Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xv3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N GLN 1.A O no hydrogen 3.159 N/A PHE 6.A N LEU 3.A O no hydrogen 3.414 N/A LEU 12.A N PRO 9.A O no hydrogen 3.174 N/A CYS 13.A N VAL 10.A O no hydrogen 3.318 N/A CYS 13.A SG PRO 9.A O no hydrogen 3.781 N/A CYS 13.A SG VAL 10.A O no hydrogen 3.539 N/A ILE 16.A N LEU 12.A O no hydrogen 2.843 N/A GLU 17.A N LYS 14.A O no hydrogen 3.273 N/A LEU 18.A N GLU 15.A O no hydrogen 3.202 N/A PHE 21.A N LEU 18.A O no hydrogen 3.374 N/A GLY 24.A N ASP 22.A OD1 no hydrogen 2.860 N/A PHE 26.A N ILE 23.A O no hydrogen 3.018 N/A MET 29.A N PHE 26.A O no hydrogen 3.046 N/A TRP 30.A N GLU 27.A O no hydrogen 3.255 N/A TRP 30.A NE1 ILE 23.A O no hydrogen 2.508 N/A ILE 33.A N MET 29.A O no hydrogen 2.687 N/A PHE 34.A N TRP 30.A O no hydrogen 3.281 N/A VAL 35.A N PRO 31.A O no hydrogen 3.246 N/A TYR 36.A N GLY 32.A O no hydrogen 2.682 N/A MET 37.A N ILE 33.A O no hydrogen 2.809 N/A VAL 38.A N PHE 34.A O no hydrogen 2.827 N/A HIS 39.A N VAL 35.A O no hydrogen 2.771 N/A ARG 40.A N TYR 36.A O no hydrogen 2.695 N/A ARG 40.A NE TYR 36.A OH no hydrogen 3.296 N/A SER 41.A N MET 37.A O no hydrogen 3.050 N/A CYS 42.A N VAL 38.A O no hydrogen 2.708 N/A GLY 43.A N VAL 38.A O no hydrogen 3.109 N/A GLU 50.A N GLU 48.A OE1 no hydrogen 3.427 N/A LYS 51.A N GLU 48.A OE2 no hydrogen 3.032 N/A LYS 51.A NZ ASN 153.A O no hydrogen 2.847 N/A LEU 52.A N GLU 48.A O no hydrogen 3.059 N/A CYS 53.A N LEU 49.A O no hydrogen 3.225 N/A CYS 53.A N GLU 50.A O no hydrogen 3.061 N/A CYS 53.A SG LEU 49.A O no hydrogen 3.169 N/A ARG 54.A N GLU 50.A O no hydrogen 3.011 N/A ARG 54.A NH1 GLY 151.A O no hydrogen 2.495 N/A PHE 55.A N LYS 51.A O no hydrogen 3.159 N/A ILE 56.A N LEU 52.A O no hydrogen 3.170 N/A MET 57.A N CYS 53.A O no hydrogen 3.199 N/A SER 58.A N ARG 54.A O no hydrogen 2.759 N/A SER 58.A OG ARG 54.A O no hydrogen 3.219 N/A SER 58.A OG HIS 152.A NE2 no hydrogen 2.844 N/A VAL 59.A N PHE 55.A O no hydrogen 2.662 N/A LYS 60.A N ILE 56.A O no hydrogen 2.840 N/A LYS 61.A N MET 57.A O no hydrogen 3.132 N/A ASN 62.A N SER 58.A O no hydrogen 3.377 N/A TYR 63.A N LYS 60.A O no hydrogen 3.131 N/A TYR 63.A OH LEU 105.A O no hydrogen 2.788 N/A ARG 64.A NE ASP 110.A OD1 no hydrogen 2.601 N/A ARG 64.A NH2 ASP 110.A OD1 no hydrogen 2.895 N/A ARG 64.A NH2 ASP 110.A OD2 no hydrogen 3.272 N/A TYR 68.A N GLU 239.A OE1 no hydrogen 2.877 N/A HIS 69.A N GLU 239.A OE1 no hydrogen 3.053 N/A HIS 69.A ND1 GLU 239.A OE2 no hydrogen 2.624 N/A ASN 70.A N TYR 68.A O no hydrogen 2.663 N/A ASN 70.A ND2 VAL 66.A O no hydrogen 2.972 N/A HIS 73.A N ASN 70.A OD1 no hydrogen 3.155 N/A HIS 73.A NE2 HIS 107.A NE2 no hydrogen 3.016 N/A HIS 73.A NE2 ASP 218.A OD1 no hydrogen 3.069 N/A ALA 74.A N ASN 70.A O no hydrogen 3.224 N/A VAL 75.A N TRP 71.A O no hydrogen 3.245 N/A THR 76.A N LYS 72.A O no hydrogen 3.022 N/A THR 76.A OG1 LYS 72.A O no hydrogen 2.703 N/A VAL 77.A N HIS 73.A O no hydrogen 2.882 N/A ALA 78.A N ALA 74.A O no hydrogen 2.881 N/A HIS 79.A N VAL 75.A O no hydrogen 2.809 N/A HIS 79.A NE2 ILE 16.A O no hydrogen 2.708 N/A CYS 80.A N THR 76.A O no hydrogen 3.413 N/A MET 81.A N VAL 77.A O no hydrogen 3.269 N/A TYR 82.A N ALA 78.A O no hydrogen 3.055 N/A TYR 82.A OH GLU 17.A OE1 no hydrogen 3.251 N/A TYR 82.A OH GLU 17.A OE2 no hydrogen 2.575 N/A ALA 83.A N HIS 79.A O no hydrogen 2.756 N/A ILE 84.A N CYS 80.A O no hydrogen 2.825 N/A LEU 85.A N MET 81.A O no hydrogen 2.766 N/A GLN 86.A N TYR 82.A O no hydrogen 2.891 N/A GLN 86.A NE2 GLU 17.A OE1 no hydrogen 3.387 N/A ASN 87.A N ALA 83.A O no hydrogen 3.338 N/A ASN 87.A ND2 ALA 83.A O no hydrogen 2.761 N/A ASN 88.A N LEU 85.A O no hydrogen 3.271 N/A ASN 88.A ND2 ILE 84.A O no hydrogen 2.887 N/A LEU 91.A N ASN 88.A O no hydrogen 3.496 N/A THR 93.A N GLU 96.A OE1 no hydrogen 2.846 N/A GLU 96.A N THR 93.A OG1 no hydrogen 2.903 N/A ARG 97.A N THR 93.A O no hydrogen 3.173 N/A ARG 97.A NH2 ASP 94.A OD1 no hydrogen 2.267 N/A LYS 98.A N ASP 94.A O no hydrogen 3.347 N/A GLY 99.A N LEU 95.A O no hydrogen 3.206 N/A LEU 100.A N GLU 96.A O no hydrogen 2.790 N/A LEU 101.A N ARG 97.A O no hydrogen 3.103 N/A ILE 102.A N LYS 98.A O no hydrogen 3.235 N/A ALA 103.A N GLY 99.A O no hydrogen 2.856 N/A CYS 104.A N LEU 100.A O no hydrogen 2.926 N/A CYS 104.A SG LEU 100.A O no hydrogen 3.604 N/A LEU 105.A N LEU 101.A O no hydrogen 3.274 N/A CYS 106.A N ILE 102.A O no hydrogen 3.126 N/A CYS 106.A N ALA 103.A O no hydrogen 3.054 N/A CYS 106.A SG ILE 102.A O no hydrogen 3.360 N/A HIS 107.A ND1 CYS 104.A O no hydrogen 2.590 N/A HIS 107.A NE2 HIS 73.A NE2 no hydrogen 3.016 N/A ASP 108.A N TYR 63.A OH no hydrogen 3.293 N/A LEU 109.A N CYS 106.A O no hydrogen 3.261 N/A ASP 110.A N ASN 62.A O no hydrogen 2.879 N/A HIS 111.A N ASP 108.A O no hydrogen 3.370 N/A ARG 112.A NE ASP 110.A O no hydrogen 3.252 N/A ARG 112.A NH2 ASP 110.A OD2 no hydrogen 3.502 N/A GLY 113.A N HIS 111.A ND1 no hydrogen 2.977 N/A SER 115.A N GLU 243.A OE1 no hydrogen 2.534 N/A SER 115.A OG GLU 243.A OE2 no hydrogen 2.754 N/A ASN 116.A ND2 GLU 136.A OE2 no hydrogen 3.032 N/A TYR 118.A N SER 115.A OG no hydrogen 2.656 N/A LEU 119.A N SER 115.A O no hydrogen 3.412 N/A GLN 120.A N ASN 116.A O no hydrogen 3.018 N/A GLN 120.A NE2 THR 134.A OG1 no hydrogen 2.588 N/A LYS 121.A N TYR 118.A O no hydrogen 3.096 N/A PHE 122.A N TYR 118.A O no hydrogen 3.033 N/A LEU 126.A N HIS 124.A ND1 no hydrogen 2.988 N/A ALA 127.A N HIS 124.A O no hydrogen 2.854 N/A ALA 128.A N HIS 124.A O no hydrogen 3.343 N/A TYR 130.A N LEU 126.A O no hydrogen 2.984 N/A SER 133.A OG ASP 178.A OD2 no hydrogen 2.617 N/A THR 134.A OG1 TYR 130.A O no hydrogen 3.111 N/A GLN 137.A N SER 133.A O no hydrogen 3.265 N/A HIS 138.A NE2 ASP 110.A OD2 no hydrogen 3.060 N/A HIS 139.A N MET 135.A O no hydrogen 2.837 N/A HIS 139.A ND1 LEU 109.A O no hydrogen 2.480 N/A PHE 140.A N GLU 136.A O no hydrogen 3.015 N/A SER 141.A N GLN 137.A O no hydrogen 2.895 N/A GLN 142.A N HIS 138.A O no hydrogen 2.911 N/A THR 143.A N HIS 139.A O no hydrogen 3.006 N/A THR 143.A OG1 HIS 139.A O no hydrogen 2.957 N/A VAL 144.A N PHE 140.A O no hydrogen 2.869 N/A SER 145.A N SER 141.A O no hydrogen 2.941 N/A ILE 146.A N GLN 142.A O no hydrogen 3.168 N/A LEU 147.A N THR 143.A O no hydrogen 3.143 N/A GLN 148.A N VAL 144.A O no hydrogen 3.360 N/A GLN 148.A N SER 145.A O no hydrogen 3.170 N/A LEU 149.A N ILE 146.A O no hydrogen 3.090 N/A HIS 152.A N LEU 149.A O no hydrogen 3.260 N/A HIS 152.A ND1 GLU 150.A O no hydrogen 2.617 N/A HIS 152.A NE2 SER 58.A OG no hydrogen 2.844 N/A ASN 153.A ND2 TYR 163.A OH no hydrogen 3.054 N/A PHE 155.A N ASN 153.A OD1 no hydrogen 3.403 N/A SER 156.A N ASN 153.A O no hydrogen 3.424 N/A SER 161.A N SER 159.A OG no hydrogen 2.245 N/A GLU 162.A N SER 159.A OG no hydrogen 2.907 N/A TYR 163.A OH ASN 153.A OD1 no hydrogen 3.243 N/A GLN 165.A N SER 161.A O no hydrogen 3.381 N/A VAL 166.A N GLU 162.A O no hydrogen 3.391 N/A LEU 167.A N TYR 163.A O no hydrogen 3.180 N/A GLU 168.A N GLU 164.A O no hydrogen 3.210 N/A ILE 169.A N GLN 165.A O no hydrogen 3.015 N/A ILE 170.A N VAL 166.A O no hydrogen 2.834 N/A ARG 171.A N LEU 167.A O no hydrogen 2.769 N/A LYS 172.A N GLU 168.A O no hydrogen 2.857 N/A LYS 172.A NZ ASP 207.A OD2 no hydrogen 2.692 N/A ALA 173.A N ILE 169.A O no hydrogen 3.155 N/A ILE 174.A N ILE 170.A O no hydrogen 2.963 N/A ILE 175.A N ARG 171.A O no hydrogen 2.839 N/A ALA 176.A N LYS 172.A O no hydrogen 2.862 N/A THR 177.A N ILE 174.A O no hydrogen 3.301 N/A THR 177.A OG1 ILE 174.A O no hydrogen 2.528 N/A ASP 178.A N ILE 175.A O no hydrogen 3.028 N/A LEU 181.A N ASP 178.A O no hydrogen 3.006 N/A TYR 182.A N LEU 179.A O no hydrogen 2.938 N/A ASN 185.A N LEU 181.A O no hydrogen 3.216 N/A ASN 185.A ND2 ARG 208.A O no hydrogen 3.219 N/A ARG 186.A N TYR 182.A O no hydrogen 2.853 N/A ARG 186.A NE PRO 280.A O no hydrogen 3.206 N/A LYS 187.A N PHE 183.A O no hydrogen 3.233 N/A GLN 188.A N GLY 184.A O no hydrogen 3.255 N/A LEU 189.A N ASN 185.A O no hydrogen 3.243 N/A GLU 190.A N ARG 186.A O no hydrogen 2.795 N/A GLU 191.A N LYS 187.A O no hydrogen 3.304 N/A MET 192.A N GLN 188.A O no hydrogen 3.007 N/A TYR 193.A N LEU 189.A O no hydrogen 3.287 N/A GLN 194.A N GLU 190.A O no hydrogen 3.154 N/A THR 195.A N GLU 191.A O no hydrogen 3.090 N/A SER 197.A N MET 192.A O no hydrogen 2.579 N/A ASN 199.A N HIS 205.A ND1 no hydrogen 3.239 N/A ASN 201.A N ASN 199.A OD1 no hydrogen 2.872 N/A SER 204.A N ASN 202.A OD1 no hydrogen 2.926 N/A HIS 205.A N ASN 202.A O no hydrogen 3.235 N/A HIS 205.A N ASN 202.A OD1 no hydrogen 3.310 N/A ARG 206.A N ASN 202.A O no hydrogen 3.138 N/A ARG 206.A NE GLU 96.A OE2 no hydrogen 2.607 N/A ARG 206.A NH1 LEU 200.A O no hydrogen 3.072 N/A ARG 206.A NH2 LEU 91.A O no hydrogen 2.848 N/A ARG 206.A NH2 GLU 96.A OE1 no hydrogen 2.866 N/A ARG 206.A NH2 GLU 96.A OE2 no hydrogen 3.428 N/A ASP 207.A N GLN 203.A O no hydrogen 3.107 N/A VAL 209.A N HIS 205.A O no hydrogen 2.922 N/A ILE 210.A N ARG 206.A O no hydrogen 2.798 N/A GLY 211.A N ASP 207.A O no hydrogen 2.913 N/A LEU 212.A N ARG 208.A O no hydrogen 3.072 N/A MET 213.A N VAL 209.A O no hydrogen 2.999 N/A MET 214.A N ILE 210.A O no hydrogen 2.695 N/A THR 215.A N GLY 211.A O no hydrogen 2.879 N/A THR 215.A OG1 GLY 211.A O no hydrogen 3.049 N/A ALA 216.A N LEU 212.A O no hydrogen 2.764 N/A CYS 217.A N MET 213.A O no hydrogen 2.890 N/A CYS 217.A SG MET 213.A O no hydrogen 3.165 N/A ASP 218.A N MET 214.A O no hydrogen 3.008 N/A LEU 219.A N THR 215.A O no hydrogen 3.176 N/A CYS 220.A N CYS 217.A O no hydrogen 3.291 N/A CYS 220.A SG THR 76.A O no hydrogen 3.580 N/A CYS 220.A SG CYS 217.A O no hydrogen 3.271 N/A VAL 222.A N LEU 219.A O no hydrogen 3.081 N/A THR 223.A N CYS 220.A O no hydrogen 3.029 N/A THR 223.A OG1 CYS 220.A O no hydrogen 2.537 N/A LYS 224.A NZ PHE 19.A O no hydrogen 3.383 N/A LYS 224.A NZ PHE 21.A O no hydrogen 3.023 N/A THR 229.A N LEU 225.A O no hydrogen 2.887 N/A THR 229.A OG1 SER 221.A O no hydrogen 2.386 N/A THR 229.A OG1 LYS 224.A O no hydrogen 3.387 N/A LYS 230.A N TRP 226.A O no hydrogen 2.954 N/A LEU 231.A N PRO 227.A O no hydrogen 3.388 N/A THR 232.A N VAL 228.A O no hydrogen 3.049 N/A THR 232.A OG1 VAL 228.A O no hydrogen 3.182 N/A ALA 233.A N THR 229.A O no hydrogen 3.176 N/A ASN 234.A N LEU 231.A O no hydrogen 3.095 N/A ASP 235.A N THR 232.A O no hydrogen 2.865 N/A ILE 236.A N THR 232.A O no hydrogen 3.317 N/A TYR 237.A N ALA 233.A O no hydrogen 3.206 N/A ALA 238.A N ASN 234.A O no hydrogen 2.996 N/A GLU 239.A N ASP 235.A O no hydrogen 3.212 N/A PHE 240.A N ILE 236.A O no hydrogen 2.941 N/A TRP 241.A N TYR 237.A O no hydrogen 2.705 N/A ALA 242.A N ALA 238.A O no hydrogen 3.248 N/A GLU 243.A N GLU 239.A O no hydrogen 3.329 N/A GLY 244.A N PHE 240.A O no hydrogen 2.849 N/A ASP 245.A N TRP 241.A O no hydrogen 2.591 N/A GLU 246.A N ALA 242.A O no hydrogen 3.178 N/A MET 247.A N GLU 243.A O no hydrogen 3.296 N/A MET 247.A N GLY 244.A O no hydrogen 3.078 N/A LYS 248.A N GLY 244.A O no hydrogen 3.066 N/A LYS 248.A NZ ASP 259.A OD1 no hydrogen 2.648 N/A LYS 249.A N ASP 245.A O no hydrogen 3.217 N/A LYS 249.A NZ GLU 246.A OE1 no hydrogen 3.218 N/A LEU 250.A N MET 247.A O no hydrogen 3.200 N/A GLY 251.A N LYS 248.A O no hydrogen 3.032 N/A ILE 252.A N MET 247.A O no hydrogen 2.921 N/A MET 258.A N ILE 255.A O no hydrogen 2.798 N/A ASP 259.A N PRO 256.A O no hydrogen 3.141 N/A ARG 260.A NE ASP 245.A OD1 no hydrogen 3.278 N/A ARG 260.A NE ASP 245.A OD2 no hydrogen 3.015 N/A ARG 260.A NH2 ASP 245.A OD2 no hydrogen 3.211 N/A ASP 261.A N ASP 259.A OD1 no hydrogen 3.160 N/A LYS 262.A N ASP 259.A O no hydrogen 3.194 N/A LYS 263.A NZ ARG 260.A O no hydrogen 2.617 N/A GLU 265.A N LYS 262.A O no hydrogen 3.421 N/A VAL 266.A N LYS 263.A O no hydrogen 2.930 N/A GLY 269.A N GLU 265.A O no hydrogen 2.941 N/A GLN 270.A N VAL 266.A O no hydrogen 2.750 N/A GLN 270.A NE2 TYR 237.A OH no hydrogen 2.974 N/A LEU 271.A N PRO 267.A O no hydrogen 3.076 N/A GLY 272.A N GLN 268.A O no hydrogen 3.224 N/A PHE 273.A N GLY 269.A O no hydrogen 2.987 N/A TYR 274.A N GLN 270.A O no hydrogen 2.744 N/A ASN 275.A N LEU 271.A O no hydrogen 3.091 N/A ASN 275.A ND2 LEU 271.A O no hydrogen 3.174 N/A ALA 276.A N GLY 272.A O no hydrogen 2.910 N/A VAL 277.A N PHE 273.A O no hydrogen 2.804 N/A ALA 278.A N PHE 273.A O no hydrogen 3.105 N/A ILE 279.A N TYR 274.A O no hydrogen 2.613 N/A CYS 281.A N VAL 277.A O no hydrogen 3.131 N/A CYS 281.A SG LEU 212.A O no hydrogen 4.040 N/A TYR 282.A N ALA 278.A O no hydrogen 3.136 N/A TYR 282.A OH ALA 216.A O no hydrogen 2.848 N/A THR 283.A N ILE 279.A O no hydrogen 2.939 N/A THR 283.A OG1 ILE 279.A O no hydrogen 2.494 N/A THR 284.A N PRO 280.A O no hydrogen 3.000 N/A THR 284.A OG1 PRO 280.A O no hydrogen 2.572 N/A LEU 285.A N CYS 281.A O no hydrogen 2.927 N/A THR 286.A N TYR 282.A O no hydrogen 2.830 N/A THR 286.A OG1 TYR 282.A O no hydrogen 2.825 N/A GLN 287.A N THR 283.A O no hydrogen 3.080 N/A ILE 288.A N THR 284.A O no hydrogen 3.184 N/A LEU 289.A N LEU 285.A O no hydrogen 2.716 N/A THR 292.A N LEU 289.A O no hydrogen 3.033 N/A THR 292.A OG1 LEU 289.A O no hydrogen 2.559 N/A GLU 293.A N PRO 290.A O no hydrogen 2.991 N/A LEU 295.A N THR 292.A O no hydrogen 3.223 N/A LYS 297.A N GLU 293.A O no hydrogen 2.999 N/A ALA 298.A N PRO 294.A O no hydrogen 2.863 N/A CYS 299.A N LEU 295.A O no hydrogen 2.972 N/A ARG 300.A N LEU 296.A O no hydrogen 3.001 N/A ASP 301.A N LYS 297.A O no hydrogen 2.902 N/A ASN 302.A N ALA 298.A O no hydrogen 3.102 N/A ASN 302.A ND2 VAL 222.A O no hydrogen 2.535 N/A ASN 302.A ND2 LYS 224.A O no hydrogen 2.843 N/A LEU 303.A N CYS 299.A O no hydrogen 2.945 N/A SER 304.A N ARG 300.A O no hydrogen 3.109 N/A SER 304.A OG ARG 300.A O no hydrogen 2.939 N/A GLN 305.A N ASP 301.A O no hydrogen 3.287 N/A TRP 306.A N ASN 302.A O no hydrogen 3.066 N/A GLU 307.A N LEU 303.A O no hydrogen 2.797 N/A LYS 308.A N SER 304.A O no hydrogen 2.939 N/A VAL 309.A N GLN 305.A O no hydrogen 3.044 N/A ILE 310.A N TRP 306.A O no hydrogen 3.188 N/A ARG 311.A N GLU 307.A O no hydrogen 3.226 N/A GLY 312.A N VAL 309.A O no hydrogen 3.414 N/A