Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3or1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 6.A N SER 4.A OG no hydrogen 2.978 N/A TYR 7.A N SER 5.A OG no hydrogen 3.388 N/A LYS 11.A N ASN 8.A O no hydrogen 3.016 N/A GLU 14.A N LYS 11.A O no hydrogen 3.135 N/A ARG 16.A NE PRO 12.A O no hydrogen 3.256 N/A ARG 16.A NH2 PRO 12.A O no hydrogen 3.010 N/A ARG 23.A NE GLU 27.A OE1 no hydrogen 3.420 N/A ARG 23.A NE GLU 27.A OE2 no hydrogen 2.523 N/A ARG 23.A NH2 GLU 27.A OE2 no hydrogen 3.025 N/A LYS 24.A N GLU 27.A OE1 no hydrogen 3.044 N/A GLU 27.A N LYS 24.A O no hydrogen 2.985 N/A PHE 28.A N PHE 25.A O no hydrogen 2.804 N/A PHE 29.A N THR 26.A O no hydrogen 3.384 N/A ILE 33.A N PRO 30.A O no hydrogen 2.897 N/A ALA 34.A N PRO 30.A O no hydrogen 3.060 N/A LYS 35.A N PRO 31.A O no hydrogen 2.993 N/A LYS 35.A NZ ASP 59.A OD2 no hydrogen 2.887 N/A ASN 36.A N VAL 32.A O no hydrogen 3.230 N/A ASN 36.A ND2 ASP 59.A OD2 no hydrogen 3.272 N/A ASN 39.A N ASN 36.A O no hydrogen 2.910 N/A ASP 41.A N VAL 54.A O no hydrogen 2.778 N/A TYR 42.A N VAL 54.A O no hydrogen 3.298 N/A GLU 44.A N VAL 52.A O no hydrogen 2.897 N/A LEU 46.A N ILE 50.A O no hydrogen 2.953 N/A GLU 47.A N ILE 50.A O no hydrogen 3.516 N/A GLY 49.A N THR 134.A OG1 no hydrogen 2.737 N/A ILE 50.A N GLU 47.A O no hydrogen 3.052 N/A LEU 51.A N THR 63.A O no hydrogen 2.941 N/A VAL 52.A N GLU 44.A O no hydrogen 3.011 N/A HIS 53.A N VAL 61.A O no hydrogen 2.957 N/A VAL 54.A N TYR 42.A O no hydrogen 2.861 N/A ALA 55.A N ASP 59.A O no hydrogen 2.809 N/A LYS 56.A N ASN 39.A O no hydrogen 2.903 N/A ASN 57.A ND2 ASP 59.A OD2 no hydrogen 3.158 N/A GLY 58.A N ALA 55.A O no hydrogen 3.000 N/A ASP 59.A N ASN 57.A OD1 no hydrogen 2.713 N/A VAL 61.A N HIS 53.A O no hydrogen 3.028 N/A PHE 62.A N VAL 104.A O no hydrogen 2.838 N/A THR 63.A N LEU 51.A O no hydrogen 3.051 N/A VAL 64.A N PHE 102.A O no hydrogen 2.719 N/A ARG 65.A N GLY 49.A O no hydrogen 2.822 N/A ARG 65.A NE GLU 101.A OE2 no hydrogen 2.830 N/A ARG 65.A NH1 GLY 133.A O no hydrogen 3.069 N/A ARG 65.A NH2 GLU 101.A OE2 no hydrogen 2.810 N/A CYS 66.A N ILE 100.A O no hydrogen 2.879 N/A CYS 66.A SG PHE 129.A O no hydrogen 3.846 N/A GLY 67.A N PRO 130.A O no hydrogen 2.721 N/A LEU 71.A N ALA 69.A O no hydrogen 2.522 N/A HIS 76.A N SER 73.A OG no hydrogen 3.125 N/A ILE 77.A N SER 73.A O no hydrogen 3.025 N/A ARG 78.A N THR 74.A O no hydrogen 2.751 N/A GLU 79.A N SER 75.A O no hydrogen 2.945 N/A ALA 80.A N HIS 76.A O no hydrogen 2.993 N/A CYS 81.A N ILE 77.A O no hydrogen 3.067 N/A CYS 81.A SG ILE 77.A O no hydrogen 3.558 N/A GLU 82.A N ARG 78.A O no hydrogen 3.012 N/A ILE 83.A N GLU 79.A O no hydrogen 3.228 N/A ALA 84.A N ALA 80.A O no hydrogen 3.206 N/A LYS 85.A N CYS 81.A O no hydrogen 2.947 N/A LYS 86.A N GLU 82.A O no hydrogen 3.102 N/A LYS 86.A N ILE 83.A O no hydrogen 3.216 N/A PHE 87.A N ILE 83.A O no hydrogen 2.972 N/A CYS 88.A N ALA 84.A O no hydrogen 2.750 N/A GLY 90.A N ALA 84.A O no hydrogen 2.731 N/A HIS 91.A N CYS 88.A O no hydrogen 3.030 N/A HIS 91.A ND1 CYS 88.A O no hydrogen 3.221 N/A ARG 93.A N GLU 101.A O no hydrogen 3.191 N/A ARG 93.A NH2 GLU 101.A OE1 no hydrogen 3.046 N/A THR 95.A N ASN 99.A O no hydrogen 2.886 N/A ARG 97.A N THR 95.A OG1 no hydrogen 3.009 N/A ARG 97.A NE ASN 140.A O no hydrogen 3.065 N/A ARG 97.A NH1 ASN 140.A O no hydrogen 3.205 N/A ASN 98.A N THR 95.A O no hydrogen 3.060 N/A ASN 99.A N THR 95.A OG1 no hydrogen 3.247 N/A ILE 100.A N CYS 66.A O no hydrogen 3.041 N/A GLU 101.A N ARG 93.A O no hydrogen 2.955 N/A PHE 102.A N VAL 64.A O no hydrogen 2.868 N/A VAL 104.A N PHE 62.A O no hydrogen 2.975 N/A ASN 106.A ND2 THR 109.A OG1 no hydrogen 2.735 N/A THR 109.A OG1 ASN 106.A OD1 no hydrogen 2.694 N/A LEU 110.A N ASN 106.A O no hydrogen 3.040 N/A LYS 111.A N GLU 107.A O no hydrogen 2.883 N/A ALA 112.A N GLU 108.A O no hydrogen 3.234 N/A LEU 113.A N THR 109.A O no hydrogen 2.886 N/A VAL 114.A N LEU 110.A O no hydrogen 3.046 N/A ALA 115.A N LYS 111.A O no hydrogen 3.113 N/A ASP 116.A N ALA 112.A O no hydrogen 3.168 N/A LEU 117.A N LEU 113.A O no hydrogen 2.920 N/A LYS 118.A N VAL 114.A O no hydrogen 3.205 N/A THR 119.A N ASP 116.A O no hydrogen 2.941 N/A THR 119.A OG1 ASP 116.A O no hydrogen 2.890 N/A THR 119.A OG1 ASP 116.A OD2 no hydrogen 3.336 N/A ARG 120.A N LEU 117.A O no hydrogen 3.171 N/A ARG 120.A NE ASP 116.A OD2 no hydrogen 3.296 N/A ARG 120.A NH1 GLU 79.A OE2 no hydrogen 2.766 N/A ARG 120.A NH1 GLU 82.A OE1 no hydrogen 3.176 N/A ARG 120.A NH2 GLU 82.A OE1 no hydrogen 3.019 N/A ARG 120.A NH2 ASP 116.A OD1 no hydrogen 3.141 N/A PHE 122.A N SER 126.A O no hydrogen 2.986 N/A GLY 125.A N PHE 122.A O no hydrogen 2.941 N/A LYS 128.A N ARG 120.A O no hydrogen 2.908 N/A LYS 128.A NZ GLU 79.A OE1 no hydrogen 2.875 N/A GLY 132.A N ARG 65.A O no hydrogen 2.890 N/A GLY 133.A N PHE 172.A O no hydrogen 2.977 N/A SER 137.A N GLY 135.A O no hydrogen 2.845 N/A SER 137.A OG THR 134.A O no hydrogen 2.911 N/A ILE 138.A N GLU 171.A O no hydrogen 3.037 N/A SER 139.A OG GLY 133.A O no hydrogen 3.551 N/A ASN 140.A ND2 ALA 68.A O no hydrogen 2.773 N/A ASN 140.A ND2 ASN 99.A OD1 no hydrogen 2.845 N/A ILE 141.A N ASN 140.A OD1 no hydrogen 2.703 N/A TRP 147.A N ASP 156.A OD2 no hydrogen 2.929 N/A VAL 148.A N GLN 145.A O no hydrogen 3.256 N/A TYR 149.A N GLY 146.A O no hydrogen 3.433 N/A CYS 150.A N GLY 146.A O no hydrogen 3.146 N/A CYS 150.A SG THR 152.A OG1 no hydrogen 3.457 N/A ALA 154.A N CYS 187.A O no hydrogen 2.676 N/A THR 155.A OG1 ASN 307.A OD1 no hydrogen 2.728 N/A GLY 159.A N ASP 156.A OD1 no hydrogen 2.734 N/A VAL 161.A N ALA 157.A O no hydrogen 3.061 N/A LYS 162.A N SER 158.A O no hydrogen 3.129 N/A LYS 162.A NZ ASP 166.A OD1 no hydrogen 2.875 N/A LYS 162.A NZ ASP 166.A OD2 no hydrogen 2.637 N/A ALA 163.A N GLY 159.A O no hydrogen 3.016 N/A VAL 164.A N PRO 160.A O no hydrogen 2.878 N/A MET 165.A N VAL 161.A O no hydrogen 2.957 N/A ASP 166.A N LYS 162.A O no hydrogen 3.082 N/A GLU 167.A N ALA 163.A O no hydrogen 3.458 N/A LEU 168.A N VAL 164.A O no hydrogen 2.920 N/A PHE 169.A N ASP 166.A O no hydrogen 3.358 N/A GLU 171.A N LEU 168.A O no hydrogen 2.807 N/A PHE 172.A N PHE 169.A O no hydrogen 2.938 N/A THR 173.A N PHE 169.A O no hydrogen 3.406 N/A SER 174.A OG GLU 170.A O no hydrogen 2.695 N/A ARG 176.A NE GLU 171.A OE1 no hydrogen 2.650 N/A ARG 176.A NH2 GLU 171.A OE2 no hydrogen 3.189 N/A LEU 177.A N ALA 136.A O no hydrogen 3.355 N/A VAL 181.A N SER 137.A O no hydrogen 3.267 N/A ARG 182.A N ASP 199.A OD2 no hydrogen 2.773 N/A SER 184.A N ILE 200.A O no hydrogen 3.033 N/A SER 184.A OG SER 198.A OG no hydrogen 2.713 N/A LEU 185.A N VAL 142.A O no hydrogen 2.935 N/A ALA 186.A N LEU 202.A O no hydrogen 3.048 N/A CYS 187.A N THR 144.A OG1 no hydrogen 3.051 N/A CYS 187.A SG THR 144.A OG1 no hydrogen 3.015 N/A MET 191.A N CYS 188.A O no hydrogen 3.002 N/A HIS 196.A N HIS 196.A ND1 no hydrogen 2.998 N/A CYS 197.A N ALA 194.A O no hydrogen 2.940 N/A CYS 197.A SG ALA 194.A O no hydrogen 3.436 N/A SER 198.A OG SER 184.A OG no hydrogen 2.713 N/A SER 198.A OG ALA 194.A O no hydrogen 2.810 N/A ILE 200.A N ARG 182.A O no hydrogen 3.053 N/A GLY 201.A N MET 283.A O no hydrogen 2.699 N/A LEU 202.A N SER 184.A O no hydrogen 2.965 N/A VAL 203.A N ALA 281.A O no hydrogen 2.972 N/A GLY 204.A N ALA 186.A O no hydrogen 3.183 N/A ILE 205.A N GLY 279.A O no hydrogen 2.907 N/A HIS 206.A ND1 TYR 259.A O no hydrogen 3.244 N/A ARG 207.A NE GLY 277.A O no hydrogen 2.908 N/A ARG 207.A NH1 THR 276.A O no hydrogen 3.188 N/A LYS 208.A NZ ASP 274.A OD1 no hydrogen 3.049 N/A LYS 208.A NZ ASP 274.A OD2 no hydrogen 3.425 N/A MET 211.A N PRO 271.A O no hydrogen 2.817 N/A ASP 213.A N ALA 269.A O no hydrogen 2.999 N/A ASN 216.A N ASP 213.A O no hydrogen 3.183 N/A ASN 216.A ND2 ASP 213.A OD1 no hydrogen 3.051 N/A ASN 216.A ND2 ASP 213.A OD2 no hydrogen 3.403 N/A LEU 217.A N ASP 213.A O no hydrogen 2.942 N/A LEU 220.A N ASN 216.A O no hydrogen 3.008 N/A LEU 220.A N LEU 217.A O no hydrogen 2.795 N/A CYS 221.A N LEU 217.A O no hydrogen 2.664 N/A LEU 225.A N GLU 222.A O no hydrogen 2.889 N/A VAL 227.A N ILE 223.A O no hydrogen 3.100 N/A ALA 228.A N PRO 224.A O no hydrogen 3.043 N/A ALA 229.A N ALA 226.A O no hydrogen 3.163 N/A CYS 230.A SG THR 232.A OG1 no hydrogen 3.403 N/A THR 232.A OG1 ARG 256.A O no hydrogen 2.654 N/A ALA 233.A N CYS 230.A O no hydrogen 3.382 N/A LYS 236.A N ALA 251.A O no hydrogen 3.039 N/A ILE 238.A N SER 249.A O no hydrogen 2.913 N/A ALA 240.A N VAL 247.A O no hydrogen 2.771 N/A VAL 242.A N GLN 245.A O no hydrogen 2.855 N/A GLN 245.A N VAL 242.A O no hydrogen 2.633 N/A GLN 245.A NE2 ASN 243.A O no hydrogen 3.619 N/A LYS 246.A NZ GLU 241.A OE2 no hydrogen 2.609 N/A VAL 247.A N ALA 240.A O no hydrogen 2.913 N/A SER 249.A N ILE 238.A O no hydrogen 2.910 N/A ALA 251.A N LYS 236.A O no hydrogen 2.791 N/A ASN 253.A N ALA 234.A O no hydrogen 2.898 N/A ARG 256.A N ASN 253.A O no hydrogen 2.677 N/A ARG 256.A NH2 ALA 233.A O no hydrogen 3.239 N/A CYS 257.A N ASN 253.A O no hydrogen 3.136 N/A TYR 264.A N GLY 261.A O no hydrogen 3.100 N/A THR 265.A N GLY 261.A O no hydrogen 3.186 N/A THR 265.A OG1 GLY 261.A O no hydrogen 3.551 N/A MET 266.A N ASN 262.A O no hydrogen 3.199 N/A CYS 267.A N CYS 263.A O no hydrogen 2.692 N/A CYS 267.A N TYR 264.A O no hydrogen 3.101 N/A LEU 270.A N CYS 267.A O no hydrogen 3.095 N/A ASP 274.A N ASP 278.A OD2 no hydrogen 3.001 N/A THR 276.A N ASP 274.A OD1 no hydrogen 3.126 N/A THR 276.A OG1 ASP 274.A OD1 no hydrogen 3.178 N/A GLY 277.A N ASP 274.A OD1 no hydrogen 2.775 N/A ASP 278.A N ASP 274.A O no hydrogen 2.909 N/A GLY 279.A N ILE 205.A O no hydrogen 3.081 N/A ILE 280.A N VAL 305.A O no hydrogen 2.903 N/A ALA 281.A N VAL 203.A O no hydrogen 2.749 N/A ILE 282.A N VAL 302.A O no hydrogen 2.868 N/A MET 283.A N GLY 201.A O no hydrogen 2.719 N/A VAL 284.A N LYS 299.A O no hydrogen 2.880 N/A GLY 285.A N ASP 199.A O no hydrogen 2.910 N/A GLY 286.A N SER 198.A O no hydrogen 2.901 N/A LYS 287.A N SER 296.A O no hydrogen 3.050 N/A LYS 287.A NZ SER 289.A O no hydrogen 2.811 N/A LYS 287.A NZ ARG 291.A O no hydrogen 3.214 N/A LYS 287.A NZ LYS 293.A O no hydrogen 2.871 N/A LYS 293.A N ARG 291.A O no hydrogen 2.697 N/A SER 296.A N LYS 287.A O no hydrogen 3.068 N/A SER 296.A OG GLY 285.A O no hydrogen 2.996 N/A SER 298.A N HIS 196.A O no hydrogen 3.095 N/A SER 298.A OG VAL 195.A O no hydrogen 2.813 N/A LYS 299.A N VAL 284.A O no hydrogen 2.678 N/A LYS 299.A NZ PHE 297.A O no hydrogen 2.647 N/A VAL 301.A N ILE 282.A O no hydrogen 2.954 N/A VAL 302.A N ILE 282.A O no hydrogen 3.313 N/A VAL 305.A N ILE 280.A O no hydrogen 2.905 N/A ASN 307.A ND2 ALA 154.A O no hydrogen 2.883 N/A ARG 311.A NH1 ASP 166.A OD1 no hydrogen 3.147 N/A ARG 311.A NH2 ASP 166.A OD1 no hydrogen 2.758 N/A TRP 312.A N GLU 308.A O no hydrogen 2.830 N/A TRP 312.A NE1 ASN 307.A OD1 no hydrogen 2.993 N/A THR 314.A N GLU 308.A OE1 no hydrogen 2.977 N/A THR 314.A OG1 GLU 308.A OE1 no hydrogen 2.659 N/A THR 314.A OG1 GLU 308.A OE2 no hydrogen 3.194 N/A ALA 316.A N TRP 312.A O no hydrogen 2.904 N/A LYS 317.A N PRO 313.A O no hydrogen 2.833 N/A ILE 318.A N THR 314.A O no hydrogen 3.236 N/A VAL 319.A N MET 315.A O no hydrogen 3.041 N/A LYS 320.A N ALA 316.A O no hydrogen 3.017 N/A LYS 320.A NZ GLU 167.A OE1 no hydrogen 2.731 N/A LYS 321.A N LYS 317.A O no hydrogen 2.894 N/A ILE 322.A N ILE 318.A O no hydrogen 2.961 N/A VAL 323.A N VAL 319.A O no hydrogen 3.044 N/A GLU 324.A N LYS 320.A O no hydrogen 2.904 N/A VAL 325.A N LYS 321.A O no hydrogen 2.983 N/A TYR 326.A N ILE 322.A O no hydrogen 2.996 N/A TYR 326.A OH GLU 334.A O no hydrogen 2.480 N/A ALA 327.A N VAL 323.A O no hydrogen 2.913 N/A GLU 328.A N GLU 324.A O no hydrogen 3.203 N/A ASP 329.A N VAL 325.A O no hydrogen 2.951 N/A ALA 330.A N TYR 326.A O no hydrogen 2.805 N/A ARG 331.A N GLU 334.A OE2 no hydrogen 2.947 N/A TYR 333.A N PRO 178.A O no hydrogen 2.908 N/A GLU 334.A N ARG 331.A O no hydrogen 2.985 N/A ARG 335.A N ASP 338.A OD1 no hydrogen 2.901 N/A ARG 335.A NE ILE 180.A O no hydrogen 3.144 N/A ARG 335.A NE ASP 199.A OD1 no hydrogen 3.004 N/A ARG 335.A NH2 ASP 199.A OD1 no hydrogen 3.470 N/A ARG 335.A NH2 ASP 199.A OD2 no hydrogen 2.770 N/A TRP 339.A N ARG 335.A O no hydrogen 2.959 N/A TRP 339.A NE1 ASP 329.A OD2 no hydrogen 2.686 N/A ILE 340.A N ILE 336.A O no hydrogen 2.988 N/A HIS 341.A N GLY 337.A O no hydrogen 2.907 N/A ARG 342.A N ASP 338.A O no hydrogen 3.085 N/A ARG 342.A NE GLU 334.A OE1 no hydrogen 3.044 N/A ARG 342.A NH2 ASP 329.A O no hydrogen 3.324 N/A ARG 342.A NH2 GLU 334.A OE1 no hydrogen 3.518 N/A ARG 342.A NH2 GLU 334.A OE2 no hydrogen 2.819 N/A ILE 343.A N TRP 339.A O no hydrogen 2.946 N/A GLY 344.A N ILE 340.A O no hydrogen 2.712 N/A GLU 346.A N GLU 346.A OE1 no hydrogen 2.707 N/A THR 347.A OG1 ILE 343.A O no hydrogen 3.272 N/A PHE 348.A N GLY 344.A O no hydrogen 3.136 N/A TYR 349.A N TRP 345.A O no hydrogen 3.025 N/A TYR 349.A OH VAL 301.A O no hydrogen 2.908 N/A GLU 350.A N GLU 346.A O no hydrogen 2.944 N/A LYS 351.A N THR 347.A O no hydrogen 2.794 N/A THR 352.A N PHE 348.A O no hydrogen 2.954 N/A THR 352.A OG1 PHE 348.A O no hydrogen 2.791 N/A GLY 353.A N TYR 349.A O no hydrogen 3.002 N/A SER 357.A OG HIS 359.A ND1 no hydrogen 3.266 N/A HIS 359.A N SER 357.A OG no hydrogen 3.347 N/A HIS 359.A ND1 SER 357.A OG no hydrogen 3.266 N/A CYS 360.A N SER 357.A O no hydrogen 3.161 N/A CYS 360.A SG VAL 300.A O no hydrogen 3.593 N/A ILE 361.A N HIS 358.A O no hydrogen 3.104 N/A PHE 364.A N ASP 362.A OD2 no hydrogen 3.044 N/A ARG 365.A NH2 PRO 231.A O no hydrogen 3.129 N/A ALA 368.A N ARG 365.A O no hydrogen 3.118 N/A TYR 369.A N ASP 366.A O no hydrogen 3.277 N/A TYR 370.A N PRO 367.A O no hydrogen 3.156 N/A THR 371.A N ALA 368.A O no hydrogen 2.896 N/A THR 371.A OG1 ALA 368.A O no hydrogen 2.583 N/A TRP 372.A N TYR 369.A O no hydrogen 3.000 N/A TRP 372.A NE1 ASP 362.A O no hydrogen 3.310 N/A ARG 373.A NH1 GLU 346.A OE1 no hydrogen 3.323 N/A ARG 373.A NH1 GLU 346.A OE2 no hydrogen 2.950 N/A ARG 373.A NH1 GLN 377.A O no hydrogen 3.129 N/A ARG 373.A NH2 GLU 346.A OE1 no hydrogen 2.759 N/A GLN 374.A NE2 TYR 369.A O no hydrogen 3.079 N/A LYS 379.A N GLU 346.A OE2 no hydrogen 2.869 N/A LYS 379.A NZ ILE 343.A O no hydrogen 2.894 N/A SER 382.A N GLU 350.A OE2 no hydrogen 2.863 N/A SER 382.A OG GLU 350.A OE1 no hydrogen 2.746 N/A ASP 384.A N VAL 381.A O no hydrogen 3.017 N/A SER 385.A N SER 382.A O no hydrogen 3.222 N/A