Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3llt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N GLU 2.A O no hydrogen 3.371 N/A HIS 5.A NE2 GLY 27.A O no hydrogen 2.798 N/A LYS 10.A NZ ILE 21.A O no hydrogen 3.436 N/A GLY 11.A N VAL 20.A O no hydrogen 3.091 N/A MET 12.A N LYS 9.A O no hydrogen 3.108 N/A LEU 14.A N PHE 18.A O no hydrogen 2.754 N/A ALA 17.A N LEU 14.A O no hydrogen 3.084 N/A PHE 18.A N LEU 14.A O no hydrogen 2.939 N/A LEU 19.A N GLN 36.A O no hydrogen 2.791 N/A VAL 20.A N MET 12.A O no hydrogen 2.892 N/A ILE 21.A N LEU 34.A O no hydrogen 2.826 N/A MET 24.A N VAL 32.A O no hydrogen 2.776 N/A GLY 25.A N VAL 32.A O no hydrogen 3.429 N/A GLY 27.A N GLY 30.A O no hydrogen 2.942 N/A ARG 31.A N VAL 48.A O no hydrogen 2.909 N/A ARG 31.A NE ASP 26.A OD1 no hydrogen 2.867 N/A ARG 31.A NH1 ASP 26.A OD2 no hydrogen 3.313 N/A ARG 31.A NH2 PHE 6.A O no hydrogen 2.792 N/A VAL 32.A N GLY 25.A O no hydrogen 2.944 N/A LEU 33.A N VAL 46.A O no hydrogen 2.808 N/A LEU 34.A N ARG 22.A O no hydrogen 2.764 N/A CYS 35.A N TYR 44.A O no hydrogen 2.816 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.896 N/A GLN 36.A N LEU 19.A O no hydrogen 2.945 N/A GLN 36.A NE2 LYS 41.A O no hydrogen 2.863 N/A HIS 37.A N LYS 42.A O no hydrogen 3.068 N/A ILE 38.A N ALA 17.A O no hydrogen 2.861 N/A ASP 39.A N HIS 37.A ND1 no hydrogen 3.165 N/A ASN 40.A ND2 TYR 44.A OH no hydrogen 3.081 N/A LYS 41.A N HIS 37.A O no hydrogen 2.861 N/A LYS 42.A N ASN 40.A OD1 no hydrogen 2.882 N/A TYR 44.A N CYS 35.A O no hydrogen 2.793 N/A ALA 45.A N PHE 96.A O no hydrogen 2.922 N/A VAL 46.A N LEU 33.A O no hydrogen 2.819 N/A LYS 47.A N LEU 94.A O no hydrogen 2.877 N/A LYS 47.A NZ GLU 62.A OE1 no hydrogen 3.295 N/A LYS 47.A NZ GLU 62.A OE2 no hydrogen 2.621 N/A VAL 48.A N ARG 31.A O no hydrogen 2.741 N/A VAL 49.A N MET 92.A O no hydrogen 2.863 N/A ARG 50.A N PHE 29.A O no hydrogen 3.002 N/A ARG 50.A NE THR 28.A O no hydrogen 2.978 N/A ARG 50.A NH1 THR 28.A O no hydrogen 2.825 N/A THR 56.A N ILE 52.A O no hydrogen 3.234 N/A THR 56.A OG1 ILE 52.A O no hydrogen 2.841 N/A ARG 57.A N LYS 53.A O no hydrogen 3.148 N/A SER 58.A N LYS 54.A O no hydrogen 3.253 N/A SER 58.A OG LYS 54.A O no hydrogen 3.345 N/A SER 58.A OG TYR 55.A O no hydrogen 3.136 N/A ALA 59.A N TYR 55.A O no hydrogen 3.124 N/A LYS 60.A N THR 56.A O no hydrogen 3.153 N/A ILE 61.A N ARG 57.A O no hydrogen 3.267 N/A GLU 62.A N SER 58.A O no hydrogen 2.821 N/A ALA 63.A N ALA 59.A O no hydrogen 2.776 N/A ASP 64.A N LYS 60.A O no hydrogen 2.985 N/A ILE 65.A N ILE 61.A O no hydrogen 2.845 N/A LEU 66.A N GLU 62.A O no hydrogen 2.922 N/A LYS 67.A N ALA 63.A O no hydrogen 2.998 N/A LYS 68.A N ASP 64.A O no hydrogen 3.260 N/A ILE 69.A N ILE 65.A O no hydrogen 3.355 N/A GLN 70.A NE2 LEU 66.A O no hydrogen 3.031 N/A GLN 70.A NE2 VAL 80.A O no hydrogen 3.220 N/A ASN 71.A N ASN 76.A OD1 no hydrogen 3.137 N/A ASN 71.A ND2 ILE 69.A O no hydrogen 2.930 N/A ASN 71.A ND2 ASN 76.A O no hydrogen 3.301 N/A ASP 73.A N ASN 71.A OD1 no hydrogen 3.260 N/A ASN 75.A N ASP 73.A OD2 no hydrogen 2.987 N/A ASN 76.A N ASP 73.A O no hydrogen 3.168 N/A ASN 76.A ND2 GLN 70.A OE1 no hydrogen 3.154 N/A ASN 76.A ND2 ILE 79.A O no hydrogen 2.860 N/A ASN 76.A ND2 VAL 80.A O no hydrogen 3.570 N/A ASN 77.A N ASP 73.A OD2 no hydrogen 2.988 N/A ASN 78.A N ASN 75.A O no hydrogen 2.812 N/A ASN 78.A ND2 GLU 126.A O no hydrogen 2.686 N/A ASN 78.A ND2 GLU 126.A OE2 no hydrogen 2.793 N/A ILE 79.A N ASN 76.A O no hydrogen 3.115 N/A VAL 80.A N LEU 184.A O no hydrogen 3.085 N/A LYS 81.A N GLU 97.A OE1 no hydrogen 2.854 N/A TYR 82.A N GLN 70.A OE1 no hydrogen 2.886 N/A HIS 83.A N ILE 95.A O no hydrogen 2.878 N/A PHE 86.A N CYS 93.A O no hydrogen 3.075 N/A TYR 88.A N HIS 91.A O no hydrogen 2.823 N/A HIS 91.A N TYR 88.A O no hydrogen 2.921 N/A HIS 91.A ND1 VAL 49.A O no hydrogen 2.667 N/A CYS 93.A N PHE 86.A O no hydrogen 2.946 N/A LEU 94.A N LYS 47.A O no hydrogen 2.974 N/A ILE 95.A N GLY 84.A O no hydrogen 2.838 N/A PHE 96.A N ALA 45.A O no hydrogen 2.797 N/A GLU 97.A N LYS 81.A O no hydrogen 3.075 N/A GLY 100.A N LEU 151.A O no hydrogen 2.824 N/A SER 102.A N GLU 105.A OE1 no hydrogen 3.191 N/A LEU 103.A N ILE 149.A O no hydrogen 2.952 N/A TYR 104.A N PRO 146.A O no hydrogen 3.320 N/A GLU 105.A N SER 102.A OG no hydrogen 2.946 N/A ILE 106.A N SER 102.A O no hydrogen 3.162 N/A ILE 107.A N LEU 103.A O no hydrogen 3.053 N/A THR 108.A N TYR 104.A O no hydrogen 2.919 N/A THR 108.A OG1 TYR 104.A O no hydrogen 2.981 N/A ARG 109.A N GLU 105.A O no hydrogen 2.913 N/A ASN 110.A N ILE 106.A O no hydrogen 2.932 N/A ASN 110.A ND2 TYR 175.A O no hydrogen 3.250 N/A ASN 111.A N THR 108.A O no hydrogen 3.176 N/A TYR 112.A N ILE 107.A O no hydrogen 2.867 N/A ASN 113.A N ASN 110.A O no hydrogen 3.229 N/A ASN 113.A ND2 ASN 110.A O no hydrogen 3.017 N/A PHE 115.A N LEU 233.A O no hydrogen 2.781 N/A GLU 118.A N HIS 116.A ND1 no hydrogen 3.263 N/A ILE 120.A N HIS 116.A O no hydrogen 3.014 N/A LYS 121.A N ILE 117.A O no hydrogen 3.138 N/A LYS 121.A NZ PHE 339.A O no hydrogen 2.805 N/A TYR 123.A N ASP 119.A O no hydrogen 2.951 N/A TYR 123.A OH THR 177.A OG1 no hydrogen 2.712 N/A CYS 124.A N ILE 120.A O no hydrogen 2.842 N/A ILE 125.A N LYS 121.A O no hydrogen 3.092 N/A GLU 126.A N LEU 122.A O no hydrogen 3.144 N/A ILE 127.A N TYR 123.A O no hydrogen 2.859 N/A LEU 128.A N CYS 124.A O no hydrogen 3.033 N/A LYS 129.A N ILE 125.A O no hydrogen 3.119 N/A ALA 130.A N GLU 126.A O no hydrogen 3.473 N/A LEU 131.A N ILE 127.A O no hydrogen 3.042 N/A ASN 132.A N LEU 128.A O no hydrogen 2.813 N/A TYR 133.A N LYS 129.A O no hydrogen 3.180 N/A TYR 133.A OH ILE 69.A O no hydrogen 2.948 N/A LEU 134.A N ALA 130.A O no hydrogen 3.019 N/A ARG 135.A N LEU 131.A O no hydrogen 2.975 N/A LYS 136.A N ASN 132.A O no hydrogen 3.179 N/A MET 137.A N TYR 133.A O no hydrogen 3.024 N/A SER 138.A N ARG 135.A O no hydrogen 2.981 N/A LEU 139.A N LEU 134.A O no hydrogen 2.795 N/A THR 140.A N THR 191.A O no hydrogen 2.945 N/A HIS 141.A N ASP 222.A OD2 no hydrogen 2.791 N/A HIS 141.A NE2 ILE 185.A O no hydrogen 2.779 N/A THR 142.A N ASP 222.A OD1 no hydrogen 2.979 N/A THR 142.A OG1 HIS 141.A O no hydrogen 2.572 N/A THR 142.A OG1 CYS 189.A O no hydrogen 3.028 N/A ASP 143.A N HIS 141.A ND1 no hydrogen 3.077 N/A LYS 145.A NZ THR 203.A OG1 no hydrogen 3.138 N/A GLU 147.A N GLU 147.A OE2 no hydrogen 2.790 N/A ASN 148.A N LYS 145.A O no hydrogen 2.820 N/A ASN 148.A ND2 ASP 143.A O no hydrogen 2.754 N/A ASN 148.A ND2 ASP 143.A OD2 no hydrogen 3.202 N/A ASN 148.A ND2 ASP 186.A OD2 no hydrogen 3.206 N/A ILE 149.A N PRO 146.A O no hydrogen 3.483 N/A LEU 150.A N LYS 183.A O no hydrogen 2.933 N/A LEU 151.A N PRO 101.A O no hydrogen 2.897 N/A ASP 152.A N GLY 181.A O no hydrogen 2.879 N/A TYR 155.A N ASP 153.A OD1 no hydrogen 3.354 N/A PHE 156.A N ASP 153.A O no hydrogen 3.272 N/A GLU 157.A N ASP 153.A OD2 no hydrogen 3.179 N/A LYS 158.A NZ PHE 156.A O no hydrogen 3.490 N/A SER 159.A N ARG 176.A O no hydrogen 3.244 N/A ILE 161.A N ILE 174.A O no hydrogen 2.864 N/A VAL 163.A N ILE 172.A O no hydrogen 2.877 N/A ARG 165.A N LYS 170.A O no hydrogen 2.778 N/A ARG 165.A NE ASP 168.A OD1 no hydrogen 2.995 N/A ARG 165.A NH2 ASP 168.A OD1 no hydrogen 3.302 N/A ARG 165.A NH2 ASP 168.A OD2 no hydrogen 2.801 N/A THR 167.A OG1 ASP 168.A OD1 no hydrogen 3.436 N/A GLY 169.A N ARG 165.A O no hydrogen 2.998 N/A LYS 170.A N ASP 168.A OD1 no hydrogen 3.219 N/A ILE 172.A N VAL 163.A O no hydrogen 2.835 N/A ILE 174.A N ILE 161.A O no hydrogen 3.047 N/A TYR 175.A N ASN 110.A OD1 no hydrogen 2.702 N/A ARG 176.A N SER 159.A O no hydrogen 3.112 N/A ARG 176.A NE ASP 119.A OD1 no hydrogen 2.991 N/A THR 177.A OG1 TYR 123.A OH no hydrogen 2.712 N/A THR 177.A OG1 SER 179.A O no hydrogen 2.713 N/A LYS 178.A N GLU 157.A O no hydrogen 2.825 N/A GLY 181.A N SER 179.A OG no hydrogen 3.181 N/A LYS 183.A N LEU 150.A O no hydrogen 2.853 N/A LYS 183.A NZ GLU 97.A OE1 no hydrogen 2.654 N/A LYS 183.A NZ GLU 97.A OE2 no hydrogen 3.442 N/A LEU 184.A N ASN 78.A O no hydrogen 2.935 N/A ILE 185.A N ASN 148.A O no hydrogen 3.004 N/A ALA 190.A N PHE 187.A O no hydrogen 3.294 N/A THR 191.A N THR 140.A O no hydrogen 2.854 N/A THR 191.A OG1 CYS 189.A O no hydrogen 3.092 N/A PHE 192.A N ASP 195.A OD2 no hydrogen 3.379 N/A LYS 193.A N SER 138.A O no hydrogen 2.962 N/A ASP 195.A N PHE 192.A O no hydrogen 2.996 N/A HIS 197.A ND1 ASP 195.A O no hydrogen 2.968 N/A ASN 202.A ND2 THR 142.A O no hydrogen 2.558 N/A THR 203.A OG1 ASP 143.A OD1 no hydrogen 2.757 N/A GLN 205.A NE2 THR 242.A O no hydrogen 2.996 N/A TYR 206.A N THR 203.A O no hydrogen 2.794 N/A TYR 206.A OH GLU 232.A OE1 no hydrogen 2.529 N/A ARG 207.A N ARG 204.A O no hydrogen 3.257 N/A ARG 207.A NE ILE 201.A O no hydrogen 2.786 N/A ARG 207.A NH1 ASN 202.A O no hydrogen 2.870 N/A ARG 207.A NH2 HIS 245.A NE2 no hydrogen 3.074 N/A ALA 208.A N ASN 202.A OD1 no hydrogen 3.270 N/A GLU 210.A N GLU 210.A OE2 no hydrogen 2.719 N/A VAL 211.A N ALA 208.A O no hydrogen 3.040 N/A ILE 212.A N ALA 208.A O no hydrogen 3.174 N/A LEU 213.A N PRO 209.A O no hydrogen 2.884 N/A ASN 214.A N VAL 211.A O no hydrogen 3.101 N/A LEU 215.A N GLU 210.A O no hydrogen 2.806 N/A TRP 217.A NE1 GLY 198.A O no hydrogen 2.826 N/A SER 220.A N ASP 218.A OD1 no hydrogen 3.129 N/A SER 220.A OG ASP 218.A OD1 no hydrogen 2.458 N/A SER 221.A N ASP 218.A O no hydrogen 3.034 N/A SER 221.A OG ASP 218.A O no hydrogen 2.627 N/A MET 223.A N SER 220.A O no hydrogen 3.182 N/A SER 225.A N SER 221.A O no hydrogen 3.463 N/A SER 225.A OG TYR 206.A O no hydrogen 2.745 N/A SER 225.A OG SER 221.A O no hydrogen 3.513 N/A PHE 226.A N ASP 222.A O no hydrogen 3.047 N/A GLY 227.A N MET 223.A O no hydrogen 3.227 N/A CYS 228.A N TRP 224.A O no hydrogen 3.256 N/A CYS 228.A SG TRP 224.A O no hydrogen 3.385 N/A VAL 229.A N SER 225.A O no hydrogen 2.951 N/A LEU 230.A N PHE 226.A O no hydrogen 2.970 N/A ALA 231.A N GLY 227.A O no hydrogen 3.076 N/A GLU 232.A N CYS 228.A O no hydrogen 3.084 N/A LEU 233.A N VAL 229.A O no hydrogen 2.830 N/A TYR 234.A N LEU 230.A O no hydrogen 3.132 N/A TYR 234.A N ALA 231.A O no hydrogen 3.301 N/A THR 235.A N ALA 231.A O no hydrogen 3.013 N/A THR 235.A OG1 ALA 231.A O no hydrogen 3.019 N/A GLY 236.A N GLU 232.A O no hydrogen 2.737 N/A SER 237.A N THR 235.A OG1 no hydrogen 3.316 N/A THR 242.A OG1 GLU 244.A O no hydrogen 3.294 N/A THR 242.A OG1 GLU 247.A OE1 no hydrogen 2.669 N/A HIS 245.A ND1 TYR 275.A OH no hydrogen 2.866 N/A HIS 248.A N GLU 244.A O no hydrogen 3.000 N/A HIS 248.A NE2 ARG 204.A O no hydrogen 3.003 N/A LEU 249.A N HIS 245.A O no hydrogen 2.821 N/A ALA 250.A N MET 246.A O no hydrogen 3.099 N/A MET 251.A N GLU 247.A O no hydrogen 2.868 N/A MET 252.A N HIS 248.A O no hydrogen 3.162 N/A GLU 253.A N LEU 249.A O no hydrogen 3.382 N/A SER 254.A N ALA 250.A O no hydrogen 3.250 N/A SER 254.A OG ALA 250.A O no hydrogen 3.226 N/A ILE 255.A N MET 251.A O no hydrogen 2.956 N/A ILE 256.A N MET 252.A O no hydrogen 2.995 N/A GLN 257.A N MET 252.A O no hydrogen 3.283 N/A ILE 259.A N GLU 253.A OE1 no hydrogen 3.119 N/A MET 263.A N PRO 260.A O no hydrogen 3.038 N/A LEU 264.A N PRO 260.A O no hydrogen 3.354 N/A TYR 265.A N LYS 261.A O no hydrogen 3.154 N/A GLU 266.A N ASN 262.A O no hydrogen 3.085 N/A ALA 267.A N MET 263.A O no hydrogen 3.047 N/A THR 268.A N TYR 265.A O no hydrogen 3.339 N/A THR 268.A OG1 TYR 265.A O no hydrogen 2.567 N/A LYS 269.A NZ TYR 265.A OH no hydrogen 3.375 N/A THR 270.A N ALA 267.A O no hydrogen 3.159 N/A THR 270.A OG1 LEU 213.A O no hydrogen 2.965 N/A THR 270.A OG1 ASN 214.A O no hydrogen 3.405 N/A THR 270.A OG1 ALA 267.A O no hydrogen 3.211 N/A ASN 271.A N ASN 214.A OD1 no hydrogen 3.171 N/A ASN 271.A ND2 ASN 214.A OD1 no hydrogen 2.983 N/A GLY 272.A N THR 270.A OG1 no hydrogen 3.333 N/A SER 273.A N THR 270.A O no hydrogen 3.306 N/A TYR 275.A N GLY 272.A O no hydrogen 3.127 N/A VAL 276.A N SER 273.A O no hydrogen 3.137 N/A ASN 277.A N LYS 282.A O no hydrogen 2.767 N/A LYS 282.A NZ GLU 280.A O no hydrogen 3.114 N/A ALA 284.A N TYR 275.A O no hydrogen 2.914 N/A TRP 285.A N LEU 283.A O no hydrogen 2.703 N/A ASN 288.A N ALA 284.A O no hydrogen 2.917 N/A ASN 288.A ND2 LYS 274.A O no hydrogen 2.839 N/A ALA 289.A N PRO 286.A O no hydrogen 3.190 N/A SER 290.A OG GLU 244.A OE2 no hydrogen 2.781 N/A SER 294.A N SER 291.A OG no hydrogen 3.208 N/A SER 294.A OG GLU 247.A OE2 no hydrogen 2.697 N/A ILE 295.A N SER 291.A O no hydrogen 3.442 N/A LYS 296.A N ILE 292.A O no hydrogen 2.843 N/A LYS 296.A NZ ASN 293.A OD1 no hydrogen 3.244 N/A HIS 297.A N ASN 293.A O no hydrogen 2.780 N/A HIS 297.A NE2 ARG 241.A O no hydrogen 2.836 N/A VAL 298.A N SER 294.A O no hydrogen 3.167 N/A LYS 299.A N ILE 295.A O no hydrogen 2.926 N/A LYS 300.A N LYS 296.A O no hydrogen 2.964 N/A CYS 301.A N VAL 298.A O no hydrogen 3.260 N/A CYS 301.A SG HIS 297.A O no hydrogen 3.358 N/A LEU 304.A N ILE 255.A O no hydrogen 2.786 N/A LYS 306.A N PRO 303.A O no hydrogen 3.122 N/A ILE 307.A N LEU 304.A O no hydrogen 3.048 N/A ILE 308.A N LEU 304.A O no hydrogen 2.796 N/A LYS 309.A NZ VAL 166.A O no hydrogen 2.794 N/A HIS 310.A N TYR 234.A OH no hydrogen 3.267 N/A PHE 313.A N HIS 310.A ND1 no hydrogen 3.380 N/A CYS 314.A N HIS 310.A O no hydrogen 2.941 N/A CYS 314.A SG ILE 308.A O no hydrogen 3.979 N/A ASP 315.A N GLU 311.A O no hydrogen 3.113 N/A PHE 316.A N LEU 312.A O no hydrogen 2.933 N/A LEU 317.A N PHE 313.A O no hydrogen 2.892 N/A TYR 318.A N CYS 314.A O no hydrogen 2.971 N/A SER 319.A N ASP 315.A O no hydrogen 3.204 N/A SER 319.A OG ASP 315.A O no hydrogen 2.864 N/A ILE 320.A N PHE 316.A O no hydrogen 3.422 N/A LEU 321.A N LEU 317.A O no hydrogen 2.805 N/A GLN 322.A N ILE 320.A O no hydrogen 2.782 N/A GLN 322.A NE2 SER 319.A O no hydrogen 2.789 N/A ILE 323.A N GLN 257.A OE1 no hydrogen 2.959 N/A THR 326.A OG1 ASP 324.A OD1 no hydrogen 2.935 N/A LEU 327.A N ASP 324.A O no hydrogen 3.189 N/A ARG 328.A N PRO 325.A O no hydrogen 3.431 N/A ARG 328.A NE GLN 322.A O no hydrogen 2.698 N/A ARG 328.A NH1 GLU 210.A OE2 no hydrogen 2.799 N/A ARG 328.A NH1 GLN 322.A O no hydrogen 3.175 N/A ARG 328.A NH2 GLU 210.A OE1 no hydrogen 2.695 N/A ARG 328.A NH2 GLU 210.A OE2 no hydrogen 3.406 N/A ARG 328.A NH2 SER 220.A O no hydrogen 2.949 N/A SER 330.A N GLU 333.A OE1 no hydrogen 3.016 N/A GLU 333.A N SER 330.A O no hydrogen 3.120 N/A LEU 334.A N SER 330.A O no hydrogen 3.221 N/A LEU 335.A N PRO 331.A O no hydrogen 3.271 N/A LYS 336.A N GLU 333.A O no hydrogen 3.111 N/A HIS 337.A N LEU 334.A O no hydrogen 3.053 N/A HIS 337.A NE2 ASP 315.A OD2 no hydrogen 2.994 N/A PHE 339.A N HIS 337.A ND1 no hydrogen 3.187 N/A LEU 340.A N HIS 337.A O no hydrogen 3.074 N/A GLU 341.A N LYS 338.A O no hydrogen 3.321 N/A