Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k50_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 13.A N.A ILE 9.A O no hydrogen 3.220 N/A SER 13.A N.B ILE 9.A O no hydrogen 3.129 N/A SER 13.A OG.A ILE 9.A O no hydrogen 3.339 N/A SER 13.A OG.A TRP 10.A O no hydrogen 2.556 N/A VAL 14.A N.A TRP 10.A O no hydrogen 2.730 N/A VAL 14.A N.B TRP 10.A O no hydrogen 2.829 N/A ARG 15.A NE ASP 12.A OD1 no hydrogen 3.007 N/A ARG 15.A NH2 PRO 24.A O no hydrogen 3.083 N/A GLN 16.A N SER 13.A O.A no hydrogen 3.111 N/A GLN 16.A N VAL 14.A O.B no hydrogen 2.762 N/A GLU 17.A N VAL 14.A O.A no hydrogen 2.912 N/A GLU 17.A N VAL 14.A O.B no hydrogen 2.779 N/A TYR 18.A OH ASP 46.A OD2 no hydrogen 2.613 N/A LEU 19.A N VAL 322.A O no hydrogen 2.995 N/A TYR 21.A N TYR 18.A O no hydrogen 3.249 N/A TYR 21.A OH ASP 243.A OD1 no hydrogen 2.399 N/A ARG 22.A NE ASP 243.A OD2 no hydrogen 3.128 N/A ARG 22.A NH2 ASP 243.A OD2 no hydrogen 2.858 N/A ASP 23.A N TRP 20.A O no hydrogen 2.986 N/A PHE 32.A N ASP 30.A OD1 no hydrogen 3.301 N/A GLN 33.A N ASP 30.A OD1 no hydrogen 3.315 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.662 N/A ALA 37.A N LYS 34.A O no hydrogen 2.845 N/A PHE 38.A N LYS 34.A O no hydrogen 3.024 N/A LEU 39.A N PRO 35.A O no hydrogen 2.815 N/A LYS 40.A N GLU 36.A O no hydrogen 3.102 N/A LYS 41.A N ALA 37.A O no hydrogen 3.377 N/A LYS 41.A N PHE 38.A O no hydrogen 3.102 N/A ALA 42.A N PHE 38.A O no hydrogen 2.865 N/A ALA 42.A N LEU 39.A O no hydrogen 3.150 N/A VAL 43.A N LEU 39.A O no hydrogen 3.009 N/A ALA 44.A N TYR 18.A OH no hydrogen 3.058 N/A GLY 48.A N ASP 46.A O no hydrogen 2.959 N/A SER 50.A N ASP 46.A OD1 no hydrogen 2.862 N/A SER 50.A OG ASP 46.A OD2 no hydrogen 2.714 N/A LYS 51.A N ASN 320.A O no hydrogen 2.869 N/A LYS 51.A NZ ASP 53.A OD1 no hydrogen 3.416 N/A LYS 51.A NZ ASP 53.A OD2 no hydrogen 2.571 N/A ASP 53.A N ILE 318.A O no hydrogen 2.844 N/A LEU 55.A N ARG 316.A O no hydrogen 3.271 N/A SER 62.A N ARG 149.A O no hydrogen 2.879 N/A TYR 63.A N LEU 117.A O no hydrogen 3.131 N/A TYR 63.A OH SER 120.A O no hydrogen 2.629 N/A ASP 66.A N TYR 85.A O no hydrogen 2.957 N/A TYR 67.A OH GLU 113.A OE2 no hydrogen 2.785 N/A THR 68.A N LEU 82.A O no hydrogen 3.043 N/A TYR 70.A N ASN 80.A O no hydrogen 2.911 N/A LYS 71.A NZ ASP 76.A O no hydrogen 2.860 N/A LYS 71.A NZ TYR 79.A OH no hydrogen 3.508 N/A VAL 72.A N ALA 78.A O no hydrogen 2.958 N/A ASN 75.A N VAL 72.A O no hydrogen 3.311 N/A TYR 79.A N ILE 108.A O no hydrogen 2.845 N/A ASN 80.A N TYR 70.A O no hydrogen 2.750 N/A ALA 81.A N ILE 103.A O no hydrogen 2.918 N/A LEU 82.A N THR 68.A O no hydrogen 2.860 N/A ILE 83.A N HIS 101.A O no hydrogen 2.797 N/A SER 84.A N ASP 66.A O no hydrogen 2.914 N/A TYR 85.A OH ASP 153.A OD2 no hydrogen 2.517 N/A VAL 87.A N GLY 64.A O no hydrogen 2.724 N/A GLY 89.A N GLU 93.A OE1 no hydrogen 2.753 N/A SER 90.A N VAL 87.A O no hydrogen 3.231 N/A SER 90.A OG VAL 87.A O no hydrogen 2.492 N/A ALA 92.A N TYR 63.A O no hydrogen 2.899 N/A GLU 93.A N SER 90.A OG no hydrogen 3.267 N/A GLU 94.A N SER 90.A O no hydrogen 3.031 N/A ALA 95.A N PRO 91.A O no hydrogen 2.913 N/A GLY 96.A N GLU 93.A O no hydrogen 3.081 N/A LEU 97.A N ALA 92.A O no hydrogen 3.098 N/A GLN 98.A N HIS 101.A ND1 no hydrogen 2.951 N/A ARG 99.A NE LEU 355.A O no hydrogen 2.873 N/A ARG 99.A NH1 SER 84.A O no hydrogen 2.852 N/A ARG 99.A NH1 TYR 212.A OH no hydrogen 3.018 N/A ARG 99.A NH2 GLU 347.A OE1 no hydrogen 3.067 N/A GLY 100.A N ILE 83.A O no hydrogen 3.018 N/A HIS 101.A N GLN 98.A O no hydrogen 2.993 N/A TRP 102.A N GLY 127.A O no hydrogen 2.996 N/A ILE 103.A N ALA 81.A O no hydrogen 2.765 N/A LYS 110.A NZ GLU 113.A OE1 no hydrogen 3.446 N/A VAL 112.A N THR 109.A O no hydrogen 3.098 N/A VAL 112.A N THR 109.A OG1 no hydrogen 3.402 N/A GLU 115.A N VAL 112.A O no hydrogen 2.786 N/A LEU 116.A N GLU 113.A O no hydrogen 2.989 N/A LEU 117.A N SER 114.A O no hydrogen 3.094 N/A GLY 119.A N SER 148.A OG no hydrogen 2.807 N/A SER 120.A OG THR 121.A O no hydrogen 3.541 N/A ARG 122.A NE ASN 104.A OD1 no hydrogen 2.965 N/A ARG 122.A NH1 GLU 115.A OE1 no hydrogen 3.258 N/A ARG 122.A NH2 ASN 104.A OD1 no hydrogen 3.191 N/A GLN 123.A N ASN 104.A OD1 no hydrogen 3.074 N/A LEU 124.A N THR 144.A O no hydrogen 2.802 N/A ILE 126.A N GLY 142.A O no hydrogen 2.949 N/A GLY 127.A N TRP 102.A O no hydrogen 2.740 N/A VAL 128.A N VAL 139.A O no hydrogen 3.118 N/A LYS 130.A N GLY 137.A O no hydrogen 2.904 N/A VAL 132.A N THR 135.A O no hydrogen 2.869 N/A THR 135.A N VAL 132.A O no hydrogen 2.906 N/A GLY 137.A N LYS 130.A O no hydrogen 3.102 N/A VAL 139.A N VAL 128.A O no hydrogen 2.910 N/A ILE 141.A N ILE 126.A O no hydrogen 2.971 N/A GLY 142.A N ILE 126.A O no hydrogen 3.352 N/A THR 144.A N LEU 124.A O no hydrogen 3.041 N/A THR 144.A OG1 ALA 95.A O no hydrogen 2.514 N/A THR 145.A OG1 GLN 123.A OE1 no hydrogen 2.566 N/A SER 148.A N GLY 119.A O no hydrogen 2.880 N/A SER 148.A OG GLY 119.A O no hydrogen 2.996 N/A ARG 149.A N SER 62.A O no hydrogen 3.055 N/A ARG 149.A NH1 GLU 94.A OE1 no hydrogen 3.209 N/A ARG 149.A NH2 GLU 94.A OE2 no hydrogen 2.829 N/A SER 150.A OG PRO 59.A O no hydrogen 2.773 N/A ARG 158.A NH1 HIS 157.A O no hydrogen 3.159 N/A GLU 160.A N TYR 171.A O no hydrogen 3.024 N/A ILE 162.A N VAL 169.A O no hydrogen 2.721 N/A TRP 164.A N LYS 167.A O no hydrogen 2.930 N/A ASN 165.A ND2 SER 372.A OG no hydrogen 3.211 N/A LYS 167.A N TRP 164.A O no hydrogen 2.954 N/A LYS 167.A NZ GLU 205.A OE2 no hydrogen 2.855 N/A LYS 168.A N ASN 204.A OD1 no hydrogen 2.994 N/A VAL 169.A N ILE 162.A O no hydrogen 2.818 N/A GLY 170.A N GLU 205.A O no hydrogen 2.982 N/A TYR 171.A N GLU 160.A O no hydrogen 2.757 N/A TYR 171.A OH ASP 209.A OD2 no hydrogen 2.446 N/A LEU 172.A N VAL 207.A O no hydrogen 2.991 N/A ASN 174.A N PRO 155.A O no hydrogen 2.817 N/A PHE 176.A N GLY 215.A O no hydrogen 3.021 N/A LYS 177.A N GLU 175.A O no hydrogen 3.050 N/A SER 184.A N THR 181.A O no hydrogen 3.124 N/A ALA 186.A N SER 184.A OG no hydrogen 3.043 N/A TYR 187.A N ALA 178.A O no hydrogen 2.717 N/A ASN 188.A N ALA 178.A O no hydrogen 2.979 N/A ASP 189.A N GLN 185.A O no hydrogen 2.840 N/A ASP 190.A N ALA 186.A O no hydrogen 3.065 N/A LEU 191.A N TYR 187.A O no hydrogen 2.904 N/A ARG 192.A N ASN 188.A O no hydrogen 2.909 N/A ARG 192.A NE LEU 258.A O no hydrogen 3.167 N/A ARG 192.A NE ILE 259.A O no hydrogen 3.160 N/A ARG 192.A NH1 GLN 185.A OE1 no hydrogen 3.497 N/A ARG 192.A NH1 ASP 189.A OD1 no hydrogen 2.764 N/A ARG 192.A NH2 LEU 258.A O no hydrogen 2.930 N/A ARG 193.A N ASP 189.A O no hydrogen 2.959 N/A ALA 194.A N ASP 190.A O no hydrogen 3.136 N/A PHE 195.A N LEU 191.A O no hydrogen 3.060 N/A ARG 196.A N ARG 192.A O no hydrogen 2.909 N/A ARG 196.A NH2 ASP 197.A OD1 no hydrogen 3.185 N/A ASP 197.A N ARG 193.A O no hydrogen 3.123 N/A PHE 198.A N ALA 194.A O no hydrogen 2.815 N/A GLN 199.A N PHE 195.A O no hydrogen 2.903 N/A THR 200.A N ARG 196.A O no hydrogen 2.992 N/A THR 200.A OG1 ARG 196.A O no hydrogen 3.141 N/A GLY 201.A N ASP 197.A O no hydrogen 3.002 N/A GLY 202.A N GLN 199.A O no hydrogen 2.933 N/A VAL 203.A N PHE 198.A O no hydrogen 3.224 N/A ASN 204.A N LYS 168.A O no hydrogen 2.844 N/A GLU 205.A N LYS 168.A O no hydrogen 3.209 N/A VAL 207.A N GLY 170.A O no hydrogen 2.887 N/A LEU 208.A N TYR 271.A O no hydrogen 2.714 N/A ASP 209.A N LEU 172.A O no hydrogen 2.724 N/A LEU 210.A N LEU 273.A O no hydrogen 3.011 N/A ARG 211.A N ASP 209.A OD1 no hydrogen 3.306 N/A ARG 211.A NE ASP 209.A OD1 no hydrogen 2.947 N/A ARG 211.A NE ASP 209.A OD2 no hydrogen 3.269 N/A ARG 211.A NH1 GLU 347.A OE1 no hydrogen 2.822 N/A ARG 211.A NH1 GLU 362.A OE2 no hydrogen 2.869 N/A ARG 211.A NH2 ASP 209.A OD2 no hydrogen 2.841 N/A ARG 211.A NH2 GLU 362.A OE1 no hydrogen 3.025 N/A ARG 211.A NH2 GLU 362.A OE2 no hydrogen 3.296 N/A TYR 212.A OH GLU 347.A OE2 no hydrogen 2.650 N/A ASN 213.A N LEU 210.A O no hydrogen 3.008 N/A ASN 213.A ND2 TYR 173.A O no hydrogen 2.867 N/A GLY 215.A N ASN 213.A OD1 no hydrogen 2.933 N/A SER 217.A N PHE 176.A O no hydrogen 2.786 N/A ASP 219.A N SER 217.A OG no hydrogen 3.087 N/A CYS 220.A N SER 217.A OG no hydrogen 3.263 N/A CYS 220.A SG ASN 188.A OD1 no hydrogen 3.374 N/A CYS 220.A SG SER 217.A OG no hydrogen 3.731 N/A ALA 221.A N SER 217.A O no hydrogen 3.226 N/A GLN 222.A N LEU 218.A O no hydrogen 2.893 N/A GLN 222.A NE2 THR 253.A O no hydrogen 2.785 N/A LEU 223.A N ASP 219.A O no hydrogen 3.066 N/A LEU 224.A N CYS 220.A O no hydrogen 3.033 N/A CYS 225.A N ALA 221.A O no hydrogen 2.973 N/A CYS 225.A SG ALA 221.A O no hydrogen 3.308 N/A THR 226.A N GLN 222.A O no hydrogen 3.008 N/A THR 226.A OG1 GLN 222.A O no hydrogen 2.916 N/A ALA 228.A N CYS 225.A O no hydrogen 3.125 N/A ALA 230.A N ASN 266.A OD1 no hydrogen 2.907 N/A LYS 232.A N PRO 229.A O no hydrogen 2.936 N/A GLN 234.A N LYS 232.A O no hydrogen 2.988 N/A LEU 236.A N LEU 252.A O no hydrogen 2.694 N/A ALA 237.A N LEU 252.A O no hydrogen 3.044 N/A LEU 238.A N TYR 327.A O no hydrogen 2.814 N/A LEU 239.A N GLN 250.A O no hydrogen 2.783 N/A ARG 240.A N ASN 325.A O no hydrogen 3.013 N/A ARG 240.A NH1 LEU 239.A O no hydrogen 3.075 N/A ARG 240.A NH1 GLN 250.A O no hydrogen 3.384 N/A ARG 240.A NH1 ASP 251.A OD1 no hydrogen 3.081 N/A ARG 240.A NH2 ASP 251.A OD1 no hydrogen 3.000 N/A TYR 241.A N ASN 249.A OD1 no hydrogen 2.920 N/A LYS 244.A N SER 242.A OG no hydrogen 3.144 N/A LYS 244.A NZ ARG 15.A O no hydrogen 2.582 N/A ARG 245.A N.A SER 242.A O no hydrogen 2.967 N/A ARG 245.A N.B SER 242.A O no hydrogen 2.949 N/A ARG 245.A NE.A GLN 16.A OE1 no hydrogen 2.865 N/A ARG 245.A NE.B GLU 17.A OE1 no hydrogen 2.789 N/A ARG 245.A NH1.A GLU 247.A OE2 no hydrogen 3.521 N/A ALA 248.A N ARG 245.A O.A no hydrogen 2.992 N/A ALA 248.A N ARG 245.A O.B no hydrogen 3.031 N/A ASN 249.A N VAL 246.A O.A no hydrogen 2.920 N/A ASN 249.A N VAL 246.A O.B no hydrogen 3.155 N/A GLN 250.A N LEU 239.A O no hydrogen 3.099 N/A LEU 252.A N ALA 237.A O no hydrogen 2.751 N/A PHE 254.A N GLN 234.A O no hydrogen 2.942 N/A ASN 255.A N THR 226.A OG1 no hydrogen 3.011 N/A GLU 257.A N ASN 255.A OD1 no hydrogen 3.134 N/A LEU 258.A N ASN 255.A O no hydrogen 2.942 N/A ILE 259.A N PRO 256.A O no hydrogen 3.119 N/A GLN 260.A NE2 GLU 257.A O no hydrogen 2.789 N/A GLY 262.A N ILE 259.A O no hydrogen 2.840 N/A ASN 264.A ND2 THR 226.A O no hydrogen 2.936 N/A ASN 264.A ND2 ALA 228.A O no hydrogen 2.756 N/A ASN 266.A N ASN 264.A OD1 no hydrogen 2.814 N/A LEU 267.A N LEU 227.A O no hydrogen 3.357 N/A VAL 270.A N LYS 292.A O no hydrogen 2.816 N/A TYR 271.A N PHE 206.A O no hydrogen 2.873 N/A VAL 272.A N VAL 294.A O no hydrogen 2.878 N/A LEU 273.A N LEU 208.A O no hydrogen 2.980 N/A THR 274.A N ILE 296.A O no hydrogen 2.990 N/A THR 274.A OG1 THR 298.A O no hydrogen 2.900 N/A THR 275.A N THR 278.A OG1 no hydrogen 3.041 N/A THR 275.A OG1 ARG 211.A O no hydrogen 2.421 N/A ASN 276.A ND2 LYS 299.A O no hydrogen 2.697 N/A ALA 277.A N THR 275.A OG1 no hydrogen 3.124 N/A THR 278.A N THR 275.A O no hydrogen 2.991 N/A THR 278.A OG1 LEU 210.A O no hydrogen 2.830 N/A THR 278.A OG1 THR 275.A O no hydrogen 3.188 N/A ARG 279.A N ASN 213.A O no hydrogen 2.967 N/A ARG 279.A NH1 GLU 303.A OE1 no hydrogen 2.803 N/A GLY 280.A N GLU 283.A OE1 no hydrogen 2.798 N/A ALA 282.A N ARG 279.A O no hydrogen 3.144 N/A ASN 286.A N GLU 283.A O no hydrogen 2.875 N/A ASN 286.A ND2 LYS 332.A O no hydrogen 2.902 N/A CYS 287.A SG LEU 236.A O no hydrogen 3.251 N/A LEU 288.A N VAL 284.A O no hydrogen 3.005 N/A ASN 289.A N ILE 285.A O no hydrogen 3.066 N/A TYR 291.A N LEU 288.A O no hydrogen 2.918 N/A TYR 291.A OH LEU 235.A O no hydrogen 2.623 N/A LYS 292.A N SER 268.A O no hydrogen 3.021 N/A VAL 294.A N VAL 270.A O no hydrogen 2.881 N/A LEU 295.A N THR 342.A OG1 no hydrogen 3.000 N/A ILE 296.A N VAL 272.A O no hydrogen 3.006 N/A GLY 297.A N TYR 343.A O no hydrogen 3.169 N/A THR 298.A N THR 274.A O no hydrogen 3.024 N/A LYS 299.A NZ THR 337.A O no hydrogen 3.139 N/A LYS 299.A NZ THR 337.A OG1 no hydrogen 2.768 N/A THR 300.A N PHE 339.A O no hydrogen 3.163 N/A THR 300.A OG1 GLU 283.A OE2 no hydrogen 2.701 N/A ALA 301.A N THR 278.A O no hydrogen 2.964 N/A GLY 302.A N GLU 283.A OE2 no hydrogen 2.695 N/A GLU 303.A N GLU 283.A OE1 no hydrogen 2.950 N/A ALA 306.A N CYS 324.A O no hydrogen 2.915 N/A LYS 308.A N.A LEU 321.A O no hydrogen 2.921 N/A LYS 308.A N.B LEU 321.A O no hydrogen 2.911 N/A LYS 308.A NZ.A TYR 241.A OH no hydrogen 3.238 N/A LYS 308.A NZ.B PRO 309.A O no hydrogen 3.270 N/A PHE 310.A N LEU 319.A O no hydrogen 2.805 N/A HIS 312.A N PHE 317.A O no hydrogen 3.005 N/A THR 314.A N HIS 312.A ND1 no hydrogen 3.008 N/A THR 314.A OG1 ASP 315.A OD1 no hydrogen 3.490 N/A ASP 315.A N HIS 312.A ND1 no hydrogen 2.902 N/A ILE 318.A N ASP 53.A O no hydrogen 2.678 N/A LEU 319.A N PHE 310.A O no hydrogen 2.784 N/A ASN 320.A N LYS 51.A O no hydrogen 2.862 N/A LEU 321.A N LYS 308.A O.A no hydrogen 2.938 N/A LEU 321.A N LYS 308.A O.B no hydrogen 3.060 N/A VAL 322.A N SER 50.A OG no hydrogen 3.130 N/A VAL 323.A N ALA 306.A O no hydrogen 2.945 N/A CYS 324.A N ALA 306.A O no hydrogen 3.496 N/A CYS 324.A SG ASN 325.A O no hydrogen 3.651 N/A ASN 325.A N ARG 240.A O no hydrogen 2.836 N/A TYR 327.A N LEU 238.A O no hydrogen 2.950 N/A ASN 328.A N LYS 332.A O no hydrogen 2.844 N/A ASN 328.A ND2 ASN 286.A O no hydrogen 3.070 N/A GLU 330.A N ASN 328.A OD1 no hydrogen 2.896 N/A GLU 331.A N ASN 328.A O no hydrogen 2.930 N/A LYS 332.A N ASN 328.A OD1 no hydrogen 3.067 N/A SER 333.A N ASP 334.A OD1.A no hydrogen 2.891 N/A TYR 335.A N SER 333.A O no hydrogen 3.062 N/A THR 337.A OG1 ALA 336.A O no hydrogen 2.779 N/A GLY 338.A N TYR 335.A O no hydrogen 2.841 N/A PHE 339.A N THR 300.A OG1 no hydrogen 2.673 N/A THR 342.A N LEU 295.A O no hydrogen 2.767 N/A THR 342.A OG1 LEU 295.A O no hydrogen 3.368 N/A TYR 343.A N LEU 295.A O no hydrogen 3.106 N/A TYR 345.A N GLY 297.A O no hydrogen 2.908 N/A ASP 348.A N ASN 346.A OD1 no hydrogen 3.073 N/A SER 349.A N.A ASN 346.A O no hydrogen 2.989 N/A SER 349.A N.B ASN 346.A O no hydrogen 2.990 N/A TYR 350.A N GLU 347.A O no hydrogen 3.329 N/A THR 353.A N TYR 350.A O no hydrogen 3.163 N/A THR 353.A OG1 TYR 350.A O no hydrogen 3.497 N/A THR 353.A OG1 THR 363.A OG1 no hydrogen 2.650 N/A TYR 354.A N LEU 351.A O no hydrogen 3.191 N/A ASN 359.A N PRO 356.A O no hydrogen 3.152 N/A ASN 361.A N ASN 359.A OD1 no hydrogen 2.958 N/A GLU 362.A N ASN 359.A O no hydrogen 2.918 N/A THR 363.A N THR 353.A O no hydrogen 3.174 N/A THR 363.A OG1 THR 353.A O no hydrogen 3.179 N/A THR 363.A OG1 THR 353.A OG1 no hydrogen 2.650 N/A LEU 364.A N GLU 362.A OE2 no hydrogen 2.997 N/A LEU 365.A N GLU 362.A OE1 no hydrogen 2.990 N/A ASN 366.A N GLU 362.A O no hydrogen 2.757 N/A ASN 366.A ND2 THR 360.A O no hydrogen 2.864 N/A ALA 367.A N THR 363.A O no hydrogen 2.977 N/A ALA 368.A N LEU 364.A O no hydrogen 3.223 N/A LEU 369.A N LEU 365.A O no hydrogen 3.007 N/A LYS 370.A N ASN 366.A O no hydrogen 2.948 N/A ILE 371.A N ALA 367.A O no hydrogen 2.827 N/A SER 372.A OG LEU 369.A O no hydrogen 3.096 N/A GLY 373.A N ILE 371.A O no hydrogen 3.131 N/A ILE 374.A N LYS 370.A O no hydrogen 2.934 N/A THR 375.A N LYS 370.A O no hydrogen 3.515 N/A