Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hai_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N THR 1.A O no hydrogen 3.190 N/A ASN 10.A N GLU 7.A O no hydrogen 3.329 N/A ASN 10.A ND2 THR 2.A O no hydrogen 3.556 N/A ASN 10.A ND2 ASP 3.A O no hydrogen 2.770 N/A ASN 10.A ND2 SER 4.A O no hydrogen 2.221 N/A LYS 12.A N GLY 9.A O no hydrogen 3.484 N/A ARG 13.A N ASN 10.A O no hydrogen 3.100 N/A THR 14.A N TYR 11.A O no hydrogen 3.171 N/A VAL 15.A N TYR 11.A O no hydrogen 3.312 N/A VAL 15.A N LYS 12.A O no hydrogen 2.791 N/A LYS 16.A N LYS 12.A O no hydrogen 2.880 N/A LYS 16.A NZ ASP 20.A OD1 no hydrogen 2.932 N/A LYS 16.A NZ ASP 20.A OD2 no hydrogen 3.502 N/A ASP 20.A N LYS 16.A O no hydrogen 2.591 N/A GLY 21.A N ARG 17.A O no hydrogen 3.101 N/A HIS 22.A N ASP 19.A O no hydrogen 3.000 N/A LEU 24.A N ASP 20.A O no hydrogen 3.107 N/A CYS 25.A N GLY 21.A O no hydrogen 3.119 N/A CYS 25.A SG GLY 21.A O no hydrogen 3.400 N/A ASN 26.A N HIS 22.A O no hydrogen 3.100 N/A ASP 27.A N ARG 23.A O no hydrogen 2.581 N/A LEU 28.A N LEU 24.A O no hydrogen 2.957 N/A MET 29.A N CYS 25.A O no hydrogen 3.124 N/A ASN 30.A N ASN 26.A O no hydrogen 3.032 N/A ASN 30.A ND2 ASN 26.A O no hydrogen 2.958 N/A CYS 31.A N ASP 27.A O no hydrogen 2.784 N/A VAL 32.A N LEU 28.A O no hydrogen 2.905 N/A GLN 33.A N MET 29.A O no hydrogen 2.813 N/A GLU 34.A N ASN 30.A O no hydrogen 2.640 N/A ARG 35.A N CYS 31.A O no hydrogen 3.419 N/A ALA 36.A N VAL 32.A O no hydrogen 2.621 N/A LYS 37.A N GLN 33.A O no hydrogen 2.645 N/A ILE 38.A N GLU 34.A O no hydrogen 2.947 N/A ILE 38.A N ARG 35.A O no hydrogen 2.755 N/A GLU 39.A N ARG 35.A O no hydrogen 2.917 N/A TYR 42.A N ILE 38.A O no hydrogen 3.333 N/A GLY 43.A N GLU 39.A O no hydrogen 3.184 N/A GLN 44.A N LYS 40.A O no hydrogen 3.075 N/A GLN 44.A N ALA 41.A O no hydrogen 3.256 N/A GLN 44.A NE2 ASP 48.A OD2 no hydrogen 3.281 N/A GLN 45.A N ALA 41.A O no hydrogen 3.146 N/A LEU 46.A N TYR 42.A O no hydrogen 3.016 N/A THR 47.A N GLY 43.A O no hydrogen 2.914 N/A THR 47.A OG1 GLY 43.A O no hydrogen 2.380 N/A THR 47.A OG1 GLN 44.A O no hydrogen 3.374 N/A THR 47.A OG1 SER 81.A OG no hydrogen 3.207 N/A ASP 48.A N GLN 44.A O no hydrogen 2.830 N/A TRP 49.A N GLN 45.A O no hydrogen 2.633 N/A ALA 50.A N LEU 46.A O no hydrogen 2.820 N/A ALA 50.A N THR 47.A O no hydrogen 3.170 N/A LYS 51.A N THR 47.A O no hydrogen 2.913 N/A ARG 52.A N ASP 48.A O no hydrogen 2.834 N/A ARG 54.A N ALA 50.A O no hydrogen 2.746 N/A ARG 54.A NH1 ASP 78.A OD2 no hydrogen 3.026 N/A ARG 54.A NH2 ASP 78.A OD2 no hydrogen 3.202 N/A GLN 55.A N LYS 51.A O no hydrogen 3.478 N/A LEU 56.A N ARG 52.A O no hydrogen 3.308 N/A ILE 57.A N TRP 53.A O no hydrogen 2.841 N/A GLU 58.A N ARG 54.A O no hydrogen 2.964 N/A LYS 59.A N GLN 55.A O no hydrogen 3.021 N/A GLY 60.A N ILE 57.A O no hydrogen 3.459 N/A GLN 62.A NE2 TYR 63.A O no hydrogen 3.528 N/A SER 65.A N ASP 269.A OD1 no hydrogen 2.774 N/A SER 65.A OG ASP 269.A OD1 no hydrogen 2.459 N/A LEU 66.A N ASP 269.A OD2 no hydrogen 3.273 N/A GLU 67.A N TYR 63.A O no hydrogen 3.204 N/A ARG 68.A N GLY 64.A O no hydrogen 3.411 N/A TRP 70.A N LEU 66.A O no hydrogen 2.966 N/A GLY 71.A N GLU 67.A O no hydrogen 2.628 N/A ALA 72.A N ARG 68.A O no hydrogen 2.972 N/A ILE 73.A N TRP 70.A O no hydrogen 3.305 N/A THR 75.A OG1 ALA 72.A O no hydrogen 3.477 N/A GLU 76.A N ALA 72.A O no hydrogen 3.300 N/A GLU 76.A N ILE 73.A O no hydrogen 2.718 N/A ALA 77.A N ILE 73.A O no hydrogen 3.006 N/A ASP 78.A N MET 74.A O no hydrogen 3.034 N/A LYS 79.A N THR 75.A O no hydrogen 3.102 N/A LYS 79.A NZ GLU 256.A OE1 no hydrogen 3.470 N/A VAL 80.A N GLU 76.A O no hydrogen 2.742 N/A SER 81.A N ALA 77.A O no hydrogen 2.727 N/A SER 81.A OG GLY 43.A O no hydrogen 2.469 N/A SER 81.A OG THR 47.A OG1 no hydrogen 3.207 N/A GLU 82.A N ASP 78.A O no hydrogen 3.089 N/A LEU 83.A N VAL 80.A O no hydrogen 3.112 N/A HIS 84.A N VAL 80.A O no hydrogen 3.266 N/A HIS 84.A N SER 81.A O no hydrogen 2.548 N/A GLN 85.A N SER 81.A O no hydrogen 3.129 N/A GLU 86.A N GLU 82.A O no hydrogen 3.489 N/A VAL 87.A N LEU 83.A O no hydrogen 3.070 N/A LYS 88.A N HIS 84.A O no hydrogen 2.880 N/A ASN 89.A N GLN 85.A O no hydrogen 2.590 N/A ASN 90.A N GLU 86.A O no hydrogen 2.875 N/A LEU 91.A N VAL 87.A O no hydrogen 3.045 N/A LEU 91.A N LYS 88.A O no hydrogen 2.552 N/A LEU 92.A N LYS 88.A O no hydrogen 2.836 N/A ASN 93.A N ASN 89.A O no hydrogen 2.610 N/A ASP 95.A N ASN 90.A O no hydrogen 3.134 N/A LEU 96.A N LEU 91.A O no hydrogen 2.694 N/A GLU 97.A N GLU 94.A O no hydrogen 3.163 N/A LYS 98.A N ASP 95.A O no hydrogen 3.022 N/A LYS 98.A NZ GLU 233.A OE1 no hydrogen 3.505 N/A LYS 98.A NZ ASP 237.A OD2 no hydrogen 2.759 N/A VAL 99.A N ASP 95.A O no hydrogen 3.411 N/A ASN 101.A N GLU 97.A O no hydrogen 3.039 N/A TRP 102.A N LYS 98.A O no hydrogen 2.704 N/A GLN 103.A N VAL 99.A O no hydrogen 2.997 N/A GLN 103.A NE2 ASN 26.A OD1 no hydrogen 3.142 N/A LYS 104.A N LYS 100.A O no hydrogen 3.271 N/A ASP 105.A N TRP 102.A O no hydrogen 2.964 N/A ALA 106.A N TRP 102.A O no hydrogen 3.221 N/A TYR 107.A OH ILE 18.A O no hydrogen 3.048 N/A HIS 108.A N GLU 117.A OE2 no hydrogen 2.748 N/A GLN 110.A N GLY 114.A O no hydrogen 2.970 N/A LYS 116.A N HIS 108.A O no hydrogen 2.892 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.569 N/A THR 118.A N PHE 115.A O no hydrogen 2.792 N/A THR 118.A OG1 ASP 19.A OD2 no hydrogen 3.547 N/A THR 118.A OG1 PHE 115.A O no hydrogen 2.591 N/A LYS 119.A N PHE 115.A O no hydrogen 3.156 N/A GLU 120.A N LYS 116.A O no hydrogen 3.176 N/A ALA 121.A N THR 118.A O no hydrogen 2.673 N/A GLU 122.A N THR 118.A O no hydrogen 2.802 N/A ASP 123.A N LYS 119.A O no hydrogen 2.983 N/A GLY 124.A N GLU 120.A O no hydrogen 3.419 N/A PHE 125.A N ALA 121.A O no hydrogen 3.023 N/A ARG 126.A N GLU 122.A O no hydrogen 2.681 N/A LYS 127.A N ASP 123.A O no hydrogen 2.930 N/A ALA 128.A N GLY 124.A O no hydrogen 3.377 N/A GLN 129.A N PHE 125.A O no hydrogen 3.177 N/A GLN 129.A N ARG 126.A O no hydrogen 3.232 N/A LYS 130.A N ARG 126.A O no hydrogen 2.809 N/A ALA 133.A N GLN 129.A O no hydrogen 2.486 N/A ALA 133.A N LYS 130.A O no hydrogen 3.015 N/A LYS 134.A N LYS 130.A O no hydrogen 3.392 N/A LYS 135.A NZ ASP 201.A OD2 no hydrogen 3.137 N/A MET 136.A N TRP 132.A O no hydrogen 3.290 N/A LYS 137.A N LYS 134.A O no hydrogen 3.128 N/A GLU 138.A N LYS 134.A O no hydrogen 2.948 N/A GLU 140.A N MET 136.A O no hydrogen 3.313 N/A ALA 141.A N LYS 137.A O no hydrogen 3.509 N/A ALA 142.A N GLU 138.A O no hydrogen 3.032 N/A LYS 144.A N GLU 140.A O no hydrogen 3.171 N/A ALA 145.A N ALA 141.A O no hydrogen 2.830 N/A HIS 147.A N LYS 143.A O no hydrogen 2.802 N/A LEU 148.A N LYS 144.A O no hydrogen 2.987 N/A ALA 149.A N ALA 145.A O no hydrogen 2.857 N/A CYS 150.A N TYR 146.A O no hydrogen 2.987 N/A CYS 150.A SG TYR 146.A O no hydrogen 2.876 N/A LYS 151.A N HIS 147.A O no hydrogen 3.147 N/A LYS 151.A N LEU 148.A O no hydrogen 3.212 N/A GLU 152.A N LEU 148.A O no hydrogen 3.162 N/A LEU 155.A N LYS 151.A O no hydrogen 2.908 N/A ALA 156.A N GLU 152.A O no hydrogen 3.235 N/A MET 157.A N GLU 153.A O no hydrogen 3.016 N/A THR 158.A N LYS 154.A O no hydrogen 3.168 N/A THR 158.A OG1 LYS 154.A O no hydrogen 2.717 N/A THR 158.A OG1 LEU 155.A O no hydrogen 3.351 N/A ARG 159.A N ALA 156.A O no hydrogen 3.185 N/A GLU 160.A N ALA 156.A O no hydrogen 2.859 N/A MET 161.A N MET 157.A O no hydrogen 2.766 N/A ASN 162.A N THR 158.A O no hydrogen 2.996 N/A LYS 164.A N MET 161.A O no hydrogen 3.237 N/A GLU 166.A N SER 163.A O no hydrogen 2.849 N/A GLU 172.A N THR 170.A OG1 no hydrogen 2.962 N/A GLN 174.A N THR 170.A O no hydrogen 2.924 N/A LYS 175.A N PRO 171.A O no hydrogen 2.919 N/A LYS 175.A N GLU 172.A O no hydrogen 3.036 N/A LYS 176.A N GLU 172.A O no hydrogen 2.941 N/A LEU 177.A N GLN 173.A O no hydrogen 3.280 N/A GLN 178.A N LYS 175.A O no hydrogen 2.966 N/A GLN 178.A NE2 GLN 178.A O no hydrogen 2.667 N/A ASP 179.A N LYS 175.A O no hydrogen 2.775 N/A LYS 180.A N LYS 176.A O no hydrogen 2.947 N/A ASP 182.A N GLN 178.A O no hydrogen 3.144 N/A LYS 183.A N ASP 179.A O no hydrogen 2.813 N/A CYS 184.A N LYS 180.A O no hydrogen 2.806 N/A CYS 184.A SG GLU 152.A O no hydrogen 3.698 N/A CYS 184.A SG LYS 180.A O no hydrogen 3.048 N/A LYS 185.A N VAL 181.A O no hydrogen 3.038 N/A GLN 186.A N ASP 182.A O no hydrogen 3.237 N/A GLN 186.A N LYS 183.A O no hydrogen 3.142 N/A ASP 187.A N LYS 183.A O no hydrogen 3.235 N/A VAL 188.A N CYS 184.A O no hydrogen 3.201 N/A GLN 189.A N LYS 185.A O no hydrogen 3.471 N/A LYS 190.A N GLN 186.A O no hydrogen 2.833 N/A THR 191.A N ASP 187.A O no hydrogen 2.646 N/A THR 191.A OG1 ASP 187.A O no hydrogen 2.758 N/A THR 191.A OG1 VAL 188.A O no hydrogen 3.050 N/A GLN 192.A N VAL 188.A O no hydrogen 2.689 N/A GLU 193.A N GLN 189.A O no hydrogen 3.016 N/A GLU 193.A N LYS 190.A O no hydrogen 3.189 N/A LYS 194.A N LYS 190.A O no hydrogen 3.015 N/A TYR 195.A N THR 191.A O no hydrogen 2.949 N/A GLU 196.A N GLN 192.A O no hydrogen 3.100 N/A LYS 197.A N GLU 193.A O no hydrogen 2.784 N/A LYS 197.A N LYS 194.A O no hydrogen 2.768 N/A VAL 198.A N LYS 194.A O no hydrogen 2.841 N/A GLU 200.A N GLU 196.A O no hydrogen 3.275 N/A ASP 201.A N LYS 197.A O no hydrogen 3.388 N/A GLY 203.A N LEU 199.A O no hydrogen 2.993 N/A LYS 204.A N ASP 201.A O no hydrogen 3.026 N/A THR 205.A N ASP 201.A O no hydrogen 3.192 N/A THR 206.A OG1 GLY 203.A O no hydrogen 3.222 N/A TYR 209.A N THR 205.A O no hydrogen 3.076 N/A TYR 209.A N THR 206.A O no hydrogen 2.760 N/A TYR 209.A OH TRP 6.A O no hydrogen 3.357 N/A MET 210.A N THR 206.A O no hydrogen 2.614 N/A GLU 211.A N PRO 207.A O no hydrogen 2.729 N/A ASN 212.A N GLN 208.A O no hydrogen 3.209 N/A ASN 212.A N TYR 209.A O no hydrogen 3.161 N/A MET 213.A N TYR 209.A O no hydrogen 2.930 N/A PHE 217.A N MET 213.A O no hydrogen 3.254 N/A GLU 218.A N GLU 214.A O no hydrogen 3.276 N/A GLN 219.A N GLN 215.A O no hydrogen 3.212 N/A CYS 220.A N PHE 217.A O no hydrogen 2.685 N/A GLN 222.A N GLU 218.A O no hydrogen 2.990 N/A GLU 225.A N GLN 221.A O no hydrogen 3.136 N/A ARG 227.A N GLU 224.A O no hydrogen 3.248 N/A LEU 228.A N GLU 224.A O no hydrogen 3.090 N/A VAL 229.A N GLU 225.A O no hydrogen 3.227 N/A LEU 231.A N ARG 227.A O no hydrogen 2.498 N/A GLU 233.A N PHE 230.A O no hydrogen 2.638 N/A VAL 234.A N PHE 230.A O no hydrogen 3.099 N/A LEU 235.A N LEU 231.A O no hydrogen 3.012 N/A LEU 236.A N GLU 233.A O no hydrogen 2.773 N/A ASP 237.A N GLU 233.A O no hydrogen 2.861 N/A ILE 238.A N VAL 234.A O no hydrogen 2.709 N/A ARG 240.A N LEU 236.A O no hydrogen 2.997 N/A ARG 240.A NH1 ASP 237.A OD1 no hydrogen 2.473 N/A ARG 240.A NH2 ASP 237.A OD1 no hydrogen 2.641 N/A HIS 241.A N ASP 237.A O no hydrogen 2.993 N/A LEU 242.A N ILE 238.A O no hydrogen 3.205 N/A ASN 243.A N LYS 239.A O no hydrogen 3.207 N/A ASN 243.A N ARG 240.A O no hydrogen 2.873 N/A ASN 247.A N LEU 244.A O no hydrogen 2.473 N/A TYR 250.A N ASN 247.A O no hydrogen 3.022 N/A HIS 252.A N SER 248.A O no hydrogen 3.317 N/A VAL 253.A N SER 249.A O no hydrogen 3.124 N/A VAL 253.A N TYR 250.A O no hydrogen 2.734 N/A TYR 254.A OH GLU 76.A OE1 no hydrogen 2.485 N/A ARG 255.A N ILE 251.A O no hydrogen 3.227 N/A GLU 256.A N HIS 252.A O no hydrogen 2.699 N/A LEU 257.A N VAL 253.A O no hydrogen 2.818 N/A GLU 258.A N TYR 254.A O no hydrogen 3.142 N/A GLN 259.A N ARG 255.A O no hydrogen 3.046 N/A ALA 260.A N GLU 256.A O no hydrogen 3.037 N/A ILE 261.A N LEU 257.A O no hydrogen 3.109 N/A ARG 262.A N GLU 258.A O no hydrogen 3.184 N/A ARG 262.A NE GLU 258.A OE1 no hydrogen 2.899 N/A GLY 263.A N GLN 259.A O no hydrogen 3.089 N/A ALA 264.A N ILE 261.A O no hydrogen 2.630 N/A ASP 265.A N SER 65.A OG no hydrogen 3.005 N/A ASP 269.A N ASP 265.A O no hydrogen 3.180 N/A LEU 270.A N ALA 266.A O no hydrogen 2.652 N/A ARG 271.A N GLN 267.A O no hydrogen 2.719 N/A TRP 272.A N GLU 268.A O no hydrogen 2.875 N/A PHE 273.A N ASP 269.A O no hydrogen 2.912 N/A ARG 274.A N LEU 270.A O no hydrogen 2.913 N/A SER 275.A N ARG 271.A O no hydrogen 2.973 N/A SER 275.A N TRP 272.A O no hydrogen 3.144 N/A THR 276.A N TRP 272.A O no hydrogen 2.946 N/A THR 276.A OG1 TRP 272.A O no hydrogen 3.156 N/A SER 277.A N PHE 273.A O no hydrogen 2.609 N/A GLY 278.A N ARG 274.A O no hydrogen 3.058 N/A GLY 280.A N ARG 274.A O no hydrogen 3.214 N/A MET 281.A N GLY 278.A O no hydrogen 2.884 N/A