Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vgl_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N GLY 119.A O no hydrogen 3.278 N/A GLY 3.A N VAL 68.A O no hydrogen 2.524 N/A LEU 5.A N ARG 18.A O no hydrogen 3.003 N/A PHE 6.A N ALA 66.A O no hydrogen 3.078 N/A ILE 7.A N ILE 16.A O no hydrogen 2.897 N/A TYR 8.A N TRP 64.A O no hydrogen 3.003 N/A TYR 8.A OH VAL 29.A O no hydrogen 3.106 N/A ASN 9.A N GLU 13.A O no hydrogen 2.994 N/A GLY 12.A N ASN 9.A O no hydrogen 2.819 N/A GLU 13.A N ASN 9.A OD1 no hydrogen 2.573 N/A ILE 16.A N ILE 7.A O no hydrogen 3.363 N/A ARG 18.A N LEU 5.A O no hydrogen 2.952 N/A TYR 20.A N GLY 3.A O no hydrogen 3.087 N/A ALA 28.A N GLY 25.A O no hydrogen 3.128 N/A ASP 30.A N ARG 26.A O no hydrogen 3.365 N/A ALA 31.A N ASN 27.A O no hydrogen 3.114 N/A PHE 32.A N ALA 28.A O no hydrogen 3.055 N/A ARG 33.A N VAL 29.A O no hydrogen 2.860 N/A ARG 33.A NE GLY 12.A O no hydrogen 2.750 N/A ARG 33.A NH2 GLY 12.A O no hydrogen 2.752 N/A VAL 34.A N ASP 30.A O no hydrogen 2.763 N/A ASN 35.A N ALA 31.A O no hydrogen 2.993 N/A ASN 35.A ND2 ALA 31.A O no hydrogen 2.616 N/A VAL 36.A N PHE 32.A O no hydrogen 3.308 N/A ILE 37.A N PHE 32.A O no hydrogen 3.178 N/A HIS 38.A N ARG 33.A O no hydrogen 3.088 N/A ALA 39.A N VAL 36.A O no hydrogen 3.064 N/A VAL 47.A N SER 45.A OG no hydrogen 3.260 N/A THR 48.A N PHE 55.A O no hydrogen 3.134 N/A ASN 49.A ND2 SER 54.A OG no hydrogen 2.800 N/A ILE 50.A N THR 53.A O no hydrogen 2.954 N/A THR 53.A N ILE 50.A O no hydrogen 3.143 N/A THR 53.A OG1 ALA 51.A O no hydrogen 3.201 N/A SER 54.A N THR 69.A O no hydrogen 2.864 N/A PHE 56.A N ALA 67.A O no hydrogen 2.747 N/A VAL 58.A N LEU 65.A O no hydrogen 2.930 N/A LYS 59.A NZ SER 61.A O no hydrogen 3.108 N/A LYS 59.A NZ ASP 201.A OD1 no hydrogen 3.142 N/A ARG 60.A N ILE 63.A O no hydrogen 2.797 N/A ILE 63.A N ARG 60.A O no hydrogen 2.723 N/A TRP 64.A N TYR 8.A O no hydrogen 3.023 N/A LEU 65.A N VAL 58.A O no hydrogen 2.829 N/A ALA 66.A N PHE 6.A O no hydrogen 3.104 N/A ALA 67.A N PHE 56.A O no hydrogen 2.798 N/A VAL 68.A N GLY 4.A O no hydrogen 3.099 N/A THR 69.A N SER 54.A O no hydrogen 3.350 N/A LYS 70.A NZ ASP 23.A O no hydrogen 2.728 N/A VAL 73.A N GLN 71.A O no hydrogen 2.873 N/A MET 77.A N ASN 74.A OD1 no hydrogen 3.352 N/A VAL 78.A N ASN 74.A O no hydrogen 3.302 N/A GLU 80.A N ALA 76.A O no hydrogen 3.320 N/A PHE 81.A N MET 77.A O no hydrogen 3.122 N/A LEU 82.A N VAL 78.A O no hydrogen 3.202 N/A TYR 83.A N PHE 79.A O no hydrogen 2.905 N/A LYS 84.A N GLU 80.A O no hydrogen 3.022 N/A LYS 84.A N PHE 81.A O no hydrogen 2.653 N/A MET 85.A N PHE 81.A O no hydrogen 2.728 N/A CYS 86.A N LEU 82.A O no hydrogen 3.361 N/A CYS 86.A SG LEU 82.A O no hydrogen 3.232 N/A ASP 87.A N TYR 83.A O no hydrogen 2.954 N/A VAL 88.A N LYS 84.A O no hydrogen 2.670 N/A MET 89.A N MET 85.A O no hydrogen 2.786 N/A ALA 91.A N ASP 87.A O no hydrogen 3.119 N/A ALA 91.A N VAL 88.A O no hydrogen 2.571 N/A TYR 92.A N MET 89.A O no hydrogen 2.870 N/A PHE 93.A N MET 89.A O no hydrogen 3.062 N/A GLY 94.A N ALA 90.A O no hydrogen 3.059 N/A ASN 100.A N SER 97.A OG no hydrogen 3.345 N/A ASN 100.A ND2 PHE 93.A O no hydrogen 2.736 N/A ILE 101.A N SER 97.A O no hydrogen 2.771 N/A LYS 102.A N GLU 98.A O no hydrogen 2.620 N/A ASN 103.A N GLU 99.A O no hydrogen 2.957 N/A ASN 104.A N ILE 101.A O no hydrogen 2.992 N/A ASN 104.A ND2 ASN 100.A O no hydrogen 2.334 N/A ILE 108.A N ASN 104.A O no hydrogen 2.862 N/A TYR 109.A N PHE 105.A O no hydrogen 2.927 N/A GLU 110.A N VAL 106.A O no hydrogen 3.079 N/A GLU 110.A N LEU 107.A O no hydrogen 2.376 N/A LEU 111.A N LEU 107.A O no hydrogen 3.004 N/A LEU 112.A N ILE 108.A O no hydrogen 3.222 N/A ASP 113.A N TYR 109.A O no hydrogen 3.227 N/A GLU 114.A N LEU 111.A O no hydrogen 2.855 N/A ILE 115.A N LEU 111.A O no hydrogen 2.574 N/A TYR 120.A N ASP 117.A O no hydrogen 2.772 N/A SER 124.A N ASN 123.A OD1 no hydrogen 3.043 N/A SER 124.A OG GLN 122.A O no hydrogen 3.224 N/A LEU 129.A N THR 126.A O no hydrogen 3.255 N/A PHE 132.A N LEU 129.A O no hydrogen 2.926 N/A ILE 133.A N LYS 130.A O no hydrogen 3.134 N/A THR 134.A N GLU 110.A OE1 no hydrogen 3.230 N/A THR 134.A OG1 GLU 110.A OE1 no hydrogen 3.326 N/A GLN 135.A N GLU 110.A OE2 no hydrogen 3.259 N/A ILE 138.A N ASN 104.A OD1 no hydrogen 2.954 N/A TRP 144.A NE1 ILE 227.A O no hydrogen 2.848 N/A ARG 145.A NE GLY 191.A O no hydrogen 3.076 N/A ARG 145.A NH1 PRO 228.A O no hydrogen 3.173 N/A ARG 145.A NH2 GLY 191.A O no hydrogen 3.437 N/A TYR 151.A N SER 190.A OG no hydrogen 2.741 N/A TYR 151.A OH ASP 230.A OD1 no hydrogen 2.503 N/A TYR 151.A OH ASP 230.A OD2 no hydrogen 3.034 N/A ARG 153.A NE GLU 155.A OE2 no hydrogen 3.170 N/A ARG 153.A NH2 GLU 155.A OE2 no hydrogen 3.323 N/A GLU 155.A N TYR 188.A O no hydrogen 2.579 N/A LEU 156.A N ILE 380.A O no hydrogen 2.732 N/A PHE 157.A N LYS 186.A O no hydrogen 2.747 N/A LEU 158.A N TRP 382.A O no hydrogen 3.027 N/A ASP 159.A N VAL 184.A O no hydrogen 2.785 N/A VAL 160.A N ARG 384.A O no hydrogen 2.982 N/A LEU 161.A N ARG 182.A O no hydrogen 2.959 N/A GLU 162.A N ILE 386.A O no hydrogen 2.844 N/A SER 163.A N SER 180.A O no hydrogen 2.740 N/A VAL 164.A N ARG 388.A O no hydrogen 2.741 N/A ASN 165.A N HIS 178.A O no hydrogen 2.745 N/A ASN 165.A ND2 HIS 178.A O no hydrogen 3.291 N/A LEU 166.A N ILE 391.A O no hydrogen 2.920 N/A LEU 167.A N SER 176.A O no hydrogen 2.795 N/A MET 168.A N GLU 393.A O no hydrogen 2.902 N/A SER 169.A N GLN 173.A O no hydrogen 3.143 N/A GLN 171.A N SER 169.A OG no hydrogen 3.111 N/A GLN 171.A NE2 SER 169.A OG no hydrogen 3.382 N/A GLY 172.A N SER 169.A O no hydrogen 3.075 N/A GLN 173.A N SER 169.A OG no hydrogen 3.124 N/A LEU 175.A N LEU 167.A O no hydrogen 2.818 N/A SER 176.A N LEU 167.A O no hydrogen 3.162 N/A HIS 178.A N ASN 165.A O no hydrogen 3.018 N/A VAL 179.A N THR 240.A O no hydrogen 2.693 N/A SER 180.A N SER 163.A O no hydrogen 2.890 N/A GLY 181.A N TYR 238.A O no hydrogen 2.876 N/A ARG 182.A N LEU 161.A O no hydrogen 3.143 N/A VAL 183.A N MET 236.A O no hydrogen 3.002 N/A VAL 184.A N ASP 159.A O no hydrogen 2.794 N/A MET 185.A N PHE 233.A O no hydrogen 2.696 N/A LYS 186.A N PHE 157.A O no hydrogen 2.870 N/A SER 187.A N GLY 231.A O no hydrogen 2.915 N/A TYR 188.A N GLU 155.A O no hydrogen 2.888 N/A SER 190.A N ASN 154.A OD1 no hydrogen 2.559 N/A SER 190.A OG TYR 151.A O no hydrogen 3.355 N/A SER 190.A OG ASN 154.A OD1 no hydrogen 3.147 N/A GLY 191.A N ILE 149.A O no hydrogen 2.747 N/A MET 192.A N GLU 369.A OE1 no hydrogen 2.417 N/A GLU 194.A N PHE 368.A O no hydrogen 2.785 N/A CYS 195.A N PHE 226.A O no hydrogen 2.735 N/A LYS 196.A N LYS 366.A O no hydrogen 2.627 N/A PHE 197.A N ILE 224.A O no hydrogen 2.686 N/A GLY 198.A N TYR 364.A O no hydrogen 2.721 N/A ASN 200.A N LYS 361.A O no hydrogen 3.106 N/A ASN 200.A ND2 GLY 359.A O no hydrogen 2.913 N/A ASP 211.A N ARG 239.A O no hydrogen 3.000 N/A CYS 212.A SG ARG 237.A O no hydrogen 3.617 N/A THR 213.A N ARG 237.A O no hydrogen 2.734 N/A HIS 215.A N LEU 235.A O no hydrogen 2.879 N/A CYS 217.A N HIS 215.A ND1 no hydrogen 3.223 N/A CYS 217.A SG HIS 215.A ND1 no hydrogen 3.391 N/A VAL 218.A N HIS 215.A O no hydrogen 2.953 N/A ARG 219.A N SER 225.A O no hydrogen 2.913 N/A ILE 224.A N PHE 197.A O no hydrogen 3.177 N/A SER 225.A N ARG 219.A O no hydrogen 3.374 N/A SER 225.A OG GLU 194.A OE2 no hydrogen 3.104 N/A PHE 226.A N CYS 195.A O no hydrogen 3.103 N/A GLY 231.A N SER 187.A O no hydrogen 2.985 N/A PHE 233.A N MET 185.A O no hydrogen 2.774 N/A LEU 235.A N VAL 183.A O no hydrogen 2.972 N/A ARG 237.A N THR 213.A O no hydrogen 2.733 N/A TYR 238.A N GLY 181.A O no hydrogen 2.957 N/A TYR 238.A OH GLU 162.A OE2 no hydrogen 2.378 N/A ARG 239.A N ASP 211.A O no hydrogen 2.927 N/A THR 240.A N VAL 179.A O no hydrogen 2.811 N/A THR 240.A OG1 ASP 210.A OD1 no hydrogen 3.480 N/A THR 241.A N ASP 210.A OD1 no hydrogen 2.890 N/A THR 241.A OG1 ASP 210.A OD1 no hydrogen 2.954 N/A THR 241.A OG1 ASP 210.A OD2 no hydrogen 2.883 N/A ILE 245.A N PRO 357.A O no hydrogen 2.896 N/A PHE 248.A N TYR 392.A OH no hydrogen 3.034 N/A ARG 249.A N LYS 269.A O no hydrogen 3.108 N/A ILE 251.A N VAL 267.A O no hydrogen 2.688 N/A LEU 253.A N LYS 265.A O no hydrogen 2.729 N/A ARG 255.A N GLU 263.A O no hydrogen 2.598 N/A ARG 255.A NH2 GLU 263.A OE2 no hydrogen 3.138 N/A LYS 261.A N VAL 257.A O no hydrogen 3.356 N/A LEU 262.A N ILE 331.A O no hydrogen 3.210 N/A GLU 263.A N ARG 255.A O no hydrogen 2.734 N/A VAL 264.A N ALA 329.A O no hydrogen 3.368 N/A LYS 265.A N LEU 253.A O no hydrogen 2.858 N/A VAL 266.A N ILE 327.A O no hydrogen 3.067 N/A VAL 267.A N ILE 251.A O no hydrogen 2.850 N/A ILE 268.A N SER 325.A O no hydrogen 2.990 N/A LYS 269.A N ARG 249.A O no hydrogen 2.984 N/A SER 270.A N LYS 323.A O no hydrogen 3.005 N/A SER 270.A OG ALA 320.A O no hydrogen 2.720 N/A SER 270.A OG LYS 323.A O no hydrogen 3.534 N/A ASN 271.A N PRO 247.A O no hydrogen 2.669 N/A ASN 271.A ND2 LEU 246.A O no hydrogen 2.758 N/A ALA 278.A N MET 319.A O no hydrogen 2.944 N/A GLN 279.A N GLU 352.A O no hydrogen 2.853 N/A LYS 280.A N LYS 317.A O no hydrogen 3.376 N/A LYS 280.A NZ GLU 352.A OE1 no hydrogen 3.102 N/A ILE 281.A N ILE 316.A O no hydrogen 3.243 N/A GLU 282.A N ASN 350.A O no hydrogen 3.086 N/A VAL 283.A N TRP 314.A O no hydrogen 2.743 N/A ARG 284.A N SER 348.A O no hydrogen 2.850 N/A ILE 285.A N ILE 312.A O no hydrogen 2.881 N/A THR 287.A N ASN 310.A O no hydrogen 2.723 N/A ASN 290.A ND2 LEU 334.A O no hydrogen 3.615 N/A THR 291.A OG1 PRO 288.A O no hydrogen 2.341 N/A SER 292.A N GLU 332.A O no hydrogen 2.712 N/A GLN 295.A N GLU 330.A O no hydrogen 3.049 N/A ILE 297.A N SER 328.A O no hydrogen 2.729 N/A CYS 298.A SG LYS 300.A O no hydrogen 3.492 N/A CYS 298.A SG GLY 301.A O no hydrogen 3.712 N/A LYS 300.A NZ ARG 318.A O no hydrogen 3.036 N/A LYS 302.A N LYS 315.A O no hydrogen 2.945 N/A LYS 304.A N VAL 313.A O no hydrogen 2.990 N/A LYS 306.A N ALA 311.A O no hydrogen 2.987 N/A ASN 310.A N ALA 307.A O no hydrogen 2.910 N/A ALA 311.A N LYS 306.A O no hydrogen 3.251 N/A ILE 312.A N ILE 285.A O no hydrogen 2.575 N/A VAL 313.A N LYS 304.A O no hydrogen 3.018 N/A TRP 314.A N VAL 283.A O no hydrogen 2.844 N/A TRP 314.A NE1 LYS 300.A O no hydrogen 3.015 N/A LYS 315.A N LYS 302.A O no hydrogen 2.688 N/A ILE 316.A N ILE 281.A O no hydrogen 2.958 N/A MET 319.A N ALA 278.A O no hydrogen 2.998 N/A MET 322.A N SER 270.A O no hydrogen 2.891 N/A LYS 323.A N SER 270.A OG no hydrogen 2.852 N/A SER 325.A N ILE 268.A O no hydrogen 3.087 N/A SER 325.A OG GLU 324.A O no hydrogen 2.895 N/A ILE 327.A N VAL 266.A O no hydrogen 2.934 N/A SER 328.A N ILE 297.A O no hydrogen 2.866 N/A SER 328.A OG ILE 297.A O no hydrogen 3.251 N/A ALA 329.A N VAL 264.A O no hydrogen 2.773 N/A GLU 330.A N GLN 295.A O no hydrogen 2.908 N/A ILE 331.A N LEU 262.A O no hydrogen 2.957 N/A GLU 332.A N GLY 293.A O no hydrogen 3.239 N/A LEU 333.A N THR 260.A O no hydrogen 2.663 N/A THR 336.A N LEU 334.A O no hydrogen 3.030 N/A LYS 340.A NZ ASN 337.A OD1 no hydrogen 2.546 N/A ILE 347.A N THR 394.A O no hydrogen 2.578 N/A SER 348.A N ARG 284.A O no hydrogen 3.312 N/A MET 349.A N TYR 392.A O no hydrogen 3.067 N/A ASN 350.A N GLU 282.A O no hydrogen 3.073 N/A PHE 351.A N SER 389.A OG no hydrogen 2.658 N/A GLU 352.A N GLN 279.A O no hydrogen 2.770 N/A VAL 353.A N GLY 387.A O no hydrogen 2.777 N/A SER 358.A N GLU 162.A OE1 no hydrogen 2.882 N/A SER 358.A OG GLU 162.A OE1 no hydrogen 3.064 N/A SER 358.A OG GLU 162.A OE2 no hydrogen 2.453 N/A GLY 359.A N ALA 356.A O no hydrogen 2.659 N/A LEU 360.A N SER 358.A OG no hydrogen 3.174 N/A VAL 362.A N TYR 385.A OH no hydrogen 2.673 N/A ARG 363.A N GLY 198.A O no hydrogen 2.863 N/A TYR 364.A N GLY 198.A O no hydrogen 3.155 N/A LYS 366.A N LYS 196.A O no hydrogen 2.679 N/A LYS 366.A NZ ASP 376.A OD2 no hydrogen 2.454 N/A PHE 368.A N GLU 194.A O no hydrogen 2.967 N/A LEU 372.A N GLU 369.A OE2 no hydrogen 3.194 N/A TYR 374.A OH SER 190.A O no hydrogen 2.457 N/A SER 375.A N ASP 378.A OD2 no hydrogen 2.789 N/A SER 375.A OG ASP 378.A OD2 no hydrogen 3.190 N/A ASP 378.A N SER 375.A O no hydrogen 2.429 N/A VAL 379.A N ASP 376.A O no hydrogen 3.091 N/A ILE 380.A N ASN 154.A O no hydrogen 3.024 N/A LYS 381.A NZ LEU 365.A O no hydrogen 2.596 N/A LYS 381.A NZ ASP 376.A OD1 no hydrogen 2.592 N/A LYS 381.A NZ ASP 376.A OD2 no hydrogen 3.257 N/A TRP 382.A N LEU 156.A O no hydrogen 3.054 N/A ARG 384.A N LEU 158.A O no hydrogen 2.899 N/A ARG 384.A NE ASP 159.A OD1 no hydrogen 3.362 N/A ARG 384.A NH2 ASP 159.A OD1 no hydrogen 3.195 N/A ILE 386.A N VAL 160.A O no hydrogen 2.885 N/A GLY 387.A N VAL 353.A O no hydrogen 2.796 N/A ARG 388.A N GLU 162.A O no hydrogen 2.677 N/A SER 389.A N PHE 351.A O no hydrogen 3.097 N/A SER 389.A OG PHE 351.A O no hydrogen 3.219 N/A GLY 390.A N VAL 164.A O no hydrogen 2.890 N/A ILE 391.A N ASN 165.A OD1 no hydrogen 2.688 N/A TYR 392.A OH PHE 248.A O no hydrogen 2.513 N/A GLU 393.A N LEU 166.A O no hydrogen 2.512 N/A THR 394.A N ILE 347.A O no hydrogen 2.734 N/A ARG 395.A N MET 168.A O no hydrogen 2.933 N/A