Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nh9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N HIS 1.A O no hydrogen 3.417 N/A GLU 7.A N ASP 5.A OD1 no hydrogen 2.973 N/A MET 9.A N ASP 5.A O no hydrogen 3.043 N/A PHE 10.A N MET 6.A O no hydrogen 2.998 N/A ASP 11.A N GLU 7.A O no hydrogen 2.956 N/A LEU 12.A N ASN 8.A O no hydrogen 2.943 N/A LEU 13.A N MET 9.A O no hydrogen 2.952 N/A LYS 14.A N PHE 10.A O no hydrogen 2.865 N/A LYS 14.A NZ GLU 18.A OE1 no hydrogen 3.402 N/A GLU 15.A N ASP 11.A O no hydrogen 2.981 N/A GLU 16.A N LEU 13.A O no hydrogen 3.090 N/A THR 17.A N LYS 14.A O no hydrogen 3.150 N/A ALA 25.A N LEU 22.A O no hydrogen 3.189 N/A LEU 28.A N SER 106.A OG no hydrogen 2.824 N/A ARG 29.A N GLN 97.A OE1 no hydrogen 2.704 N/A GLN 31.A N ASP 95.A OD2 no hydrogen 2.691 N/A LYS 32.A N ASP 95.A OD2 no hydrogen 2.993 N/A GLY 33.A N ASP 95.A OD2 no hydrogen 2.915 N/A ARG 34.A N ASP 95.A OD1 no hydrogen 2.695 N/A ARG 34.A NE GLU 36.A OE2 no hydrogen 2.941 N/A ARG 34.A NH2 GLU 36.A OE2 no hydrogen 2.633 N/A ILE 35.A N VAL 58.A O no hydrogen 2.976 N/A GLU 36.A N ARG 93.A O no hydrogen 2.876 N/A PHE 37.A N PHE 56.A O no hydrogen 2.912 N/A GLU 38.A N CYS 91.A O no hydrogen 2.741 N/A ASN 39.A N SER 55.A OG no hydrogen 2.949 N/A ASN 39.A ND2 ASP 53.A OD1 no hydrogen 2.679 N/A VAL 40.A N VAL 54.A O no hydrogen 2.940 N/A HIS 41.A N SER 89.A O no hydrogen 3.024 N/A HIS 41.A ND1 GLU 49.A OE2 no hydrogen 2.744 N/A PHE 42.A N LEU 51.A O no hydrogen 3.045 N/A SER 43.A OG ARG 48.A O no hydrogen 2.831 N/A TYR 44.A OH THR 76.A OG1 no hydrogen 2.599 N/A THR 50.A N PHE 42.A O no hydrogen 2.879 N/A LEU 51.A N PHE 42.A O no hydrogen 2.974 N/A GLN 52.A N GLY 245.A O no hydrogen 2.735 N/A VAL 54.A N VAL 40.A O no hydrogen 2.874 N/A PHE 56.A N PHE 37.A O no hydrogen 2.972 N/A VAL 58.A N ILE 35.A O no hydrogen 2.797 N/A MET 59.A N GLN 62.A OE1 no hydrogen 2.989 N/A GLY 61.A N THR 222.A OG1 no hydrogen 3.002 N/A GLN 62.A N MET 59.A O no hydrogen 3.089 N/A THR 63.A N ASP 237.A OD2 no hydrogen 2.656 N/A THR 63.A OG1.A ASP 237.A OD2 no hydrogen 3.199 N/A LEU 64.A N THR 223.A O no hydrogen 2.674 N/A ALA 65.A N GLN 238.A O no hydrogen 2.966 N/A LEU 66.A N VAL 225.A O no hydrogen 2.817 N/A VAL 67.A N LEU 240.A O no hydrogen 2.893 N/A LYS 74.A NZ PRO 69.A O no hydrogen 2.763 N/A SER 75.A OG ASP 196.A OD2 no hydrogen 3.379 N/A THR 76.A OG1 TYR 44.A OH no hydrogen 2.599 N/A ILE 77.A N GLY 73.A O no hydrogen 3.036 N/A ILE 77.A N LYS 74.A O no hydrogen 3.040 N/A ARG 79.A N SER 75.A O no hydrogen 2.989 N/A ARG 79.A NE TYR 44.A OH no hydrogen 2.945 N/A ARG 79.A NH2 TYR 44.A OH no hydrogen 3.004 N/A LEU 80.A N THR 76.A O no hydrogen 2.835 N/A LEU 81.A N ILE 77.A O no hydrogen 3.059 N/A PHE 82.A N LEU 78.A O no hydrogen 3.118 N/A ARG 83.A N LEU 80.A O no hydrogen 2.782 N/A ARG 83.A NE ASP 86.A OD1 no hydrogen 2.869 N/A ARG 83.A NH1 LYS 20.A O no hydrogen 3.164 N/A ARG 83.A NH2 LYS 20.A O no hydrogen 2.755 N/A ARG 83.A NH2 ASP 86.A OD1 no hydrogen 2.982 N/A ARG 83.A NH2 ASP 86.A OD2 no hydrogen 3.304 N/A PHE 84.A N ARG 79.A O no hydrogen 2.737 N/A SER 88.A N HIS 41.A O no hydrogen 2.938 N/A SER 88.A OG HIS 41.A O no hydrogen 3.327 N/A CYS 91.A N GLU 38.A O no hydrogen 2.793 N/A ARG 93.A N GLU 36.A O no hydrogen 2.785 N/A ARG 93.A NE GLU 38.A OE1 no hydrogen 2.940 N/A ARG 93.A NH1 GLY 96.A O no hydrogen 3.066 N/A ILE 94.A N GLN 97.A O no hydrogen 2.937 N/A ASP 95.A N ARG 34.A O no hydrogen 2.704 N/A GLN 97.A N ILE 94.A O no hydrogen 2.939 N/A GLN 97.A NE2 ARG 29.A O no hydrogen 2.679 N/A GLN 97.A NE2 ASP 95.A O no hydrogen 3.401 N/A ILE 99.A N ILE 92.A O no hydrogen 2.783 N/A SER 100.A N ASP 98.A OD1 no hydrogen 2.843 N/A SER 100.A OG ASP 98.A OD1 no hydrogen 2.634 N/A SER 100.A OG ASP 98.A OD2 no hydrogen 3.059 N/A GLN 101.A N ASP 98.A O no hydrogen 3.084 N/A GLN 101.A NE2 SER 100.A OG no hydrogen 3.317 N/A THR 103.A N GLY 26.A O no hydrogen 2.873 N/A THR 103.A OG1 SER 106.A OG no hydrogen 2.886 N/A GLN 104.A N ASP 21.A OD1 no hydrogen 2.707 N/A GLN 104.A NE2 VAL 19.A O no hydrogen 3.062 N/A GLN 104.A NE2 ASP 21.A OD1 no hydrogen 3.083 N/A SER 106.A N THR 103.A OG1 no hydrogen 3.061 N/A SER 106.A OG THR 103.A O no hydrogen 2.932 N/A SER 106.A OG THR 103.A OG1 no hydrogen 2.886 N/A LEU 107.A N THR 103.A O no hydrogen 2.958 N/A ARG 108.A N GLN 104.A O no hydrogen 3.084 N/A ARG 108.A NE PHE 82.A O no hydrogen 3.062 N/A ARG 108.A NH1 GLN 104.A OE1 no hydrogen 3.209 N/A ARG 108.A NH2 PHE 82.A O no hydrogen 3.356 N/A ARG 108.A NH2 ARG 83.A O no hydrogen 2.983 N/A ARG 108.A NH2 GLN 104.A OE1 no hydrogen 3.222 N/A SER 109.A N ALA 105.A O no hydrogen 3.081 N/A SER 109.A OG SER 106.A O no hydrogen 2.702 N/A HIS 110.A N LEU 107.A O no hydrogen 3.008 N/A ILE 111.A N ARG 108.A O no hydrogen 3.132 N/A GLY 112.A N ILE 192.A O no hydrogen 2.761 N/A VAL 114.A N LEU 194.A O no hydrogen 2.858 N/A GLN 116.A NE2 GLU 197.A O no hydrogen 3.023 N/A THR 118.A OG1 LYS 177.A O no hydrogen 3.468 N/A PHE 121.A N ASN 128.A OD1 no hydrogen 2.694 N/A THR 124.A N ASP 123.A OD2 no hydrogen 2.663 N/A ILE 125.A N THR 163.A O no hydrogen 2.901 N/A ALA 126.A N TYR 161.A O no hydrogen 3.113 N/A ASP 127.A N THR 124.A OG1 no hydrogen 2.996 N/A ASN 128.A N THR 124.A O no hydrogen 2.875 N/A ASN 128.A ND2 PHE 121.A O no hydrogen 2.656 N/A ASN 128.A ND2 ASP 123.A O no hydrogen 3.509 N/A ASN 128.A ND2 THR 124.A O no hydrogen 3.242 N/A ILE 129.A N ILE 125.A O no hydrogen 3.047 N/A ILE 129.A N ALA 126.A O no hydrogen 3.159 N/A ARG 130.A N ALA 126.A O no hydrogen 2.918 N/A ARG 130.A NE ASP 127.A OD2 no hydrogen 2.947 N/A ARG 130.A NH1 ALA 136.A O no hydrogen 2.875 N/A ARG 130.A NH1 ASN 138.A OD1 no hydrogen 3.171 N/A ARG 130.A NH2 ASP 127.A OD2 no hydrogen 3.122 N/A ARG 130.A NH2 ASN 138.A OD1 no hydrogen 2.637 N/A TYR 131.A N ASP 127.A O no hydrogen 3.080 N/A GLY 132.A N ILE 129.A O no hydrogen 3.020 N/A ARG 133.A N ARG 130.A O no hydrogen 2.847 N/A ARG 133.A NE LEU 187.A O no hydrogen 2.776 N/A ARG 133.A NH1 GLU 140.A OE2 no hydrogen 2.756 N/A ARG 133.A NH2 GLU 140.A OE2 no hydrogen 3.040 N/A ARG 133.A NH2 LEU 187.A O no hydrogen 2.741 N/A ALA 136.A N ARG 133.A O no hydrogen 2.766 N/A GLY 137.A N GLU 140.A OE1 no hydrogen 2.909 N/A GLU 140.A N GLY 137.A O no hydrogen 2.949 N/A VAL 141.A N GLY 137.A O no hydrogen 3.017 N/A GLU 142.A N ASN 138.A O no hydrogen 2.897 N/A ALA 143.A N ASP 139.A O no hydrogen 3.031 N/A ALA 144.A N GLU 140.A O no hydrogen 2.739 N/A ALA 145.A N VAL 141.A O no hydrogen 2.805 N/A GLN 146.A N GLU 142.A O no hydrogen 2.883 N/A ALA 147.A N ALA 143.A O no hydrogen 2.962 N/A ALA 148.A N ALA 144.A O no hydrogen 2.741 N/A GLY 149.A N GLN 146.A O no hydrogen 2.909 N/A ILE 150.A N ALA 145.A O no hydrogen 2.820 N/A HIS 151.A ND1 TYR 161.A OH no hydrogen 2.642 N/A ILE 154.A N ILE 150.A O no hydrogen 2.876 N/A MET 155.A N HIS 151.A O no hydrogen 2.856 N/A ALA 156.A N ASP 152.A O no hydrogen 3.246 N/A ALA 156.A N ALA 153.A O no hydrogen 3.222 N/A PHE 157.A N ILE 154.A O no hydrogen 2.945 N/A GLU 159.A N THR 163.A OG1 no hydrogen 2.858 N/A GLY 160.A N PHE 157.A O no hydrogen 2.986 N/A TYR 161.A OH HIS 151.A ND1 no hydrogen 2.642 N/A ARG 162.A N GLU 159.A O no hydrogen 2.960 N/A THR 163.A N GLY 160.A O no hydrogen 3.012 N/A THR 163.A OG1 GLY 160.A O no hydrogen 2.669 N/A VAL 165.A N ASP 123.A O no hydrogen 2.910 N/A ARG 168.A NH1 ASN 122.A OD1 no hydrogen 3.336 N/A GLY 169.A N GLY 166.A O no hydrogen 2.933 N/A LEU 170.A N GLN 164.A O no hydrogen 2.752 N/A SER 173.A N GLU 176.A OE1 no hydrogen 3.035 N/A GLU 176.A N SER 173.A OG no hydrogen 3.196 N/A LYS 177.A N SER 173.A O no hydrogen 2.851 N/A GLN 178.A N GLY 174.A O no hydrogen 3.210 N/A ARG 179.A N GLY 175.A O no hydrogen 2.906 N/A ARG 179.A NH1 ALA 148.A O no hydrogen 2.928 N/A ARG 179.A NH1 SER 213.A OG no hydrogen 3.016 N/A VAL 180.A N GLU 176.A O no hydrogen 2.928 N/A ALA 181.A N LYS 177.A O no hydrogen 3.438 N/A ILE 182.A N GLN 178.A O no hydrogen 3.204 N/A ALA 183.A N ARG 179.A O no hydrogen 2.624 N/A ARG 184.A N VAL 180.A O no hydrogen 2.843 N/A ARG 184.A NE ASN 128.A O no hydrogen 2.784 N/A ARG 184.A NH1 VAL 119.A O no hydrogen 2.921 N/A ARG 184.A NH2 VAL 119.A O no hydrogen 2.719 N/A ARG 184.A NH2 ASN 128.A O no hydrogen 3.271 N/A THR 185.A N ALA 181.A O no hydrogen 3.237 N/A THR 185.A OG1 ALA 181.A O no hydrogen 2.912 N/A ILE 186.A N ILE 182.A O no hydrogen 2.833 N/A LEU 187.A N ALA 183.A O no hydrogen 2.856 N/A LYS 188.A N ARG 184.A O no hydrogen 3.053 N/A LYS 188.A NZ ARG 108.A O no hydrogen 2.880 N/A LYS 188.A NZ ILE 111.A O no hydrogen 2.816 N/A ALA 189.A N THR 185.A O no hydrogen 3.062 N/A ALA 189.A N ILE 186.A O no hydrogen 2.865 N/A ILE 192.A N HIS 110.A O no hydrogen 2.940 N/A ILE 193.A N THR 222.A O no hydrogen 2.866 N/A LEU 194.A N GLY 112.A O no hydrogen 2.781 N/A LEU 195.A N ILE 224.A O no hydrogen 3.006 N/A ASP 196.A N VAL 114.A O no hydrogen 2.989 N/A GLU 197.A N VAL 226.A O no hydrogen 3.059 N/A LEU 202.A N GLU 207.A OE1 no hydrogen 2.906 N/A ASN 206.A N ASP 203.A OD2 no hydrogen 2.608 N/A ASN 206.A ND2 ASP 203.A OD1 no hydrogen 3.074 N/A ASN 206.A ND2 ASP 203.A OD2 no hydrogen 2.962 N/A GLU 207.A N ASP 203.A O no hydrogen 2.778 N/A ARG 208.A N THR 204.A O no hydrogen 2.834 N/A ALA 209.A N SER 205.A O no hydrogen 2.846 N/A ILE 210.A N ASN 206.A O no hydrogen 2.846 N/A GLN 211.A N GLU 207.A O no hydrogen 2.946 N/A ALA 212.A N ARG 208.A O no hydrogen 2.852 N/A SER 213.A N ALA 209.A O no hydrogen 3.063 N/A SER 213.A OG ALA 209.A O no hydrogen 3.494 N/A LEU 214.A N ILE 210.A O no hydrogen 2.954 N/A ALA 215.A N GLN 211.A O no hydrogen 3.160 N/A LYS 216.A N ALA 212.A O no hydrogen 3.225 N/A LYS 216.A NZ ALA 212.A O no hydrogen 3.468 N/A VAL 217.A N SER 213.A O no hydrogen 2.906 N/A CYS 218.A N LEU 214.A O no hydrogen 2.850 N/A CYS 218.A SG LEU 214.A O no hydrogen 3.116 N/A ALA 219.A N ALA 215.A O no hydrogen 3.101 N/A ARG 221.A N CYS 218.A O no hydrogen 2.912 N/A ARG 221.A NH1 VAL 217.A O no hydrogen 3.239 N/A THR 222.A N GLY 191.A O no hydrogen 3.259 N/A THR 222.A OG1 GLY 33.A O no hydrogen 2.771 N/A THR 223.A N GLN 62.A O no hydrogen 2.949 N/A THR 223.A OG1 ARG 221.A O no hydrogen 2.870 N/A ILE 224.A N ILE 193.A O no hydrogen 2.998 N/A VAL 225.A N LEU 64.A O no hydrogen 2.783 N/A VAL 226.A N LEU 195.A O no hydrogen 2.883 N/A ALA 227.A N LEU 66.A O no hydrogen 3.282 N/A HIS 228.A N GLU 197.A OE1 no hydrogen 2.556 N/A ARG 229.A N GLU 197.A OE1 no hydrogen 2.799 N/A ARG 229.A NE GLU 207.A OE2 no hydrogen 2.637 N/A ARG 229.A NH1 ALA 198.A O no hydrogen 2.776 N/A ARG 229.A NH2 SER 200.A O no hydrogen 2.641 N/A ARG 229.A NH2 GLU 207.A OE1 no hydrogen 3.475 N/A ARG 229.A NH2 GLU 207.A OE2 no hydrogen 3.169 N/A THR 232.A N ARG 229.A O no hydrogen 3.075 N/A THR 232.A OG1 GLU 197.A OE2 no hydrogen 2.599 N/A VAL 233.A N ARG 229.A O no hydrogen 3.348 N/A VAL 234.A N LEU 230.A O no hydrogen 2.999 N/A ASN 235.A N SER 231.A O no hydrogen 3.275 N/A ASN 235.A ND2 SER 231.A O no hydrogen 2.591 N/A ALA 236.A N VAL 233.A O no hydrogen 3.142 N/A ASP 237.A N THR 63.A OG1.A no hydrogen 2.771 N/A GLN 238.A NE2 THR 57.A O no hydrogen 2.808 N/A ILE 239.A N GLY 251.A O no hydrogen 2.789 N/A LEU 240.A N ALA 65.A O no hydrogen 2.870 N/A VAL 241.A N GLU 249.A O no hydrogen 2.888 N/A ILE 242.A N VAL 67.A O no hydrogen 2.725 N/A LYS 243.A N CYS 246.A O no hydrogen 2.992 N/A GLY 245.A N ALA 72.A O no hydrogen 2.711 N/A CYS 246.A N LYS 243.A O no hydrogen 3.069 N/A CYS 246.A SG.A ASP 244.A O no hydrogen 3.757 N/A CYS 246.A SG.B ILE 247.A O no hydrogen 3.757 N/A VAL 248.A N VAL 241.A O no hydrogen 2.817 N/A ARG 250.A NH1 SER 55.A O no hydrogen 2.829 N/A ARG 250.A NH2 SER 55.A O no hydrogen 2.920 N/A GLY 251.A N ILE 239.A O no hydrogen 3.271 N/A HIS 253.A ND1 TYR 263.A OH no hydrogen 2.613 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.656 N/A LEU 256.A N ARG 252.A O no hydrogen 2.894 N/A LEU 257.A N HIS 253.A O no hydrogen 3.015 N/A SER 258.A N GLU 254.A O no hydrogen 2.971 N/A SER 258.A OG ALA 255.A O no hydrogen 3.357 N/A ARG 259.A N ALA 255.A O no hydrogen 2.919 N/A GLY 260.A N LEU 257.A O no hydrogen 2.974 N/A VAL 262.A N GLU 249.A OE2 no hydrogen 2.967 N/A TYR 263.A N GLU 249.A OE1 no hydrogen 2.970 N/A TYR 263.A OH HIS 253.A ND1 no hydrogen 2.613 N/A ASP 265.A N GLY 261.A O no hydrogen 2.874 N/A MET 266.A N VAL 262.A O no hydrogen 2.952 N/A TRP 267.A N TYR 263.A O no hydrogen 2.816 N/A GLN 268.A N ALA 264.A O no hydrogen 2.866 N/A LEU 269.A N ASP 265.A O no hydrogen 2.862 N/A GLN 270.A N MET 266.A O no hydrogen 2.931 N/A GLN 270.A NE2 TRP 267.A O no hydrogen 3.253 N/A GLN 271.A N TRP 267.A O no hydrogen 3.108 N/A GLY 272.A N GLN 268.A O no hydrogen 3.184 N/A