Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5g2s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N LYS 269.A O no hydrogen 3.017 N/A ALA 8.A N PRO 4.A O no hydrogen 2.733 N/A LEU 9.A N THR 5.A O no hydrogen 3.086 N/A ARG 10.A N GLU 6.A O no hydrogen 3.124 N/A ILE 11.A N GLU 7.A O no hydrogen 3.023 N/A ILE 11.A N ALA 8.A O no hydrogen 3.175 N/A VAL 12.A N ALA 8.A O no hydrogen 3.292 N/A PHE 13.A N LEU 9.A O no hydrogen 2.749 N/A GLY 14.A N ARG 10.A O no hydrogen 3.194 N/A GLY 14.A N ILE 11.A O no hydrogen 2.935 N/A VAL 15.A N ILE 11.A O no hydrogen 2.900 N/A VAL 15.A N VAL 12.A O no hydrogen 3.125 N/A SER 16.A N VAL 12.A O no hydrogen 2.837 N/A SER 16.A OG VAL 12.A O no hydrogen 2.501 N/A LEU 19.A N LEU 319.A O no hydrogen 2.943 N/A VAL 22.A N VAL 166.A O no hydrogen 2.751 N/A VAL 24.A N VAL 164.A O no hydrogen 2.907 N/A SER 25.A N GLU 28.A OE1 no hydrogen 3.230 N/A ALA 29.A N LEU 26.A O no hydrogen 3.120 N/A LEU 30.A N TYR 27.A O no hydrogen 3.174 N/A GLY 31.A N ILE 148.A O no hydrogen 2.884 N/A LYS 32.A N ALA 29.A O no hydrogen 3.244 N/A LYS 32.A NZ GLU 28.A O no hydrogen 3.063 N/A LEU 34.A N GLU 146.A O no hydrogen 2.720 N/A ALA 35.A N LYS 165.A O no hydrogen 2.912 N/A ILE 38.A N LEU 142.A O no hydrogen 2.784 N/A ALA 40.A N ALA 139.A O no hydrogen 3.099 N/A LEU 44.A N ILE 135.A O no hydrogen 2.766 N/A TYR 47.A OH GLY 91.A O no hydrogen 2.722 N/A ALA 49.A N ARG 129.A O no hydrogen 3.225 N/A SER 50.A N GLY 92.A O no hydrogen 3.012 N/A SER 50.A OG LYS 52.A O no hydrogen 2.753 N/A VAL 51.A N ASP 127.A O no hydrogen 3.200 N/A GLY 54.A N VAL 88.A O no hydrogen 2.982 N/A TYR 55.A N VAL 102.A O no hydrogen 3.125 N/A ALA 56.A N ALA 86.A O no hydrogen 2.651 N/A VAL 57.A N ALA 100.A O no hydrogen 2.814 N/A ASP 61.A N VAL 58.A O no hydrogen 3.161 N/A GLY 64.A N ILE 118.A O no hydrogen 3.033 N/A TYR 66.A N VAL 116.A O no hydrogen 2.888 N/A TYR 66.A OH GLY 62.A O no hydrogen 2.445 N/A TYR 66.A OH PRO 63.A O no hydrogen 3.401 N/A VAL 68.A N LYS 114.A O no hydrogen 3.511 N/A ILE 69.A N VAL 85.A O no hydrogen 2.844 N/A THR 70.A OG1 GLU 71.A O no hydrogen 3.375 N/A SER 72.A N TYR 87.A O no hydrogen 2.703 N/A SER 72.A OG PRO 93.A O no hydrogen 2.365 N/A ALA 74.A N THR 89.A OG1 no hydrogen 3.367 N/A VAL 80.A N ASP 96.A O no hydrogen 2.609 N/A THR 84.A N THR 81.A O no hydrogen 2.961 N/A THR 84.A OG1 PRO 67.A O no hydrogen 3.396 N/A VAL 85.A N PRO 67.A O no hydrogen 3.056 N/A ALA 86.A N ALA 56.A O no hydrogen 3.051 N/A TYR 87.A N THR 70.A O no hydrogen 3.220 N/A VAL 88.A N GLY 54.A O no hydrogen 2.999 N/A THR 90.A N ASP 53.A OD1 no hydrogen 2.939 N/A GLY 91.A N SER 50.A O no hydrogen 3.008 N/A GLY 92.A N THR 89.A O no hydrogen 3.014 N/A ILE 94.A N PRO 48.A O no hydrogen 2.860 N/A ASP 99.A N VAL 57.A O no hydrogen 2.812 N/A ALA 100.A N VAL 57.A O no hydrogen 3.218 N/A VAL 101.A N THR 126.A O no hydrogen 2.966 N/A VAL 102.A N TYR 55.A O no hydrogen 2.987 N/A THR 107.A N VAL 104.A O no hydrogen 3.151 N/A THR 107.A OG1 VAL 104.A O no hydrogen 2.671 N/A LYS 108.A N LYS 117.A O no hydrogen 3.016 N/A VAL 116.A N TYR 66.A O no hydrogen 2.820 N/A ILE 118.A N GLY 64.A O no hydrogen 2.643 N/A LEU 119.A N ASP 106.A O no hydrogen 3.209 N/A GLN 121.A NE2 ALA 59.A O no hydrogen 2.642 N/A GLY 125.A N ASP 99.A O no hydrogen 2.745 N/A THR 126.A N LYS 123.A O no hydrogen 3.292 N/A THR 126.A OG1 LYS 123.A O no hydrogen 2.391 N/A ARG 129.A N ALA 49.A O no hydrogen 3.028 N/A ARG 129.A NH1 ASP 134.A OD2 no hydrogen 2.293 N/A GLY 132.A N PRO 45.A O no hydrogen 2.948 N/A CYS 133.A N ARG 130.A O no hydrogen 2.798 N/A ASP 134.A N LEU 44.A O no hydrogen 3.038 N/A ILE 135.A N LEU 44.A O no hydrogen 3.054 N/A ASP 138.A N ALA 40.A O no hydrogen 2.831 N/A ALA 139.A N GLU 136.A O no hydrogen 3.429 N/A VAL 141.A N ILE 38.A O no hydrogen 3.022 N/A THR 143.A N GLU 146.A OE1 no hydrogen 3.340 N/A THR 143.A OG1 ASP 37.A OD1 no hydrogen 3.401 N/A THR 144.A N ASP 37.A OD1 no hydrogen 2.839 N/A THR 144.A OG1 ASP 37.A OD1 no hydrogen 2.769 N/A GLY 145.A N LEU 34.A O no hydrogen 2.912 N/A GLU 146.A N THR 143.A O no hydrogen 3.246 N/A ILE 148.A N LYS 32.A O no hydrogen 2.924 N/A GLY 149.A N GLU 152.A OE1 no hydrogen 2.986 N/A SER 151.A OG GLU 152.A OE1 no hydrogen 3.014 N/A SER 151.A OG GLU 152.A OE2 no hydrogen 3.532 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.631 N/A ILE 153.A N GLY 149.A O no hydrogen 3.083 N/A GLY 154.A N ALA 150.A O no hydrogen 3.059 N/A LEU 155.A N SER 151.A O no hydrogen 2.867 N/A LEU 156.A N GLU 152.A O no hydrogen 2.932 N/A ALA 157.A N ILE 153.A O no hydrogen 2.881 N/A THR 158.A N GLY 154.A O no hydrogen 2.987 N/A THR 158.A OG1 GLY 154.A O no hydrogen 2.891 N/A ALA 159.A N LEU 155.A O no hydrogen 3.071 N/A GLY 160.A N ALA 157.A O no hydrogen 3.061 N/A VAL 161.A N LEU 156.A O no hydrogen 2.891 N/A VAL 164.A N VAL 24.A O no hydrogen 2.872 N/A LYS 165.A N GLU 36.A OE2 no hydrogen 3.110 N/A VAL 166.A N VAL 22.A O no hydrogen 2.921 N/A TYR 167.A N VAL 33.A O no hydrogen 3.004 N/A ILE 171.A N ASP 239.A OD2 no hydrogen 3.107 N/A VAL 172.A N LYS 212.A O no hydrogen 2.841 N/A ALA 173.A N ILE 240.A O no hydrogen 2.841 N/A ILE 174.A N VAL 214.A O no hydrogen 3.143 N/A LEU 175.A N LEU 242.A O no hydrogen 2.955 N/A SER 176.A N GLY 217.A O no hydrogen 3.220 N/A SER 176.A OG ASP 196.A OD1 no hydrogen 3.028 N/A SER 176.A OG ASP 196.A OD2 no hydrogen 3.229 N/A THR 177.A N SER 244.A O no hydrogen 2.925 N/A THR 177.A OG1 SER 244.A O no hydrogen 3.386 N/A GLY 178.A N VAL 219.A O no hydrogen 3.113 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.661 N/A LEU 181.A N GLY 178.A O no hydrogen 3.448 N/A VAL 182.A N ILE 194.A O no hydrogen 2.918 N/A ALA 186.A N GLU 183.A O no hydrogen 3.065 N/A GLY 190.A N GLN 193.A OE1 no hydrogen 2.977 N/A GLN 193.A N GLY 190.A O no hydrogen 3.299 N/A ILE 194.A N GLU 180.A O no hydrogen 2.843 N/A ARG 195.A NE ALA 186.A O no hydrogen 2.948 N/A ARG 195.A NH2 ALA 186.A O no hydrogen 3.216 N/A ASP 196.A N VAL 182.A O no hydrogen 2.846 N/A ASN 198.A ND2 SER 244.A OG no hydrogen 2.663 N/A ASN 198.A ND2 GLY 299.A O no hydrogen 2.750 N/A ARG 199.A NE ASP 196.A OD2 no hydrogen 2.857 N/A ARG 199.A NH1 ASP 215.A OD1 no hydrogen 2.558 N/A MET 201.A N SER 197.A O no hydrogen 3.236 N/A LEU 202.A N ASN 198.A O no hydrogen 2.796 N/A VAL 203.A N ARG 199.A O no hydrogen 2.788 N/A ALA 204.A N ALA 200.A O no hydrogen 3.090 N/A ALA 205.A N MET 201.A O no hydrogen 2.790 N/A VAL 206.A N LEU 202.A O no hydrogen 2.752 N/A MET 207.A N VAL 203.A O no hydrogen 2.797 N/A GLN 208.A N ALA 204.A O no hydrogen 2.930 N/A GLN 210.A N MET 207.A O no hydrogen 2.923 N/A CYS 211.A N VAL 206.A O no hydrogen 3.391 N/A CYS 211.A SG GLN 209.A O no hydrogen 3.497 N/A VAL 214.A N VAL 172.A O no hydrogen 2.912 N/A LEU 216.A N ILE 174.A O no hydrogen 2.980 N/A GLY 217.A N ASP 215.A OD1 no hydrogen 3.014 N/A VAL 219.A N SER 176.A O no hydrogen 2.683 N/A ARG 220.A NH1 GLY 178.A O no hydrogen 2.767 N/A ARG 220.A NH1 LEU 181.A O no hydrogen 2.769 N/A ARG 220.A NH2 LEU 181.A O no hydrogen 3.246 N/A ASP 221.A N ASP 179.A OD1 no hydrogen 2.871 N/A ASP 222.A N ARG 220.A O no hydrogen 2.995 N/A ARG 223.A NH2 GLU 261.A OE1 no hydrogen 2.426 N/A LYS 224.A N ASP 222.A OD2 no hydrogen 3.191 N/A GLU 225.A N ASP 222.A OD1 no hydrogen 3.027 N/A GLU 225.A N ASP 222.A OD2 no hydrogen 3.505 N/A LEU 226.A N ASP 222.A O no hydrogen 3.141 N/A GLU 227.A N ARG 223.A O no hydrogen 2.921 N/A LYS 228.A N LYS 224.A O no hydrogen 2.941 N/A VAL 229.A N GLU 225.A O no hydrogen 2.987 N/A LEU 230.A N LEU 226.A O no hydrogen 3.240 N/A ASP 231.A N GLU 227.A O no hydrogen 2.810 N/A GLU 232.A N LYS 228.A O no hydrogen 2.879 N/A ALA 233.A N VAL 229.A O no hydrogen 2.892 N/A VAL 234.A N LEU 230.A O no hydrogen 3.146 N/A SER 235.A N ASP 231.A O no hydrogen 3.427 N/A SER 235.A OG ASP 231.A O no hydrogen 2.886 N/A SER 235.A OG GLU 232.A O no hydrogen 3.139 N/A SER 236.A N ALA 233.A O no hydrogen 3.008 N/A SER 236.A OG ALA 233.A O no hydrogen 2.594 N/A ASP 239.A N ILE 171.A O no hydrogen 3.012 N/A ILE 240.A N ILE 171.A O no hydrogen 3.024 N/A ILE 241.A N LEU 293.A O no hydrogen 2.900 N/A LEU 242.A N ALA 173.A O no hydrogen 2.596 N/A THR 243.A N PHE 295.A O no hydrogen 2.947 N/A SER 244.A N LEU 175.A O no hydrogen 2.943 N/A GLY 245.A N LEU 297.A O no hydrogen 3.146 N/A SER 248.A N ASP 253.A OD2 no hydrogen 3.249 N/A GLY 250.A N ASP 253.A OD2 no hydrogen 2.942 N/A VAL 255.A N GLY 246.A O no hydrogen 3.262 N/A LYS 256.A NZ VAL 247.A O no hydrogen 3.523 N/A LYS 256.A NZ SER 268.A O no hydrogen 3.449 N/A LEU 258.A N PHE 254.A O no hydrogen 3.164 N/A LEU 259.A N VAL 255.A O no hydrogen 2.913 N/A GLU 260.A N LYS 256.A O no hydrogen 3.139 N/A GLU 261.A N PRO 257.A O no hydrogen 3.197 N/A LYS 262.A N LEU 258.A O no hydrogen 3.129 N/A GLY 263.A N LEU 259.A O no hydrogen 2.911 N/A LYS 264.A N GLU 282.A O no hydrogen 2.915 N/A TYR 266.A N PHE 280.A O no hydrogen 2.887 N/A TYR 266.A OH GLU 282.A OE1 no hydrogen 2.636 N/A VAL 270.A N LYS 276.A O no hydrogen 2.786 N/A LEU 271.A N ILE 3.A O no hydrogen 3.005 N/A LEU 278.A N SER 268.A O no hydrogen 3.231 N/A THR 279.A N GLY 296.A O no hydrogen 3.389 N/A PHE 280.A N PHE 267.A O no hydrogen 3.198 N/A ALA 281.A N ALA 294.A O no hydrogen 2.920 N/A GLU 282.A N LYS 264.A O no hydrogen 2.921 N/A ILE 283.A N VAL 292.A O no hydrogen 2.759 N/A ALA 285.A N LYS 290.A O no hydrogen 2.819 N/A VAL 292.A N ILE 283.A O no hydrogen 2.608 N/A LEU 293.A N ASP 239.A O no hydrogen 3.190 N/A ALA 294.A N ALA 281.A O no hydrogen 2.932 N/A PHE 295.A N ILE 241.A O no hydrogen 2.887 N/A GLY 296.A N THR 279.A O no hydrogen 2.631 N/A CYS 304.A N ASN 300.A O no hydrogen 2.730 N/A CYS 304.A N PRO 301.A O no hydrogen 3.189 N/A LEU 305.A N PRO 301.A O no hydrogen 3.273 N/A VAL 306.A N VAL 302.A O no hydrogen 3.181 N/A CYS 307.A N SER 303.A O no hydrogen 3.238 N/A CYS 307.A SG SER 303.A O no hydrogen 3.735 N/A PHE 308.A N CYS 304.A O no hydrogen 3.038 N/A ASN 309.A N LEU 305.A O no hydrogen 2.887 N/A ILE 310.A N VAL 306.A O no hydrogen 3.147 N/A PHE 311.A N CYS 307.A O no hydrogen 2.934 N/A VAL 312.A N PHE 308.A O no hydrogen 2.976 N/A VAL 313.A N PHE 308.A O no hydrogen 3.010 N/A THR 315.A OG1 PHE 311.A O no hydrogen 2.502 N/A ILE 316.A N VAL 312.A O no hydrogen 2.785 N/A ARG 317.A N VAL 313.A O no hydrogen 2.978 N/A GLN 318.A N PRO 314.A O no hydrogen 2.826 N/A LEU 319.A N THR 315.A O no hydrogen 3.098 N/A ALA 320.A N ILE 316.A O no hydrogen 3.036 N/A GLY 321.A N GLN 318.A O no hydrogen 3.184 N/A TRP 322.A N ARG 317.A O no hydrogen 2.851 N/A VAL 330.A N ALA 405.A O no hydrogen 3.026 N/A LEU 332.A N VAL 403.A O no hydrogen 3.179 N/A ARG 333.A N PHE 365.A O no hydrogen 3.418 N/A LEU 334.A N SER 401.A O no hydrogen 2.864 N/A GLN 335.A N ALA 367.A O no hydrogen 3.253 N/A ILE 338.A N LEU 397.A O no hydrogen 3.424 N/A SER 340.A N ASN 395.A O no hydrogen 3.212 N/A SER 340.A OG PRO 391.A O no hydrogen 3.478 N/A SER 340.A OG THR 393.A OG1 no hydrogen 3.303 N/A ILE 343.A N ASP 341.A OD1 no hydrogen 2.562 N/A ARG 344.A N ASP 341.A OD1 no hydrogen 2.738 N/A ARG 344.A NE MET 272.A O no hydrogen 2.608 N/A PHE 347.A N LYS 273.A O no hydrogen 2.628 N/A HIS 348.A N LEU 388.A O no hydrogen 2.962 N/A HIS 348.A NE2 SER 369.A OG no hydrogen 2.502 N/A ARG 349.A NE SER 380.A OG no hydrogen 3.360 N/A ARG 349.A NH1 PHE 347.A O no hydrogen 2.827 N/A ALA 350.A N ALA 386.A O no hydrogen 3.126 N/A ILE 351.A N GLU 368.A O no hydrogen 2.931 N/A ILE 352.A N ASN 385.A OD1 no hydrogen 2.745 N/A LYS 353.A N VAL 366.A O no hydrogen 3.054 N/A LYS 355.A N GLY 364.A O no hydrogen 2.956 N/A ASP 358.A N THR 362.A O no hydrogen 2.476 N/A GLY 361.A N SER 360.A OG no hydrogen 2.550 N/A GLY 364.A N LYS 355.A O no hydrogen 3.052 N/A VAL 366.A N LYS 353.A O no hydrogen 3.155 N/A GLU 368.A N ILE 351.A O no hydrogen 3.248 N/A SER 369.A N GLU 336.A OE1 no hydrogen 3.069 N/A SER 369.A OG HIS 348.A NE2 no hydrogen 2.502 N/A THR 370.A OG1 SER 380.A O no hydrogen 2.905 N/A GLY 371.A N SER 369.A OG no hydrogen 3.253 N/A ARG 377.A N MET 374.A O no hydrogen 3.129 N/A SER 380.A N ARG 377.A O no hydrogen 2.989 N/A SER 380.A OG ARG 377.A O no hydrogen 2.875 N/A MET 381.A N LEU 378.A O no hydrogen 3.067 N/A SER 383.A OG ARG 382.A O no hydrogen 2.514 N/A ALA 384.A N MET 381.A O no hydrogen 3.132 N/A ASN 385.A N ALA 350.A O no hydrogen 3.336 N/A ASN 385.A ND2 ILE 352.A O no hydrogen 3.289 N/A ALA 386.A N ALA 350.A O no hydrogen 3.236 N/A LEU 387.A N ILE 406.A O no hydrogen 2.798 N/A LEU 388.A N HIS 348.A O no hydrogen 2.466 N/A GLU 389.A N SER 404.A O no hydrogen 2.736 N/A LEU 390.A N GLU 346.A O no hydrogen 3.055 N/A THR 393.A OG1 SER 340.A OG no hydrogen 3.303 N/A GLY 394.A N SER 340.A OG no hydrogen 2.988 N/A ASN 395.A N THR 393.A OG1 no hydrogen 3.305 N/A LEU 397.A N ILE 338.A O no hydrogen 3.083 N/A GLY 400.A N SER 398.A O no hydrogen 2.808 N/A SER 401.A N SER 398.A O no hydrogen 3.358 N/A SER 401.A OG SER 398.A O no hydrogen 3.247 N/A VAL 403.A N LEU 332.A O no hydrogen 2.877 N/A SER 404.A OG GLU 389.A OE1 no hydrogen 2.447 N/A ALA 405.A N VAL 330.A O no hydrogen 3.022 N/A ILE 406.A N LEU 387.A O no hydrogen 2.906 N/A ILE 407.A N LEU 328.A O no hydrogen 2.988 N/A VAL 408.A N ASN 385.A O no hydrogen 3.036 N/A SER 409.A N ASN 385.A O no hydrogen 3.343 N/A