Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ov6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N HIS 32.A O no hydrogen 2.827 N/A THR 5.A OG1 THR 87.A OG1 no hydrogen 3.061 N/A LYS 7.A N SER 29.A O no hydrogen 2.649 N/A LYS 7.A NZ ASP 331.A OD1 no hydrogen 3.378 N/A GLN 9.A N TYR 27.A O no hydrogen 2.888 N/A VAL 10.A N GLY 103.A O no hydrogen 2.923 N/A TYR 11.A N ASN 25.A O no hydrogen 2.975 N/A TYR 11.A OH PRO 334.A O no hydrogen 2.627 N/A SER 12.A OG HIS 14.A O no hydrogen 2.677 N/A ARG 13.A N PHE 23.A O no hydrogen 3.108 N/A HIS 14.A N ASN 22.A OD1 no hydrogen 3.003 N/A HIS 14.A ND1 GLU 285.A OE1 no hydrogen 3.133 N/A GLY 19.A N PRO 73.A O no hydrogen 3.017 N/A LYS 20.A N GLU 17.A O no hydrogen 2.896 N/A ASN 22.A N PHE 71.A O no hydrogen 2.767 N/A ASN 22.A ND2 HIS 14.A O no hydrogen 3.132 N/A PHE 23.A N ASN 22.A OD1 no hydrogen 2.823 N/A LEU 24.A N THR 69.A O no hydrogen 2.797 N/A ASN 25.A N TYR 11.A O no hydrogen 2.747 N/A ASN 25.A ND2 TYR 11.A O no hydrogen 2.952 N/A CYS 26.A N TYR 67.A O no hydrogen 2.778 N/A CYS 26.A SG GLN 9.A O no hydrogen 3.982 N/A TYR 27.A N GLN 9.A O no hydrogen 2.700 N/A VAL 28.A N LEU 65.A O no hydrogen 2.806 N/A SER 29.A N LYS 7.A O no hydrogen 2.984 N/A PHE 31.A N PHE 63.A O no hydrogen 3.509 N/A HIS 32.A N ARG 4.A O no hydrogen 2.954 N/A SER 34.A N GLU 191.A OE1 no hydrogen 3.280 N/A SER 34.A N GLU 191.A OE2 no hydrogen 2.955 N/A SER 34.A OG GLU 191.A OE2 no hydrogen 2.455 N/A GLU 37.A N ASN 84.A O no hydrogen 2.895 N/A ASP 39.A N ARG 82.A O no hydrogen 2.762 N/A LEU 41.A N ALA 80.A O no hydrogen 2.785 N/A LYS 42.A N GLU 45.A O no hydrogen 2.639 N/A LYS 42.A NZ TYR 79.A OH no hydrogen 3.560 N/A ASN 43.A N GLU 78.A O no hydrogen 2.647 N/A ASN 43.A ND2 ASP 77.A OD1 no hydrogen 2.821 N/A GLU 45.A N LYS 42.A O no hydrogen 3.097 N/A ARG 46.A NE ASP 39.A OD1 no hydrogen 3.202 N/A ILE 47.A N LEU 40.A O no hydrogen 2.942 N/A GLU 51.A N TYR 68.A O no hydrogen 2.751 N/A HIS 52.A ND1 SER 53.A O no hydrogen 2.655 N/A SER 53.A N LEU 66.A O no hydrogen 3.122 N/A SER 53.A OG ASP 54.A O no hydrogen 3.072 N/A ASP 54.A N GLN 135.A OE1 no hydrogen 2.935 N/A SER 56.A N TYR 64.A O no hydrogen 3.301 N/A SER 56.A OG TYR 64.A OH no hydrogen 2.989 N/A SER 58.A N SER 62.A O no hydrogen 2.675 N/A TRP 61.A N SER 58.A O no hydrogen 2.546 N/A TRP 61.A NE1 ASP 218.A OD1 no hydrogen 2.787 N/A PHE 63.A N PHE 31.A O no hydrogen 3.042 N/A TYR 64.A N SER 56.A O no hydrogen 2.830 N/A LEU 65.A N VAL 28.A O no hydrogen 2.659 N/A LEU 66.A N SER 53.A OG no hydrogen 3.254 N/A TYR 67.A N CYS 26.A O no hydrogen 2.684 N/A TYR 68.A N GLU 51.A O no hydrogen 2.794 N/A THR 69.A N LEU 24.A O no hydrogen 3.203 N/A THR 69.A OG1 LYS 49.A O no hydrogen 2.801 N/A PHE 71.A N ASN 22.A O no hydrogen 2.680 N/A THR 74.A OG1 ASP 77.A OD2 no hydrogen 2.420 N/A ASP 77.A N THR 74.A OG1 no hydrogen 2.729 N/A GLU 78.A N ASN 43.A OD1 no hydrogen 2.888 N/A TYR 79.A OH THR 72.A O no hydrogen 3.077 N/A ALA 80.A N LEU 41.A O no hydrogen 2.942 N/A CYS 81.A N VAL 94.A O no hydrogen 3.184 N/A ARG 82.A N ASP 39.A O no hydrogen 2.756 N/A ARG 82.A NE ASP 39.A OD2 no hydrogen 3.188 N/A ARG 82.A NH2 ASP 39.A OD2 no hydrogen 2.731 N/A VAL 83.A N LYS 92.A O no hydrogen 2.870 N/A ASN 84.A N GLU 37.A O no hydrogen 2.696 N/A HIS 85.A ND1 THR 87.A OG1 no hydrogen 3.110 N/A HIS 85.A NE2 PRO 33.A O no hydrogen 2.950 N/A THR 87.A N HIS 85.A ND1 no hydrogen 3.146 N/A THR 87.A OG1 THR 5.A OG1 no hydrogen 3.061 N/A THR 87.A OG1 HIS 85.A ND1 no hydrogen 3.110 N/A LEU 88.A N HIS 85.A O no hydrogen 2.905 N/A LYS 92.A N VAL 83.A O no hydrogen 3.031 N/A LYS 92.A NZ PRO 6.A O no hydrogen 3.085 N/A VAL 94.A N CYS 81.A O no hydrogen 2.995 N/A TRP 96.A N TYR 79.A O no hydrogen 3.022 N/A ARG 98.A NH1 THR 74.A O no hydrogen 3.543 N/A MET 100.A N ASP 97.A O no hydrogen 2.952 N/A GLY 101.A N ARG 98.A O no hydrogen 3.144 N/A GLY 102.A N ASP 97.A O no hydrogen 2.836 N/A VAL 107.A N LEU 200.A O no hydrogen 3.098 N/A SER 108.A N ASP 132.A OD1 no hydrogen 3.147 N/A SER 108.A OG ASP 132.A OD1 no hydrogen 3.098 N/A PHE 109.A N CYS 198.A O no hydrogen 3.023 N/A HIS 110.A N TRP 130.A O no hydrogen 3.001 N/A VAL 111.A N ALA 196.A O no hydrogen 2.746 N/A ILE 112.A N SER 128.A O no hydrogen 2.905 N/A GLN 113.A N VAL 194.A O no hydrogen 2.909 N/A GLN 113.A NE2 TYR 172.A OH no hydrogen 2.920 N/A ILE 114.A N GLN 126.A O no hydrogen 2.787 N/A PHE 115.A N VAL 192.A O no hydrogen 2.816 N/A SER 116.A N ARG 124.A O no hydrogen 2.968 N/A SER 116.A OG GLU 191.A OE2 no hydrogen 3.234 N/A PHE 117.A N PHE 190.A O no hydrogen 3.136 N/A VAL 118.A N TRP 122.A O no hydrogen 3.127 N/A ASN 119.A N TRP 122.A O no hydrogen 3.424 N/A SER 121.A N ASN 119.A OD1 no hydrogen 2.778 N/A ARG 124.A N SER 116.A O no hydrogen 2.845 N/A ARG 124.A NH2 SER 34.A OG no hydrogen 3.275 N/A GLN 126.A N ILE 114.A O no hydrogen 2.900 N/A SER 128.A N ILE 112.A O no hydrogen 3.047 N/A GLY 129.A N HIS 137.A O no hydrogen 3.052 N/A TRP 130.A N HIS 110.A O no hydrogen 2.931 N/A TRP 130.A NE1 SER 128.A OG no hydrogen 2.752 N/A LEU 131.A N LEU 134.A O no hydrogen 2.778 N/A ASP 132.A N SER 108.A O no hydrogen 2.848 N/A LEU 134.A N LEU 131.A O no hydrogen 3.298 N/A GLN 135.A NE2 ASP 54.A OD2 no hydrogen 3.274 N/A GLN 135.A NE2 HIS 137.A O no hydrogen 2.674 N/A THR 136.A N GLY 129.A O no hydrogen 2.807 N/A THR 136.A OG1 GLY 129.A O no hydrogen 3.176 N/A THR 136.A OG1 HIS 137.A ND1 no hydrogen 2.889 N/A HIS 137.A N GLY 129.A O no hydrogen 3.074 N/A HIS 137.A ND1 THR 136.A OG1 no hydrogen 2.889 N/A HIS 137.A NE2 SER 153.A O no hydrogen 2.646 N/A GLY 138.A N ILE 147.A O no hydrogen 2.862 N/A ASP 140.A N THR 145.A O no hydrogen 2.590 N/A GLU 142.A N ASP 140.A OD1 no hydrogen 3.296 N/A SER 143.A OG THR 145.A OG1 no hydrogen 3.025 N/A GLY 144.A N ASP 140.A O no hydrogen 2.900 N/A THR 145.A N ASP 140.A O no hydrogen 3.391 N/A THR 145.A OG1 SER 143.A OG no hydrogen 3.025 N/A ILE 146.A N GLU 166.A OE1 no hydrogen 3.258 N/A ILE 147.A N GLY 138.A O no hydrogen 2.683 N/A LEU 149.A N THR 136.A O no hydrogen 3.240 N/A HIS 150.A N SER 153.A OG no hydrogen 3.070 N/A HIS 150.A NE2 GLN 135.A O no hydrogen 2.757 N/A SER 153.A N HIS 150.A O no hydrogen 2.898 N/A SER 153.A OG THR 136.A O no hydrogen 2.780 N/A GLN 156.A NE2 ASP 272.A OD1 no hydrogen 2.788 N/A PHE 157.A N LYS 154.A O no hydrogen 3.210 N/A SER 158.A N GLU 161.A OE2 no hydrogen 3.166 N/A SER 158.A OG GLU 161.A OE2 no hydrogen 3.049 N/A LEU 162.A N SER 158.A O no hydrogen 3.166 N/A SER 163.A N ASN 159.A O no hydrogen 2.938 N/A SER 163.A OG ASN 159.A O no hydrogen 3.062 N/A LEU 165.A N GLU 161.A O no hydrogen 3.183 N/A GLU 166.A N LEU 162.A O no hydrogen 3.108 N/A LEU 167.A N SER 163.A O no hydrogen 2.990 N/A LEU 168.A N ASP 164.A O no hydrogen 2.795 N/A PHE 169.A N LEU 165.A O no hydrogen 2.783 N/A ARG 170.A N GLU 166.A O no hydrogen 2.924 N/A ARG 170.A NH1 SER 143.A O no hydrogen 3.416 N/A PHE 171.A N LEU 167.A O no hydrogen 3.055 N/A TYR 172.A N LEU 168.A O no hydrogen 3.003 N/A LEU 173.A N PHE 169.A O no hydrogen 2.819 N/A PHE 174.A N ARG 170.A O no hydrogen 3.048 N/A GLY 175.A N PHE 171.A O no hydrogen 2.803 N/A LEU 176.A N TYR 172.A O no hydrogen 2.865 N/A THR 177.A N LEU 173.A O no hydrogen 3.040 N/A THR 177.A OG1 LEU 173.A O no hydrogen 3.089 N/A THR 177.A OG1 PHE 174.A O no hydrogen 2.776 N/A ARG 178.A N PHE 174.A O no hydrogen 3.174 N/A GLU 179.A N GLY 175.A O no hydrogen 2.984 N/A ILE 180.A N LEU 176.A O no hydrogen 2.680 N/A GLN 181.A N THR 177.A O no hydrogen 2.751 N/A ASP 182.A N ARG 178.A O no hydrogen 3.224 N/A HIS 183.A ND1 HIS 183.A O no hydrogen 2.994 N/A SER 185.A OG ALA 184.A O no hydrogen 2.759 N/A PHE 190.A N PHE 117.A O no hydrogen 3.070 N/A GLU 191.A N ASN 215.A OD1 no hydrogen 2.918 N/A VAL 192.A N PHE 115.A O no hydrogen 2.967 N/A GLN 193.A N ALA 213.A O no hydrogen 3.203 N/A GLN 193.A NE2 TRP 61.A O no hydrogen 2.769 N/A VAL 194.A N GLN 113.A O no hydrogen 3.012 N/A LYS 195.A N GLN 211.A O no hydrogen 2.868 N/A ALA 196.A N VAL 111.A O no hydrogen 3.052 N/A GLY 197.A N PHE 209.A O no hydrogen 2.756 N/A CYS 198.A N PHE 109.A O no hydrogen 2.985 N/A CYS 198.A SG PHE 109.A O no hydrogen 3.989 N/A GLU 199.A N GLU 207.A O no hydrogen 2.831 N/A LEU 200.A N VAL 107.A O no hydrogen 2.812 N/A HIS 201.A N SER 205.A O no hydrogen 2.868 N/A SER 202.A N GLU 105.A O no hydrogen 3.265 N/A SER 202.A OG GLU 105.A O no hydrogen 3.331 N/A GLY 204.A N HIS 201.A O no hydrogen 2.822 N/A GLU 207.A N GLU 199.A O no hydrogen 2.955 N/A PHE 209.A N GLY 197.A O no hydrogen 2.807 N/A GLN 211.A N LYS 195.A O no hydrogen 2.796 N/A VAL 212.A N LEU 220.A O no hydrogen 2.888 N/A ALA 213.A N GLN 193.A O no hydrogen 2.895 N/A PHE 214.A N LEU 217.A O no hydrogen 2.487 N/A ASN 215.A N GLU 191.A O no hydrogen 2.723 N/A LEU 217.A N PHE 214.A O no hydrogen 2.890 N/A LEU 219.A N VAL 212.A O no hydrogen 2.968 N/A LEU 220.A N VAL 212.A O no hydrogen 3.423 N/A SER 221.A N VAL 228.A O no hydrogen 2.799 N/A PHE 222.A N PHE 210.A O no hydrogen 2.979 N/A GLN 223.A N THR 226.A O no hydrogen 2.969 N/A THR 226.A N GLN 223.A O no hydrogen 2.997 N/A THR 226.A OG1 GLN 223.A O no hydrogen 3.380 N/A VAL 228.A N SER 221.A O no hydrogen 2.616 N/A SER 230.A N LEU 219.A O no hydrogen 2.959 N/A GLN 238.A N GLY 234.A O no hydrogen 3.005 N/A GLN 238.A NE2 GLY 234.A O no hydrogen 3.081 N/A SER 239.A N SER 235.A O no hydrogen 2.849 N/A VAL 240.A N LEU 236.A O no hydrogen 2.929 N/A CYS 241.A N ALA 237.A O no hydrogen 2.881 N/A CYS 241.A SG ALA 237.A O no hydrogen 3.336 N/A HIS 242.A N GLN 238.A O no hydrogen 2.823 N/A LEU 243.A N SER 239.A O no hydrogen 2.883 N/A LEU 244.A N VAL 240.A O no hydrogen 3.055 N/A ASN 245.A N CYS 241.A O no hydrogen 2.607 N/A ASN 245.A ND2 TRP 227.A O no hydrogen 3.581 N/A HIS 246.A N HIS 242.A O no hydrogen 2.806 N/A GLN 247.A N LEU 243.A O no hydrogen 2.823 N/A TYR 248.A N LEU 243.A O no hydrogen 3.091 N/A THR 254.A N GLY 250.A O no hydrogen 3.124 N/A THR 254.A OG1 GLY 250.A O no hydrogen 2.532 N/A VAL 255.A N VAL 251.A O no hydrogen 2.697 N/A TYR 256.A N THR 252.A O no hydrogen 2.696 N/A ASN 257.A N GLU 253.A O no hydrogen 3.029 N/A LEU 258.A N THR 254.A O no hydrogen 2.691 N/A ILE 259.A N VAL 255.A O no hydrogen 2.841 N/A ARG 260.A N TYR 256.A O no hydrogen 2.932 N/A SER 261.A N ASN 257.A O no hydrogen 2.764 N/A THR 262.A N ASN 257.A O no hydrogen 3.087 N/A CYS 263.A N LEU 258.A O no hydrogen 2.725 N/A CYS 263.A SG PHE 109.A O no hydrogen 3.639 N/A ARG 265.A N SER 261.A O no hydrogen 3.380 N/A ARG 265.A NH1 GLU 161.A OE1 no hydrogen 3.545 N/A ARG 265.A NH2 GLU 161.A OE1 no hydrogen 3.146 N/A PHE 266.A N THR 262.A O no hydrogen 2.840 N/A LEU 267.A N CYS 263.A O no hydrogen 2.703 N/A LEU 268.A N PRO 264.A O no hydrogen 2.896 N/A GLY 269.A N ARG 265.A O no hydrogen 3.042 N/A LEU 270.A N PHE 266.A O no hydrogen 2.853 N/A LEU 271.A N LEU 267.A O no hydrogen 3.016 N/A ASP 272.A N LEU 268.A O no hydrogen 3.017 N/A ALA 273.A N GLY 269.A O no hydrogen 2.899 N/A GLY 274.A N LEU 270.A O no hydrogen 2.780 N/A LYS 275.A N LEU 271.A O no hydrogen 3.072 N/A VAL 278.A N GLY 274.A O no hydrogen 2.851 N/A VAL 282.A N TYR 309.A O no hydrogen 2.522 N/A LYS 283.A NZ GLU 366.A OE2 no hydrogen 3.519 N/A GLU 285.A N SER 306.A O no hydrogen 3.031 N/A TRP 287.A N HIS 304.A O no hydrogen 2.991 N/A SER 289.A N VAL 302.A O no hydrogen 3.126 N/A SER 289.A OG SER 290.A O no hydrogen 2.842 N/A SER 289.A OG HIS 304.A NE2 no hydrogen 2.914 N/A SER 290.A OG ASP 99.A O no hydrogen 2.788 N/A GLY 291.A N GLN 300.A O no hydrogen 2.890 N/A SER 293.A OG GLY 295.A O no hydrogen 3.027 N/A GLY 295.A N SER 293.A OG no hydrogen 3.178 N/A ARG 298.A N GLY 295.A O no hydrogen 3.361 N/A ARG 298.A NH2 ASP 347.A OD2 no hydrogen 3.278 N/A LEU 299.A N VAL 348.A O no hydrogen 2.559 N/A LEU 301.A N LEU 346.A O no hydrogen 2.762 N/A VAL 302.A N SER 289.A O no hydrogen 2.849 N/A CYS 303.A N ALA 344.A O no hydrogen 2.810 N/A HIS 304.A N TRP 287.A O no hydrogen 2.818 N/A HIS 304.A ND1 TYR 341.A OH no hydrogen 2.637 N/A HIS 304.A NE2 SER 289.A OG no hydrogen 2.914 N/A VAL 305.A N LEU 342.A O no hydrogen 2.785 N/A SER 306.A N GLU 285.A O no hydrogen 2.993 N/A SER 306.A OG ARG 13.A O no hydrogen 2.822 N/A GLY 307.A N TRP 340.A O no hydrogen 2.556 N/A TYR 309.A N VAL 282.A O no hydrogen 3.125 N/A TRP 314.A N LYS 361.A O no hydrogen 2.796 N/A MET 316.A N ARG 359.A O no hydrogen 2.951 N/A TRP 317.A NE1 ALA 344.A O no hydrogen 3.109 N/A MET 318.A N SER 357.A O no hydrogen 2.736 N/A ARG 319.A N GLN 322.A O no hydrogen 2.808 N/A ARG 319.A NH1 ALA 354.A O no hydrogen 2.945 N/A ARG 319.A NH2 GLU 352.A O no hydrogen 2.664 N/A GLN 322.A N ARG 319.A O no hydrogen 3.155 N/A GLN 324.A N TRP 317.A O no hydrogen 2.850 N/A THR 327.A N GLN 324.A O no hydrogen 3.186 N/A THR 327.A OG1 GLN 324.A O no hydrogen 2.751 N/A GLN 328.A N THR 345.A O no hydrogen 2.868 N/A GLY 330.A N ARG 343.A O no hydrogen 2.832 N/A LEU 333.A N TYR 341.A O no hydrogen 2.689 N/A ASN 335.A N THR 339.A O no hydrogen 2.877 N/A ASN 335.A ND2 SER 306.A OG no hydrogen 3.158 N/A ASN 335.A ND2 THR 339.A OG1 no hydrogen 3.410 N/A GLY 338.A N ASN 335.A O no hydrogen 3.351 N/A TRP 340.A N PHE 308.A O no hydrogen 3.141 N/A TYR 341.A N LEU 333.A O no hydrogen 2.714 N/A TYR 341.A OH HIS 304.A ND1 no hydrogen 2.637 N/A LEU 342.A N VAL 305.A O no hydrogen 2.779 N/A ARG 343.A NH1 VAL 10.A O no hydrogen 3.435 N/A ARG 343.A NH2 VAL 10.A O no hydrogen 3.410 N/A ALA 344.A N CYS 303.A O no hydrogen 2.914 N/A THR 345.A N GLN 328.A O no hydrogen 2.906 N/A THR 345.A OG1 GLN 328.A O no hydrogen 3.557 N/A LEU 346.A N LEU 301.A O no hydrogen 3.049 N/A VAL 348.A N LEU 299.A O no hydrogen 2.849 N/A ASP 350.A N GLY 297.A O no hydrogen 2.560 N/A GLU 352.A N ALA 349.A O no hydrogen 3.283 N/A ALA 353.A N ASP 350.A O no hydrogen 3.467 N/A LEU 356.A N ALA 353.A O no hydrogen 3.340 N/A SER 357.A N MET 318.A O no hydrogen 2.991 N/A CYS 358.A N LEU 372.A O no hydrogen 2.761 N/A ARG 359.A N MET 316.A O no hydrogen 2.931 N/A VAL 360.A N ILE 370.A O no hydrogen 3.200 N/A LYS 361.A N TRP 314.A O no hydrogen 2.509 N/A LYS 361.A NZ ASP 369.A OD2 no hydrogen 3.031 N/A HIS 362.A ND1 SER 364.A OG no hydrogen 2.597 N/A HIS 362.A NE2 PRO 310.A O no hydrogen 2.671 N/A SER 364.A N HIS 362.A ND1 no hydrogen 3.266 N/A SER 364.A OG VAL 282.A O no hydrogen 3.507 N/A SER 364.A OG HIS 362.A ND1 no hydrogen 2.597 N/A LEU 365.A N HIS 362.A O no hydrogen 2.856 N/A GLN 368.A N LEU 365.A O no hydrogen 2.977 N/A ILE 370.A N VAL 360.A O no hydrogen 3.491 N/A LEU 372.A N CYS 358.A O no hydrogen 3.097 N/A TRP 374.A N LEU 356.A O no hydrogen 3.075 N/A HIS 375.A ND1 HIS 376.A O no hydrogen 2.901 N/A