Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iap_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N MET 1.A O no hydrogen 2.892 N/A ILE 6.A N PHE 2.A O no hydrogen 2.734 N/A LEU 7.A N PHE 3.A O no hydrogen 2.661 N/A THR 8.A N ILE 4.A O no hydrogen 2.754 N/A THR 8.A OG1 ASN 5.A O no hydrogen 2.606 N/A LEU 9.A N ASN 5.A O no hydrogen 3.052 N/A LEU 9.A N ILE 6.A O no hydrogen 3.280 N/A LEU 10.A N ILE 6.A O no hydrogen 3.104 N/A VAL 11.A N LEU 7.A O no hydrogen 2.985 N/A ILE 13.A N LEU 9.A O no hydrogen 3.349 N/A LEU 14.A N LEU 10.A O no hydrogen 2.877 N/A ILE 15.A N VAL 11.A O no hydrogen 2.983 N/A ALA 16.A N PRO 12.A O no hydrogen 2.854 N/A MET 17.A N ILE 13.A O no hydrogen 2.750 N/A ALA 18.A N LEU 14.A O no hydrogen 3.018 N/A PHE 19.A N ILE 15.A O no hydrogen 3.100 N/A LEU 20.A N ALA 16.A O no hydrogen 2.969 N/A LEU 20.A N MET 17.A O no hydrogen 3.035 N/A THR 21.A N MET 17.A O no hydrogen 3.446 N/A THR 21.A N ALA 18.A O no hydrogen 3.079 N/A THR 21.A OG1 ALA 18.A O no hydrogen 2.483 N/A VAL 23.A N PHE 19.A O no hydrogen 2.798 N/A GLU 24.A N LEU 20.A O no hydrogen 2.702 N/A ARG 25.A N THR 21.A O no hydrogen 3.071 N/A ARG 25.A N LEU 22.A O no hydrogen 2.850 N/A LYS 26.A N VAL 23.A O no hydrogen 3.351 N/A LYS 26.A NZ PRO 37.A O no hydrogen 3.413 N/A ILE 27.A N VAL 23.A O no hydrogen 3.095 N/A TYR 30.A N LYS 26.A O no hydrogen 2.787 N/A MET 31.A N ILE 27.A O no hydrogen 3.231 N/A GLN 32.A N LEU 28.A O no hydrogen 3.089 N/A LEU 33.A N TYR 30.A O no hydrogen 3.222 N/A ARG 34.A N GLY 29.A O no hydrogen 3.019 N/A ARG 34.A NE GLN 32.A OE1 no hydrogen 3.551 N/A ILE 45.A N PRO 42.A O no hydrogen 3.244 N/A GLN 47.A N GLY 44.A O no hydrogen 3.035 N/A ALA 50.A N LEU 46.A O no hydrogen 3.156 N/A MET 53.A N PHE 49.A O no hydrogen 3.108 N/A LYS 54.A N ALA 50.A O no hydrogen 3.114 N/A LEU 55.A N ASP 51.A O no hydrogen 2.523 N/A PHE 56.A N ALA 52.A O no hydrogen 2.965 N/A MET 57.A N MET 53.A O no hydrogen 3.150 N/A LYS 58.A N LYS 54.A O no hydrogen 3.106 N/A THR 65.A OG1 THR 65.A O no hydrogen 2.661 N/A THR 65.A OG1 ASN 124.A O no hydrogen 3.371 N/A THR 66.A OG1 SER 67.A O no hydrogen 3.189 N/A THR 66.A OG1 ALA 122.A O no hydrogen 2.869 N/A SER 67.A N ALA 122.A O no hydrogen 3.227 N/A SER 69.A N SER 67.A OG no hydrogen 3.265 N/A LEU 70.A N SER 67.A OG no hydrogen 3.365 N/A ILE 73.A N SER 69.A O no hydrogen 2.607 N/A THR 76.A OG1 ILE 72.A O no hydrogen 3.399 N/A THR 76.A OG1 ILE 73.A O no hydrogen 2.565 N/A LEU 77.A N ILE 73.A O no hydrogen 2.768 N/A SER 78.A N ALA 74.A O no hydrogen 3.029 N/A SER 78.A OG ALA 74.A O no hydrogen 3.091 N/A SER 78.A OG SER 115.A OG no hydrogen 2.880 N/A LEU 79.A N PRO 75.A O no hydrogen 2.949 N/A THR 80.A N THR 76.A O no hydrogen 2.787 N/A THR 80.A OG1 THR 76.A O no hydrogen 2.721 N/A LEU 81.A N LEU 77.A O no hydrogen 2.856 N/A ALA 82.A N SER 78.A O no hydrogen 3.208 N/A LEU 83.A N LEU 79.A O no hydrogen 3.018 N/A SER 84.A N THR 80.A O no hydrogen 2.927 N/A SER 84.A OG THR 80.A O no hydrogen 2.499 N/A LEU 85.A N LEU 81.A O no hydrogen 2.885 N/A TRP 86.A N LEU 83.A O no hydrogen 3.199 N/A VAL 87.A N SER 84.A O no hydrogen 2.799 N/A ASN 97.A ND2 GLN 163.A OE1 no hydrogen 3.659 N/A ILE 102.A N TYR 160.A O no hydrogen 2.767 N/A PHE 104.A N LEU 100.A O no hydrogen 3.376 N/A ILE 105.A N GLY 101.A O no hydrogen 3.159 N/A LEU 106.A N ILE 102.A O no hydrogen 2.858 N/A ALA 107.A N LEU 103.A O no hydrogen 2.847 N/A THR 108.A N PHE 104.A O no hydrogen 2.835 N/A THR 108.A OG1 PHE 104.A O no hydrogen 2.665 N/A SER 109.A N ILE 105.A O no hydrogen 2.998 N/A SER 109.A OG ILE 105.A O no hydrogen 2.836 N/A SER 110.A N LEU 106.A O no hydrogen 3.037 N/A SER 110.A OG LEU 106.A O no hydrogen 2.790 N/A SER 110.A OG GLU 143.A OE2 no hydrogen 3.245 N/A LEU 111.A N ALA 107.A O no hydrogen 3.193 N/A LEU 111.A N THR 108.A O no hydrogen 3.205 N/A SER 112.A N SER 109.A O no hydrogen 2.936 N/A SER 112.A OG SER 109.A O no hydrogen 2.630 N/A VAL 113.A N SER 110.A O no hydrogen 3.253 N/A TYR 114.A N LEU 111.A O no hydrogen 3.191 N/A SER 115.A OG SER 78.A OG no hydrogen 2.880 N/A SER 115.A OG SER 112.A O no hydrogen 2.605 N/A LEU 117.A N VAL 113.A O no hydrogen 3.019 N/A TRP 118.A N TYR 114.A O no hydrogen 2.503 N/A SER 119.A N SER 115.A O no hydrogen 2.816 N/A SER 119.A OG SER 115.A O no hydrogen 2.974 N/A SER 119.A OG ILE 116.A O no hydrogen 2.859 N/A GLY 120.A N ILE 116.A O no hydrogen 3.001 N/A TRP 121.A N LEU 117.A O no hydrogen 3.044 N/A ALA 122.A N TRP 118.A O no hydrogen 2.821 N/A SER 123.A N SER 119.A O no hydrogen 3.027 N/A SER 123.A OG SER 119.A O no hydrogen 3.202 N/A ASN 124.A N TRP 121.A O no hydrogen 3.345 N/A SER 128.A OG SER 125.A OG no hydrogen 3.408 N/A SER 128.A OG GLY 209.A O no hydrogen 3.549 N/A LEU 129.A N SER 125.A O no hydrogen 3.352 N/A PHE 130.A N LYS 126.A O no hydrogen 3.121 N/A GLY 131.A N TYR 127.A O no hydrogen 3.042 N/A ALA 132.A N SER 128.A O no hydrogen 2.861 N/A LEU 133.A N LEU 129.A O no hydrogen 3.010 N/A ARG 134.A N PHE 130.A O no hydrogen 3.254 N/A ALA 135.A N GLY 131.A O no hydrogen 2.819 N/A VAL 136.A N ALA 132.A O no hydrogen 2.689 N/A ALA 137.A N LEU 133.A O no hydrogen 3.226 N/A GLN 138.A N ARG 134.A O no hydrogen 2.957 N/A GLN 138.A NE2 PHE 198.A O no hydrogen 3.123 N/A THR 139.A N ALA 135.A O no hydrogen 2.919 N/A THR 139.A OG1 ALA 135.A O no hydrogen 3.235 N/A ILE 140.A N VAL 136.A O no hydrogen 2.776 N/A SER 141.A N ALA 137.A O no hydrogen 2.830 N/A SER 141.A OG ALA 137.A O no hydrogen 2.683 N/A TYR 142.A N GLN 138.A O no hydrogen 2.944 N/A TYR 142.A OH LEU 284.A O no hydrogen 3.208 N/A GLU 143.A N ILE 140.A O no hydrogen 2.771 N/A VAL 144.A N ILE 140.A O no hydrogen 3.283 N/A VAL 144.A N SER 141.A O no hydrogen 3.009 N/A THR 145.A OG1 THR 296.A OG1 no hydrogen 3.093 N/A ALA 147.A N GLU 143.A O no hydrogen 2.706 N/A ILE 148.A N VAL 144.A O no hydrogen 3.258 N/A ILE 149.A N THR 145.A O no hydrogen 2.868 N/A LEU 150.A N MET 146.A O no hydrogen 3.230 N/A LEU 151.A N ALA 147.A O no hydrogen 2.983 N/A SER 152.A N ILE 148.A O no hydrogen 3.030 N/A SER 152.A OG ILE 148.A O no hydrogen 3.448 N/A VAL 153.A N ILE 149.A O no hydrogen 3.232 N/A LEU 154.A N LEU 150.A O no hydrogen 2.756 N/A LEU 155.A N LEU 151.A O no hydrogen 3.104 N/A MET 156.A N VAL 153.A O no hydrogen 2.678 N/A ASN 157.A N LEU 154.A O no hydrogen 2.502 N/A ASN 157.A ND2 SER 159.A O no hydrogen 2.835 N/A ASN 157.A ND2 THR 164.A OG1 no hydrogen 2.488 N/A GLY 158.A N LEU 154.A O no hydrogen 2.621 N/A SER 161.A N SER 159.A OG no hydrogen 3.118 N/A SER 161.A OG LEU 98.A O no hydrogen 3.486 N/A THR 164.A N SER 161.A O no hydrogen 3.151 N/A THR 164.A OG1 ASN 157.A OD1 no hydrogen 2.655 N/A THR 164.A OG1 SER 161.A O no hydrogen 2.639 N/A LEU 165.A N LEU 162.A O no hydrogen 3.418 N/A THR 167.A N THR 164.A O no hydrogen 2.974 N/A THR 167.A OG1 THR 164.A O no hydrogen 2.435 N/A THR 168.A N THR 164.A O no hydrogen 2.926 N/A THR 168.A OG1 ASN 157.A OD1 no hydrogen 2.892 N/A THR 168.A OG1 THR 164.A O no hydrogen 3.242 N/A GLN 169.A N LEU 165.A O no hydrogen 2.714 N/A GLN 169.A NE2 ILE 240.A O no hydrogen 2.894 N/A GLN 169.A NE2 PHE 241.A O no hydrogen 2.899 N/A MET 181.A N ALA 178.A O no hydrogen 3.244 N/A ALA 182.A N ALA 178.A O no hydrogen 3.317 N/A ALA 182.A N TRP 179.A O no hydrogen 2.701 N/A MET 183.A N TRP 179.A O no hydrogen 3.210 N/A TRP 185.A N ALA 182.A O no hydrogen 2.686 N/A PHE 186.A N ALA 182.A O no hydrogen 2.536 N/A ILE 187.A N MET 183.A O no hydrogen 2.887 N/A SER 188.A OG MET 184.A O no hydrogen 2.954 N/A THR 189.A N TRP 185.A O no hydrogen 2.715 N/A THR 189.A OG1 TRP 185.A O no hydrogen 3.306 N/A THR 189.A OG1 PHE 186.A O no hydrogen 2.609 N/A LEU 190.A N PHE 186.A O no hydrogen 2.944 N/A LEU 190.A N ILE 187.A O no hydrogen 2.958 N/A ALA 191.A N ILE 187.A O no hydrogen 3.040 N/A GLU 192.A N SER 188.A O no hydrogen 2.944 N/A THR 193.A OG1 THR 189.A O no hydrogen 2.980 N/A THR 193.A OG1 LEU 190.A O no hydrogen 3.364 N/A ASN 194.A N ALA 191.A O no hydrogen 2.954 N/A ARG 195.A N LEU 190.A O no hydrogen 3.092 N/A ARG 195.A NH1 GLU 24.A OE1 no hydrogen 3.183 N/A ARG 195.A NH1 GLU 24.A OE2 no hydrogen 3.172 N/A ARG 195.A NH2 GLU 24.A OE2 no hydrogen 2.819 N/A THR 201.A OG1 GLN 138.A OE1 no hydrogen 2.557 N/A THR 201.A OG1 ASN 194.A OD1 no hydrogen 2.584 N/A SER 205.A OG GLU 206.A OE1 no hydrogen 2.664 N/A TYR 214.A N ASN 211.A O no hydrogen 2.718 N/A TYR 214.A OH PHE 71.A O no hydrogen 2.458 N/A ALA 220.A N ALA 216.A O no hydrogen 2.989 N/A LEU 221.A N GLY 217.A O no hydrogen 3.070 N/A PHE 222.A N PRO 218.A O no hydrogen 3.396 N/A PHE 223.A N PHE 219.A O no hydrogen 2.884 N/A MET 224.A N ALA 220.A O no hydrogen 2.489 N/A ALA 225.A N LEU 221.A O no hydrogen 2.770 N/A GLU 226.A N PHE 222.A O no hydrogen 2.709 N/A TYR 227.A N PHE 223.A O no hydrogen 3.278 N/A TYR 227.A OH GLU 24.A OE1 no hydrogen 2.994 N/A THR 228.A N MET 224.A O no hydrogen 2.961 N/A THR 228.A OG1 MET 224.A O no hydrogen 3.303 N/A ASN 229.A N ALA 225.A O no hydrogen 2.858 N/A ILE 230.A N GLU 226.A O no hydrogen 2.732 N/A ILE 231.A N TYR 227.A O no hydrogen 3.063 N/A LEU 232.A N THR 228.A O no hydrogen 2.760 N/A MET 233.A N ASN 229.A O no hydrogen 2.887 N/A ASN 234.A N ILE 230.A O no hydrogen 3.468 N/A ASN 234.A ND2 ILE 230.A O no hydrogen 2.791 N/A ALA 235.A N ILE 231.A O no hydrogen 2.731 N/A LEU 236.A N LEU 232.A O no hydrogen 2.788 N/A THR 237.A N MET 233.A O no hydrogen 2.947 N/A THR 237.A OG1 MET 233.A O no hydrogen 3.445 N/A THR 238.A N ASN 234.A O no hydrogen 2.882 N/A THR 238.A OG1 ASN 234.A O no hydrogen 3.221 N/A ILE 239.A N LEU 236.A O no hydrogen 3.111 N/A ILE 240.A N LEU 236.A O no hydrogen 2.844 N/A PHE 241.A N THR 237.A O no hydrogen 3.060 N/A LEU 242.A N THR 237.A O no hydrogen 3.080 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.576 N/A SER 255.A OG GLU 252.A O no hydrogen 2.569 N/A THR 256.A N GLU 252.A O no hydrogen 2.429 N/A THR 256.A OG1 GLU 252.A O no hydrogen 2.581 N/A ASN 257.A N LEU 253.A O no hydrogen 2.876 N/A ASN 257.A ND2 LEU 253.A O no hydrogen 2.790 N/A PHE 258.A N TYR 254.A O no hydrogen 2.832 N/A MET 259.A N SER 255.A O no hydrogen 2.599 N/A MET 260.A N THR 256.A O no hydrogen 2.906 N/A GLU 261.A N ASN 257.A O no hydrogen 2.798 N/A ALA 262.A N PHE 258.A O no hydrogen 2.903 N/A LEU 263.A N MET 259.A O no hydrogen 2.979 N/A LEU 264.A N MET 260.A O no hydrogen 3.090 N/A LEU 265.A N GLU 261.A O no hydrogen 3.004 N/A SER 266.A N ALA 262.A O no hydrogen 2.795 N/A SER 266.A OG ALA 262.A O no hydrogen 3.236 N/A SER 267.A N LEU 263.A O no hydrogen 2.653 N/A SER 267.A OG LEU 263.A O no hydrogen 2.802 N/A THR 268.A N LEU 264.A O no hydrogen 2.797 N/A THR 268.A OG1 LEU 264.A O no hydrogen 2.728 N/A PHE 269.A N LEU 265.A O no hydrogen 3.388 N/A TRP 271.A N SER 267.A O no hydrogen 2.833 N/A ILE 272.A N THR 268.A O no hydrogen 2.642 N/A ARG 273.A N PHE 269.A O no hydrogen 2.938 N/A ALA 274.A N LEU 270.A O no hydrogen 3.388 N/A SER 275.A N TRP 271.A O no hydrogen 3.106 N/A SER 275.A OG TRP 271.A O no hydrogen 3.027 N/A TYR 276.A N ILE 272.A O no hydrogen 2.988 N/A ARG 278.A NH2 GLU 206.A OE1 no hydrogen 2.652 N/A PHE 279.A N PRO 197.A O no hydrogen 3.131 N/A LEU 284.A N ARG 280.A O no hydrogen 2.701 N/A MET 285.A N TYR 281.A O no hydrogen 3.311 N/A HIS 286.A N ASP 282.A O no hydrogen 2.658 N/A LEU 287.A N GLN 283.A O no hydrogen 3.044 N/A LEU 288.A N LEU 284.A O no hydrogen 3.307 N/A TRP 289.A N MET 285.A O no hydrogen 2.922 N/A LYS 290.A N HIS 286.A O no hydrogen 2.908 N/A ASN 291.A N HIS 286.A O no hydrogen 3.399 N/A PHE 292.A N LEU 287.A O no hydrogen 2.830 N/A LEU 293.A N LEU 288.A O no hydrogen 2.671 N/A THR 296.A N PHE 292.A O no hydrogen 2.657 N/A THR 296.A OG1 THR 145.A OG1 no hydrogen 3.093 N/A THR 296.A OG1 PHE 292.A O no hydrogen 2.788 N/A LEU 297.A N LEU 293.A O no hydrogen 2.820 N/A ALA 298.A N PRO 294.A O no hydrogen 3.162 N/A LEU 299.A N LEU 295.A O no hydrogen 2.898 N/A CYS 300.A N THR 296.A O no hydrogen 2.646 N/A MET 301.A N LEU 297.A O no hydrogen 3.096 N/A TRP 302.A N ALA 298.A O no hydrogen 3.024 N/A HIS 303.A N LEU 299.A O no hydrogen 3.126 N/A HIS 303.A N CYS 300.A O no hydrogen 2.900 N/A ILE 304.A N MET 301.A O no hydrogen 2.954 N/A SER 305.A N TRP 302.A O no hydrogen 3.340 N/A LEU 306.A N TRP 302.A O no hydrogen 2.743 N/A PHE 309.A N SER 305.A O no hydrogen 3.188 N/A THR 310.A OG1 LEU 306.A O no hydrogen 2.280 N/A ALA 311.A N ILE 308.A O no hydrogen 2.855 N/A GLY 312.A N PRO 307.A O no hydrogen 2.725 N/A