Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k6k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 1.A OD1 no hydrogen 3.396 N/A MET 4.A N PHE 277.A O no hydrogen 2.850 N/A ARG 7.A N ASP 5.A OD1 no hydrogen 2.897 N/A ASP 8.A N ASP 5.A O no hydrogen 2.818 N/A PHE 9.A N ASP 5.A O no hydrogen 3.185 N/A LEU 10.A N PRO 6.A O no hydrogen 3.049 N/A GLN 11.A N ARG 7.A O no hydrogen 3.246 N/A LEU 12.A N ASP 8.A O no hydrogen 3.095 N/A LEU 13.A N PHE 9.A O no hydrogen 2.929 N/A LYS 14.A N LEU 10.A O no hydrogen 2.778 N/A ILE 15.A N GLN 11.A O no hydrogen 3.066 N/A ASN 16.A N LEU 12.A O no hydrogen 3.275 N/A ALA 17.A N LEU 13.A O no hydrogen 3.044 N/A GLU 18.A N LYS 14.A O no hydrogen 2.937 N/A LYS 19.A N ILE 15.A O no hydrogen 3.277 N/A LYS 29.A N PRO 25.A O no hydrogen 2.816 N/A ARG 30.A N LEU 26.A O no hydrogen 3.007 N/A ARG 30.A NE ILE 80.A O no hydrogen 2.756 N/A ARG 30.A NH1 GLU 112.A OE2 no hydrogen 2.778 N/A ARG 30.A NH2 ILE 80.A O no hydrogen 3.021 N/A ARG 30.A NH2 ALA 110.A O no hydrogen 2.991 N/A ARG 30.A NH2 GLU 112.A OE1 no hydrogen 2.812 N/A ALA 31.A N ASP 27.A O no hydrogen 3.016 N/A GLY 32.A N GLN 28.A O no hydrogen 2.739 N/A MET 33.A N LYS 29.A O no hydrogen 2.754 N/A GLU 34.A N ARG 30.A O no hydrogen 2.954 N/A ALA 35.A N ALA 31.A O no hydrogen 3.049 N/A LEU 36.A N GLY 32.A O no hydrogen 3.199 N/A CYS 37.A N MET 33.A O no hydrogen 2.960 N/A CYS 37.A SG MET 33.A O no hydrogen 3.159 N/A CYS 37.A SG THR 86.A O no hydrogen 3.619 N/A GLU 38.A N GLU 34.A O no hydrogen 3.191 N/A ARG 39.A N LEU 36.A O no hydrogen 3.095 N/A PHE 40.A N CYS 37.A O no hydrogen 3.107 N/A ALA 43.A N THR 92.A OG1 no hydrogen 3.037 N/A VAL 46.A N ALA 43.A O no hydrogen 3.340 N/A GLU 47.A N ALA 62.A O no hydrogen 2.869 N/A THR 49.A N ARG 60.A O no hydrogen 2.781 N/A THR 51.A N CYS 58.A O no hydrogen 2.752 N/A THR 51.A OG1 ASP 52.A O no hydrogen 3.482 N/A ASP 52.A N THR 51.A OG1 no hydrogen 2.494 N/A LEU 53.A N VAL 56.A O no hydrogen 2.882 N/A GLY 55.A N ASP 52.A OD2 no hydrogen 2.874 N/A VAL 56.A N LEU 53.A O no hydrogen 3.120 N/A CYS 58.A N THR 51.A O no hydrogen 2.825 N/A ILE 59.A N SER 104.A O no hydrogen 3.119 N/A ARG 60.A N THR 49.A O no hydrogen 2.779 N/A GLN 61.A N LEU 102.A O no hydrogen 2.726 N/A GLN 61.A NE2 THR 91.A OG1 no hydrogen 2.738 N/A ALA 62.A N GLU 47.A O no hydrogen 3.409 N/A ALA 66.A N THR 63.A O no hydrogen 3.257 N/A HIS 70.A N ARG 138.A O no hydrogen 2.769 N/A ILE 71.A N THR 101.A O no hydrogen 2.902 N/A LEU 72.A N ILE 140.A O no hydrogen 2.839 N/A TYR 73.A N TRP 103.A O no hydrogen 2.939 N/A TYR 73.A OH ASP 144.A OD1 no hydrogen 2.345 N/A PHE 74.A N ALA 142.A O no hydrogen 2.862 N/A ILE 80.A N GLY 77.A O no hydrogen 3.017 N/A SER 81.A N GLY 77.A O no hydrogen 3.039 N/A SER 81.A OG GLY 77.A O no hydrogen 2.844 N/A SER 83.A N THR 86.A OG1 no hydrogen 2.755 N/A SER 83.A OG GLU 34.A OE1 no hydrogen 3.520 N/A SER 83.A OG GLU 34.A OE2 no hydrogen 2.746 N/A THR 86.A N SER 83.A OG no hydrogen 3.157 N/A THR 86.A OG1 SER 83.A O no hydrogen 2.697 N/A HIS 87.A N PRO 84.A O no hydrogen 3.203 N/A LEU 88.A N SER 85.A O no hydrogen 3.286 N/A THR 91.A N HIS 87.A O no hydrogen 2.883 N/A THR 91.A OG1 HIS 87.A O no hydrogen 3.418 N/A THR 92.A N LEU 88.A O no hydrogen 2.941 N/A THR 92.A OG1 LEU 88.A O no hydrogen 2.657 N/A GLN 93.A NE2 GLN 97.A OE1 no hydrogen 3.216 N/A LEU 94.A N LEU 90.A O no hydrogen 3.112 N/A ALA 95.A N THR 91.A O no hydrogen 2.861 N/A LYS 96.A N THR 92.A O no hydrogen 3.049 N/A LYS 96.A NZ GLU 44.A O no hydrogen 2.966 N/A GLN 97.A N GLN 93.A O no hydrogen 3.085 N/A SER 98.A N LEU 94.A O no hydrogen 3.117 N/A SER 98.A OG LEU 94.A O no hydrogen 2.293 N/A SER 98.A OG ALA 95.A O no hydrogen 3.348 N/A SER 99.A N LYS 96.A O no hydrogen 3.331 N/A ALA 100.A N ALA 95.A O no hydrogen 3.332 N/A THR 101.A N ALA 69.A O no hydrogen 3.063 N/A LEU 102.A N GLN 61.A O no hydrogen 2.718 N/A TRP 103.A N ILE 71.A O no hydrogen 2.853 N/A TRP 103.A NE1 HIS 70.A ND1 no hydrogen 3.043 N/A SER 104.A N ILE 59.A O no hydrogen 2.901 N/A LEU 105.A N TYR 73.A O no hydrogen 2.913 N/A ASP 106.A N PRO 57.A O no hydrogen 2.770 N/A TYR 107.A OH HIS 75.A O no hydrogen 2.749 N/A ARG 108.A N ASP 121.A OD2 no hydrogen 2.871 N/A ALA 110.A N TYR 79.A O no hydrogen 3.028 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.633 N/A ASN 113.A N LEU 109.A O no hydrogen 2.960 N/A PHE 115.A N TYR 207.A O no hydrogen 2.793 N/A ALA 117.A N PRO 114.A O no hydrogen 2.884 N/A ASP 120.A N PRO 116.A O no hydrogen 3.022 N/A ASP 121.A N ALA 117.A O no hydrogen 3.083 N/A CYS 122.A N ALA 118.A O no hydrogen 2.951 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.211 N/A VAL 123.A N VAL 119.A O no hydrogen 2.987 N/A ALA 124.A N ASP 120.A O no hydrogen 2.803 N/A ALA 125.A N ASP 121.A O no hydrogen 2.741 N/A TYR 126.A N CYS 122.A O no hydrogen 2.921 N/A TYR 126.A OH PRO 164.A O no hydrogen 2.955 N/A ARG 127.A N VAL 123.A O no hydrogen 2.885 N/A ALA 128.A N ALA 124.A O no hydrogen 3.037 N/A LEU 129.A N ALA 125.A O no hydrogen 2.666 N/A LEU 130.A N TYR 126.A O no hydrogen 2.749 N/A THR 132.A N ALA 128.A O no hydrogen 3.370 N/A ALA 133.A N LEU 129.A O no hydrogen 2.762 N/A GLY 134.A N LEU 130.A O no hydrogen 2.796 N/A ASP 137.A N SER 135.A OG no hydrogen 3.208 N/A ARG 138.A NH2 ALA 133.A O no hydrogen 3.290 N/A ILE 139.A N ALA 136.A O no hydrogen 3.430 N/A ILE 140.A N HIS 70.A O no hydrogen 2.981 N/A ILE 141.A N GLY 168.A O no hydrogen 3.040 N/A ALA 142.A N LEU 72.A O no hydrogen 3.110 N/A ASP 144.A N PHE 74.A O no hydrogen 3.384 N/A SER 145.A N LEU 172.A O no hydrogen 3.066 N/A GLY 149.A N SER 145.A O no hydrogen 3.117 N/A LEU 150.A N ALA 146.A O no hydrogen 2.972 N/A THR 151.A N GLY 147.A O no hydrogen 2.963 N/A THR 152.A N GLY 148.A O no hydrogen 3.384 N/A ALA 153.A N GLY 149.A O no hydrogen 2.979 N/A SER 154.A N LEU 150.A O no hydrogen 2.732 N/A SER 154.A OG LEU 150.A O no hydrogen 2.730 N/A SER 154.A OG THR 151.A O no hydrogen 3.461 N/A MET 155.A N THR 152.A O no hydrogen 2.809 N/A LEU 156.A N THR 152.A O no hydrogen 3.110 N/A LYS 157.A N ALA 153.A O no hydrogen 3.119 N/A ALA 158.A N SER 154.A O no hydrogen 2.821 N/A LYS 159.A N MET 155.A O no hydrogen 2.604 N/A LYS 159.A NZ SER 226.A O no hydrogen 2.439 N/A GLU 160.A N LEU 156.A O no hydrogen 2.824 N/A ASP 161.A N LYS 157.A O no hydrogen 2.861 N/A GLY 162.A N LYS 159.A O no hydrogen 2.892 N/A LEU 163.A N ALA 158.A O no hydrogen 2.958 N/A ALA 167.A N ILE 139.A O no hydrogen 2.822 N/A LEU 169.A N GLU 230.A O no hydrogen 2.815 N/A VAL 170.A N ILE 141.A O no hydrogen 2.679 N/A MET 171.A N LEU 232.A O no hydrogen 2.937 N/A LEU 172.A N GLY 143.A O no hydrogen 2.974 N/A SER 173.A N HIS 234.A O no hydrogen 2.818 N/A SER 173.A OG GLU 239.A OE1 no hydrogen 3.283 N/A SER 173.A OG GLU 239.A OE2 no hydrogen 2.498 N/A PHE 175.A N SER 145.A O no hydrogen 2.807 N/A VAL 176.A N ASP 244.A OD1 no hydrogen 2.497 N/A ASP 177.A N ASP 244.A OD1 no hydrogen 2.968 N/A LEU 178.A N SER 219.A OG no hydrogen 2.828 N/A THR 179.A N ASP 177.A OD2 no hydrogen 3.016 N/A THR 179.A OG1 ASP 177.A OD1 no hydrogen 3.375 N/A THR 179.A OG1 ASP 177.A OD2 no hydrogen 2.721 N/A THR 179.A OG1 SER 181.A OG no hydrogen 2.846 N/A LEU 180.A N ASP 177.A O no hydrogen 3.027 N/A SER 181.A OG THR 179.A OG1 no hydrogen 2.846 N/A ARG 182.A NH1 ASP 177.A OD1 no hydrogen 3.277 N/A SER 184.A N SER 243.A OG no hydrogen 2.854 N/A SER 184.A OG ALA 240.A O no hydrogen 2.767 N/A SER 184.A OG SER 243.A OG no hydrogen 3.073 N/A ASN 185.A ND2 ARG 182.A O no hydrogen 3.215 N/A SER 186.A N TRP 183.A O no hydrogen 3.294 N/A SER 186.A OG TRP 183.A O no hydrogen 3.410 N/A ASN 187.A N TRP 183.A O no hydrogen 2.928 N/A ASN 187.A ND2 TRP 183.A O no hydrogen 2.937 N/A LEU 188.A N SER 184.A O no hydrogen 2.827 N/A ARG 191.A N LEU 188.A O no hydrogen 2.919 N/A ARG 191.A NH1 GLU 238.A OE1 no hydrogen 2.995 N/A ARG 191.A NH1 GLU 238.A OE2 no hydrogen 2.589 N/A ASP 192.A N ALA 189.A O no hydrogen 3.125 N/A LEU 194.A N ASP 192.A OD1 no hydrogen 3.023 N/A ALA 195.A N ASP 192.A OD1 no hydrogen 2.717 N/A THR 199.A OG1 GLU 196.A O no hydrogen 3.109 N/A LEU 200.A N GLU 196.A O no hydrogen 3.015 N/A MET 203.A N THR 199.A O no hydrogen 2.893 N/A SER 204.A N LEU 200.A O no hydrogen 3.115 N/A SER 204.A OG LEU 200.A O no hydrogen 2.960 N/A SER 204.A OG GLY 201.A O no hydrogen 3.227 N/A LEU 206.A N MET 203.A O no hydrogen 2.999 N/A TYR 207.A N SER 204.A O no hydrogen 2.789 N/A VAL 208.A N SER 204.A O no hydrogen 3.089 N/A GLU 211.A N VAL 208.A O no hydrogen 3.387 N/A ARG 213.A NH1 LEU 178.A O no hydrogen 2.402 N/A ARG 213.A NH1 SER 204.A OG no hydrogen 3.258 N/A ARG 213.A NH2 GLY 201.A O no hydrogen 3.362 N/A ARG 213.A NH2 GLU 205.A OE2 no hydrogen 3.099 N/A ASN 215.A N ASP 212.A O no hydrogen 3.110 N/A ILE 218.A N ASN 215.A O no hydrogen 2.930 N/A SER 219.A N ASN 215.A O no hydrogen 2.854 N/A SER 219.A OG ARG 213.A O no hydrogen 2.611 N/A VAL 221.A N VAL 176.A O no hydrogen 3.408 N/A TYR 222.A N SER 219.A O no hydrogen 2.693 N/A TYR 222.A OH ASP 177.A OD1 no hydrogen 2.818 N/A TYR 222.A OH ASP 177.A OD2 no hydrogen 3.268 N/A ALA 223.A N PRO 220.A O no hydrogen 2.809 N/A SER 226.A N ASP 224.A OD1 no hydrogen 3.042 N/A SER 226.A OG ASP 224.A OD1 no hydrogen 2.497 N/A LEU 228.A N LEU 225.A O no hydrogen 3.497 N/A MET 231.A N SER 258.A O no hydrogen 2.964 N/A LEU 232.A N LEU 169.A O no hydrogen 2.959 N/A ILE 233.A N GLU 260.A O no hydrogen 2.873 N/A HIS 234.A N MET 171.A O no hydrogen 2.946 N/A HIS 234.A ND1 SER 284.A OG no hydrogen 2.850 N/A VAL 235.A N LYS 262.A O no hydrogen 3.081 N/A GLY 236.A N GLU 239.A OE2 no hydrogen 2.883 N/A SER 237.A N TRP 264.A O no hydrogen 3.094 N/A SER 237.A OG GLU 238.A OE2 no hydrogen 2.969 N/A SER 237.A OG TRP 264.A O no hydrogen 3.156 N/A GLU 238.A N MET 267.A O no hydrogen 3.161 N/A ALA 240.A N ASP 192.A OD2 no hydrogen 2.745 N/A LEU 242.A N GLU 239.A O no hydrogen 3.087 N/A SER 243.A N SER 184.A OG no hydrogen 2.566 N/A SER 243.A OG SER 184.A OG no hydrogen 3.073 N/A ASP 244.A N LEU 241.A O no hydrogen 3.073 N/A THR 246.A N LEU 242.A O no hydrogen 3.167 N/A THR 246.A OG1 SER 243.A O no hydrogen 3.297 N/A THR 247.A N SER 243.A O no hydrogen 2.806 N/A THR 247.A OG1 SER 243.A O no hydrogen 2.578 N/A LEU 248.A N ASP 244.A O no hydrogen 2.845 N/A ALA 249.A N SER 245.A O no hydrogen 3.052 N/A GLU 250.A N THR 246.A O no hydrogen 2.814 N/A ARG 251.A N THR 247.A O no hydrogen 3.007 N/A ARG 251.A NE GLU 250.A OE2 no hydrogen 2.910 N/A ALA 252.A N LEU 248.A O no hydrogen 2.713 N/A GLY 253.A N ALA 249.A O no hydrogen 2.892 N/A ALA 254.A N GLU 250.A O no hydrogen 3.025 N/A ALA 255.A N ARG 251.A O no hydrogen 3.012 N/A GLY 256.A N GLY 253.A O no hydrogen 2.873 N/A VAL 257.A N ALA 252.A O no hydrogen 2.969 N/A GLU 260.A N MET 231.A O no hydrogen 2.956 N/A LYS 262.A N ILE 233.A O no hydrogen 3.023 N/A LYS 262.A NZ GLU 287.A OE2 no hydrogen 2.611 N/A TRP 264.A N VAL 235.A O no hydrogen 2.673 N/A MET 267.A N TRP 264.A O no hydrogen 3.178 N/A HIS 269.A ND1 GLU 239.A OE1 no hydrogen 2.599 N/A VAL 270.A N SER 173.A OG no hydrogen 3.098 N/A GLN 272.A N GLN 272.A OE1 no hydrogen 2.632 N/A GLN 272.A NE2 SER 284.A OG no hydrogen 3.309 N/A MET 273.A N VAL 270.A O no hydrogen 3.087 N/A TYR 274.A N PHE 271.A O no hydrogen 2.857 N/A PHE 277.A N TYR 274.A O no hydrogen 2.678 N/A VAL 278.A N TYR 274.A O no hydrogen 2.795 N/A ASN 279.A ND2 ASP 282.A OD1 no hydrogen 3.558 N/A ILE 283.A N ASN 279.A O no hydrogen 3.345 N/A SER 284.A N ALA 280.A O no hydrogen 2.881 N/A SER 284.A OG HIS 234.A ND1 no hydrogen 2.850 N/A ILE 285.A N ALA 281.A O no hydrogen 3.152 N/A LYS 286.A N ASP 282.A O no hydrogen 3.057 N/A GLU 287.A N ILE 283.A O no hydrogen 2.974 N/A ILE 288.A N SER 284.A O no hydrogen 2.848 N/A CYS 289.A N ILE 285.A O no hydrogen 2.983 N/A CYS 289.A SG LEU 94.A O no hydrogen 3.584 N/A CYS 289.A SG ILE 285.A O no hydrogen 3.457 N/A HIS 290.A N LYS 286.A O no hydrogen 2.989 N/A TRP 291.A N GLU 287.A O no hydrogen 2.847 N/A TRP 291.A NE1 GLU 260.A OE1 no hydrogen 2.967 N/A ILE 292.A N ILE 288.A O no hydrogen 2.765 N/A SER 293.A N CYS 289.A O no hydrogen 2.700 N/A ALA 294.A N TRP 291.A O no hydrogen 3.252 N/A ARG 295.A N ILE 292.A O no hydrogen 3.008 N/A ARG 295.A NH1 TRP 291.A O no hydrogen 3.306 N/A ARG 295.A NH2 GLU 230.A OE1 no hydrogen 3.289 N/A ILE 296.A N ILE 292.A O no hydrogen 3.516 N/A SER 297.A N ARG 295.A O no hydrogen 2.660 N/A SER 297.A OG ILE 296.A O no hydrogen 2.836 N/A