Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qhm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 ILE 6.A O no hydrogen 2.883 N/A GLY 5.A N THR 2.A OG1 no hydrogen 2.870 N/A TYR 7.A N ILE 18.A O no hydrogen 2.852 N/A TYR 8.A N HIS 213.A O no hydrogen 2.878 N/A TYR 8.A OH TRP 158.A O no hydrogen 2.391 N/A GLU 9.A N TYR 16.A O no hydrogen 3.172 N/A VAL 10.A N ASN 257.A O no hydrogen 2.676 N/A ARG 11.A N THR 14.A O no hydrogen 2.921 N/A ARG 11.A NE GLU 9.A OE2 no hydrogen 2.427 N/A ARG 11.A NH1 GLU 25.A OE1 no hydrogen 3.186 N/A ARG 11.A NH1 GLU 25.A OE2 no hydrogen 3.484 N/A ARG 11.A NH2 GLU 9.A OE2 no hydrogen 2.689 N/A ARG 11.A NH2 GLU 25.A OE2 no hydrogen 3.096 N/A THR 14.A N ARG 11.A O no hydrogen 2.783 N/A TYR 16.A N GLU 9.A O no hydrogen 2.794 N/A MET 17.A N THR 26.A O no hydrogen 2.739 N/A ILE 18.A N TYR 7.A O no hydrogen 2.831 N/A ASN 19.A N GLU 24.A O no hydrogen 2.940 N/A VAL 20.A N GLY 5.A O no hydrogen 2.933 N/A THR 21.A N ASN 19.A OD1 no hydrogen 3.130 N/A SER 22.A N ASN 19.A OD1 no hydrogen 3.034 N/A GLY 23.A N ASN 19.A O no hydrogen 2.737 N/A GLU 24.A N SER 22.A OG no hydrogen 3.156 N/A THR 26.A N MET 17.A O no hydrogen 2.726 N/A ILE 28.A N ILE 15.A O no hydrogen 2.829 N/A LEU 30.A N ASP 340.A OD1 no hydrogen 2.715 N/A PHE 31.A N ASN 66.A OD1 no hydrogen 2.695 N/A GLY 32.A N PHE 341.A O no hydrogen 2.888 N/A VAL 33.A N ALA 67.A O no hydrogen 2.939 N/A ASN 34.A N TYR 343.A O no hydrogen 2.737 N/A ASN 34.A ND2 GLY 308.A O no hydrogen 3.228 N/A ASN 34.A ND2 TYR 343.A O no hydrogen 2.987 N/A TRP 35.A N ARG 69.A O no hydrogen 3.156 N/A GLY 37.A N GLU 39.A OE1 no hydrogen 2.804 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.438 N/A THR 40.A OG1 GLY 37.A O no hydrogen 2.306 N/A HIS 43.A N THR 40.A O no hydrogen 3.017 N/A HIS 43.A ND1 PRO 41.A O no hydrogen 2.388 N/A HIS 46.A N PHE 36.A O no hydrogen 3.021 N/A HIS 46.A ND1 VAL 44.A O no hydrogen 2.829 N/A LYS 50.A N GLY 47.A O no hydrogen 3.411 N/A LEU 57.A N TRP 53.A O no hydrogen 2.938 N/A LEU 58.A N GLU 54.A O no hydrogen 2.365 N/A GLN 59.A N ASP 55.A O no hydrogen 2.702 N/A ILE 60.A N MET 56.A O no hydrogen 2.692 N/A LYS 61.A N LEU 57.A O no hydrogen 2.726 N/A LYS 61.A NZ LEU 113.A O no hydrogen 2.698 N/A SER 62.A N LEU 58.A O no hydrogen 2.898 N/A SER 62.A OG LEU 58.A O no hydrogen 2.572 N/A SER 62.A OG GLN 59.A O no hydrogen 2.837 N/A LEU 63.A N ILE 60.A O no hydrogen 2.891 N/A GLY 64.A N LYS 61.A O no hydrogen 2.390 N/A PHE 65.A N LYS 61.A O no hydrogen 3.234 N/A ASN 66.A N PHE 31.A O no hydrogen 3.145 N/A ASN 66.A ND2 HIS 29.A O no hydrogen 2.622 N/A ILE 68.A N PHE 116.A O no hydrogen 2.824 N/A ARG 69.A N VAL 33.A O no hydrogen 2.867 N/A ARG 69.A NE ASP 164.A OD2 no hydrogen 2.887 N/A ARG 69.A NH1 ASN 34.A OD1 no hydrogen 3.289 N/A ARG 69.A NH2 ASP 164.A OD2 no hydrogen 2.825 N/A ARG 69.A NH2 ASN 167.A OD1 no hydrogen 3.134 N/A LEU 70.A N LEU 118.A O no hydrogen 3.052 N/A PHE 72.A N ASP 120.A O no hydrogen 2.886 N/A CYS 73.A N PHE 38.A O no hydrogen 3.286 N/A CYS 73.A SG PHE 38.A O no hydrogen 3.590 N/A CYS 73.A SG SER 76.A OG no hydrogen 3.490 N/A THR 74.A N ARG 123.A O no hydrogen 3.384 N/A THR 74.A OG1 TYR 121.A OH no hydrogen 2.625 N/A THR 74.A OG1 ILE 124.A O no hydrogen 3.191 N/A SER 76.A OG PHE 38.A O no hydrogen 2.332 N/A VAL 77.A N THR 74.A O no hydrogen 3.291 N/A LYS 78.A N GLU 75.A O no hydrogen 2.929 N/A LYS 78.A NZ GLU 149.A OE1 no hydrogen 2.796 N/A LYS 78.A NZ GLU 149.A OE2 no hydrogen 3.227 N/A THR 81.A OG1 GLU 75.A O no hydrogen 3.070 N/A ILE 84.A N ASN 42.A O no hydrogen 2.648 N/A ASP 87.A N LEU 48.A O no hydrogen 3.378 N/A LYS 90.A N ASP 87.A O no hydrogen 3.078 N/A ASN 91.A N ASP 87.A O no hydrogen 3.164 N/A SER 99.A N THR 81.A O no hydrogen 3.245 N/A SER 99.A OG THR 81.A O no hydrogen 3.435 N/A GLN 101.A N ASP 98.A O no hydrogen 2.142 N/A MET 103.A N SER 99.A O no hydrogen 3.139 N/A GLU 104.A N LEU 100.A O no hydrogen 2.522 N/A LYS 105.A N GLN 101.A O no hydrogen 2.494 N/A ILE 106.A N ILE 102.A O no hydrogen 2.721 N/A ILE 107.A N MET 103.A O no hydrogen 2.991 N/A LYS 108.A N GLU 104.A O no hydrogen 2.877 N/A LYS 109.A N LYS 105.A O no hydrogen 2.990 N/A ALA 110.A N ILE 106.A O no hydrogen 3.068 N/A GLY 111.A N ILE 107.A O no hydrogen 3.066 N/A ASP 112.A N LYS 108.A O no hydrogen 3.237 N/A LEU 113.A N LYS 109.A O no hydrogen 3.387 N/A GLY 114.A N GLY 111.A O no hydrogen 2.575 N/A ILE 115.A N ALA 110.A O no hydrogen 2.656 N/A PHE 116.A N ASN 66.A O no hydrogen 2.490 N/A VAL 117.A N ASN 159.A O no hydrogen 2.605 N/A LEU 118.A N ILE 68.A O no hydrogen 3.134 N/A LEU 119.A N GLY 162.A O no hydrogen 3.137 N/A ASP 120.A N LEU 70.A O no hydrogen 3.441 N/A TYR 121.A N ASP 164.A O no hydrogen 3.279 N/A TYR 121.A OH THR 74.A OG1 no hydrogen 2.625 N/A HIS 122.A N PHE 72.A O no hydrogen 2.724 N/A HIS 122.A ND1 ASP 120.A OD2 no hydrogen 2.807 N/A ARG 123.A N PHE 72.A O no hydrogen 3.316 N/A ARG 123.A NH1 GLU 39.A O no hydrogen 2.772 N/A ILE 124.A N GLU 130.A OE1 no hydrogen 3.092 N/A GLY 125.A N GLU 130.A OE2 no hydrogen 2.562 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.642 N/A TRP 133.A NE1 GLU 140.A OE1 no hydrogen 3.106 N/A TYR 134.A OH ALA 193.A O no hydrogen 2.676 N/A THR 135.A N PHE 138.A O no hydrogen 2.591 N/A PHE 138.A N THR 135.A O no hydrogen 2.994 N/A ASP 142.A N SER 139.A OG no hydrogen 3.257 N/A PHE 143.A N SER 139.A O no hydrogen 2.942 N/A ILE 144.A N GLU 140.A O no hydrogen 2.799 N/A ASN 145.A N GLU 141.A O no hydrogen 2.761 N/A THR 146.A N ASP 142.A O no hydrogen 3.056 N/A THR 146.A OG1 ASP 142.A O no hydrogen 2.506 N/A TRP 147.A N PHE 143.A O no hydrogen 2.937 N/A TRP 147.A NE1 LEU 165.A O no hydrogen 2.729 N/A ILE 148.A N ILE 144.A O no hydrogen 2.960 N/A GLU 149.A N ASN 145.A O no hydrogen 3.171 N/A VAL 150.A N THR 146.A O no hydrogen 3.035 N/A ALA 151.A N TRP 147.A O no hydrogen 2.863 N/A LYS 152.A N GLU 149.A O no hydrogen 2.906 N/A GLY 155.A N LYS 152.A O no hydrogen 3.333 N/A LYS 156.A N ARG 153.A O no hydrogen 3.317 N/A TYR 157.A OH GLU 104.A OE1 no hydrogen 3.321 N/A ASN 159.A ND2 ILE 107.A O no hydrogen 3.378 N/A ASN 159.A ND2 ILE 115.A O no hydrogen 2.631 N/A VAL 160.A N TYR 157.A O no hydrogen 2.819 N/A ILE 161.A N VAL 117.A O no hydrogen 3.075 N/A ALA 163.A N LEU 215.A O no hydrogen 3.030 N/A ASP 164.A N LEU 119.A O no hydrogen 2.735 N/A LEU 165.A N PHE 217.A O no hydrogen 3.112 N/A LYS 166.A NZ GLU 130.A O no hydrogen 3.088 N/A LYS 166.A NZ LEU 132.A O no hydrogen 3.356 N/A ASN 167.A N TYR 121.A O no hydrogen 2.887 N/A GLU 168.A N GLU 219.A OE2 no hydrogen 2.752 N/A HIS 170.A N PRO 131.A O no hydrogen 3.246 N/A HIS 170.A ND1 SER 171.A O no hydrogen 3.111 N/A HIS 170.A NE2 ILE 129.A O no hydrogen 2.959 N/A SER 171.A N GLN 222.A OE1 no hydrogen 3.202 N/A THR 173.A OG1 ASP 181.A OD2 no hydrogen 2.883 N/A ALA 178.A N SER 174.A O no hydrogen 3.064 N/A TYR 179.A N PRO 176.A O no hydrogen 3.240 N/A TYR 179.A OH ASP 229.A OD2 no hydrogen 2.668 N/A THR 180.A N ALA 177.A O no hydrogen 2.982 N/A THR 183.A N ASP 181.A OD1 no hydrogen 3.093 N/A THR 183.A OG1 ASP 181.A OD1 no hydrogen 2.795 N/A ALA 185.A N HIS 170.A O no hydrogen 3.231 N/A THR 186.A N THR 194.A O no hydrogen 2.734 N/A THR 186.A OG1 THR 194.A OG1 no hydrogen 2.903 N/A THR 186.A OG1 ASP 195.A OD1 no hydrogen 2.566 N/A TRP 187.A N THR 224.A O no hydrogen 3.122 N/A TRP 187.A NE1 TYR 250.A O no hydrogen 2.926 N/A GLY 188.A N ASN 197.A OD1 no hydrogen 3.176 N/A MET 189.A N ASP 195.A OD1 no hydrogen 2.910 N/A GLY 190.A N ASP 195.A OD2 no hydrogen 2.681 N/A ALA 193.A N ASN 191.A OD1 no hydrogen 2.764 N/A THR 194.A N ASN 191.A O no hydrogen 2.978 N/A THR 194.A OG1 THR 186.A OG1 no hydrogen 2.903 N/A THR 194.A OG1 ASN 191.A O no hydrogen 3.520 N/A ASP 195.A N ASN 191.A O no hydrogen 2.938 N/A TRP 196.A N THR 186.A O no hydrogen 2.669 N/A TRP 196.A NE1 GLU 219.A O no hydrogen 2.911 N/A LEU 198.A N ASP 195.A O no hydrogen 3.211 N/A ALA 199.A N ASP 195.A O no hydrogen 3.073 N/A ALA 200.A N TRP 196.A O no hydrogen 2.774 N/A ARG 202.A N LEU 198.A O no hydrogen 3.211 N/A ARG 202.A NE GLU 140.A OE2 no hydrogen 2.883 N/A ARG 202.A NH1 PRO 192.A O no hydrogen 3.030 N/A ARG 202.A NH2 GLU 140.A OE1 no hydrogen 2.721 N/A ARG 202.A NH2 GLU 140.A OE2 no hydrogen 3.394 N/A ARG 202.A NH2 PRO 192.A O no hydrogen 2.963 N/A ILE 203.A N ALA 199.A O no hydrogen 2.852 N/A GLY 204.A N ALA 200.A O no hydrogen 2.834 N/A LYS 205.A N GLU 201.A O no hydrogen 2.920 N/A ALA 206.A N ARG 202.A O no hydrogen 3.303 N/A ILE 207.A N ILE 203.A O no hydrogen 3.052 N/A LEU 208.A N GLY 204.A O no hydrogen 2.860 N/A LYS 209.A N LYS 205.A O no hydrogen 3.295 N/A ALA 211.A N ILE 207.A O no hydrogen 2.758 N/A TRP 214.A N ALA 211.A O no hydrogen 2.894 N/A LEU 215.A N ILE 161.A O no hydrogen 2.869 N/A ILE 216.A N LYS 258.A O no hydrogen 2.600 N/A PHE 217.A N ALA 163.A O no hydrogen 2.723 N/A VAL 218.A N VAL 260.A O no hydrogen 2.799 N/A GLY 220.A N GLY 241.A O no hydrogen 3.246 N/A THR 221.A N ASN 243.A O no hydrogen 3.148 N/A THR 221.A OG1 PHE 223.A O no hydrogen 2.794 N/A THR 224.A N ASP 229.A OD2 no hydrogen 2.765 N/A THR 224.A OG1 ASP 229.A OD1 no hydrogen 2.939 N/A ASN 225.A N THR 224.A OG1 no hydrogen 2.576 N/A THR 228.A OG1 ASN 225.A OD1 no hydrogen 2.717 N/A ASP 229.A N ASN 225.A O no hydrogen 2.940 N/A SER 230.A N PRO 226.A O no hydrogen 2.956 N/A SER 230.A OG PRO 226.A O no hydrogen 3.049 N/A SER 230.A OG LYS 227.A O no hydrogen 3.401 N/A SER 231.A N THR 228.A O no hydrogen 3.005 N/A SER 231.A OG THR 228.A O no hydrogen 2.364 N/A GLY 235.A N TYR 232.A O no hydrogen 2.620 N/A ASN 237.A N TRP 234.A O no hydrogen 2.860 N/A GLY 242.A N TRP 239.A O no hydrogen 2.776 N/A ASN 243.A N THR 221.A O no hydrogen 2.691 N/A ASN 243.A ND2 GLN 222.A O no hydrogen 2.867 N/A ASN 243.A ND2 ASP 229.A OD1 no hydrogen 3.086 N/A LEU 244.A N HIS 293.A O no hydrogen 2.889 N/A MET 245.A N ASN 243.A OD1 no hydrogen 3.058 N/A VAL 247.A N LEU 244.A O no hydrogen 3.351 N/A LYS 248.A N TYR 296.A OH no hydrogen 3.394 N/A TYR 250.A N ALA 246.A O no hydrogen 2.809 N/A VAL 252.A N TYR 261.A OH no hydrogen 3.105 N/A ASN 253.A ND2 GLU 201.A OE2 no hydrogen 3.561 N/A LEU 254.A N VAL 252.A O no hydrogen 3.108 N/A LYS 258.A N PRO 255.A O no hydrogen 3.017 N/A LYS 258.A NZ TYR 8.A O no hydrogen 2.645 N/A LYS 258.A NZ PRO 212.A O no hydrogen 2.845 N/A LYS 258.A NZ TRP 214.A O no hydrogen 2.605 N/A VAL 260.A N ILE 216.A O no hydrogen 2.885 N/A TYR 261.A N SER 304.A O no hydrogen 3.050 N/A SER 262.A N VAL 218.A O no hydrogen 2.995 N/A SER 262.A OG VAL 306.A O no hydrogen 2.891 N/A HIS 264.A N GLY 241.A O no hydrogen 2.932 N/A VAL 265.A N ALA 309.A O no hydrogen 3.136 N/A GLN 273.A N TYR 271.A O no hydrogen 2.966 N/A TYR 275.A OH ASN 237.A O no hydrogen 3.154 N/A PHE 276.A N GLN 273.A O no hydrogen 3.305 N/A GLY 277.A N PRO 274.A O no hydrogen 3.138 N/A LYS 280.A N GLY 277.A O no hydrogen 2.665 N/A GLY 281.A N GLY 277.A O no hydrogen 3.080 N/A ASN 285.A N GLY 281.A O no hydrogen 3.244 N/A ASN 285.A ND2 TYR 275.A O no hydrogen 2.763 N/A LEU 286.A N PRO 283.A O no hydrogen 3.220 N/A TRP 290.A N LEU 286.A O no hydrogen 3.073 N/A TYR 291.A N PRO 287.A O no hydrogen 3.024 N/A HIS 292.A N ASP 288.A O no hydrogen 2.967 N/A HIS 293.A N ILE 289.A O no hydrogen 2.929 N/A PHE 294.A N TRP 290.A O no hydrogen 2.966 N/A GLY 295.A N TRP 290.A O no hydrogen 2.876 N/A TYR 296.A N TYR 291.A O no hydrogen 2.852 N/A TYR 296.A OH LEU 244.A O no hydrogen 2.596 N/A VAL 297.A N PHE 294.A O no hydrogen 3.041 N/A LYS 298.A N GLY 295.A O no hydrogen 3.172 N/A LYS 298.A NZ ASN 336.A O no hydrogen 3.003 N/A LEU 299.A N GLY 295.A O no hydrogen 3.207 N/A GLU 300.A N TYR 296.A O no hydrogen 2.883 N/A LEU 301.A N TYR 296.A O no hydrogen 3.035 N/A GLY 302.A N LYS 298.A O no hydrogen 2.980 N/A TYR 303.A N VAL 297.A O no hydrogen 3.075 N/A VAL 306.A N TYR 261.A O no hydrogen 2.921 N/A ILE 307.A N ASP 340.A O no hydrogen 3.221 N/A GLY 308.A N PRO 263.A O no hydrogen 3.151 N/A LYS 313.A N ASP 322.A OD2 no hydrogen 2.649 N/A ASP 322.A N ASP 319.A OD2 no hydrogen 3.276 N/A VAL 323.A N PRO 320.A O no hydrogen 2.737 N/A TRP 325.A N ARG 321.A O no hydrogen 3.235 N/A GLN 326.A N ASP 322.A O no hydrogen 2.976 N/A ASN 327.A N VAL 323.A O no hydrogen 3.120 N/A LYS 328.A N ILE 324.A O no hydrogen 2.939 N/A LYS 328.A NZ ASP 284.A OD1 no hydrogen 3.259 N/A LEU 329.A N TRP 325.A O no hydrogen 2.953 N/A VAL 330.A N GLN 326.A O no hydrogen 3.238 N/A ASP 331.A N ASN 327.A O no hydrogen 2.918 N/A TRP 332.A N LYS 328.A O no hydrogen 2.999 N/A MET 333.A N LEU 329.A O no hydrogen 2.804 N/A ILE 334.A N VAL 330.A O no hydrogen 3.087 N/A GLU 335.A N ASP 331.A O no hydrogen 2.968 N/A ASN 336.A N TRP 332.A O no hydrogen 3.125 N/A ASN 336.A ND2 TRP 332.A O no hydrogen 3.021 N/A LYS 337.A N ILE 334.A O no hydrogen 3.293 N/A PHE 338.A N MET 333.A O no hydrogen 2.727 N/A PHE 341.A N LEU 30.A O no hydrogen 2.807 N/A TYR 343.A N GLY 32.A O no hydrogen 2.941 N/A TYR 343.A OH GLY 312.A O no hydrogen 3.282 N/A TRP 344.A N PHE 310.A O no hydrogen 2.400 N/A SER 345.A OG ASN 34.A O no hydrogen 2.719 N/A TRP 346.A N ASN 34.A O no hydrogen 2.985 N/A ASN 347.A N SER 345.A OG no hydrogen 2.843 N/A ASN 347.A ND2 ASN 34.A O no hydrogen 3.597 N/A SER 350.A OG ASP 352.A OD2 no hydrogen 2.370 N/A SER 350.A OG THR 353.A OG1 no hydrogen 2.478 N/A THR 353.A N SER 350.A O no hydrogen 2.488 N/A THR 353.A OG1 SER 350.A OG no hydrogen 2.478 N/A THR 353.A OG1 GLY 354.A O no hydrogen 3.242 N/A GLY 354.A N SER 350.A O no hydrogen 2.573 N/A THR 362.A N ASP 360.A O no hydrogen 2.421 N/A THR 363.A OG1 GLN 358.A OE1 no hydrogen 2.965 N/A THR 363.A OG1 ILE 364.A O no hydrogen 3.454 N/A ASP 367.A N ASP 367.A OD1 no hydrogen 2.376 N/A LYS 368.A NZ GLY 312.A O no hydrogen 2.854 N/A LYS 368.A NZ GLY 355.A O no hydrogen 2.697 N/A TYR 369.A N TRP 365.A O no hydrogen 2.658 N/A TYR 369.A OH LEU 63.A O no hydrogen 2.461 N/A ASN 370.A N GLU 366.A O no hydrogen 2.605 N/A ASN 371.A N ASP 367.A O no hydrogen 3.267 N/A ASN 371.A ND2 GLN 326.A O no hydrogen 2.789 N/A LEU 372.A N TYR 369.A O no hydrogen 2.987 N/A LYS 373.A N TYR 369.A O no hydrogen 3.297 N/A LYS 373.A NZ TYR 369.A OH no hydrogen 2.307 N/A ARG 374.A NH1 ASP 331.A OD1 no hydrogen 2.742 N/A ARG 374.A NH1 ASN 371.A OD1 no hydrogen 2.657 N/A ARG 374.A NH2 ASP 331.A OD1 no hydrogen 2.269 N/A LEU 375.A N LEU 372.A O no hydrogen 3.312 N/A ASP 377.A N LYS 373.A O no hydrogen 2.549 N/A