Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gd1_I.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 ILE 2.A O no hydrogen 3.425 N/A ARG 6.A N CYS 326.A O no hydrogen 3.019 N/A GLN 8.A N SER 324.A O no hydrogen 2.955 N/A GLN 8.A NE2 SER 324.A OG no hydrogen 3.275 N/A HIS 10.A N VAL 322.A O no hydrogen 2.670 N/A LEU 11.A N VAL 322.A O no hydrogen 3.426 N/A GLN 12.A NE2 LYS 319.A O no hydrogen 3.035 N/A ASN 15.A N GLN 12.A O no hydrogen 2.577 N/A LEU 16.A N LEU 13.A O no hydrogen 2.938 N/A GLY 17.A N GLN 14.A O no hydrogen 3.174 N/A ALA 21.A N ASN 19.A OD1 no hydrogen 2.621 N/A ASN 22.A N ASN 19.A O no hydrogen 2.682 N/A THR 27.A OG1 ASN 22.A O no hydrogen 3.276 N/A LEU 28.A N GLY 24.A O no hydrogen 3.149 N/A THR 29.A N CYS 37.A O no hydrogen 2.822 N/A THR 29.A OG1 ALA 69.A O no hydrogen 2.783 N/A SER 32.A OG PRO 73.A O no hydrogen 2.941 N/A LYS 34.A N SER 32.A OG no hydrogen 3.134 N/A LYS 34.A NZ ASP 33.A OD1 no hydrogen 3.473 N/A LYS 34.A NZ ASP 33.A OD2 no hydrogen 3.508 N/A LYS 34.A NZ GLU 308.A OE1 no hydrogen 3.424 N/A ILE 36.A N ILE 51.A O no hydrogen 3.095 N/A CYS 37.A N THR 29.A O no hydrogen 3.020 N/A ILE 38.A N VAL 49.A O no hydrogen 3.232 N/A ARG 39.A N THR 27.A O no hydrogen 3.266 N/A ARG 39.A NH2 SER 26.A O no hydrogen 2.803 N/A GLU 40.A N GLN 47.A O no hydrogen 2.813 N/A VAL 42.A N GLN 45.A O no hydrogen 3.260 N/A GLU 44.A N VAL 42.A O no hydrogen 2.355 N/A GLN 47.A N GLU 40.A O no hydrogen 2.850 N/A GLN 47.A NE2 GLU 40.A OE2 no hydrogen 3.428 N/A VAL 48.A N ARG 62.A O no hydrogen 2.821 N/A VAL 49.A N ILE 38.A O no hydrogen 2.938 N/A ILE 50.A N ILE 60.A O no hydrogen 3.190 N/A ILE 51.A N ILE 36.A O no hydrogen 3.038 N/A MET 53.A N LYS 34.A O no hydrogen 2.726 N/A ASN 54.A N ASP 52.A OD1 no hydrogen 2.793 N/A ASN 54.A ND2 ASP 52.A OD1 no hydrogen 2.711 N/A ASP 55.A N ASP 52.A O no hydrogen 2.858 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 3.395 N/A ASN 58.A N ASP 55.A O no hydrogen 3.341 N/A ASN 58.A ND2 ASP 55.A OD1 no hydrogen 3.004 N/A ASN 58.A ND2 ASP 55.A OD2 no hydrogen 3.437 N/A ARG 61.A NH2 LEU 16.A O no hydrogen 3.066 N/A ARG 62.A N VAL 48.A O no hydrogen 3.175 N/A ARG 62.A NE ARG 61.A O no hydrogen 3.155 N/A ILE 64.A N ALA 46.A O no hydrogen 2.702 N/A ASP 67.A N ASP 67.A OD1 no hydrogen 2.582 N/A ASP 67.A N LYS 81.A O no hydrogen 2.885 N/A ILE 70.A N ALA 79.A O no hydrogen 3.170 N/A ASN 72.A N VAL 77.A O no hydrogen 3.210 N/A ASN 72.A ND2 LEU 114.A O no hydrogen 3.349 N/A ALA 74.A N ASN 72.A OD1 no hydrogen 2.699 N/A LEU 80.A N GLN 87.A O no hydrogen 2.903 N/A LYS 81.A N SER 68.A O no hydrogen 3.353 N/A LYS 81.A NZ ASP 67.A OD2 no hydrogen 2.782 N/A LYS 81.A NZ VAL 106.A O no hydrogen 3.122 N/A ALA 82.A N THR 85.A O no hydrogen 2.665 N/A LYS 84.A NZ ASP 105.A OD1 no hydrogen 3.340 N/A THR 85.A OG1 ALA 82.A O no hydrogen 2.660 N/A LEU 86.A N HIS 100.A O no hydrogen 3.099 N/A GLN 87.A N LEU 80.A O no hydrogen 2.790 N/A ILE 88.A N LYS 98.A O no hydrogen 2.976 N/A PHE 89.A N ILE 78.A O no hydrogen 2.863 N/A MET 93.A N ASN 90.A O no hydrogen 2.749 N/A LYS 94.A N ILE 91.A O no hydrogen 3.156 N/A MET 97.A N ILE 88.A O no hydrogen 2.832 N/A LYS 98.A NZ SER 129.A O no hydrogen 2.612 N/A LYS 98.A NZ GLU 131.A O no hydrogen 2.872 N/A LYS 98.A NZ GLY 132.A O no hydrogen 2.989 N/A LYS 98.A NZ SER 134.A O no hydrogen 2.955 N/A HIS 100.A N LEU 86.A O no hydrogen 3.193 N/A MET 102.A N LYS 84.A O no hydrogen 3.110 N/A TRP 109.A NE1 SER 68.A OG no hydrogen 3.062 N/A LYS 110.A N ALA 118.A O no hydrogen 3.105 N/A LYS 110.A NZ TYR 154.A O no hydrogen 3.458 N/A TRP 111.A N GLU 31.A OE1 no hydrogen 2.862 N/A TRP 111.A NE1 ILE 70.A O no hydrogen 2.831 N/A ILE 112.A N THR 116.A O no hydrogen 2.866 N/A SER 113.A OG THR 116.A OG1 no hydrogen 2.757 N/A ASN 115.A N SER 113.A OG no hydrogen 3.401 N/A THR 116.A OG1 SER 113.A OG no hydrogen 2.757 N/A THR 116.A OG1 ASN 115.A OD1 no hydrogen 2.987 N/A VAL 117.A N TRP 128.A O no hydrogen 2.892 N/A ALA 118.A N LYS 110.A O no hydrogen 2.794 N/A LEU 119.A N TYR 126.A O no hydrogen 2.973 N/A VAL 120.A N PHE 108.A O no hydrogen 2.900 N/A THR 121.A N ALA 124.A O no hydrogen 2.951 N/A THR 121.A OG1 ASN 123.A OD1 no hydrogen 3.173 N/A THR 121.A OG1 ALA 124.A O no hydrogen 3.531 N/A ASN 123.A N THR 121.A OG1 no hydrogen 3.084 N/A VAL 125.A N PHE 140.A O no hydrogen 2.965 N/A TYR 126.A N LEU 119.A O no hydrogen 2.965 N/A HIS 127.A N VAL 137.A O no hydrogen 3.056 N/A HIS 127.A NE2 TYR 154.A OH no hydrogen 2.561 N/A TRP 128.A N VAL 117.A O no hydrogen 3.252 N/A SER 129.A OG ASN 115.A O no hydrogen 3.329 N/A GLU 131.A N SER 129.A OG no hydrogen 3.352 N/A SER 134.A OG GLN 135.A O no hydrogen 3.022 N/A LYS 138.A NZ ASP 141.A OD1 no hydrogen 2.411 N/A MET 139.A N VAL 125.A O no hydrogen 2.558 N/A ARG 142.A N ASN 123.A O no hydrogen 3.025 N/A ARG 142.A NE LEU 146.A O no hydrogen 3.309 N/A ARG 142.A NH2 LEU 146.A O no hydrogen 2.804 N/A HIS 143.A N GLN 180.A OE1 no hydrogen 2.441 N/A SER 145.A N HIS 143.A ND1 no hydrogen 2.721 N/A SER 145.A OG HIS 143.A ND1 no hydrogen 2.919 N/A ALA 147.A N SER 145.A O no hydrogen 2.777 N/A CYS 149.A SG SER 145.A O no hydrogen 3.813 N/A ASN 153.A N THR 166.A O no hydrogen 3.301 N/A TYR 154.A N ASN 153.A OD1 no hydrogen 2.458 N/A TYR 154.A OH HIS 127.A NE2 no hydrogen 2.561 N/A ARG 155.A N LEU 164.A O no hydrogen 2.920 N/A ARG 155.A NH2 GLN 263.A OE1 no hydrogen 3.406 N/A ASP 157.A N TRP 162.A O no hydrogen 3.178 N/A LYS 159.A NZ GLN 201.A OE1 no hydrogen 3.278 N/A GLN 160.A N ASP 157.A O no hydrogen 2.915 N/A LYS 161.A N ASP 157.A OD2 no hydrogen 3.412 N/A LEU 163.A N TYR 182.A O no hydrogen 2.957 N/A LEU 164.A N ARG 155.A O no hydrogen 3.243 N/A LEU 165.A N GLN 180.A O no hydrogen 2.984 N/A THR 166.A N ASN 153.A O no hydrogen 2.812 N/A GLY 167.A N ALA 178.A O no hydrogen 3.099 N/A SER 169.A OG VAL 176.A O no hydrogen 3.400 N/A GLN 171.A N ARG 174.A O no hydrogen 3.109 N/A GLN 171.A NE2 GLN 171.A O no hydrogen 3.338 N/A VAL 176.A N SER 169.A O no hydrogen 2.806 N/A GLY 177.A N HIS 195.A NE2 no hydrogen 3.047 N/A ALA 178.A N GLY 167.A O no hydrogen 3.246 N/A MET 179.A N ILE 192.A O no hydrogen 2.744 N/A GLN 180.A N LEU 165.A O no hydrogen 2.994 N/A GLN 180.A NE2 ASP 141.A O no hydrogen 3.376 N/A LEU 181.A N GLN 190.A O no hydrogen 3.016 N/A TYR 182.A N LEU 163.A O no hydrogen 2.865 N/A SER 183.A N VAL 188.A O no hydrogen 3.194 N/A VAL 184.A N LYS 161.A O no hydrogen 3.109 N/A ARG 186.A N SER 183.A O no hydrogen 3.146 N/A ILE 192.A N MET 179.A O no hydrogen 2.993 N/A GLY 194.A N GLY 177.A O no hydrogen 3.013 N/A HIS 195.A N ALA 217.A O no hydrogen 2.988 N/A SER 198.A N CYS 215.A O no hydrogen 3.048 N/A SER 198.A OG PHE 199.A O no hydrogen 3.469 N/A ALA 200.A N LEU 213.A O no hydrogen 3.015 N/A PHE 202.A N SER 211.A O no hydrogen 2.924 N/A LYS 203.A NZ ALA 208.A O no hydrogen 3.221 N/A ASN 207.A N GLU 205.A O no hydrogen 2.567 N/A ASN 207.A ND2 GLN 239.A O no hydrogen 2.758 N/A GLU 209.A N ASN 238.A OD1 no hydrogen 3.307 N/A SER 211.A N PHE 202.A O no hydrogen 2.617 N/A SER 211.A OG PHE 202.A O no hydrogen 3.534 N/A LEU 213.A N ALA 200.A O no hydrogen 2.912 N/A PHE 214.A N ILE 229.A O no hydrogen 3.070 N/A CYS 215.A N SER 198.A O no hydrogen 3.047 N/A CYS 215.A SG HIS 227.A O no hydrogen 3.490 N/A PHE 216.A N HIS 227.A O no hydrogen 3.043 N/A ALA 217.A N ALA 196.A O no hydrogen 2.988 N/A VAL 218.A N LYS 225.A O no hydrogen 2.923 N/A ARG 219.A NH1 ALA 254.A O no hydrogen 3.284 N/A ARG 219.A NH1 ASP 257.A O no hydrogen 2.816 N/A ARG 219.A NH2 ALA 254.A O no hydrogen 3.543 N/A GLY 220.A N GLY 223.A O no hydrogen 2.999 N/A GLY 223.A N GLN 221.A O no hydrogen 2.975 N/A LYS 225.A N VAL 218.A O no hydrogen 2.897 N/A LEU 226.A N VAL 246.A O no hydrogen 2.865 N/A HIS 227.A N PHE 216.A O no hydrogen 2.772 N/A ILE 228.A N LYS 244.A O no hydrogen 3.062 N/A ILE 229.A N PHE 214.A O no hydrogen 3.281 N/A VAL 231.A N THR 212.A O no hydrogen 2.828 N/A ASN 238.A ND2 GLU 209.A O no hydrogen 3.420 N/A GLN 239.A N ASN 207.A OD1 no hydrogen 3.086 N/A PHE 241.A N GLU 230.A OE1 no hydrogen 2.765 N/A LYS 244.A NZ PRO 242.A O no hydrogen 2.689 N/A VAL 248.A N GLY 224.A O no hydrogen 2.873 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.454 N/A ALA 254.A N PRO 251.A O no hydrogen 3.111 N/A ASN 256.A N TYR 277.A OH no hydrogen 3.346 N/A VAL 260.A N ILE 274.A O no hydrogen 2.861 N/A ALA 261.A N ILE 274.A O no hydrogen 3.120 N/A GLN 263.A N PHE 272.A O no hydrogen 2.958 N/A SER 265.A N VAL 270.A O no hydrogen 3.061 N/A SER 265.A OG ALA 311.A O no hydrogen 3.194 N/A HIS 268.A NE2 GLU 329.A OE2 no hydrogen 3.083 N/A VAL 270.A N SER 265.A O no hydrogen 3.328 N/A VAL 271.A N TYR 283.A O no hydrogen 2.777 N/A PHE 272.A N GLN 263.A O no hydrogen 2.704 N/A LEU 273.A N HIS 281.A O no hydrogen 2.909 N/A ILE 274.A N ALA 261.A O no hydrogen 2.700 N/A THR 275.A N TYR 279.A O no hydrogen 2.954 N/A THR 275.A OG1 ASP 257.A OD1 no hydrogen 3.002 N/A THR 275.A OG1 ASP 257.A OD2 no hydrogen 2.692 N/A LYS 276.A N PHE 258.A O no hydrogen 2.885 N/A TYR 277.A N ASP 257.A OD1 no hydrogen 2.500 N/A GLY 278.A N THR 275.A O no hydrogen 2.883 N/A TYR 279.A N THR 275.A OG1 no hydrogen 3.019 N/A ILE 280.A N ASN 294.A O no hydrogen 2.740 N/A HIS 281.A N LEU 273.A O no hydrogen 2.621 N/A LEU 282.A N TYR 292.A O no hydrogen 2.758 N/A TYR 283.A N VAL 271.A O no hydrogen 2.929 N/A ASP 284.A N THR 289.A O no hydrogen 3.060 N/A LEU 285.A N ASP 269.A O no hydrogen 2.963 N/A THR 287.A N ASP 284.A OD1 no hydrogen 3.070 N/A THR 287.A OG1 THR 289.A OG1 no hydrogen 3.002 N/A THR 289.A N THR 287.A OG1 no hydrogen 2.749 N/A THR 289.A OG1 THR 287.A OG1 no hydrogen 3.002 N/A CYS 290.A SG LEU 282.A O no hydrogen 3.849 N/A ILE 291.A N LEU 282.A O no hydrogen 2.761 N/A ARG 295.A NE TYR 277.A O no hydrogen 2.653 N/A ARG 295.A NE SER 297.A O no hydrogen 3.015 N/A ARG 295.A NH2 TYR 277.A O no hydrogen 3.138 N/A ARG 295.A NH2 GLY 298.A O no hydrogen 3.503 N/A ILE 296.A N GLY 278.A O no hydrogen 2.870 N/A SER 297.A OG GLU 299.A O no hydrogen 2.417 N/A PHE 302.A N VAL 316.A O no hydrogen 3.149 N/A ALA 305.A N ILE 314.A O no hydrogen 2.885 N/A HIS 307.A N GLY 312.A O no hydrogen 2.749 N/A THR 310.A OG1 HIS 307.A ND1 no hydrogen 3.110 N/A ALA 311.A N GLU 308.A O no hydrogen 3.013 N/A GLY 312.A N HIS 307.A O no hydrogen 3.306 N/A ILE 313.A N VAL 325.A O no hydrogen 3.109 N/A ILE 314.A N ALA 305.A O no hydrogen 2.928 N/A GLY 315.A N LEU 323.A O no hydrogen 3.125 N/A VAL 316.A N VAL 303.A O no hydrogen 3.079 N/A ASN 317.A N GLN 321.A O no hydrogen 3.043 N/A ARG 318.A N THR 300.A O no hydrogen 2.955 N/A ARG 318.A NE ILE 23.A O no hydrogen 3.404 N/A ARG 318.A NH2 ILE 23.A O no hydrogen 2.803 N/A LYS 319.A NZ GLN 12.A OE1 no hydrogen 3.396 N/A GLY 320.A N ASN 317.A O no hydrogen 2.916 N/A GLN 321.A N ASN 317.A OD1 no hydrogen 2.637 N/A VAL 322.A N LEU 11.A O no hydrogen 2.826 N/A LEU 323.A N GLY 315.A O no hydrogen 3.083 N/A SER 324.A N GLN 8.A O no hydrogen 2.735 N/A SER 324.A OG HIS 307.A ND1 no hydrogen 3.204 N/A VAL 325.A N ILE 313.A O no hydrogen 3.331 N/A CYS 326.A N ARG 6.A O no hydrogen 3.233 N/A CYS 326.A SG ARG 6.A O no hydrogen 3.831 N/A CYS 326.A SG THR 310.A OG1 no hydrogen 3.203 N/A GLU 328.A N PRO 4.A O no hydrogen 2.965 N/A GLU 329.A N VAL 327.A O no hydrogen 2.662 N/A ASN 331.A N GLU 328.A O no hydrogen 2.781 N/A ILE 332.A N GLU 328.A O no hydrogen 3.160 N/A TYR 335.A N ILE 332.A O no hydrogen 2.873 N/A ILE 336.A N ILE 332.A O no hydrogen 3.228 N/A THR 337.A N ILE 333.A O no hydrogen 2.984 N/A THR 337.A OG1 ILE 333.A O no hydrogen 3.138 N/A ASN 338.A N ILE 336.A O no hydrogen 2.547 N/A ASN 338.A ND2 PRO 334.A O no hydrogen 2.981 N/A VAL 339.A N TYR 335.A O no hydrogen 2.728 N/A LEU 340.A N TYR 335.A O no hydrogen 3.234 N/A ASN 342.A N ILE 336.A O no hydrogen 3.359 N/A ALA 346.A N ASN 342.A O no hydrogen 3.026 N/A LEU 347.A N PRO 343.A O no hydrogen 2.753 N/A ARG 348.A N ASP 344.A O no hydrogen 2.960 N/A ARG 348.A NE GLU 286.A OE1 no hydrogen 3.436 N/A ARG 348.A NE GLU 286.A OE2 no hydrogen 2.850 N/A ARG 348.A NH2 GLU 286.A OE1 no hydrogen 2.753 N/A MET 349.A N LEU 345.A O no hydrogen 2.552 N/A ALA 350.A N ALA 346.A O no hydrogen 3.134 N/A VAL 351.A N LEU 347.A O no hydrogen 3.246 N/A ARG 352.A N ARG 348.A O no hydrogen 2.891 N/A ARG 352.A NH1 ASP 284.A OD1 no hydrogen 3.006 N/A ARG 352.A NH1 ASP 284.A OD2 no hydrogen 3.091 N/A ARG 352.A NH2 ASP 284.A OD2 no hydrogen 3.178 N/A ASN 353.A N MET 349.A O no hydrogen 2.769 N/A LEU 355.A N ALA 350.A O no hydrogen 3.179 N/A