Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a1j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 116.A OD2 no hydrogen 3.199 N/A ILE 4.A N ASN 126.A OD1 no hydrogen 2.806 N/A SER 5.A N LYS 16.A O no hydrogen 2.725 N/A SER 7.A N LEU 14.A O no hydrogen 2.828 N/A SER 7.A OG GLU 9.A OE2 no hydrogen 3.013 N/A GLU 9.A N SER 12.A O no hydrogen 2.795 N/A GLY 10.A N ASP 8.A OD1 no hydrogen 2.986 N/A ASP 11.A N GLU 9.A O no hydrogen 3.048 N/A SER 12.A OG ASP 11.A OD1 no hydrogen 2.671 N/A PHE 13.A N ILE 24.A O no hydrogen 3.007 N/A LEU 14.A N SER 7.A O no hydrogen 2.773 N/A VAL 15.A N ASN 22.A O no hydrogen 2.786 N/A LYS 16.A N SER 5.A O no hydrogen 2.784 N/A ASP 17.A N GLY 20.A O no hydrogen 2.926 N/A SER 18.A OG LEU 2.A O no hydrogen 3.310 N/A ASN 22.A N VAL 15.A O no hydrogen 2.766 N/A ASN 22.A ND2 THR 110.A O no hydrogen 2.954 N/A ILE 24.A N PHE 13.A O no hydrogen 2.899 N/A LYS 26.A N ASP 11.A O no hydrogen 2.898 N/A LYS 26.A NZ ASP 8.A OD1 no hydrogen 2.897 N/A LYS 26.A NZ GLY 10.A O no hydrogen 2.957 N/A ASN 27.A N LEU 134.A O no hydrogen 2.968 N/A SER 29.A N ASP 89.A OD2 no hydrogen 2.452 N/A SER 29.A OG ASP 89.A OD2 no hydrogen 2.739 N/A LYS 30.A N ASP 89.A OD1 no hydrogen 2.788 N/A LYS 30.A N ASP 89.A OD2 no hydrogen 3.270 N/A LYS 30.A NZ LEU 86.A O no hydrogen 3.471 N/A LYS 30.A NZ LYS 87.A O no hydrogen 3.073 N/A VAL 31.A N LYS 50.A O no hydrogen 2.730 N/A VAL 32.A N LEU 90.A O no hydrogen 3.038 N/A ILE 33.A N GLY 53.A O no hydrogen 3.388 N/A LEU 34.A N ILE 92.A O no hydrogen 2.866 N/A ILE 38.A N ASP 35.A O no hydrogen 3.008 N/A ILE 38.A N ASP 35.A OD1 no hydrogen 2.984 N/A LEU 39.A N ASP 35.A O no hydrogen 3.207 N/A ASP 40.A N LEU 36.A O no hydrogen 3.321 N/A THR 41.A N GLY 37.A O no hydrogen 3.176 N/A PHE 42.A N ILE 38.A O no hydrogen 2.883 N/A ASP 43.A N LEU 39.A O no hydrogen 3.207 N/A ALA 44.A N ASP 40.A O no hydrogen 2.811 N/A LEU 45.A N THR 41.A O no hydrogen 2.962 N/A LYS 46.A N ASP 43.A O no hydrogen 2.869 N/A LEU 47.A N PHE 42.A O no hydrogen 2.832 N/A ASN 48.A ND2 ASP 43.A OD1 no hydrogen 2.476 N/A LYS 50.A N LEU 47.A O no hydrogen 2.721 N/A VAL 51.A N ASN 48.A O no hydrogen 3.167 N/A VAL 52.A N VAL 31.A O no hydrogen 3.274 N/A VAL 54.A N PRO 70.A O no hydrogen 2.947 N/A ALA 56.A N SER 71.A OG no hydrogen 2.934 N/A LYS 57.A N GLY 73.A O no hydrogen 3.062 N/A LEU 59.A N ALA 56.A O no hydrogen 3.237 N/A LYS 61.A N GLU 263.A OE1 no hydrogen 2.875 N/A TYR 62.A OH ASP 40.A OD2 no hydrogen 2.965 N/A LEU 63.A N PRO 60.A O no hydrogen 2.845 N/A GLN 64.A NE2 LEU 59.A O no hydrogen 3.097 N/A GLN 64.A NE2 PRO 60.A O no hydrogen 3.536 N/A GLN 65.A N GLN 65.A OE1 no hydrogen 2.693 N/A GLN 65.A NE2 ASP 43.A OD2 no hydrogen 3.108 N/A PHE 66.A N LEU 63.A O no hydrogen 2.816 N/A LYS 69.A N PHE 66.A O no hydrogen 3.045 N/A LYS 69.A NZ ASN 48.A O no hydrogen 3.217 N/A LYS 69.A NZ VAL 51.A O no hydrogen 2.947 N/A SER 71.A OG VAL 54.A O no hydrogen 3.539 N/A VAL 72.A N VAL 54.A O no hydrogen 2.941 N/A GLY 73.A N SER 71.A OG no hydrogen 3.358 N/A GLY 74.A N GLN 77.A O no hydrogen 3.105 N/A VAL 75.A N ASN 58.A OD1 no hydrogen 3.261 N/A ASP 79.A N VAL 72.A O no hydrogen 2.689 N/A ALA 82.A N ASP 79.A OD1 no hydrogen 3.016 N/A ILE 83.A N ASP 79.A O no hydrogen 3.289 N/A ASN 84.A N PHE 80.A O no hydrogen 2.756 N/A ASN 84.A ND2 PHE 80.A O no hydrogen 2.502 N/A ALA 85.A N GLU 81.A O no hydrogen 3.101 N/A LEU 86.A N ALA 82.A O no hydrogen 3.268 N/A LYS 87.A N ASN 84.A O no hydrogen 3.194 N/A ILE 91.A N PRO 109.A O no hydrogen 2.956 N/A ILE 92.A N VAL 32.A O no hydrogen 2.843 N/A ILE 93.A N LEU 111.A O no hydrogen 2.993 N/A SER 94.A N GLN 97.A OE1 no hydrogen 3.161 N/A SER 94.A OG ASP 35.A OD2 no hydrogen 2.976 N/A ARG 96.A NE GLN 76.A OE1 no hydrogen 3.238 N/A ARG 96.A NH1 TYR 266.A O no hydrogen 3.318 N/A ARG 96.A NH1 LEU 267.A O no hydrogen 3.318 N/A ARG 96.A NH2 TYR 266.A O no hydrogen 2.668 N/A GLN 97.A N SER 94.A O no hydrogen 3.042 N/A GLN 97.A NE2 LEU 34.A O no hydrogen 3.303 N/A GLN 97.A NE2 VAL 75.A O no hydrogen 2.939 N/A SER 98.A OG SER 94.A O no hydrogen 3.515 N/A SER 98.A OG GLY 95.A O no hydrogen 3.439 N/A PHE 100.A N GLN 97.A O no hydrogen 2.715 N/A LEU 104.A N PHE 100.A O no hydrogen 3.170 N/A LYS 105.A NZ GLU 21.A O no hydrogen 2.953 N/A LYS 105.A NZ TYR 101.A OH no hydrogen 2.721 N/A GLU 106.A N ASP 102.A O no hydrogen 3.317 N/A GLU 106.A N LYS 103.A O no hydrogen 3.165 N/A ILE 107.A N LEU 104.A O no hydrogen 3.050 N/A ALA 108.A N LEU 104.A O no hydrogen 3.203 N/A THR 110.A N ASN 22.A OD1 no hydrogen 2.920 N/A THR 110.A OG1 ALA 108.A O no hydrogen 3.248 N/A LEU 111.A N ILE 91.A O no hydrogen 2.867 N/A PHE 112.A N ASP 17.A OD2 no hydrogen 3.137 N/A VAL 113.A N ILE 93.A O no hydrogen 2.965 N/A ASP 116.A N SER 123.A OG no hydrogen 3.179 N/A ALA 118.A N ASP 116.A OD1 no hydrogen 2.994 N/A ASN 119.A N ASP 116.A O no hydrogen 2.943 N/A ASN 119.A ND2 ASP 116.A OD2 no hydrogen 2.731 N/A SER 123.A N ASN 119.A O no hydrogen 3.091 N/A SER 123.A N PHE 120.A O no hydrogen 3.124 N/A SER 123.A OG ASN 119.A O no hydrogen 2.950 N/A SER 123.A OG PHE 120.A O no hydrogen 2.904 N/A PHE 124.A N PHE 120.A O no hydrogen 2.863 N/A GLU 125.A N LEU 121.A O no hydrogen 3.015 N/A ASN 126.A N SER 122.A O no hydrogen 3.004 N/A ASN 126.A ND2 ILE 4.A O no hydrogen 3.500 N/A ASN 127.A N SER 123.A O no hydrogen 2.834 N/A ASN 127.A ND2 GLY 114.A O no hydrogen 3.284 N/A ASN 127.A ND2 ASN 271.A OD1 no hydrogen 2.970 N/A VAL 128.A N PHE 124.A O no hydrogen 2.852 N/A LEU 129.A N GLU 125.A O no hydrogen 2.553 N/A SER 130.A N ASN 126.A O no hydrogen 2.991 N/A SER 130.A OG ASN 126.A O no hydrogen 2.738 N/A VAL 131.A N ASN 127.A O no hydrogen 3.192 N/A VAL 131.A N VAL 128.A O no hydrogen 3.192 N/A ALA 132.A N VAL 128.A O no hydrogen 2.858 N/A LYS 133.A N LEU 129.A O no hydrogen 2.804 N/A LEU 134.A N VAL 131.A O no hydrogen 3.134 N/A TYR 135.A N ALA 132.A O no hydrogen 2.726 N/A TYR 135.A OH PRO 28.A O no hydrogen 2.554 N/A GLY 136.A N LYS 133.A O no hydrogen 3.060 N/A LEU 137.A N ALA 132.A O no hydrogen 3.017 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.886 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.622 N/A ALA 141.A N LEU 137.A O no hydrogen 3.129 N/A LEU 142.A N GLU 138.A O no hydrogen 2.792 N/A GLU 143.A N LYS 139.A O no hydrogen 3.160 N/A LYS 144.A N GLU 140.A O no hydrogen 3.050 N/A ILE 145.A N ALA 141.A O no hydrogen 2.778 N/A SER 146.A N LEU 142.A O no hydrogen 2.876 N/A ASP 147.A N GLU 143.A O no hydrogen 3.140 N/A ILE 148.A N LYS 144.A O no hydrogen 3.081 N/A LYS 149.A N ILE 145.A O no hydrogen 2.839 N/A ASN 150.A N SER 146.A O no hydrogen 2.927 N/A GLU 151.A N ASP 147.A O no hydrogen 3.244 N/A ILE 152.A N ILE 148.A O no hydrogen 3.008 N/A GLU 153.A N LYS 149.A O no hydrogen 2.948 N/A LYS 154.A N ASN 150.A O no hydrogen 2.723 N/A LYS 154.A NZ GLU 151.A OE1 no hydrogen 3.094 N/A ALA 155.A N GLU 151.A O no hydrogen 2.732 N/A LYS 156.A N ILE 152.A O no hydrogen 2.832 N/A SER 157.A N GLU 153.A O no hydrogen 3.121 N/A SER 157.A OG GLU 153.A O no hydrogen 2.781 N/A ILE 158.A N ALA 155.A O no hydrogen 3.225 N/A VAL 159.A N LYS 156.A O no hydrogen 3.254 N/A ASP 162.A N ASP 160.A OD1 no hydrogen 2.995 N/A LYS 163.A N ASP 160.A O no hydrogen 3.040 N/A LYS 164.A N ASP 220.A OD2 no hydrogen 2.775 N/A ALA 165.A N ASN 194.A O no hydrogen 2.746 N/A LEU 166.A N TYR 221.A O no hydrogen 2.929 N/A ILE 168.A N PHE 223.A O no hydrogen 2.808 N/A LEU 169.A N SER 176.A O no hydrogen 2.853 N/A THR 170.A N VAL 225.A O no hydrogen 3.092 N/A THR 170.A OG1 ASP 226.A OD1 no hydrogen 2.962 N/A ASN 171.A N LYS 174.A O no hydrogen 2.988 N/A SER 172.A N ASN 228.A OD1 no hydrogen 2.805 N/A ASN 173.A N SER 172.A OG no hydrogen 2.595 N/A LYS 174.A N ASN 171.A O no hydrogen 2.805 N/A SER 176.A N LEU 169.A O no hydrogen 3.032 N/A SER 176.A OG HIS 205.A O no hydrogen 2.840 N/A ALA 177.A N LYS 207.A O no hydrogen 2.833 N/A PHE 178.A N ILE 167.A O no hydrogen 3.059 N/A GLN 181.A N ASP 189.A OD2 no hydrogen 2.840 N/A SER 182.A OG GLY 179.A O no hydrogen 2.751 N/A ARG 183.A NH1 THR 204.A O no hydrogen 2.925 N/A GLY 185.A N SER 182.A O no hydrogen 2.861 N/A ILE 187.A N PHE 184.A O no hydrogen 3.292 N/A HIS 188.A ND1 ILE 193.A O no hydrogen 2.776 N/A ASP 189.A N GLY 185.A O no hydrogen 2.774 N/A VAL 190.A N ILE 186.A O no hydrogen 3.083 N/A LEU 191.A N ILE 186.A O no hydrogen 2.900 N/A ILE 193.A N ILE 187.A O no hydrogen 3.149 N/A VAL 196.A N ALA 165.A O no hydrogen 3.107 N/A ASN 199.A N ASP 197.A OD1 no hydrogen 2.774 N/A GLY 206.A N GLY 203.A O no hydrogen 2.969 N/A LYS 207.A N ALA 177.A O no hydrogen 2.993 N/A ILE 209.A N ILE 175.A O no hydrogen 3.110 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.947 N/A PHE 213.A N ASN 210.A OD1 no hydrogen 2.870 N/A ILE 214.A N ASN 210.A O no hydrogen 3.300 N/A LEU 215.A N SER 211.A O no hydrogen 2.997 N/A GLU 216.A N GLU 212.A O no hydrogen 2.841 N/A LYS 217.A N PHE 213.A O no hydrogen 3.069 N/A ASN 218.A N ILE 214.A O no hydrogen 2.927 N/A ASP 220.A N LYS 164.A O no hydrogen 2.816 N/A TYR 221.A N LYS 164.A O no hydrogen 3.274 N/A ILE 222.A N LYS 256.A O no hydrogen 3.014 N/A PHE 223.A N LEU 166.A O no hydrogen 2.795 N/A VAL 224.A N ILE 258.A O no hydrogen 2.812 N/A VAL 225.A N ILE 168.A O no hydrogen 2.863 N/A ARG 227.A N THR 170.A O no hydrogen 2.803 N/A ARG 227.A NE TYR 266.A OH no hydrogen 2.932 N/A ASN 228.A N ASP 226.A OD1 no hydrogen 2.943 N/A ASN 228.A ND2 SER 172.A O no hydrogen 3.414 N/A VAL 229.A N ASP 226.A O no hydrogen 3.281 N/A LEU 231.A N ARG 227.A O no hydrogen 3.216 N/A GLY 232.A N ASN 228.A O no hydrogen 3.069 N/A ASN 233.A N ASN 228.A O no hydrogen 3.279 N/A ASN 233.A ND2 ASN 228.A OD1 no hydrogen 2.782 N/A ARG 236.A NE GLU 235.A O no hydrogen 2.882 N/A ARG 236.A NH2 ASN 233.A O no hydrogen 3.113 N/A ALA 237.A N ASP 226.A OD2 no hydrogen 3.144 N/A GLN 238.A N GLN 238.A OE1 no hydrogen 2.695 N/A GLY 239.A N ARG 236.A O no hydrogen 3.276 N/A LEU 241.A N ALA 237.A O no hydrogen 3.065 N/A ASN 243.A N LEU 241.A O no hydrogen 3.168 N/A ASN 243.A ND2 SER 211.A OG no hydrogen 3.253 N/A ASN 243.A ND2 ILE 240.A O no hydrogen 3.094 N/A VAL 246.A N ASN 243.A OD1 no hydrogen 2.936 N/A ALA 247.A N ASN 243.A O no hydrogen 2.998 N/A LYS 248.A N LEU 245.A O no hydrogen 3.214 N/A THR 249.A N VAL 246.A O no hydrogen 3.141 N/A THR 249.A OG1 VAL 246.A O no hydrogen 2.564 N/A LYS 250.A N ASN 218.A OD1 no hydrogen 2.723 N/A LYS 250.A NZ ASN 218.A O no hydrogen 2.911 N/A LYS 250.A NZ ASP 220.A OD1 no hydrogen 3.045 N/A LYS 250.A NZ ASP 220.A OD2 no hydrogen 3.482 N/A ALA 251.A N PRO 219.A O no hydrogen 3.162 N/A ALA 252.A N THR 249.A OG1 no hydrogen 3.387 N/A GLN 253.A N THR 249.A O no hydrogen 2.812 N/A ASN 254.A N LYS 250.A O no hydrogen 2.880 N/A LYS 255.A N ALA 252.A O no hydrogen 3.100 N/A LYS 256.A N ALA 251.A O no hydrogen 2.746 N/A LYS 256.A NZ ALA 286.A O no hydrogen 2.402 N/A ILE 258.A N ILE 222.A O no hydrogen 2.685 N/A LEU 260.A N VAL 224.A O no hydrogen 2.822 N/A ASP 261.A N GLU 282.A OE2 no hydrogen 3.092 N/A GLU 263.A N ASP 261.A OD1 no hydrogen 3.140 N/A TYR 264.A N ASP 261.A O no hydrogen 2.990 N/A TRP 265.A N ASP 261.A O no hydrogen 2.840 N/A TRP 265.A NE1 GLU 282.A OE1 no hydrogen 2.761 N/A TYR 266.A N PRO 262.A O no hydrogen 2.823 N/A TYR 266.A OH HIS 205.A NE2 no hydrogen 2.559 N/A LEU 267.A N PRO 262.A O no hydrogen 3.056 N/A ALA 268.A N GLU 263.A O no hydrogen 3.316 N/A SER 269.A N TYR 264.A O no hydrogen 2.928 N/A SER 269.A OG TYR 266.A O no hydrogen 3.416 N/A SER 269.A OG LEU 267.A O no hydrogen 2.773 N/A ASN 271.A N ALA 268.A O no hydrogen 3.136 N/A ASN 271.A ND2 ASP 35.A OD2 no hydrogen 2.949 N/A ASN 271.A ND2 VAL 113.A O no hydrogen 2.892 N/A LEU 273.A N THR 41.A OG1 no hydrogen 3.196 N/A GLU 274.A N ASP 40.A OD1 no hydrogen 2.936 N/A SER 275.A N ASP 40.A OD1 no hydrogen 3.485 N/A SER 275.A OG ASP 40.A OD2 no hydrogen 3.452 N/A SER 275.A OG GLY 272.A O no hydrogen 3.226 N/A LEU 276.A N GLY 272.A O no hydrogen 2.944 N/A LYS 277.A N LEU 273.A O no hydrogen 3.402 N/A LYS 277.A NZ ASP 147.A OD2 no hydrogen 2.637 N/A THR 278.A N GLU 274.A O no hydrogen 2.743 N/A THR 278.A OG1 GLU 274.A O no hydrogen 2.716 N/A MET 279.A N SER 275.A O no hydrogen 2.623 N/A ILE 280.A N LEU 276.A O no hydrogen 2.881 N/A LEU 281.A N LYS 277.A O no hydrogen 3.220 N/A GLU 282.A N THR 278.A O no hydrogen 3.033 N/A ILE 283.A N MET 279.A O no hydrogen 3.177 N/A LYS 284.A N ILE 280.A O no hydrogen 2.996 N/A ASN 285.A N LEU 281.A O no hydrogen 2.870 N/A ALA 286.A N GLU 282.A O no hydrogen 3.043 N/A VAL 287.A N ILE 283.A O no hydrogen 3.025 N/A VAL 287.A N LYS 284.A O no hydrogen 3.178 N/A LYS 288.A N LYS 284.A O no hydrogen 2.932 N/A