Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vas_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG GLU 4.A O no hydrogen 3.428 N/A GLY 5.A N PHE 79.A O no hydrogen 2.783 N/A VAL 7.A N VAL 80.A O no hydrogen 3.090 N/A PHE 8.A N VAL 161.A O no hydrogen 2.888 N/A GLY 9.A N SER 82.A O no hydrogen 2.738 N/A GLY 11.A N VAL 84.A O no hydrogen 2.947 N/A ASN 12.A ND2 PHE 167.A O no hydrogen 3.311 N/A LEU 15.A N GLY 119.A O no hydrogen 3.061 N/A ASP 16.A N ILE 59.A O no hydrogen 2.814 N/A ILE 17.A N VAL 121.A O no hydrogen 2.773 N/A ILE 18.A N ASN 57.A O no hydrogen 2.895 N/A VAL 19.A N VAL 123.A O no hydrogen 3.026 N/A ALA 21.A N VAL 125.A O no hydrogen 2.783 N/A MET 25.A N ASP 22.A O no hydrogen 3.200 N/A TYR 26.A OH LEU 124.A O no hydrogen 2.985 N/A TYR 26.A OH SER 126.A OG no hydrogen 3.121 N/A LYS 28.A N PHE 24.A O no hydrogen 2.760 N/A LYS 28.A NZ GLU 49.A OE1 no hydrogen 3.113 N/A LYS 28.A NZ GLU 49.A OE2 no hydrogen 2.897 N/A TYR 29.A N MET 25.A O no hydrogen 3.041 N/A TYR 29.A OH THR 45.A OG1 no hydrogen 2.713 N/A TYR 29.A OH GLU 49.A OE1 no hydrogen 2.560 N/A ASN 30.A N ARG 27.A O no hydrogen 3.137 N/A LEU 31.A N TYR 26.A O no hydrogen 2.790 N/A LYS 33.A NZ ASP 34.A OD2 no hydrogen 2.905 N/A ASP 34.A N ARG 130.A O no hydrogen 2.732 N/A VAL 37.A N MET 132.A O no hydrogen 3.048 N/A ALA 39.A N THR 134.A O no hydrogen 2.824 N/A GLU 40.A N HIS 43.A ND1 no hydrogen 2.885 N/A HIS 43.A N GLU 40.A O no hydrogen 2.917 N/A MET 44.A N GLU 41.A O no hydrogen 3.234 N/A THR 45.A OG1 TYR 29.A OH no hydrogen 2.713 N/A ILE 46.A N HIS 43.A O no hydrogen 2.995 N/A TYR 47.A OH VAL 133.A O no hydrogen 2.978 N/A GLU 49.A N THR 45.A O no hydrogen 2.908 N/A ILE 50.A N ILE 46.A O no hydrogen 2.871 N/A LYS 52.A N GLU 49.A O no hydrogen 3.142 N/A LYS 53.A N ILE 50.A O no hydrogen 3.042 N/A LYS 53.A NZ ASP 22.A OD1 no hydrogen 3.066 N/A LYS 53.A NZ ASP 22.A OD2 no hydrogen 2.687 N/A ASN 57.A N ILE 18.A O no hydrogen 3.004 N/A TYR 58.A OH GLN 51.A OE1 no hydrogen 2.301 N/A ILE 59.A N ASP 16.A O no hydrogen 3.123 N/A ALA 60.A N TYR 95.A OH no hydrogen 3.029 N/A GLY 61.A N LEU 14.A O no hydrogen 2.588 N/A ASN 66.A N GLY 62.A O no hydrogen 2.792 N/A ASN 66.A ND2 ASP 300.A OD2 no hydrogen 3.107 N/A THR 67.A N ALA 63.A O no hydrogen 3.232 N/A THR 67.A OG1 ALA 63.A O no hydrogen 3.427 N/A THR 67.A OG1 ASP 300.A O no hydrogen 2.816 N/A VAL 68.A N THR 64.A O no hydrogen 2.951 N/A LYS 69.A N LEU 65.A O no hydrogen 2.951 N/A LYS 69.A NZ ASP 99.A OD2 no hydrogen 2.960 N/A MET 70.A N ASN 66.A O no hydrogen 3.155 N/A ILE 71.A N THR 67.A O no hydrogen 2.953 N/A GLN 72.A N VAL 68.A O no hydrogen 3.066 N/A GLN 72.A NE2 LYS 77.A O no hydrogen 2.588 N/A TRP 73.A N LYS 69.A O no hydrogen 2.885 N/A TRP 73.A NE1 GLY 339.A O no hydrogen 3.021 N/A ILE 74.A N MET 70.A O no hydrogen 2.740 N/A ILE 75.A N ILE 71.A O no hydrogen 2.996 N/A GLN 76.A N GLN 72.A O no hydrogen 2.938 N/A LYS 77.A NZ LEU 2.A O no hydrogen 2.681 N/A PHE 79.A N ASP 104.A O no hydrogen 3.020 N/A VAL 80.A N LYS 77.A O no hydrogen 3.493 N/A CYS 81.A N GLN 72.A OE1 no hydrogen 2.881 N/A CYS 81.A SG VAL 68.A O no hydrogen 3.675 N/A SER 82.A N VAL 7.A O no hydrogen 2.697 N/A TYR 83.A N VAL 106.A O no hydrogen 2.873 N/A VAL 84.A N GLY 9.A O no hydrogen 2.914 N/A CYS 86.A SG ILE 87.A O no hydrogen 3.839 N/A CYS 86.A SG GLN 110.A O no hydrogen 3.365 N/A CYS 86.A SG ALA 138.A O no hydrogen 3.151 N/A ILE 87.A N GLN 110.A O no hydrogen 2.972 N/A GLY 88.A N THR 118.A OG1 no hydrogen 2.908 N/A GLN 92.A N GLN 92.A OE1 no hydrogen 2.769 N/A GLY 93.A N ASP 90.A OD2 no hydrogen 2.997 N/A LYS 94.A N ASP 90.A O no hydrogen 3.149 N/A TYR 95.A N ILE 91.A O no hydrogen 2.833 N/A ILE 96.A N GLN 92.A O no hydrogen 3.027 N/A LYS 97.A N GLY 93.A O no hydrogen 2.943 N/A ASN 98.A N LYS 94.A O no hydrogen 2.879 N/A ASP 99.A N TYR 95.A O no hydrogen 2.953 N/A CYS 100.A N ILE 96.A O no hydrogen 3.190 N/A CYS 100.A SG ILE 96.A O no hydrogen 3.460 N/A SER 101.A N LYS 97.A O no hydrogen 3.145 N/A SER 101.A OG LYS 97.A O no hydrogen 3.440 N/A ALA 102.A N ASN 98.A O no hydrogen 3.011 N/A LEU 103.A N CYS 100.A O no hydrogen 3.000 N/A ASP 104.A N SER 101.A O no hydrogen 3.115 N/A LEU 105.A N CYS 100.A O no hydrogen 3.073 N/A VAL 106.A N CYS 81.A O no hydrogen 3.145 N/A GLU 108.A N TYR 83.A O no hydrogen 3.071 N/A GLN 110.A N GLY 85.A O no hydrogen 2.839 N/A GLN 110.A NE2 ASP 141.A O no hydrogen 2.834 N/A ALA 112.A N ILE 87.A O no hydrogen 2.753 N/A LEU 116.A N GLU 113.A O no hydrogen 3.156 N/A THR 118.A N ASP 90.A OD1 no hydrogen 2.966 N/A THR 118.A OG1 ASP 90.A OD2 no hydrogen 2.751 N/A LYS 120.A N TYR 135.A O no hydrogen 2.848 N/A VAL 121.A N LEU 15.A O no hydrogen 2.771 N/A ALA 122.A N VAL 133.A O no hydrogen 2.815 N/A VAL 123.A N ILE 17.A O no hydrogen 2.917 N/A LEU 124.A N SER 131.A O no hydrogen 2.770 N/A VAL 125.A N VAL 19.A O no hydrogen 2.773 N/A SER 126.A N LEU 129.A O no hydrogen 2.851 N/A SER 126.A OG TYR 26.A OH no hydrogen 3.121 N/A SER 126.A OG LEU 129.A O no hydrogen 2.837 N/A LEU 129.A N SER 126.A OG no hydrogen 3.006 N/A SER 131.A N LEU 124.A O no hydrogen 3.114 N/A SER 131.A OG LYS 32.A O no hydrogen 2.898 N/A MET 132.A N ASN 35.A O no hydrogen 2.981 N/A VAL 133.A N ALA 122.A O no hydrogen 2.920 N/A THR 134.A N VAL 37.A O no hydrogen 2.899 N/A TYR 135.A N LYS 120.A O no hydrogen 2.794 N/A ALA 138.A N MET 117.A O no hydrogen 2.835 N/A ALA 139.A N LEU 136.A O no hydrogen 3.107 N/A CYS 140.A N GLY 137.A O no hydrogen 3.175 N/A ASP 141.A N ALA 138.A O no hydrogen 2.966 N/A LEU 142.A N ALA 139.A O no hydrogen 3.445 N/A SER 143.A N GLN 110.A OE1 no hydrogen 3.062 N/A LEU 144.A N GLU 174.A OE2 no hydrogen 3.213 N/A HIS 146.A N SER 143.A O no hydrogen 3.218 N/A HIS 146.A N SER 143.A OG no hydrogen 3.292 N/A HIS 146.A NE2 GLU 108.A O no hydrogen 3.012 N/A ILE 147.A N SER 143.A O no hydrogen 3.258 N/A GLU 148.A N LEU 144.A O no hydrogen 2.864 N/A GLN 149.A N HIS 146.A O no hydrogen 3.425 N/A GLN 149.A NE2 HIS 146.A O no hydrogen 3.222 N/A VAL 152.A N GLN 149.A O no hydrogen 2.903 N/A TRP 153.A N GLN 149.A O no hydrogen 2.774 N/A SER 154.A N PRO 150.A O no hydrogen 3.257 N/A SER 154.A OG PRO 150.A O no hydrogen 3.528 N/A SER 154.A OG HIS 151.A O no hydrogen 3.428 N/A LEU 155.A N VAL 152.A O no hydrogen 2.960 N/A GLU 157.A N TRP 153.A O no hydrogen 2.985 N/A LYS 158.A N SER 154.A O no hydrogen 3.206 N/A ALA 159.A N VAL 156.A O no hydrogen 3.303 N/A GLN 160.A N TYR 6.A O no hydrogen 2.826 N/A VAL 161.A N TYR 6.A O no hydrogen 3.053 N/A TYR 162.A N LEU 189.A O no hydrogen 2.732 N/A TYR 162.A OH VAL 156.A O no hydrogen 2.603 N/A TYR 163.A N PHE 8.A O no hydrogen 3.078 N/A ILE 164.A N CYS 191.A O no hydrogen 3.099 N/A ALA 165.A N THR 64.A OG1 no hydrogen 3.104 N/A GLY 166.A N ASN 193.A O no hydrogen 2.738 N/A GLY 166.A N SER 195.A OG no hydrogen 2.845 N/A VAL 168.A N ALA 165.A O no hydrogen 3.183 N/A ILE 169.A N GLY 166.A O no hydrogen 2.925 N/A ASN 170.A N PHE 167.A O no hydrogen 3.368 N/A THR 171.A N VAL 168.A O no hydrogen 3.059 N/A THR 171.A OG1 ASN 12.A OD1 no hydrogen 2.556 N/A THR 171.A OG1 VAL 168.A O no hydrogen 3.331 N/A CYS 172.A N VAL 168.A O no hydrogen 2.904 N/A CYS 172.A SG LEU 142.A O no hydrogen 3.339 N/A TYR 173.A OH GLU 209.A OE1 no hydrogen 2.436 N/A MET 176.A N CYS 172.A O no hydrogen 3.203 N/A LEU 177.A N TYR 173.A O no hydrogen 2.844 N/A LYS 178.A N GLU 174.A O no hydrogen 3.041 N/A LYS 178.A NZ GLU 148.A OE2 no hydrogen 3.149 N/A ILE 179.A N GLY 175.A O no hydrogen 2.977 N/A ALA 180.A N MET 176.A O no hydrogen 2.944 N/A LYS 181.A N LEU 177.A O no hydrogen 2.988 N/A HIS 182.A N LYS 178.A O no hydrogen 3.063 N/A SER 183.A N ILE 179.A O no hydrogen 2.931 N/A LEU 184.A N ALA 180.A O no hydrogen 3.103 N/A GLU 185.A N LYS 181.A O no hydrogen 3.034 N/A ASN 186.A N HIS 182.A O no hydrogen 3.120 N/A ASN 186.A N SER 183.A O no hydrogen 3.148 N/A GLU 187.A N LEU 184.A O no hydrogen 3.194 N/A LYS 188.A N SER 183.A O no hydrogen 2.886 N/A LYS 188.A NZ VAL 156.A O no hydrogen 3.406 N/A LYS 188.A NZ GLU 157.A O no hydrogen 2.862 N/A LYS 188.A NZ ALA 159.A O no hydrogen 2.740 N/A LYS 188.A NZ TYR 162.A OH no hydrogen 3.039 N/A LYS 188.A NZ HIS 182.A NE2 no hydrogen 2.944 N/A LEU 189.A N GLN 160.A O no hydrogen 2.957 N/A PHE 190.A N ASN 215.A OD1 no hydrogen 2.765 N/A CYS 191.A N TYR 162.A O no hydrogen 2.767 N/A PHE 192.A N ILE 216.A O no hydrogen 2.896 N/A ASN 193.A ND2 TYR 163.A OH no hydrogen 2.971 N/A LEU 194.A N PHE 218.A O no hydrogen 2.919 N/A SER 195.A N ASN 193.A OD1 no hydrogen 2.892 N/A SER 195.A OG ASN 193.A O no hydrogen 3.015 N/A ALA 196.A N LEU 194.A O no hydrogen 2.710 N/A LEU 199.A N ALA 196.A O no hydrogen 3.171 N/A GLN 201.A N PRO 197.A O no hydrogen 3.197 N/A PHE 202.A N PHE 198.A O no hydrogen 2.824 N/A ASN 203.A N LEU 199.A O no hydrogen 2.821 N/A THR 204.A OG1 SER 200.A O no hydrogen 2.637 N/A GLU 206.A N GLU 206.A OE1 no hydrogen 2.827 N/A VAL 207.A N ASN 203.A O no hydrogen 2.997 N/A ASP 208.A N THR 204.A O no hydrogen 2.967 N/A GLU 209.A N LYS 205.A O no hydrogen 2.981 N/A MET 210.A N GLU 206.A O no hydrogen 2.960 N/A ILE 211.A N VAL 207.A O no hydrogen 2.935 N/A SER 212.A N ASP 208.A O no hydrogen 3.230 N/A SER 212.A N GLU 209.A O no hydrogen 3.115 N/A SER 212.A OG GLU 209.A O no hydrogen 2.640 N/A TYR 213.A N MET 210.A O no hydrogen 2.945 N/A SER 214.A N ILE 211.A O no hydrogen 2.951 N/A SER 214.A OG MET 210.A O no hydrogen 2.717 N/A ASN 215.A N PHE 190.A O no hydrogen 2.847 N/A ILE 216.A N PHE 190.A O no hydrogen 3.304 N/A VAL 217.A N LEU 259.A O no hydrogen 2.798 N/A PHE 218.A N PHE 192.A O no hydrogen 2.838 N/A GLY 219.A N ILE 261.A O no hydrogen 2.962 N/A ASN 220.A N GLU 223.A OE1 no hydrogen 2.917 N/A SER 222.A OG ASN 220.A OD1 no hydrogen 3.045 N/A GLU 223.A N ASN 220.A OD1 no hydrogen 2.961 N/A ALA 224.A N ASN 220.A O no hydrogen 2.988 N/A GLU 225.A N GLU 221.A O no hydrogen 2.917 N/A ALA 226.A N SER 222.A O no hydrogen 3.016 N/A TYR 227.A N GLU 223.A O no hydrogen 2.863 N/A TYR 227.A OH ASP 208.A OD1 no hydrogen 2.649 N/A GLY 228.A N ALA 224.A O no hydrogen 2.784 N/A GLU 229.A N GLU 225.A O no hydrogen 3.012 N/A VAL 230.A N ALA 226.A O no hydrogen 3.203 N/A HIS 231.A N TYR 227.A O no hydrogen 3.180 N/A HIS 231.A N GLY 228.A O no hydrogen 3.035 N/A HIS 231.A ND1 TYR 227.A O no hydrogen 2.653 N/A HIS 231.A NE2 ASP 208.A OD2 no hydrogen 2.757 N/A GLY 232.A N GLU 229.A O no hydrogen 3.052 N/A LEU 233.A N GLY 228.A O no hydrogen 2.922 N/A THR 237.A OG1 LEU 233.A O no hydrogen 3.192 N/A THR 237.A OG1 LEU 234.A O no hydrogen 3.085 N/A ALA 240.A N ASP 236.A O no hydrogen 2.791 N/A THR 241.A N THR 237.A O no hydrogen 2.805 N/A THR 241.A OG1 ALA 224.A O no hydrogen 2.980 N/A THR 241.A OG1 THR 237.A O no hydrogen 2.861 N/A ALA 242.A N VAL 238.A O no hydrogen 3.136 N/A ARG 243.A N HIS 239.A O no hydrogen 3.042 N/A ARG 243.A NH1 ASP 247.A OD1 no hydrogen 3.148 N/A ARG 243.A NH2 THR 272.A OG1 no hydrogen 2.788 N/A TYR 244.A N ALA 240.A O no hydrogen 2.829 N/A ILE 245.A N THR 241.A O no hydrogen 2.864 N/A ALA 246.A N ALA 242.A O no hydrogen 3.100 N/A ASP 247.A N ARG 243.A O no hydrogen 3.048 N/A ASP 247.A N TYR 244.A O no hydrogen 3.249 N/A ALA 251.A N SER 212.A O no hydrogen 2.896 N/A GLY 253.A N PHE 250.A O no hydrogen 2.827 N/A LYS 254.A N ASP 252.A OD2 no hydrogen 3.047 N/A ARG 256.A NE GLU 187.A OE2 no hydrogen 2.986 N/A ARG 256.A NH1 ASP 252.A OD2 no hydrogen 3.246 N/A ARG 256.A NH2 GLU 187.A OE2 no hydrogen 2.916 N/A ARG 256.A NH2 ASP 252.A OD1 no hydrogen 2.947 N/A ARG 258.A N SER 274.A OG no hydrogen 2.848 N/A ARG 258.A NE ILE 245.A O no hydrogen 2.890 N/A ARG 258.A NH1 SER 214.A O no hydrogen 3.549 N/A ARG 258.A NH2 ILE 245.A O no hydrogen 2.904 N/A ARG 258.A NH2 LEU 248.A O no hydrogen 2.219 N/A LEU 259.A N ASN 215.A O no hydrogen 2.782 N/A VAL 260.A N THR 272.A O no hydrogen 2.931 N/A ILE 261.A N VAL 217.A O no hydrogen 2.902 N/A ILE 262.A N LEU 270.A O no hydrogen 2.793 N/A THR 263.A N GLY 219.A O no hydrogen 2.827 N/A THR 263.A OG1 GLY 219.A O no hydrogen 3.328 N/A ARG 264.A NE GLU 221.A OE1 no hydrogen 3.202 N/A ARG 264.A NH1 PRO 268.A O no hydrogen 2.832 N/A ASN 267.A N ARG 264.A O no hydrogen 3.108 N/A LEU 269.A N PHE 282.A O no hydrogen 3.114 N/A LEU 270.A N ILE 262.A O no hydrogen 2.847 N/A TYR 271.A N HIS 280.A O no hydrogen 3.029 N/A THR 272.A N VAL 260.A O no hydrogen 3.131 N/A THR 272.A OG1 ASP 273.A O no hydrogen 3.442 N/A THR 272.A OG1 GLU 278.A O no hydrogen 2.875 N/A SER 274.A N ARG 258.A O no hydrogen 3.124 N/A SER 274.A OG ARG 256.A O no hydrogen 3.159 N/A SER 275.A N ASP 273.A OD1 no hydrogen 3.103 N/A ASP 276.A N ASP 273.A O no hydrogen 2.848 N/A GLU 278.A N ASP 276.A OD2 no hydrogen 2.915 N/A HIS 280.A N TYR 271.A O no hydrogen 2.959 N/A HIS 280.A NE2 ASP 276.A OD1 no hydrogen 2.857 N/A PHE 282.A N LEU 269.A O no hydrogen 2.873 N/A LYS 288.A N GLN 291.A OE1 no hydrogen 2.710 N/A GLN 291.A N LYS 288.A O no hydrogen 3.365 N/A ILE 293.A N ILE 331.A O no hydrogen 3.134 N/A ASP 294.A N ILE 331.A O no hydrogen 2.937 N/A ASN 296.A N ASP 294.A OD1 no hydrogen 3.315 N/A ALA 298.A N THR 295.A O no hydrogen 3.060 N/A ALA 301.A N GLY 297.A O no hydrogen 2.972 N/A PHE 302.A N ALA 298.A O no hydrogen 2.782 N/A ALA 303.A N GLY 299.A O no hydrogen 3.116 N/A ALA 304.A N ASP 300.A O no hydrogen 3.150 N/A GLY 305.A N ALA 301.A O no hydrogen 2.781 N/A PHE 306.A N PHE 302.A O no hydrogen 2.969 N/A ILE 307.A N ALA 303.A O no hydrogen 2.952 N/A ALA 308.A N ALA 304.A O no hydrogen 2.947 N/A TYR 310.A N PHE 306.A O no hydrogen 2.876 N/A ILE 311.A N ILE 307.A O no hydrogen 2.899 N/A ARG 312.A N ASP 309.A O no hydrogen 3.065 N/A ARG 312.A NE ALA 308.A O no hydrogen 2.760 N/A ARG 312.A NH2 ASP 309.A OD1 no hydrogen 2.995 N/A GLY 313.A N TYR 310.A O no hydrogen 3.229 N/A LYS 314.A N ASP 309.A O no hydrogen 3.266 N/A SER 319.A N PRO 315.A O no hydrogen 2.967 N/A SER 319.A OG LYS 314.A O no hydrogen 3.261 N/A SER 319.A OG PRO 315.A O no hydrogen 3.098 N/A LEU 320.A N MET 316.A O no hydrogen 2.961 N/A HIS 321.A N ILE 317.A O no hydrogen 3.060 N/A ALA 322.A N THR 318.A O no hydrogen 3.044 N/A ALA 323.A N SER 319.A O no hydrogen 2.855 N/A VAL 324.A N LEU 320.A O no hydrogen 2.956 N/A LYS 325.A N HIS 321.A O no hydrogen 2.948 N/A LYS 325.A NZ SER 345.A O no hydrogen 2.884 N/A ALA 326.A N ALA 322.A O no hydrogen 3.039 N/A ALA 327.A N ALA 323.A O no hydrogen 3.037 N/A ALA 328.A N VAL 324.A O no hydrogen 2.813 N/A TYR 329.A N LYS 325.A O no hydrogen 2.966 N/A ILE 330.A N ALA 326.A O no hydrogen 3.229 N/A ILE 331.A N ALA 327.A O no hydrogen 2.840 N/A CYS 332.A N ALA 328.A O no hydrogen 3.266 N/A CYS 332.A SG GLN 291.A O no hydrogen 3.868 N/A CYS 332.A SG ALA 328.A O no hydrogen 3.600 N/A ARG 333.A N ILE 330.A O no hydrogen 2.926 N/A ARG 333.A NE SER 337.A O no hydrogen 2.796 N/A ARG 333.A NH2 SER 337.A OG no hydrogen 3.129 N/A GLY 335.A N ASP 294.A OD2 no hydrogen 3.118 N/A SER 337.A N GLY 335.A O no hydrogen 2.881 N/A GLY 339.A N TYR 329.A OH no hydrogen 2.788 N/A ARG 341.A NE TRP 73.A O no hydrogen 3.012 N/A ARG 341.A NE ILE 74.A O no hydrogen 3.380 N/A ARG 341.A NH1 ARG 341.A O no hydrogen 3.103 N/A ARG 341.A NH2 ILE 74.A O no hydrogen 2.784 N/A SER 343.A N SER 340.A O no hydrogen 3.039 N/A TYR 344.A N ARG 341.A O no hydrogen 3.237 N/A