Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3awg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 8.A OD2 no hydrogen 3.357 N/A TYR 2.A N LEU 9.A O no hydrogen 2.909 N/A ARG 3.A NE ASP 8.A OD1 no hydrogen 3.372 N/A PHE 7.A N LYS 4.A O no hydrogen 3.139 N/A LEU 9.A N TYR 2.A O no hydrogen 3.123 N/A ASP 10.A N ASN 27.A OD1 no hydrogen 2.650 N/A THR 12.A N ALA 20.A O no hydrogen 2.839 N/A TYR 13.A OH HIS 40.A NE2 no hydrogen 2.701 N/A VAL 14.A N VAL 18.A O no hydrogen 2.665 N/A THR 15.A N VAL 18.A O no hydrogen 3.351 N/A HIS 17.A N THR 15.A OG1 no hydrogen 3.104 N/A VAL 18.A N THR 15.A O no hydrogen 3.411 N/A ILE 19.A N ILE 99.A O no hydrogen 2.730 N/A ALA 20.A N THR 12.A O no hydrogen 2.935 N/A MET 21.A N ILE 101.A O no hydrogen 3.117 N/A SER 22.A N ASP 10.A O no hydrogen 3.269 N/A SER 22.A OG ASP 10.A OD2 no hydrogen 2.412 N/A PHE 23.A N LYS 104.A O no hydrogen 3.186 N/A SER 25.A N ASN 27.A O no hydrogen 2.792 N/A SER 25.A OG ASN 27.A O no hydrogen 3.394 N/A ASN 27.A ND2 ASP 10.A O no hydrogen 2.875 N/A ILE 29.A N SER 25.A O no hydrogen 2.733 N/A GLU 31.A N PRO 28.A O no hydrogen 3.164 N/A VAL 32.A N PRO 28.A O no hydrogen 3.120 N/A SER 33.A N ILE 29.A O no hydrogen 2.590 N/A SER 33.A OG LYS 59.A O no hydrogen 2.581 N/A ARG 34.A N GLY 30.A O no hydrogen 2.684 N/A ARG 34.A NE GLU 31.A OE1 no hydrogen 3.341 N/A ARG 34.A NH2 GLU 31.A OE2 no hydrogen 2.449 N/A PHE 35.A N GLU 31.A O no hydrogen 2.902 N/A PHE 36.A N VAL 32.A O no hydrogen 3.285 N/A LYS 37.A N SER 33.A O no hydrogen 3.234 N/A LYS 37.A NZ ASP 61.A OD2 no hydrogen 3.333 N/A THR 38.A N ARG 34.A O no hydrogen 2.775 N/A THR 38.A OG1 ARG 34.A O no hydrogen 2.660 N/A LYS 39.A N PHE 35.A O no hydrogen 2.563 N/A LYS 39.A NZ ASP 5.A OD2 no hydrogen 2.735 N/A HIS 40.A N PHE 36.A O no hydrogen 2.797 N/A HIS 40.A NE2 TYR 13.A OH no hydrogen 2.701 N/A LYS 43.A N HIS 40.A O no hydrogen 2.901 N/A LYS 43.A NZ ASP 94.A OD1 no hydrogen 2.697 N/A ARG 45.A N VAL 98.A O no hydrogen 3.030 N/A ARG 45.A NE ASP 86.A OD1 no hydrogen 2.921 N/A ARG 45.A NH2 ASP 86.A OD2 no hydrogen 3.551 N/A ILE 46.A N HIS 63.A O no hydrogen 2.901 N/A TYR 47.A N ALA 100.A O no hydrogen 2.797 N/A TYR 47.A OH ASP 86.A OD1 no hydrogen 2.738 N/A ASN 48.A N TYR 65.A O no hydrogen 2.973 N/A ASN 48.A ND2 ARG 53.A O no hydrogen 3.357 N/A LEU 49.A N HIS 102.A O no hydrogen 2.957 N/A CYS 50.A N ASN 48.A OD1 no hydrogen 2.944 N/A CYS 50.A SG ASN 48.A OD1 no hydrogen 3.295 N/A SER 51.A N ILE 69.A O no hydrogen 3.023 N/A SER 51.A OG GLU 52.A OE1 no hydrogen 3.569 N/A SER 51.A OG ILE 69.A O no hydrogen 3.460 N/A SER 51.A OG ASP 70.A OD1 no hydrogen 2.739 N/A GLU 52.A N GLU 52.A OE1 no hydrogen 2.848 N/A TYR 55.A OH HIS 102.A NE2 no hydrogen 2.881 N/A THR 58.A N ASP 56.A OD1 no hydrogen 3.002 N/A THR 58.A OG1 ASN 62.A OD1 no hydrogen 2.934 N/A LYS 59.A N ASP 56.A O no hydrogen 3.108 N/A PHE 60.A N GLU 57.A O no hydrogen 2.947 N/A ASP 61.A N THR 58.A O no hydrogen 2.942 N/A ASN 62.A N GLU 57.A O no hydrogen 2.833 N/A HIS 63.A N PHE 60.A O no hydrogen 2.951 N/A TYR 65.A N ILE 46.A O no hydrogen 2.717 N/A ARG 66.A NH2 CYS 50.A O no hydrogen 3.096 N/A VAL 67.A N ASN 48.A O no hydrogen 3.023 N/A ILE 69.A N LEU 49.A O no hydrogen 3.138 N/A ASN 73.A N ASP 70.A O no hydrogen 2.959 N/A ASN 73.A ND2 ASP 71.A O no hydrogen 2.705 N/A ASN 73.A ND2 ASP 258.A OD1 no hydrogen 3.172 N/A LEU 77.A N ASP 241.A OD2 no hydrogen 2.921 N/A ASP 79.A N THR 76.A OG1 no hydrogen 2.938 N/A LEU 80.A N THR 76.A O no hydrogen 2.933 N/A LEU 81.A N LEU 77.A O no hydrogen 2.889 N/A LYS 82.A N VAL 78.A O no hydrogen 2.923 N/A PHE 83.A N ASP 79.A O no hydrogen 2.852 N/A ILE 84.A N LEU 80.A O no hydrogen 3.050 N/A ASP 85.A N LEU 81.A O no hydrogen 2.947 N/A ASP 86.A N LYS 82.A O no hydrogen 2.872 N/A ALA 87.A N PHE 83.A O no hydrogen 2.768 N/A LYS 88.A N ILE 84.A O no hydrogen 2.886 N/A LYS 88.A NZ GLU 120.A OE2 no hydrogen 2.735 N/A VAL 89.A N ASP 85.A O no hydrogen 3.231 N/A TRP 90.A N ASP 86.A O no hydrogen 3.294 N/A TRP 90.A NE1 VAL 98.A O no hydrogen 3.166 N/A MET 91.A N ALA 87.A O no hydrogen 2.764 N/A THR 92.A N LYS 88.A O no hydrogen 2.891 N/A THR 92.A OG1 LYS 88.A O no hydrogen 2.752 N/A THR 92.A OG1 VAL 89.A O no hydrogen 3.371 N/A SER 93.A OG VAL 89.A O no hydrogen 3.443 N/A SER 93.A OG TRP 90.A O no hydrogen 3.492 N/A SER 93.A OG HIS 97.A ND1 no hydrogen 3.424 N/A ASP 96.A N ASP 94.A OD2 no hydrogen 3.184 N/A HIS 97.A N ASP 94.A O no hydrogen 2.827 N/A HIS 97.A ND1 TRP 90.A O no hydrogen 2.776 N/A VAL 98.A N LYS 43.A O no hydrogen 2.763 N/A ILE 99.A N HIS 17.A O no hydrogen 3.002 N/A ALA 100.A N ARG 45.A O no hydrogen 2.911 N/A ILE 101.A N ILE 19.A O no hydrogen 2.814 N/A HIS 102.A N TYR 47.A O no hydrogen 3.102 N/A HIS 102.A ND1 CYS 103.A O no hydrogen 2.920 N/A HIS 102.A NE2 TYR 55.A OH no hydrogen 2.881 N/A CYS 103.A N THR 110.A OG1 no hydrogen 3.273 N/A CYS 103.A SG GLU 52.A OE2 no hydrogen 3.618 N/A LYS 107.A NZ PHE 142.A O no hydrogen 3.417 N/A LYS 107.A NZ GLN 143.A O no hydrogen 3.330 N/A GLY 108.A N GLU 146.A OE1 no hydrogen 3.253 N/A ARG 109.A NH1 GLU 52.A OE1 no hydrogen 2.928 N/A ARG 109.A NH1 GLU 52.A OE2 no hydrogen 3.300 N/A ARG 109.A NH1 ILE 69.A O no hydrogen 2.875 N/A ARG 109.A NH2 GLU 52.A OE2 no hydrogen 3.408 N/A GLY 111.A N LYS 107.A O no hydrogen 2.724 N/A THR 112.A N GLY 108.A O no hydrogen 2.959 N/A THR 112.A N ARG 109.A O no hydrogen 2.936 N/A THR 112.A OG1 GLY 108.A O no hydrogen 2.830 N/A LEU 113.A N ARG 109.A O no hydrogen 3.281 N/A VAL 114.A N THR 110.A O no hydrogen 3.055 N/A SER 115.A N GLY 111.A O no hydrogen 3.164 N/A SER 115.A OG GLY 111.A O no hydrogen 3.065 N/A SER 116.A N THR 112.A O no hydrogen 3.289 N/A SER 116.A OG THR 112.A O no hydrogen 2.883 N/A TRP 117.A N LEU 113.A O no hydrogen 2.850 N/A LEU 118.A N VAL 114.A O no hydrogen 2.660 N/A LEU 119.A N SER 115.A O no hydrogen 3.097 N/A GLU 120.A N SER 116.A O no hydrogen 2.851 N/A ASP 121.A N TRP 117.A O no hydrogen 2.875 N/A GLY 122.A N LEU 119.A O no hydrogen 3.012 N/A LYS 123.A N LEU 118.A O no hydrogen 3.224 N/A LYS 123.A NZ ASP 121.A OD1 no hydrogen 2.946 N/A THR 126.A OG1 GLU 129.A OE2 no hydrogen 3.087 N/A ALA 127.A N GLU 158.A OE1 no hydrogen 2.888 N/A LYS 128.A NZ GLU 132.A OE2 no hydrogen 3.540 N/A GLU 129.A N THR 126.A OG1 no hydrogen 3.183 N/A ALA 130.A N THR 126.A O no hydrogen 3.176 N/A LEU 131.A N ALA 127.A O no hydrogen 2.887 N/A GLU 132.A N LYS 128.A O no hydrogen 2.918 N/A TYR 133.A N GLU 129.A O no hydrogen 3.090 N/A TYR 133.A OH VAL 14.A O no hydrogen 2.614 N/A PHE 134.A N ALA 130.A O no hydrogen 2.996 N/A GLY 135.A N LEU 131.A O no hydrogen 2.968 N/A SER 136.A N GLU 132.A O no hydrogen 3.132 N/A SER 136.A OG GLU 132.A O no hydrogen 3.180 N/A SER 136.A OG TYR 133.A O no hydrogen 3.545 N/A ARG 137.A N PHE 134.A O no hydrogen 3.172 N/A ARG 137.A NE TYR 133.A OH no hydrogen 3.511 N/A ARG 138.A N GLY 135.A O no hydrogen 3.273 N/A ARG 138.A NE GLY 106.A O no hydrogen 2.835 N/A ARG 138.A NH1 ASP 10.A OD1 no hydrogen 2.935 N/A ARG 138.A NH1 THR 12.A OG1 no hydrogen 2.998 N/A ARG 138.A NH2 ASP 10.A OD1 no hydrogen 2.845 N/A ARG 138.A NH2 ASP 10.A OD2 no hydrogen 2.997 N/A ARG 138.A NH2 ALA 105.A O no hydrogen 3.121 N/A THR 139.A OG1 GLY 135.A O no hydrogen 3.123 N/A GLN 143.A N ASP 140.A O no hydrogen 2.797 N/A GLY 144.A N VAL 141.A O no hydrogen 3.225 N/A GLU 146.A N GLN 150.A OE1 no hydrogen 2.965 N/A THR 147.A N GLN 150.A OE1 no hydrogen 3.128 N/A SER 149.A N ASP 284.A OD2 no hydrogen 2.721 N/A SER 149.A OG ASP 284.A OD1 no hydrogen 2.491 N/A SER 149.A OG ASP 284.A OD2 no hydrogen 3.284 N/A GLN 150.A N THR 147.A OG1 no hydrogen 3.056 N/A GLN 150.A NE2 ASN 73.A O no hydrogen 3.144 N/A ILE 151.A N THR 147.A O no hydrogen 3.055 N/A ARG 152.A N ALA 148.A O no hydrogen 2.927 N/A ARG 152.A NH1 TRP 265.A O no hydrogen 2.846 N/A ARG 152.A NH2 GLU 282.A O no hydrogen 2.779 N/A TYR 153.A N SER 149.A O no hydrogen 2.927 N/A TYR 153.A OH ASP 241.A OD1 no hydrogen 2.726 N/A VAL 154.A N GLN 150.A O no hydrogen 3.282 N/A GLY 155.A N ILE 151.A O no hydrogen 3.026 N/A TYR 156.A N ARG 152.A O no hydrogen 2.641 N/A PHE 157.A N TYR 153.A O no hydrogen 3.049 N/A GLU 158.A N VAL 154.A O no hydrogen 3.003 N/A LYS 159.A N GLY 155.A O no hydrogen 2.905 N/A LYS 159.A NZ ASN 163.A OD1 no hydrogen 2.968 N/A ILE 160.A N TYR 156.A O no hydrogen 2.971 N/A LYS 161.A N PHE 157.A O no hydrogen 3.149 N/A LYS 161.A NZ GLU 120.A OE1 no hydrogen 2.875 N/A LYS 162.A N GLU 158.A O no hydrogen 2.980 N/A LYS 162.A NZ ASP 125.A O no hydrogen 3.037 N/A LYS 162.A NZ GLU 158.A OE2 no hydrogen 3.363 N/A ASN 163.A N LYS 159.A O no hydrogen 2.734 N/A TYR 164.A N ILE 160.A O no hydrogen 3.125 N/A GLY 166.A N ILE 160.A O no hydrogen 2.866 N/A GLN 167.A N TYR 164.A O no hydrogen 3.062 N/A LYS 172.A N SER 269.A OG no hydrogen 2.995 N/A LYS 172.A NZ VAL 271.A O no hydrogen 2.659 N/A LEU 174.A N LEU 238.A O no hydrogen 3.054 N/A LYS 175.A N SER 306.A O no hydrogen 3.336 N/A LYS 175.A NZ CYS 235.A O no hydrogen 3.545 N/A THR 177.A N THR 304.A O no hydrogen 2.743 N/A THR 177.A OG1 THR 304.A O no hydrogen 3.286 N/A GLY 178.A N THR 304.A O no hydrogen 3.241 N/A VAL 179.A N CYS 230.A O no hydrogen 2.921 N/A THR 180.A N LYS 302.A O no hydrogen 2.850 N/A ILE 181.A N VAL 228.A O no hydrogen 2.803 N/A THR 182.A N THR 300.A O no hydrogen 3.181 N/A THR 182.A OG1 ASN 298.A O no hydrogen 2.861 N/A THR 182.A OG1 THR 300.A OG1 no hydrogen 2.361 N/A ILE 184.A N ASP 226.A O no hydrogen 3.092 N/A GLN 185.A N ASP 226.A OD1 no hydrogen 2.831 N/A VAL 187.A N ILE 184.A O no hydrogen 2.995 N/A ARG 189.A N ASP 194.A OD2 no hydrogen 3.021 N/A GLY 190.A N VAL 187.A O no hydrogen 3.128 N/A SER 193.A N ASN 191.A OD1 no hydrogen 3.140 N/A SER 193.A OG ASN 191.A OD1 no hydrogen 2.897 N/A LEU 195.A N GLY 192.A O no hydrogen 3.212 N/A SER 196.A N MET 247.A O no hydrogen 2.965 N/A MET 197.A N CYS 209.A O no hydrogen 3.015 N/A GLN 198.A N ARG 245.A O no hydrogen 2.651 N/A GLN 198.A NE2 GLU 205.A OE1 no hydrogen 2.696 N/A ILE 199.A N LEU 207.A O no hydrogen 2.788 N/A VAL 200.A N LYS 243.A O no hydrogen 2.840 N/A SER 201.A N GLN 204.A O no hydrogen 3.060 N/A GLN 204.A N SER 201.A O no hydrogen 2.941 N/A VAL 206.A N ILE 199.A O no hydrogen 2.843 N/A CYS 209.A N MET 197.A O no hydrogen 2.931 N/A CYS 209.A SG ASN 216.A O no hydrogen 3.497 N/A LYS 210.A N TYR 215.A O no hydrogen 2.903 N/A PHE 211.A N LEU 195.A O no hydrogen 3.041 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.521 N/A GLY 214.A N PHE 211.A O no hydrogen 3.347 N/A TYR 215.A N LYS 210.A O no hydrogen 3.262 N/A ASN 216.A ND2 LEU 208.A O no hydrogen 3.049 N/A CYS 217.A N GLY 214.A O no hydrogen 3.375 N/A CYS 217.A SG LYS 210.A O no hydrogen 3.106 N/A CYS 217.A SG TYR 215.A O no hydrogen 3.254 N/A ALA 218.A N GLU 231.A O no hydrogen 3.061 N/A GLN 220.A N THR 229.A O no hydrogen 2.751 N/A ASP 222.A N CYS 227.A O no hydrogen 2.981 N/A ASP 225.A N ASP 222.A O no hydrogen 3.152 N/A ASP 226.A N ALA 223.A O no hydrogen 3.080 N/A CYS 227.A N ASP 222.A O no hydrogen 3.192 N/A VAL 228.A N ILE 181.A O no hydrogen 2.891 N/A THR 229.A N GLN 220.A O no hydrogen 2.963 N/A CYS 230.A N VAL 179.A O no hydrogen 2.756 N/A CYS 230.A SG ALA 218.A O no hydrogen 3.623 N/A GLU 231.A N ALA 218.A O no hydrogen 2.920 N/A VAL 232.A N THR 177.A O no hydrogen 2.833 N/A LYS 233.A N ASN 216.A O no hydrogen 2.891 N/A ASN 234.A ND2 ASN 216.A OD1 no hydrogen 2.656 N/A CYS 235.A SG PRO 236.A O no hydrogen 3.184 N/A LEU 238.A N LEU 174.A O no hydrogen 2.564 N/A GLY 240.A N THR 268.A OG1 no hydrogen 2.972 N/A ILE 242.A N PHE 266.A O no hydrogen 2.870 N/A LYS 243.A N VAL 200.A O no hydrogen 3.026 N/A LYS 243.A NZ ASN 73.A OD1 no hydrogen 3.367 N/A LYS 243.A NZ ASP 258.A OD1 no hydrogen 2.809 N/A VAL 244.A N PHE 264.A O no hydrogen 2.723 N/A ARG 245.A N GLN 198.A O no hydrogen 2.740 N/A ARG 245.A NE ASP 258.A OD2 no hydrogen 2.860 N/A ARG 245.A NH1 GLN 198.A OE1 no hydrogen 3.021 N/A ARG 245.A NH2 ASP 258.A O no hydrogen 2.704 N/A PHE 246.A N PHE 262.A O no hydrogen 2.951 N/A MET 247.A N SER 196.A O no hydrogen 2.862 N/A SER 248.A OG ASP 194.A OD1 no hydrogen 2.499 N/A THR 249.A N ASP 194.A O no hydrogen 2.876 N/A THR 249.A OG1 ASP 194.A O no hydrogen 3.554 N/A SER 250.A N SER 248.A OG no hydrogen 2.937 N/A ARG 255.A NH1 ASN 259.A OD1 no hydrogen 3.113 N/A GLY 256.A N CYS 260.A O no hydrogen 3.254 N/A TYR 257.A N ASN 285.A OD1 no hydrogen 2.933 N/A CYS 260.A SG ASP 258.A O no hydrogen 3.864 N/A CYS 260.A SG PHE 262.A O no hydrogen 3.517 N/A TYR 263.A N ASP 284.A O no hydrogen 3.059 N/A TYR 263.A OH HIS 72.A O no hydrogen 2.586 N/A PHE 264.A N VAL 244.A O no hydrogen 2.985 N/A TRP 265.A N SER 149.A OG no hydrogen 3.061 N/A TRP 265.A NE1 ASN 73.A OD1 no hydrogen 2.777 N/A PHE 266.A N ILE 242.A O no hydrogen 2.968 N/A ASN 267.A N TYR 156.A OH no hydrogen 3.001 N/A ASN 267.A ND2 ASP 241.A OD1 no hydrogen 2.730 N/A THR 268.A N GLY 240.A O no hydrogen 2.690 N/A THR 268.A OG1 LYS 172.A O no hydrogen 2.645 N/A SER 269.A N ASN 267.A OD1 no hydrogen 3.107 N/A SER 269.A OG PRO 170.A O no hydrogen 3.347 N/A LEU 270.A N ASN 267.A O no hydrogen 2.955 N/A VAL 276.A N LEU 303.A O no hydrogen 3.011 N/A LEU 278.A N VAL 301.A O no hydrogen 2.795 N/A LYS 279.A N GLU 282.A OE1 no hydrogen 2.892 N/A ARG 280.A NH1 TYR 295.A O no hydrogen 2.926 N/A GLU 282.A N LYS 279.A O no hydrogen 2.970 N/A ILE 283.A N ARG 280.A O no hydrogen 3.174 N/A ASP 284.A N TYR 263.A O no hydrogen 2.802 N/A ASN 285.A N HIS 287.A ND1 no hydrogen 3.007 N/A ASN 285.A ND2 TYR 257.A O no hydrogen 3.298 N/A ASN 285.A ND2 PRO 261.A O no hydrogen 2.983 N/A HIS 287.A N ILE 283.A O no hydrogen 3.218 N/A HIS 287.A NE2 GLU 146.A O no hydrogen 2.634 N/A LYS 288.A N ASN 285.A O no hydrogen 3.076 N/A LYS 288.A NZ GLU 146.A O no hydrogen 3.307 N/A LYS 288.A NZ TYR 257.A OH no hydrogen 2.775 N/A THR 291.A N LYS 288.A O no hydrogen 2.873 N/A THR 291.A OG1 LYS 288.A O no hydrogen 2.735 N/A TRP 292.A N LYS 289.A O no hydrogen 3.131 N/A TRP 292.A NE1 PRO 286.A O no hydrogen 2.882 N/A ILE 294.A N THR 291.A O no hydrogen 2.859 N/A TYR 295.A N THR 291.A O no hydrogen 3.039 N/A ARG 296.A NH1 ASP 226.A OD2 no hydrogen 3.491 N/A ARG 296.A NH2 GLN 185.A O no hydrogen 3.047 N/A ARG 296.A NH2 ASP 226.A OD2 no hydrogen 2.789 N/A PHE 299.A N ARG 296.A O no hydrogen 2.984 N/A THR 300.A N THR 182.A OG1 no hydrogen 2.751 N/A THR 300.A OG1 THR 182.A OG1 no hydrogen 2.361 N/A VAL 301.A N LEU 278.A O no hydrogen 3.034 N/A LYS 302.A N THR 180.A O no hydrogen 2.831 N/A LEU 303.A N VAL 276.A O no hydrogen 2.974 N/A THR 304.A N GLY 178.A O no hydrogen 2.833 N/A PHE 305.A N ASP 274.A O no hydrogen 2.789 N/A SER 306.A N LYS 175.A O no hydrogen 3.024 N/A