Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pvw_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 4.A OD2 no hydrogen 3.085 N/A GLN 5.A N SER 1.A O no hydrogen 3.467 N/A GLU 11.A N ARG 7.A O no hydrogen 3.145 N/A GLN 12.A N GLN 8.A O no hydrogen 2.764 N/A LYS 14.A N ALA 10.A O no hydrogen 3.157 N/A ASN 15.A N GLU 11.A O no hydrogen 2.714 N/A ILE 17.A N LEU 13.A O no hydrogen 2.871 N/A ARG 18.A N LYS 14.A O no hydrogen 3.363 N/A ASP 19.A N ASN 15.A O no hydrogen 2.752 N/A ALA 20.A N GLN 16.A O no hydrogen 3.207 N/A ARG 21.A NE ASP 257.A OD2 no hydrogen 2.919 N/A ARG 21.A NH2 THR 220.A O no hydrogen 3.334 N/A ARG 21.A NH2 ASP 257.A OD2 no hydrogen 3.211 N/A LYS 22.A N ARG 18.A O no hydrogen 2.888 N/A ALA 23.A N ASP 19.A O no hydrogen 2.945 N/A CYS 24.A N ALA 20.A O no hydrogen 3.383 N/A CYS 24.A SG ALA 20.A O no hydrogen 3.193 N/A ALA 25.A N LYS 22.A O no hydrogen 3.156 N/A ASP 26.A N CYS 24.A O no hydrogen 2.970 N/A THR 28.A N GLN 31.A OE1 no hydrogen 3.046 N/A GLN 31.A N THR 28.A OG1 no hydrogen 3.122 N/A ILE 32.A N THR 28.A O no hydrogen 3.020 N/A THR 33.A N LEU 29.A O no hydrogen 2.815 N/A THR 33.A OG1 LEU 29.A O no hydrogen 2.960 N/A THR 33.A OG1 SER 30.A O no hydrogen 3.464 N/A THR 33.A OG1 LEU 299.A O no hydrogen 2.680 N/A ASN 34.A N GLN 31.A O no hydrogen 3.402 N/A ILE 36.A N THR 33.A O no hydrogen 3.118 N/A ILE 42.A N ALA 304.A O no hydrogen 3.354 N/A THR 46.A OG1 ARG 48.A O no hydrogen 3.478 N/A ARG 47.A N ILE 337.A O no hydrogen 2.701 N/A ARG 48.A NE SER 83.A O no hydrogen 2.836 N/A ARG 48.A NE TYR 84.A O no hydrogen 3.156 N/A ARG 48.A NH1 ARG 47.A O no hydrogen 3.004 N/A ARG 48.A NH2 TYR 84.A O no hydrogen 2.794 N/A LEU 50.A N LEU 335.A O no hydrogen 2.887 N/A HIS 53.A ND1 ASP 75.A OD1 no hydrogen 2.900 N/A HIS 53.A NE2 SER 71.A OG no hydrogen 2.651 N/A LEU 54.A N ASP 75.A OD1 no hydrogen 2.839 N/A LYS 56.A N GLN 74.A OE1 no hydrogen 3.145 N/A ILE 57.A N SER 330.A O no hydrogen 3.096 N/A TYR 58.A N ALA 72.A O no hydrogen 2.833 N/A HIS 61.A N VAL 70.A O no hydrogen 2.997 N/A GLY 63.A N LEU 68.A O no hydrogen 2.889 N/A THR 64.A OG1 PRO 106.A O no hydrogen 2.653 N/A SER 66.A N GLY 63.A O no hydrogen 3.191 N/A ARG 67.A N ASP 65.A OD2 no hydrogen 2.919 N/A ARG 67.A NE ASP 82.A OD1 no hydrogen 2.977 N/A ARG 67.A NH2 ASP 82.A OD2 no hydrogen 3.056 N/A LEU 68.A N ASP 65.A OD2 no hydrogen 3.027 N/A LEU 69.A N TRP 81.A O no hydrogen 3.026 N/A VAL 70.A N HIS 61.A O no hydrogen 3.063 N/A SER 71.A N ILE 79.A O no hydrogen 2.913 N/A SER 71.A OG HIS 53.A NE2 no hydrogen 2.651 N/A ALA 72.A N ALA 59.A O no hydrogen 2.934 N/A SER 73.A OG ALA 55.A O no hydrogen 3.358 N/A SER 73.A OG LYS 56.A O no hydrogen 2.664 N/A GLN 74.A N LYS 56.A O no hydrogen 2.812 N/A ASP 75.A N SER 73.A OG no hydrogen 2.914 N/A GLY 76.A N SER 73.A O no hydrogen 2.912 N/A LYS 77.A N ASP 75.A OD2 no hydrogen 2.872 N/A LEU 78.A N ILE 92.A O no hydrogen 2.963 N/A ILE 79.A N SER 71.A O no hydrogen 3.151 N/A ILE 80.A N HIS 90.A O no hydrogen 3.097 N/A TRP 81.A N LEU 69.A O no hydrogen 2.832 N/A TRP 81.A NE1 SER 71.A OG no hydrogen 2.900 N/A ASP 82.A N ASN 87.A O no hydrogen 2.901 N/A SER 83.A N ARG 67.A O no hydrogen 2.953 N/A SER 83.A OG ARG 67.A O no hydrogen 2.740 N/A TYR 84.A N ASP 82.A OD1 no hydrogen 3.049 N/A TYR 84.A OH SER 66.A O no hydrogen 3.213 N/A THR 85.A OG1 ASP 82.A OD2 no hydrogen 2.816 N/A THR 86.A N ASP 82.A O no hydrogen 2.705 N/A ASN 87.A N THR 85.A OG1 no hydrogen 3.162 N/A LYS 88.A NZ ARG 51.A O no hydrogen 3.056 N/A VAL 89.A N ILE 80.A O no hydrogen 2.851 N/A ILE 92.A N LEU 78.A O no hydrogen 2.755 N/A LEU 94.A N GLY 76.A O no hydrogen 3.060 N/A TRP 98.A N SER 96.A OG no hydrogen 3.249 N/A MET 100.A N GLY 114.A O no hydrogen 2.815 N/A THR 101.A N GLY 114.A O no hydrogen 3.087 N/A CYS 102.A SG ALA 59.A O no hydrogen 3.566 N/A CYS 102.A SG VAL 70.A O no hydrogen 3.722 N/A ALA 103.A N ALA 112.A O no hydrogen 2.893 N/A TYR 104.A N HIS 61.A ND1 no hydrogen 3.086 N/A ALA 105.A N TYR 110.A O no hydrogen 3.085 N/A SER 107.A OG ASP 153.A OD1 no hydrogen 3.315 N/A SER 107.A OG ASP 153.A OD2 no hydrogen 2.606 N/A GLY 108.A N ALA 105.A O no hydrogen 2.636 N/A ASN 109.A N SER 107.A OG no hydrogen 3.121 N/A ASN 109.A ND2 ASP 153.A OD1 no hydrogen 3.511 N/A VAL 111.A N TYR 123.A O no hydrogen 3.135 N/A ALA 112.A N ALA 103.A O no hydrogen 2.898 N/A CYS 113.A N SER 121.A O no hydrogen 2.977 N/A GLY 114.A N THR 101.A O no hydrogen 3.468 N/A GLY 115.A N ASP 117.A OD1 no hydrogen 3.014 N/A LEU 116.A N TRP 98.A O no hydrogen 3.073 N/A ASN 118.A N GLY 115.A O no hydrogen 3.344 N/A ILE 119.A N ASP 117.A OD1 no hydrogen 3.026 N/A CYS 120.A N LEU 138.A O no hydrogen 3.252 N/A SER 121.A N CYS 113.A O no hydrogen 2.859 N/A ILE 122.A N ARG 136.A O no hydrogen 2.766 N/A TYR 123.A N VAL 111.A O no hydrogen 2.711 N/A ASN 124.A N ARG 133.A O no hydrogen 3.154 N/A LEU 125.A N ASN 109.A O no hydrogen 2.990 N/A LYS 126.A N ASN 124.A OD1 no hydrogen 2.789 N/A THR 127.A N ASN 131.A O no hydrogen 3.194 N/A SER 135.A N ILE 122.A O no hydrogen 2.874 N/A SER 135.A OG ILE 122.A O no hydrogen 3.336 N/A ARG 136.A N ILE 122.A O no hydrogen 3.411 N/A ARG 136.A NE SER 135.A O no hydrogen 3.481 N/A LEU 138.A N CYS 120.A O no hydrogen 2.805 N/A HIS 141.A ND1 ASP 162.A OD2 no hydrogen 2.978 N/A HIS 141.A NE2 THR 158.A OG1 no hydrogen 2.730 N/A THR 142.A N ASP 162.A OD2 no hydrogen 2.901 N/A TYR 144.A OH ASP 185.A OD2 no hydrogen 2.586 N/A LEU 145.A N GLY 115.A O no hydrogen 2.920 N/A SER 146.A N SER 159.A O no hydrogen 3.089 N/A SER 146.A OG SER 159.A OG no hydrogen 2.445 N/A SER 146.A OG VAL 186.A O no hydrogen 2.597 N/A CYS 147.A SG LEU 189.A O no hydrogen 4.030 N/A ARG 149.A N VAL 157.A O no hydrogen 2.919 N/A ARG 149.A NH1 CYS 102.A O no hydrogen 3.501 N/A LEU 151.A N GLN 155.A O no hydrogen 2.902 N/A ASP 152.A N GLN 155.A O no hydrogen 3.320 N/A ASN 154.A ND2 ASP 169.A OD1 no hydrogen 3.361 N/A ASN 154.A ND2 ASP 169.A OD2 no hydrogen 3.378 N/A GLN 155.A N ASP 152.A O no hydrogen 3.414 N/A ILE 156.A N TRP 168.A O no hydrogen 3.443 N/A VAL 157.A N ARG 149.A O no hydrogen 2.937 N/A THR 158.A N ALA 166.A O no hydrogen 3.054 N/A THR 158.A OG1 HIS 141.A NE2 no hydrogen 2.730 N/A THR 158.A OG1 ALA 166.A O no hydrogen 3.470 N/A SER 159.A N CYS 147.A O no hydrogen 2.871 N/A SER 159.A OG SER 146.A OG no hydrogen 2.445 N/A SER 159.A OG CYS 147.A O no hydrogen 3.362 N/A SER 160.A OG TYR 144.A O no hydrogen 3.170 N/A GLY 161.A N TYR 144.A O no hydrogen 3.004 N/A ASP 162.A N SER 160.A OG no hydrogen 3.218 N/A THR 163.A N SER 160.A O no hydrogen 3.064 N/A THR 163.A OG1 ASP 162.A O no hydrogen 2.304 N/A THR 164.A N ASP 162.A OD1 no hydrogen 2.915 N/A THR 164.A OG1 HIS 141.A ND1 no hydrogen 3.336 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.558 N/A THR 164.A OG1 ASP 162.A OD2 no hydrogen 3.272 N/A CYS 165.A N PHE 179.A O no hydrogen 3.240 N/A ALA 166.A N THR 158.A O no hydrogen 3.018 N/A LEU 167.A N THR 177.A O no hydrogen 2.780 N/A TRP 168.A N ILE 156.A O no hydrogen 2.866 N/A TRP 168.A NE1 THR 158.A OG1 no hydrogen 2.808 N/A ASP 169.A N GLN 174.A O no hydrogen 3.108 N/A ILE 170.A N ASN 154.A O no hydrogen 2.794 N/A GLU 171.A N ASN 154.A OD1 no hydrogen 2.871 N/A THR 172.A N ASP 169.A OD2 no hydrogen 2.952 N/A GLY 173.A N ASP 169.A O no hydrogen 2.709 N/A GLN 174.A NE2 GLY 173.A O no hydrogen 2.907 N/A THR 176.A N LEU 167.A O no hydrogen 2.868 N/A THR 177.A N LEU 167.A O no hydrogen 3.316 N/A THR 177.A OG1 THR 176.A O no hydrogen 2.660 N/A PHE 179.A N CYS 165.A O no hydrogen 2.968 N/A HIS 182.A ND1 ASP 204.A OD2 no hydrogen 2.704 N/A HIS 182.A NE2 SER 200.A OG no hydrogen 2.979 N/A THR 183.A N ASP 204.A OD2 no hydrogen 2.823 N/A THR 183.A OG1 ASP 204.A OD2 no hydrogen 3.537 N/A VAL 186.A N SER 160.A O no hydrogen 3.107 N/A MET 187.A N GLY 201.A O no hydrogen 2.958 N/A SER 188.A N GLY 201.A O no hydrogen 3.387 N/A SER 190.A N VAL 199.A O no hydrogen 3.022 N/A ALA 192.A N LEU 197.A O no hydrogen 2.960 N/A THR 195.A N ALA 192.A O no hydrogen 2.707 N/A THR 195.A OG1 ASP 194.A O no hydrogen 2.684 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 3.011 N/A PHE 198.A N TRP 210.A O no hydrogen 3.386 N/A VAL 199.A N SER 190.A O no hydrogen 2.879 N/A SER 200.A N LYS 208.A O no hydrogen 2.894 N/A SER 200.A OG HIS 182.A NE2 no hydrogen 2.979 N/A GLY 201.A N SER 188.A O no hydrogen 2.999 N/A ALA 202.A N SER 206.A O no hydrogen 3.275 N/A CYS 203.A N ASP 185.A O no hydrogen 2.731 N/A CYS 203.A SG ASP 185.A O no hydrogen 3.421 N/A CYS 203.A SG ASP 227.A OD2 no hydrogen 3.661 N/A ALA 205.A N ALA 202.A O no hydrogen 2.903 N/A SER 206.A N ASP 204.A OD1 no hydrogen 3.011 N/A SER 206.A OG ASP 204.A OD1 no hydrogen 2.690 N/A ALA 207.A N PHE 221.A O no hydrogen 2.916 N/A LYS 208.A N SER 200.A O no hydrogen 2.939 N/A LYS 208.A NZ THR 220.A OG1 no hydrogen 2.574 N/A LEU 209.A N GLN 219.A O no hydrogen 3.126 N/A TRP 210.A N PHE 198.A O no hydrogen 2.877 N/A TRP 210.A NE1 SER 200.A OG no hydrogen 3.065 N/A ASP 211.A N MET 216.A O no hydrogen 3.061 N/A VAL 212.A N ARG 196.A O no hydrogen 3.080 N/A ARG 213.A N ASP 211.A OD2 no hydrogen 3.272 N/A GLY 215.A N ASP 211.A O no hydrogen 2.800 N/A CYS 217.A SG LEU 209.A O no hydrogen 4.010 N/A CYS 217.A SG GLN 219.A O no hydrogen 3.633 N/A CYS 217.A SG THR 220.A OG1 no hydrogen 3.518 N/A ARG 218.A N LEU 209.A O no hydrogen 2.951 N/A GLN 219.A NE2 LEU 254.A O no hydrogen 2.752 N/A GLN 219.A NE2 ASP 257.A OD1 no hydrogen 2.726 N/A PHE 221.A N ALA 207.A O no hydrogen 2.767 N/A HIS 224.A ND1 ASP 246.A OD2 no hydrogen 2.566 N/A HIS 224.A NE2 THR 242.A OG1 no hydrogen 2.700 N/A GLU 225.A N ASP 246.A OD2 no hydrogen 3.120 N/A ASP 227.A N SER 226.A OG no hydrogen 2.814 N/A ILE 228.A N ALA 202.A O no hydrogen 3.233 N/A ASN 229.A N GLY 243.A O no hydrogen 2.948 N/A ASN 229.A ND2 ASP 245.A OD1 no hydrogen 2.726 N/A ASN 229.A ND2 ILE 272.A O no hydrogen 2.891 N/A ALA 230.A N GLY 243.A O no hydrogen 3.330 N/A CYS 232.A N ALA 241.A O no hydrogen 2.667 N/A CYS 232.A SG PHE 233.A O no hydrogen 3.718 N/A CYS 232.A SG VAL 275.A O no hydrogen 3.746 N/A PHE 233.A N SER 190.A OG no hydrogen 3.143 N/A PHE 234.A N ALA 239.A O no hydrogen 2.896 N/A GLY 237.A N PHE 234.A O no hydrogen 3.122 N/A ASN 238.A N ASN 236.A OD1 no hydrogen 3.021 N/A PHE 240.A N PHE 252.A O no hydrogen 2.953 N/A ALA 241.A N CYS 232.A O no hydrogen 2.610 N/A THR 242.A N ARG 250.A O no hydrogen 2.920 N/A THR 242.A OG1 HIS 224.A NE2 no hydrogen 2.700 N/A GLY 243.A N ALA 230.A O no hydrogen 3.040 N/A SER 244.A N THR 248.A O no hydrogen 3.209 N/A SER 244.A OG SER 226.A O no hydrogen 3.532 N/A SER 244.A OG ASP 227.A O no hydrogen 3.115 N/A ASP 245.A N ASP 227.A O no hydrogen 2.976 N/A ASP 246.A N SER 244.A OG no hydrogen 2.736 N/A ALA 247.A N SER 244.A O no hydrogen 3.449 N/A THR 248.A N ASP 246.A OD1 no hydrogen 2.891 N/A THR 248.A OG1 ASP 246.A OD1 no hydrogen 2.579 N/A THR 248.A OG1 ASP 246.A OD2 no hydrogen 3.481 N/A CYS 249.A N TYR 263.A O no hydrogen 3.191 N/A ARG 250.A N THR 242.A O no hydrogen 2.987 N/A ARG 250.A NE THR 248.A OG1 no hydrogen 3.172 N/A ARG 250.A NH1 GLU 259.A OE1 no hydrogen 3.325 N/A LEU 251.A N MET 261.A O no hydrogen 2.986 N/A PHE 252.A N PHE 240.A O no hydrogen 2.856 N/A ASP 253.A N GLN 258.A O no hydrogen 2.949 N/A LEU 254.A N ASN 238.A O no hydrogen 2.948 N/A ALA 256.A N ASP 253.A OD1 no hydrogen 2.824 N/A ASP 257.A N ASP 253.A O no hydrogen 2.991 N/A LEU 260.A N LEU 251.A O no hydrogen 2.868 N/A THR 262.A OG1 GLU 259.A OE2 no hydrogen 2.712 N/A TYR 263.A N CYS 249.A O no hydrogen 2.967 N/A TYR 263.A OH ALA 298.A O no hydrogen 2.734 N/A ASN 267.A N HIS 265.A ND1 no hydrogen 3.421 N/A ILE 272.A N SER 244.A O no hydrogen 2.904 N/A THR 273.A N GLY 287.A O no hydrogen 2.825 N/A THR 273.A OG1 SER 274.A OG no hydrogen 2.903 N/A THR 273.A OG1 GLY 287.A O no hydrogen 3.405 N/A THR 273.A OG1 VAL 314.A O no hydrogen 2.689 N/A SER 274.A OG THR 273.A OG1 no hydrogen 2.903 N/A SER 276.A N LEU 285.A O no hydrogen 2.889 N/A SER 278.A N LEU 283.A O no hydrogen 2.956 N/A LYS 279.A NZ ASP 321.A O no hydrogen 2.658 N/A GLY 281.A N SER 278.A O no hydrogen 3.024 N/A ARG 282.A N SER 280.A OG no hydrogen 3.370 N/A ARG 282.A NE ASP 297.A OD1 no hydrogen 2.917 N/A ARG 282.A NH2 ASP 37.A O no hydrogen 3.209 N/A ARG 282.A NH2 ASP 297.A OD1 no hydrogen 3.416 N/A ARG 282.A NH2 ASP 297.A OD2 no hydrogen 2.803 N/A LEU 283.A N SER 278.A OG no hydrogen 3.247 N/A LEU 284.A N TRP 296.A O no hydrogen 2.994 N/A LEU 285.A N SER 276.A O no hydrogen 2.679 N/A ALA 286.A N ASN 294.A O no hydrogen 3.031 N/A GLY 287.A N SER 274.A O no hydrogen 2.975 N/A TYR 288.A N ASN 292.A O no hydrogen 2.949 N/A ASP 289.A N GLY 271.A O no hydrogen 3.280 N/A PHE 291.A N TYR 288.A O no hydrogen 3.405 N/A ASN 292.A N ASP 290.A OD1 no hydrogen 2.860 N/A CYS 293.A N LEU 307.A O no hydrogen 3.137 N/A CYS 293.A SG ALA 286.A O no hydrogen 3.457 N/A CYS 293.A SG ASN 294.A O no hydrogen 3.900 N/A ASN 294.A N ALA 286.A O no hydrogen 2.887 N/A VAL 295.A N GLY 305.A O no hydrogen 2.686 N/A TRP 296.A N LEU 284.A O no hydrogen 3.005 N/A TRP 296.A NE1 TYR 288.A OH no hydrogen 3.109 N/A ASP 297.A N ASP 302.A O no hydrogen 2.657 N/A ALA 298.A N ARG 282.A O no hydrogen 2.754 N/A LEU 299.A N ASP 297.A OD1 no hydrogen 3.046 N/A LYS 300.A N ASP 297.A O no hydrogen 3.271 N/A LYS 300.A N ASP 297.A OD1 no hydrogen 3.217 N/A LYS 300.A NZ ILE 36.A O no hydrogen 2.563 N/A ALA 301.A N ASP 297.A O no hydrogen 2.788 N/A ALA 304.A N VAL 295.A O no hydrogen 2.672 N/A GLY 305.A N VAL 295.A O no hydrogen 3.292 N/A LEU 307.A N CYS 293.A O no hydrogen 2.691 N/A HIS 310.A ND1 ASP 332.A OD2 no hydrogen 2.973 N/A HIS 310.A NE2 THR 328.A OG1 no hydrogen 2.784 N/A ASP 311.A N ASP 332.A OD2 no hydrogen 3.172 N/A ARG 313.A N ASN 312.A OD1 no hydrogen 2.647 N/A ARG 313.A NE ASP 289.A OD2 no hydrogen 2.349 N/A VAL 314.A N TYR 288.A O no hydrogen 3.188 N/A SER 315.A N GLY 329.A O no hydrogen 2.798 N/A SER 315.A OG ILE 57.A O no hydrogen 2.760 N/A SER 315.A OG GLY 329.A O no hydrogen 3.196 N/A CYS 316.A N GLY 329.A O no hydrogen 3.369 N/A CYS 316.A SG SER 315.A OG no hydrogen 3.553 N/A GLY 318.A N ALA 327.A O no hydrogen 3.049 N/A THR 320.A N ALA 325.A O no hydrogen 2.990 N/A THR 320.A OG1 ASP 322.A OD1 no hydrogen 2.554 N/A THR 320.A OG1 ALA 325.A O no hydrogen 3.371 N/A ASP 322.A N SER 66.A OG no hydrogen 3.032 N/A GLY 323.A N THR 320.A O no hydrogen 2.663 N/A MET 324.A N ASP 322.A OD1 no hydrogen 2.884 N/A ALA 325.A N THR 320.A OG1 no hydrogen 3.079 N/A VAL 326.A N TRP 338.A O no hydrogen 3.179 N/A ALA 327.A N GLY 318.A O no hydrogen 2.809 N/A THR 328.A N LYS 336.A O no hydrogen 2.873 N/A THR 328.A OG1 HIS 310.A NE2 no hydrogen 2.784 N/A THR 328.A OG1 LYS 336.A O no hydrogen 3.388 N/A GLY 329.A N CYS 316.A O no hydrogen 2.797 N/A SER 330.A N PHE 334.A O no hydrogen 3.191 N/A SER 330.A OG ASN 312.A O no hydrogen 3.194 N/A SER 330.A OG ARG 313.A O no hydrogen 2.764 N/A TRP 331.A N ARG 313.A O no hydrogen 2.806 N/A ASP 332.A N SER 330.A OG no hydrogen 2.897 N/A SER 333.A N SER 330.A O no hydrogen 3.124 N/A SER 333.A OG ASP 332.A O no hydrogen 2.488 N/A PHE 334.A N ASP 332.A OD1 no hydrogen 2.936 N/A LEU 335.A N LEU 50.A O no hydrogen 3.436 N/A LYS 336.A N THR 328.A O no hydrogen 2.963 N/A LYS 336.A NZ GLY 309.A O no hydrogen 2.777 N/A ILE 337.A N ARG 48.A O no hydrogen 3.219 N/A TRP 338.A N VAL 326.A O no hydrogen 2.851 N/A TRP 338.A NE1 THR 328.A OG1 no hydrogen 2.874 N/A