88.A N THR 53.A O no hydrogen 2.756 N/A SER 89.A N VAL 9.A O no hydrogen 2.961 N/A SER 89.A OG TYR 50.A OH no hydrogen 3.374 N/A PHE 90.A N ALA 51.A O no hydrogen 2.688 N/A ILE 91.A N ILE 11.A O no hydrogen 2.794 N/A ASP 92.A N GLY 49.A O no hydrogen 3.058 N/A ALA 101.A N LEU 99.A O no hydrogen 3.031 N/A MET 103.A N VAL 98.A O no hydrogen 3.201 N/A SER 105.A N ALA 101.A O no hydrogen 3.259 N/A SER 105.A OG ALA 101.A O no hydrogen 2.805 N/A GLY 106.A N THR 102.A O no hydrogen 2.981 N/A ALA 108.A N SER 105.A O no hydrogen 3.324 N/A ASP 111.A N ASN 10.A O no hydrogen 2.622 N/A ALA 113.A N ASN 142.A O no hydrogen 2.732 N/A ILE 114.A N GLY 12.A O no hydrogen 2.799 N/A LEU 115.A N ILE 144.A O no hydrogen 2.974 N/A VAL 116.A N VAL 14.A O no hydrogen 2.838 N/A VAL 117.A N VAL 146.A O no hydrogen 2.751 N/A ALA 118.A N HIS 19.A ND1 no hydrogen 3.298 N/A ALA 119.A N ASN 148.A O no hydrogen 2.714 N/A GLU 121.A N ALA 118.A O no hydrogen 3.211 N/A GLN 125.A NE2 PRO 122.A O no hydrogen 3.236 N/A THR 128.A N GLN 125.A O no hydrogen 3.218 N/A ARG 129.A N GLN 125.A O no hydrogen 3.308 N/A GLU 130.A N PRO 126.A O no hydrogen 3.292 N/A HIS 131.A N GLN 127.A O no hydrogen 3.129 N/A PHE 132.A N THR 128.A O no hydrogen 2.762 N/A VAL 133.A N ARG 129.A O no hydrogen 2.945 N/A ALA 134.A N GLU 130.A O no hydrogen 2.776 N/A LEU 135.A N HIS 131.A O no hydrogen 2.832 N/A GLY 136.A N PHE 132.A O no hydrogen 3.153 N/A ILE 137.A N VAL 133.A O no hydrogen 2.753 N/A ILE 138.A N ALA 134.A O no hydrogen 2.843 N/A GLY 139.A N LEU 135.A O no hydrogen 3.114 N/A GLY 139.A N GLY 136.A O no hydrogen 3.127 N/A VAL 140.A N LEU 135.A O no hydrogen 2.881 N/A ASN 142.A ND2 ASP 111.A O no hydrogen 2.828 N/A ILE 144.A N ALA 113.A O no hydrogen 2.908 N/A ILE 145.A N PRO 178.A O no hydrogen 2.848 N/A VAL 146.A N LEU 115.A O no hydrogen 2.852 N/A GLN 147.A N ILE 180.A O no hydrogen 2.571 N/A GLN 147.A NE2 ALA 158.A O no hydrogen 3.102 N/A GLN 147.A NE2 GLN 161.A OE1 no hydrogen 2.655 N/A ASN 148.A N VAL 117.A O no hydrogen 2.649 N/A ASN 148.A ND2 HIS 19.A O no hydrogen 2.713 N/A VAL 150.A N VAL 182.A O no hydrogen 3.162 N/A VAL 152.A N LYS 149.A O no hydrogen 3.124 N/A VAL 153.A N VAL 150.A O no hydrogen 3.502 N/A GLU 157.A N SER 154.A OG no hydrogen 3.101 N/A ALA 158.A N SER 154.A O no hydrogen 2.798 N/A LEU 159.A N LYS 155.A O no hydrogen 2.911 N/A SER 160.A N GLU 156.A O no hydrogen 2.838 N/A GLN 161.A N GLU 157.A O no hydrogen 3.009 N/A GLN 161.A NE2 ALA 118.A O no hydrogen 3.013 N/A TYR 162.A N ALA 158.A O no hydrogen 2.900 N/A ARG 163.A N LEU 159.A O no hydrogen 3.167 N/A GLN 164.A N SER 160.A O no hydrogen 3.261 N/A ILE 165.A N GLN 161.A O no hydrogen 2.901 N/A LYS 166.A N TYR 162.A O no hydrogen 2.904 N/A LYS 166.A NZ VAL 177.A O no hydrogen 3.284 N/A GLN 167.A N ARG 163.A O no hydrogen 2.696 N/A THR 169.A N ILE 165.A O no hydrogen 3.284 N/A THR 169.A OG1 ILE 165.A O no hydrogen 3.352 N/A THR 169.A OG1 LYS 166.A O no hydrogen 3.468 N/A THR 172.A N THR 169.A O no hydrogen 3.127 N/A TRP 173.A N THR 172.A OG1 no hydrogen 2.598 N/A GLU 175.A N THR 172.A O no hydrogen 3.107 N/A VAL 177.A N ALA 174.A O no hydrogen 2.567 N/A ILE 180.A N ILE 145.A O no hydrogen 2.748 N/A VAL 182.A N GLN 147.A O no hydrogen 2.745 N/A SER 183.A N ILE 188.A O no hydrogen 3.242 N/A ALA 184.A N ASN 148.A OD1 no hydrogen 3.241 N/A HIS 186.A N SER 183.A OG no hydrogen 3.424 N/A HIS 186.A ND1 ASP 151.A OD2 no hydrogen 2.893 N/A ILE 188.A N SER 183.A O no hydrogen 2.845 N/A ASN 189.A ND2 PRO 181.A O no hydrogen 2.666 N/A SER 192.A N ASN 189.A O no hydrogen 3.005 N/A SER 192.A OG ASN 189.A OD1 no hydrogen 2.721 N/A ILE 194.A N ILE 190.A O no hydrogen 3.216 N/A GLU 195.A N ASP 191.A O no hydrogen 3.092 N/A GLY 196.A N SER 192.A O no hydrogen 2.596 N/A ILE 197.A N LEU 193.A O no hydrogen 2.772 N/A GLU 198.A N ILE 194.A O no hydrogen 3.241 N/A GLU 198.A N GLU 195.A O no hydrogen 2.816 N/A GLU 199.A N GLU 195.A O no hydrogen 2.988 N/A TYR 200.A N GLY 196.A O no hydrogen 3.038 N/A ILE 201.A N ILE 197.A O no hydrogen 3.207 N/A LYS 202.A NZ GLU 198.A O no hydrogen 2.889 N/A THR 203.A OG1 GLU 8.A OE2 no hydrogen 2.516 N/A ARG 206.A NH2 GLU 8.A O no hydrogen 2.926 N/A ARG 206.A NH2 ASP 111.A OD2 no hydrogen 3.255 N/A SER 209.A N ASP 207.A OD1 no hydrogen 2.674 N/A SER 209.A OG ASP 207.A OD1 no hydrogen 2.562 N/A SER 209.A OG ASP 207.A OD2 no hydrogen 3.541 N/A GLN 210.A N ASP 207.A O no hydrogen 3.286 N/A GLN 210.A N ASP 207.A OD1 no hydrogen 3.220 N/A VAL 213.A N GLN 243.A O no hydrogen 3.140 N/A MET 214.A N ILE 315.A O no hydrogen 2.880 N/A LEU 215.A N SER 240.A O no hydrogen 2.794 N/A VAL 216.A N SER 313.A O no hydrogen 2.891 N/A ILE 217.A N GLY 238.A O no hydrogen 3.021 N/A ARG 218.A N GLY 238.A O no hydrogen 2.837 N/A ARG 218.A NH2 THR 45.A O no hydrogen 2.970 N/A SER 219.A N ASP 308.A OD1 no hydrogen 2.919 N/A SER 219.A OG THR 305.A O no hydrogen 2.658 N/A PHE 220.A N VAL 236.A O no hydrogen 2.957 N/A ASN 223.A N ASP 221.A OD2 no hydrogen 3.172 N/A THR 227.A N LYS 224.A O no hydrogen 3.067 N/A THR 227.A OG1 LYS 224.A O no hydrogen 2.581 N/A GLN 228.A NE2 GLY 226.A O no hydrogen 2.538 N/A GLU 231.A N GLN 228.A O no hydrogen 2.728 N/A LEU 232.A N PHE 229.A O no hydrogen 3.503 N/A LYS 233.A N ASN 223.A OD1 no hydrogen 3.275 N/A GLY 235.A N LEU 300.A O no hydrogen 2.680 N/A VAL 236.A N PHE 220.A O no hydrogen 3.005 N/A ILE 237.A N ILE 296.A O no hydrogen 2.827 N/A GLY 238.A N ARG 218.A O no hydrogen 2.522 N/A GLY 239.A N VAL 294.A O no hydrogen 3.059 N/A SER 240.A N LEU 215.A O no hydrogen 2.898 N/A SER 240.A OG GLY 292.A O no hydrogen 3.074 N/A ILE 242.A N VAL 213.A O no hydrogen 2.833 N/A GLN 243.A N VAL 213.A O no hydrogen 3.447 N/A GLN 243.A NE2 LYS 211.A O no hydrogen 2.654 N/A PHE 246.A N ALA 288.A O no hydrogen 3.166 N/A LYS 247.A N GLN 250.A OE1 no hydrogen 2.998 N/A VAL 248.A N LYS 286.A O no hydrogen 3.049 N/A ASP 249.A N ILE 275.A O no hydrogen 2.618 N/A GLN 250.A N LYS 247.A O no hydrogen 3.164 N/A ILE 252.A N THR 273.A O no hydrogen 2.822 N/A LYS 253.A N THR 316.A O no hydrogen 2.962 N/A LYS 253.A NZ ALA 318.A O no hydrogen 3.303 N/A LYS 253.A NZ ALA 320.A O no hydrogen 2.654 N/A VAL 254.A N ILE 271.A O no hydrogen 2.704 N/A LEU 255.A N ILE 314.A O no hydrogen 2.994 N/A LEU 258.A N GLU 269.A O no hydrogen 2.977 N/A VAL 260.A N SER 267.A O no hydrogen 2.735 N/A LYS 265.A N LYS 262.A O no hydrogen 2.833 N/A LYS 265.A NZ LYS 262.A O no hydrogen 3.340 N/A SER 267.A OG VAL 260.A O no hydrogen 3.218 N/A GLU 269.A N LEU 258.A O no hydrogen 2.879 N/A ILE 271.A N VAL 254.A O no hydrogen 3.310 N/A THR 273.A N ILE 252.A O no hydrogen 3.184 N/A ILE 275.A N GLN 250.A O no hydrogen 3.127 N/A SER 276.A N GLY 297.A O no hydrogen 2.734 N/A SER 276.A OG THR 298.A O no hydrogen 3.315 N/A ARG 279.A N ALA 295.A O no hydrogen 2.934 N/A ARG 279.A NH2 GLY 281.A O no hydrogen 2.382 N/A PHE 280.A N GLU 283.A O no hydrogen 2.971 N/A GLU 283.A N PHE 280.A O no hydrogen 3.447 N/A PHE 285.A N ILE 278.A O no hydrogen 2.969 N/A ALA 288.A N PHE 246.A O no hydrogen 2.914 N/A GLY 292.A N ASN 10.A OD1 no hydrogen 2.552 N/A LEU 293.A N TYR 50.A OH no hydrogen 2.957 N/A VAL 294.A N GLY 239.A O no hydrogen 2.931 N/A ALA 295.A N ARG 279.A O no hydrogen 2.975 N/A ILE 296.A N ILE 237.A O no hydrogen 2.717 N/A GLY 297.A N SER 277.A O no hydrogen 2.771 N/A THR 298.A N GLY 235.A O no hydrogen 3.244 N/A THR 298.A OG1 GLY 235.A O no hydrogen 3.065 N/A TYR 299.A N THR 273.A OG1 no hydrogen 3.108 N/A LEU 300.A N THR 298.A OG1 no hydrogen 3.010 N/A SER 303.A N ASP 301.A OD2 no hydrogen 2.754 N/A SER 303.A OG ASP 301.A OD2 no hydrogen 3.315 N/A LEU 304.A N ASP 301.A O no hydrogen 2.665 N/A THR 305.A N PRO 302.A O no hydrogen 3.149 N/A THR 305.A OG1 PHE 220.A O no hydrogen 2.774 N/A THR 305.A OG1 PRO 302.A O no hydrogen 3.392 N/A LYS 306.A N PRO 302.A O no hydrogen 2.791 N/A ASP 308.A N SER 219.A O no hydrogen 2.719 N/A ASN 309.A N THR 305.A O no hydrogen 2.879 N/A ASN 309.A N LYS 306.A O no hydrogen 3.140 N/A ASN 309.A ND2 LEU 304.A O no hydrogen 2.620 N/A LEU 310.A N SER 219.A OG no hydrogen 3.271 N/A LEU 311.A N ASP 308.A O no hydrogen 3.292 N/A GLY 312.A N VAL 216.A O no hydrogen 3.035 N/A SER 313.A N LEU 310.A O no hydrogen 3.088 N/A SER 313.A OG LEU 310.A O no hydrogen 2.696 N/A ILE 314.A N LEU 255.A O no hydrogen 2.967 N/A ILE 315.A N MET 214.A O no hydrogen 2.755 N/A THR 316.A N LYS 253.A O no hydrogen 3.268 N/A THR 316.A OG1 LEU 317.A O no hydrogen 2.979 N/A ALA 318.A N GLU 251.A O no hydrogen 3.143 N/A ALA 320.A N LEU 317.A O no hydrogen 2.885 N/A LEU 325.A N VAL 385.A O no hydrogen 3.171 N/A ILE 328.A N VAL 379.A O no hydrogen 3.170 N/A ARG 329.A NE GLU 376.A OE1 no hydrogen 3.091 N/A ILE 330.A N ILE 377.A O no hydrogen 2.854 N/A LYS 331.A N LEU 411.A O no hydrogen 2.901 N/A TYR 332.A N ASP 375.A O no hydrogen 3.001 N/A TYR 332.A OH LYS 373.A O no hydrogen 2.448 N/A ASN 333.A N TRP 409.A O no hydrogen 2.968 N/A LEU 335.A N ILE 407.A O no hydrogen 2.828 N/A ARG 337.A N GLU 336.A OE2 no hydrogen 3.300 N/A VAL 338.A N LEU 345.A O no hydrogen 2.637 N/A VAL 347.A N GLU 336.A O no hydrogen 3.464 N/A ARG 351.A N GLU 354.A OE2 no hydrogen 2.973 N/A LYS 353.A N VAL 369.A O no hydrogen 3.063 N/A GLU 354.A N ARG 351.A O no hydrogen 3.426 N/A LEU 356.A N GLY 367.A O no hydrogen 3.005 N/A MET 357.A N SER 397.A O no hydrogen 2.887 N/A LEU 358.A N THR 365.A O no hydrogen 3.201 N/A SER 359.A N VAL 395.A O no hydrogen 3.198 N/A VAL 360.A N SER 363.A O no hydrogen 2.931 N/A SER 362.A OG VAL 216.A O no hydrogen 2.799 N/A SER 363.A N VAL 360.A O no hydrogen 2.560 N/A SER 363.A OG GLY 312.A O no hydrogen 2.654 N/A SER 363.A OG VAL 360.A O no hydrogen 2.939 N/A THR 365.A N LEU 358.A O no hydrogen 3.275 N/A GLY 367.A N LEU 356.A O no hydrogen 3.044 N/A ILE 368.A N GLU 380.A O no hydrogen 2.893 N/A VAL 369.A N GLU 354.A O no hydrogen 3.225 N/A THR 370.A N GLU 378.A O no hydrogen 2.763 N/A THR 370.A OG1 GLU 378.A O no hydrogen 3.121 N/A SER 371.A N GLU 378.A O no hydrogen 3.395 N/A LYS 373.A N GLU 376.A O no hydrogen 2.642 N/A ILE 377.A N ILE 330.A O no hydrogen 3.136 N/A GLU 378.A N SER 371.A O no hydrogen 2.992 N/A VAL 379.A N ILE 328.A O no hydrogen 2.996 N/A GLU 380.A N ILE 368.A O no hydrogen 2.737 N/A LEU 381.A N TRP 326.A O no hydrogen 2.773 N/A ARG 382.A N LEU 366.A O no hydrogen 2.971 N/A VAL 385.A N LEU 325.A O no hydrogen 3.126 N/A VAL 387.A N PRO 323.A O no hydrogen 3.196 N/A ASN 390.A ND2 VAL 412.A O no hydrogen 3.537 N/A ARG 393.A NE ILE 137.A O no hydrogen 2.501 N/A ARG 393.A NH2 ILE 137.A O no hydrogen 2.887 N/A THR 394.A N GLY 410.A O no hydrogen 2.781 N/A THR 394.A OG1 SER 359.A O no hydrogen 3.247 N/A VAL 395.A N SER 359.A O no hydrogen 3.321 N/A ILE 396.A N GLY 408.A O no hydrogen 2.887 N/A SER 397.A N MET 357.A O no hydrogen 3.024 N/A ARG 398.A N ARG 405.A O no hydrogen 2.807 N/A ARG 398.A NH1 ASP 348.A O no hydrogen 3.004 N/A ARG 398.A NH2 ASP 348.A O no hydrogen 2.805 N/A ILE 400.A N ARG 398.A O no hydrogen 2.638 N/A ARG 405.A N ARG 398.A O no hydrogen 2.578 N/A ARG 405.A NH1 VAL 339.A O no hydrogen 2.912 N/A ILE 407.A N ILE 396.A O no hydrogen 2.907 N/A GLY 408.A N ILE 396.A O no hydrogen 3.352 N/A TRP 409.A N ASN 333.A O no hydrogen 3.079 N/A GLY 410.A N THR 394.A O no hydrogen 2.920 N/A LEU 411.A N LYS 331.A O no hydrogen 2.801 N/A VAL 412.A N ILE 392.A O no hydrogen 3.269 N/A GLU 413.A N ARG 329.A O no hydrogen 2.801 N/A