Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ALA 1.A O no hydrogen 2.736 N/A TYR 6.A OH GLU 12.A OE1 no hydrogen 2.611 N/A LYS 10.A N ASP 7.A O no hydrogen 3.218 N/A TRP 11.A N ASP 7.A O no hydrogen 3.190 N/A GLU 12.A N ALA 8.A O no hydrogen 3.025 N/A PHE 13.A N ALA 78.A O no hydrogen 2.744 N/A ARG 15.A NE PRO 85.A O no hydrogen 2.938 N/A ARG 15.A NH1 LYS 81.A O no hydrogen 2.929 N/A ARG 15.A NH1 PRO 85.A O no hydrogen 2.920 N/A ARG 15.A NH2 LYS 81.A O no hydrogen 2.953 N/A ARG 17.A N PRO 14.A O no hydrogen 3.024 N/A ARG 17.A NH2 PHE 33.A O no hydrogen 3.355 N/A LEU 18.A N ARG 15.A O no hydrogen 3.211 N/A LYS 19.A N ASP 31.A O no hydrogen 2.970 N/A GLY 21.A N GLU 29.A O no hydrogen 2.599 N/A LYS 22.A NZ GLU 29.A OE1 no hydrogen 3.098 N/A LEU 24.A N VAL 27.A O no hydrogen 2.780 N/A GLN 26.A N MET 46.A O no hydrogen 3.112 N/A ILE 28.A N VAL 44.A O no hydrogen 2.814 N/A GLU 29.A N LYS 22.A O no hydrogen 2.887 N/A ALA 30.A N VAL 42.A O no hydrogen 3.040 N/A ASP 31.A N LYS 19.A O no hydrogen 2.938 N/A ALA 32.A N ARG 40.A O no hydrogen 2.746 N/A PHE 33.A N ARG 17.A O no hydrogen 2.878 N/A GLY 34.A N THR 38.A O no hydrogen 3.015 N/A CYS 39.A SG ASP 31.A OD1 no hydrogen 3.258 N/A ARG 40.A N ALA 32.A O no hydrogen 2.835 N/A ARG 40.A NH1 ASP 36.A OD1 no hydrogen 2.831 N/A VAL 42.A N ALA 30.A O no hydrogen 2.760 N/A ALA 43.A N THR 90.A O no hydrogen 3.164 N/A VAL 44.A N ILE 28.A O no hydrogen 2.770 N/A LYS 45.A N VAL 88.A O no hydrogen 2.852 N/A LYS 45.A NZ GLU 59.A OE1 no hydrogen 3.233 N/A LYS 45.A NZ GLU 59.A OE2 no hydrogen 3.056 N/A LYS 45.A NZ ASP 170.A O no hydrogen 2.697 N/A LYS 45.A NZ GLY 172.A O no hydrogen 3.271 N/A MET 46.A N GLN 26.A O no hydrogen 3.017 N/A THR 49.A OG1 GLU 52.A OE2 no hydrogen 3.441 N/A HIS 53.A N THR 49.A O no hydrogen 2.915 N/A ARG 54.A N HIS 50.A O no hydrogen 2.769 N/A ALA 55.A N SER 51.A O no hydrogen 3.030 N/A LEU 56.A N GLU 52.A O no hydrogen 3.110 N/A MET 57.A N HIS 53.A O no hydrogen 2.917 N/A SER 58.A N ARG 54.A O no hydrogen 2.820 N/A SER 58.A OG ARG 54.A O no hydrogen 2.907 N/A GLU 59.A N ALA 55.A O no hydrogen 2.861 N/A LEU 60.A N LEU 56.A O no hydrogen 2.948 N/A LYS 61.A N MET 57.A O no hydrogen 3.072 N/A LYS 61.A NZ GLU 2.A O no hydrogen 3.234 N/A LYS 61.A NZ LEU 4.A O no hydrogen 3.448 N/A ILE 62.A N SER 58.A O no hydrogen 3.016 N/A LEU 63.A N GLU 59.A O no hydrogen 3.025 N/A ILE 64.A N LEU 60.A O no hydrogen 3.098 N/A HIS 65.A N LYS 61.A O no hydrogen 2.812 N/A ILE 66.A N ILE 62.A O no hydrogen 2.697 N/A GLY 67.A N LEU 63.A O no hydrogen 3.262 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 2.861 N/A ASN 71.A ND2 GLN 135.A OE1 no hydrogen 3.135 N/A ASN 71.A ND2 VAL 166.A O no hydrogen 3.012 N/A VAL 72.A N HIS 69.A O no hydrogen 3.040 N/A VAL 73.A N ILE 168.A O no hydrogen 3.050 N/A ASN 74.A N GLU 91.A OE2 no hydrogen 2.749 N/A ASN 74.A ND2 HIS 69.A O no hydrogen 3.468 N/A ASN 74.A ND2 VAL 72.A O no hydrogen 2.592 N/A LEU 76.A N ILE 89.A O no hydrogen 2.815 N/A GLY 77.A N ILE 89.A O no hydrogen 3.337 N/A ALA 78.A N TRP 11.A O no hydrogen 3.118 N/A CYS 79.A N MET 87.A O no hydrogen 2.901 N/A CYS 79.A SG PHE 13.A O no hydrogen 3.299 N/A THR 80.A N GLU 12.A OE1 no hydrogen 3.396 N/A THR 80.A N GLU 12.A OE2 no hydrogen 2.841 N/A THR 80.A OG1 GLU 12.A OE1 no hydrogen 2.711 N/A LYS 81.A N GLU 12.A OE2 no hydrogen 3.109 N/A MET 87.A N CYS 79.A O no hydrogen 3.006 N/A VAL 88.A N LYS 45.A O no hydrogen 2.862 N/A ILE 89.A N GLY 77.A O no hydrogen 2.959 N/A THR 90.A N ALA 43.A O no hydrogen 2.901 N/A THR 90.A OG1 GLU 91.A O no hydrogen 3.035 N/A GLU 91.A N ASN 74.A O no hydrogen 2.884 N/A PHE 95.A N LEU 160.A O no hydrogen 3.068 N/A GLY 96.A N CYS 93.A O no hydrogen 3.210 N/A ASN 97.A ND2 THR 100.A OG1 no hydrogen 2.859 N/A LEU 98.A N ILE 158.A O no hydrogen 2.814 N/A THR 100.A N ASN 97.A OD1 no hydrogen 2.954 N/A TYR 101.A N ASN 97.A O no hydrogen 3.177 N/A LEU 102.A N LEU 98.A O no hydrogen 2.837 N/A ARG 103.A N SER 99.A O no hydrogen 3.062 N/A ARG 103.A NE GLY 207.A O no hydrogen 2.751 N/A ARG 103.A NH2 SER 99.A OG no hydrogen 2.998 N/A SER 104.A N THR 100.A O no hydrogen 3.140 N/A SER 104.A N TYR 101.A O no hydrogen 3.064 N/A SER 104.A OG TYR 101.A O no hydrogen 2.635 N/A LYS 105.A N LEU 102.A O no hydrogen 3.109 N/A LYS 105.A NZ GLU 108.A OE2 no hydrogen 2.843 N/A LYS 105.A NZ ASP 122.A O no hydrogen 2.730 N/A ARG 106.A NE LEU 206.A O no hydrogen 2.962 N/A ARG 106.A NH1 LEU 206.A O no hydrogen 3.071 N/A GLU 108.A N LYS 105.A O no hydrogen 2.891 N/A VAL 110.A N LEU 124.A O no hydrogen 3.324 N/A LYS 113.A NZ TYR 120.A O no hydrogen 3.279 N/A LEU 119.A N PRO 116.A O no hydrogen 3.274 N/A TYR 120.A N GLU 117.A O no hydrogen 2.738 N/A PHE 123.A N TYR 120.A O no hydrogen 2.926 N/A LEU 124.A N GLU 108.A O no hydrogen 2.919 N/A THR 125.A N HIS 128.A ND1 no hydrogen 3.232 N/A THR 125.A OG1 HIS 128.A ND1 no hydrogen 2.901 N/A LEU 126.A N PRO 111.A O no hydrogen 3.041 N/A HIS 128.A ND1 THR 125.A OG1 no hydrogen 2.901 N/A LEU 129.A N THR 125.A O no hydrogen 3.122 N/A ILE 130.A N LEU 126.A O no hydrogen 2.942 N/A CYS 131.A N GLU 127.A O no hydrogen 2.888 N/A TYR 132.A N HIS 128.A O no hydrogen 2.807 N/A SER 133.A N LEU 129.A O no hydrogen 3.221 N/A SER 133.A OG LEU 129.A O no hydrogen 2.868 N/A PHE 134.A N ILE 130.A O no hydrogen 2.776 N/A GLN 135.A N CYS 131.A O no hydrogen 2.906 N/A GLN 135.A NE2 CYS 131.A O no hydrogen 3.691 N/A GLN 135.A NE2 ASN 164.A O no hydrogen 2.925 N/A VAL 136.A N TYR 132.A O no hydrogen 3.094 N/A ALA 137.A N SER 133.A O no hydrogen 3.089 N/A LYS 138.A N PHE 134.A O no hydrogen 3.117 N/A GLY 139.A N GLN 135.A O no hydrogen 2.988 N/A MET 140.A N VAL 136.A O no hydrogen 2.839 N/A GLU 141.A N ALA 137.A O no hydrogen 2.796 N/A PHE 142.A N LYS 138.A O no hydrogen 2.939 N/A LEU 143.A N GLY 139.A O no hydrogen 3.058 N/A ALA 144.A N MET 140.A O no hydrogen 2.807 N/A SER 145.A N GLU 141.A O no hydrogen 3.027 N/A SER 145.A OG GLU 141.A O no hydrogen 2.570 N/A ARG 146.A N LEU 143.A O no hydrogen 3.080 N/A ARG 146.A NE ILE 66.A O no hydrogen 3.079 N/A ARG 146.A NH2 PHE 142.A O no hydrogen 2.967 N/A LYS 147.A N ALA 144.A O no hydrogen 2.944 N/A CYS 148.A N LEU 143.A O no hydrogen 2.941 N/A CYS 148.A SG ARG 146.A O no hydrogen 3.917 N/A HIS 150.A N ASP 192.A OD2 no hydrogen 2.660 N/A HIS 150.A NE2 CYS 169.A O no hydrogen 2.889 N/A ARG 151.A N ASP 192.A OD1 no hydrogen 3.065 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.027 N/A ALA 155.A N GLU 202.A OE1 no hydrogen 2.799 N/A ARG 156.A NH1 ASP 152.A OD1 no hydrogen 2.865 N/A ARG 156.A NH2 ASP 152.A OD1 no hydrogen 2.808 N/A ARG 156.A NH2 ASP 152.A OD2 no hydrogen 2.684 N/A ASN 157.A N ALA 154.A O no hydrogen 2.996 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.939 N/A ASN 157.A ND2 ASP 152.A OD2 no hydrogen 2.988 N/A ILE 158.A N ALA 155.A O no hydrogen 3.037 N/A LEU 159.A N LYS 167.A O no hydrogen 2.821 N/A LEU 160.A N GLY 96.A O no hydrogen 2.864 N/A SER 161.A N VAL 165.A O no hydrogen 2.808 N/A GLU 162.A N SER 161.A OG no hydrogen 2.580 N/A VAL 165.A N GLU 162.A O no hydrogen 3.179 N/A VAL 166.A N GLN 135.A OE1 no hydrogen 2.928 N/A LYS 167.A N LEU 159.A O no hydrogen 2.797 N/A LYS 167.A NZ LEU 70.A O no hydrogen 2.841 N/A LYS 167.A NZ GLU 91.A OE2 no hydrogen 3.216 N/A ILE 168.A N ASN 71.A O no hydrogen 2.853 N/A CYS 169.A N ASN 157.A O no hydrogen 2.923 N/A CYS 169.A SG ASN 157.A O no hydrogen 3.539 N/A PHE 171.A N ASN 157.A OD1 no hydrogen 3.339 N/A GLY 172.A N ASP 170.A OD2 no hydrogen 2.977 N/A LYS 175.A NZ SER 209.A OG no hydrogen 2.649 N/A LYS 175.A NZ PRO 210.A O no hydrogen 3.085 N/A TRP 176.A N PRO 173.A O no hydrogen 3.015 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.923 N/A MET 177.A N LEU 174.A O no hydrogen 3.153 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.812 N/A THR 181.A N ALA 178.A O no hydrogen 2.905 N/A THR 181.A OG1 VAL 186.A O no hydrogen 3.050 N/A ILE 182.A N ALA 178.A O no hydrogen 3.072 N/A PHE 183.A N PRO 179.A O no hydrogen 3.015 N/A ASP 184.A N GLU 180.A O no hydrogen 2.762 N/A VAL 186.A N GLU 180.A O no hydrogen 3.383 N/A THR 188.A N SER 191.A OG no hydrogen 2.779 N/A THR 188.A OG1 GLN 190.A OE1 no hydrogen 3.191 N/A SER 191.A N THR 188.A O no hydrogen 3.041 N/A SER 191.A N THR 188.A OG1 no hydrogen 3.195 N/A SER 191.A OG THR 188.A O no hydrogen 2.705 N/A ASP 192.A N THR 188.A O no hydrogen 3.096 N/A VAL 193.A N ILE 189.A O no hydrogen 2.999 N/A TRP 194.A N GLN 190.A O no hydrogen 3.197 N/A SER 195.A N SER 191.A O no hydrogen 3.124 N/A SER 195.A OG TRP 176.A O no hydrogen 2.659 N/A SER 195.A OG SER 191.A O no hydrogen 3.385 N/A PHE 196.A N ASP 192.A O no hydrogen 2.905 N/A GLY 197.A N VAL 193.A O no hydrogen 3.079 N/A VAL 198.A N TRP 194.A O no hydrogen 3.306 N/A LEU 199.A N SER 195.A O no hydrogen 2.888 N/A LEU 200.A N PHE 196.A O no hydrogen 2.779 N/A TRP 201.A N GLY 197.A O no hydrogen 3.195 N/A TRP 201.A NE1 ARG 231.A O no hydrogen 2.989 N/A GLU 202.A N VAL 198.A O no hydrogen 2.919 N/A ILE 203.A N LEU 199.A O no hydrogen 2.977 N/A PHE 204.A N LEU 200.A O no hydrogen 2.902 N/A SER 205.A N GLU 202.A O no hydrogen 3.386 N/A SER 205.A OG TRP 201.A O no hydrogen 3.173 N/A SER 205.A OG GLU 202.A O no hydrogen 3.075 N/A LEU 206.A N ILE 203.A O no hydrogen 3.002 N/A GLY 207.A N GLU 202.A O no hydrogen 2.783 N/A ALA 208.A N SER 205.A OG no hydrogen 2.981 N/A VAL 214.A N TYR 211.A O no hydrogen 3.284 N/A PHE 220.A N ASP 217.A OD2 no hydrogen 3.136 N/A CYS 221.A N ASP 217.A O no hydrogen 3.295 N/A CYS 221.A SG ASP 217.A O no hydrogen 3.676 N/A ARG 222.A N GLU 218.A O no hydrogen 3.066 N/A ARG 222.A NE GLU 219.A OE1 no hydrogen 3.148 N/A ARG 222.A NE GLU 219.A OE2 no hydrogen 3.381 N/A ARG 222.A NH2 GLU 219.A OE2 no hydrogen 2.922 N/A ARG 223.A N GLU 219.A O no hydrogen 3.003 N/A LEU 224.A N PHE 220.A O no hydrogen 2.991 N/A LYS 225.A N CYS 221.A O no hydrogen 2.928 N/A GLU 226.A N ARG 222.A O no hydrogen 2.931 N/A GLY 227.A N LEU 224.A O no hydrogen 2.989 N/A THR 228.A N ARG 223.A O no hydrogen 2.900 N/A THR 228.A OG1 ARG 223.A O no hydrogen 3.529 N/A ARG 229.A NE TRP 248.A O no hydrogen 2.884 N/A ARG 229.A NH1 LEU 224.A O no hydrogen 2.957 N/A ARG 229.A NH1 THR 228.A O no hydrogen 2.822 N/A ARG 229.A NH2 TRP 248.A O no hydrogen 2.807 N/A TYR 235.A N PHE 204.A O no hydrogen 2.985 N/A THR 236.A N PRO 233.A O no hydrogen 3.385 N/A THR 236.A OG1 THR 237.A O no hydrogen 2.805 N/A GLU 239.A N GLU 239.A OE1 no hydrogen 2.864 N/A MET 240.A N THR 237.A OG1 no hydrogen 3.237 N/A TYR 241.A N THR 237.A O no hydrogen 3.141 N/A TYR 241.A OH MET 230.A O no hydrogen 2.685 N/A GLN 242.A N PRO 238.A O no hydrogen 3.074 N/A GLN 242.A NE2 ASP 246.A OD1 no hydrogen 3.175 N/A THR 243.A N GLU 239.A O no hydrogen 3.002 N/A THR 243.A OG1 GLU 239.A O no hydrogen 3.313 N/A MET 244.A N MET 240.A O no hydrogen 3.116 N/A LEU 245.A N TYR 241.A O no hydrogen 2.951 N/A ASP 246.A N GLN 242.A O no hydrogen 2.727 N/A CYS 247.A N THR 243.A O no hydrogen 2.882 N/A CYS 247.A SG THR 243.A O no hydrogen 3.362 N/A TRP 248.A N MET 244.A O no hydrogen 3.106 N/A TRP 248.A N LEU 245.A O no hydrogen 3.038 N/A GLU 251.A N HIS 249.A ND1 no hydrogen 2.971 N/A GLN 254.A N GLU 251.A O no hydrogen 2.658 N/A GLN 254.A NE2 SER 253.A OG no hydrogen 3.290 N/A ARG 255.A N PRO 252.A O no hydrogen 3.335 N/A ARG 255.A NE HIS 249.A O no hydrogen 2.939 N/A ARG 255.A NH1 GLU 180.A OE2 no hydrogen 2.733 N/A ARG 255.A NH1 GLN 190.A O no hydrogen 2.825 N/A ARG 255.A NH2 GLU 180.A OE1 no hydrogen 2.835 N/A ARG 255.A NH2 GLU 180.A OE2 no hydrogen 3.383 N/A ARG 255.A NH2 HIS 249.A O no hydrogen 3.307 N/A THR 257.A N GLU 260.A OE1 no hydrogen 2.942 N/A SER 259.A OG GLU 141.A OE2 no hydrogen 2.751 N/A GLU 260.A N THR 257.A OG1 no hydrogen 3.106 N/A LEU 261.A N THR 257.A O no hydrogen 2.971 N/A VAL 262.A N PHE 258.A O no hydrogen 2.839 N/A GLU 263.A N SER 259.A O no hydrogen 3.111 N/A HIS 264.A N GLU 260.A O no hydrogen 2.867 N/A LEU 265.A N LEU 261.A O no hydrogen 2.794 N/A GLY 266.A N VAL 262.A O no hydrogen 2.985 N/A ASN 267.A N GLU 263.A O no hydrogen 3.086 N/A LEU 268.A N HIS 264.A O no hydrogen 3.009 N/A LEU 269.A N LEU 265.A O no hydrogen 2.895 N/A GLN 270.A N GLY 266.A O no hydrogen 3.055 N/A ALA 271.A N ASN 267.A O no hydrogen 2.967 N/A ASN 272.A N LEU 268.A O no hydrogen 2.879 N/A ALA 273.A N LEU 269.A O no hydrogen 2.969 N/A GLN 274.A N GLN 270.A O no hydrogen 2.944 N/A GLN 275.A N ALA 271.A O no hydrogen 2.994 N/A ASP 276.A N ASN 272.A O no hydrogen 2.912 N/A ARG 277.A N ALA 273.A O no hydrogen 2.874 N/A HIS 278.A N GLN 274.A O no hydrogen 3.132 N/A HIS 278.A ND1 GLN 274.A O no hydrogen 3.087 N/A HIS 279.A N GLN 275.A O no hydrogen 2.950 N/A HIS 280.A N ASP 276.A O no hydrogen 2.943 N/A HIS 281.A N ARG 277.A O no hydrogen 2.956 N/A HIS 282.A N HIS 278.A O no hydrogen 2.966 N/A HIS 282.A ND1 HIS 278.A O no hydrogen 2.660 N/A HIS 283.A N HIS 279.A O no hydrogen 3.247 N/A HIS 283.A ND1 HIS 279.A O no hydrogen 2.919 N/A