Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wul_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PHE 104.A O no hydrogen 2.834 N/A GLN 4.A N SER 106.A OG no hydrogen 2.845 N/A GLN 4.A NE2 TYR 87.A O no hydrogen 2.966 N/A LYS 7.A NZ TYR 8.A OH no hydrogen 3.539 N/A LEU 9.A N ARG 109.A O no hydrogen 2.843 N/A ALA 11.A N THR 111.A O no hydrogen 3.066 N/A THR 13.A N LEU 113.A O no hydrogen 2.686 N/A GLY 14.A N LEU 79.A O no hydrogen 2.869 N/A SER 15.A N VAL 12.A O no hydrogen 3.059 N/A SER 15.A OG VAL 12.A O no hydrogen 2.378 N/A LYS 17.A N ILE 76.A O no hydrogen 3.019 N/A LEU 19.A N LEU 74.A O no hydrogen 2.793 N/A CYS 21.A N ASP 73.A OD1 no hydrogen 3.155 N/A GLN 23.A N ASN 70.A O no hydrogen 2.942 N/A TYR 24.A OH GLU 22.A OE1 no hydrogen 2.280 N/A LEU 25.A N GLN 23.A OE1 no hydrogen 2.800 N/A HIS 27.A N GLN 23.A OE1 no hydrogen 3.321 N/A HIS 27.A ND1 SER 91.A OG no hydrogen 2.659 N/A ASN 28.A N GLN 93.A O no hydrogen 3.224 N/A ASN 28.A ND2 GLN 93.A O no hydrogen 3.344 N/A ALA 29.A N SER 92.A O no hydrogen 3.186 N/A MET 30.A N TYR 47.A O no hydrogen 2.880 N/A TYR 31.A N ALA 90.A O no hydrogen 2.642 N/A TYR 31.A OH SER 92.A OG no hydrogen 2.697 N/A TRP 32.A N PHE 45.A O no hydrogen 3.078 N/A TRP 32.A NE1 LEU 72.A O no hydrogen 2.729 N/A TYR 33.A N PHE 88.A O no hydrogen 2.843 N/A ARG 34.A N GLU 42.A O no hydrogen 2.813 N/A GLN 35.A N THR 86.A O no hydrogen 2.799 N/A GLN 35.A NE2 PRO 40.A O no hydrogen 2.888 N/A SER 36.A N LYS 39.A O no hydrogen 3.225 N/A SER 36.A OG LYS 39.A O no hydrogen 3.545 N/A GLU 42.A N ARG 34.A O no hydrogen 2.711 N/A MET 44.A N TRP 32.A O no hydrogen 2.950 N/A PHE 45.A N TRP 32.A O no hydrogen 3.343 N/A SER 46.A N ASP 54.A O no hydrogen 3.008 N/A TYR 47.A N MET 30.A O no hydrogen 2.856 N/A SER 48.A N MET 51.A O no hydrogen 2.983 N/A TYR 49.A N ASN 28.A O no hydrogen 2.784 N/A GLN 50.A NE2 SER 66.A O no hydrogen 2.690 N/A GLN 50.A NE2 SER 67.A O no hydrogen 3.277 N/A MET 51.A N SER 48.A O no hydrogen 2.934 N/A MET 53.A N SER 46.A O no hydrogen 2.839 N/A ASP 54.A N SER 46.A O no hydrogen 3.428 N/A ASN 55.A N ASP 54.A OD1 no hydrogen 2.715 N/A ASN 55.A ND2 THR 57.A O no hydrogen 3.687 N/A GLN 56.A N MET 44.A O no hydrogen 3.112 N/A THR 57.A N ASN 55.A OD1 no hydrogen 2.892 N/A THR 57.A OG1 ASN 55.A OD1 no hydrogen 3.348 N/A ARG 61.A N SER 59.A OG no hydrogen 3.195 N/A ARG 61.A NH1 THR 77.A O no hydrogen 3.136 N/A ARG 61.A NH1 ASP 83.A OD2 no hydrogen 2.997 N/A ARG 61.A NH2 ASP 83.A OD1 no hydrogen 3.369 N/A ARG 61.A NH2 ASP 83.A OD2 no hydrogen 3.271 N/A PHE 62.A N SER 59.A O no hydrogen 3.513 N/A GLN 63.A N GLN 75.A O no hydrogen 2.908 N/A GLN 65.A N ASP 73.A O no hydrogen 2.785 N/A GLN 65.A NE2 GLN 75.A OE1 no hydrogen 3.390 N/A SER 66.A OG GLN 50.A O no hydrogen 2.989 N/A HIS 71.A N LYS 68.A O no hydrogen 3.430 N/A HIS 71.A ND1 LYS 69.A O no hydrogen 2.898 N/A LEU 72.A N CYS 21.A O no hydrogen 3.105 N/A ASP 73.A N GLN 65.A O no hydrogen 2.952 N/A LEU 74.A N LEU 19.A O no hydrogen 2.803 N/A GLN 75.A N GLN 63.A O no hydrogen 3.056 N/A ILE 76.A N LYS 17.A O no hydrogen 2.800 N/A THR 77.A N ARG 61.A O no hydrogen 3.094 N/A LEU 79.A N SER 15.A O no hydrogen 2.955 N/A LYS 80.A N ASP 83.A OD2 no hydrogen 2.951 N/A ASP 83.A N LYS 80.A O no hydrogen 3.089 N/A SER 84.A N PRO 81.A O no hydrogen 3.242 N/A SER 84.A OG PRO 81.A O no hydrogen 2.852 N/A ALA 85.A N LEU 110.A O no hydrogen 3.049 N/A THR 86.A N GLN 35.A O no hydrogen 2.969 N/A TYR 87.A N THR 108.A O no hydrogen 2.758 N/A TYR 87.A OH ASP 83.A O no hydrogen 2.717 N/A PHE 88.A N TYR 33.A O no hydrogen 2.860 N/A CYS 89.A N GLN 4.A OE1 no hydrogen 2.717 N/A CYS 89.A SG TYR 31.A O no hydrogen 3.753 N/A ALA 90.A N TYR 31.A O no hydrogen 2.975 N/A SER 91.A N TYR 103.A O no hydrogen 2.928 N/A SER 91.A OG HIS 27.A ND1 no hydrogen 2.659 N/A SER 92.A N ALA 29.A O no hydrogen 2.978 N/A SER 92.A OG TYR 31.A OH no hydrogen 2.697 N/A SER 92.A OG ASP 94.A O no hydrogen 2.877 N/A GLN 93.A NE2 GLY 26.A O no hydrogen 3.623 N/A ARG 95.A NE ASP 97.A OD1 no hydrogen 2.542 N/A ARG 95.A NE ASP 97.A OD2 no hydrogen 3.367 N/A ARG 95.A NH2 ASP 97.A OD2 no hydrogen 2.882 N/A GLY 96.A N SER 48.A OG no hydrogen 2.957 N/A SER 98.A N ARG 95.A O no hydrogen 3.024 N/A SER 98.A OG ASP 97.A OD1 no hydrogen 2.589 N/A TYR 103.A N SER 91.A O no hydrogen 2.944 N/A GLY 105.A N CYS 89.A O no hydrogen 2.447 N/A SER 106.A N ILE 2.A O no hydrogen 3.162 N/A GLY 107.A N GLN 4.A OE1 no hydrogen 2.857 N/A THR 108.A N TYR 87.A O no hydrogen 2.940 N/A THR 108.A OG1 PRO 6.A O no hydrogen 2.690 N/A ARG 109.A N LYS 7.A O no hydrogen 2.821 N/A ARG 109.A NH1 ASP 152.A OD2 no hydrogen 3.116 N/A ARG 109.A NH2 ASP 152.A OD2 no hydrogen 3.457 N/A LEU 110.A N ALA 85.A O no hydrogen 2.773 N/A THR 111.A N LEU 9.A O no hydrogen 3.036 N/A THR 111.A OG1 HIS 153.A NE2 no hydrogen 2.788 N/A VAL 112.A N SER 84.A OG no hydrogen 2.808 N/A LEU 113.A N ALA 11.A O no hydrogen 2.951 N/A VAL 119.A N LEU 116.A O no hydrogen 3.204 N/A THR 120.A N PHE 150.A O no hydrogen 3.056 N/A THR 120.A OG1 GLY 148.A O no hydrogen 2.874 N/A LYS 123.A N ARG 147.A O no hydrogen 2.913 N/A SER 125.A N LEU 145.A O no hydrogen 2.831 N/A PHE 127.A N VAL 143.A O no hydrogen 2.731 N/A ALA 132.A N SER 130.A OG no hydrogen 3.233 N/A GLU 133.A N SER 130.A O no hydrogen 3.338 N/A ASN 136.A N ALA 132.A O no hydrogen 3.090 N/A LYS 137.A N GLU 133.A O no hydrogen 2.864 N/A ALA 140.A N VAL 191.A O no hydrogen 2.628 N/A THR 141.A N GLU 133.A OE1 no hydrogen 2.831 N/A THR 141.A OG1 GLU 133.A OE1 no hydrogen 3.086 N/A THR 141.A OG1 GLU 133.A OE2 no hydrogen 2.296 N/A LEU 142.A N LEU 189.A O no hydrogen 2.819 N/A VAL 143.A N PHE 127.A O no hydrogen 3.153 N/A CYS 144.A N SER 187.A O no hydrogen 2.835 N/A CYS 144.A SG SER 125.A O no hydrogen 3.654 N/A LEU 145.A N SER 125.A O no hydrogen 2.911 N/A ALA 146.A N LEU 185.A O no hydrogen 2.763 N/A ARG 147.A N LYS 123.A O no hydrogen 3.082 N/A ARG 147.A NH2 SER 125.A OG no hydrogen 3.278 N/A GLY 148.A N GLU 178.A OE1 no hydrogen 3.285 N/A PHE 150.A N THR 120.A O no hydrogen 2.896 N/A HIS 153.A N PRO 151.A O no hydrogen 2.850 N/A HIS 153.A NE2 THR 111.A OG1 no hydrogen 2.788 N/A GLU 155.A N GLN 208.A O no hydrogen 3.045 N/A SER 157.A N GLN 206.A O no hydrogen 2.760 N/A SER 157.A OG GLN 206.A O no hydrogen 3.546 N/A TRP 158.A NE1 SER 187.A OG no hydrogen 2.910 N/A TRP 159.A N ARG 204.A O no hydrogen 2.765 N/A TRP 159.A NE1 SER 157.A OG no hydrogen 2.891 N/A VAL 160.A N LYS 163.A O no hydrogen 2.834 N/A ASN 161.A N HIS 202.A O no hydrogen 2.943 N/A ASN 161.A ND2 ASN 201.A OD1 no hydrogen 3.489 N/A LYS 163.A N VAL 160.A O no hydrogen 2.980 N/A VAL 165.A N TRP 158.A O no hydrogen 2.959 N/A CYS 170.A N ARG 188.A O no hydrogen 3.306 N/A THR 171.A OG1 SER 187.A OG no hydrogen 2.679 N/A ASP 172.A N SER 186.A O no hydrogen 3.121 N/A TYR 176.A N CYS 184.A O no hydrogen 2.946 N/A LYS 177.A NZ TYR 183.A OH no hydrogen 2.423 N/A GLU 178.A N SER 182.A O no hydrogen 2.782 N/A SER 179.A N SER 182.A O no hydrogen 3.314 N/A SER 179.A OG SER 182.A OG no hydrogen 2.687 N/A SER 182.A OG GLU 178.A OE1 no hydrogen 3.343 N/A SER 182.A OG SER 179.A OG no hydrogen 2.687 N/A TYR 183.A N PHE 149.A O no hydrogen 2.966 N/A CYS 184.A N TYR 176.A O no hydrogen 2.593 N/A CYS 184.A SG TYR 176.A O no hydrogen 3.218 N/A LEU 185.A N ALA 146.A O no hydrogen 2.784 N/A SER 186.A OG ASP 172.A OD2 no hydrogen 2.400 N/A SER 187.A N CYS 144.A O no hydrogen 3.080 N/A SER 187.A OG CYS 170.A O no hydrogen 3.143 N/A SER 187.A OG THR 171.A OG1 no hydrogen 2.679 N/A ARG 188.A N CYS 170.A O no hydrogen 2.973 N/A LEU 189.A N LEU 142.A O no hydrogen 2.821 N/A ARG 190.A N GLY 168.A O no hydrogen 2.899 N/A ARG 190.A NE GLU 133.A OE2 no hydrogen 3.356 N/A ARG 190.A NH2 GLU 133.A OE2 no hydrogen 3.270 N/A VAL 191.A N ALA 140.A O no hydrogen 2.738 N/A SER 192.A OG THR 194.A OG1 no hydrogen 3.255 N/A ALA 193.A N GLN 138.A O no hydrogen 3.168 N/A THR 194.A OG1 SER 192.A OG no hydrogen 3.255 N/A PHE 195.A N SER 192.A O no hydrogen 3.266 N/A PHE 195.A N SER 192.A OG no hydrogen 3.232 N/A TRP 196.A N SER 192.A O no hydrogen 3.067 N/A HIS 197.A N ALA 193.A O no hydrogen 3.212 N/A ASN 201.A N ASN 198.A O no hydrogen 3.291 N/A ASN 201.A ND2 PHE 195.A O no hydrogen 2.744 N/A HIS 202.A N ASN 161.A OD1 no hydrogen 3.052 N/A PHE 203.A N ALA 234.A O no hydrogen 3.009 N/A ARG 204.A N TRP 159.A O no hydrogen 2.815 N/A ARG 204.A NH1 GLN 206.A OE1 no hydrogen 2.921 N/A ARG 204.A NH1 SER 231.A OG no hydrogen 2.858 N/A ARG 204.A NH2 GLN 206.A OE1 no hydrogen 3.405 N/A CYS 205.A N ALA 232.A O no hydrogen 2.823 N/A GLN 206.A N SER 157.A O no hydrogen 2.780 N/A VAL 207.A N ILE 230.A O no hydrogen 2.920 N/A GLN 208.A N GLU 155.A O no hydrogen 2.832 N/A PHE 209.A N GLN 228.A O no hydrogen 2.873 N/A HIS 210.A N HIS 153.A O no hydrogen 2.892 N/A GLY 211.A N THR 227.A OG1 no hydrogen 3.181 N/A LEU 212.A N PRO 225.A O no hydrogen 2.987 N/A SER 213.A N ASP 216.A OD2 no hydrogen 2.848 N/A SER 213.A OG ASP 216.A OD2 no hydrogen 3.246 N/A ASP 216.A N SER 213.A O no hydrogen 3.163 N/A TRP 218.A NE1 SER 222.A O no hydrogen 3.014 N/A TRP 218.A NE1 SER 222.A OG no hydrogen 3.124 N/A LYS 224.A NZ SER 213.A O no hydrogen 2.615 N/A LYS 224.A NZ ASP 216.A O no hydrogen 2.791 N/A VAL 226.A N LYS 224.A O no hydrogen 2.820 N/A GLN 228.A N PHE 209.A O no hydrogen 3.065 N/A GLN 228.A NE2 VAL 226.A O no hydrogen 3.019 N/A ILE 230.A N VAL 207.A O no hydrogen 2.980 N/A ALA 232.A N CYS 205.A O no hydrogen 2.953 N/A ALA 234.A N PHE 203.A O no hydrogen 2.931 N/A GLY 236.A N ASN 201.A O no hydrogen 3.217 N/A ARG 237.A N TRP 196.A O no hydrogen 3.004 N/A ARG 237.A NH1 GLU 128.A OE2 no hydrogen 3.239 N/A ARG 237.A NH2 GLU 128.A OE1 no hydrogen 2.376 N/A