Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o96_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N LEU 28.A O no hydrogen 2.667 N/A LYS 7.A NZ GLU 91.A OE2 no hydrogen 3.552 N/A GLY 9.A N PHE 26.A O no hydrogen 3.109 N/A LEU 11.A N ARG 24.A O no hydrogen 2.567 N/A LYS 13.A N ARG 22.A O no hydrogen 2.647 N/A LYS 13.A NZ GLU 16.A OE1 no hydrogen 2.683 N/A LYS 13.A NZ ASP 261.A OD1 no hydrogen 3.352 N/A LYS 13.A NZ ASP 261.A OD2 no hydrogen 2.816 N/A ARG 14.A N THR 83.A O no hydrogen 2.812 N/A GLY 15.A N THR 20.A O no hydrogen 3.022 N/A LYS 19.A NZ GLU 16.A O no hydrogen 3.561 N/A THR 20.A N ILE 18.A O no hydrogen 2.790 N/A THR 20.A OG1 TRP 21.A O no hydrogen 3.192 N/A ARG 22.A N LYS 13.A O no hydrogen 2.859 N/A ARG 24.A N LEU 11.A O no hydrogen 2.634 N/A ARG 24.A NE ASP 261.A O no hydrogen 3.253 N/A ARG 24.A NH1 PRO 23.A O no hydrogen 3.004 N/A ARG 24.A NH2 ASP 261.A O no hydrogen 3.229 N/A TYR 25.A N TYR 37.A O no hydrogen 3.224 N/A TYR 25.A OH GLU 8.A OE2 no hydrogen 2.509 N/A PHE 26.A N GLY 9.A O no hydrogen 2.786 N/A LEU 27.A N ILE 35.A O no hydrogen 3.191 N/A LEU 28.A N LYS 7.A O no hydrogen 2.930 N/A LYS 29.A N THR 33.A O no hydrogen 2.861 N/A ASP 31.A N ASP 31.A OD1 no hydrogen 2.645 N/A GLY 32.A N LYS 29.A O no hydrogen 3.049 N/A THR 33.A N ASP 31.A OD1 no hydrogen 3.032 N/A THR 33.A OG1 ASP 31.A OD2 no hydrogen 2.663 N/A PHE 34.A N PHE 51.A O no hydrogen 2.676 N/A ILE 35.A N LEU 27.A O no hydrogen 3.430 N/A TYR 37.A N TYR 25.A O no hydrogen 2.929 N/A ASN 49.A N ASN 221.A O no hydrogen 2.877 N/A ASN 50.A ND2 VAL 223.A O no hydrogen 3.117 N/A PHE 51.A N LEU 48.A O no hydrogen 3.198 N/A SER 52.A N ASN 49.A O no hydrogen 3.224 N/A VAL 53.A N GLY 32.A O no hydrogen 2.911 N/A CYS 56.A SG ALA 54.A O no hydrogen 2.988 N/A LYS 60.A NZ GLU 90.A OE1 no hydrogen 2.980 N/A THR 61.A N THR 68.A O no hydrogen 3.066 N/A ARG 63.A N THR 61.A OG1 no hydrogen 3.302 N/A ARG 63.A NE GLU 62.A O no hydrogen 2.959 N/A ARG 63.A NH2 GLU 62.A O no hydrogen 3.440 N/A THR 68.A OG1 ARG 65.A O no hydrogen 3.282 N/A ILE 70.A N MET 59.A O no hydrogen 3.082 N/A ILE 71.A N ARG 82.A O no hydrogen 3.483 N/A ARG 72.A N GLN 57.A O no hydrogen 3.141 N/A ARG 72.A NE VAL 147.A O no hydrogen 2.770 N/A ARG 72.A NH1 GLU 81.A OE2 no hydrogen 2.641 N/A ARG 72.A NH2 VAL 147.A O no hydrogen 3.374 N/A CYS 73.A N ILE 80.A O no hydrogen 3.033 N/A LEU 74.A N GLN 55.A O no hydrogen 3.239 N/A GLN 75.A NE2 ASN 50.A O no hydrogen 2.958 N/A THR 77.A OG1 ASP 244.A OD1 no hydrogen 2.464 N/A THR 78.A N GLN 75.A O no hydrogen 2.790 N/A ILE 80.A N CYS 73.A O no hydrogen 3.092 N/A ARG 82.A N ILE 71.A O no hydrogen 3.282 N/A PHE 84.A N PHE 69.A O no hydrogen 3.463 N/A THR 85.A OG1 GLU 87.A OE2 no hydrogen 3.423 N/A THR 85.A OG1 GLU 88.A OE1 no hydrogen 3.090 N/A GLU 87.A N GLU 87.A OE2 no hydrogen 2.775 N/A GLU 88.A N THR 85.A O no hydrogen 3.331 N/A GLU 90.A N GLU 87.A O no hydrogen 3.313 N/A GLU 91.A N GLU 88.A O no hydrogen 2.709 N/A TRP 92.A N GLU 88.A O no hydrogen 2.918 N/A THR 93.A OG1 ARG 89.A O no hydrogen 2.733 N/A THR 94.A N GLU 91.A O no hydrogen 2.995 N/A THR 94.A OG1 GLU 90.A O no hydrogen 2.449 N/A ALA 95.A N GLU 91.A O no hydrogen 2.819 N/A ILE 96.A N TRP 92.A O no hydrogen 2.931 N/A THR 98.A N THR 94.A O no hydrogen 3.139 N/A THR 98.A OG1 THR 94.A O no hydrogen 2.510 N/A VAL 99.A N ALA 95.A O no hydrogen 2.982 N/A ALA 100.A N ILE 96.A O no hydrogen 2.902 N/A ASP 101.A N GLN 97.A O no hydrogen 2.773 N/A GLY 102.A N THR 98.A O no hydrogen 2.613 N/A LEU 103.A N VAL 99.A O no hydrogen 2.626 N/A LYS 104.A N ALA 100.A O no hydrogen 2.926 N/A LYS 104.A NZ CYS 56.A O no hydrogen 2.952 N/A LYS 104.A NZ ASP 101.A OD1 no hydrogen 3.531 N/A LYS 105.A N GLY 102.A O no hydrogen 3.217 N/A THR 108.A N GLU 111.A OE2 no hydrogen 3.037 N/A THR 108.A OG1 GLU 111.A OE2 no hydrogen 3.019 N/A GLU 113.A N LYS 130.A O no hydrogen 2.813 N/A LEU 115.A N LEU 128.A O no hydrogen 2.757 N/A LEU 118.A N VAL 126.A O no hydrogen 2.787 N/A GLY 119.A N VAL 126.A O no hydrogen 3.417 N/A GLY 121.A N GLY 124.A O no hydrogen 2.607 N/A PHE 123.A N LEU 247.A O no hydrogen 3.237 N/A GLY 124.A N GLY 121.A O no hydrogen 3.102 N/A LYS 125.A N ILE 142.A O no hydrogen 3.103 N/A VAL 126.A N GLY 119.A O no hydrogen 2.770 N/A ILE 127.A N MET 140.A O no hydrogen 2.916 N/A LEU 128.A N LYS 116.A O no hydrogen 2.965 N/A VAL 129.A N TYR 138.A O no hydrogen 2.906 N/A LYS 130.A N GLU 113.A O no hydrogen 2.991 N/A GLU 131.A N ARG 136.A O no hydrogen 3.503 N/A LYS 132.A N GLU 111.A O no hydrogen 2.405 N/A THR 134.A N GLU 131.A O no hydrogen 3.068 N/A THR 134.A OG1 GLU 131.A OE1 no hydrogen 2.768 N/A GLY 135.A N GLU 131.A O no hydrogen 2.662 N/A TYR 138.A N VAL 129.A O no hydrogen 2.850 N/A TYR 138.A OH GLU 131.A OE1 no hydrogen 3.324 N/A ALA 139.A N MET 179.A O no hydrogen 3.010 N/A MET 140.A N ILE 127.A O no hydrogen 2.548 N/A LYS 141.A N PHE 177.A O no hydrogen 2.829 N/A LYS 141.A NZ THR 77.A O no hydrogen 3.229 N/A LYS 141.A NZ THR 77.A OG1 no hydrogen 3.311 N/A LYS 141.A NZ THR 78.A OG1 no hydrogen 2.891 N/A LYS 141.A NZ ASP 244.A O no hydrogen 3.392 N/A LYS 141.A NZ GLY 246.A O no hydrogen 2.920 N/A ILE 142.A N LYS 125.A O no hydrogen 2.911 N/A LEU 143.A N LEU 175.A O no hydrogen 2.831 N/A LYS 144.A N PHE 123.A O no hydrogen 3.205 N/A LYS 145.A N ASP 173.A O no hydrogen 2.969 N/A LYS 145.A NZ THR 171.A O no hydrogen 2.742 N/A VAL 147.A N LYS 144.A O no hydrogen 3.387 N/A ILE 148.A N LYS 145.A O no hydrogen 3.198 N/A ALA 150.A N ILE 148.A O no hydrogen 2.772 N/A GLN 155.A N ARG 152.A O no hydrogen 3.101 N/A ASN 156.A N VAL 153.A O no hydrogen 3.358 N/A SER 157.A OG VAL 153.A O no hydrogen 3.332 N/A ARG 158.A NH2 HIS 159.A O no hydrogen 3.173 N/A PHE 161.A N HIS 159.A ND1 no hydrogen 3.202 N/A LEU 162.A N HIS 159.A O no hydrogen 3.160 N/A THR 163.A N ILE 242.A O no hydrogen 3.187 N/A THR 163.A OG1 ILE 242.A O no hydrogen 3.539 N/A LYS 166.A N VAL 178.A O no hydrogen 2.885 N/A TYR 167.A N VAL 178.A O no hydrogen 3.158 N/A PHE 169.A N CYS 176.A O no hydrogen 3.089 N/A THR 171.A N ARG 174.A O no hydrogen 3.108 N/A THR 171.A OG1 ARG 174.A O no hydrogen 3.506 N/A LEU 175.A N LEU 143.A O no hydrogen 2.679 N/A CYS 176.A N PHE 169.A O no hydrogen 2.963 N/A PHE 177.A N LYS 141.A O no hydrogen 2.934 N/A VAL 178.A N TYR 167.A O no hydrogen 2.582 N/A MET 179.A N ALA 139.A O no hydrogen 2.960 N/A GLU 180.A N ALA 164.A O no hydrogen 2.752 N/A GLY 184.A N LEU 234.A O no hydrogen 2.859 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.448 N/A LEU 187.A N LEU 232.A O no hydrogen 2.875 N/A LEU 191.A N LEU 187.A O no hydrogen 2.893 N/A SER 192.A N PHE 189.A O no hydrogen 2.633 N/A SER 192.A OG PHE 188.A O no hydrogen 2.853 N/A ARG 193.A N PHE 189.A O no hydrogen 3.437 N/A ARG 195.A N LEU 191.A O no hydrogen 2.765 N/A VAL 196.A N GLU 194.A O no hydrogen 2.789 N/A PHE 197.A N MET 280.A O no hydrogen 2.747 N/A ARG 201.A N SER 198.A OG no hydrogen 3.091 N/A ALA 202.A N SER 198.A O no hydrogen 3.030 N/A ARG 203.A N GLU 199.A O no hydrogen 2.666 N/A ARG 203.A NH1 PHE 345.A O no hydrogen 2.967 N/A PHE 204.A N ASP 200.A O no hydrogen 3.138 N/A PHE 204.A N ARG 201.A O no hydrogen 3.343 N/A TYR 205.A N ARG 201.A O no hydrogen 3.451 N/A GLY 206.A N ALA 202.A O no hydrogen 2.998 N/A ALA 207.A N ARG 203.A O no hydrogen 3.137 N/A GLU 208.A N PHE 204.A O no hydrogen 3.460 N/A ILE 209.A N TYR 205.A O no hydrogen 3.091 N/A VAL 210.A N GLY 206.A O no hydrogen 2.913 N/A SER 211.A N ALA 207.A O no hydrogen 3.020 N/A SER 211.A OG HIS 159.A NE2 no hydrogen 3.174 N/A ALA 212.A N GLU 208.A O no hydrogen 3.197 N/A LEU 213.A N ILE 209.A O no hydrogen 2.802 N/A ASP 214.A N VAL 210.A O no hydrogen 2.762 N/A TYR 215.A N SER 211.A O no hydrogen 3.026 N/A TYR 215.A OH ASN 156.A O no hydrogen 2.814 N/A LEU 216.A N ALA 212.A O no hydrogen 3.060 N/A HIS 217.A N LEU 213.A O no hydrogen 2.865 N/A HIS 217.A ND1 ASP 336.A OD1 no hydrogen 2.936 N/A HIS 217.A ND1 ASP 336.A OD2 no hydrogen 2.716 N/A HIS 217.A NE2 ASP 269.A OD2 no hydrogen 2.672 N/A SER 218.A N ASP 214.A O no hydrogen 2.869 N/A SER 218.A OG ASP 214.A O no hydrogen 3.249 N/A SER 218.A OG ASP 214.A OD1 no hydrogen 3.319 N/A GLU 219.A N TYR 215.A O no hydrogen 3.036 N/A LYS 220.A NZ TYR 215.A OH no hydrogen 3.271 N/A VAL 222.A N LEU 216.A O no hydrogen 2.972 N/A VAL 223.A N ASN 50.A OD1 no hydrogen 3.050 N/A TYR 224.A N ASP 269.A OD1 no hydrogen 3.188 N/A TYR 224.A N ASP 269.A OD2 no hydrogen 3.004 N/A TYR 224.A OH THR 243.A O no hydrogen 2.703 N/A ARG 225.A N ASP 269.A OD1 no hydrogen 2.711 N/A LYS 228.A NZ GLU 250.A OE1 no hydrogen 2.892 N/A GLU 230.A N GLU 230.A OE2 no hydrogen 2.782 N/A ASN 231.A N LYS 228.A O no hydrogen 2.836 N/A ASN 231.A ND2 ASP 226.A O no hydrogen 2.911 N/A ASN 231.A ND2 ASP 226.A OD1 no hydrogen 2.790 N/A LEU 232.A N LEU 229.A O no hydrogen 3.381 N/A MET 233.A N LYS 241.A O no hydrogen 3.112 N/A LEU 234.A N GLY 185.A O no hydrogen 2.726 N/A ASP 235.A N HIS 239.A O no hydrogen 2.809 N/A LYS 236.A NZ ASP 237.A OD1 no hydrogen 3.188 N/A LYS 236.A NZ ASP 237.A OD2 no hydrogen 3.001 N/A ASP 237.A N ASP 235.A OD1 no hydrogen 2.846 N/A GLY 238.A N ASP 235.A O no hydrogen 3.266 N/A HIS 239.A N ASP 235.A OD1 no hydrogen 2.822 N/A HIS 239.A ND1 GLU 208.A OE2 no hydrogen 2.706 N/A ILE 240.A N GLU 208.A OE1 no hydrogen 2.811 N/A LYS 241.A N MET 233.A O no hydrogen 2.822 N/A LYS 241.A NZ PRO 160.A O no hydrogen 2.690 N/A LYS 241.A NZ GLU 180.A OE2 no hydrogen 3.400 N/A ILE 242.A N PHE 161.A O no hydrogen 2.896 N/A THR 243.A N ASN 231.A O no hydrogen 3.058 N/A THR 243.A OG1 ASN 231.A O no hydrogen 3.274 N/A CYS 248.A SG THR 122.A OG1 no hydrogen 3.688 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.875 N/A TYR 253.A OH GLU 230.A OE2 no hydrogen 3.246 N/A TYR 253.A OH GLU 279.A OE1 no hydrogen 2.591 N/A LEU 254.A N PRO 251.A O no hydrogen 3.379 N/A GLU 257.A N GLU 257.A OE1 no hydrogen 2.600 N/A VAL 258.A N ALA 255.A O no hydrogen 3.031 N/A LEU 259.A N ALA 255.A O no hydrogen 3.236 N/A GLU 260.A N PRO 256.A O no hydrogen 3.008 N/A ASP 261.A N VAL 258.A O no hydrogen 3.379 N/A ASN 262.A N GLU 257.A O no hydrogen 2.918 N/A ARG 266.A NH2 HIS 217.A O no hydrogen 3.130 N/A ASP 269.A N ARG 266.A O no hydrogen 3.293 N/A TRP 270.A N ALA 267.A O no hydrogen 3.125 N/A TRP 270.A NE1 ASP 336.A OD1 no hydrogen 3.020 N/A TRP 271.A N ALA 267.A O no hydrogen 3.072 N/A GLY 272.A N VAL 268.A O no hydrogen 3.423 N/A LEU 273.A N ASP 269.A O no hydrogen 2.988 N/A GLY 274.A N TRP 270.A O no hydrogen 2.802 N/A VAL 275.A N TRP 271.A O no hydrogen 2.927 N/A VAL 276.A N GLY 272.A O no hydrogen 2.924 N/A MET 277.A N LEU 273.A O no hydrogen 2.782 N/A TYR 278.A N GLY 274.A O no hydrogen 2.695 N/A TYR 278.A OH ARG 305.A O no hydrogen 2.744 N/A GLU 279.A N VAL 275.A O no hydrogen 2.829 N/A MET 280.A N VAL 276.A O no hydrogen 3.096 N/A MET 281.A N MET 277.A O no hydrogen 3.074 N/A GLY 283.A N GLU 279.A O no hydrogen 2.996 N/A ASP 291.A N ASN 289.A OD1 no hydrogen 2.595 N/A LEU 295.A N ASP 291.A O no hydrogen 2.981 N/A PHE 296.A N HIS 292.A O no hydrogen 3.014 N/A GLU 297.A N GLU 293.A O no hydrogen 3.236 N/A LEU 298.A N LYS 294.A O no hydrogen 2.847 N/A ILE 299.A N LEU 295.A O no hydrogen 3.172 N/A LEU 300.A N PHE 296.A O no hydrogen 3.024 N/A MET 301.A N GLU 297.A O no hydrogen 2.793 N/A GLU 302.A N LEU 298.A O no hydrogen 2.983 N/A LEU 310.A N PRO 307.A O no hydrogen 3.233 N/A GLY 311.A N GLU 199.A OE2 no hydrogen 2.976 N/A GLU 313.A N GLU 313.A OE1 no hydrogen 3.083 N/A LYS 315.A NZ LEU 310.A O no hydrogen 3.565 N/A SER 316.A N PRO 312.A O no hydrogen 3.075 N/A SER 316.A OG HIS 343.A NE2 no hydrogen 3.045 N/A LEU 317.A N GLU 313.A O no hydrogen 3.060 N/A LEU 318.A N ALA 314.A O no hydrogen 3.247 N/A SER 319.A N LYS 315.A O no hydrogen 2.839 N/A SER 319.A OG LYS 315.A O no hydrogen 2.774 N/A GLY 320.A N SER 316.A O no hydrogen 3.332 N/A LEU 321.A N LEU 317.A O no hydrogen 3.075 N/A LEU 322.A N LEU 318.A O no hydrogen 2.953 N/A LYS 323.A N GLY 320.A O no hydrogen 3.478 N/A LYS 324.A NZ LEU 298.A O no hydrogen 3.210 N/A LYS 324.A NZ ILE 299.A O no hydrogen 2.656 N/A LYS 324.A NZ GLU 302.A O no hydrogen 2.753 N/A LYS 327.A N ASP 325.A OD1 no hydrogen 3.258 N/A LYS 327.A NZ ASP 325.A OD1 no hydrogen 2.800 N/A LYS 327.A NZ ASP 325.A OD2 no hydrogen 3.513 N/A GLN 328.A N ASP 325.A O no hydrogen 2.764 N/A ARG 329.A N ASP 325.A O no hydrogen 2.881 N/A ARG 329.A N PRO 326.A O no hydrogen 3.154 N/A ARG 329.A NE LYS 323.A O no hydrogen 3.057 N/A ARG 329.A NH1 GLU 257.A OE2 no hydrogen 2.656 N/A ARG 329.A NH1 ALA 267.A O no hydrogen 2.914 N/A ARG 329.A NH2 GLU 257.A OE1 no hydrogen 2.857 N/A ARG 329.A NH2 GLU 257.A OE2 no hydrogen 3.147 N/A ARG 329.A NH2 LYS 323.A O no hydrogen 3.311 N/A ARG 329.A NH2 LYS 324.A O no hydrogen 3.154 N/A LEU 330.A N GLY 320.A O no hydrogen 2.906 N/A GLY 332.A N ARG 329.A O no hydrogen 2.772 N/A GLY 333.A N GLU 339.A OE2 no hydrogen 3.307 N/A ASP 336.A N GLY 333.A O no hydrogen 3.171 N/A LYS 338.A N GLU 335.A O no hydrogen 3.141 N/A LYS 338.A NZ ASP 214.A OD1 no hydrogen 3.066 N/A GLU 339.A N ASP 336.A O no hydrogen 3.366 N/A MET 341.A N ALA 337.A O no hydrogen 3.061 N/A HIS 343.A N ILE 340.A O no hydrogen 2.908 N/A HIS 343.A NE2 SER 316.A OG no hydrogen 3.045 N/A PHE 345.A N HIS 343.A ND1 no hydrogen 3.112 N/A PHE 346.A N HIS 343.A O no hydrogen 3.171 N/A ALA 347.A N ARG 344.A O no hydrogen 2.982 N/A ILE 349.A N PHE 346.A O no hydrogen 3.307 N/A HIS 353.A N VAL 350.A O no hydrogen 2.974 N/A TYR 355.A N TRP 351.A O no hydrogen 3.050 N/A GLU 356.A N GLN 352.A O no hydrogen 2.974 N/A LYS 357.A N VAL 354.A O no hydrogen 3.013 N/A LYS 358.A N HIS 353.A O no hydrogen 2.862 N/A LYS 358.A NZ GLU 356.A OE1 no hydrogen 2.626 N/A LYS 364.A NZ ASP 237.A O no hydrogen 2.918 N/A VAL 367.A N PRO 365.A O no hydrogen 3.115 N/A