Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jul_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ASP 133.A OD1 no hydrogen 2.539 N/A THR 5.A N GLU 56.A O no hydrogen 3.157 N/A THR 5.A OG1 SER 45.A OG no hydrogen 2.633 N/A ILE 6.A N VAL 135.A O no hydrogen 2.858 N/A THR 7.A N LEU 58.A O no hydrogen 2.862 N/A ASN 9.A ND2 ALA 109.A O no hydrogen 2.986 N/A ALA 11.A N GLY 38.A O no hydrogen 3.116 N/A ILE 12.A N ARG 91.A O no hydrogen 3.081 N/A ASP 13.A N ASP 36.A O no hydrogen 2.769 N/A ARG 14.A N CYS 93.A O no hydrogen 3.021 N/A ARG 14.A NE GLU 92.A OE2 no hydrogen 2.881 N/A ARG 14.A NH2 GLU 92.A OE1 no hydrogen 3.209 N/A ARG 14.A NH2 GLU 92.A OE2 no hydrogen 3.253 N/A LEU 15.A N GLU 34.A O no hydrogen 2.536 N/A LEU 16.A N VAL 95.A O no hydrogen 2.852 N/A PHE 17.A N LYS 32.A O no hydrogen 3.198 N/A ILE 18.A N LEU 97.A O no hydrogen 3.428 N/A GLY 20.A N ASP 100.A OD2 no hydrogen 2.974 N/A ILE 31.A N PHE 17.A O no hydrogen 2.569 N/A LYS 32.A NZ GLU 34.A OE2 no hydrogen 3.225 N/A GLU 34.A N LEU 15.A O no hydrogen 2.877 N/A ASP 36.A N ASP 13.A O no hydrogen 2.915 N/A CYS 37.A N ASP 36.A OD1 no hydrogen 2.833 N/A GLY 38.A N ALA 11.A O no hydrogen 2.544 N/A GLY 41.A N ALA 137.A O no hydrogen 3.284 N/A HIS 43.A N GLY 39.A O no hydrogen 3.074 N/A VAL 44.A N LYS 40.A O no hydrogen 2.834 N/A SER 45.A N GLY 41.A O no hydrogen 2.851 N/A SER 45.A OG GLY 41.A O no hydrogen 3.381 N/A SER 45.A OG ASN 55.A OD1 no hydrogen 3.408 N/A GLY 46.A N LEU 42.A O no hydrogen 2.816 N/A VAL 47.A N HIS 43.A O no hydrogen 3.180 N/A LEU 48.A N VAL 44.A O no hydrogen 3.063 N/A SER 49.A N SER 45.A O no hydrogen 3.063 N/A SER 49.A OG SER 45.A O no hydrogen 3.077 N/A SER 49.A OG HIS 77.A O no hydrogen 2.948 N/A LYS 50.A N GLY 46.A O no hydrogen 3.365 N/A LYS 50.A NZ PHE 274.A O no hydrogen 2.559 N/A PHE 51.A N VAL 47.A O no hydrogen 3.213 N/A PHE 51.A N LEU 48.A O no hydrogen 3.012 N/A GLY 52.A N SER 49.A O no hydrogen 2.796 N/A ILE 53.A N LEU 48.A O no hydrogen 3.015 N/A ASN 55.A ND2 ILE 53.A O no hydrogen 3.121 N/A GLU 56.A N ILE 3.A O no hydrogen 3.005 N/A ALA 57.A N ASN 79.A O no hydrogen 2.721 N/A LEU 58.A N THR 5.A O no hydrogen 2.784 N/A ALA 61.A N LEU 83.A O no hydrogen 2.975 N/A GLY 62.A N THR 90.A OG1 no hydrogen 3.076 N/A SER 63.A N GLU 85.A O no hydrogen 3.142 N/A SER 63.A OG ASP 64.A OD1 no hydrogen 3.195 N/A SER 63.A OG GLU 85.A O no hydrogen 3.542 N/A SER 63.A OG THR 88.A O no hydrogen 3.446 N/A ASP 64.A N THR 88.A O no hydrogen 2.877 N/A ASN 65.A ND2 THR 90.A O no hydrogen 2.985 N/A LEU 66.A N SER 63.A O no hydrogen 3.174 N/A LEU 69.A N ASN 65.A O no hydrogen 3.074 N/A TYR 70.A N LEU 66.A O no hydrogen 2.840 N/A ALA 71.A N ASP 67.A O no hydrogen 3.090 N/A ILE 72.A N LYS 68.A O no hydrogen 3.326 N/A LEU 73.A N LEU 69.A O no hydrogen 3.039 N/A LYS 74.A N TYR 70.A O no hydrogen 2.824 N/A GLU 75.A N ALA 71.A O no hydrogen 2.965 N/A LYS 76.A N ILE 72.A O no hydrogen 2.812 N/A HIS 77.A N LYS 74.A O no hydrogen 2.971 N/A ILE 78.A N LEU 73.A O no hydrogen 2.727 N/A ASP 81.A N ALA 57.A O no hydrogen 3.111 N/A LEU 83.A N GLY 59.A O no hydrogen 2.941 N/A GLU 85.A N ALA 61.A O no hydrogen 2.945 N/A GLY 87.A N SER 63.A OG no hydrogen 2.617 N/A THR 88.A N SER 63.A OG no hydrogen 3.351 N/A THR 90.A N ASN 65.A OD1 no hydrogen 2.837 N/A ARG 91.A NE ASN 9.A O no hydrogen 2.846 N/A ARG 91.A NE PRO 10.A O no hydrogen 2.838 N/A ARG 91.A NH1 GLU 108.A O no hydrogen 2.819 N/A ARG 91.A NH2 ASN 9.A O no hydrogen 2.673 N/A GLU 92.A N GLU 108.A OE1 no hydrogen 2.701 N/A CYS 93.A N ILE 12.A O no hydrogen 3.012 N/A PHE 94.A N ILE 106.A O no hydrogen 2.961 N/A VAL 95.A N ARG 14.A O no hydrogen 3.033 N/A VAL 96.A N THR 105.A O no hydrogen 2.808 N/A LEU 97.A N LEU 16.A O no hydrogen 2.827 N/A SER 98.A OG ILE 18.A O no hydrogen 3.116 N/A SER 98.A OG GLY 20.A O no hydrogen 3.376 N/A THR 101.A N SER 98.A O no hydrogen 3.186 N/A THR 105.A N VAL 96.A O no hydrogen 3.143 N/A GLU 108.A N GLU 92.A O no hydrogen 2.920 N/A SER 114.A N GLU 85.A OE1 no hydrogen 2.723 N/A SER 114.A OG GLU 85.A OE1 no hydrogen 2.898 N/A SER 114.A OG GLU 85.A OE2 no hydrogen 2.705 N/A GLN 115.A NE2 ASP 119.A OD1 no hydrogen 3.250 N/A GLN 115.A NE2 ASP 119.A OD2 no hydrogen 3.473 N/A ASN 117.A N SER 114.A OG no hydrogen 3.397 N/A ASN 117.A ND2 VAL 84.A O no hydrogen 3.379 N/A ASN 117.A ND2 GLU 85.A OE1 no hydrogen 3.007 N/A LYS 118.A N SER 114.A O no hydrogen 3.193 N/A LYS 118.A N GLN 115.A O no hydrogen 3.047 N/A LYS 118.A NZ HIS 143.A O no hydrogen 3.353 N/A LYS 118.A NZ ASP 148.A OD2 no hydrogen 2.593 N/A ASP 119.A N GLN 115.A O no hydrogen 3.079 N/A ASN 120.A N THR 116.A O no hydrogen 2.852 N/A ASN 120.A ND2 ASN 117.A OD1 no hydrogen 3.447 N/A LEU 121.A N ASN 117.A O no hydrogen 3.080 N/A LEU 122.A N LYS 118.A O no hydrogen 3.288 N/A LYS 123.A N ASP 119.A O no hydrogen 3.189 N/A LYS 123.A NZ ASN 120.A OD1 no hydrogen 3.168 N/A GLN 124.A N ASN 120.A O no hydrogen 3.061 N/A ILE 125.A N LEU 121.A O no hydrogen 3.028 N/A ALA 126.A N LEU 122.A O no hydrogen 3.033 N/A LYS 127.A N LYS 123.A O no hydrogen 2.585 N/A LYS 128.A N GLN 124.A O no hydrogen 2.970 N/A LYS 128.A N ILE 125.A O no hydrogen 3.307 N/A LYS 128.A NZ GLU 56.A OE1 no hydrogen 2.587 N/A LYS 128.A NZ GLU 56.A OE2 no hydrogen 3.547 N/A LYS 128.A NZ ASP 81.A OD2 no hydrogen 3.308 N/A VAL 129.A N ILE 125.A O no hydrogen 2.886 N/A LYS 130.A N ASP 133.A OD2 no hydrogen 2.525 N/A LYS 130.A NZ LYS 128.A O no hydrogen 3.050 N/A GLU 132.A N GLU 132.A OE1 no hydrogen 2.616 N/A ASP 133.A N LYS 130.A O no hydrogen 2.892 N/A VAL 135.A N TYR 4.A O no hydrogen 2.632 N/A ILE 136.A N GLY 164.A O no hydrogen 3.165 N/A ALA 137.A N ILE 6.A O no hydrogen 2.924 N/A GLY 138.A N ASP 166.A O no hydrogen 2.982 N/A TYR 144.A N PRO 141.A O no hydrogen 3.187 N/A THR 145.A N ASP 148.A OD2 no hydrogen 2.753 N/A ASP 148.A N THR 145.A OG1 no hydrogen 2.819 N/A PHE 149.A N THR 145.A O no hydrogen 2.728 N/A LYS 150.A N LEU 146.A O no hydrogen 2.819 N/A GLU 151.A N SER 147.A O no hydrogen 3.292 N/A LEU 152.A N ASP 148.A O no hydrogen 3.088 N/A LEU 153.A N PHE 149.A O no hydrogen 2.999 N/A ARG 154.A N LYS 150.A O no hydrogen 2.944 N/A THR 155.A N GLU 151.A O no hydrogen 2.753 N/A THR 155.A OG1 GLU 151.A O no hydrogen 2.697 N/A VAL 156.A N LEU 152.A O no hydrogen 3.116 N/A LYS 157.A N LEU 153.A O no hydrogen 2.846 N/A ALA 158.A N ARG 154.A O no hydrogen 2.804 N/A THR 159.A N VAL 156.A O no hydrogen 2.929 N/A THR 159.A OG1 VAL 156.A O no hydrogen 3.073 N/A GLY 160.A N LYS 157.A O no hydrogen 2.720 N/A PHE 162.A N ASP 133.A O no hydrogen 3.093 N/A LEU 163.A N ASP 180.A OD2 no hydrogen 3.016 N/A GLY 164.A N VAL 134.A O no hydrogen 2.930 N/A CYS 165.A N PHE 181.A O no hydrogen 2.792 N/A ASP 166.A N ILE 136.A O no hydrogen 3.069 N/A TYR 171.A OH TYR 144.A O no hydrogen 2.720 N/A LEU 172.A N SER 168.A O no hydrogen 3.249 N/A ASN 173.A N GLY 169.A O no hydrogen 3.367 N/A ASN 173.A ND2 GLU 170.A OE1 no hydrogen 2.963 N/A LEU 174.A N GLU 170.A O no hydrogen 2.745 N/A ALA 175.A N TYR 171.A O no hydrogen 2.772 N/A VAL 176.A N LEU 172.A O no hydrogen 2.939 N/A GLU 177.A N ASN 173.A O no hydrogen 2.907 N/A ASP 180.A N LEU 163.A O no hydrogen 2.805 N/A PHE 181.A N LEU 163.A O no hydrogen 3.284 N/A ASN 185.A N GLU 188.A OE2 no hydrogen 2.612 N/A GLU 186.A N SER 217.A O no hydrogen 3.184 N/A GLU 188.A N ASN 185.A OD1 no hydrogen 2.702 N/A VAL 189.A N ASN 185.A O no hydrogen 3.155 N/A ILE 190.A N GLU 186.A O no hydrogen 3.191 N/A ALA 191.A N ASP 187.A O no hydrogen 2.848 N/A ILE 192.A N GLU 188.A O no hydrogen 2.832 N/A LEU 193.A N VAL 189.A O no hydrogen 3.318 N/A ASP 194.A N ILE 190.A O no hydrogen 2.654 N/A GLU 195.A N ILE 190.A O no hydrogen 3.406 N/A THR 197.A N GLU 195.A OE2 no hydrogen 2.592 N/A THR 197.A OG1 GLU 195.A OE2 no hydrogen 2.580 N/A ASN 198.A N GLU 195.A OE1 no hydrogen 2.684 N/A ASN 198.A N GLU 195.A OE2 no hydrogen 3.249 N/A GLU 202.A N SER 199.A OG no hydrogen 3.170 N/A ASN 203.A N SER 199.A O no hydrogen 3.046 N/A ASN 203.A ND2 GLU 195.A OE1 no hydrogen 3.235 N/A ILE 204.A N LEU 200.A O no hydrogen 2.812 N/A ARG 205.A N GLU 201.A O no hydrogen 2.832 N/A ARG 205.A NH2 LEU 291.A O no hydrogen 3.276 N/A THR 206.A N GLU 202.A O no hydrogen 2.887 N/A THR 206.A OG1 GLU 202.A O no hydrogen 2.683 N/A THR 206.A OG1 GLU 202.A OE2 no hydrogen 3.049 N/A LEU 207.A N ASN 203.A O no hydrogen 2.873 N/A ALA 208.A N ILE 204.A O no hydrogen 2.722 N/A ALA 208.A N ARG 205.A O no hydrogen 3.088 N/A GLU 209.A N THR 206.A O no hydrogen 3.083 N/A LYS 210.A N LEU 207.A O no hydrogen 3.082 N/A ILE 211.A N LEU 207.A O no hydrogen 3.191 N/A TYR 213.A N ASP 180.A O no hydrogen 3.037 N/A LEU 214.A N ALA 226.A O no hydrogen 3.223 N/A VAL 215.A N ILE 182.A O no hydrogen 3.412 N/A VAL 216.A N ILE 224.A O no hydrogen 2.765 N/A SER 217.A N PRO 184.A O no hydrogen 2.966 N/A LEU 218.A N GLY 222.A O no hydrogen 2.957 N/A GLY 222.A N GLY 219.A O no hydrogen 3.103 N/A SER 223.A N VAL 234.A O no hydrogen 2.859 N/A SER 223.A OG VAL 216.A O no hydrogen 3.399 N/A SER 223.A OG GLY 222.A O no hydrogen 2.933 N/A ILE 224.A N VAL 216.A O no hydrogen 2.932 N/A CYS 225.A N TYR 232.A O no hydrogen 2.935 N/A CYS 225.A SG LEU 214.A O no hydrogen 3.344 N/A CYS 225.A SG ALA 226.A O no hydrogen 3.586 N/A ALA 226.A N LEU 214.A O no hydrogen 2.714 N/A HIS 227.A N LYS 230.A O no hydrogen 2.899 N/A LYS 230.A N HIS 227.A O no hydrogen 2.820 N/A TYR 232.A N CYS 225.A O no hydrogen 2.822 N/A GLN 233.A N ILE 289.A O no hydrogen 2.790 N/A VAL 234.A N SER 223.A O no hydrogen 2.649 N/A ILE 235.A N SER 287.A O no hydrogen 2.951 N/A VAL 243.A N GLY 239.A O no hydrogen 2.964 N/A PHE 244.A N ALA 240.A O no hydrogen 3.016 N/A VAL 245.A N GLY 241.A O no hydrogen 3.030 N/A GLY 246.A N ASP 242.A O no hydrogen 2.869 N/A ALA 247.A N VAL 243.A O no hydrogen 2.697 N/A PHE 248.A N PHE 244.A O no hydrogen 2.724 N/A ILE 249.A N VAL 245.A O no hydrogen 2.786 N/A ALA 250.A N GLY 246.A O no hydrogen 2.989 N/A GLY 251.A N ALA 247.A O no hydrogen 2.931 N/A LEU 252.A N PHE 248.A O no hydrogen 3.063 N/A ALA 253.A N ILE 249.A O no hydrogen 2.785 N/A THR 259.A N PRO 255.A O no hydrogen 2.760 N/A THR 259.A OG1 PRO 255.A O no hydrogen 3.187 N/A LEU 260.A N ILE 256.A O no hydrogen 2.850 N/A LYS 261.A N THR 257.A O no hydrogen 3.072 N/A VAL 262.A N GLU 258.A O no hydrogen 3.004 N/A ALA 263.A N THR 259.A O no hydrogen 2.834 N/A THR 264.A N LEU 260.A O no hydrogen 2.986 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.992 N/A GLY 265.A N LYS 261.A O no hydrogen 2.892 N/A CYS 266.A N VAL 262.A O no hydrogen 2.947 N/A CYS 266.A SG VAL 262.A O no hydrogen 3.350 N/A SER 267.A N ALA 263.A O no hydrogen 3.009 N/A SER 267.A OG ALA 240.A O no hydrogen 2.746 N/A ALA 268.A N THR 264.A O no hydrogen 3.148 N/A SER 269.A N GLY 265.A O no hydrogen 2.997 N/A LYS 270.A N SER 267.A O no hydrogen 3.256 N/A VAL 271.A N SER 267.A O no hydrogen 3.339 N/A ALA 279.A N ASP 275.A O no hydrogen 2.748 N/A GLY 280.A N LEU 276.A O no hydrogen 2.964 N/A GLY 280.A N GLU 277.A O no hydrogen 3.112 N/A LYS 281.A NZ GLU 277.A OE2 no hydrogen 3.515 N/A LEU 282.A N ALA 279.A O no hydrogen 3.154 N/A GLN 285.A N LEU 282.A O no hydrogen 3.044 N/A VAL 286.A N LYS 283.A O no hydrogen 3.305 N/A SER 287.A N ILE 235.A O no hydrogen 3.012 N/A ILE 289.A N GLN 233.A O no hydrogen 2.975 N/A LEU 291.A N LEU 231.A O no hydrogen 2.678 N/A