Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6orr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 3.A O no hydrogen 2.572 N/A LEU 6.A N SER 3.A O no hydrogen 3.413 N/A ARG 9.A N LYS 221.A O no hydrogen 2.851 N/A SER 11.A N PRO 8.A O no hydrogen 3.266 N/A SER 11.A OG PRO 8.A O no hydrogen 2.542 N/A SER 14.A OG PHE 16.A O no hydrogen 2.886 N/A GLY 15.A N SER 11.A O no hydrogen 2.827 N/A THR 17.A N SER 223.A OG no hydrogen 3.032 N/A THR 17.A OG1 ARG 9.A O no hydrogen 2.938 N/A THR 17.A OG1 SER 223.A OG no hydrogen 2.824 N/A SER 18.A N GLY 10.A O no hydrogen 3.141 N/A SER 18.A OG THR 21.A OG1 no hydrogen 3.150 N/A LYS 19.A NZ ASP 153.A OD2 no hydrogen 2.861 N/A THR 21.A N SER 18.A O no hydrogen 3.184 N/A THR 21.A OG1 SER 18.A O no hydrogen 3.469 N/A THR 21.A OG1 SER 18.A OG no hydrogen 3.150 N/A TYR 22.A N LYS 19.A O no hydrogen 3.139 N/A TYR 22.A OH TYR 215.A OH no hydrogen 2.745 N/A LEU 23.A N ASP 20.A O no hydrogen 3.137 N/A SER 24.A N THR 21.A O no hydrogen 3.335 N/A SER 24.A OG ASP 20.A O no hydrogen 3.244 N/A SER 24.A OG HIS 25.A ND1 no hydrogen 2.788 N/A HIS 25.A N THR 21.A O no hydrogen 2.748 N/A HIS 25.A ND1 SER 24.A OG no hydrogen 2.788 N/A ASN 27.A ND2 ASP 30.A OD2 no hydrogen 2.557 N/A TYR 31.A N ASN 27.A O no hydrogen 3.017 N/A LEU 32.A N PRO 28.A O no hydrogen 2.963 N/A GLU 33.A N ARG 29.A O no hydrogen 2.934 N/A LYS 34.A N ASP 30.A O no hydrogen 3.027 N/A LYS 34.A N TYR 31.A O no hydrogen 3.188 N/A TYR 35.A N TYR 31.A O no hydrogen 3.034 N/A TYR 35.A OH MET 216.A O no hydrogen 2.364 N/A TYR 35.A OH MET 257.A O no hydrogen 2.924 N/A TYR 36.A N LEU 32.A O no hydrogen 2.956 N/A TYR 36.A OH TYR 80.A OH no hydrogen 3.217 N/A LYS 37.A NZ GLU 33.A OE1 no hydrogen 3.243 N/A LYS 37.A NZ GLU 33.A OE2 no hydrogen 2.693 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.649 N/A SER 46.A N SER 43.A OG no hydrogen 3.231 N/A GLN 47.A N SER 43.A O no hydrogen 2.887 N/A ILE 48.A N ALA 44.A O no hydrogen 3.258 N/A LEU 49.A N GLU 45.A O no hydrogen 3.232 N/A LYS 50.A N SER 46.A O no hydrogen 2.987 N/A LYS 50.A NZ GLN 47.A OE1 no hydrogen 3.285 N/A HIS 51.A N GLN 47.A O no hydrogen 3.058 N/A LEU 52.A N ILE 48.A O no hydrogen 2.908 N/A LEU 53.A N LEU 49.A O no hydrogen 2.908 N/A LYS 54.A N LYS 50.A O no hydrogen 3.101 N/A ASN 55.A N HIS 51.A O no hydrogen 3.046 N/A ASN 55.A ND2 SER 265.A OG no hydrogen 2.954 N/A LEU 56.A N LEU 52.A O no hydrogen 2.980 N/A PHE 57.A N LEU 53.A O no hydrogen 2.870 N/A LYS 58.A N LYS 54.A O no hydrogen 2.911 N/A LYS 58.A NZ ASP 63.A OD2 no hydrogen 3.472 N/A ILE 59.A N ASN 55.A O no hydrogen 2.771 N/A PHE 60.A N LEU 56.A O no hydrogen 3.013 N/A CYS 61.A N PHE 57.A O no hydrogen 2.891 N/A CYS 61.A SG GLU 129.A OE2 no hydrogen 3.830 N/A LEU 62.A N PHE 57.A O no hydrogen 3.357 N/A ASP 63.A N LYS 58.A O no hydrogen 2.822 N/A GLY 67.A N SER 88.A O no hydrogen 3.333 N/A ASP 68.A N ASP 169.A OD2 no hydrogen 2.405 N/A LEU 69.A N ASP 169.A OD2 no hydrogen 3.368 N/A LEU 70.A N GLU 91.A O no hydrogen 2.995 N/A ILE 71.A N CYS 170.A O no hydrogen 3.167 N/A ASP 72.A N VAL 93.A O no hydrogen 2.691 N/A ILE 73.A N LEU 172.A O no hydrogen 2.720 N/A SER 75.A N THR 95.A O no hydrogen 2.800 N/A SER 75.A OG GLY 76.A O no hydrogen 3.302 N/A SER 75.A OG THR 95.A O no hydrogen 3.037 N/A GLY 76.A N ASP 96.A OD1 no hydrogen 2.897 N/A THR 78.A N SER 75.A O no hydrogen 3.421 N/A THR 78.A OG1 SER 75.A O no hydrogen 2.752 N/A THR 78.A OG1 GLN 81.A OE1 no hydrogen 3.022 N/A TYR 80.A OH TYR 36.A OH no hydrogen 3.217 N/A GLN 81.A N GLN 81.A OE1 no hydrogen 2.536 N/A GLN 81.A NE2 ASP 72.A OD2 no hydrogen 2.709 N/A GLN 81.A NE2 THR 78.A O no hydrogen 3.167 N/A GLN 81.A NE2 THR 78.A OG1 no hydrogen 3.178 N/A LEU 82.A N ILE 79.A O no hydrogen 3.192 N/A LEU 83.A N TYR 80.A O no hydrogen 3.395 N/A SER 84.A OG GLU 129.A OE2 no hydrogen 3.404 N/A CYS 86.A N LEU 82.A O no hydrogen 3.137 N/A CYS 86.A SG LEU 83.A O no hydrogen 3.167 N/A GLU 87.A N SER 84.A O no hydrogen 3.243 N/A SER 88.A N ALA 85.A O no hydrogen 3.046 N/A SER 88.A OG PHE 60.A O no hydrogen 2.463 N/A PHE 89.A N ALA 85.A O no hydrogen 3.040 N/A GLU 91.A N ASP 68.A O no hydrogen 3.053 N/A ILE 92.A N ALA 145.A O no hydrogen 2.814 N/A VAL 93.A N LEU 70.A O no hydrogen 2.729 N/A VAL 94.A N GLN 148.A O no hydrogen 2.967 N/A THR 95.A N ASP 72.A O no hydrogen 2.928 N/A THR 95.A OG1 ASP 72.A O no hydrogen 2.367 N/A ASP 96.A N LEU 150.A O no hydrogen 3.321 N/A SER 98.A N ASP 96.A OD2 no hydrogen 2.869 N/A SER 98.A OG TYR 22.A O no hydrogen 3.459 N/A ASN 101.A N SER 98.A OG no hydrogen 3.366 N/A ASN 101.A ND2 ASP 96.A OD2 no hydrogen 2.849 N/A LEU 102.A N SER 98.A O no hydrogen 3.208 N/A GLN 103.A N ASP 99.A O no hydrogen 3.041 N/A GLU 104.A N GLN 100.A O no hydrogen 2.981 N/A LEU 105.A N ASN 101.A O no hydrogen 2.895 N/A GLU 106.A N LEU 102.A O no hydrogen 2.932 N/A LYS 107.A N GLN 103.A O no hydrogen 3.053 N/A TRP 108.A N GLU 104.A O no hydrogen 3.375 N/A TRP 108.A N LEU 105.A O no hydrogen 2.963 N/A LEU 109.A N LEU 105.A O no hydrogen 3.068 N/A LYS 110.A N GLU 106.A O no hydrogen 3.316 N/A ALA 111.A N TRP 108.A O no hydrogen 3.057 N/A ALA 112.A N LYS 107.A O no hydrogen 2.995 N/A ALA 115.A N ALA 112.A O no hydrogen 3.094 N/A PHE 116.A N GLU 104.A OE2 no hydrogen 3.341 N/A SER 119.A N ASP 117.A OD1 no hydrogen 3.210 N/A SER 119.A OG ASP 117.A OD1 no hydrogen 2.721 N/A SER 119.A OG ASP 117.A OD2 no hydrogen 3.336 N/A VAL 122.A N TRP 118.A O no hydrogen 2.867 N/A THR 123.A N SER 119.A O no hydrogen 2.915 N/A THR 123.A OG1 SER 119.A O no hydrogen 2.858 N/A TYR 124.A N PRO 120.A O no hydrogen 3.335 N/A VAL 125.A N VAL 121.A O no hydrogen 3.184 N/A CYS 126.A N VAL 122.A O no hydrogen 2.939 N/A CYS 126.A SG VAL 122.A O no hydrogen 3.302 N/A CYS 126.A SG VAL 133.A O no hydrogen 3.776 N/A ASP 127.A N THR 123.A O no hydrogen 3.007 N/A LEU 128.A N TYR 124.A O no hydrogen 3.053 N/A GLU 129.A N VAL 125.A O no hydrogen 3.029 N/A GLY 130.A N ASP 127.A O no hydrogen 3.425 N/A ASN 131.A N CYS 126.A O no hydrogen 2.825 N/A ASN 131.A ND2 ASP 127.A OD1 no hydrogen 2.624 N/A LYS 138.A N LYS 134.A O no hydrogen 2.982 N/A LYS 138.A NZ LEU 83.A O no hydrogen 2.720 N/A LYS 138.A NZ GLU 87.A OE2 no hydrogen 3.191 N/A LYS 138.A NZ GLU 129.A OE1 no hydrogen 2.803 N/A LYS 138.A NZ GLU 129.A OE2 no hydrogen 2.850 N/A GLU 139.A N GLY 135.A O no hydrogen 2.864 N/A GLU 140.A N PRO 136.A O no hydrogen 3.096 N/A LYS 141.A N GLU 137.A O no hydrogen 3.282 N/A LYS 141.A NZ CYS 86.A O no hydrogen 3.117 N/A LYS 141.A NZ GLU 87.A OE1 no hydrogen 3.494 N/A LEU 142.A N LYS 138.A O no hydrogen 3.315 N/A ARG 143.A N GLU 139.A O no hydrogen 2.970 N/A ARG 143.A NE TRP 108.A O no hydrogen 2.604 N/A ARG 143.A NH1 GLU 139.A OE1 no hydrogen 3.543 N/A ARG 143.A NH2 TRP 108.A O no hydrogen 3.180 N/A GLN 144.A N GLU 140.A O no hydrogen 3.038 N/A GLN 144.A NE2 GLU 140.A O no hydrogen 3.317 N/A ALA 145.A N LYS 141.A O no hydrogen 3.135 N/A ALA 145.A N LEU 142.A O no hydrogen 3.019 N/A VAL 146.A N LEU 142.A O no hydrogen 2.988 N/A LYS 147.A N ILE 92.A O no hydrogen 2.890 N/A LYS 147.A NZ GLN 144.A O no hydrogen 3.426 N/A LEU 150.A N VAL 94.A O no hydrogen 2.951 N/A CYS 152.A N ASP 96.A O no hydrogen 3.086 N/A CYS 152.A SG.A THR 95.A OG1 no hydrogen 3.550 N/A CYS 152.A SG.B PRO 159.A O no hydrogen 3.415 N/A ASP 153.A N PRO 159.A O no hydrogen 2.994 N/A THR 155.A N ASP 153.A OD1 no hydrogen 3.195 N/A THR 155.A OG1 ASP 153.A OD1 no hydrogen 2.717 N/A THR 155.A OG1 ASP 153.A OD2 no hydrogen 3.253 N/A GLN 156.A N ASP 153.A O no hydrogen 3.280 N/A GLN 156.A NE2 ASP 153.A OD2 no hydrogen 3.444 N/A GLN 156.A NE2 THR 155.A OG1 no hydrogen 3.193 N/A GLY 161.A N GLN 158.A O no hydrogen 3.005 N/A ALA 168.A N LEU 197.A O no hydrogen 2.745 N/A ASP 169.A N LEU 69.A O no hydrogen 2.969 N/A CYS 170.A N LEU 69.A O no hydrogen 3.399 N/A CYS 170.A SG PHE 203.A O no hydrogen 3.797 N/A VAL 171.A N PHE 203.A O no hydrogen 2.874 N/A LEU 172.A N ILE 71.A O no hydrogen 2.888 N/A SER 173.A N VAL 205.A O no hydrogen 2.973 N/A SER 173.A OG ILE 73.A O no hydrogen 3.224 N/A LEU 175.A N MET 207.A O no hydrogen 2.604 N/A ASP 178.A N ASP 208.A OD2 no hydrogen 2.930 N/A ALA 179.A N CYS 176.A O no hydrogen 3.099 N/A ALA 180.A N CYS 176.A O no hydrogen 2.925 N/A ALA 180.A N LEU 177.A O no hydrogen 3.277 N/A CYS 181.A N LEU 177.A O no hydrogen 3.089 N/A CYS 181.A SG LEU 177.A O no hydrogen 3.420 N/A THR 186.A N ASP 183.A OD1 no hydrogen 2.727 N/A THR 186.A OG1 ASP 183.A OD1 no hydrogen 2.778 N/A THR 186.A OG1 ASP 183.A OD2 no hydrogen 3.517 N/A TYR 187.A N ASP 183.A O no hydrogen 2.947 N/A CYS 188.A N LEU 184.A O no hydrogen 2.729 N/A CYS 188.A SG.A ALA 235.A O no hydrogen 3.679 N/A CYS 188.A SG.B LEU 184.A O no hydrogen 3.245 N/A ARG 189.A N PRO 185.A O no hydrogen 2.870 N/A ALA 190.A N THR 186.A O no hydrogen 2.691 N/A LEU 191.A N TYR 187.A O no hydrogen 3.064 N/A ARG 192.A N CYS 188.A O no hydrogen 3.125 N/A ASN 193.A N ARG 189.A O no hydrogen 2.901 N/A ASN 193.A ND2 VAL 154.A O no hydrogen 2.611 N/A LEU 194.A N ALA 190.A O no hydrogen 3.135 N/A GLY 195.A N LEU 191.A O no hydrogen 3.179 N/A SER 196.A N ASN 193.A O no hydrogen 3.183 N/A SER 196.A OG ASN 193.A O no hydrogen 2.468 N/A LEU 197.A N LEU 194.A O no hydrogen 3.115 N/A LEU 198.A N GLY 195.A O no hydrogen 3.117 N/A LYS 199.A N ALA 168.A O no hydrogen 2.940 N/A LYS 199.A NZ ASP 169.A OD1 no hydrogen 3.135 N/A GLY 202.A N LYS 199.A O no hydrogen 2.911 N/A PHE 203.A N ASP 169.A O no hydrogen 2.896 N/A LEU 204.A N ALA 268.A O no hydrogen 2.629 N/A VAL 205.A N VAL 171.A O no hydrogen 2.846 N/A ILE 206.A N LEU 266.A O no hydrogen 3.257 N/A MET 207.A N SER 173.A O no hydrogen 3.019 N/A ASP 208.A N PHE 264.A O no hydrogen 3.293 N/A ALA 209.A N ASP 208.A OD1 no hydrogen 2.685 N/A LEU 210.A N GLY 262.A O no hydrogen 2.701 N/A LYS 211.A N LEU 227.A O no hydrogen 2.792 N/A SER 212.A OG ASN 259.A OD1 no hydrogen 3.278 N/A SER 213.A N ASN 259.A OD1 no hydrogen 3.065 N/A TYR 214.A N ASN 259.A OD1 no hydrogen 3.178 N/A TYR 215.A N PHE 222.A O no hydrogen 2.905 N/A TYR 215.A OH TYR 22.A OH no hydrogen 2.745 N/A MET 216.A N MET 257.A O no hydrogen 2.447 N/A ILE 217.A N GLN 220.A O no hydrogen 2.822 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.619 N/A GLN 220.A N ILE 217.A O no hydrogen 3.098 N/A GLN 220.A NE2 GLU 219.A OE2 no hydrogen 3.359 N/A LYS 221.A NZ GLY 5.A O no hydrogen 3.324 N/A PHE 222.A N TYR 215.A O no hydrogen 2.864 N/A SER 223.A N THR 17.A OG1 no hydrogen 2.914 N/A SER 223.A OG THR 17.A OG1 no hydrogen 2.824 N/A SER 224.A N SER 213.A O no hydrogen 3.106 N/A SER 224.A OG SER 212.A O no hydrogen 2.789 N/A LEU 225.A N ASP 178.A O no hydrogen 2.829 N/A LEU 227.A N LEU 225.A O no hydrogen 2.845 N/A ARG 229.A NH1 GLU 233.A OE2 no hydrogen 2.700 N/A VAL 232.A N GLY 228.A O no hydrogen 2.898 N/A GLU 233.A N ARG 229.A O no hydrogen 2.935 N/A ALA 234.A N GLU 230.A O no hydrogen 3.192 N/A ALA 235.A N ALA 231.A O no hydrogen 3.028 N/A VAL 236.A N VAL 232.A O no hydrogen 2.909 N/A LYS 237.A N GLU 233.A O no hydrogen 3.051 N/A GLU 238.A N ALA 234.A O no hydrogen 2.888 N/A ALA 239.A N ALA 235.A O no hydrogen 3.033 N/A GLY 240.A N LYS 237.A O no hydrogen 3.156 N/A TYR 241.A N VAL 236.A O no hydrogen 3.324 N/A TYR 241.A OH LEU 191.A O no hydrogen 2.689 N/A THR 242.A N ARG 269.A O no hydrogen 2.863 N/A GLU 244.A N VAL 267.A O no hydrogen 2.769 N/A TRP 245.A N VAL 267.A O no hydrogen 3.444 N/A GLU 247.A N SER 265.A O no hydrogen 2.692 N/A ILE 249.A N LEU 263.A O no hydrogen 2.876 N/A SER 252.A OG SER 250.A O no hydrogen 3.285 N/A SER 252.A OG ASN 260.A O no hydrogen 3.219 N/A TYR 253.A N ASN 260.A OD1 no hydrogen 2.928 N/A MET 257.A N SER 254.A O no hydrogen 2.782 N/A ALA 258.A N SER 254.A O no hydrogen 2.823 N/A ASN 259.A ND2 SER 213.A OG no hydrogen 2.540 N/A ASN 260.A ND2 GLY 262.A O no hydrogen 3.163 N/A GLU 261.A N LEU 210.A O no hydrogen 2.806 N/A LEU 263.A N ILE 249.A O no hydrogen 3.298 N/A PHE 264.A N ASP 208.A O no hydrogen 2.918 N/A SER 265.A N GLU 247.A O no hydrogen 2.724 N/A LEU 266.A N ILE 206.A O no hydrogen 3.098 N/A VAL 267.A N TRP 245.A O no hydrogen 3.117 N/A ALA 268.A N LEU 204.A O no hydrogen 2.810 N/A ARG 269.A N THR 242.A O no hydrogen 2.870 N/A ARG 269.A NE GLY 201.A O no hydrogen 3.000 N/A ARG 269.A NH2 GLY 201.A O no hydrogen 3.016 N/A LYS 270.A N GLY 202.A O no hydrogen 3.013 N/A LYS 270.A NZ GLY 195.A O no hydrogen 2.723 N/A LYS 270.A NZ LEU 198.A O no hydrogen 3.291 N/A LEU 271.A N GLY 240.A O no hydrogen 2.879 N/A