Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6yk8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG HIS 265.A ND1 no hydrogen 3.546 N/A TYR 3.A OH THR 216.A OG1 no hydrogen 3.297 N/A ALA 5.A N CYS 1.A O no hydrogen 3.187 N/A TYR 6.A N LEU 2.A O no hydrogen 2.626 N/A TYR 6.A OH HIS 221.A ND1 no hydrogen 2.695 N/A SER 7.A N TYR 3.A O no hydrogen 2.633 N/A SER 7.A OG TYR 3.A O no hydrogen 2.845 N/A ILE 8.A N TYR 4.A O no hydrogen 2.848 N/A SER 9.A N ALA 5.A O no hydrogen 2.887 N/A LEU 10.A N TYR 6.A O no hydrogen 2.774 N/A MET 11.A N SER 7.A O no hydrogen 2.914 N/A TYR 12.A N ILE 8.A O no hydrogen 3.064 N/A TYR 13.A N SER 9.A O no hydrogen 3.156 N/A LEU 14.A N LEU 10.A O no hydrogen 3.110 N/A ARG 15.A N MET 11.A O no hydrogen 3.054 N/A ALA 16.A N TYR 12.A O no hydrogen 3.012 N/A LYS 17.A N TYR 13.A O no hydrogen 3.170 N/A LYS 17.A N LEU 14.A O no hydrogen 2.895 N/A ASN 18.A N LEU 14.A O no hydrogen 2.966 N/A LYS 21.A N ASN 19.A OD1 no hydrogen 2.463 N/A ILE 22.A N ASN 19.A OD1 no hydrogen 3.368 N/A THR 23.A N ASN 19.A O no hydrogen 3.033 N/A THR 23.A OG1 ASN 19.A O no hydrogen 2.703 N/A GLU 24.A N VAL 20.A O no hydrogen 2.665 N/A ASP 25.A N LYS 21.A O no hydrogen 2.776 N/A ILE 26.A N ILE 22.A O no hydrogen 3.005 N/A PHE 27.A N THR 23.A O no hydrogen 2.908 N/A ASN 28.A N GLU 24.A O no hydrogen 2.864 N/A LYS 29.A N ASP 25.A O no hydrogen 3.008 N/A LYS 29.A NZ ASP 25.A OD1 no hydrogen 3.322 N/A LYS 29.A NZ ASP 25.A OD2 no hydrogen 3.288 N/A LYS 29.A NZ ASP 237.A OD2 no hydrogen 2.670 N/A LEU 30.A N ILE 26.A O no hydrogen 3.182 N/A GLY 31.A N ASN 28.A O no hydrogen 2.621 N/A LEU 32.A N PHE 27.A O no hydrogen 3.333 N/A LYS 33.A NZ GLU 35.A OE2 no hydrogen 3.233 N/A ARG 37.A N LYS 33.A O no hydrogen 2.917 N/A ARG 37.A NE LEU 32.A O no hydrogen 2.657 N/A ARG 37.A NH1 GLU 24.A OE2 no hydrogen 3.150 N/A ARG 37.A NH1 ASN 28.A OD1 no hydrogen 2.927 N/A ARG 37.A NH2 ASN 28.A OD1 no hydrogen 3.046 N/A ARG 37.A NH2 LEU 32.A O no hydrogen 3.174 N/A ALA 38.A N GLU 34.A O no hydrogen 3.120 N/A ALA 38.A N GLU 35.A O no hydrogen 3.215 N/A LEU 40.A N ASP 36.A O no hydrogen 3.223 N/A ARG 41.A N ARG 37.A O no hydrogen 3.323 N/A ARG 41.A NH1 GLU 34.A OE1 no hydrogen 2.701 N/A ARG 41.A NH2 GLU 24.A OE1 no hydrogen 2.341 N/A LYS 42.A N ALA 38.A O no hydrogen 3.160 N/A LEU 44.A N LEU 40.A O no hydrogen 3.130 N/A LEU 44.A N ARG 41.A O no hydrogen 2.897 N/A SER 45.A N ARG 41.A O no hydrogen 3.382 N/A SER 45.A N LYS 42.A O no hydrogen 3.353 N/A ALA 49.A N TYR 12.A OH no hydrogen 2.911 N/A PHE 50.A N TYR 12.A OH no hydrogen 3.120 N/A THR 51.A N GLU 54.A OE1 no hydrogen 2.464 N/A GLU 54.A N THR 51.A OG1 no hydrogen 2.629 N/A ILE 55.A N THR 51.A O no hydrogen 3.100 N/A LYS 56.A N ARG 52.A O no hydrogen 3.080 N/A LYS 56.A NZ GLU 60.A OE1 no hydrogen 2.884 N/A THR 57.A N ASP 53.A O no hydrogen 3.039 N/A THR 57.A OG1 ASP 53.A O no hydrogen 2.633 N/A ILE 58.A N GLU 54.A O no hydrogen 3.084 N/A ILE 59.A N GLU 54.A O no hydrogen 3.052 N/A GLU 60.A N ILE 55.A O no hydrogen 2.755 N/A LEU 63.A N ILE 59.A O no hydrogen 2.757 N/A GLY 64.A N ILE 59.A O no hydrogen 3.430 N/A GLY 64.A N GLU 60.A O no hydrogen 2.947 N/A ALA 66.A N ILE 62.A O no hydrogen 3.264 N/A THR 67.A N LEU 63.A O no hydrogen 2.911 N/A THR 67.A OG1 LEU 63.A O no hydrogen 2.532 N/A THR 67.A OG1 GLY 64.A O no hydrogen 3.089 N/A ARG 68.A N GLY 64.A O no hydrogen 3.191 N/A ARG 68.A NH1 LEU 205.A O no hydrogen 3.184 N/A ARG 68.A NH1 VAL 210.A O no hydrogen 3.029 N/A ARG 68.A NH2 VAL 210.A O no hydrogen 3.185 N/A ASP 69.A N ARG 65.A O no hydrogen 2.931 N/A LEU 70.A N ALA 66.A O no hydrogen 2.894 N/A ALA 71.A N THR 67.A O no hydrogen 2.830 N/A ALA 72.A N ARG 68.A O no hydrogen 2.757 N/A GLU 73.A N ASP 69.A O no hydrogen 2.856 N/A HIS 74.A N LEU 70.A O no hydrogen 2.907 N/A THR 75.A N ALA 71.A O no hydrogen 2.843 N/A THR 75.A OG1 ALA 71.A O no hydrogen 2.605 N/A THR 75.A OG1 ALA 72.A O no hydrogen 3.211 N/A LYS 76.A N ALA 72.A O no hydrogen 3.329 N/A LYS 76.A NZ GLU 195.A OE2 no hydrogen 3.300 N/A LYS 76.A NZ ASP 199.A OD1 no hydrogen 2.763 N/A VAL 77.A N GLU 73.A O no hydrogen 3.214 N/A GLU 78.A N HIS 74.A O no hydrogen 3.068 N/A PHE 79.A N THR 75.A O no hydrogen 3.090 N/A LYS 80.A N LYS 76.A O no hydrogen 3.104 N/A LYS 80.A NZ GLU 195.A OE1 no hydrogen 2.466 N/A LYS 80.A NZ GLU 195.A OE2 no hydrogen 3.113 N/A SER 81.A N VAL 77.A O no hydrogen 2.909 N/A SER 82.A N GLU 78.A O no hydrogen 3.135 N/A SER 82.A OG SER 82.A O no hydrogen 2.334 N/A SER 82.A OG ASP 85.A OD2 no hydrogen 2.932 N/A THR 86.A N PRO 83.A O no hydrogen 3.031 N/A THR 86.A OG1 PRO 83.A O no hydrogen 3.159 N/A PHE 89.A N THR 86.A OG1 no hydrogen 3.182 N/A SER 90.A N THR 86.A O no hydrogen 3.403 N/A SER 90.A OG THR 86.A O no hydrogen 3.215 N/A SER 90.A OG PRO 87.A O no hydrogen 3.375 N/A SER 91.A N PRO 87.A O no hydrogen 2.782 N/A SER 91.A OG PRO 87.A O no hydrogen 2.382 N/A LEU 92.A N LEU 88.A O no hydrogen 2.784 N/A HIS 93.A N PHE 89.A O no hydrogen 2.549 N/A HIS 93.A ND1 THR 186.A OG1 no hydrogen 3.203 N/A TYR 94.A N SER 90.A O no hydrogen 3.015 N/A ALA 95.A N SER 91.A O no hydrogen 3.285 N/A VAL 96.A N LEU 92.A O no hydrogen 2.828 N/A GLU 97.A N HIS 93.A O no hydrogen 2.726 N/A PHE 98.A N TYR 94.A O no hydrogen 3.241 N/A PHE 98.A N ALA 95.A O no hydrogen 2.964 N/A GLY 99.A N ALA 95.A O no hydrogen 2.830 N/A PHE 100.A N VAL 96.A O no hydrogen 2.998 N/A LYS 101.A N GLU 97.A O no hydrogen 3.330 N/A LYS 101.A NZ ASN 117.A O no hydrogen 2.978 N/A ARG 102.A N PHE 98.A O no hydrogen 3.124 N/A SER 103.A N GLY 99.A O no hydrogen 2.773 N/A SER 103.A OG PHE 100.A O no hydrogen 3.528 N/A SER 103.A OG THR 147.A OG1 no hydrogen 2.643 N/A LEU 104.A N PHE 100.A O no hydrogen 2.665 N/A GLN 105.A N LYS 101.A O no hydrogen 3.343 N/A ILE 106.A N ARG 102.A O no hydrogen 3.140 N/A ASN 107.A N SER 103.A O no hydrogen 3.024 N/A ASN 107.A ND2 SER 103.A O no hydrogen 2.677 N/A GLU 108.A N GLN 105.A O no hydrogen 2.913 N/A SER 109.A N LEU 104.A O no hydrogen 3.245 N/A LEU 111.A N SER 109.A OG no hydrogen 2.953 N/A THR 112.A OG1 LYS 101.A O no hydrogen 3.363 N/A LEU 113.A N GLU 110.A O no hydrogen 3.363 N/A LEU 114.A N LEU 111.A O no hydrogen 2.774 N/A ILE 115.A N THR 112.A O no hydrogen 3.107 N/A ASP 116.A N ASP 116.A OD2 no hydrogen 2.346 N/A ASN 117.A ND2 TYR 94.A O no hydrogen 2.945 N/A ASN 117.A ND2 GLU 97.A OE2 no hydrogen 2.636 N/A PHE 119.A N ASN 117.A OD1 no hydrogen 2.781 N/A SER 120.A OG ASP 118.A O no hydrogen 3.308 N/A ASN 121.A N TYR 94.A OH no hydrogen 2.947 N/A ASP 123.A N ASN 121.A OD1 no hydrogen 2.572 N/A TYR 124.A N ASN 121.A O no hydrogen 3.093 N/A THR 125.A N ASN 121.A O no hydrogen 3.080 N/A THR 125.A OG1 GLU 126.A OE2 no hydrogen 3.262 N/A ALA 127.A N TYR 124.A O no hydrogen 3.089 N/A TYR 130.A N ALA 127.A O no hydrogen 3.156 N/A TYR 130.A OH SER 91.A O no hydrogen 2.640 N/A LYS 131.A N GLU 128.A O no hydrogen 2.710 N/A LEU 135.A N VAL 132.A O no hydrogen 3.152 N/A ALA 138.A N GLY 134.A O no hydrogen 3.127 N/A LEU 139.A N LEU 135.A O no hydrogen 2.822 N/A GLN 140.A N LEU 136.A O no hydrogen 2.836 N/A GLU 141.A N ASP 137.A O no hydrogen 3.020 N/A TYR 142.A N ALA 138.A O no hydrogen 2.915 N/A TYR 142.A OH GLU 185.A O no hydrogen 3.327 N/A TYR 142.A OH GLU 185.A OE1 no hydrogen 3.184 N/A ILE 143.A N LEU 139.A O no hydrogen 2.808 N/A LEU 144.A N GLN 140.A O no hydrogen 2.919 N/A THR 145.A N GLU 141.A O no hydrogen 3.097 N/A THR 145.A OG1 GLU 141.A O no hydrogen 2.652 N/A ARG 146.A N TYR 142.A O no hydrogen 3.050 N/A ARG 146.A NE GLU 185.A OE1 no hydrogen 2.849 N/A THR 147.A N LEU 144.A O no hydrogen 3.069 N/A THR 147.A OG1 SER 103.A OG no hydrogen 2.643 N/A THR 147.A OG1 ILE 143.A O no hydrogen 2.280 N/A VAL 150.A N ARG 146.A O no hydrogen 3.049 N/A ILE 151.A N THR 147.A O no hydrogen 2.906 N/A GLU 152.A N PRO 148.A O no hydrogen 3.028 N/A GLU 153.A N SER 149.A O no hydrogen 2.681 N/A PHE 154.A N VAL 150.A O no hydrogen 2.721 N/A ASN 155.A N ILE 151.A O no hydrogen 2.805 N/A ARG 156.A N GLU 152.A O no hydrogen 2.815 N/A ARG 156.A NE GLU 153.A OE1 no hydrogen 2.894 N/A ARG 156.A NH2 GLU 153.A OE2 no hydrogen 2.614 N/A GLN 157.A N GLU 153.A O no hydrogen 2.946 N/A GLN 157.A NE2 GLU 153.A OE2 no hydrogen 2.611 N/A TRP 158.A N PHE 154.A O no hydrogen 2.743 N/A GLU 159.A N ASN 155.A O no hydrogen 3.070 N/A ASN 160.A N ARG 156.A O no hydrogen 3.222 N/A LYS 161.A N GLN 157.A O no hydrogen 3.183 N/A LYS 161.A N TRP 158.A O no hydrogen 2.881 N/A LYS 162.A N TRP 158.A O no hydrogen 3.229 N/A THR 166.A OG1 GLU 169.A OE2 no hydrogen 3.160 N/A VAL 172.A N LYS 168.A O no hydrogen 3.340 N/A ALA 175.A N GLN 171.A O no hydrogen 3.056 N/A THR 176.A N VAL 172.A O no hydrogen 2.906 N/A THR 176.A OG1 VAL 172.A O no hydrogen 3.518 N/A ILE 177.A N HIS 173.A O no hydrogen 2.923 N/A LEU 178.A N GLN 174.A O no hydrogen 2.949 N/A ASP 179.A N ALA 175.A O no hydrogen 2.777 N/A ASN 180.A N THR 176.A O no hydrogen 2.934 N/A ILE 181.A N ILE 177.A O no hydrogen 3.136 N/A LEU 182.A N LEU 178.A O no hydrogen 2.983 N/A ARG 183.A N ASP 179.A O no hydrogen 2.826 N/A ARG 183.A NH2.A ASP 179.A OD1 no hydrogen 2.756 N/A ARG 183.A NH2.A ASP 179.A OD2 no hydrogen 3.070 N/A LYS 184.A N ASN 180.A O no hydrogen 3.091 N/A LYS 184.A NZ ASP 188.A OD2 no hydrogen 2.608 N/A GLU 185.A N ILE 181.A O no hydrogen 2.873 N/A THR 186.A N LEU 182.A O no hydrogen 2.879 N/A THR 186.A OG1 HIS 93.A ND1 no hydrogen 3.203 N/A THR 186.A OG1 LEU 182.A O no hydrogen 3.062 N/A ILE 187.A N ARG 183.A O no hydrogen 3.404 N/A ASP 188.A N LYS 184.A O no hydrogen 2.970 N/A PHE 189.A N GLU 185.A O no hydrogen 3.005 N/A LEU 190.A N THR 186.A O no hydrogen 3.431 N/A LEU 191.A N ILE 187.A O no hydrogen 2.889 N/A ALA 192.A N ASP 188.A O no hydrogen 2.852 N/A GLU 195.A N LEU 191.A O no hydrogen 3.208 N/A LYS 196.A N ALA 192.A O no hydrogen 2.941 N/A LYS 196.A NZ GLU 200.A OE1 no hydrogen 3.200 N/A HIS 197.A ND1 GLU 200.A OE2 no hydrogen 2.763 N/A LEU 198.A N LEU 190.A O no hydrogen 3.339 N/A ASP 199.A N GLU 195.A O no hydrogen 2.796 N/A GLU 200.A N LYS 196.A O no hydrogen 2.786 N/A TYR 201.A N HIS 197.A O no hydrogen 2.993 N/A ARG 202.A N LEU 198.A O no hydrogen 3.071 N/A ARG 202.A NE GLU 203.A OE1 no hydrogen 3.069 N/A ARG 202.A NH1 GLU 73.A OE2 no hydrogen 3.283 N/A GLU 203.A N ASP 199.A O no hydrogen 2.877 N/A HIS 204.A N GLU 200.A O no hydrogen 3.081 N/A HIS 204.A NE2 GLU 128.A OE2 no hydrogen 3.019 N/A LEU 205.A N TYR 201.A O no hydrogen 3.005 N/A ARG 206.A N ARG 202.A O no hydrogen 3.016 N/A ARG 206.A N GLU 203.A O no hydrogen 2.983 N/A ARG 206.A NE GLU 203.A OE2 no hydrogen 3.231 N/A ARG 206.A NH1 ASP 69.A OD1 no hydrogen 3.006 N/A ARG 207.A N GLU 203.A O no hydrogen 3.139 N/A ARG 207.A N HIS 204.A O no hydrogen 2.973 N/A GLU 215.A N SER 213.A OG no hydrogen 2.541 N/A THR 216.A OG1 TYR 3.A OH no hydrogen 3.297 N/A LEU 217.A N SER 213.A O no hydrogen 3.038 N/A MET 218.A N GLU 214.A O no hydrogen 3.209 N/A VAL 219.A N GLU 215.A O no hydrogen 3.325 N/A LEU 220.A N THR 216.A O no hydrogen 2.879 N/A HIS 221.A N LEU 217.A O no hydrogen 2.848 N/A HIS 221.A ND1 TYR 6.A OH no hydrogen 2.695 N/A HIS 221.A NE2 ILE 240.A O no hydrogen 2.686 N/A ARG 222.A N MET 218.A O no hydrogen 3.103 N/A ARG 222.A NE GLU 78.A OE1 no hydrogen 2.793 N/A ARG 222.A NH2 GLU 78.A OE1 no hydrogen 3.362 N/A ARG 222.A NH2 GLU 78.A OE2 no hydrogen 2.908 N/A ALA 223.A N VAL 219.A O no hydrogen 2.759 N/A ILE 224.A N LEU 220.A O no hydrogen 2.686 N/A GLN 225.A N HIS 221.A O no hydrogen 2.930 N/A GLN 225.A NE2 HIS 221.A O no hydrogen 3.091 N/A GLY 226.A N ALA 223.A O no hydrogen 2.893 N/A GLU 227.A N ARG 222.A O no hydrogen 2.886 N/A ARG 228.A N VAL 235.A O no hydrogen 2.754 N/A ARG 228.A NH1 ASP 237.A OD1 no hydrogen 3.243 N/A ARG 228.A NH1 ASP 237.A OD2 no hydrogen 2.665 N/A ARG 228.A NH2 ASP 237.A OD1 no hydrogen 2.836 N/A VAL 230.A N GLU 233.A O no hydrogen 2.876 N/A VAL 235.A N ARG 228.A O no hydrogen 3.124 N/A ASP 237.A N GLN 225.A O no hydrogen 2.929 N/A HIS 238.A N GLN 225.A O no hydrogen 3.128 N/A HIS 238.A NE2 ASP 25.A OD2 no hydrogen 2.292 N/A ILE 240.A N GLN 225.A OE1 no hydrogen 2.773 N/A HIS 243.A N MET 256.A O no hydrogen 2.894 N/A HIS 243.A ND1 LEU 242.A O no hydrogen 2.827 N/A HIS 245.A N LEU 258.A O no hydrogen 2.565 N/A ASN 247.A N ASN 260.A O no hydrogen 3.230 N/A GLY 248.A N ASN 259.A OD1 no hydrogen 2.959 N/A ALA 249.A N ARG 246.A O no hydrogen 3.157 N/A GLU 255.A N ILE 241.A O no hydrogen 2.952 N/A MET 256.A N ILE 241.A O no hydrogen 3.224 N/A LEU 258.A N HIS 243.A O no hydrogen 3.009 N/A ASN 259.A N THR 267.A O no hydrogen 2.808 N/A ASN 260.A N HIS 245.A O no hydrogen 2.424 N/A GLU 261.A N HIS 265.A O no hydrogen 2.936 N/A ASN 263.A N ASN 260.A OD1 no hydrogen 2.981 N/A VAL 264.A N GLU 261.A O no hydrogen 2.932 N/A HIS 265.A N GLU 261.A O no hydrogen 3.449 N/A THR 267.A N ASN 259.A O no hydrogen 3.204 N/A THR 267.A OG1 ASN 259.A O no hydrogen 3.564 N/A SER 268.A OG ALA 5.A O no hydrogen 3.302 N/A ILE 269.A N ILE 257.A O no hydrogen 2.965 N/A