Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r1g_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLY 174.A O no hydrogen 2.994 N/A PHE 5.A N ASP 177.A OD1 no hydrogen 3.185 N/A MET 8.A N PHE 5.A O no hydrogen 3.227 N/A ASP 10.A N SER 170.A OG no hydrogen 2.714 N/A ASN 11.A ND2 HIS 95.A O no hydrogen 2.981 N/A ASN 11.A ND2 MET 171.A O no hydrogen 3.328 N/A LEU 12.A N GLY 169.A O no hydrogen 2.890 N/A ARG 13.A N TYR 21.A O no hydrogen 3.186 N/A ARG 13.A NE VAL 167.A O no hydrogen 3.463 N/A ARG 13.A NH2 ASP 10.A OD2 no hydrogen 3.198 N/A SER 16.A N ALA 165.A O no hydrogen 2.958 N/A SER 16.A OG PRO 305.A O no hydrogen 3.393 N/A GLN 18.A N LYS 15.A O no hydrogen 2.707 N/A TYR 21.A N ARG 13.A O no hydrogen 2.773 N/A VAL 22.A N ILE 35.A O no hydrogen 2.693 N/A MET 24.A N LEU 33.A O no hydrogen 2.823 N/A THR 25.A N SER 92.A O no hydrogen 2.778 N/A THR 25.A OG1 SER 92.A O no hydrogen 3.413 N/A VAL 26.A N GLN 31.A O no hydrogen 2.756 N/A GLY 27.A N LEU 90.A O no hydrogen 2.982 N/A SER 28.A N SER 63.A OG no hydrogen 3.177 N/A SER 28.A OG THR 65.A OG1 no hydrogen 2.911 N/A GLN 31.A N VAL 26.A O no hydrogen 2.843 N/A GLN 31.A NE2 GLN 59.A O no hydrogen 2.683 N/A LEU 33.A N MET 24.A O no hydrogen 2.913 N/A ASN 34.A N GLU 122.A OE2 no hydrogen 2.833 N/A ASN 34.A ND2 ASN 120.A O no hydrogen 2.972 N/A ILE 35.A N VAL 22.A O no hydrogen 2.808 N/A LEU 36.A N GLY 123.A O no hydrogen 2.759 N/A VAL 37.A N TYR 20.A O no hydrogen 2.706 N/A ASP 38.A N LEU 125.A O no hydrogen 3.147 N/A THR 39.A N SER 226.A OG no hydrogen 2.983 N/A THR 39.A OG1 VAL 224.A O no hydrogen 2.788 N/A THR 39.A OG1 SER 226.A OG no hydrogen 3.316 N/A GLY 40.A N ASP 38.A OD1 no hydrogen 2.977 N/A SER 41.A OG ASP 38.A OD2 no hydrogen 2.565 N/A SER 42.A OG TYR 129.A O no hydrogen 2.520 N/A ASN 43.A ND2 ARG 134.A O no hydrogen 2.695 N/A ALA 45.A N ILE 124.A O no hydrogen 3.150 N/A VAL 46.A N ALA 106.A O no hydrogen 3.004 N/A GLY 47.A N GLU 122.A O no hydrogen 2.887 N/A ALA 48.A N ILE 108.A O no hydrogen 3.092 N/A PHE 53.A N HIS 51.A ND1 no hydrogen 3.073 N/A ARG 56.A NH1 ASN 120.A OD1 no hydrogen 2.912 N/A ARG 56.A NH1 GLU 122.A OE1 no hydrogen 3.235 N/A TYR 58.A N GLY 47.A O no hydrogen 2.785 N/A TYR 58.A OH ASP 89.A OD2 no hydrogen 2.621 N/A GLN 59.A N GLN 31.A OE1 no hydrogen 2.840 N/A ARG 60.A NH1 GLU 85.A OE2 no hydrogen 2.774 N/A ARG 60.A NH2 GLU 85.A OE2 no hydrogen 3.420 N/A GLN 61.A N GLN 61.A OE1 no hydrogen 3.002 N/A LEU 62.A N GLN 59.A O no hydrogen 2.936 N/A SER 63.A N ARG 60.A O no hydrogen 2.930 N/A SER 63.A OG THR 65.A OG1 no hydrogen 3.187 N/A SER 63.A OG ASP 89.A OD1 no hydrogen 3.138 N/A SER 63.A OG ASP 89.A OD2 no hydrogen 2.642 N/A SER 64.A N SER 28.A O no hydrogen 3.005 N/A SER 64.A OG SER 28.A O no hydrogen 3.247 N/A THR 65.A OG1 SER 28.A OG no hydrogen 2.911 N/A THR 65.A OG1 SER 63.A OG no hydrogen 3.187 N/A THR 65.A OG1 ASP 89.A OD1 no hydrogen 2.769 N/A TYR 66.A N SER 63.A O no hydrogen 3.203 N/A ARG 67.A N THR 88.A O no hydrogen 2.872 N/A LEU 69.A N LEU 86.A O no hydrogen 3.285 N/A VAL 73.A N GLY 84.A O no hydrogen 2.806 N/A VAL 75.A N TRP 82.A O no hydrogen 2.769 N/A TYR 77.A OH ASP 38.A OD2 no hydrogen 3.249 N/A LYS 81.A NZ GLU 110.A OE2 no hydrogen 3.481 N/A TRP 82.A N VAL 75.A O no hydrogen 3.129 N/A GLU 83.A N GLU 110.A O no hydrogen 2.943 N/A GLY 84.A N VAL 73.A O no hydrogen 2.834 N/A GLU 85.A N ALA 107.A O no hydrogen 2.927 N/A LEU 86.A N LYS 71.A O no hydrogen 2.726 N/A THR 88.A N ARG 67.A O no hydrogen 2.826 N/A ASP 89.A N ALA 103.A O no hydrogen 3.310 N/A LEU 90.A N ASP 89.A OD1 no hydrogen 2.727 N/A VAL 91.A N VAL 101.A O no hydrogen 2.614 N/A SER 92.A N THR 25.A O no hydrogen 2.956 N/A SER 92.A OG VAL 99.A O no hydrogen 3.378 N/A VAL 101.A N VAL 91.A O no hydrogen 2.983 N/A ARG 102.A NH2 THR 65.A O no hydrogen 2.743 N/A ALA 103.A N ASP 89.A O no hydrogen 3.440 N/A ILE 105.A N GLY 87.A O no hydrogen 2.834 N/A ALA 106.A N PHE 44.A O no hydrogen 2.873 N/A ALA 107.A N GLU 85.A O no hydrogen 2.936 N/A ILE 108.A N VAL 46.A O no hydrogen 2.759 N/A THR 109.A N GLU 83.A O no hydrogen 3.060 N/A GLU 110.A N GLU 83.A O no hydrogen 3.355 N/A ASP 112.A N LYS 81.A O no hydrogen 3.004 N/A GLY 118.A N PHE 53.A O no hydrogen 3.388 N/A SER 119.A N ILE 116.A O no hydrogen 3.094 N/A SER 119.A OG ILE 116.A O no hydrogen 3.126 N/A ASN 120.A ND2 TYR 21.A OH no hydrogen 3.154 N/A TRP 121.A NE1 GLN 18.A O no hydrogen 2.931 N/A GLU 122.A N ASN 34.A O no hydrogen 2.742 N/A GLY 123.A N ASN 34.A O no hydrogen 3.382 N/A ILE 124.A N ALA 45.A O no hydrogen 2.681 N/A LEU 125.A N LEU 36.A O no hydrogen 2.827 N/A GLY 126.A N ASN 43.A O no hydrogen 2.992 N/A LEU 127.A N ASP 38.A O no hydrogen 2.822 N/A ALA 128.A N SER 41.A O no hydrogen 2.644 N/A TYR 129.A N TRP 194.A O no hydrogen 2.917 N/A ILE 132.A N TYR 129.A O no hydrogen 3.196 N/A ALA 133.A N ALA 130.A O no hydrogen 2.859 N/A ARG 134.A N ASN 43.A OD1 no hydrogen 2.809 N/A SER 138.A N ASP 136.A OD2 no hydrogen 3.056 N/A SER 138.A OG ASP 136.A OD2 no hydrogen 2.645 N/A LEU 139.A N ASP 136.A O no hydrogen 3.146 N/A SER 145.A N PRO 141.A O no hydrogen 2.940 N/A SER 145.A OG PRO 141.A O no hydrogen 3.260 N/A LEU 146.A N PHE 142.A O no hydrogen 2.799 N/A VAL 147.A N PHE 143.A O no hydrogen 3.094 N/A LYS 148.A N ASP 144.A O no hydrogen 3.156 N/A LYS 148.A NZ GLU 140.A OE1 no hydrogen 3.117 N/A LYS 148.A NZ GLU 140.A OE2 no hydrogen 3.138 N/A GLN 149.A N LEU 146.A O no hydrogen 3.350 N/A THR 150.A N LEU 146.A O no hydrogen 2.946 N/A THR 150.A OG1 LEU 146.A O no hydrogen 2.591 N/A VAL 152.A N THR 150.A OG1 no hydrogen 3.416 N/A PHE 156.A N PHE 340.A O no hydrogen 3.402 N/A SER 157.A N ILE 172.A O no hydrogen 2.978 N/A SER 157.A OG GLY 175.A O no hydrogen 3.424 N/A SER 157.A OG TYR 337.A OH no hydrogen 2.647 N/A LEU 158.A N VAL 338.A O no hydrogen 2.763 N/A GLN 159.A N SER 170.A O no hydrogen 2.684 N/A CYS 161.A N GLY 168.A O no hydrogen 3.174 N/A CYS 161.A SG GLN 159.A O no hydrogen 3.549 N/A VAL 167.A N GLY 14.A O no hydrogen 2.828 N/A GLY 169.A N LEU 12.A O no hydrogen 3.022 N/A SER 170.A N GLN 159.A O no hydrogen 3.004 N/A SER 170.A OG GLN 159.A OE1 no hydrogen 3.244 N/A MET 171.A N ASN 11.A OD1 no hydrogen 2.793 N/A ILE 172.A N SER 157.A O no hydrogen 2.851 N/A GLY 174.A N LEU 155.A O no hydrogen 2.741 N/A ASP 177.A N TYR 337.A OH no hydrogen 3.095 N/A HIS 178.A ND1 TYR 181.A OH no hydrogen 3.263 N/A SER 179.A N ASP 177.A OD2 no hydrogen 3.000 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 2.537 N/A LEU 180.A N ASP 177.A O no hydrogen 3.393 N/A TYR 181.A OH HIS 178.A ND1 no hydrogen 3.263 N/A THR 182.A N VAL 351.A O no hydrogen 2.962 N/A TRP 186.A N PHE 349.A O no hydrogen 3.040 N/A THR 188.A N ILE 347.A O no hydrogen 2.945 N/A THR 188.A OG1 MET 285.A O no hydrogen 2.838 N/A ILE 190.A N LYS 345.A O no hydrogen 3.124 N/A ARG 191.A N GLU 197.A O no hydrogen 2.925 N/A ARG 191.A NH1 GLU 197.A OE2 no hydrogen 3.353 N/A ARG 192.A NE GLU 131.A OE1 no hydrogen 3.010 N/A ARG 192.A NH1 GLU 131.A OE2 no hydrogen 2.681 N/A TRP 194.A N TYR 195.A O no hydrogen 3.248 N/A TRP 194.A NE1 GLU 197.A OE1 no hydrogen 2.952 N/A TYR 196.A OH LEU 127.A O no hydrogen 2.720 N/A VAL 198.A N SER 222.A O no hydrogen 2.924 N/A ILE 200.A N ASN 218.A OD1 no hydrogen 2.735 N/A VAL 201.A N TYR 283.A O no hydrogen 2.753 N/A ARG 202.A NE GLU 204.A OE2 no hydrogen 2.761 N/A ARG 202.A NH2 GLU 204.A OE2 no hydrogen 3.390 N/A GLU 204.A N SER 281.A O no hydrogen 2.988 N/A ILE 205.A N GLN 208.A O no hydrogen 2.838 N/A ASN 206.A N VAL 279.A O no hydrogen 2.852 N/A GLN 208.A N ILE 205.A O no hydrogen 2.873 N/A LEU 210.A N VAL 203.A O no hydrogen 3.065 N/A CYS 214.A N ASP 213.A OD1 no hydrogen 2.670 N/A CYS 214.A SG VAL 201.A O no hydrogen 3.314 N/A CYS 214.A SG ASP 373.A OD2 no hydrogen 3.833 N/A LYS 215.A NZ GLY 378.A O no hydrogen 3.212 N/A GLU 216.A N ASP 213.A O no hydrogen 3.115 N/A TYR 217.A N CYS 214.A O no hydrogen 3.377 N/A ASN 218.A ND2 ILE 200.A O no hydrogen 2.807 N/A ASN 218.A ND2 CYS 214.A O no hydrogen 3.278 N/A ASN 218.A ND2 CYS 377.A O no hydrogen 3.180 N/A LYS 221.A NZ ASP 220.A OD1 no hydrogen 3.331 N/A LYS 221.A NZ THR 324.A O no hydrogen 3.275 N/A SER 222.A OG ASN 218.A OD1 no hydrogen 2.690 N/A ILE 223.A N THR 326.A O no hydrogen 3.018 N/A VAL 224.A N TYR 196.A O no hydrogen 3.252 N/A ASP 225.A N MET 328.A O no hydrogen 3.026 N/A SER 226.A N THR 39.A OG1 no hydrogen 2.783 N/A SER 226.A OG VAL 37.A O no hydrogen 2.765 N/A SER 226.A OG THR 39.A OG1 no hydrogen 3.316 N/A GLY 227.A N ASP 225.A OD1 no hydrogen 2.754 N/A THR 228.A N ASP 225.A O no hydrogen 3.221 N/A THR 228.A OG1 ASP 225.A OD2 no hydrogen 2.559 N/A LEU 231.A N ALA 318.A O no hydrogen 3.002 N/A ARG 232.A N VAL 327.A O no hydrogen 2.950 N/A ARG 232.A NH2 GLN 321.A O no hydrogen 3.296 N/A LEU 233.A N SER 320.A O no hydrogen 3.066 N/A PHE 238.A N PRO 234.A O no hydrogen 2.809 N/A GLU 239.A N LYS 235.A O no hydrogen 2.853 N/A ALA 240.A N LYS 236.A O no hydrogen 2.996 N/A ALA 241.A N VAL 237.A O no hydrogen 2.831 N/A VAL 242.A N PHE 238.A O no hydrogen 3.093 N/A SER 244.A N ALA 240.A O no hydrogen 2.867 N/A ILE 245.A N ALA 241.A O no hydrogen 2.740 N/A LYS 246.A N VAL 242.A O no hydrogen 2.941 N/A ALA 247.A N LYS 243.A O no hydrogen 3.044 N/A ALA 248.A N ILE 245.A O no hydrogen 2.943 N/A SER 249.A N LYS 246.A O no hydrogen 3.381 N/A SER 249.A OG ILE 245.A O no hydrogen 2.649 N/A SER 249.A OG LYS 246.A O no hydrogen 3.310 N/A THR 251.A OG1 THR 251.A O no hydrogen 2.518 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.607 N/A PHE 258.A N PRO 255.A O no hydrogen 3.300 N/A TRP 259.A N ASP 256.A O no hydrogen 3.019 N/A LEU 260.A N GLY 257.A O no hydrogen 2.989 N/A GLY 261.A N PHE 258.A O no hydrogen 2.979 N/A GLU 262.A N GLY 257.A O no hydrogen 2.942 N/A GLN 263.A N GLY 257.A O no hydrogen 3.478 N/A VAL 265.A N TYR 315.A O no hydrogen 3.065 N/A TRP 267.A N ASP 313.A O no hydrogen 2.922 N/A ALA 269.A N GLN 311.A O no hydrogen 3.060 N/A GLY 270.A N ASP 313.A OD1 no hydrogen 2.939 N/A THR 271.A N GLN 268.A O no hydrogen 2.677 N/A THR 272.A OG1 TYR 315.A OH no hydrogen 2.757 N/A ILE 276.A N PRO 273.A O no hydrogen 3.493 N/A PHE 277.A N TRP 274.A O no hydrogen 2.863 N/A VAL 279.A N ASN 206.A OD1 no hydrogen 2.871 N/A ILE 280.A N ILE 297.A O no hydrogen 3.054 N/A SER 281.A N GLU 204.A O no hydrogen 2.930 N/A SER 281.A OG THR 296.A OG1 no hydrogen 3.052 N/A LEU 282.A N ILE 295.A O no hydrogen 2.985 N/A TYR 283.A N ARG 202.A O no hydrogen 2.689 N/A TYR 283.A OH GLU 204.A OE1 no hydrogen 2.759 N/A LEU 284.A N PHE 293.A O no hydrogen 2.702 N/A MET 285.A N ILE 199.A O no hydrogen 3.014 N/A GLY 286.A N GLN 291.A O no hydrogen 2.928 N/A GLN 291.A N VAL 288.A O no hydrogen 3.291 N/A SER 292.A N PHE 369.A O no hydrogen 2.753 N/A SER 292.A OG PHE 369.A O no hydrogen 3.441 N/A SER 292.A OG THR 371.A OG1 no hydrogen 3.188 N/A PHE 293.A N LEU 284.A O no hydrogen 3.226 N/A ARG 294.A N GLU 366.A O no hydrogen 2.855 N/A ARG 294.A NH1 TYR 283.A OH no hydrogen 2.992 N/A ARG 294.A NH2 GLU 366.A OE2 no hydrogen 3.125 N/A ILE 295.A N LEU 282.A O no hydrogen 3.133 N/A THR 296.A N ALA 364.A O no hydrogen 2.770 N/A THR 296.A OG1 SER 281.A OG no hydrogen 3.052 N/A ILE 297.A N ILE 280.A O no hydrogen 2.880 N/A LEU 298.A N GLN 301.A OE1 no hydrogen 2.791 N/A GLN 300.A N GLN 300.A OE1 no hydrogen 2.789 N/A GLN 300.A NE2 ASP 358.A OD2 no hydrogen 2.996 N/A GLN 301.A N LEU 298.A O no hydrogen 2.780 N/A TYR 302.A N LEU 298.A O no hydrogen 3.338 N/A TYR 302.A OH PRO 278.A O no hydrogen 2.659 N/A ARG 304.A N LYS 316.A O no hydrogen 3.385 N/A ARG 304.A NH1 PRO 305.A O no hydrogen 3.438 N/A VAL 306.A N CYS 314.A O no hydrogen 3.113 N/A THR 309.A OG1 VAL 307.A O no hydrogen 3.234 N/A ASP 312.A N THR 309.A O no hydrogen 2.803 N/A ASP 313.A N TRP 267.A O no hydrogen 2.873 N/A TYR 315.A N VAL 265.A O no hydrogen 2.935 N/A TYR 315.A OH THR 272.A OG1 no hydrogen 2.757 N/A LYS 316.A N ARG 304.A O no hydrogen 2.999 N/A ALA 318.A N TYR 302.A O no hydrogen 2.971 N/A SER 320.A OG ASN 230.A OD1 no hydrogen 3.324 N/A SER 322.A N LEU 233.A O no hydrogen 2.791 N/A SER 322.A OG GLY 325.A O no hydrogen 2.622 N/A THR 324.A N SER 322.A OG no hydrogen 3.263 N/A THR 326.A N LYS 221.A O no hydrogen 2.657 N/A THR 326.A OG1 TYR 217.A O no hydrogen 2.592 N/A VAL 327.A N ARG 232.A O no hydrogen 2.934 N/A MET 328.A N ILE 223.A O no hydrogen 2.900 N/A ALA 330.A N THR 228.A O no hydrogen 2.662 N/A VAL 331.A N THR 229.A O no hydrogen 3.237 N/A ILE 332.A N GLY 329.A O no hydrogen 3.011 N/A MET 333.A N ALA 330.A O no hydrogen 3.119 N/A PHE 336.A N MET 333.A O no hydrogen 3.278 N/A TYR 337.A N ALA 350.A O no hydrogen 2.590 N/A VAL 339.A N GLY 348.A O no hydrogen 2.715 N/A PHE 340.A N PHE 156.A O no hydrogen 2.930 N/A ARG 342.A NE ASN 154.A OD1 no hydrogen 2.688 N/A ARG 342.A NH1 TYR 196.A OH no hydrogen 3.029 N/A ARG 342.A NH2 ASP 144.A OD2 no hydrogen 3.489 N/A ALA 343.A N ASN 154.A O no hydrogen 2.923 N/A ARG 344.A N ASP 341.A OD1 no hydrogen 3.026 N/A LYS 345.A N ARG 342.A O no hydrogen 3.398 N/A ARG 346.A N ASP 341.A O no hydrogen 2.943 N/A ARG 346.A NE ASP 341.A OD2 no hydrogen 3.051 N/A ARG 346.A NH1 GLU 287.A OE1 no hydrogen 3.473 N/A ARG 346.A NH1 GLU 287.A OE2 no hydrogen 2.871 N/A ARG 346.A NH2 ASP 341.A OD2 no hydrogen 3.521 N/A ILE 347.A N THR 188.A O no hydrogen 2.981 N/A GLY 348.A N VAL 339.A O no hydrogen 2.820 N/A PHE 349.A N TRP 186.A O no hydrogen 3.059 N/A SER 352.A N GLY 335.A O no hydrogen 3.487 N/A SER 352.A OG GLY 335.A O no hydrogen 3.069 N/A ALA 353.A N LEU 180.A O no hydrogen 2.698 N/A CYS 354.A SG LEU 160.A O no hydrogen 3.890 N/A CYS 354.A SG SER 352.A OG no hydrogen 3.699 N/A HIS 355.A N SER 352.A O no hydrogen 3.171 N/A ASP 358.A N ARG 361.A O no hydrogen 3.062 N/A PHE 360.A N ASP 358.A OD1 no hydrogen 3.163 N/A ARG 361.A N ASP 358.A OD1 no hydrogen 2.648 N/A ARG 361.A NH1 PHE 277.A O no hydrogen 2.755 N/A ARG 361.A NH2 PHE 277.A O no hydrogen 2.817 N/A THR 362.A OG1 ALA 363.A O no hydrogen 3.341 N/A ALA 363.A N VAL 356.A O no hydrogen 3.246 N/A ALA 364.A N THR 296.A O no hydrogen 3.236 N/A GLU 366.A N ARG 294.A O no hydrogen 2.970 N/A PHE 369.A N SER 292.A O no hydrogen 2.677 N/A THR 371.A N ASN 290.A O no hydrogen 2.664 N/A THR 371.A OG1 SER 292.A OG no hydrogen 3.188 N/A ASP 376.A N ASP 373.A O no hydrogen 3.188 N/A CYS 377.A N MET 374.A O no hydrogen 3.116 N/A CYS 377.A SG MET 374.A O no hydrogen 2.906 N/A