Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wyi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ALA 1.A O no hydrogen 2.657 N/A ARG 4.A NE ASP 227.A OD2 no hydrogen 3.027 N/A ARG 4.A NH1 GLN 202.A O no hydrogen 2.652 N/A ARG 4.A NH2 ASP 227.A OD1 no hydrogen 3.173 N/A PHE 7.A N ASP 227.A O no hydrogen 3.035 N/A VAL 8.A N GLU 38.A O no hydrogen 2.667 N/A GLY 9.A N PHE 229.A O no hydrogen 2.959 N/A GLY 10.A N VAL 40.A O no hydrogen 2.593 N/A ASN 11.A N VAL 231.A O no hydrogen 2.640 N/A ASN 11.A ND2 HIS 95.A NE2 no hydrogen 3.261 N/A TRP 12.A N ALA 42.A O no hydrogen 3.217 N/A LYS 13.A N ASN 11.A OD1 no hydrogen 3.136 N/A LYS 13.A NZ GLU 97.A OE2 no hydrogen 2.750 N/A ASN 15.A ND2 TRP 12.A O no hydrogen 2.736 N/A ARG 17.A N SER 20.A OG no hydrogen 3.091 N/A ARG 17.A NH1 GLY 16.A O no hydrogen 3.047 N/A SER 20.A OG ARG 17.A O no hydrogen 3.273 N/A LEU 21.A N ARG 17.A O no hydrogen 2.669 N/A GLY 22.A N LYS 18.A O no hydrogen 2.513 N/A GLU 23.A N GLN 19.A O no hydrogen 2.969 N/A LEU 24.A N SER 20.A O no hydrogen 2.952 N/A ILE 25.A N LEU 21.A O no hydrogen 2.784 N/A GLY 26.A N GLY 22.A O no hydrogen 2.920 N/A THR 27.A N GLU 23.A O no hydrogen 3.339 N/A LEU 28.A N LEU 24.A O no hydrogen 3.290 N/A ASN 29.A N ILE 25.A O no hydrogen 2.791 N/A ASN 29.A ND2 LYS 54.A O no hydrogen 2.650 N/A ALA 30.A N GLY 26.A O no hydrogen 2.890 N/A ALA 31.A N LEU 28.A O no hydrogen 2.789 N/A THR 37.A N PRO 34.A O no hydrogen 2.820 N/A THR 37.A OG1 PRO 34.A O no hydrogen 2.936 N/A GLU 38.A N PHE 6.A O no hydrogen 2.622 N/A VAL 40.A N VAL 8.A O no hydrogen 2.871 N/A CYS 41.A N ALA 60.A O no hydrogen 3.040 N/A ALA 42.A N GLY 10.A O no hydrogen 2.782 N/A TYR 47.A N PRO 44.A O no hydrogen 2.828 N/A ALA 51.A N TYR 47.A O no hydrogen 2.745 N/A ARG 52.A N ILE 48.A O no hydrogen 2.987 N/A ARG 52.A NE ARG 52.A O no hydrogen 2.686 N/A ARG 52.A NH1 ILE 59.A O no hydrogen 2.681 N/A ARG 52.A NH2 LEU 55.A O no hydrogen 2.786 N/A ARG 52.A NH2 ASP 56.A O no hydrogen 3.027 N/A ARG 52.A NH2 ILE 59.A O no hydrogen 3.028 N/A GLN 53.A N ASP 49.A O no hydrogen 2.887 N/A LYS 54.A N PHE 50.A O no hydrogen 2.987 N/A LEU 55.A N ALA 51.A O no hydrogen 2.518 N/A ASP 56.A N ASN 29.A OD1 no hydrogen 2.865 N/A LYS 58.A N ASP 56.A OD2 no hydrogen 3.073 N/A LYS 58.A NZ ALA 31.A O no hydrogen 2.636 N/A ILE 59.A N ASP 56.A O no hydrogen 2.771 N/A ALA 60.A N VAL 39.A O no hydrogen 3.240 N/A ALA 62.A N CYS 41.A O no hydrogen 2.829 N/A ALA 63.A N TRP 90.A O no hydrogen 2.953 N/A GLN 64.A NE2 LYS 13.A O no hydrogen 2.739 N/A GLN 64.A NE2 ALA 42.A O no hydrogen 2.771 N/A ASN 65.A ND2 GLU 104.A OE2 no hydrogen 3.456 N/A CYS 66.A SG TYR 67.A O no hydrogen 3.420 N/A TYR 67.A N ILE 78.A O no hydrogen 2.842 N/A PHE 74.A N GLY 72.A O no hydrogen 2.708 N/A GLU 77.A N PHE 74.A O no hydrogen 2.888 N/A SER 79.A OG THR 70.A O no hydrogen 2.605 N/A MET 82.A N SER 79.A O no hydrogen 2.887 N/A ILE 83.A N SER 79.A O no hydrogen 3.152 N/A LYS 84.A N PRO 80.A O no hydrogen 2.812 N/A LYS 84.A NZ GLU 119.A O no hydrogen 2.724 N/A ASP 85.A N GLY 81.A O no hydrogen 2.675 N/A CYS 86.A N MET 82.A O no hydrogen 2.768 N/A CYS 86.A N ILE 83.A O no hydrogen 3.329 N/A CYS 86.A SG MET 82.A O no hydrogen 3.219 N/A GLY 87.A N LYS 84.A O no hydrogen 2.644 N/A ALA 88.A N ILE 83.A O no hydrogen 3.039 N/A THR 89.A N VAL 61.A O no hydrogen 3.171 N/A VAL 92.A N ALA 63.A O no hydrogen 2.857 N/A LEU 93.A N ILE 124.A O no hydrogen 2.709 N/A SER 96.A N GLU 165.A OE1 no hydrogen 3.268 N/A SER 96.A N GLU 165.A OE2 no hydrogen 3.216 N/A SER 96.A OG GLU 165.A OE2 no hydrogen 2.574 N/A GLU 97.A N HIS 95.A ND1 no hydrogen 3.206 N/A ARG 98.A NE GLU 104.A OE2 no hydrogen 3.414 N/A ARG 99.A N HIS 95.A O no hydrogen 2.980 N/A ARG 99.A NE GLY 94.A O no hydrogen 2.764 N/A ARG 99.A NH1 ASP 106.A OD1 no hydrogen 2.682 N/A ARG 99.A NH2 CYS 126.A O no hydrogen 2.964 N/A HIS 100.A N SER 96.A O no hydrogen 2.800 N/A PHE 102.A N GLU 97.A O no hydrogen 3.133 N/A GLY 103.A N HIS 100.A O no hydrogen 3.279 N/A GLU 104.A N ARG 98.A O no hydrogen 2.853 N/A LEU 108.A N SER 105.A OG no hydrogen 3.147 N/A ILE 109.A N SER 105.A O no hydrogen 2.762 N/A GLY 110.A N ASP 106.A O no hydrogen 2.479 N/A GLN 111.A N GLU 107.A O no hydrogen 2.996 N/A LYS 112.A N LEU 108.A O no hydrogen 2.994 N/A LYS 112.A NZ ASN 65.A OD1 no hydrogen 3.071 N/A LYS 112.A NZ GLU 104.A OE1 no hydrogen 2.361 N/A LYS 112.A NZ GLU 104.A OE2 no hydrogen 2.706 N/A VAL 113.A N ILE 109.A O no hydrogen 3.053 N/A ALA 114.A N GLY 110.A O no hydrogen 3.203 N/A HIS 115.A N GLN 111.A O no hydrogen 3.030 N/A ALA 116.A N LYS 112.A O no hydrogen 2.575 N/A LEU 117.A N VAL 113.A O no hydrogen 2.925 N/A ALA 118.A N ALA 114.A O no hydrogen 2.939 N/A GLU 119.A N HIS 115.A O no hydrogen 2.750 N/A GLY 120.A N LEU 117.A O no hydrogen 2.807 N/A LEU 121.A N ALA 116.A O no hydrogen 3.147 N/A GLY 122.A N THR 89.A O no hydrogen 2.865 N/A VAL 123.A N LYS 159.A O no hydrogen 2.731 N/A ILE 124.A N VAL 91.A O no hydrogen 2.772 N/A ALA 125.A N VAL 161.A O no hydrogen 3.053 N/A CYS 126.A N LEU 93.A O no hydrogen 2.694 N/A CYS 126.A SG ILE 124.A O no hydrogen 4.017 N/A ILE 127.A N ALA 163.A O no hydrogen 2.907 N/A GLY 128.A N GLN 146.A OE1 no hydrogen 2.821 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.560 N/A LYS 130.A N GLU 133.A OE1 no hydrogen 2.756 N/A ARG 134.A N LYS 130.A O no hydrogen 2.994 N/A ARG 134.A NH1 GLU 129.A OE2 no hydrogen 3.049 N/A GLU 135.A N LEU 131.A O no hydrogen 2.757 N/A ALA 136.A N ASP 132.A O no hydrogen 3.042 N/A GLY 137.A N ARG 134.A O no hydrogen 2.984 N/A ILE 138.A N GLU 133.A O no hydrogen 3.027 N/A THR 139.A OG1 GLU 129.A OE2 no hydrogen 2.602 N/A LYS 141.A NZ GLU 145.A OE2 no hydrogen 3.239 N/A VAL 142.A N ILE 138.A O no hydrogen 2.852 N/A VAL 143.A N THR 139.A O no hydrogen 2.923 N/A PHE 144.A N GLU 140.A O no hydrogen 2.819 N/A PHE 144.A N LYS 141.A O no hydrogen 3.255 N/A GLU 145.A N LYS 141.A O no hydrogen 3.080 N/A GLN 146.A N VAL 142.A O no hydrogen 3.219 N/A GLN 146.A NE2 GLY 128.A O no hydrogen 3.299 N/A THR 147.A N VAL 143.A O no hydrogen 3.108 N/A THR 147.A OG1 VAL 143.A O no hydrogen 2.810 N/A LYS 148.A N PHE 144.A O no hydrogen 2.757 N/A LYS 148.A NZ ASP 152.A OD1 no hydrogen 3.157 N/A LYS 148.A NZ ASP 152.A OD2 no hydrogen 2.640 N/A VAL 149.A N GLU 145.A O no hydrogen 3.186 N/A ILE 150.A N GLN 146.A O no hydrogen 3.144 N/A ALA 151.A N THR 147.A O no hydrogen 2.657 N/A ASP 152.A N LYS 148.A O no hydrogen 2.739 N/A ASN 153.A ND2 VAL 149.A O no hydrogen 2.835 N/A VAL 154.A N ALA 151.A O no hydrogen 2.999 N/A SER 158.A OG ASP 156.A OD1 no hydrogen 2.574 N/A VAL 160.A N TRP 157.A O no hydrogen 3.291 N/A VAL 161.A N VAL 123.A O no hydrogen 3.277 N/A LEU 162.A N ARG 205.A O no hydrogen 2.850 N/A ALA 163.A N ALA 125.A O no hydrogen 3.004 N/A TYR 164.A N ILE 207.A O no hydrogen 2.912 N/A TYR 164.A OH GLU 129.A OE1 no hydrogen 2.560 N/A TYR 164.A OH GLU 129.A OE2 no hydrogen 3.035 N/A GLU 165.A N ILE 127.A O no hydrogen 2.628 N/A VAL 167.A N GLU 165.A O no hydrogen 2.783 N/A TRP 168.A NE1 TYR 164.A OH no hydrogen 2.724 N/A ALA 169.A N PRO 166.A O no hydrogen 2.703 N/A ILE 170.A N VAL 167.A O no hydrogen 3.049 N/A THR 172.A OG1 TRP 168.A O no hydrogen 2.551 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.284 N/A THR 177.A N GLN 180.A OE1 no hydrogen 2.848 N/A GLN 179.A NE2 THR 177.A OG1 no hydrogen 3.324 N/A GLN 180.A N THR 177.A OG1 no hydrogen 3.128 N/A ALA 181.A N PRO 178.A O no hydrogen 3.188 N/A GLN 182.A N PRO 178.A O no hydrogen 2.988 N/A GLN 182.A NE2 GLU 186.A OE2 no hydrogen 3.284 N/A GLN 182.A NE2 ASP 225.A OD1 no hydrogen 2.500 N/A GLU 183.A N GLN 179.A O no hydrogen 2.906 N/A VAL 184.A N GLN 180.A O no hydrogen 3.464 N/A HIS 185.A N ALA 181.A O no hydrogen 3.048 N/A HIS 185.A ND1 ASP 225.A O no hydrogen 3.150 N/A GLU 186.A N GLN 182.A O no hydrogen 2.686 N/A LYS 187.A N GLU 183.A O no hydrogen 3.399 N/A LEU 188.A N VAL 184.A O no hydrogen 3.088 N/A ARG 189.A N HIS 185.A O no hydrogen 2.937 N/A ARG 189.A NE ASP 225.A OD2 no hydrogen 3.440 N/A ARG 189.A NH1 ALA 201.A O no hydrogen 2.763 N/A ARG 189.A NH1 THR 204.A O no hydrogen 2.707 N/A ARG 189.A NH2 ASP 225.A O no hydrogen 3.140 N/A ARG 189.A NH2 ASP 227.A OD2 no hydrogen 3.001 N/A GLY 190.A N GLU 186.A O no hydrogen 2.761 N/A TRP 191.A N LYS 187.A O no hydrogen 2.574 N/A LEU 192.A N LEU 188.A O no hydrogen 3.213 N/A LYS 193.A N ARG 189.A O no hydrogen 3.019 N/A SER 194.A N GLY 190.A O no hydrogen 3.166 N/A ASN 195.A N TRP 191.A O no hydrogen 2.722 N/A ASN 195.A ND2 TRP 191.A O no hydrogen 2.799 N/A VAL 196.A N LEU 192.A O no hydrogen 2.403 N/A VAL 200.A N SER 197.A OG no hydrogen 3.007 N/A ALA 201.A N SER 197.A O no hydrogen 3.086 N/A GLN 202.A N ASP 198.A O no hydrogen 3.009 N/A SER 203.A N ALA 199.A O no hydrogen 2.890 N/A SER 203.A N VAL 200.A O no hydrogen 3.147 N/A SER 203.A OG ALA 199.A O no hydrogen 3.270 N/A SER 203.A OG VAL 200.A O no hydrogen 3.184 N/A THR 204.A N VAL 200.A O no hydrogen 2.751 N/A THR 204.A OG1 VAL 200.A O no hydrogen 2.718 N/A ARG 205.A NE LYS 5.A O no hydrogen 3.069 N/A ILE 206.A N ASP 227.A OD2 no hydrogen 2.852 N/A ILE 207.A N LEU 162.A O no hydrogen 2.602 N/A TYR 208.A N GLY 228.A O no hydrogen 2.708 N/A GLY 209.A N TYR 164.A O no hydrogen 2.748 N/A ALA 215.A N THR 213.A OG1 no hydrogen 3.393 N/A THR 216.A N THR 213.A O no hydrogen 2.938 N/A CYS 217.A N THR 213.A O no hydrogen 2.807 N/A CYS 217.A SG GLY 214.A O no hydrogen 3.394 N/A CYS 217.A SG ASP 242.A O no hydrogen 3.720 N/A LYS 218.A NZ ASN 245.A O no hydrogen 2.697 N/A LYS 218.A NZ GLN 248.A OXT no hydrogen 2.795 N/A LEU 220.A N THR 216.A O no hydrogen 3.287 N/A ALA 221.A N CYS 217.A O no hydrogen 2.790 N/A SER 222.A N LYS 218.A O no hydrogen 3.020 N/A SER 222.A OG GLU 219.A O no hydrogen 2.701 N/A GLN 223.A N LEU 220.A O no hydrogen 2.970 N/A GLN 223.A NE2 GLU 219.A O no hydrogen 3.505 N/A ASP 225.A N GLN 182.A OE1 no hydrogen 2.763 N/A VAL 226.A N GLN 223.A O no hydrogen 3.374 N/A ASP 227.A N ILE 206.A O no hydrogen 3.363 N/A PHE 229.A N PHE 7.A O no hydrogen 2.798 N/A LEU 230.A N TYR 208.A O no hydrogen 2.836 N/A VAL 231.A N GLY 9.A O no hydrogen 2.875 N/A SER 235.A N GLY 232.A O no hydrogen 2.844 N/A SER 235.A OG GLY 232.A O no hydrogen 2.943 N/A LEU 236.A N GLY 233.A O no hydrogen 3.040 N/A LYS 237.A N ALA 234.A O no hydrogen 3.216 N/A PHE 240.A N LYS 237.A O no hydrogen 2.848 N/A VAL 241.A N PRO 238.A O no hydrogen 2.830 N/A ILE 243.A N GLU 239.A O no hydrogen 3.122 N/A ILE 244.A N PHE 240.A O no hydrogen 2.929 N/A ASN 245.A N ASP 242.A O no hydrogen 3.060 N/A ALA 246.A N ILE 243.A O no hydrogen 3.162 N/A LYS 247.A NZ ALA 221.A O no hydrogen 2.686 N/A LYS 247.A NZ VAL 226.A O no hydrogen 2.952 N/A GLN 248.A N ASN 245.A O no hydrogen 3.277 N/A