Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s0u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 ALA 3.A O no hydrogen 3.165 N/A GLN 2.A NE2 HIS 267.A O no hydrogen 2.734 N/A GLN 2.A NE2 GLY 269.A O no hydrogen 3.003 N/A GLU 4.A N ARG 71.A O no hydrogen 2.753 N/A ASN 6.A N ASP 95.A OD2 no hydrogen 2.940 N/A ILE 7.A N SER 73.A O no hydrogen 2.820 N/A GLY 8.A N GLY 96.A O no hydrogen 2.991 N/A MET 9.A N VAL 75.A O no hydrogen 3.190 N/A VAL 10.A N ILE 98.A O no hydrogen 2.874 N/A GLY 11.A N HIS 115.A ND1 no hydrogen 2.803 N/A VAL 13.A N GLN 111.A OE1 no hydrogen 3.464 N/A ASP 14.A N HIS 12.A ND1 no hydrogen 2.617 N/A HIS 15.A N HIS 12.A O no hydrogen 3.134 N/A HIS 15.A NE2 GLU 105.A OE1 no hydrogen 2.856 N/A LYS 17.A NZ MET 9.A O no hydrogen 2.995 N/A SER 19.A OG GLY 16.A O no hydrogen 3.312 N/A LEU 20.A N GLY 16.A O no hydrogen 3.150 N/A THR 21.A N LYS 17.A O no hydrogen 2.956 N/A THR 21.A OG1 LYS 17.A O no hydrogen 2.873 N/A LYS 22.A N THR 18.A O no hydrogen 3.371 N/A LYS 22.A NZ GLY 26.A O no hydrogen 2.586 N/A ALA 23.A N SER 19.A O no hydrogen 2.974 N/A LEU 24.A N LEU 20.A O no hydrogen 3.248 N/A THR 25.A N THR 21.A O no hydrogen 3.063 N/A THR 25.A N LYS 22.A O no hydrogen 3.240 N/A THR 25.A OG1 THR 21.A O no hydrogen 2.698 N/A GLY 26.A N LYS 22.A O no hydrogen 2.607 N/A VAL 27.A N THR 25.A OG1 no hydrogen 3.100 N/A GLY 38.A N ASP 76.A O no hydrogen 2.817 N/A ALA 40.A N PHE 74.A O no hydrogen 2.928 N/A CYS 42.A N VAL 72.A O no hydrogen 2.836 N/A CYS 42.A SG LEU 24.A O no hydrogen 3.454 N/A ILE 44.A N ARG 70.A O no hydrogen 2.900 N/A ARG 45.A N THR 54.A O no hydrogen 2.724 N/A LYS 46.A N GLU 67.A O no hydrogen 2.904 N/A LYS 46.A NZ TYR 53.A OH no hydrogen 3.104 N/A CYS 47.A N THR 52.A O no hydrogen 3.116 N/A GLY 51.A N CYS 47.A O no hydrogen 3.020 N/A THR 52.A OG1 ASP 169.A OD1 no hydrogen 3.456 N/A TYR 53.A N ASP 169.A OD1 no hydrogen 2.707 N/A THR 54.A N ARG 45.A O no hydrogen 2.881 N/A LYS 56.A N THR 54.A OG1 no hydrogen 2.873 N/A CYS 59.A N ALA 64.A O no hydrogen 2.838 N/A CYS 62.A N CYS 59.A O no hydrogen 3.244 N/A ALA 64.A N CYS 62.A O no hydrogen 2.504 N/A THR 66.A N PRO 57.A O no hydrogen 2.975 N/A THR 66.A OG1 LYS 56.A O no hydrogen 2.852 N/A THR 66.A OG1 PRO 57.A O no hydrogen 3.151 N/A GLU 67.A N LYS 46.A O no hydrogen 2.570 N/A LEU 69.A N ILE 44.A O no hydrogen 3.026 N/A ARG 70.A NH1 ILE 179.A O no hydrogen 2.944 N/A ARG 70.A NH1 THR 181.A OG1 no hydrogen 3.118 N/A ARG 70.A NH2 ILE 175.A O no hydrogen 3.374 N/A ARG 70.A NH2 ILE 179.A O no hydrogen 3.084 N/A ARG 71.A NH1 SER 1.A O no hydrogen 3.254 N/A ARG 71.A NH1 ALA 258.A O no hydrogen 2.951 N/A ARG 71.A NH2 ALA 258.A O no hydrogen 2.958 N/A VAL 72.A N CYS 42.A O no hydrogen 2.924 N/A SER 73.A N VAL 5.A O no hydrogen 3.003 N/A SER 73.A OG ASP 41.A OD1 no hydrogen 3.011 N/A PHE 74.A N ALA 40.A O no hydrogen 2.641 N/A VAL 75.A N ILE 7.A O no hydrogen 2.851 N/A ASP 76.A N GLY 38.A O no hydrogen 2.828 N/A SER 77.A OG THR 86.A OG1 no hydrogen 3.271 N/A HIS 80.A ND1 HIS 115.A NE2 no hydrogen 2.988 N/A HIS 80.A NE2 GLU 114.A OE1 no hydrogen 2.646 N/A LEU 83.A N GLY 79.A O no hydrogen 2.911 N/A MET 84.A N HIS 80.A O no hydrogen 3.056 N/A ALA 85.A N GLU 81.A O no hydrogen 2.979 N/A THR 86.A N THR 82.A O no hydrogen 2.821 N/A THR 86.A OG1 SER 77.A OG no hydrogen 3.271 N/A THR 86.A OG1 THR 82.A O no hydrogen 2.524 N/A MET 87.A N LEU 83.A O no hydrogen 3.187 N/A MET 87.A N MET 84.A O no hydrogen 3.283 N/A LEU 88.A N MET 84.A O no hydrogen 3.024 N/A SER 89.A N ALA 85.A O no hydrogen 3.009 N/A SER 89.A OG ALA 85.A O no hydrogen 3.262 N/A SER 89.A OG THR 86.A O no hydrogen 3.343 N/A SER 89.A OG GLY 339.A O no hydrogen 3.106 N/A GLY 90.A N MET 87.A O no hydrogen 3.099 N/A ALA 91.A N SER 89.A OG no hydrogen 3.176 N/A SER 92.A N THR 86.A O no hydrogen 3.034 N/A ASP 95.A N ASN 6.A O no hydrogen 3.031 N/A GLY 96.A N ASN 6.A O no hydrogen 3.405 N/A ALA 97.A N LYS 126.A O no hydrogen 3.017 N/A ILE 98.A N GLY 8.A O no hydrogen 2.691 N/A LEU 99.A N ILE 128.A O no hydrogen 3.076 N/A VAL 100.A N VAL 10.A O no hydrogen 2.809 N/A ILE 101.A N VAL 130.A O no hydrogen 2.885 N/A ALA 102.A N HIS 15.A ND1 no hydrogen 3.046 N/A ALA 103.A N ASN 132.A O no hydrogen 3.140 N/A GLN 109.A NE2 PRO 106.A O no hydrogen 2.884 N/A LYS 113.A N GLN 109.A O no hydrogen 2.979 N/A GLU 114.A N PRO 110.A O no hydrogen 2.900 N/A HIS 115.A N GLN 111.A O no hydrogen 2.948 N/A LEU 116.A N THR 112.A O no hydrogen 3.369 N/A MET 117.A N LYS 113.A O no hydrogen 3.165 N/A ALA 118.A N GLU 114.A O no hydrogen 3.234 N/A LEU 119.A N HIS 115.A O no hydrogen 3.027 N/A GLU 120.A N LEU 116.A O no hydrogen 2.940 N/A ILE 121.A N MET 117.A O no hydrogen 2.919 N/A LEU 122.A N ALA 118.A O no hydrogen 2.865 N/A GLY 123.A N GLU 120.A O no hydrogen 2.846 N/A ILE 124.A N LEU 119.A O no hydrogen 2.942 N/A LYS 126.A NZ PRO 180.A O no hydrogen 2.910 N/A ILE 127.A N ASP 125.A O no hydrogen 2.899 N/A ILE 128.A N ALA 97.A O no hydrogen 3.086 N/A ILE 129.A N PRO 162.A O no hydrogen 2.917 N/A VAL 130.A N LEU 99.A O no hydrogen 3.139 N/A GLN 131.A N ILE 164.A O no hydrogen 2.881 N/A ASN 132.A N ILE 101.A O no hydrogen 2.971 N/A LYS 133.A NZ ASP 14.A O no hydrogen 2.898 N/A ASP 138.A N GLN 141.A OE1 no hydrogen 2.717 N/A ALA 142.A N ASP 138.A O no hydrogen 2.890 N/A GLU 144.A N GLN 141.A O no hydrogen 3.164 N/A ASN 145.A N GLN 141.A O no hydrogen 2.834 N/A ASN 145.A ND2 GLN 131.A OE1 no hydrogen 2.875 N/A GLN 148.A N GLU 144.A O no hydrogen 3.044 N/A ILE 149.A N ASN 145.A O no hydrogen 2.979 N/A LYS 150.A N TYR 146.A O no hydrogen 3.063 N/A GLU 151.A N GLU 147.A O no hydrogen 2.969 N/A PHE 152.A N GLN 148.A O no hydrogen 2.792 N/A VAL 153.A N ILE 149.A O no hydrogen 3.060 N/A LYS 154.A N GLU 151.A O no hydrogen 2.965 N/A GLY 155.A N GLU 159.A OE1 no hydrogen 2.519 N/A THR 156.A N VAL 153.A O no hydrogen 2.963 N/A THR 156.A OG1 VAL 153.A O no hydrogen 2.825 N/A ILE 157.A N GLU 120.A OE1 no hydrogen 2.731 N/A ALA 158.A N THR 156.A OG1 no hydrogen 3.024 N/A GLU 159.A N THR 156.A O no hydrogen 3.175 N/A ALA 161.A N ALA 158.A O no hydrogen 3.042 N/A ILE 164.A N ILE 129.A O no hydrogen 2.850 N/A ILE 166.A N GLN 131.A O no hydrogen 3.076 N/A VAL 170.A N ASN 167.A OD1 no hydrogen 2.935 N/A LEU 171.A N ASN 167.A O no hydrogen 3.511 N/A LEU 172.A N ILE 168.A O no hydrogen 3.121 N/A LYS 173.A N ASP 169.A O no hydrogen 3.304 N/A LYS 173.A NZ ASP 177.A OD2 no hydrogen 3.211 N/A ALA 174.A N VAL 170.A O no hydrogen 3.088 N/A ILE 175.A N LEU 171.A O no hydrogen 2.874 N/A GLN 176.A N LEU 172.A O no hydrogen 3.145 N/A ASP 177.A N LYS 173.A O no hydrogen 2.924 N/A PHE 178.A N ALA 174.A O no hydrogen 2.845 N/A ILE 179.A N ILE 175.A O no hydrogen 3.105 N/A THR 181.A OG1 GLU 4.A OE1 no hydrogen 2.807 N/A ARG 184.A NH2 GLU 4.A O no hydrogen 2.890 N/A ASP 187.A N ASP 185.A OD1 no hydrogen 3.105 N/A ALA 188.A N ASP 185.A O no hydrogen 3.162 N/A ARG 191.A N GLN 221.A O no hydrogen 3.279 N/A ARG 191.A NH2 THR 298.A O no hydrogen 3.041 N/A MET 192.A N VAL 293.A O no hydrogen 2.709 N/A TYR 193.A N ALA 218.A O no hydrogen 3.066 N/A VAL 194.A N SER 291.A O no hydrogen 2.942 N/A ALA 195.A N GLY 216.A O no hydrogen 2.820 N/A ARG 196.A N GLY 216.A O no hydrogen 3.195 N/A ARG 196.A NE ASP 286.A OD1 no hydrogen 3.082 N/A ARG 196.A NE ASP 286.A OD2 no hydrogen 3.414 N/A SER 197.A N ASP 286.A OD1 no hydrogen 3.017 N/A SER 197.A OG THR 283.A O no hydrogen 2.662 N/A PHE 198.A N VAL 214.A O no hydrogen 2.784 N/A ASN 201.A N ASP 199.A OD1 no hydrogen 3.266 N/A ASN 201.A ND2 ASP 199.A OD1 no hydrogen 2.829 N/A ASN 201.A ND2 LYS 211.A O no hydrogen 3.352 N/A THR 205.A OG1 LYS 202.A O no hydrogen 3.299 N/A THR 205.A OG1 PRO 203.A O no hydrogen 3.254 N/A ASP 209.A N GLU 206.A O no hydrogen 2.764 N/A LEU 210.A N ILE 207.A O no hydrogen 3.316 N/A LYS 211.A N ASN 201.A OD1 no hydrogen 3.096 N/A LYS 211.A NZ THR 276.A O no hydrogen 3.120 N/A GLY 213.A N LEU 278.A O no hydrogen 2.652 N/A VAL 214.A N PHE 198.A O no hydrogen 3.090 N/A LEU 215.A N VAL 274.A O no hydrogen 2.752 N/A GLY 216.A N ARG 196.A O no hydrogen 2.547 N/A GLY 217.A N ILE 272.A O no hydrogen 2.833 N/A ALA 218.A N TYR 193.A O no hydrogen 2.904 N/A ILE 220.A N ARG 191.A O no hydrogen 3.282 N/A GLN 221.A NE2 THR 189.A O no hydrogen 2.721 N/A PHE 224.A N ALA 266.A O no hydrogen 2.919 N/A LYS 225.A N ASP 228.A OD2 no hydrogen 2.723 N/A VAL 226.A N ARG 264.A O no hydrogen 3.011 N/A GLY 227.A N ILE 253.A O no hydrogen 2.861 N/A ASP 228.A N LYS 225.A O no hydrogen 3.141 N/A ILE 230.A N THR 251.A O no hydrogen 2.956 N/A GLU 231.A N GLY 294.A O no hydrogen 2.804 N/A ILE 232.A N LEU 249.A O no hydrogen 2.705 N/A ARG 233.A N VAL 292.A O no hydrogen 2.606 N/A ILE 236.A N LYS 247.A O no hydrogen 2.852 N/A VAL 238.A N PHE 245.A O no hydrogen 3.222 N/A THR 239.A OG1 THR 244.A OG1 no hydrogen 2.531 N/A LYS 243.A N GLU 240.A O no hydrogen 3.088 N/A THR 244.A OG1 VAL 238.A O no hydrogen 3.403 N/A THR 244.A OG1 THR 239.A OG1 no hydrogen 2.531 N/A LYS 247.A N ILE 236.A O no hydrogen 2.751 N/A THR 251.A N ILE 230.A O no hydrogen 3.188 N/A LYS 252.A N THR 251.A OG1 no hydrogen 2.725 N/A LYS 252.A NZ GLY 227.A O no hydrogen 2.487 N/A ILE 253.A N ASP 228.A O no hydrogen 2.880 N/A VAL 254.A N GLY 275.A O no hydrogen 2.609 N/A SER 255.A N GLY 275.A O no hydrogen 3.352 N/A ALA 257.A N GLY 273.A O no hydrogen 3.075 N/A ALA 258.A N THR 261.A O no hydrogen 2.808 N/A THR 261.A N ALA 258.A O no hydrogen 2.984 N/A LEU 263.A N LEU 256.A O no hydrogen 2.947 N/A HIS 267.A N GLN 2.A OE1 no hydrogen 2.781 N/A GLY 270.A N ASN 6.A OD1 no hydrogen 2.612 N/A ILE 272.A N GLY 217.A O no hydrogen 2.737 N/A GLY 273.A N ALA 257.A O no hydrogen 2.899 N/A VAL 274.A N LEU 215.A O no hydrogen 2.690 N/A GLY 275.A N SER 255.A O no hydrogen 2.917 N/A THR 276.A N GLY 213.A O no hydrogen 3.120 N/A THR 276.A OG1 GLY 213.A O no hydrogen 2.728 N/A THR 277.A N THR 251.A OG1 no hydrogen 2.855 N/A LEU 278.A N THR 276.A OG1 no hydrogen 3.116 N/A TYR 281.A N ASP 279.A OD1 no hydrogen 3.019 N/A LEU 282.A N ASP 279.A O no hydrogen 3.097 N/A THR 283.A N PRO 280.A O no hydrogen 3.108 N/A THR 283.A OG1 PHE 198.A O no hydrogen 2.680 N/A THR 283.A OG1 PRO 280.A O no hydrogen 3.126 N/A LYS 284.A N PRO 280.A O no hydrogen 3.095 N/A ASP 286.A N SER 197.A O no hydrogen 3.028 N/A ALA 287.A N LYS 284.A O no hydrogen 3.068 N/A LEU 288.A N SER 197.A OG no hydrogen 3.416 N/A THR 289.A N ASP 286.A O no hydrogen 3.098 N/A THR 289.A OG1 ALA 195.A O no hydrogen 3.433 N/A THR 289.A OG1 ASP 286.A O no hydrogen 3.306 N/A GLY 290.A N VAL 194.A O no hydrogen 2.971 N/A SER 291.A OG LEU 288.A O no hydrogen 2.995 N/A VAL 292.A N ARG 233.A O no hydrogen 2.891 N/A VAL 293.A N MET 192.A O no hydrogen 2.655 N/A GLY 294.A N GLU 231.A O no hydrogen 3.205 N/A GLY 297.A N GLU 231.A OE2 no hydrogen 3.085 N/A THR 298.A N LEU 295.A O no hydrogen 2.876 N/A THR 298.A OG1 LEU 295.A O no hydrogen 2.556 N/A ARG 303.A N ILE 363.A O no hydrogen 2.823 N/A ARG 303.A NE ALA 365.A O no hydrogen 2.954 N/A ARG 303.A NH2 ALA 365.A O no hydrogen 3.502 N/A ILE 306.A N ILE 357.A O no hydrogen 2.729 N/A THR 307.A N GLY 391.A O no hydrogen 2.908 N/A THR 307.A OG1 ASP 356.A OD1 no hydrogen 2.978 N/A ILE 308.A N ALA 355.A O no hydrogen 2.955 N/A ARG 309.A N THR 388.A O no hydrogen 2.867 N/A ALA 310.A N ASP 353.A O no hydrogen 2.833 N/A ASN 311.A N TYR 386.A O no hydrogen 2.765 N/A LEU 313.A N ILE 384.A O no hydrogen 2.993 N/A ARG 315.A NE GLU 114.A OE2 no hydrogen 3.535 N/A ARG 315.A NH1 GLU 81.A OE1 no hydrogen 3.055 N/A ARG 315.A NH1 GLU 81.A OE2 no hydrogen 2.983 N/A ARG 315.A NH1 LEU 383.A O no hydrogen 2.786 N/A ARG 315.A NH2 GLU 81.A OE1 no hydrogen 2.698 N/A ARG 315.A NH2 GLU 114.A OE1 no hydrogen 3.352 N/A VAL 316.A N GLU 114.A OE2 no hydrogen 2.907 N/A VAL 317.A N GLU 114.A OE2 no hydrogen 2.813 N/A THR 319.A N GLU 322.A OE2 no hydrogen 2.995 N/A LYS 324.A N GLU 321.A O no hydrogen 3.001 N/A ARG 329.A N GLU 332.A OE1 no hydrogen 2.657 N/A GLY 331.A N ILE 347.A O no hydrogen 2.708 N/A GLU 332.A N ARG 329.A O no hydrogen 3.118 N/A LEU 334.A N GLY 345.A O no hydrogen 2.744 N/A MET 335.A N SER 374.A O no hydrogen 3.088 N/A LEU 336.A N THR 343.A O no hydrogen 2.937 N/A ASN 337.A N ALA 372.A O no hydrogen 3.129 N/A ILE 338.A N ALA 341.A O no hydrogen 3.064 N/A GLY 339.A N SER 89.A O no hydrogen 3.116 N/A THR 340.A OG1 VAL 194.A O no hydrogen 2.783 N/A ALA 341.A N ILE 338.A O no hydrogen 3.082 N/A THR 342.A OG1 ASN 337.A OD1 no hydrogen 3.260 N/A THR 343.A N LEU 336.A O no hydrogen 2.919 N/A THR 343.A OG1 ALA 344.A O no hydrogen 2.949 N/A GLY 345.A N LEU 334.A O no hydrogen 2.911 N/A VAL 346.A N LYS 358.A O no hydrogen 3.051 N/A ILE 347.A N GLU 332.A O no hydrogen 2.817 N/A THR 348.A N ASP 356.A O no hydrogen 2.935 N/A THR 348.A OG1 ASP 356.A O no hydrogen 3.438 N/A ALA 350.A N THR 330.A OG1 no hydrogen 3.123 N/A ARG 351.A N ILE 354.A O no hydrogen 2.753 N/A ARG 351.A NH1 SER 349.A OG no hydrogen 2.660 N/A ARG 351.A NH1 ASP 356.A OD1 no hydrogen 3.550 N/A ARG 351.A NH1 ASP 356.A OD2 no hydrogen 2.920 N/A ARG 351.A NH2 ASP 356.A OD1 no hydrogen 2.941 N/A ARG 351.A NH2 ASP 356.A OD2 no hydrogen 3.467 N/A ILE 354.A N ARG 351.A O no hydrogen 3.289 N/A ALA 355.A N ILE 308.A O no hydrogen 3.140 N/A ASP 356.A N SER 349.A O no hydrogen 2.965 N/A ILE 357.A N ILE 306.A O no hydrogen 2.636 N/A LYS 358.A N VAL 346.A O no hydrogen 2.973 N/A LYS 358.A NZ LYS 358.A O no hydrogen 2.904 N/A LEU 359.A N GLU 304.A O no hydrogen 2.944 N/A LYS 360.A N ALA 344.A O no hydrogen 3.066 N/A LEU 361.A N THR 343.A OG1 no hydrogen 2.997 N/A ILE 363.A N ARG 303.A O no hydrogen 2.909 N/A CYS 364.A SG PRO 300.A O no hydrogen 3.169 N/A GLU 366.A N ASP 369.A OD2 no hydrogen 2.626 N/A GLY 368.A N ILE 389.A O no hydrogen 2.691 N/A ASP 369.A N GLU 366.A O no hydrogen 3.005 N/A VAL 371.A N GLY 387.A O no hydrogen 2.889 N/A ALA 372.A N ASN 337.A O no hydrogen 2.787 N/A ILE 373.A N GLY 385.A O no hydrogen 2.789 N/A SER 374.A N MET 335.A O no hydrogen 3.067 N/A ARG 375.A N ARG 382.A O no hydrogen 2.868 N/A ARG 375.A NE GLU 332.A OE2 no hydrogen 2.969 N/A ARG 375.A NH1 GLU 326.A O no hydrogen 2.922 N/A ARG 375.A NH2 PRO 327.A O no hydrogen 3.565 N/A ARG 375.A NH2 GLU 332.A OE1 no hydrogen 2.832 N/A ARG 375.A NH2 GLU 332.A OE2 no hydrogen 2.590 N/A VAL 377.A N ARG 380.A O no hydrogen 3.175 N/A ARG 382.A N ARG 375.A O no hydrogen 2.992 N/A ARG 382.A NH1 VAL 317.A O no hydrogen 3.048 N/A ARG 382.A NH2 VAL 317.A O no hydrogen 3.169 N/A LEU 383.A N GLU 81.A OE2 no hydrogen 3.236 N/A ILE 384.A N ILE 373.A O no hydrogen 2.756 N/A GLY 385.A N ILE 373.A O no hydrogen 3.072 N/A TYR 386.A N ASN 311.A O no hydrogen 3.164 N/A GLY 387.A N VAL 371.A O no hydrogen 2.874 N/A THR 388.A N ARG 309.A O no hydrogen 2.980 N/A ILE 389.A N ASP 369.A O no hydrogen 2.985 N/A GLU 390.A N THR 307.A O no hydrogen 2.903 N/A GLY 391.A N THR 307.A O no hydrogen 3.191 N/A