Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nqy_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N VAL 26.A O no hydrogen 2.616 N/A ALA 3.A N LEU 24.A O no hydrogen 2.971 N/A THR 4.A N PRO 60.A O no hydrogen 2.898 N/A GLY 5.A N TYR 17.A O no hydrogen 3.477 N/A GLY 7.A N TYR 15.A O no hydrogen 2.788 N/A GLY 8.A N ASP 76.A OD2 no hydrogen 2.959 N/A ASN 9.A N THR 12.A OG1 no hydrogen 2.898 N/A ASN 9.A ND2 ASP 190.A O no hydrogen 2.649 N/A LEU 10.A N GLY 69.A O no hydrogen 2.882 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.663 N/A LYS 11.A NZ LYS 189.A O no hydrogen 2.922 N/A LYS 11.A NZ PHE 192.A O no hydrogen 2.794 N/A LYS 11.A NZ GLY 194.A O no hydrogen 2.832 N/A LYS 11.A NZ GLY 196.A O no hydrogen 3.114 N/A THR 12.A N ASN 9.A OD1 no hydrogen 2.936 N/A THR 12.A OG1 ASN 9.A O no hydrogen 3.287 N/A THR 12.A OG1 GLY 13.A O no hydrogen 2.749 N/A GLY 13.A N ASN 9.A O no hydrogen 2.799 N/A TYR 15.A N GLY 7.A O no hydrogen 3.124 N/A TYR 15.A OH ASP 76.A OD1 no hydrogen 2.842 N/A LEU 16.A N ASP 20.A OD2 no hydrogen 2.916 N/A TYR 17.A N GLY 5.A O no hydrogen 2.680 N/A TYR 17.A OH ASP 76.A OD1 no hydrogen 2.323 N/A GLY 18.A N PHE 21.A O no hydrogen 2.737 N/A THR 19.A N LEU 16.A O no hydrogen 3.237 N/A ASP 20.A N LEU 16.A O no hydrogen 2.781 N/A LEU 24.A N ALA 3.A O no hydrogen 2.758 N/A VAL 26.A N ALA 1.A O no hydrogen 2.943 N/A SER 27.A N SER 34.A O no hydrogen 3.079 N/A SER 27.A OG ASN 36.A O no hydrogen 2.895 N/A GLN 28.A NE2 GLY 30.A O no hydrogen 2.990 N/A SER 29.A N THR 32.A O no hydrogen 2.873 N/A CYS 33.A N PHE 57.A O no hydrogen 2.764 N/A CYS 33.A SG GLN 28.A OE1 no hydrogen 3.975 N/A SER 34.A N SER 27.A O no hydrogen 2.912 N/A MET 35.A N TYR 55.A O no hydrogen 2.750 N/A ASN 36.A N SER 34.A O no hydrogen 2.773 N/A ASN 37.A N VAL 40.A O no hydrogen 2.689 N/A ASN 37.A ND2 ASP 25.A O no hydrogen 3.175 N/A ASN 37.A ND2 ASN 82.A OD1 no hydrogen 3.378 N/A ASN 39.A N ASN 37.A OD1 no hydrogen 2.684 N/A VAL 40.A N ASN 37.A OD1 no hydrogen 2.829 N/A ARG 41.A N LEU 101.A O no hydrogen 2.966 N/A ARG 41.A NH1 SER 52.A O no hydrogen 2.905 N/A THR 42.A N MET 35.A O no hydrogen 2.898 N/A THR 42.A OG1 HIS 78.A ND1 no hydrogen 2.863 N/A ILE 43.A N MET 103.A O no hydrogen 2.651 N/A LEU 45.A N VAL 105.A O no hydrogen 3.079 N/A GLY 47.A N HIS 106.A O no hydrogen 2.902 N/A GLY 48.A N LEU 45.A O no hydrogen 2.832 N/A TYR 55.A N THR 42.A O no hydrogen 2.799 N/A TYR 55.A OH ASN 62.A OD1 no hydrogen 2.805 N/A PHE 57.A N CYS 33.A O no hydrogen 2.817 N/A CYS 59.A N ASN 31.A O no hydrogen 3.478 N/A ASN 62.A N THR 4.A O no hydrogen 2.985 N/A ASN 62.A ND2 PHE 64.A O no hydrogen 3.352 N/A ASN 62.A ND2 ASN 75.A OD1 no hydrogen 2.636 N/A PHE 64.A N ASN 62.A OD1 no hydrogen 3.173 N/A ILE 67.A N ALA 70.A O no hydrogen 3.172 N/A ASN 68.A ND2 ASP 125.A O no hydrogen 2.942 N/A ASN 68.A ND2 GLN 127.A O no hydrogen 3.605 N/A ASN 68.A ND2 PHE 130.A O no hydrogen 2.882 N/A ALA 70.A N ILE 67.A O no hydrogen 2.963 N/A TYR 71.A N GLY 8.A O no hydrogen 2.972 N/A SER 72.A OG PHE 64.A O no hydrogen 2.950 N/A ASN 75.A N SER 72.A O no hydrogen 2.905 N/A ASN 75.A ND2 PRO 6.A O no hydrogen 2.884 N/A ASN 75.A ND2 ASN 62.A O no hydrogen 3.308 N/A ASP 76.A N SER 72.A O no hydrogen 3.307 N/A ALA 77.A N PRO 73.A O no hydrogen 2.977 N/A HIS 78.A N LEU 74.A O no hydrogen 3.242 N/A HIS 78.A ND1 THR 42.A OG1 no hydrogen 2.863 N/A HIS 78.A NE2 ASP 25.A O no hydrogen 2.706 N/A PHE 79.A N ASN 75.A O no hydrogen 3.193 N/A PHE 80.A N ASP 76.A O no hydrogen 2.926 N/A GLY 81.A N ALA 77.A O no hydrogen 2.888 N/A ASN 82.A N HIS 78.A O no hydrogen 3.396 N/A ASN 82.A ND2 HIS 78.A O no hydrogen 3.091 N/A VAL 83.A N PHE 79.A O no hydrogen 3.003 N/A ILE 84.A N PHE 80.A O no hydrogen 2.908 N/A PHE 85.A N GLY 81.A O no hydrogen 3.046 N/A ASN 86.A N ASN 82.A O no hydrogen 3.033 N/A MET 87.A N VAL 83.A O no hydrogen 2.870 N/A TYR 88.A N ILE 84.A O no hydrogen 3.163 N/A TYR 88.A OH SER 144.A OG no hydrogen 3.022 N/A ASN 89.A N PHE 85.A O no hydrogen 2.854 N/A ASP 90.A N ASN 86.A O no hydrogen 2.529 N/A TRP 91.A N MET 87.A O no hydrogen 2.974 N/A LEU 92.A N TYR 88.A O no hydrogen 2.745 N/A GLY 93.A N ASN 89.A O no hydrogen 2.951 N/A THR 94.A OG1 ALA 95.A O no hydrogen 2.825 N/A SER 98.A N GLN 150.A OE1 no hydrogen 2.805 N/A GLN 100.A NE2 ASN 37.A O no hydrogen 2.717 N/A LEU 101.A N ASN 39.A O no hydrogen 3.198 N/A MET 103.A N ARG 41.A O no hydrogen 2.799 N/A ARG 104.A N MET 121.A O no hydrogen 2.841 N/A ARG 104.A NE GLY 51.A O no hydrogen 3.346 N/A ARG 104.A NH1 THR 122.A OG1 no hydrogen 2.749 N/A ARG 104.A NH2 THR 49.A O no hydrogen 3.453 N/A VAL 105.A N ILE 43.A O no hydrogen 3.074 N/A HIS 106.A ND1 ASN 44.A OD1 no hydrogen 3.046 N/A TYR 107.A N PHE 123.A O no hydrogen 3.005 N/A SER 108.A N GLY 48.A O no hydrogen 2.885 N/A SER 109.A N SER 108.A OG no hydrogen 2.547 N/A ALA 114.A N ASN 113.A OD1 no hydrogen 2.736 N/A PHE 115.A N THR 122.A O no hydrogen 2.906 N/A TRP 116.A NE1 GLU 149.A OE1 no hydrogen 2.661 N/A ASP 117.A N ALA 120.A O no hydrogen 3.445 N/A SER 119.A N ASP 117.A OD1 no hydrogen 2.718 N/A ALA 120.A N ASP 117.A OD1 no hydrogen 2.763 N/A MET 121.A N GLN 102.A O no hydrogen 3.029 N/A THR 122.A N PHE 115.A O no hydrogen 2.931 N/A PHE 123.A N ARG 104.A O no hydrogen 2.813 N/A GLY 124.A N ASN 113.A O no hydrogen 2.954 N/A GLY 126.A N TYR 111.A O no hydrogen 3.216 N/A ASN 128.A N GLU 112.A OE1 no hydrogen 2.553 N/A THR 129.A N GLU 112.A OE1 no hydrogen 2.849 N/A THR 129.A N GLU 112.A OE2 no hydrogen 3.319 N/A THR 129.A OG1 GLU 112.A OE1 no hydrogen 3.536 N/A PHE 130.A N GLU 112.A OE2 no hydrogen 2.828 N/A TYR 131.A N ILE 191.A O no hydrogen 2.824 N/A LEU 133.A N GLY 124.A O no hydrogen 3.116 N/A VAL 134.A N PRO 132.A O no hydrogen 2.857 N/A SER 135.A OG ASP 137.A OD1 no hydrogen 2.400 N/A VAL 138.A N SER 135.A OG no hydrogen 3.055 N/A SER 139.A N SER 135.A O no hydrogen 3.023 N/A SER 139.A OG SER 135.A O no hydrogen 2.677 N/A ALA 140.A N LEU 136.A O no hydrogen 2.977 N/A HIS 141.A N ASP 137.A O no hydrogen 2.553 N/A HIS 141.A ND1 ASP 169.A OD1 no hydrogen 2.764 N/A ALA 142.A N VAL 138.A O no hydrogen 3.017 N/A VAL 143.A N SER 139.A O no hydrogen 3.006 N/A SER 144.A N ALA 140.A O no hydrogen 2.870 N/A SER 144.A OG TYR 88.A OH no hydrogen 3.022 N/A SER 144.A OG ALA 140.A O no hydrogen 2.610 N/A HIS 145.A N ALA 142.A O no hydrogen 3.022 N/A HIS 145.A NE2 GLU 165.A OE1 no hydrogen 3.036 N/A GLY 146.A N VAL 143.A O no hydrogen 3.001 N/A PHE 147.A N VAL 143.A O no hydrogen 3.183 N/A THR 148.A N SER 144.A O no hydrogen 2.832 N/A THR 148.A OG1 SER 144.A O no hydrogen 3.331 N/A GLU 149.A N HIS 145.A O no hydrogen 2.812 N/A GLN 150.A N GLY 146.A O no hydrogen 2.999 N/A ASN 151.A N THR 148.A O no hydrogen 2.905 N/A ASN 151.A ND2 PHE 147.A O no hydrogen 2.760 N/A SER 152.A N ASN 256.A OD1 no hydrogen 3.364 N/A SER 152.A OG ASN 256.A OD1 no hydrogen 2.635 N/A GLY 153.A N THR 148.A O no hydrogen 2.948 N/A ILE 155.A N ALA 262.A O no hydrogen 2.847 N/A TYR 156.A OH GLU 165.A OE1 no hydrogen 2.829 N/A ASN 157.A N ILE 155.A O no hydrogen 2.624 N/A GLY 161.A N ASN 157.A O no hydrogen 3.121 N/A GLY 162.A N GLY 158.A O no hydrogen 3.031 N/A LEU 163.A N LYS 159.A O no hydrogen 2.932 N/A ASN 164.A N PRO 160.A O no hydrogen 2.878 N/A ASN 164.A ND2 LEU 154.A O no hydrogen 3.008 N/A GLU 165.A N GLY 161.A O no hydrogen 3.105 N/A ALA 166.A N GLY 162.A O no hydrogen 2.853 N/A PHE 167.A N LEU 163.A O no hydrogen 2.878 N/A SER 168.A N ASN 164.A O no hydrogen 3.270 N/A SER 168.A OG HIS 141.A O no hydrogen 2.802 N/A ASP 169.A N GLU 165.A O no hydrogen 2.850 N/A MET 170.A N ALA 166.A O no hydrogen 2.774 N/A ALA 171.A N PHE 167.A O no hydrogen 2.981 N/A GLY 172.A N SER 168.A O no hydrogen 3.120 N/A GLU 173.A N ASP 169.A O no hydrogen 3.353 N/A ALA 174.A N MET 170.A O no hydrogen 2.947 N/A ALA 175.A N ALA 171.A O no hydrogen 2.830 N/A GLU 176.A N GLY 172.A O no hydrogen 3.360 N/A PHE 177.A N GLU 173.A O no hydrogen 2.968 N/A TYR 178.A N ALA 174.A O no hydrogen 2.728 N/A TYR 178.A OH ASP 90.A OD2 no hydrogen 2.697 N/A MET 179.A N ALA 175.A O no hydrogen 3.088 N/A LYS 180.A N GLU 176.A O no hydrogen 2.727 N/A GLY 181.A N PHE 177.A O no hydrogen 2.788 N/A ASN 183.A ND2 GLU 173.A OE1 no hydrogen 2.827 N/A TRP 185.A N GLU 173.A OE1 no hydrogen 2.738 N/A LEU 186.A N ASP 184.A OD1 no hydrogen 2.825 N/A VAL 187.A N ARG 199.A O no hydrogen 2.931 N/A GLY 188.A N ASP 137.A OD2 no hydrogen 2.650 N/A ILE 191.A N GLY 188.A O no hydrogen 3.091 N/A PHE 192.A N GLY 188.A O no hydrogen 3.079 N/A PHE 192.A N LYS 189.A O no hydrogen 3.324 N/A LYS 193.A N THR 129.A O no hydrogen 3.036 N/A LYS 193.A NZ ASN 68.A OD1 no hydrogen 2.837 N/A LYS 193.A NZ GLN 127.A O no hydrogen 3.114 N/A ALA 197.A N TYR 200.A OH no hydrogen 2.981 N/A LEU 198.A N VAL 187.A O no hydrogen 3.128 N/A ARG 199.A NE ASP 169.A OD2 no hydrogen 2.876 N/A ARG 199.A NH2 ASP 169.A OD1 no hydrogen 2.887 N/A TYR 200.A OH ALA 197.A O no hydrogen 3.356 N/A MET 201.A N TRP 185.A O no hydrogen 2.886 N/A ASN 203.A N TYR 200.A O no hydrogen 2.905 N/A ASN 203.A ND2 GLN 206.A OE1 no hydrogen 3.167 N/A GLN 206.A N ASN 203.A O no hydrogen 2.971 N/A ASP 207.A N PRO 204.A O no hydrogen 3.291 N/A GLY 208.A N THR 205.A O no hydrogen 3.033 N/A ARG 209.A N ASP 207.A OD1 no hydrogen 2.822 N/A SER 210.A N ASP 207.A OD1 no hydrogen 2.784 N/A SER 210.A OG ASP 207.A OD2 no hydrogen 2.722 N/A SER 210.A OG HIS 224.A O no hydrogen 3.345 N/A ILE 211.A N TYR 225.A O no hydrogen 3.036 N/A GLN 214.A N VAL 294.A O no hydrogen 2.929 N/A SER 215.A N ASN 213.A OD1 no hydrogen 3.035 N/A SER 215.A OG ASN 213.A OD1 no hydrogen 2.824 N/A ASN 216.A N ASN 213.A O no hydrogen 2.895 N/A TYR 217.A N GLN 214.A O no hydrogen 3.005 N/A MET 221.A N TYR 218.A O no hydrogen 3.225 N/A HIS 224.A N ASP 222.A OD2 no hydrogen 2.603 N/A HIS 224.A ND1 ASP 222.A OD2 no hydrogen 2.739 N/A TYR 225.A N ASP 222.A O no hydrogen 2.915 N/A SER 226.A N ASP 222.A O no hydrogen 3.097 N/A SER 226.A OG ASP 222.A O no hydrogen 3.368 N/A SER 226.A OG VAL 223.A O no hydrogen 3.539 N/A SER 227.A N VAL 223.A O no hydrogen 3.019 N/A SER 227.A OG VAL 223.A O no hydrogen 3.253 N/A GLY 228.A N TYR 225.A O no hydrogen 3.453 N/A VAL 229.A N SER 226.A O no hydrogen 3.182 N/A TYR 230.A OH TRP 266.A O no hydrogen 2.586 N/A ASN 231.A N SER 227.A O no hydrogen 2.978 N/A ASN 231.A ND2 ASP 169.A OD2 no hydrogen 2.827 N/A LYS 232.A N GLY 228.A O no hydrogen 2.966 N/A LYS 232.A NZ ASN 236.A OD1 no hydrogen 3.420 N/A ALA 233.A N VAL 229.A O no hydrogen 2.923 N/A PHE 234.A N TYR 230.A O no hydrogen 2.757 N/A TYR 235.A N ASN 231.A O no hydrogen 3.062 N/A ASN 236.A N LYS 232.A O no hydrogen 2.823 N/A ASN 236.A ND2 ALA 290.A O no hydrogen 3.227 N/A LEU 237.A N ALA 233.A O no hydrogen 3.035 N/A ALA 238.A N PHE 234.A O no hydrogen 2.867 N/A THR 239.A N TYR 235.A O no hydrogen 3.175 N/A THR 239.A OG1 TYR 235.A O no hydrogen 2.901 N/A THR 239.A OG1 ASN 236.A O no hydrogen 3.436 N/A THR 240.A N LEU 237.A O no hydrogen 2.994 N/A THR 240.A OG1 ASN 236.A O no hydrogen 2.642 N/A THR 240.A OG1 LEU 237.A O no hydrogen 3.117 N/A TRP 243.A N THR 240.A O no hydrogen 2.896 N/A TRP 243.A NE1 ASP 286.A OD2 no hydrogen 2.780 N/A THR 245.A OG1 ASN 183.A OD1 no hydrogen 2.553 N/A LYS 247.A N ASP 244.A OD1 no hydrogen 2.818 N/A LYS 247.A NZ GLY 242.A O no hydrogen 3.227 N/A ALA 248.A N ASP 244.A O no hydrogen 3.119 N/A PHE 249.A N THR 245.A O no hydrogen 2.949 N/A ILE 250.A N GLN 246.A O no hydrogen 3.074 N/A VAL 251.A N LYS 247.A O no hydrogen 3.178 N/A MET 252.A N ALA 248.A O no hydrogen 2.958 N/A ALA 253.A N PHE 249.A O no hydrogen 2.675 N/A ARG 254.A N ILE 250.A O no hydrogen 3.022 N/A ARG 254.A NE ASP 279.A OD2 no hydrogen 2.856 N/A ARG 254.A NH2 ASP 279.A OD2 no hydrogen 3.266 N/A ALA 255.A N VAL 251.A O no hydrogen 3.048 N/A ASN 256.A N MET 252.A O no hydrogen 2.937 N/A ASN 256.A ND2 THR 148.A OG1 no hydrogen 3.125 N/A GLN 257.A N ALA 253.A O no hydrogen 3.094 N/A GLN 257.A N ARG 254.A O no hydrogen 3.109 N/A GLN 257.A NE2 ASN 151.A OD1 no hydrogen 3.543 N/A LEU 258.A N ARG 254.A O no hydrogen 2.878 N/A TYR 259.A N ALA 255.A O no hydrogen 2.872 N/A TYR 259.A OH ASP 279.A OD2 no hydrogen 2.592 N/A TRP 260.A N ALA 255.A O no hydrogen 2.773 N/A TRP 260.A NE1 ALA 269.A O no hydrogen 2.848 N/A VAL 264.A N SER 261.A O no hydrogen 3.357 N/A TRP 266.A NE1 LYS 159.A O no hydrogen 2.715 N/A ALA 269.A N GLY 265.A O no hydrogen 2.944 N/A GLY 270.A N TRP 266.A O no hydrogen 3.038 N/A ASN 271.A N ASP 267.A O no hydrogen 3.208 N/A GLY 272.A N LEU 268.A O no hydrogen 3.235 N/A GLY 272.A N ALA 269.A O no hydrogen 2.935 N/A VAL 273.A N ALA 269.A O no hydrogen 3.048 N/A MET 274.A N GLY 270.A O no hydrogen 2.948 N/A ASP 275.A N ASN 271.A O no hydrogen 3.110 N/A ALA 276.A N GLY 272.A O no hydrogen 2.804 N/A ALA 277.A N VAL 273.A O no hydrogen 2.902 N/A CYS 278.A N MET 274.A O no hydrogen 3.133 N/A ASP 279.A N ASP 275.A O no hydrogen 2.941 N/A LEU 280.A N ALA 276.A O no hydrogen 3.029 N/A LEU 280.A N ALA 277.A O no hydrogen 2.898 N/A ASN 281.A N CYS 278.A O no hydrogen 3.023 N/A TYR 282.A N ALA 277.A O no hydrogen 2.899 N/A ASN 285.A N ASP 283.A OD1 no hydrogen 2.931 N/A ASP 286.A N ASP 283.A O no hydrogen 3.164 N/A LYS 288.A N PRO 284.A O no hydrogen 2.882 N/A LYS 288.A NZ SER 298.A O no hydrogen 2.928 N/A LYS 288.A NZ ASN 299.A OD1 no hydrogen 2.620 N/A ALA 289.A N ASN 285.A O no hydrogen 2.785 N/A ALA 290.A N ASP 286.A O no hydrogen 3.031 N/A LEU 291.A N VAL 287.A O no hydrogen 2.986 N/A ALA 292.A N LYS 288.A O no hydrogen 2.853 N/A ALA 293.A N ALA 289.A O no hydrogen 3.119 N/A VAL 294.A N LEU 291.A O no hydrogen 2.987 N/A GLY 295.A N ALA 292.A O no hydrogen 3.003 N/A VAL 296.A N LEU 291.A O no hydrogen 2.874 N/A ASN 297.A N ASP 267.A OD1 no hydrogen 2.731 N/A SER 298.A OG ASP 267.A O no hydrogen 2.583 N/A ASN 299.A N ASN 271.A OD1 no hydrogen 2.721 N/A SER 301.A N ASP 275.A OD1 no hydrogen 3.036 N/A SER 301.A OG ASP 275.A OD2 no hydrogen 2.675 N/A SER 304.A N SER 301.A O no hydrogen 3.169 N/A CYS 306.A N SER 304.A OG no hydrogen 3.227 N/A ALA 307.A N SER 304.A O no hydrogen 3.241 N/A