Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5i5z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 8.A N ASP 5.A OD2 no hydrogen 2.993 N/A LYS 9.A N ASP 5.A O no hydrogen 2.918 N/A VAL 10.A N TYR 6.A O no hydrogen 2.898 N/A LYS 11.A N ASP 7.A O no hydrogen 3.069 N/A LYS 11.A NZ GLU 15.A OE2 no hydrogen 2.770 N/A LEU 12.A N PHE 8.A O no hydrogen 3.225 N/A SER 13.A N LYS 9.A O no hydrogen 3.130 N/A SER 14.A N VAL 10.A O no hydrogen 2.793 N/A GLU 15.A N LYS 11.A O no hydrogen 3.069 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.733 N/A ASP 21.A N ARG 18.A O no hydrogen 3.133 N/A LEU 22.A N ARG 18.A O no hydrogen 3.275 N/A LEU 22.A N VAL 19.A O no hydrogen 3.102 N/A PHE 23.A N VAL 19.A O no hydrogen 3.106 N/A GLU 24.A N LYS 42.A O no hydrogen 2.819 N/A CYS 28.A N TYR 25.A O no hydrogen 3.093 N/A CYS 28.A SG GLU 26.A O no hydrogen 3.373 N/A LYS 29.A NZ HIS 37.A ND1 no hydrogen 3.092 N/A LYS 29.A NZ GLU 344.A OE1 no hydrogen 2.641 N/A VAL 30.A N VAL 38.A O no hydrogen 2.721 N/A GLY 31.A N VAL 38.A O no hydrogen 3.105 N/A ARG 32.A NH1 GLY 36.A O no hydrogen 3.147 N/A GLY 33.A N GLY 36.A O no hydrogen 3.123 N/A GLY 36.A N GLY 33.A O no hydrogen 3.059 N/A HIS 37.A N GLN 56.A O no hydrogen 2.938 N/A VAL 38.A N GLY 31.A O no hydrogen 2.838 N/A TYR 39.A N LEU 54.A O no hydrogen 2.950 N/A LYS 40.A N CYS 28.A O no hydrogen 2.905 N/A ALA 41.A N TYR 52.A O no hydrogen 2.753 N/A LYS 42.A N GLU 24.A O no hydrogen 3.047 N/A LYS 42.A NZ ASP 51.A OD1 no hydrogen 3.032 N/A ARG 43.A NE ASP 45.A O no hydrogen 3.040 N/A ARG 43.A NH2 ASP 45.A OD2 no hydrogen 3.555 N/A LYS 44.A N LEU 22.A O no hydrogen 2.844 N/A LYS 44.A NZ GLU 20.A O no hydrogen 2.656 N/A LYS 44.A NZ PHE 23.A O no hydrogen 3.298 N/A LYS 47.A N ASP 45.A O no hydrogen 2.891 N/A LYS 50.A NZ ASP 48.A OD2 no hydrogen 2.775 N/A TYR 52.A N ALA 41.A O no hydrogen 2.759 N/A TYR 52.A OH ASP 48.A OD1 no hydrogen 3.427 N/A TYR 52.A OH ASP 48.A OD2 no hydrogen 2.657 N/A ALA 53.A N PHE 100.A O no hydrogen 2.763 N/A LEU 54.A N TYR 39.A O no hydrogen 2.869 N/A LYS 55.A N LEU 98.A O no hydrogen 2.932 N/A LYS 55.A NZ GLU 69.A OE2 no hydrogen 2.902 N/A GLN 56.A N HIS 37.A O no hydrogen 2.846 N/A ILE 57.A N VAL 96.A O no hydrogen 3.063 N/A GLU 58.A N TYR 35.A O no hydrogen 3.161 N/A GLY 61.A N ARG 94.A O no hydrogen 3.016 N/A CYS 67.A N SER 63.A O no hydrogen 2.825 N/A ARG 68.A N MET 64.A O no hydrogen 2.993 N/A GLU 69.A N SER 65.A O no hydrogen 3.055 N/A ILE 70.A N ALA 66.A O no hydrogen 2.893 N/A ALA 71.A N CYS 67.A O no hydrogen 2.743 N/A LEU 72.A N ARG 68.A O no hydrogen 3.021 N/A LEU 73.A N GLU 69.A O no hydrogen 3.072 N/A ARG 74.A N ILE 70.A O no hydrogen 3.024 N/A ARG 74.A NH1 ARG 74.A O no hydrogen 3.539 N/A GLU 75.A N LEU 72.A O no hydrogen 2.942 N/A LEU 76.A N LEU 72.A O no hydrogen 2.925 N/A LYS 77.A N TYR 139.A OH no hydrogen 3.007 N/A ASN 80.A N HIS 78.A ND1 no hydrogen 3.119 N/A ASN 80.A ND2 GLN 132.A OE1 no hydrogen 3.294 N/A ASN 80.A ND2 VAL 167.A O no hydrogen 3.042 N/A VAL 81.A N HIS 78.A O no hydrogen 3.226 N/A ILE 82.A N ILE 169.A O no hydrogen 2.887 N/A GLN 85.A N LEU 99.A O no hydrogen 2.717 N/A LYS 86.A NZ GLU 17.A OE1 no hydrogen 3.347 N/A LYS 86.A NZ GLU 17.A OE2 no hydrogen 2.894 N/A PHE 88.A N TRP 97.A O no hydrogen 2.912 N/A SER 90.A N LYS 95.A O no hydrogen 3.044 N/A SER 90.A OG ASP 93.A OD1 no hydrogen 2.419 N/A LYS 95.A N SER 90.A O no hydrogen 3.267 N/A LYS 95.A NZ GLY 59.A O no hydrogen 3.066 N/A TRP 97.A N PHE 88.A O no hydrogen 2.875 N/A LEU 98.A N LYS 55.A O no hydrogen 2.843 N/A LEU 99.A N LYS 86.A O no hydrogen 2.881 N/A PHE 100.A N ALA 53.A O no hydrogen 2.884 N/A TYR 102.A N ASP 51.A O no hydrogen 3.271 N/A TYR 102.A OH GLU 104.A OE2 no hydrogen 2.806 N/A HIS 105.A N VAL 157.A O no hydrogen 3.067 N/A LEU 107.A N ILE 155.A O no hydrogen 3.101 N/A HIS 109.A N ASP 106.A OD1 no hydrogen 2.966 N/A HIS 109.A ND1 ASP 106.A OD1 no hydrogen 2.942 N/A HIS 109.A ND1 ASP 106.A OD2 no hydrogen 3.113 N/A ILE 110.A N ASP 106.A O no hydrogen 2.931 N/A ILE 111.A N LEU 107.A O no hydrogen 2.849 N/A LYS 112.A N TRP 108.A O no hydrogen 3.005 N/A PHE 113.A N HIS 109.A O no hydrogen 3.005 N/A PHE 113.A N ILE 110.A O no hydrogen 3.069 N/A HIS 114.A N ILE 110.A O no hydrogen 3.291 N/A ARG 115.A N ILE 111.A O no hydrogen 2.998 N/A ALA 116.A N LYS 112.A O no hydrogen 3.165 N/A SER 117.A N PHE 113.A O no hydrogen 3.055 N/A SER 117.A OG PHE 113.A O no hydrogen 3.010 N/A SER 117.A OG HIS 114.A O no hydrogen 2.976 N/A LYS 118.A N HIS 114.A O no hydrogen 2.846 N/A ALA 119.A N ARG 115.A O no hydrogen 3.366 N/A ASN 120.A N SER 117.A O no hydrogen 2.902 N/A ARG 123.A NH2 ASP 321.A OD2 no hydrogen 3.343 N/A MET 125.A N PRO 122.A O no hydrogen 3.261 N/A LYS 127.A NZ TYR 317.A O no hydrogen 2.822 N/A LYS 127.A NZ GLU 320.A O no hydrogen 2.825 N/A LYS 127.A NZ PRO 322.A O no hydrogen 2.807 N/A SER 128.A N GLY 124.A O no hydrogen 2.822 N/A SER 128.A OG GLY 124.A O no hydrogen 2.624 N/A SER 128.A OG THR 325.A O no hydrogen 3.487 N/A SER 128.A OG THR 325.A OG1 no hydrogen 3.331 N/A LEU 129.A N MET 125.A O no hydrogen 3.035 N/A LEU 130.A N VAL 126.A O no hydrogen 2.964 N/A TYR 131.A N LYS 127.A O no hydrogen 2.925 N/A GLN 132.A N SER 128.A O no hydrogen 2.973 N/A GLN 132.A NE2 THR 325.A O no hydrogen 2.982 N/A GLN 132.A NE2 SER 326.A O no hydrogen 2.886 N/A ILE 133.A N LEU 129.A O no hydrogen 2.971 N/A LEU 134.A N LEU 130.A O no hydrogen 2.953 N/A ASP 135.A N TYR 131.A O no hydrogen 2.809 N/A GLY 136.A N GLN 132.A O no hydrogen 3.007 N/A ILE 137.A N ILE 133.A O no hydrogen 2.950 N/A HIS 138.A N LEU 134.A O no hydrogen 3.096 N/A TYR 139.A N ASP 135.A O no hydrogen 3.154 N/A LEU 140.A N GLY 136.A O no hydrogen 3.278 N/A HIS 141.A N ILE 137.A O no hydrogen 2.853 N/A HIS 141.A NE2 ASP 204.A OD2 no hydrogen 2.970 N/A ALA 142.A N HIS 138.A O no hydrogen 2.936 N/A ASN 143.A N TYR 139.A O no hydrogen 3.357 N/A ASN 143.A N LEU 140.A O no hydrogen 2.902 N/A ASN 143.A ND2 TYR 139.A O no hydrogen 2.959 N/A TRP 144.A N HIS 141.A O no hydrogen 2.988 N/A VAL 145.A N LEU 140.A O no hydrogen 2.825 N/A HIS 147.A N ASP 204.A OD2 no hydrogen 2.786 N/A HIS 147.A NE2 ALA 170.A O no hydrogen 2.953 N/A ARG 148.A N ASP 204.A OD1 no hydrogen 3.029 N/A ARG 148.A NE ASN 179.A OD1 no hydrogen 3.063 N/A ASP 149.A N HIS 147.A ND1 no hydrogen 3.216 N/A LYS 151.A N ASN 154.A OD1 no hydrogen 3.165 N/A ASN 154.A N LYS 151.A O no hydrogen 3.192 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.668 N/A ILE 155.A N PRO 152.A O no hydrogen 3.158 N/A LEU 156.A N LYS 168.A O no hydrogen 2.962 N/A VAL 157.A N HIS 105.A O no hydrogen 2.737 N/A MET 158.A N ARG 166.A O no hydrogen 2.975 N/A ARG 164.A NE GLU 160.A OE1 no hydrogen 3.212 N/A ARG 164.A NE GLU 160.A OE2 no hydrogen 2.865 N/A ARG 164.A NH1 ASP 327.A OD2 no hydrogen 3.265 N/A ARG 164.A NH1 CYS 332.A O no hydrogen 3.390 N/A ARG 164.A NH2 CYS 332.A O no hydrogen 3.074 N/A GLY 165.A N MET 158.A O no hydrogen 3.093 N/A ARG 166.A N GLU 163.A O no hydrogen 3.196 N/A ARG 166.A NH1 GLU 163.A OE1 no hydrogen 3.264 N/A VAL 167.A N GLN 132.A OE1 no hydrogen 2.918 N/A LYS 168.A N LEU 156.A O no hydrogen 2.905 N/A LYS 168.A NZ PRO 79.A O no hydrogen 2.754 N/A LYS 168.A NZ GLU 163.A OE1 no hydrogen 2.686 N/A LYS 168.A NZ GLU 163.A OE2 no hydrogen 3.541 N/A ILE 169.A N ASN 80.A O no hydrogen 2.701 N/A ALA 170.A N ASN 154.A O no hydrogen 2.979 N/A GLY 173.A N HIS 147.A O no hydrogen 2.691 N/A PHE 174.A N MET 172.A O no hydrogen 2.614 N/A ARG 176.A NH1 ARG 148.A O no hydrogen 3.322 N/A ARG 176.A NH1 TYR 199.A OH no hydrogen 3.430 N/A ASN 179.A N ARG 176.A O no hydrogen 2.923 N/A ASN 179.A ND2 TYR 199.A O no hydrogen 3.324 N/A SER 180.A N LEU 177.A O no hydrogen 3.143 N/A SER 180.A OG ARG 197.A O no hydrogen 3.428 N/A LEU 182.A N SER 180.A OG no hydrogen 3.341 N/A TRP 186.A N THR 184.A OG1 no hydrogen 3.385 N/A TRP 186.A NE1 CYS 224.A O no hydrogen 3.144 N/A TYR 187.A OH GLU 214.A OE1 no hydrogen 2.738 N/A ARG 188.A N PHE 185.A O no hydrogen 3.294 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.750 N/A LEU 192.A N ALA 189.A O no hydrogen 2.898 N/A LEU 193.A N ALA 189.A O no hydrogen 3.429 N/A LEU 194.A N PRO 190.A O no hydrogen 2.911 N/A GLY 195.A N LEU 192.A O no hydrogen 3.191 N/A ALA 196.A N GLU 191.A O no hydrogen 3.026 N/A HIS 198.A ND1 ASN 179.A O no hydrogen 3.296 N/A TYR 199.A N ASN 179.A O no hydrogen 3.256 N/A LYS 201.A NZ HIS 141.A O no hydrogen 3.289 N/A ILE 203.A N THR 200.A OG1 no hydrogen 3.051 N/A ASP 204.A N THR 200.A O no hydrogen 3.470 N/A ILE 205.A N LYS 201.A O no hydrogen 3.190 N/A TRP 206.A N ALA 202.A O no hydrogen 3.136 N/A ILE 208.A N ASP 204.A O no hydrogen 3.248 N/A GLY 209.A N ILE 205.A O no hydrogen 2.993 N/A CYS 210.A N TRP 206.A O no hydrogen 2.938 N/A CYS 210.A SG TRP 186.A O no hydrogen 3.972 N/A CYS 210.A SG TRP 206.A O no hydrogen 3.453 N/A ILE 211.A N ALA 207.A O no hydrogen 2.997 N/A PHE 212.A N ILE 208.A O no hydrogen 2.855 N/A ALA 213.A N GLY 209.A O no hydrogen 2.992 N/A GLU 214.A N CYS 210.A O no hydrogen 3.114 N/A LEU 215.A N ILE 211.A O no hydrogen 2.943 N/A LEU 216.A N PHE 212.A O no hydrogen 3.223 N/A THR 217.A N ALA 213.A O no hydrogen 3.007 N/A THR 217.A OG1 ALA 213.A O no hydrogen 2.888 N/A THR 217.A OG1 GLU 219.A O no hydrogen 2.909 N/A SER 218.A N GLU 214.A O no hydrogen 2.725 N/A GLU 219.A N THR 217.A OG1 no hydrogen 3.111 N/A HIS 223.A N PRO 220.A O no hydrogen 3.010 N/A ASN 228.A ND2 TYR 230.A O no hydrogen 3.598 N/A TYR 230.A N ASN 228.A OD1 no hydrogen 3.378 N/A TYR 230.A OH ASP 265.A OD2 no hydrogen 3.173 N/A GLN 234.A NE2 PHE 222.A O no hydrogen 2.893 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 3.548 N/A LEU 235.A N HIS 231.A O no hydrogen 3.310 N/A ASP 236.A N HIS 232.A O no hydrogen 2.936 N/A ARG 237.A N ASP 233.A O no hydrogen 3.001 N/A ARG 237.A NE ILE 221.A O no hydrogen 3.301 N/A ARG 237.A NH2 ILE 221.A O no hydrogen 3.216 N/A ILE 238.A N GLN 234.A O no hydrogen 3.157 N/A PHE 239.A N LEU 235.A O no hydrogen 2.899 N/A ASN 240.A N ASP 236.A O no hydrogen 2.858 N/A VAL 241.A N ARG 237.A O no hydrogen 3.232 N/A MET 242.A N ILE 238.A O no hydrogen 2.729 N/A GLY 243.A N PHE 239.A O no hydrogen 2.895 N/A ALA 246.A N ASP 249.A OD2 no hydrogen 3.017 N/A TRP 250.A N ALA 246.A O no hydrogen 3.338 N/A TRP 250.A N ASP 247.A O no hydrogen 3.240 N/A ILE 253.A N TRP 250.A O no hydrogen 3.137 N/A LYS 255.A N ASP 252.A O no hydrogen 2.777 N/A LYS 255.A NZ ASP 252.A OD1 no hydrogen 3.472 N/A MET 256.A N ILE 253.A O no hydrogen 3.028 N/A GLU 258.A N LEU 194.A O no hydrogen 2.883 N/A THR 261.A OG1 GLU 258.A OE1 no hydrogen 2.826 N/A LEU 262.A N GLU 258.A O no hydrogen 2.988 N/A MET 263.A N HIS 259.A O no hydrogen 2.995 N/A LYS 264.A N SER 260.A O no hydrogen 3.038 N/A ASP 265.A N THR 261.A O no hydrogen 3.092 N/A ASP 265.A N LEU 262.A O no hydrogen 3.181 N/A PHE 266.A N LEU 262.A O no hydrogen 2.817 N/A ARG 268.A NH2 PRO 245.A O no hydrogen 3.325 N/A THR 270.A N ARG 267.A O no hydrogen 3.244 N/A THR 270.A OG1 ARG 267.A O no hydrogen 2.975 N/A TYR 271.A N ARG 268.A O no hydrogen 3.059 N/A TYR 271.A OH ASP 236.A OD1 no hydrogen 2.761 N/A THR 272.A N ASN 269.A O no hydrogen 3.420 N/A THR 272.A OG1 ASN 269.A O no hydrogen 2.935 N/A CYS 274.A N TYR 271.A O no hydrogen 2.989 N/A CYS 274.A SG ASN 240.A O no hydrogen 3.507 N/A LYS 278.A N SER 275.A OG no hydrogen 3.283 N/A LYS 278.A NZ ASN 273.A O no hydrogen 3.040 N/A TYR 279.A N SER 275.A O no hydrogen 3.043 N/A MET 280.A N LEU 276.A O no hydrogen 2.915 N/A GLU 281.A N ILE 277.A O no hydrogen 2.840 N/A LYS 282.A N LYS 278.A O no hydrogen 2.998 N/A HIS 283.A N TYR 279.A O no hydrogen 3.147 N/A LYS 284.A N GLU 281.A O no hydrogen 3.208 N/A VAL 285.A N MET 280.A O no hydrogen 2.915 N/A ASP 288.A N ASP 288.A OD1 no hydrogen 2.670 N/A SER 289.A N LYS 286.A O no hydrogen 3.292 N/A SER 289.A OG LYS 286.A O no hydrogen 2.859 N/A PHE 292.A N SER 289.A OG no hydrogen 3.271 N/A HIS 293.A N SER 289.A O no hydrogen 3.259 N/A LEU 294.A N LYS 290.A O no hydrogen 3.205 N/A LEU 295.A N ALA 291.A O no hydrogen 3.218 N/A GLN 296.A N PHE 292.A O no hydrogen 2.922 N/A LYS 297.A N HIS 293.A O no hydrogen 3.297 N/A LEU 298.A N LEU 294.A O no hydrogen 3.005 N/A LEU 299.A N LEU 295.A O no hydrogen 2.885 N/A THR 300.A OG1 GLN 296.A O no hydrogen 3.252 N/A THR 300.A OG1 LYS 297.A O no hydrogen 2.995 N/A ILE 304.A N ASP 302.A OD1 no hydrogen 3.271 N/A LYS 305.A N ASP 302.A O no hydrogen 2.927 N/A LYS 305.A NZ ASP 249.A O no hydrogen 3.304 N/A ARG 306.A N PRO 303.A O no hydrogen 3.225 N/A ARG 306.A NE THR 300.A O no hydrogen 3.021 N/A ARG 306.A NH1 GLU 191.A OE2 no hydrogen 3.090 N/A ARG 306.A NH1 ALA 202.A O no hydrogen 2.937 N/A ARG 306.A NH2 GLU 191.A OE1 no hydrogen 3.205 N/A ARG 306.A NH2 THR 300.A O no hydrogen 3.100 N/A ARG 306.A NH2 MET 301.A O no hydrogen 2.999 N/A THR 308.A N GLN 311.A OE1 no hydrogen 3.301 N/A THR 308.A OG1 GLU 310.A OE2 no hydrogen 3.006 N/A THR 308.A OG1 GLN 311.A OE1 no hydrogen 3.285 N/A GLN 311.A N THR 308.A OG1 no hydrogen 3.233 N/A ALA 312.A N THR 308.A O no hydrogen 3.069 N/A MET 313.A N SER 309.A O no hydrogen 3.019 N/A GLN 314.A N GLU 310.A O no hydrogen 3.302 N/A ASP 315.A N ALA 312.A O no hydrogen 2.851 N/A TYR 317.A N ASP 315.A OD2 no hydrogen 2.946 N/A PHE 318.A N ASP 315.A O no hydrogen 3.100 N/A LEU 319.A N PRO 316.A O no hydrogen 2.912 N/A GLU 320.A N TYR 317.A O no hydrogen 3.273 N/A THR 325.A N SER 128.A OG no hydrogen 2.755 N/A THR 325.A OG1 SER 128.A OG no hydrogen 3.331 N/A THR 325.A OG1 ASP 327.A O no hydrogen 2.550 N/A VAL 328.A N GLY 165.A O no hydrogen 2.746 N/A PHE 329.A N ASP 327.A OD1 no hydrogen 2.723 N/A ALA 330.A N ASP 327.A O no hydrogen 3.011 N/A ALA 330.A N ASP 327.A OD1 no hydrogen 3.212 N/A CYS 332.A N PHE 329.A O no hydrogen 3.121 N/A TYR 336.A OH HIS 114.A NE2 no hydrogen 2.657 N/A ARG 339.A N GLU 104.A OE2 no hydrogen 2.736 N/A ARG 339.A NE ALA 103.A O no hydrogen 3.112 N/A ARG 339.A NH1 ASP 106.A OD2 no hydrogen 2.785 N/A ARG 339.A NH2 ALA 103.A O no hydrogen 3.115 N/A ARG 339.A NH2 ASP 106.A OD2 no hydrogen 3.027 N/A LEU 342.A N LYS 29.A O no hydrogen 2.712 N/A