Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1iru_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N SER 1.A O no hydrogen 3.286 N/A ARG 7.A N ASP 5.A OD1 no hydrogen 2.684 N/A THR 8.A OG1 LYS 126.A O no hydrogen 2.506 N/A SER 12.A N ARG 16.A O no hydrogen 3.033 N/A ARG 16.A NH1 GLU 21.A OE1 no hydrogen 2.865 N/A VAL 20.A N LEU 17.A O no hydrogen 3.041 N/A GLU 21.A N LEU 17.A O no hydrogen 3.313 N/A TYR 22.A N TYR 18.A O no hydrogen 3.041 N/A ALA 23.A N GLN 19.A O no hydrogen 3.346 N/A MET 24.A N VAL 20.A O no hydrogen 3.050 N/A GLU 25.A N GLU 21.A O no hydrogen 3.179 N/A ALA 26.A N TYR 22.A O no hydrogen 3.287 N/A ILE 27.A N ALA 23.A O no hydrogen 3.016 N/A GLY 28.A N MET 24.A O no hydrogen 2.830 N/A HIS 29.A ND1 GLY 28.A O no hydrogen 2.743 N/A ALA 30.A N ILE 27.A O no hydrogen 2.931 N/A THR 32.A N GLU 47.A OE1 no hydrogen 3.106 N/A THR 32.A OG1 GLU 47.A OE1 no hydrogen 3.001 N/A THR 32.A OG1 ASN 165.A O no hydrogen 2.917 N/A CYS 33.A N ILE 163.A O no hydrogen 2.638 N/A CYS 33.A SG ALA 45.A O no hydrogen 4.043 N/A CYS 33.A SG SER 74.A OG no hydrogen 3.163 N/A LEU 34.A N ALA 45.A O no hydrogen 2.860 N/A GLY 35.A N THR 161.A O no hydrogen 3.017 N/A LEU 37.A N LYS 159.A O no hydrogen 2.628 N/A ALA 38.A N GLY 41.A O no hydrogen 2.886 N/A ASN 39.A ND2 MET 183.A O no hydrogen 2.677 N/A VAL 42.A N LEU 215.A O no hydrogen 3.072 N/A LEU 43.A N ILE 36.A O no hydrogen 3.209 N/A LEU 44.A N ALA 213.A O no hydrogen 2.905 N/A ALA 45.A N LEU 34.A O no hydrogen 2.825 N/A ALA 46.A N GLU 211.A O no hydrogen 3.070 N/A GLU 47.A N THR 32.A O no hydrogen 2.589 N/A ARG 49.A N GLU 62.A OE2 no hydrogen 3.233 N/A ASN 50.A N GLU 62.A OE1 no hydrogen 3.018 N/A ASN 50.A N GLU 62.A OE2 no hydrogen 3.302 N/A GLU 62.A N SER 61.A OG no hydrogen 2.470 N/A LYS 63.A N SER 61.A OG no hydrogen 3.118 N/A ILE 64.A N SER 61.A OG no hydrogen 2.868 N/A TYR 65.A N CYS 73.A O no hydrogen 2.642 N/A TYR 65.A OH ASN 83.A OD1 no hydrogen 3.189 N/A LEU 67.A N MET 71.A O no hydrogen 3.011 N/A ALA 72.A N ILE 136.A O no hydrogen 3.176 N/A CYS 73.A N TYR 65.A O no hydrogen 2.681 N/A SER 74.A N LEU 134.A O no hydrogen 2.911 N/A SER 74.A OG LYS 63.A O no hydrogen 2.466 N/A ALA 76.A N SER 132.A O no hydrogen 3.025 N/A ILE 78.A N GLY 130.A O no hydrogen 2.850 N/A ALA 82.A N ILE 78.A O no hydrogen 2.870 N/A ASN 83.A N THR 79.A O no hydrogen 2.752 N/A VAL 84.A N SER 80.A O no hydrogen 3.197 N/A LEU 85.A N ASP 81.A O no hydrogen 3.196 N/A THR 86.A N ALA 82.A O no hydrogen 2.921 N/A THR 86.A OG1 ALA 82.A O no hydrogen 3.020 N/A THR 86.A OG1 ASN 83.A O no hydrogen 2.987 N/A ASN 87.A N ASN 83.A O no hydrogen 3.208 N/A GLU 88.A N VAL 84.A O no hydrogen 3.110 N/A LEU 89.A N LEU 85.A O no hydrogen 3.086 N/A ARG 90.A N THR 86.A O no hydrogen 2.782 N/A ARG 90.A NE LYS 66.A O no hydrogen 2.956 N/A ARG 90.A NH2 LYS 66.A O no hydrogen 3.380 N/A LEU 91.A N ASN 87.A O no hydrogen 3.086 N/A ILE 92.A N GLU 88.A O no hydrogen 2.999 N/A ALA 93.A N LEU 89.A O no hydrogen 3.103 N/A GLN 94.A N ARG 90.A O no hydrogen 3.097 N/A ARG 95.A N LEU 91.A O no hydrogen 2.936 N/A ARG 95.A NH1 GLU 88.A OE1 no hydrogen 3.281 N/A ARG 95.A NH2 GLU 88.A OE1 no hydrogen 3.233 N/A TYR 96.A N ILE 92.A O no hydrogen 3.313 N/A LEU 97.A N ALA 93.A O no hydrogen 2.957 N/A LEU 98.A N GLN 94.A O no hydrogen 2.723 N/A GLN 99.A N ARG 95.A O no hydrogen 3.047 N/A TYR 100.A N TYR 96.A O no hydrogen 2.823 N/A GLN 101.A N LEU 97.A O no hydrogen 2.648 N/A GLN 101.A NE2 LEU 98.A O no hydrogen 3.062 N/A CYS 106.A N ASP 139.A OD2 no hydrogen 2.901 N/A LEU 109.A N PRO 105.A O no hydrogen 3.256 N/A LEU 109.A N CYS 106.A O no hydrogen 3.027 N/A VAL 110.A N GLU 107.A O no hydrogen 2.842 N/A THR 111.A N GLU 107.A O no hydrogen 2.898 N/A THR 111.A OG1 GLU 107.A O no hydrogen 3.459 N/A THR 111.A OG1 GLN 108.A O no hydrogen 2.979 N/A ALA 112.A N GLN 108.A O no hydrogen 3.109 N/A LEU 113.A N LEU 109.A O no hydrogen 3.451 N/A CYS 114.A N VAL 110.A O no hydrogen 2.929 N/A CYS 114.A SG VAL 110.A O no hydrogen 3.388 N/A ASP 115.A N THR 111.A O no hydrogen 3.024 N/A ASP 115.A N ALA 112.A O no hydrogen 3.087 N/A LYS 117.A N LEU 113.A O no hydrogen 3.380 N/A LYS 117.A NZ SER 149.A OG no hydrogen 3.235 N/A LYS 117.A NZ ASP 150.A O no hydrogen 3.298 N/A GLN 118.A N CYS 114.A O no hydrogen 2.829 N/A ALA 119.A N ASP 115.A O no hydrogen 3.165 N/A TYR 120.A N ILE 116.A O no hydrogen 3.237 N/A THR 121.A N GLN 118.A O no hydrogen 3.096 N/A THR 121.A OG1 GLN 118.A O no hydrogen 2.646 N/A GLN 122.A N ALA 119.A O no hydrogen 2.814 N/A PHE 123.A N ALA 119.A O no hydrogen 3.038 N/A LYS 126.A NZ GLY 124.A O no hydrogen 3.047 N/A ARG 127.A NH1 ASP 81.A OD2 no hydrogen 3.137 N/A ARG 127.A NH1 PRO 128.A O no hydrogen 2.775 N/A ARG 127.A NH2 ASP 81.A OD1 no hydrogen 2.736 N/A GLY 130.A N ASP 81.A OD2 no hydrogen 2.707 N/A SER 132.A N ALA 76.A O no hydrogen 3.193 N/A SER 132.A OG SER 149.A O no hydrogen 3.110 N/A SER 132.A OG ASP 150.A OD1 no hydrogen 3.372 N/A LEU 133.A N SER 149.A O no hydrogen 2.984 N/A LEU 134.A N SER 74.A O no hydrogen 2.909 N/A TYR 135.A N TYR 147.A O no hydrogen 2.625 N/A TYR 135.A OH SER 149.A OG no hydrogen 2.847 N/A ILE 136.A N ALA 72.A O no hydrogen 3.131 N/A GLY 137.A N GLN 145.A O no hydrogen 3.104 N/A TRP 138.A N ASP 70.A O no hydrogen 2.985 N/A ASP 139.A N GLY 143.A O no hydrogen 2.998 N/A LYS 140.A NZ GLU 102.A OE2 no hydrogen 3.005 N/A HIS 141.A N ASP 139.A O no hydrogen 2.313 N/A HIS 141.A N ASP 139.A OD1 no hydrogen 2.636 N/A TYR 142.A N ASP 139.A O no hydrogen 2.944 N/A TYR 142.A N ASP 139.A OD1 no hydrogen 3.089 N/A GLN 145.A N GLY 137.A O no hydrogen 3.000 N/A GLN 145.A NE2 ASP 139.A OD2 no hydrogen 2.709 N/A GLN 145.A NE2 GLY 143.A O no hydrogen 3.191 N/A TYR 147.A N TYR 135.A O no hydrogen 2.537 N/A TYR 147.A OH GLN 145.A OE1 no hydrogen 2.611 N/A GLN 148.A N GLY 156.A O no hydrogen 2.910 N/A SER 149.A N LEU 133.A O no hydrogen 2.832 N/A SER 149.A OG TYR 135.A OH no hydrogen 2.847 N/A ASP 150.A N ASN 154.A O no hydrogen 2.742 N/A GLY 153.A N ASP 150.A O no hydrogen 2.892 N/A TYR 155.A OH GLU 107.A OE2 no hydrogen 2.986 N/A GLY 156.A N GLN 148.A O no hydrogen 3.132 N/A TRP 158.A N LEU 146.A O no hydrogen 2.837 N/A THR 161.A N GLY 35.A O no hydrogen 3.065 N/A THR 161.A OG1 GLN 148.A OE1 no hydrogen 3.155 N/A THR 161.A OG1 CYS 162.A O no hydrogen 3.408 N/A CYS 162.A SG CYS 33.A O no hydrogen 3.397 N/A CYS 162.A SG ILE 163.A O no hydrogen 3.734 N/A ILE 163.A N CYS 33.A O no hydrogen 2.569 N/A ASN 165.A N ALA 30.A O no hydrogen 3.136 N/A SER 167.A N GLY 164.A O no hydrogen 3.170 N/A SER 167.A OG CYS 162.A O no hydrogen 2.696 N/A ALA 169.A N ASN 166.A O no hydrogen 2.992 N/A ALA 170.A N ASN 166.A O no hydrogen 3.236 N/A SER 172.A N ALA 168.A O no hydrogen 3.358 N/A SER 172.A OG ALA 168.A O no hydrogen 3.149 N/A SER 172.A OG ALA 169.A O no hydrogen 3.341 N/A MET 173.A N ALA 169.A O no hydrogen 3.422 N/A LEU 174.A N ALA 170.A O no hydrogen 3.219 N/A LYS 175.A N VAL 171.A O no hydrogen 2.606 N/A GLN 176.A N MET 173.A O no hydrogen 3.162 N/A ASP 177.A N MET 173.A O no hydrogen 2.988 N/A GLU 180.A N TYR 178.A O no hydrogen 2.928 N/A GLU 182.A N LYS 179.A O no hydrogen 2.963 N/A THR 184.A N SER 187.A OG no hydrogen 2.514 N/A THR 184.A OG1 SER 187.A OG no hydrogen 2.976 N/A LEU 185.A N ASP 40.A OD1 no hydrogen 2.981 N/A LEU 185.A N ASP 40.A OD2 no hydrogen 3.269 N/A SER 187.A N THR 184.A OG1 no hydrogen 2.647 N/A SER 187.A OG THR 184.A O no hydrogen 2.920 N/A SER 187.A OG THR 184.A OG1 no hydrogen 2.976 N/A ALA 188.A N THR 184.A O no hydrogen 2.724 N/A LEU 189.A N LEU 185.A O no hydrogen 3.084 N/A ALA 190.A N LYS 186.A O no hydrogen 3.085 N/A ALA 192.A N ALA 188.A O no hydrogen 3.129 N/A ILE 193.A N LEU 189.A O no hydrogen 3.369 N/A LYS 194.A N ALA 190.A O no hydrogen 3.211 N/A LYS 194.A NZ ASP 177.A OD1 no hydrogen 2.463 N/A VAL 195.A N LEU 191.A O no hydrogen 2.613 N/A LEU 196.A N ALA 192.A O no hydrogen 2.928 N/A ASN 197.A N ILE 193.A O no hydrogen 2.995 N/A THR 199.A N VAL 195.A O no hydrogen 3.012 N/A THR 199.A OG1 VAL 195.A O no hydrogen 3.121 N/A THR 199.A OG1 THR 199.A O no hydrogen 2.587 N/A VAL 202.A N MET 200.A O no hydrogen 2.343 N/A GLU 211.A N ALA 46.A O no hydrogen 3.020 N/A ALA 213.A N LEU 44.A O no hydrogen 3.035 N/A THR 214.A N ARG 225.A O no hydrogen 2.835 N/A LEU 215.A N VAL 42.A O no hydrogen 2.838 N/A THR 216.A N VAL 223.A O no hydrogen 2.871 N/A ARG 217.A NH2 THR 222.A OG1 no hydrogen 2.441 N/A THR 222.A OG1 ASP 70.A OD1 no hydrogen 3.145 N/A VAL 223.A N THR 216.A O no hydrogen 2.685 N/A ARG 225.A N THR 214.A O no hydrogen 3.143 N/A LEU 227.A N ILE 212.A O no hydrogen 3.151 N/A VAL 232.A N LYS 228.A O no hydrogen 3.015 N/A VAL 232.A N GLN 229.A O no hydrogen 3.051 N/A GLU 233.A N GLN 229.A O no hydrogen 3.353 N/A GLN 234.A N LYS 230.A O no hydrogen 3.232 N/A LEU 235.A N VAL 232.A O no hydrogen 2.822 N/A ILE 236.A N VAL 232.A O no hydrogen 3.259 N/A LYS 237.A N GLU 233.A O no hydrogen 2.746 N/A LYS 238.A N GLN 234.A O no hydrogen 2.969 N/A HIS 239.A N LEU 235.A O no hydrogen 3.224 N/A HIS 239.A N ILE 236.A O no hydrogen 3.231 N/A GLU 240.A N ILE 236.A O no hydrogen 3.491 N/A GLU 241.A N LYS 237.A O no hydrogen 2.535 N/A GLU 242.A N GLU 240.A O no hydrogen 2.450 N/A GLU 243.A N GLU 240.A O no hydrogen 2.580 N/A ALA 244.A N GLU 240.A O no hydrogen 3.334 N/A ALA 246.A N GLU 243.A O no hydrogen 2.742 N/A