Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kyr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE1 no hydrogen 3.033 N/A GLU 4.A N SER 1P.A O no hydrogen 3.299 N/A MET 5.A N PHE 2P.A O no hydrogen 2.886 N/A ASP 7.A N SER 165.A OG no hydrogen 2.928 N/A ASN 8.A ND2 HIS 92.A O no hydrogen 2.976 N/A ASN 8.A ND2 MET 166.A O no hydrogen 3.294 N/A LEU 9.A N GLY 164.A O no hydrogen 2.832 N/A ARG 10.A N TYR 18.A O no hydrogen 3.188 N/A SER 13.A OG PRO 296.A O no hydrogen 3.122 N/A GLN 15.A N LYS 12.A O no hydrogen 3.113 N/A TYR 17.A OH CYS 158.A O no hydrogen 2.989 N/A TYR 18.A N ARG 10.A O no hydrogen 3.128 N/A VAL 19.A N ILE 32.A O no hydrogen 3.105 N/A MET 21.A N LEU 30.A O no hydrogen 2.923 N/A THR 22.A N SER 89.A O no hydrogen 2.852 N/A THR 22.A OG1 SER 89.A OG no hydrogen 2.847 N/A VAL 23.A N GLN 28.A O no hydrogen 2.780 N/A GLY 24.A N LEU 87.A O no hydrogen 2.754 N/A SER 25.A N SER 60.A OG no hydrogen 3.246 N/A SER 25.A OG THR 62.A OG1 no hydrogen 2.818 N/A GLN 28.A N VAL 23.A O no hydrogen 2.660 N/A GLN 28.A NE2 GLN 56.A O no hydrogen 2.751 N/A LEU 30.A N MET 21.A O no hydrogen 2.882 N/A ASN 31.A N GLU 119.A OE1 no hydrogen 2.598 N/A ILE 32.A N VAL 19.A O no hydrogen 3.082 N/A LEU 33.A N GLY 120.A O no hydrogen 2.843 N/A VAL 34.A N TYR 17.A O no hydrogen 2.781 N/A ASP 35.A N LEU 122.A O no hydrogen 2.910 N/A THR 36.A OG1 VAL 219.A O no hydrogen 2.863 N/A GLY 37.A N ASP 35.A OD1 no hydrogen 2.938 N/A SER 38.A OG ASP 35.A OD2 no hydrogen 2.558 N/A SER 39.A OG TYR 126.A O no hydrogen 2.922 N/A ASN 40.A ND2 ARG 131.A O no hydrogen 2.864 N/A ALA 42.A N ILE 121.A O no hydrogen 3.017 N/A VAL 43.A N ALA 103.A O no hydrogen 2.937 N/A GLY 44.A N GLU 119.A O no hydrogen 3.123 N/A ALA 45.A N ILE 105.A O no hydrogen 3.159 N/A PHE 50.A N HIS 48.A ND1 no hydrogen 2.844 N/A LEU 51.A N HIS 48.A O no hydrogen 3.059 N/A ARG 53.A NE GLU 119.A OE1 no hydrogen 3.391 N/A ARG 53.A NE GLU 119.A OE2 no hydrogen 3.458 N/A TYR 55.A N GLY 44.A O no hydrogen 2.635 N/A TYR 55.A OH ASP 86.A OD2 no hydrogen 2.408 N/A GLN 56.A N GLN 28.A OE1 no hydrogen 2.839 N/A GLN 58.A N GLN 58.A OE1 no hydrogen 2.972 N/A LEU 59.A N GLN 56.A O no hydrogen 3.088 N/A SER 60.A N ARG 57.A O no hydrogen 3.091 N/A SER 60.A OG ASP 86.A OD1 no hydrogen 3.505 N/A SER 60.A OG ASP 86.A OD2 no hydrogen 2.847 N/A SER 61.A N SER 25.A O no hydrogen 2.933 N/A THR 62.A N SER 60.A OG no hydrogen 3.304 N/A THR 62.A OG1 SER 25.A OG no hydrogen 2.818 N/A THR 62.A OG1 ASP 86.A OD1 no hydrogen 2.744 N/A ARG 64.A N THR 85.A O no hydrogen 3.058 N/A LEU 66.A N LEU 83.A O no hydrogen 3.124 N/A ARG 67.A N ASP 65.A OD1 no hydrogen 2.544 N/A VAL 70.A N GLY 81.A O no hydrogen 2.987 N/A VAL 72.A N TRP 79.A O no hydrogen 3.048 N/A TYR 74.A N GLY 77.A O no hydrogen 2.893 N/A LYS 78.A N ASP 109.A O no hydrogen 3.034 N/A LYS 78.A NZ TYR 71.A OH no hydrogen 2.846 N/A TRP 79.A N VAL 72.A O no hydrogen 3.038 N/A TRP 79.A NE1 TYR 74.A OH no hydrogen 3.043 N/A GLU 80.A N GLU 107.A O no hydrogen 2.899 N/A GLY 81.A N VAL 70.A O no hydrogen 2.983 N/A GLU 82.A N ALA 104.A O no hydrogen 2.885 N/A LEU 83.A N LYS 68.A O no hydrogen 3.022 N/A GLY 84.A N ILE 102.A O no hydrogen 2.799 N/A THR 85.A N ARG 64.A O no hydrogen 2.964 N/A ASP 86.A N ALA 100.A O no hydrogen 3.008 N/A LEU 87.A N ASP 86.A OD1 no hydrogen 2.732 N/A VAL 88.A N VAL 98.A O no hydrogen 2.696 N/A SER 89.A N THR 22.A O no hydrogen 3.024 N/A SER 89.A OG THR 22.A OG1 no hydrogen 2.847 N/A GLY 93.A N ILE 90.A O no hydrogen 3.018 N/A VAL 96.A N PRO 94.A O no hydrogen 2.920 N/A VAL 98.A N VAL 88.A O no hydrogen 2.871 N/A ARG 99.A N GLN 146.A OE1 no hydrogen 2.926 N/A ARG 99.A NH1 THR 62.A O no hydrogen 3.203 N/A ARG 99.A NH1 THR 85.A OG1 no hydrogen 2.516 N/A ARG 99.A NH2 THR 62.A O no hydrogen 2.432 N/A ALA 100.A N ASP 86.A O no hydrogen 2.955 N/A ASN 101.A ND2 GLU 137.A O no hydrogen 2.559 N/A ILE 102.A N GLY 84.A O no hydrogen 2.746 N/A ALA 103.A N PHE 41.A O no hydrogen 2.962 N/A ALA 104.A N GLU 82.A O no hydrogen 2.895 N/A ILE 105.A N VAL 43.A O no hydrogen 2.800 N/A THR 106.A N GLU 80.A O no hydrogen 3.059 N/A GLU 107.A N GLU 80.A O no hydrogen 3.265 N/A ASP 109.A N LYS 78.A O no hydrogen 2.915 N/A SER 116.A N ILE 113.A O no hydrogen 3.234 N/A SER 116.A OG ILE 113.A O no hydrogen 3.279 N/A ASN 117.A ND2 TYR 18.A OH no hydrogen 2.964 N/A TRP 118.A N SER 116.A OG no hydrogen 3.351 N/A TRP 118.A NE1 GLN 15.A O no hydrogen 2.820 N/A GLU 119.A N ASN 31.A O no hydrogen 2.546 N/A ILE 121.A N ALA 42.A O no hydrogen 2.696 N/A LEU 122.A N LEU 33.A O no hydrogen 2.706 N/A GLY 123.A N ASN 40.A O no hydrogen 3.336 N/A LEU 124.A N ASP 35.A O no hydrogen 2.536 N/A ALA 125.A N SER 38.A O no hydrogen 2.928 N/A TYR 126.A N TRP 189.A O no hydrogen 3.289 N/A ILE 129.A N TYR 126.A O no hydrogen 3.270 N/A ALA 130.A N ALA 127.A O no hydrogen 2.681 N/A ARG 131.A N ASN 40.A OD1 no hydrogen 2.968 N/A SER 135.A N ASP 133.A OD2 no hydrogen 2.821 N/A SER 135.A OG ASP 133.A OD1 no hydrogen 3.253 N/A SER 135.A OG ASP 133.A OD2 no hydrogen 2.495 N/A LEU 136.A N ASP 133.A O no hydrogen 3.335 N/A SER 142.A N PRO 138.A O no hydrogen 3.183 N/A SER 142.A OG GLU 137.A OE1 no hydrogen 2.907 N/A SER 142.A OG PRO 138.A O no hydrogen 3.494 N/A LEU 143.A N PHE 139.A O no hydrogen 2.972 N/A VAL 144.A N PHE 140.A O no hydrogen 3.090 N/A LYS 145.A N ASP 141.A O no hydrogen 2.852 N/A GLN 146.A N SER 142.A O no hydrogen 2.775 N/A GLN 146.A NE2 ARG 99.A O no hydrogen 3.097 N/A THR 147.A N LEU 143.A O no hydrogen 3.245 N/A THR 147.A OG1 LEU 143.A O no hydrogen 3.081 N/A VAL 149.A N THR 147.A OG1 no hydrogen 3.147 N/A LEU 152.A N PRO 150.A O no hydrogen 2.909 N/A PHE 153.A N PHE 326.A O no hydrogen 3.280 N/A SER 154.A N ILE 167.A O no hydrogen 2.808 N/A SER 154.A OG GLY 170.A O no hydrogen 2.843 N/A SER 154.A OG TYR 323.A OH no hydrogen 3.155 N/A LEU 155.A N VAL 324.A O no hydrogen 2.943 N/A GLN 156.A N SER 165.A O no hydrogen 2.815 N/A CYS 158.A N GLY 163.A O no hydrogen 2.739 N/A VAL 162.A N GLY 11.A O no hydrogen 3.347 N/A GLY 164.A N LEU 9.A O no hydrogen 3.297 N/A SER 165.A N GLN 156.A O no hydrogen 2.714 N/A SER 165.A OG GLN 156.A OE1 no hydrogen 2.613 N/A MET 166.A N ASN 8.A OD1 no hydrogen 2.774 N/A ILE 167.A N SER 154.A O no hydrogen 3.034 N/A GLY 169.A N LEU 152.A O no hydrogen 2.914 N/A ASP 172.A N TYR 323.A OH no hydrogen 2.808 N/A SER 174.A N ASP 172.A OD1 no hydrogen 3.250 N/A SER 174.A OG ASP 172.A OD1 no hydrogen 2.534 N/A LEU 175.A N ASP 172.A O no hydrogen 3.155 N/A THR 177.A N VAL 337.A O no hydrogen 3.180 N/A TRP 181.A N PHE 335.A O no hydrogen 2.846 N/A THR 183.A N ILE 333.A O no hydrogen 2.882 N/A THR 183.A OG1 MET 276.A O no hydrogen 2.522 N/A ILE 185.A N LYS 331.A O no hydrogen 3.258 N/A ARG 186.A N GLU 192.A O no hydrogen 2.810 N/A ARG 186.A NH1 GLU 192.A OE2 no hydrogen 2.716 N/A ARG 186.A NH2 TYR 365.A O no hydrogen 3.002 N/A ARG 187.A NH2 GLU 128.A OE1 no hydrogen 2.977 N/A TRP 189.A N ARG 187.A O no hydrogen 3.108 N/A TRP 189.A N TYR 190.A O no hydrogen 3.300 N/A TRP 189.A NE1 GLU 192.A OE1 no hydrogen 2.697 N/A TYR 191.A OH LEU 124.A O no hydrogen 2.740 N/A VAL 193.A N SER 217.A O no hydrogen 3.035 N/A ILE 195.A N ASN 213.A OD1 no hydrogen 3.019 N/A VAL 196.A N TYR 274.A O no hydrogen 2.869 N/A GLU 199.A N SER 272.A O no hydrogen 2.974 N/A ILE 200.A N GLN 203.A O no hydrogen 2.793 N/A ASN 201.A N VAL 270.A O no hydrogen 2.858 N/A GLN 203.A N ILE 200.A O no hydrogen 2.975 N/A LEU 205.A N VAL 198.A O no hydrogen 3.126 N/A LYS 206.A N ASP 204.A OD1 no hydrogen 2.818 N/A LYS 210.A N ASP 208.A OD1 no hydrogen 2.966 N/A LYS 210.A NZ ASP 362.A O no hydrogen 2.633 N/A LYS 210.A NZ GLY 364.A O no hydrogen 3.507 N/A GLU 211.A N ASP 208.A O no hydrogen 2.954 N/A TYR 212.A N CYS 209.A O no hydrogen 3.089 N/A ASN 213.A N LYS 210.A O no hydrogen 3.336 N/A ASN 213.A ND2 ILE 195.A O no hydrogen 2.868 N/A ASN 213.A ND2 CYS 209.A O no hydrogen 3.325 N/A ASN 213.A ND2 CYS 363.A O no hydrogen 3.242 N/A TYR 214.A N GLU 211.A O no hydrogen 3.362 N/A LYS 216.A NZ ASP 215.A OD2 no hydrogen 3.520 N/A SER 217.A OG ASN 213.A OD1 no hydrogen 2.633 N/A ILE 218.A N THR 312.A O no hydrogen 3.068 N/A VAL 219.A N TYR 191.A O no hydrogen 3.127 N/A ASP 220.A N MET 314.A O no hydrogen 2.923 N/A SER 221.A N THR 36.A OG1 no hydrogen 2.710 N/A SER 221.A OG VAL 34.A O no hydrogen 3.132 N/A GLY 222.A N ASP 220.A OD1 no hydrogen 3.003 N/A THR 223.A N ASP 220.A O no hydrogen 3.192 N/A ASN 225.A ND2 SER 306.A OG no hydrogen 2.768 N/A LEU 226.A N ALA 304.A O no hydrogen 2.906 N/A ARG 227.A N VAL 313.A O no hydrogen 2.965 N/A LEU 228.A N SER 306.A O no hydrogen 3.176 N/A LYS 230.A NZ GLU 234.A OE1 no hydrogen 3.447 N/A LYS 230.A NZ GLU 234.A OE2 no hydrogen 2.733 N/A PHE 233.A N PRO 229.A O no hydrogen 2.603 N/A GLU 234.A N LYS 230.A O no hydrogen 2.766 N/A ALA 235.A N LYS 231.A O no hydrogen 3.095 N/A ALA 236.A N VAL 232.A O no hydrogen 2.868 N/A VAL 237.A N PHE 233.A O no hydrogen 3.138 N/A LYS 238.A N GLU 234.A O no hydrogen 3.148 N/A SER 239.A N ALA 235.A O no hydrogen 3.091 N/A SER 239.A OG ALA 235.A O no hydrogen 3.484 N/A ILE 240.A N ALA 236.A O no hydrogen 2.819 N/A LYS 241.A N VAL 237.A O no hydrogen 2.623 N/A ALA 242.A N LYS 238.A O no hydrogen 3.201 N/A ALA 243.A N SER 239.A O no hydrogen 2.956 N/A SER 244.A N ILE 240.A O no hydrogen 3.223 N/A SER 244.A N LYS 241.A O no hydrogen 3.080 N/A SER 244.A OG ILE 240.A O no hydrogen 2.685 N/A SER 244.A OG LYS 241.A O no hydrogen 3.329 N/A SER 245.A N ALA 242.A O no hydrogen 3.264 N/A SER 245.A OG ALA 242.A O no hydrogen 3.105 N/A GLU 247.A N SER 244.A O no hydrogen 2.749 N/A GLY 252.A N PHE 249.A O no hydrogen 2.888 N/A VAL 256.A N TYR 301.A O no hydrogen 3.068 N/A TRP 258.A N ASP 299.A O no hydrogen 3.188 N/A TRP 258.A NE1 GLU 247.A OE1 no hydrogen 3.047 N/A GLY 261.A N ASP 299.A OD2 no hydrogen 2.740 N/A THR 262.A N GLN 259.A O no hydrogen 3.030 N/A THR 262.A OG1 GLN 259.A O no hydrogen 2.904 N/A TRP 265.A N THR 263.A O no hydrogen 2.712 N/A ILE 267.A N PRO 264.A O no hydrogen 3.220 N/A PHE 268.A N TRP 265.A O no hydrogen 3.187 N/A VAL 270.A N ASN 201.A OD1 no hydrogen 3.052 N/A ILE 271.A N ILE 288.A O no hydrogen 3.049 N/A SER 272.A N GLU 199.A O no hydrogen 2.767 N/A SER 272.A OG THR 287.A OG1 no hydrogen 3.195 N/A LEU 273.A N ILE 286.A O no hydrogen 2.912 N/A TYR 274.A N ARG 197.A O no hydrogen 3.117 N/A TYR 274.A OH GLU 199.A OE1 no hydrogen 2.934 N/A LEU 275.A N PHE 284.A O no hydrogen 2.888 N/A MET 276.A N ILE 194.A O no hydrogen 3.116 N/A GLY 277.A N GLN 282.A O no hydrogen 2.825 N/A GLU 278.A N GLN 282.A OE1 no hydrogen 2.919 N/A VAL 279.A N GLN 282.A OE1 no hydrogen 3.033 N/A GLN 282.A N VAL 279.A O no hydrogen 3.073 N/A GLN 282.A NE2 SER 283.A O no hydrogen 3.263 N/A SER 283.A N PHE 355.A O no hydrogen 2.759 N/A SER 283.A OG THR 357.A OG1 no hydrogen 2.993 N/A PHE 284.A N LEU 275.A O no hydrogen 3.264 N/A ARG 285.A N GLU 352.A O no hydrogen 2.953 N/A ARG 285.A NE GLU 352.A OE1 no hydrogen 2.476 N/A ARG 285.A NH1 TYR 274.A OH no hydrogen 3.026 N/A ARG 285.A NH2 GLU 352.A OE1 no hydrogen 2.465 N/A ILE 286.A N LEU 273.A O no hydrogen 2.926 N/A THR 287.A N ALA 350.A O no hydrogen 2.971 N/A THR 287.A OG1 SER 272.A OG no hydrogen 3.195 N/A ILE 288.A N ILE 271.A O no hydrogen 2.813 N/A GLN 291.A N GLN 291.A OE1 no hydrogen 2.861 N/A GLN 291.A NE2 ASP 344.A OD2 no hydrogen 3.132 N/A GLN 292.A N LEU 289.A O no hydrogen 2.906 N/A TYR 293.A OH PRO 269.A O no hydrogen 2.539 N/A LEU 294.A N PRO 290.A O no hydrogen 2.815 N/A ARG 295.A N LYS 302.A O no hydrogen 2.818 N/A ARG 295.A NE SER 13.A OG no hydrogen 3.321 N/A VAL 297.A N CYS 300.A O no hydrogen 2.726 N/A ASP 299.A N TRP 258.A O no hydrogen 3.072 N/A TYR 301.A N VAL 256.A O no hydrogen 2.980 N/A LYS 302.A N ARG 295.A O no hydrogen 2.890 N/A ALA 304.A N TYR 293.A O no hydrogen 2.899 N/A SER 306.A N LEU 226.A O no hydrogen 3.246 N/A SER 308.A N LEU 228.A O no hydrogen 2.845 N/A SER 308.A OG GLY 311.A O no hydrogen 2.803 N/A THR 310.A N SER 308.A OG no hydrogen 2.812 N/A GLY 311.A N LYS 216.A O no hydrogen 2.996 N/A THR 312.A N TYR 212.A O no hydrogen 3.145 N/A THR 312.A N SER 217.A OG no hydrogen 3.270 N/A THR 312.A OG1 TYR 212.A O no hydrogen 2.597 N/A VAL 313.A N ARG 227.A O no hydrogen 2.793 N/A MET 314.A N ILE 218.A O no hydrogen 2.994 N/A ALA 316.A N THR 223.A O no hydrogen 2.660 N/A VAL 317.A N THR 224.A O no hydrogen 3.128 N/A MET 319.A N GLY 315.A O no hydrogen 3.267 N/A GLU 320.A N ALA 316.A O no hydrogen 3.067 N/A GLY 321.A N LEU 157.A O no hydrogen 3.181 N/A PHE 322.A N MET 319.A O no hydrogen 2.924 N/A TYR 323.A N ALA 336.A O no hydrogen 2.659 N/A VAL 324.A N LEU 155.A O no hydrogen 2.983 N/A VAL 325.A N GLY 334.A O no hydrogen 2.711 N/A PHE 326.A N PHE 153.A O no hydrogen 2.788 N/A ASP 327.A N ARG 332.A O no hydrogen 2.732 N/A ARG 328.A N PHE 326.A O no hydrogen 2.986 N/A ARG 328.A NE ASN 151.A OD1 no hydrogen 2.877 N/A ARG 328.A NH1 TYR 191.A OH no hydrogen 2.785 N/A ARG 328.A NH2 ASP 141.A OD1 no hydrogen 2.800 N/A ALA 329.A N ASN 151.A O no hydrogen 2.931 N/A ARG 330.A N ASP 327.A O no hydrogen 2.955 N/A LYS 331.A N ARG 328.A O no hydrogen 3.208 N/A ARG 332.A N ASP 327.A O no hydrogen 3.035 N/A ARG 332.A NE ASP 327.A OD2 no hydrogen 3.009 N/A ARG 332.A NH1 GLU 278.A OE2 no hydrogen 2.631 N/A ARG 332.A NH2 ASP 327.A OD2 no hydrogen 3.342 N/A ILE 333.A N THR 183.A O no hydrogen 3.000 N/A GLY 334.A N VAL 325.A O no hydrogen 2.668 N/A PHE 335.A N TRP 181.A O no hydrogen 2.664 N/A ALA 336.A N TYR 323.A O no hydrogen 3.072 N/A SER 338.A N GLY 321.A O no hydrogen 2.871 N/A ALA 339.A N LEU 175.A O no hydrogen 2.882 N/A CYS 340.A SG LEU 157.A O no hydrogen 3.712 N/A CYS 340.A SG SER 338.A OG no hydrogen 3.742 N/A PHE 346.A N ASP 344.A OD1 no hydrogen 2.708 N/A ARG 347.A N ASP 344.A OD1 no hydrogen 3.186 N/A ARG 347.A NH1 PHE 268.A O no hydrogen 2.768 N/A ARG 347.A NH2 TRP 265.A O no hydrogen 2.939 N/A ARG 347.A NH2 ASP 344.A OD2 no hydrogen 3.058 N/A GLU 352.A N ARG 285.A O no hydrogen 3.011 N/A PHE 355.A N SER 283.A O no hydrogen 2.837 N/A THR 357.A N ASN 281.A O no hydrogen 2.835 N/A THR 357.A OG1 SER 283.A OG no hydrogen 2.993 N/A ASP 362.A N ASP 359.A O no hydrogen 3.039 N/A CYS 363.A N MET 360.A O no hydrogen 3.116 N/A CYS 363.A SG MET 360.A O no hydrogen 3.400 N/A GLY 364.A N GLU 361.A O no hydrogen 3.221 N/A SER 1P.A N GLU 4.A OE1 no hydrogen 3.140 N/A SER 1P.A N GLU 4.A OE2 no hydrogen 3.537 N/A SER 1P.A OG GLU 4.A OE1 no hydrogen 2.734 N/A