Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1b3e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 30.A O no hydrogen 2.785 N/A THR 2.A OG1 SER 33.A OG no hydrogen 3.101 N/A VAL 3.A N SER 33.A O no hydrogen 2.660 N/A ARG 4.A N ASP 55.A OD2 no hydrogen 3.012 N/A ARG 4.A NE ASP 55.A OD2 no hydrogen 2.942 N/A ARG 4.A NH1 ASN 52.A O no hydrogen 2.874 N/A ARG 4.A NH2 ASN 52.A O no hydrogen 3.147 N/A ARG 4.A NH2 ASN 52.A OD1 no hydrogen 2.642 N/A ARG 4.A NH2 ASP 55.A OD1 no hydrogen 2.818 N/A TRP 5.A N ALA 35.A O no hydrogen 2.694 N/A CYS 6.A N ALA 56.A O no hydrogen 2.867 N/A CYS 6.A SG VAL 37.A O no hydrogen 4.020 N/A ALA 7.A N VAL 37.A O no hydrogen 2.591 N/A VAL 8.A N GLU 12.A OE1 no hydrogen 2.934 N/A SER 9.A N LYS 39.A O no hydrogen 2.797 N/A ALA 13.A N SER 9.A O no hydrogen 3.142 N/A THR 14.A N GLU 10.A O no hydrogen 2.944 N/A THR 14.A OG1 GLU 10.A O no hydrogen 3.277 N/A LYS 15.A N HIS 11.A O no hydrogen 2.957 N/A LYS 15.A NZ LEU 281.A O no hydrogen 2.763 N/A LYS 15.A NZ SER 283.A O no hydrogen 3.267 N/A LYS 15.A NZ LEU 290.A O no hydrogen 2.991 N/A CYS 16.A N GLU 12.A O no hydrogen 2.723 N/A GLN 17.A N ALA 13.A O no hydrogen 2.899 N/A SER 18.A N THR 14.A O no hydrogen 3.212 N/A PHE 19.A N LYS 15.A O no hydrogen 2.679 N/A ARG 20.A N CYS 16.A O no hydrogen 2.687 N/A ARG 20.A NE GLN 17.A O no hydrogen 3.466 N/A ARG 20.A NH2 GLN 17.A OE1 no hydrogen 3.169 N/A ARG 20.A NH2 ASP 21.A OD2 no hydrogen 3.274 N/A ASP 21.A N GLN 17.A O no hydrogen 2.920 N/A HIS 22.A N SER 18.A O no hydrogen 3.135 N/A HIS 22.A ND1 SER 18.A O no hydrogen 2.822 N/A MET 23.A N PHE 19.A O no hydrogen 3.054 N/A LYS 24.A N ARG 20.A O no hydrogen 3.112 N/A SER 25.A N HIS 22.A O no hydrogen 3.196 N/A SER 25.A OG HIS 22.A O no hydrogen 2.685 N/A VAL 26.A N MET 23.A O no hydrogen 2.881 N/A ILE 27.A N MET 23.A O no hydrogen 3.082 N/A GLY 31.A N PRO 28.A O no hydrogen 2.683 N/A SER 33.A N LYS 1.A O no hydrogen 2.710 N/A SER 33.A OG LYS 1.A O no hydrogen 3.504 N/A SER 33.A OG THR 2.A OG1 no hydrogen 3.101 N/A ALA 35.A N VAL 3.A O no hydrogen 2.687 N/A VAL 37.A N TRP 5.A O no hydrogen 2.720 N/A LYS 38.A NZ GLU 10.A OE1 no hydrogen 2.700 N/A LYS 38.A NZ GLU 10.A OE2 no hydrogen 2.898 N/A LYS 39.A N ALA 7.A O no hydrogen 2.727 N/A LYS 39.A NZ GLU 53.A OE1 no hydrogen 3.225 N/A CYS 45.A N SER 41.A O no hydrogen 3.212 N/A CYS 45.A SG SER 41.A O no hydrogen 3.949 N/A ILE 46.A N TYR 42.A O no hydrogen 2.902 N/A ARG 47.A N LEU 43.A O no hydrogen 2.948 N/A ALA 48.A N ASP 44.A O no hydrogen 2.814 N/A ILE 49.A N CYS 45.A O no hydrogen 3.053 N/A ALA 50.A N ILE 46.A O no hydrogen 3.116 N/A ALA 51.A N ARG 47.A O no hydrogen 2.780 N/A ASN 52.A N ILE 49.A O no hydrogen 2.995 N/A GLU 53.A N ALA 48.A O no hydrogen 2.800 N/A ASP 55.A N ARG 4.A O no hydrogen 2.730 N/A ALA 56.A N ARG 4.A O no hydrogen 3.275 N/A THR 58.A OG1 LEU 291.A O no hydrogen 2.793 N/A LEU 59.A N THR 247.A O no hydrogen 2.966 N/A GLY 62.A N ASP 60.A OD2 no hydrogen 3.119 N/A LEU 63.A N ASP 60.A O no hydrogen 2.984 N/A VAL 64.A N ALA 61.A O no hydrogen 3.004 N/A TYR 65.A N GLY 62.A O no hydrogen 3.313 N/A ALA 67.A N LEU 63.A O no hydrogen 3.249 N/A TYR 68.A N VAL 64.A O no hydrogen 3.264 N/A LEU 69.A N TYR 65.A O no hydrogen 3.445 N/A ASN 72.A ND2 ASP 66.A O no hydrogen 3.170 N/A ASN 73.A N LEU 69.A O no hydrogen 2.824 N/A LEU 74.A N ALA 67.A O no hydrogen 2.749 N/A LYS 75.A N ALA 250.A O no hydrogen 2.727 N/A LYS 75.A NZ GLU 257.A OE2 no hydrogen 2.933 N/A VAL 77.A N VAL 248.A O no hydrogen 2.925 N/A ALA 79.A N LEU 300.A O no hydrogen 2.712 N/A GLU 80.A N HIS 246.A O no hydrogen 2.979 N/A PHE 81.A N GLY 298.A O no hydrogen 2.952 N/A TYR 82.A N GLN 89.A O no hydrogen 2.860 N/A TYR 82.A OH GLU 80.A OE1 no hydrogen 2.707 N/A SER 84.A N ASP 87.A O no hydrogen 3.099 N/A SER 84.A OG GLU 86.A OE1 no hydrogen 3.122 N/A ASP 87.A N SER 84.A OG no hydrogen 2.915 N/A GLN 89.A N TYR 82.A O no hydrogen 2.896 N/A TYR 92.A N VAL 243.A O no hydrogen 2.950 N/A TYR 92.A OH HIS 246.A NE2 no hydrogen 3.208 N/A TYR 93.A N HIS 204.A ND1 no hydrogen 3.257 N/A ALA 94.A N ALA 241.A O no hydrogen 2.788 N/A VAL 95.A N VAL 202.A O no hydrogen 2.875 N/A VAL 97.A N ALA 200.A O no hydrogen 2.925 N/A VAL 98.A N GLU 221.A O no hydrogen 3.053 N/A LYS 99.A NZ LEU 192.A O no hydrogen 3.346 N/A LYS 99.A NZ LYS 193.A O no hydrogen 2.892 N/A LYS 100.A N ASN 219.A O no hydrogen 2.676 N/A LYS 100.A NZ ASP 218.A O no hydrogen 2.619 N/A SER 102.A OG LYS 99.A O no hydrogen 2.920 N/A PHE 104.A N SER 102.A O no hydrogen 3.201 N/A GLN 105.A N GLN 108.A OE1 no hydrogen 2.657 N/A ASN 107.A N ASN 227.A OD1 no hydrogen 2.738 N/A GLN 108.A N GLN 105.A O no hydrogen 2.969 N/A ARG 110.A NH1 GLU 138.A OE2 no hydrogen 2.596 N/A ARG 110.A NH2 GLU 138.A OE1 no hydrogen 2.942 N/A ARG 110.A NH2 GLU 138.A OE2 no hydrogen 2.943 N/A GLY 111.A N PHE 150.A O no hydrogen 2.787 N/A LYS 112.A N LEU 109.A O no hydrogen 3.118 N/A LYS 112.A NZ GLN 108.A O no hydrogen 2.603 N/A LYS 113.A N ASP 198.A OD2 no hydrogen 3.134 N/A LYS 113.A NZ SER 152.A O no hydrogen 3.216 N/A LYS 113.A NZ SER 152.A OG no hydrogen 3.006 N/A SER 114.A N GLY 153.A O no hydrogen 3.145 N/A SER 114.A OG HIS 116.A NE2 no hydrogen 2.714 N/A SER 114.A OG SER 154.A OG no hydrogen 2.840 N/A CYS 115.A N VAL 199.A O no hydrogen 2.843 N/A HIS 116.A N CYS 155.A O no hydrogen 3.004 N/A HIS 116.A ND1 GLY 124.A O no hydrogen 2.626 N/A HIS 116.A NE2 SER 114.A OG no hydrogen 2.714 N/A LEU 119.A N PRO 157.A O no hydrogen 2.759 N/A SER 122.A N ASP 60.A OD2 no hydrogen 2.713 N/A SER 122.A OG ASP 60.A OD1 no hydrogen 3.470 N/A SER 122.A OG ASP 60.A OD2 no hydrogen 3.137 N/A SER 122.A OG TYR 316.A OH no hydrogen 2.906 N/A TRP 125.A N ARG 121.A O no hydrogen 3.095 N/A ASN 126.A N ARG 121.A O no hydrogen 2.854 N/A ASN 126.A ND2 TYR 316.A OH no hydrogen 2.887 N/A ILE 127.A N SER 122.A O no hydrogen 2.836 N/A ILE 129.A N TRP 125.A O no hydrogen 3.020 N/A GLY 130.A N ASN 126.A O no hydrogen 2.945 N/A LEU 131.A N ILE 127.A O no hydrogen 3.035 N/A LEU 132.A N ILE 129.A O no hydrogen 3.158 N/A TYR 133.A N ILE 129.A O no hydrogen 3.051 N/A TYR 133.A OH THR 327.A O no hydrogen 2.815 N/A CYS 134.A SG THR 327.A O no hydrogen 3.964 N/A LEU 136.A N TYR 133.A O no hydrogen 2.914 N/A ARG 140.A N GLU 138.A O no hydrogen 2.783 N/A VAL 147.A N LEU 143.A O no hydrogen 2.789 N/A ALA 148.A N GLU 144.A O no hydrogen 2.695 N/A ASN 149.A N LYS 145.A O no hydrogen 2.991 N/A ASN 149.A N ALA 146.A O no hydrogen 3.016 N/A ASN 149.A ND2 LYS 145.A O no hydrogen 2.639 N/A PHE 150.A N VAL 147.A O no hydrogen 2.826 N/A PHE 151.A N VAL 147.A O no hydrogen 3.082 N/A SER 152.A N LYS 112.A O no hydrogen 2.672 N/A SER 152.A OG GLY 111.A O no hydrogen 2.503 N/A SER 152.A OG LYS 112.A O no hydrogen 3.495 N/A SER 154.A N GLN 166.A O no hydrogen 2.964 N/A SER 154.A OG SER 114.A OG no hydrogen 2.840 N/A CYS 155.A N SER 114.A O no hydrogen 3.056 N/A CYS 155.A SG TYR 182.A O no hydrogen 4.035 N/A ALA 156.A N LEU 167.A O no hydrogen 2.886 N/A CYS 158.A N CYS 174.A O no hydrogen 2.750 N/A ALA 159.A N ALA 156.A O no hydrogen 3.051 N/A THR 162.A N ASP 160.A OD1 no hydrogen 2.675 N/A ASP 163.A N ASP 160.A OD1 no hydrogen 2.992 N/A PHE 164.A N ASP 160.A O no hydrogen 2.932 N/A GLN 166.A N GLN 166.A OE1 no hydrogen 2.759 N/A LEU 167.A N PHE 164.A O no hydrogen 2.756 N/A CYS 168.A N PRO 165.A O no hydrogen 3.034 N/A GLN 169.A N GLN 166.A O no hydrogen 3.367 N/A GLN 169.A NE2 SER 152.A O no hydrogen 3.460 N/A LEU 170.A N SER 154.A O no hydrogen 2.914 N/A CYS 171.A N CYS 168.A O no hydrogen 3.078 N/A CYS 174.A N CYS 171.A O no hydrogen 2.790 N/A CYS 174.A SG ALA 156.A O no hydrogen 3.344 N/A CYS 174.A SG LEU 167.A O no hydrogen 3.210 N/A THR 178.A OG1 HIS 11.A ND1 no hydrogen 2.669 N/A LEU 179.A N SER 177.A OG no hydrogen 3.145 N/A ASN 180.A N SER 177.A O no hydrogen 3.026 N/A ASN 180.A ND2 GLY 175.A O no hydrogen 3.005 N/A TYR 182.A N ASN 180.A OD1 no hydrogen 2.716 N/A TYR 182.A OH ASP 194.A OD2 no hydrogen 2.690 N/A PHE 183.A N ASN 180.A O no hydrogen 3.041 N/A GLY 184.A N THR 117.A O no hydrogen 2.964 N/A TYR 185.A OH TYR 92.A OH no hydrogen 2.806 N/A TYR 185.A OH HIS 246.A NE2 no hydrogen 3.018 N/A ALA 188.A N GLY 184.A O no hydrogen 2.848 N/A PHE 189.A N TYR 185.A O no hydrogen 3.056 N/A LYS 190.A N SER 186.A O no hydrogen 2.959 N/A LYS 190.A NZ GLN 181.A OE1 no hydrogen 2.639 N/A CYS 191.A N GLY 187.A O no hydrogen 2.998 N/A LEU 192.A N ALA 188.A O no hydrogen 3.368 N/A LYS 193.A N PHE 189.A O no hydrogen 2.818 N/A ASP 194.A N LYS 190.A O no hydrogen 2.724 N/A GLY 195.A N LEU 192.A O no hydrogen 2.718 N/A ALA 196.A N CYS 191.A O no hydrogen 2.925 N/A GLY 197.A N CYS 191.A O no hydrogen 3.117 N/A ASP 198.A N LYS 113.A O no hydrogen 2.737 N/A ALA 200.A N VAL 97.A O no hydrogen 2.852 N/A PHE 201.A N CYS 115.A O no hydrogen 2.886 N/A VAL 202.A N VAL 95.A O no hydrogen 3.099 N/A LYS 203.A N THR 206.A OG1 no hydrogen 3.386 N/A LYS 203.A NZ SER 295.A OG no hydrogen 3.118 N/A HIS 204.A N TYR 93.A O no hydrogen 2.937 N/A SER 205.A OG GLU 209.A OE2 no hydrogen 2.547 N/A THR 206.A N LYS 203.A O no hydrogen 3.118 N/A THR 206.A OG1 LYS 203.A O no hydrogen 3.249 N/A GLU 209.A N SER 205.A O no hydrogen 2.933 N/A ASN 210.A N ILE 207.A O no hydrogen 2.762 N/A ASN 210.A ND2 SER 186.A OG no hydrogen 2.966 N/A ASN 210.A ND2 THR 206.A O no hydrogen 2.675 N/A LEU 211.A N ILE 207.A O no hydrogen 2.696 N/A LYS 214.A NZ ASP 218.A OD1 no hydrogen 2.707 N/A ASP 216.A N ASN 213.A O no hydrogen 3.216 N/A ARG 217.A NH1 LEU 211.A O no hydrogen 2.377 N/A ARG 217.A NH1 ALA 212.A O no hydrogen 2.942 N/A ASP 218.A N LYS 214.A O no hydrogen 2.991 N/A ASP 218.A N ALA 215.A O no hydrogen 3.232 N/A ASN 219.A N ASP 216.A O no hydrogen 2.743 N/A TYR 220.A N ARG 217.A O no hydrogen 3.094 N/A GLU 221.A N VAL 98.A O no hydrogen 2.962 N/A LEU 222.A N LYS 230.A O no hydrogen 2.948 N/A LEU 223.A N ALA 96.A O no hydrogen 2.877 N/A CYS 224.A N THR 228.A O no hydrogen 2.924 N/A CYS 224.A SG THR 228.A O no hydrogen 3.059 N/A CYS 224.A SG THR 228.A OG1 no hydrogen 3.428 N/A ASN 227.A N CYS 224.A O no hydrogen 3.237 N/A THR 228.A OG1 ASP 226.A OD1 no hydrogen 2.618 N/A ARG 229.A NE PHE 104.A O no hydrogen 2.911 N/A ARG 229.A NH1 LYS 99.A O no hydrogen 2.897 N/A ARG 229.A NH1 SER 102.A OG no hydrogen 2.839 N/A ARG 229.A NH2 SER 102.A OG no hydrogen 2.628 N/A ARG 229.A NH2 PHE 104.A O no hydrogen 2.546 N/A LYS 230.A N LEU 222.A O no hydrogen 3.145 N/A LYS 230.A NZ ARG 229.A O no hydrogen 3.390 N/A GLU 234.A N PRO 231.A O no hydrogen 2.754 N/A ASP 237.A N GLU 234.A O no hydrogen 2.690 N/A CYS 238.A N GLU 234.A O no hydrogen 2.734 N/A CYS 238.A SG LEU 222.A O no hydrogen 3.510 N/A HIS 239.A ND1 TYR 235.A O no hydrogen 2.531 N/A LEU 240.A N ALA 94.A O no hydrogen 2.778 N/A VAL 243.A N TYR 92.A O no hydrogen 2.823 N/A SER 245.A N THR 90.A O no hydrogen 3.367 N/A SER 245.A OG GLU 80.A O no hydrogen 2.686 N/A HIS 246.A N TYR 82.A OH no hydrogen 2.980 N/A HIS 246.A NE2 ASP 60.A OD1 no hydrogen 2.709 N/A THR 247.A N LEU 59.A O no hydrogen 2.969 N/A THR 247.A OG1 VAL 78.A O no hydrogen 2.792 N/A THR 247.A OG1 VAL 248.A O no hydrogen 3.377 N/A VAL 248.A N VAL 78.A O no hydrogen 2.670 N/A VAL 249.A N VAL 57.A O no hydrogen 2.926 N/A ALA 250.A N LYS 75.A O no hydrogen 2.837 N/A ARG 251.A NE GLY 254.A O no hydrogen 3.293 N/A ARG 251.A NH1 ILE 49.A O no hydrogen 2.779 N/A ARG 251.A NH1 ALA 54.A O no hydrogen 2.743 N/A ARG 251.A NH1 ASP 55.A OD1 no hydrogen 3.392 N/A ARG 251.A NH2 ASP 55.A OD1 no hydrogen 2.671 N/A ARG 251.A NH2 GLY 254.A O no hydrogen 3.000 N/A SER 252.A OG ASN 73.A O no hydrogen 2.816 N/A LYS 256.A NZ THR 2.A O no hydrogen 2.947 N/A LYS 256.A NZ ASP 55.A OD2 no hydrogen 2.992 N/A ILE 260.A N LYS 256.A O no hydrogen 2.965 N/A TRP 261.A N GLU 257.A O no hydrogen 2.984 N/A GLU 262.A N ASP 258.A O no hydrogen 2.859 N/A LEU 263.A N LEU 259.A O no hydrogen 2.979 N/A LEU 264.A N ILE 260.A O no hydrogen 3.108 N/A ASN 265.A N TRP 261.A O no hydrogen 2.725 N/A GLN 266.A N GLU 262.A O no hydrogen 2.972 N/A GLN 266.A NE2 GLU 269.A OE1 no hydrogen 2.986 N/A GLN 266.A NE2 HIS 270.A NE2 no hydrogen 3.013 N/A ALA 267.A N LEU 263.A O no hydrogen 2.946 N/A GLN 268.A N LEU 264.A O no hydrogen 2.843 N/A GLN 268.A NE2 ASN 265.A OD1 no hydrogen 2.942 N/A GLN 268.A NE2 PHE 299.A O no hydrogen 3.636 N/A GLU 269.A N ASN 265.A O no hydrogen 3.020 N/A HIS 270.A N GLN 266.A O no hydrogen 3.024 N/A PHE 271.A N ALA 267.A O no hydrogen 2.571 N/A LYS 273.A NZ ASP 294.A O no hydrogen 2.811 N/A LYS 273.A NZ ALA 296.A O no hydrogen 2.766 N/A LYS 275.A N GLY 272.A O no hydrogen 3.147 N/A GLU 278.A N SER 276.A OG no hydrogen 2.971 N/A GLN 280.A NE2 SER 276.A O no hydrogen 3.402 N/A LEU 281.A N PHE 271.A O no hydrogen 2.932 N/A HIS 286.A N SER 284.A OG no hydrogen 2.812 N/A GLY 287.A N SER 284.A O no hydrogen 3.034 N/A LYS 288.A NZ GLU 209.A O no hydrogen 3.421 N/A ASP 289.A N ASP 294.A OD1 no hydrogen 2.998 N/A LEU 291.A N GLU 12.A OE2 no hydrogen 3.113 N/A LYS 293.A N GLU 80.A OE2 no hydrogen 2.798 N/A LYS 293.A NZ TYR 82.A OH no hydrogen 3.388 N/A LYS 293.A NZ TYR 185.A OH no hydrogen 3.087 N/A ASP 294.A N ASP 289.A OD1 no hydrogen 2.827 N/A ALA 296.A N LYS 293.A O no hydrogen 2.919 N/A HIS 297.A N PHE 81.A O no hydrogen 2.775 N/A PHE 299.A N GLN 268.A OE1 no hydrogen 2.977 N/A LEU 300.A N ALA 79.A O no hydrogen 2.803 N/A VAL 302.A N VAL 77.A O no hydrogen 2.937 N/A MET 306.A N PRO 303.A O no hydrogen 2.863 N/A MET 310.A N ASP 307.A OD1 no hydrogen 2.975 N/A TYR 311.A N ASP 307.A O no hydrogen 2.854 N/A TYR 311.A OH SER 245.A O no hydrogen 3.116 N/A LEU 312.A N ALA 308.A O no hydrogen 2.885 N/A GLY 313.A N LYS 309.A O no hydrogen 3.008 N/A TYR 316.A OH SER 122.A OG no hydrogen 2.906 N/A VAL 317.A N GLY 313.A O no hydrogen 3.291 N/A THR 318.A N TYR 314.A O no hydrogen 3.197 N/A THR 318.A OG1 TYR 314.A O no hydrogen 2.875 N/A ALA 319.A N GLU 315.A O no hydrogen 2.982 N/A ILE 320.A N TYR 316.A O no hydrogen 2.715 N/A ARG 321.A N VAL 317.A O no hydrogen 2.784 N/A ASN 322.A N THR 318.A O no hydrogen 2.802 N/A LEU 323.A N ALA 319.A O no hydrogen 2.719 N/A ARG 324.A N ILE 320.A O no hydrogen 3.076 N/A ARG 324.A NH1 ASP 66.A OD1 no hydrogen 2.551 N/A ARG 324.A NH2 ASP 66.A OD2 no hydrogen 3.379 N/A GLU 325.A N ASN 322.A O no hydrogen 2.951 N/A GLY 326.A N LEU 323.A O no hydrogen 2.923 N/A THR 327.A N ASN 322.A O no hydrogen 3.163 N/A THR 327.A OG1 GLU 325.A OE1 no hydrogen 3.407 N/A CYS 328.A SG GLY 326.A O no hydrogen 3.280 N/A