Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3my1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A SG CYS 8.A O no hydrogen 3.803 N/A CYS 8.A SG ILE 79.A O no hydrogen 3.740 N/A VAL 11.A N ARG 81.A O no hydrogen 2.828 N/A LYS 13.A N GLU 10.A O no hydrogen 3.103 N/A LYS 13.A NZ ASP 9.A OD2 no hydrogen 2.887 N/A LYS 13.A NZ GLU 78.A OE1 no hydrogen 3.229 N/A LYS 13.A NZ GLU 78.A OE2 no hydrogen 2.780 N/A TYR 14.A N VAL 11.A O no hydrogen 2.865 N/A TYR 14.A OH GLU 78.A OE2 no hydrogen 2.629 N/A GLU 15.A N ARG 32.A O no hydrogen 2.717 N/A LYS 16.A NZ TYR 88.A OH no hydrogen 3.529 N/A LEU 17.A N LYS 30.A O no hydrogen 2.827 N/A LYS 19.A NZ GLU 27.A OE2 no hydrogen 2.856 N/A ILE 20.A N VAL 28.A O no hydrogen 2.826 N/A PHE 29.A N LEU 42.A O no hydrogen 2.880 N/A LYS 30.A N ALA 18.A O no hydrogen 2.973 N/A ALA 31.A N VAL 40.A O no hydrogen 2.882 N/A ARG 32.A N GLU 15.A O no hydrogen 3.078 N/A HIS 33.A N GLN 38.A O no hydrogen 2.855 N/A ARG 34.A N LYS 13.A O no hydrogen 2.949 N/A ARG 34.A NE SER 12.A O no hydrogen 2.704 N/A LYS 35.A N HIS 33.A ND1 no hydrogen 2.812 N/A THR 36.A N HIS 33.A ND1 no hydrogen 3.307 N/A GLY 37.A N HIS 33.A O no hydrogen 3.032 N/A GLN 38.A N THR 36.A OG1 no hydrogen 3.194 N/A GLN 38.A NE2 ASP 92.A OD1 no hydrogen 3.516 N/A LYS 39.A NZ GLY 37.A O no hydrogen 3.329 N/A VAL 40.A N ALA 31.A O no hydrogen 2.764 N/A ALA 41.A N PHE 91.A O no hydrogen 2.914 N/A LEU 42.A N PHE 29.A O no hydrogen 2.852 N/A LYS 43.A N LEU 89.A O no hydrogen 2.862 N/A LYS 43.A NZ GLU 61.A OE2 no hydrogen 3.024 N/A LYS 44.A N GLU 27.A O no hydrogen 3.435 N/A VAL 45.A N ILE 87.A O no hydrogen 2.719 N/A GLU 50.A N ASN 49.A OD1 no hydrogen 2.691 N/A ALA 58.A N PRO 55.A O no hydrogen 2.998 N/A LEU 59.A N PRO 55.A O no hydrogen 3.170 N/A ARG 60.A N ILE 56.A O no hydrogen 3.006 N/A ARG 60.A NH2 GLY 157.A O no hydrogen 3.168 N/A GLU 61.A N THR 57.A O no hydrogen 3.117 N/A ILE 62.A N ALA 58.A O no hydrogen 2.868 N/A LYS 63.A N LEU 59.A O no hydrogen 2.860 N/A ILE 64.A N ARG 60.A O no hydrogen 2.956 N/A LEU 65.A N GLU 61.A O no hydrogen 2.886 N/A GLN 66.A N ILE 62.A O no hydrogen 3.262 N/A LEU 67.A N LYS 63.A O no hydrogen 3.170 N/A LEU 67.A N ILE 64.A O no hydrogen 3.069 N/A LEU 68.A N ILE 64.A O no hydrogen 2.939 N/A LYS 69.A N TYR 127.A OH no hydrogen 2.745 N/A LYS 69.A NZ ASN 75.A OD1 no hydrogen 3.093 N/A LYS 69.A NZ LEU 76.A O no hydrogen 2.962 N/A ASN 72.A N HIS 70.A ND1 no hydrogen 2.771 N/A ASN 72.A ND2 LEU 151.A O no hydrogen 3.060 N/A VAL 73.A N HIS 70.A O no hydrogen 2.999 N/A VAL 74.A N LEU 153.A O no hydrogen 2.903 N/A ASN 75.A ND2 ASP 92.A OD2 no hydrogen 3.008 N/A ILE 77.A N VAL 90.A O no hydrogen 2.789 N/A CYS 80.A N TYR 88.A O no hydrogen 2.736 N/A ARG 81.A N ASP 9.A O no hydrogen 3.123 N/A ARG 81.A NE CYS 8.A O no hydrogen 3.199 N/A ARG 81.A NH1 GLU 10.A OE2 no hydrogen 3.468 N/A THR 82.A OG1 SER 86.A O no hydrogen 3.189 N/A TYR 88.A N CYS 80.A O no hydrogen 2.786 N/A LEU 89.A N LYS 43.A O no hydrogen 2.872 N/A VAL 90.A N GLU 78.A O no hydrogen 2.942 N/A PHE 91.A N ALA 41.A O no hydrogen 2.801 N/A ASP 92.A N ASN 75.A O no hydrogen 3.145 N/A PHE 93.A N LYS 39.A O no hydrogen 3.464 N/A CYS 94.A SG ASP 92.A O no hydrogen 3.662 N/A HIS 96.A N ILE 145.A O no hydrogen 3.054 N/A LEU 98.A N VAL 143.A O no hydrogen 2.840 N/A ALA 99.A N ASP 97.A OD2 no hydrogen 3.269 N/A GLY 100.A N ASP 97.A OD2 no hydrogen 3.384 N/A LEU 101.A N ASP 97.A O no hydrogen 3.147 N/A LEU 102.A N LEU 98.A O no hydrogen 3.092 N/A SER 103.A N ALA 99.A O no hydrogen 3.137 N/A SER 103.A OG ALA 99.A O no hydrogen 3.032 N/A SER 103.A OG GLY 100.A O no hydrogen 3.137 N/A ASN 104.A N GLY 100.A O no hydrogen 3.191 N/A LEU 106.A N ASN 104.A OD1 no hydrogen 2.866 N/A VAL 107.A N ASN 104.A O no hydrogen 3.234 N/A THR 110.A N GLU 113.A OE1 no hydrogen 3.003 N/A THR 110.A OG1 SER 112.A OG no hydrogen 3.049 N/A SER 112.A OG THR 110.A OG1 no hydrogen 3.049 N/A SER 112.A OG SER 309.A OG no hydrogen 2.646 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.156 N/A ILE 114.A N THR 110.A O no hydrogen 3.146 N/A LYS 115.A N LEU 111.A O no hydrogen 2.981 N/A LYS 115.A NZ PHE 301.A O no hydrogen 2.922 N/A LYS 115.A NZ SER 304.A O no hydrogen 3.040 N/A LYS 115.A NZ PRO 306.A O no hydrogen 2.789 N/A ARG 116.A N SER 112.A O no hydrogen 3.021 N/A ARG 116.A NE ASP 310.A OD1 no hydrogen 3.506 N/A ARG 116.A NH1 GLN 119.A OE1 no hydrogen 3.067 N/A VAL 117.A N GLU 113.A O no hydrogen 2.838 N/A MET 118.A N ILE 114.A O no hydrogen 2.880 N/A GLN 119.A N LYS 115.A O no hydrogen 2.908 N/A MET 120.A N ARG 116.A O no hydrogen 2.841 N/A LEU 121.A N VAL 117.A O no hydrogen 2.926 N/A LEU 122.A N MET 118.A O no hydrogen 2.723 N/A ASN 123.A N GLN 119.A O no hydrogen 2.879 N/A ASN 123.A ND2 ASN 72.A OD1 no hydrogen 3.325 N/A GLY 124.A N MET 120.A O no hydrogen 2.942 N/A LEU 125.A N LEU 121.A O no hydrogen 3.053 N/A TYR 126.A N LEU 122.A O no hydrogen 2.915 N/A TYR 127.A N ASN 123.A O no hydrogen 3.079 N/A ILE 128.A N GLY 124.A O no hydrogen 3.039 N/A HIS 129.A N LEU 125.A O no hydrogen 3.027 N/A HIS 129.A NE2 ASP 198.A OD2 no hydrogen 2.995 N/A ARG 130.A N TYR 126.A O no hydrogen 3.024 N/A ASN 131.A N TYR 127.A O no hydrogen 3.155 N/A ASN 131.A ND2 TYR 127.A O no hydrogen 2.871 N/A LYS 132.A N HIS 129.A O no hydrogen 2.903 N/A ILE 133.A N ILE 128.A O no hydrogen 3.112 N/A LEU 134.A N ARG 160.A O no hydrogen 2.771 N/A HIS 135.A N ASP 198.A OD2 no hydrogen 2.849 N/A HIS 135.A NE2 ALA 154.A O no hydrogen 2.790 N/A ARG 136.A N ASP 198.A OD1 no hydrogen 3.032 N/A ARG 136.A NE LEU 158.A O no hydrogen 2.918 N/A ARG 136.A NH1 TYR 193.A OH no hydrogen 2.741 N/A ARG 136.A NH2 LEU 158.A O no hydrogen 2.994 N/A ASN 142.A N LYS 139.A O no hydrogen 2.632 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.836 N/A ASN 142.A ND2 ASP 137.A OD2 no hydrogen 3.269 N/A VAL 143.A N ALA 140.A O no hydrogen 3.028 N/A LEU 144.A N LYS 152.A O no hydrogen 2.889 N/A ILE 145.A N HIS 96.A O no hydrogen 2.746 N/A THR 146.A N VAL 150.A O no hydrogen 2.950 N/A THR 146.A OG1 VAL 150.A O no hydrogen 3.492 N/A GLY 149.A N THR 146.A O no hydrogen 2.946 N/A VAL 150.A N THR 146.A OG1 no hydrogen 3.055 N/A LYS 152.A N LEU 144.A O no hydrogen 2.919 N/A LYS 152.A NZ GLU 71.A O no hydrogen 2.699 N/A LEU 153.A N ASN 72.A O no hydrogen 2.805 N/A ALA 154.A N ASN 142.A O no hydrogen 2.852 N/A ALA 159.A N PHE 156.A O no hydrogen 3.026 N/A ARG 160.A N LEU 134.A O no hydrogen 3.104 N/A ARG 160.A NE ALA 161.A O no hydrogen 3.207 N/A PHE 162.A N LYS 132.A O no hydrogen 2.873 N/A SER 163.A N TYR 173.A OH no hydrogen 2.915 N/A LYS 166.A N LEU 164.A O no hydrogen 3.055 N/A ASN 171.A ND2 SER 163.A O no hydrogen 3.616 N/A ASN 171.A ND2 ASP 192.A OD1 no hydrogen 3.443 N/A TYR 173.A N ARG 191.A O no hydrogen 3.054 N/A ASN 174.A ND2 LEU 186.A O no hydrogen 2.719 N/A ASN 174.A ND2 GLU 190.A O no hydrogen 2.955 N/A VAL 176.A N ASN 174.A O no hydrogen 2.635 N/A TRP 180.A NE1 GLY 218.A O no hydrogen 3.182 N/A TYR 181.A OH GLU 208.A OE1 no hydrogen 2.812 N/A TYR 181.A OH GLU 208.A OE2 no hydrogen 2.712 N/A ARG 182.A N LEU 179.A O no hydrogen 3.025 N/A ARG 182.A NE VAL 177.A O no hydrogen 2.949 N/A ARG 182.A NH1 GLU 221.A OE2 no hydrogen 3.412 N/A ARG 182.A NH2 VAL 177.A O no hydrogen 2.948 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.851 N/A LEU 186.A N PRO 183.A O no hydrogen 3.240 N/A LEU 188.A N PRO 184.A O no hydrogen 2.978 N/A GLY 189.A N LEU 186.A O no hydrogen 2.851 N/A GLU 190.A N GLU 185.A O no hydrogen 2.824 N/A ASP 192.A N GLU 190.A OE2 no hydrogen 2.925 N/A ILE 197.A N GLY 194.A O no hydrogen 2.943 N/A ASP 198.A N PRO 195.A O no hydrogen 3.059 N/A TRP 200.A N PRO 196.A O no hydrogen 3.207 N/A ALA 202.A N ASP 198.A O no hydrogen 2.906 N/A GLY 203.A N LEU 199.A O no hydrogen 2.978 N/A GLY 203.A N TRP 200.A O no hydrogen 2.835 N/A CYS 204.A N TRP 200.A O no hydrogen 3.077 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.489 N/A ILE 205.A N GLY 201.A O no hydrogen 2.952 N/A MET 206.A N ALA 202.A O no hydrogen 2.927 N/A ALA 207.A N GLY 203.A O no hydrogen 3.150 N/A GLU 208.A N CYS 204.A O no hydrogen 3.184 N/A MET 209.A N MET 206.A O no hydrogen 3.019 N/A TRP 210.A N ALA 207.A O no hydrogen 2.831 N/A THR 211.A N ALA 207.A O no hydrogen 2.855 N/A THR 211.A OG1 ALA 207.A O no hydrogen 3.331 N/A THR 211.A OG1 SER 213.A O no hydrogen 2.704 N/A ARG 212.A NE LEU 102.A O no hydrogen 2.948 N/A ARG 212.A NH1 VAL 107.A O no hydrogen 3.023 N/A ARG 212.A NH2 VAL 107.A O no hydrogen 2.630 N/A SER 213.A N THR 211.A OG1 no hydrogen 3.358 N/A GLN 217.A NE2 PRO 214.A O no hydrogen 3.439 N/A ASN 219.A N HIS 223.A ND1 no hydrogen 3.006 N/A GLN 224.A N THR 220.A O no hydrogen 2.810 N/A GLN 224.A NE2 MET 216.A O no hydrogen 3.182 N/A LEU 225.A N GLU 221.A O no hydrogen 3.176 N/A ALA 226.A N GLN 222.A O no hydrogen 3.343 N/A LEU 227.A N HIS 223.A O no hydrogen 3.072 N/A ILE 228.A N GLN 224.A O no hydrogen 2.901 N/A SER 229.A N LEU 225.A O no hydrogen 3.269 N/A SER 229.A OG GLY 233.A O no hydrogen 2.651 N/A GLN 230.A N ALA 226.A O no hydrogen 2.733 N/A LEU 231.A N ILE 228.A O no hydrogen 2.846 N/A CYS 232.A N ILE 228.A O no hydrogen 2.917 N/A CYS 232.A SG ILE 228.A O no hydrogen 3.744 N/A CYS 232.A SG LEU 283.A O no hydrogen 3.497 N/A GLY 233.A N SER 229.A O no hydrogen 3.354 N/A SER 234.A N GLN 258.A O no hydrogen 2.926 N/A SER 234.A OG LYS 256.A O no hydrogen 3.431 N/A SER 234.A OG GLN 258.A O no hydrogen 3.417 N/A VAL 239.A N THR 236.A OG1 no hydrogen 3.226 N/A TRP 240.A N THR 236.A O no hydrogen 2.540 N/A VAL 243.A N TRP 240.A O no hydrogen 3.073 N/A TYR 246.A N VAL 243.A O no hydrogen 3.513 N/A TYR 249.A N TYR 246.A O no hydrogen 3.048 N/A ARG 260.A NE ASP 280.A OD1 no hydrogen 3.016 N/A ARG 260.A NH1 CYS 232.A O no hydrogen 3.108 N/A ARG 260.A NH2 ASP 280.A OD1 no hydrogen 2.877 N/A ARG 260.A NH2 LEU 283.A O no hydrogen 3.493 N/A LYS 261.A N LEU 231.A O no hydrogen 3.206 N/A LEU 266.A N LYS 263.A O no hydrogen 3.121 N/A LYS 267.A N LYS 263.A O no hydrogen 2.849 N/A LYS 267.A NZ ASP 264.A OD1 no hydrogen 2.761 N/A TYR 269.A N LEU 266.A O no hydrogen 2.857 N/A VAL 270.A N LEU 266.A O no hydrogen 3.069 N/A ALA 275.A N ASP 272.A OD2 no hydrogen 2.712 N/A LEU 276.A N ASP 272.A O no hydrogen 3.152 N/A ASP 277.A N PRO 273.A O no hydrogen 3.209 N/A LEU 278.A N TYR 274.A O no hydrogen 3.036 N/A ILE 279.A N ALA 275.A O no hydrogen 2.950 N/A ASP 280.A N LEU 276.A O no hydrogen 2.938 N/A LYS 281.A N ASP 277.A O no hydrogen 3.081 N/A LYS 281.A NZ ASP 277.A OD2 no hydrogen 3.244 N/A LEU 282.A N LEU 278.A O no hydrogen 3.028 N/A LEU 283.A N ILE 279.A O no hydrogen 3.064 N/A GLN 289.A N ASP 286.A O no hydrogen 2.696 N/A ARG 290.A N PRO 287.A O no hydrogen 2.816 N/A ILE 291.A N LYS 281.A O no hydrogen 3.017 N/A ASP 295.A N ASP 292.A OD1 no hydrogen 2.866 N/A ALA 296.A N ASP 292.A O no hydrogen 2.657 N/A LEU 297.A N SER 293.A O no hydrogen 2.986 N/A LEU 297.A N ASP 294.A O no hydrogen 2.943 N/A ASN 298.A N ASP 294.A O no hydrogen 3.262 N/A ASN 298.A N ASP 295.A O no hydrogen 3.123 N/A HIS 299.A N ALA 296.A O no hydrogen 3.309 N/A HIS 299.A NE2 ASP 277.A OD2 no hydrogen 2.788 N/A PHE 301.A N HIS 299.A ND1 no hydrogen 2.965 N/A PHE 302.A N HIS 299.A O no hydrogen 2.954 N/A TRP 303.A N ASP 300.A O no hydrogen 2.779 N/A TRP 303.A NE1 LEU 297.A O no hydrogen 3.151 N/A SER 304.A OG ASP 300.A O no hydrogen 2.781 N/A SER 309.A N SER 112.A O no hydrogen 3.349 N/A SER 309.A OG SER 112.A OG no hydrogen 2.646 N/A SER 309.A OG ASP 310.A O no hydrogen 3.288 N/A