Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e80_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A NE2 HIS 223.A ND1 no hydrogen 2.806 N/A THR 5.A N HIS 1.A O no hydrogen 2.963 N/A THR 5.A OG1 HIS 1.A O no hydrogen 2.593 N/A THR 5.A OG1 SER 217.A OG no hydrogen 3.255 N/A LYS 6.A N LYS 2.A O no hydrogen 3.072 N/A PHE 7.A N GLU 3.A O no hydrogen 3.096 N/A CYS 8.A N PHE 4.A O no hydrogen 2.823 N/A CYS 8.A SG PHE 4.A O no hydrogen 3.283 N/A TYR 9.A N THR 5.A O no hydrogen 3.005 N/A GLU 10.A N LYS 6.A O no hydrogen 3.108 N/A VAL 11.A N PHE 7.A O no hydrogen 2.939 N/A TYR 12.A N CYS 8.A O no hydrogen 2.827 N/A ASN 13.A N TYR 9.A O no hydrogen 2.995 N/A ASN 13.A ND2 TYR 9.A O no hydrogen 2.696 N/A GLU 14.A N VAL 11.A O no hydrogen 2.881 N/A ILE 15.A N VAL 11.A O no hydrogen 3.008 N/A LYS 16.A N TYR 12.A O no hydrogen 3.085 N/A ILE 17.A N ALA 56.A O no hydrogen 3.241 N/A GLU 21.A N SER 18.A OG no hydrogen 3.372 N/A PHE 22.A N SER 18.A O no hydrogen 2.995 N/A LYS 23.A N ASP 19.A O no hydrogen 2.980 N/A GLU 24.A N LYS 20.A O no hydrogen 3.002 N/A LYS 25.A N GLU 21.A O no hydrogen 3.137 N/A LYS 25.A NZ SER 60.A O no hydrogen 2.785 N/A ARG 26.A N PHE 22.A O no hydrogen 2.945 N/A ALA 27.A N LYS 23.A O no hydrogen 2.898 N/A ALA 28.A N GLU 24.A O no hydrogen 3.058 N/A LEU 29.A N LYS 25.A O no hydrogen 3.027 N/A ASP 30.A N ARG 26.A O no hydrogen 3.202 N/A THR 31.A N ALA 27.A O no hydrogen 3.253 N/A THR 31.A OG1 ALA 27.A O no hydrogen 2.944 N/A LEU 32.A N ALA 28.A O no hydrogen 3.083 N/A ARG 33.A N LEU 29.A O no hydrogen 2.825 N/A LEU 34.A N ASP 30.A O no hydrogen 3.132 N/A LEU 34.A N THR 31.A O no hydrogen 3.228 N/A CYS 35.A N THR 31.A O no hydrogen 3.300 N/A CYS 35.A SG THR 31.A O no hydrogen 3.626 N/A LEU 36.A N LEU 32.A O no hydrogen 3.211 N/A LYS 37.A N ARG 33.A O no hydrogen 3.102 N/A ARG 38.A N LEU 34.A O no hydrogen 3.139 N/A ARG 38.A NH1 GLU 79.A OE2 no hydrogen 3.251 N/A ARG 38.A NH1 GLU 83.A OE1 no hydrogen 2.887 N/A ILE 39.A N LEU 36.A O no hydrogen 2.841 N/A SER 40.A N LEU 36.A O no hydrogen 2.675 N/A GLU 44.A N LEU 67.A O no hydrogen 3.176 N/A VAL 46.A N CYS 65.A O no hydrogen 2.798 N/A PHE 48.A N ASP 63.A O no hydrogen 3.056 N/A GLY 49.A N THR 122.A OG1 no hydrogen 3.213 N/A SER 50.A OG LEU 55.A O no hydrogen 3.076 N/A SER 53.A N GLY 49.A O no hydrogen 3.147 N/A SER 53.A OG GLY 49.A O no hydrogen 3.348 N/A SER 53.A OG SER 50.A O no hydrogen 3.374 N/A LEU 55.A N SER 50.A O no hydrogen 2.891 N/A LYS 58.A N ILE 15.A O no hydrogen 2.830 N/A LYS 58.A NZ GLU 14.A O no hydrogen 3.091 N/A ASN 59.A N GLU 21.A OE1 no hydrogen 3.015 N/A ASN 59.A N GLU 21.A OE2 no hydrogen 2.912 N/A SER 60.A N GLU 21.A OE2 no hydrogen 3.385 N/A SER 60.A OG ASP 61.A O no hydrogen 3.521 N/A LEU 64.A N ASP 110.A O no hydrogen 2.880 N/A CYS 65.A N VAL 46.A O no hydrogen 2.801 N/A VAL 66.A N GLY 112.A O no hydrogen 2.924 N/A LEU 67.A N GLU 44.A O no hydrogen 2.772 N/A MET 68.A N ASN 114.A OD1 no hydrogen 2.817 N/A THR 71.A OG1 GLN 75.A OE1 no hydrogen 3.397 N/A GLN 75.A N THR 71.A O no hydrogen 3.328 N/A PHE 76.A N ILE 72.A O no hydrogen 2.727 N/A TYR 77.A N ALA 73.A O no hydrogen 3.207 N/A TYR 77.A OH GLY 87.A O no hydrogen 2.575 N/A GLU 78.A N LEU 74.A O no hydrogen 3.041 N/A GLU 79.A N GLN 75.A O no hydrogen 3.078 N/A LEU 80.A N PHE 76.A O no hydrogen 3.047 N/A ILE 81.A N TYR 77.A O no hydrogen 3.086 N/A ALA 82.A N GLU 78.A O no hydrogen 3.121 N/A GLU 83.A N GLU 79.A O no hydrogen 2.908 N/A GLY 84.A N LEU 80.A O no hydrogen 3.196 N/A GLY 84.A N ILE 81.A O no hydrogen 3.246 N/A PHE 85.A N LEU 80.A O no hydrogen 2.988 N/A LYS 88.A N LYS 99.A O no hydrogen 2.982 N/A LEU 90.A N ILE 97.A O no hydrogen 2.889 N/A GLN 91.A NE2 ALA 93.A O no hydrogen 3.141 N/A ARG 92.A N ILE 95.A O no hydrogen 3.326 N/A ILE 95.A N ARG 92.A O no hydrogen 3.001 N/A ILE 97.A N LEU 90.A O no hydrogen 2.758 N/A ILE 98.A N ILE 111.A O no hydrogen 2.930 N/A LYS 99.A N LYS 88.A O no hydrogen 2.959 N/A LEU 100.A N CYS 109.A O no hydrogen 2.802 N/A THR 101.A N GLU 86.A O no hydrogen 2.714 N/A THR 101.A OG1 GLU 86.A O no hydrogen 3.187 N/A SER 102.A N GLU 86.A O no hydrogen 3.383 N/A GLN 108.A NE2 ASP 61.A OD2 no hydrogen 2.846 N/A CYS 109.A N LEU 100.A O no hydrogen 3.292 N/A ASP 110.A N MET 62.A O no hydrogen 3.023 N/A ILE 111.A N ILE 98.A O no hydrogen 2.756 N/A GLY 112.A N LEU 64.A O no hydrogen 2.845 N/A ASN 114.A N VAL 66.A O no hydrogen 3.185 N/A ILE 119.A N ASN 115.A O no hydrogen 3.382 N/A HIS 120.A N ARG 116.A O no hydrogen 3.097 N/A ASN 121.A N LEU 117.A O no hydrogen 2.938 N/A THR 122.A N ALA 118.A O no hydrogen 3.018 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.729 N/A LEU 123.A N ILE 119.A O no hydrogen 2.998 N/A LEU 124.A N HIS 120.A O no hydrogen 3.146 N/A LEU 125.A N ASN 121.A O no hydrogen 3.032 N/A SER 126.A N THR 122.A O no hydrogen 3.045 N/A SER 126.A OG THR 122.A O no hydrogen 2.603 N/A SER 127.A N LEU 123.A O no hydrogen 3.049 N/A SER 127.A OG LEU 123.A O no hydrogen 2.878 N/A TYR 128.A N LEU 124.A O no hydrogen 3.178 N/A TYR 128.A OH PRO 182.A O no hydrogen 2.739 N/A THR 129.A N LEU 125.A O no hydrogen 3.082 N/A THR 129.A OG1 SER 53.A O no hydrogen 3.555 N/A THR 129.A OG1 LEU 125.A O no hydrogen 2.879 N/A LYS 130.A N SER 126.A O no hydrogen 3.174 N/A LEU 131.A N SER 127.A O no hydrogen 3.004 N/A LEU 131.A N TYR 128.A O no hydrogen 2.954 N/A ASP 132.A N TYR 128.A O no hydrogen 3.218 N/A ARG 134.A N ASP 132.A OD2 no hydrogen 2.956 N/A ARG 134.A NE ASP 132.A OD2 no hydrogen 2.887 N/A ARG 134.A NH1 ASN 214.A O no hydrogen 3.390 N/A ARG 134.A NH1 ASN 214.A OD1 no hydrogen 3.266 N/A ARG 134.A NH1 SER 216.A O no hydrogen 2.807 N/A ARG 134.A NH2 ASP 132.A OD1 no hydrogen 2.838 N/A ARG 134.A NH2 ASN 214.A O no hydrogen 3.005 N/A LEU 135.A N ASP 132.A O no hydrogen 3.360 N/A LYS 136.A NZ TYR 12.A OH no hydrogen 3.383 N/A MET 138.A N ARG 134.A O no hydrogen 3.165 N/A VAL 139.A N LEU 135.A O no hydrogen 2.800 N/A LEU 140.A N LYS 136.A O no hydrogen 3.063 N/A LEU 141.A N PRO 137.A O no hydrogen 3.062 N/A VAL 142.A N MET 138.A O no hydrogen 3.075 N/A LYS 143.A N VAL 139.A O no hydrogen 2.938 N/A LYS 143.A NZ SER 50.A OG no hydrogen 2.684 N/A LYS 143.A NZ LEU 55.A O no hydrogen 2.724 N/A HIS 144.A N LEU 140.A O no hydrogen 2.851 N/A TRP 145.A N LEU 141.A O no hydrogen 2.876 N/A ALA 146.A N VAL 142.A O no hydrogen 2.805 N/A LYS 147.A N LYS 143.A O no hydrogen 2.971 N/A LYS 147.A NZ ASN 152.A OD1 no hydrogen 3.164 N/A LYS 147.A NZ SER 161.A OG no hydrogen 3.251 N/A ARG 148.A N HIS 144.A O no hydrogen 3.015 N/A ARG 148.A NH1 PHE 312.A O no hydrogen 3.099 N/A LYS 149.A N TRP 145.A O no hydrogen 2.867 N/A LYS 149.A NZ SER 310.A O no hydrogen 2.907 N/A LYS 149.A NZ GLU 313.A O no hydrogen 2.812 N/A GLN 150.A N LYS 147.A O no hydrogen 3.196 N/A ILE 151.A N ALA 146.A O no hydrogen 3.046 N/A ASN 152.A ND2 LEU 159.A O no hydrogen 3.110 N/A ASN 152.A ND2 SER 161.A OG no hydrogen 3.127 N/A SER 153.A N THR 158.A OG1 no hydrogen 2.760 N/A PHE 156.A N SER 153.A O no hydrogen 3.018 N/A THR 158.A N SER 153.A O no hydrogen 3.013 N/A THR 158.A OG1 SER 153.A O no hydrogen 3.096 N/A SER 161.A OG ASN 152.A OD1 no hydrogen 2.986 N/A TYR 162.A OH ASP 268.A OD2 no hydrogen 2.783 N/A GLY 163.A N SER 160.A OG no hydrogen 3.194 N/A TYR 164.A N SER 160.A O no hydrogen 3.246 N/A TYR 164.A OH ILE 151.A O no hydrogen 2.635 N/A VAL 165.A N SER 161.A O no hydrogen 2.999 N/A LEU 166.A N TYR 162.A O no hydrogen 3.048 N/A MET 167.A N GLY 163.A O no hydrogen 2.993 N/A VAL 168.A N TYR 164.A O no hydrogen 2.923 N/A LEU 169.A N VAL 165.A O no hydrogen 2.918 N/A TYR 170.A N LEU 166.A O no hydrogen 2.852 N/A TYR 170.A OH GLY 247.A O no hydrogen 2.668 N/A TYR 171.A N MET 167.A O no hydrogen 3.243 N/A LEU 172.A N VAL 168.A O no hydrogen 2.992 N/A ILE 173.A N LEU 169.A O no hydrogen 2.989 N/A HIS 174.A N TYR 170.A O no hydrogen 2.861 N/A VAL 175.A N TYR 171.A O no hydrogen 3.067 N/A ILE 176.A N TYR 171.A O no hydrogen 2.919 N/A LYS 177.A NZ ILE 176.A O no hydrogen 3.113 N/A VAL 180.A N LEU 172.A O no hydrogen 2.989 N/A PHE 181.A N LEU 172.A O no hydrogen 3.398 N/A ASN 183.A ND2 HIS 174.A NE2 no hydrogen 2.896 N/A ASN 183.A ND2 PHE 242.A O no hydrogen 2.840 N/A LEU 184.A N TYR 128.A OH no hydrogen 2.969 N/A LEU 186.A N ASN 183.A O no hydrogen 3.200 N/A LEU 186.A N ASN 183.A OD1 no hydrogen 3.061 N/A LEU 189.A N SER 187.A OG no hydrogen 3.163 N/A LYS 190.A N SER 187.A O no hydrogen 3.133 N/A LYS 190.A NZ ASP 199.A OD2 no hydrogen 2.740 N/A LYS 193.A N ASP 199.A OD1 no hydrogen 3.083 N/A VAL 195.A N PHE 198.A O no hydrogen 2.881 N/A PHE 198.A N VAL 195.A O no hydrogen 3.097 N/A VAL 200.A N LYS 193.A O no hydrogen 2.816 N/A GLY 201.A N ASP 199.A OD1 no hydrogen 3.194 N/A ASP 203.A N LEU 184.A O no hydrogen 2.977 N/A LYS 205.A N ASP 203.A OD1 no hydrogen 3.369 N/A LEU 206.A N ASP 204.A O no hydrogen 2.876 N/A ASP 208.A N LYS 205.A O no hydrogen 3.377 N/A ILE 209.A N LEU 206.A O no hydrogen 3.158 N/A SER 212.A OG PRO 179.A O no hydrogen 3.326 N/A SER 212.A OG VAL 180.A O no hydrogen 2.930 N/A SER 212.A OG ASN 214.A O no hydrogen 3.566 N/A ASN 214.A N SER 212.A OG no hydrogen 3.210 N/A ASN 214.A ND2 PRO 178.A O no hydrogen 2.773 N/A SER 216.A N ASN 214.A OD1 no hydrogen 3.009 N/A SER 216.A OG ASN 214.A OD1 no hydrogen 3.043 N/A SER 217.A OG THR 5.A OG1 no hydrogen 3.255 N/A GLY 219.A N THR 5.A OG1 no hydrogen 3.210 N/A SER 220.A N SER 217.A OG no hydrogen 3.145 N/A LEU 221.A N SER 217.A O no hydrogen 2.943 N/A LEU 222.A N LEU 218.A O no hydrogen 2.969 N/A HIS 223.A N GLY 219.A O no hydrogen 3.118 N/A HIS 223.A ND1 HIS 1.A NE2 no hydrogen 2.806 N/A GLY 224.A N SER 220.A O no hydrogen 3.108 N/A PHE 225.A N LEU 221.A O no hydrogen 3.106 N/A PHE 226.A N LEU 222.A O no hydrogen 3.121 N/A ARG 227.A N HIS 223.A O no hydrogen 3.044 N/A PHE 228.A N GLY 224.A O no hydrogen 2.853 N/A TYR 229.A N PHE 225.A O no hydrogen 3.201 N/A TYR 229.A OH MET 167.A O no hydrogen 2.671 N/A ALA 230.A N PHE 226.A O no hydrogen 2.921 N/A TYR 231.A N ARG 227.A O no hydrogen 3.069 N/A LYS 232.A N PHE 228.A O no hydrogen 2.946 N/A PHE 233.A N PHE 228.A O no hydrogen 2.852 N/A ARG 236.A N GLU 234.A OE1 no hydrogen 2.841 N/A ARG 236.A NE GLU 234.A OE1 no hydrogen 2.975 N/A ARG 236.A NH2 GLU 234.A OE2 no hydrogen 3.086 N/A GLU 237.A N GLU 234.A O no hydrogen 3.167 N/A LYS 238.A N GLU 234.A O no hydrogen 3.016 N/A VAL 239.A N LEU 249.A O no hydrogen 2.915 N/A VAL 240.A N ALA 265.A O no hydrogen 2.869 N/A THR 241.A OG1 GLU 267.A OE1 no hydrogen 3.072 N/A ARG 243.A N THR 241.A OG1 no hydrogen 3.053 N/A ARG 243.A NH2 ASP 199.A O no hydrogen 3.384 N/A ARG 244.A NE GLU 253.A OE2 no hydrogen 3.192 N/A ARG 244.A NH1 ARG 243.A O no hydrogen 3.375 N/A ARG 244.A NH2 GLU 253.A OE2 no hydrogen 2.821 N/A GLY 247.A N ARG 244.A O no hydrogen 3.109 N/A TYR 248.A N ASP 246.A OD2 no hydrogen 2.974 N/A LYS 251.A N GLU 237.A O no hydrogen 2.892 N/A LYS 251.A NZ PRO 235.A O no hydrogen 2.636 N/A LYS 251.A NZ TYR 262.A O no hydrogen 2.654 N/A LYS 251.A NZ ILE 263.A O no hydrogen 3.533 N/A GLU 253.A N THR 250.A OG1 no hydrogen 3.123 N/A LYS 254.A N THR 250.A O no hydrogen 3.144 N/A LYS 254.A NZ GLU 267.A OE2 no hydrogen 2.969 N/A LYS 254.A NZ ILE 272.A O no hydrogen 2.730 N/A GLY 255.A N LYS 251.A O no hydrogen 2.721 N/A GLY 255.A N GLN 252.A O no hydrogen 3.219 N/A TRP 256.A N LYS 251.A O no hydrogen 2.857 N/A ILE 266.A N ASN 275.A OD1 no hydrogen 2.915 N/A GLU 267.A N VAL 240.A O no hydrogen 2.975 N/A ASP 268.A N HIS 274.A O no hydrogen 3.361 N/A PHE 270.A N ASP 268.A OD1 no hydrogen 2.985 N/A GLU 271.A N ASP 268.A OD1 no hydrogen 2.818 N/A ILE 272.A N PHE 270.A O no hydrogen 2.850 N/A HIS 274.A N GLU 271.A O no hydrogen 2.931 N/A ASN 275.A ND2 ARG 261.A O no hydrogen 3.095 N/A ASN 275.A ND2 LEU 264.A O no hydrogen 3.273 N/A VAL 276.A N ILE 266.A O no hydrogen 2.710 N/A GLY 277.A N ASN 275.A OD1 no hydrogen 2.899 N/A ARG 278.A N ASN 275.A O no hydrogen 3.061 N/A THR 279.A OG1 THR 158.A O no hydrogen 2.873 N/A VAL 280.A N GLY 277.A O no hydrogen 3.169 N/A SER 281.A N GLY 157A.A O no hydrogen 2.952 N/A SER 281.A OG SER 283.A OG no hydrogen 3.312 N/A SER 281.A OG GLY 157A.A O no hydrogen 3.411 N/A SER 283.A OG SER 281.A OG no hydrogen 3.312 N/A GLY 284.A N SER 281.A OG no hydrogen 3.033 N/A LEU 285.A N SER 281.A O no hydrogen 2.887 N/A TYR 286.A N SER 282.A O no hydrogen 3.081 N/A ARG 287.A N SER 283.A O no hydrogen 3.091 N/A ARG 287.A NH1 LYS 149.A O no hydrogen 3.277 N/A ARG 287.A NH1 GLN 150.A O no hydrogen 2.833 N/A ARG 287.A NH2 LYS 149.A O no hydrogen 3.006 N/A ILE 288.A N GLY 284.A O no hydrogen 2.997 N/A ARG 289.A N LEU 285.A O no hydrogen 2.910 N/A ARG 289.A NH1 ALA 230.A O no hydrogen 2.955 N/A ARG 289.A NH2 PHE 233.A O no hydrogen 2.657 N/A GLY 290.A N TYR 286.A O no hydrogen 3.212 N/A GLU 291.A N ARG 287.A O no hydrogen 3.049 N/A PHE 292.A N ILE 288.A O no hydrogen 2.979 N/A MET 293.A N ARG 289.A O no hydrogen 2.921 N/A ALA 294.A N GLY 290.A O no hydrogen 3.004 N/A ALA 295.A N GLU 291.A O no hydrogen 3.078 N/A SER 296.A N PHE 292.A O no hydrogen 3.009 N/A SER 296.A OG PHE 292.A O no hydrogen 3.168 N/A ARG 297.A N MET 293.A O no hydrogen 2.896 N/A LEU 298.A N ALA 294.A O no hydrogen 3.022 N/A LEU 299.A N ALA 295.A O no hydrogen 3.082 N/A ASN 300.A N SER 296.A O no hydrogen 3.160 N/A ASN 300.A ND2 SER 296.A O no hydrogen 2.739 N/A SER 301.A N LEU 298.A O no hydrogen 3.320 N/A SER 301.A OG SER 303.A O no hydrogen 3.473 N/A SER 303.A N SER 301.A OG no hydrogen 3.200 N/A TYR 308.A N ILE 306.A O no hydrogen 2.803 N/A SER 310.A N PRO 307.A O no hydrogen 3.137 N/A SER 310.A OG PRO 307.A O no hydrogen 3.203 N/A SER 310.A OG GLU 313.A OE1 no hydrogen 3.444 N/A LEU 311.A N TYR 308.A O no hydrogen 2.995 N/A PHE 312.A N ASP 309.A O no hydrogen 3.034 N/A GLU 313.A N SER 310.A O no hydrogen 3.196 N/A ALA 315.A N ARG 148.A O no hydrogen 2.885 N/A GLY 157A.A N PRO 154.A O no hydrogen 3.434 N/A