Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zxi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N GLY 1.A O no hydrogen 2.971 N/A GLN 6.A N LEU 2.A O no hydrogen 3.340 N/A LYS 7.A N LEU 3.A O no hydrogen 2.799 N/A ALA 8.A N ALA 4.A O no hydrogen 2.800 N/A ARG 9.A N ALA 5.A O no hydrogen 2.698 N/A ARG 9.A NH1 THR 254.A O no hydrogen 3.065 N/A ARG 9.A NH2 THR 254.A O no hydrogen 3.086 N/A ARG 9.A NH2 LEU 256.A O no hydrogen 2.596 N/A GLY 10.A N GLN 6.A O no hydrogen 3.117 N/A GLY 10.A N LYS 7.A O no hydrogen 3.284 N/A LEU 11.A N GLN 6.A O no hydrogen 2.784 N/A PHE 12.A N GLN 6.A O no hydrogen 3.001 N/A PHE 16.A N GLY 213.A O no hydrogen 2.947 N/A GLN 19.A N HIS 51.A ND1 no hydrogen 3.042 N/A THR 20.A OG1 TYR 181.A O no hydrogen 3.542 N/A ILE 21.A N ASN 52.A O no hydrogen 2.973 N/A TYR 22.A N VAL 185.A O no hydrogen 2.854 N/A CYS 23.A N ILE 54.A O no hydrogen 3.297 N/A CYS 23.A SG GLY 24.A O no hydrogen 3.744 N/A PHE 25.A N LEU 56.A O no hydrogen 2.834 N/A THR 28.A N ASP 26.A O no hydrogen 2.773 N/A SER 31.A OG LEU 32.A O no hydrogen 3.010 N/A VAL 34.A N VAL 222.A O no hydrogen 3.094 N/A GLY 35.A N HIS 33.A ND1 no hydrogen 2.861 N/A HIS 36.A N HIS 33.A ND1 no hydrogen 3.246 N/A LEU 37.A N HIS 33.A O no hydrogen 3.159 N/A LEU 38.A N GLY 35.A O no hydrogen 3.049 N/A LEU 40.A N HIS 36.A O no hydrogen 3.004 N/A LEU 41.A N LEU 37.A O no hydrogen 2.860 N/A GLY 42.A N LEU 38.A O no hydrogen 3.138 N/A LEU 43.A N ALA 39.A O no hydrogen 3.365 N/A PHE 44.A N LEU 40.A O no hydrogen 2.940 N/A HIS 45.A N LEU 41.A O no hydrogen 2.655 N/A LEU 46.A N GLY 42.A O no hydrogen 3.261 N/A GLN 47.A N LEU 43.A O no hydrogen 2.763 N/A GLN 47.A NE2 SER 112.A O no hydrogen 3.127 N/A ARG 48.A N PHE 44.A O no hydrogen 2.910 N/A ARG 48.A NH1 HIS 100.A NE2 no hydrogen 3.309 N/A ARG 48.A NH1 PHE 104.A O no hydrogen 3.037 N/A ALA 49.A N HIS 45.A O no hydrogen 3.102 N/A GLY 50.A N GLN 47.A O no hydrogen 2.907 N/A HIS 51.A N LEU 46.A O no hydrogen 2.934 N/A ASN 52.A N GLN 19.A O no hydrogen 3.111 N/A ASN 52.A ND2 SER 112.A OG no hydrogen 2.735 N/A VAL 53.A N SER 112.A O no hydrogen 2.805 N/A ILE 54.A N ILE 21.A O no hydrogen 2.964 N/A ALA 55.A N THR 114.A O no hydrogen 2.777 N/A LEU 56.A N CYS 23.A O no hydrogen 2.957 N/A VAL 57.A N LEU 116.A O no hydrogen 2.728 N/A GLY 58.A N PHE 25.A O no hydrogen 3.263 N/A ALA 60.A N ASN 118.A OD1 no hydrogen 3.179 N/A THR 61.A OG1 ASP 26.A OD1 no hydrogen 2.836 N/A ALA 62.A N GLY 58.A O no hydrogen 2.900 N/A ARG 63.A N ALA 60.A O no hydrogen 3.061 N/A GLY 65.A N THR 61.A O no hydrogen 2.965 N/A SER 68.A N ASP 66.A OD1 no hydrogen 2.967 N/A SER 68.A OG ASP 66.A OD1 no hydrogen 3.038 N/A ARG 70.A N PRO 67.A O no hydrogen 2.879 N/A ARG 70.A NE LYS 72.A O no hydrogen 3.322 N/A ARG 70.A NH2 LYS 72.A O no hydrogen 3.522 N/A ARG 74.A NE ASP 66.A O no hydrogen 2.827 N/A ARG 74.A NH2 ASP 66.A O no hydrogen 2.788 N/A VAL 82.A N GLU 78.A O no hydrogen 3.208 N/A ARG 83.A NH1 GLY 59.A O no hydrogen 3.516 N/A ALA 84.A N GLU 80.A O no hydrogen 2.956 N/A ASN 85.A N ARG 81.A O no hydrogen 3.091 N/A ASN 85.A ND2 PRO 27.A O no hydrogen 3.591 N/A ALA 86.A N VAL 82.A O no hydrogen 3.077 N/A ARG 87.A N ALA 84.A O no hydrogen 2.786 N/A ALA 88.A N ALA 84.A O no hydrogen 3.048 N/A LEU 89.A N ASN 85.A O no hydrogen 2.818 N/A ARG 90.A N ALA 86.A O no hydrogen 3.288 N/A LEU 91.A N ARG 87.A O no hydrogen 3.342 N/A GLY 92.A N ALA 88.A O no hydrogen 2.895 N/A LEU 93.A N LEU 89.A O no hydrogen 2.878 N/A GLU 94.A N ARG 90.A O no hydrogen 3.069 N/A ALA 95.A N LEU 91.A O no hydrogen 3.066 N/A LEU 96.A N GLY 92.A O no hydrogen 3.099 N/A ALA 97.A N LEU 93.A O no hydrogen 3.104 N/A ALA 98.A N GLU 94.A O no hydrogen 3.141 N/A ASN 99.A N ALA 95.A O no hydrogen 3.088 N/A ASN 99.A ND2 LEU 288.A O no hydrogen 2.770 N/A HIS 100.A N LEU 96.A O no hydrogen 2.877 N/A GLN 101.A N ALA 97.A O no hydrogen 3.194 N/A GLN 101.A N ALA 98.A O no hydrogen 3.041 N/A GLN 102.A N ALA 98.A O no hydrogen 3.324 N/A GLN 102.A N ASN 99.A O no hydrogen 3.233 N/A LEU 103.A N ASN 99.A O no hydrogen 2.785 N/A THR 105.A OG1 GLN 101.A O no hydrogen 3.334 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 3.089 N/A ARG 108.A NH1 ASP 106.A OD2 no hydrogen 3.071 N/A TRP 110.A NE1 ASP 106.A OD1 no hydrogen 2.968 N/A GLY 111.A N GLN 47.A O no hydrogen 3.080 N/A THR 114.A N VAL 53.A O no hydrogen 2.888 N/A LEU 116.A N ALA 55.A O no hydrogen 3.257 N/A ASN 118.A N VAL 57.A O no hydrogen 3.157 N/A ASN 118.A ND2 THR 61.A OG1 no hydrogen 3.237 N/A ASN 118.A ND2 ASP 173.A OD2 no hydrogen 3.038 N/A SER 119.A N ASP 117.A OD1 no hydrogen 2.604 N/A SER 119.A OG ASP 117.A OD1 no hydrogen 2.720 N/A ALA 120.A N ASP 117.A O no hydrogen 3.342 N/A TRP 121.A N ASN 118.A O no hydrogen 3.047 N/A TRP 121.A NE1 ASP 173.A OD1 no hydrogen 3.022 N/A TYR 122.A N ASN 118.A O no hydrogen 2.927 N/A TYR 122.A OH ASP 173.A OD1 no hydrogen 3.040 N/A GLN 123.A N SER 119.A O no hydrogen 2.925 N/A GLN 125.A N TYR 122.A O no hydrogen 2.922 N/A PHE 130.A N HIS 126.A O no hydrogen 2.995 N/A LEU 131.A N LEU 127.A O no hydrogen 2.911 N/A ALA 132.A N VAL 128.A O no hydrogen 2.678 N/A ALA 133.A N ASP 129.A O no hydrogen 2.652 N/A ALA 133.A N PHE 130.A O no hydrogen 2.903 N/A VAL 134.A N PHE 130.A O no hydrogen 2.852 N/A HIS 137.A N VAL 134.A O no hydrogen 2.555 N/A ARG 139.A NH2 GLY 136.A O no hydrogen 3.551 N/A LEU 143.A N ARG 139.A O no hydrogen 3.338 N/A LEU 144.A N MET 140.A O no hydrogen 2.861 N/A SER 145.A N THR 142.A O no hydrogen 2.897 N/A SER 145.A OG THR 142.A O no hydrogen 3.445 N/A ARG 146.A NH1 GLU 201.A OE2 no hydrogen 3.316 N/A ARG 146.A NH2 GLU 201.A OE1 no hydrogen 2.597 N/A ARG 146.A NH2 GLU 201.A OE2 no hydrogen 2.861 N/A VAL 149.A N ARG 146.A O no hydrogen 3.139 N/A GLN 150.A NE2 LEU 144.A O no hydrogen 3.378 N/A GLN 150.A NE2 ARG 146.A O no hydrogen 2.623 N/A ARG 152.A NE GLU 163.A OE2 no hydrogen 2.837 N/A ARG 152.A NH1 GLU 157.A OE2 no hydrogen 2.579 N/A ARG 152.A NH2 GLU 157.A OE2 no hydrogen 3.203 N/A LEU 153.A N VAL 149.A O no hydrogen 2.981 N/A LYS 154.A N GLN 150.A O no hydrogen 2.791 N/A SER 155.A N ARG 152.A O no hydrogen 3.251 N/A SER 155.A OG ARG 152.A O no hydrogen 2.482 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.564 N/A GLY 158.A N SER 155.A OG no hydrogen 2.894 N/A SER 160.A N GLU 163.A OE1 no hydrogen 2.953 N/A GLU 163.A N SER 160.A OG no hydrogen 2.916 N/A PHE 164.A N SER 160.A O no hydrogen 3.386 N/A PHE 165.A N LEU 161.A O no hydrogen 2.895 N/A PHE 165.A N ALA 162.A O no hydrogen 2.947 N/A TYR 166.A N ALA 162.A O no hydrogen 2.927 N/A TYR 166.A OH ASP 26.A OD2 no hydrogen 2.536 N/A GLN 167.A NE2 LEU 143.A O no hydrogen 3.237 N/A VAL 168.A N PHE 165.A O no hydrogen 2.785 N/A GLN 170.A N TYR 166.A O no hydrogen 3.414 N/A GLN 170.A NE2 GLN 186.A OE1 no hydrogen 3.089 N/A GLN 170.A NE2 GLN 192.A OE1 no hydrogen 3.371 N/A ALA 171.A N GLN 167.A O no hydrogen 2.979 N/A TYR 172.A N VAL 168.A O no hydrogen 2.927 N/A ASP 173.A N LEU 169.A O no hydrogen 2.701 N/A PHE 174.A N GLN 170.A O no hydrogen 3.235 N/A TYR 175.A N ALA 171.A O no hydrogen 3.253 N/A TYR 176.A N TYR 172.A O no hydrogen 2.676 N/A LEU 177.A N ASP 173.A O no hydrogen 2.820 N/A PHE 178.A N PHE 174.A O no hydrogen 3.136 N/A GLN 179.A N TYR 175.A O no hydrogen 3.052 N/A ARG 180.A N TYR 176.A O no hydrogen 2.983 N/A TYR 181.A N LEU 177.A O no hydrogen 2.619 N/A CYS 183.A SG THR 20.A O no hydrogen 3.357 N/A CYS 183.A SG VAL 185.A O no hydrogen 3.514 N/A ARG 184.A N THR 20.A O no hydrogen 3.149 N/A ARG 184.A NH1 ASP 210.A O no hydrogen 2.738 N/A ARG 184.A NH2 ASP 210.A O no hydrogen 3.330 N/A GLN 186.A N PHE 212.A O no hydrogen 2.848 N/A LEU 187.A N TYR 22.A O no hydrogen 2.718 N/A GLY 188.A N ILE 214.A O no hydrogen 3.249 N/A GLN 192.A N GLY 189.A O no hydrogen 3.361 N/A GLN 192.A NE2 ASP 66.A OD2 no hydrogen 3.058 N/A GLN 192.A NE2 ASP 191.A OD2 no hydrogen 3.406 N/A LEU 193.A N SER 190.A O no hydrogen 2.978 N/A ASN 195.A ND2 ASP 66.A OD1 no hydrogen 3.557 N/A ASN 195.A ND2 GLN 170.A OE1 no hydrogen 3.134 N/A ASN 195.A ND2 GLN 192.A OE1 no hydrogen 3.149 N/A ILE 196.A N GLN 192.A O no hydrogen 3.152 N/A MET 197.A N LEU 193.A O no hydrogen 2.937 N/A SER 198.A N GLY 194.A O no hydrogen 3.147 N/A GLY 199.A N ASN 195.A O no hydrogen 3.144 N/A TYR 200.A N ILE 196.A O no hydrogen 3.099 N/A GLU 201.A N MET 197.A O no hydrogen 3.064 N/A PHE 202.A N SER 198.A O no hydrogen 2.922 N/A ILE 203.A N GLY 199.A O no hydrogen 2.898 N/A ASN 204.A N TYR 200.A O no hydrogen 2.944 N/A ASN 204.A ND2 ASP 210.A OD1 no hydrogen 3.249 N/A LYS 205.A N GLU 201.A O no hydrogen 2.746 N/A LYS 205.A NZ HIS 137.A O no hydrogen 3.442 N/A LEU 206.A N PHE 202.A O no hydrogen 3.225 N/A THR 207.A N ILE 203.A O no hydrogen 2.736 N/A THR 207.A OG1 ILE 203.A O no hydrogen 3.334 N/A PHE 212.A N ARG 184.A O no hydrogen 2.896 N/A GLY 213.A N PHE 16.A O no hydrogen 2.853 N/A ILE 214.A N GLN 186.A O no hydrogen 2.875 N/A THR 215.A N ASP 14.A O no hydrogen 2.858 N/A TRP 223.A N THR 229.A OG1 no hydrogen 2.881 N/A LEU 224.A N LEU 32.A O no hydrogen 2.832 N/A ASN 225.A ND2 SER 31.A OG no hydrogen 3.060 N/A LYS 228.A NZ ASP 30.A OD1 no hydrogen 2.729 N/A THR 229.A N ASN 225.A O no hydrogen 2.644 N/A SER 230.A N GLU 233.A OE1 no hydrogen 3.216 N/A GLU 233.A N SER 230.A OG no hydrogen 2.909 N/A LEU 234.A N SER 230.A O no hydrogen 2.978 N/A TYR 235.A N PRO 231.A O no hydrogen 3.193 N/A GLN 236.A N PHE 232.A O no hydrogen 3.117 N/A GLN 236.A N GLU 233.A O no hydrogen 2.959 N/A PHE 237.A N LEU 234.A O no hydrogen 3.281 N/A PHE 238.A N TYR 235.A O no hydrogen 3.139 N/A VAL 239.A N TYR 235.A O no hydrogen 2.872 N/A ARG 240.A N GLN 236.A O no hydrogen 2.875 N/A GLN 241.A N VAL 239.A O no hydrogen 2.845 N/A GLN 241.A NE2 PHE 237.A O no hydrogen 2.726 N/A SER 245.A N PRO 242.A O no hydrogen 3.071 N/A SER 245.A OG ASP 244.A OD1 no hydrogen 2.649 N/A VAL 246.A N PRO 242.A O no hydrogen 3.168 N/A TYR 249.A N SER 245.A O no hydrogen 3.026 N/A LEU 250.A N VAL 246.A O no hydrogen 3.311 N/A LYS 251.A NZ GLU 247.A OE2 no hydrogen 3.208 N/A LEU 252.A N TYR 249.A O no hydrogen 3.055 N/A PHE 253.A N TYR 249.A O no hydrogen 2.736 N/A THR 254.A OG1 LEU 250.A O no hydrogen 2.938 N/A LEU 256.A N THR 254.A OG1 no hydrogen 3.170 N/A ILE 261.A N PRO 257.A O no hydrogen 3.172 N/A ASP 262.A N LEU 258.A O no hydrogen 2.776 N/A HIS 263.A N PRO 259.A O no hydrogen 3.027 N/A ILE 264.A N GLU 260.A O no hydrogen 3.176 N/A MET 265.A N ILE 261.A O no hydrogen 3.121 N/A MET 265.A N ASP 262.A O no hydrogen 3.202 N/A GLN 266.A N ASP 262.A O no hydrogen 3.034 N/A GLN 266.A NE2 HIS 263.A ND1 no hydrogen 2.699 N/A LEU 267.A N HIS 263.A O no hydrogen 2.690 N/A HIS 268.A N ILE 264.A O no hydrogen 2.985 N/A HIS 268.A NE2 PRO 272.A O no hydrogen 3.058 N/A VAL 269.A N MET 265.A O no hydrogen 3.173 N/A GLU 271.A N HIS 268.A O no hydrogen 2.888 N/A ARG 274.A N GLU 271.A O no hydrogen 3.207 N/A ARG 275.A N PRO 272.A O no hydrogen 3.430 N/A GLN 278.A N GLN 278.A OE1 no hydrogen 2.659 N/A GLN 278.A NE2 GLN 241.A O no hydrogen 3.061 N/A GLN 278.A NE2 ASP 243.A OD1 no hydrogen 3.266 N/A LYS 279.A N ARG 275.A O no hydrogen 2.870 N/A LYS 279.A NZ ARG 274.A O no hydrogen 3.186 N/A ARG 280.A N PRO 277.A O no hydrogen 3.246 N/A LEU 281.A N PRO 277.A O no hydrogen 2.923 N/A ALA 282.A N GLN 278.A O no hydrogen 2.888 N/A GLU 284.A N ARG 280.A O no hydrogen 2.883 N/A VAL 285.A N LEU 281.A O no hydrogen 3.022 N/A THR 286.A N ALA 282.A O no hydrogen 3.141 N/A THR 286.A OG1 ALA 282.A O no hydrogen 2.643 N/A LYS 287.A N ALA 283.A O no hydrogen 2.989 N/A LEU 288.A N GLU 284.A O no hydrogen 3.253 N/A LEU 288.A N VAL 285.A O no hydrogen 2.670 N/A VAL 289.A N VAL 285.A O no hydrogen 3.037 N/A HIS 290.A N THR 286.A O no hydrogen 3.068 N/A GLY 294.A N HIS 290.A O no hydrogen 3.368 N/A LEU 295.A N GLY 291.A O no hydrogen 3.074 N/A ASP 296.A N ARG 292.A O no hydrogen 2.961 N/A SER 297.A N GLU 293.A O no hydrogen 2.730 N/A SER 297.A OG GLU 293.A O no hydrogen 3.190 N/A SER 297.A OG GLY 294.A O no hydrogen 3.121 N/A ALA 298.A N LEU 295.A O no hydrogen 3.007 N/A LYS 299.A N LEU 295.A O no hydrogen 2.573 N/A ARG 300.A N ASP 296.A O no hydrogen 2.854 N/A CYS 301.A SG SER 297.A O no hydrogen 2.900 N/A THR 302.A N ALA 298.A O no hydrogen 3.145 N/A THR 302.A OG1 LYS 299.A O no hydrogen 3.509 N/A GLN 303.A N LYS 299.A O no hydrogen 3.192 N/A ALA 304.A N ARG 300.A O no hydrogen 3.401 N/A LEU 305.A N GLN 303.A O no hydrogen 2.837 N/A