Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 VAL 5.A O no hydrogen 3.458 N/A TYR 4.A N GLU 251.A OE1 no hydrogen 3.090 N/A TYR 4.A N GLU 251.A OE2 no hydrogen 3.201 N/A VAL 5.A N GLU 251.A OE2 no hydrogen 3.362 N/A ARG 6.A N LYS 10.A O no hydrogen 2.450 N/A LYS 7.A NZ THR 155.A O no hydrogen 2.957 N/A LYS 7.A NZ SER 272.A O no hydrogen 2.959 N/A LYS 7.A NZ GLU 277.A OE1 no hydrogen 3.216 N/A ASN 12.A N TYR 4.A O no hydrogen 2.696 N/A ASN 12.A ND2 TYR 4.A O no hydrogen 2.849 N/A VAL 18.A N GLY 16.A O no hydrogen 3.053 N/A THR 21.A N ARG 19.A O no hydrogen 2.843 N/A ARG 23.A N GLU 20.A O no hydrogen 3.113 N/A ARG 23.A NE GLU 20.A OE1 no hydrogen 2.461 N/A TYR 24.A N THR 21.A O no hydrogen 3.330 N/A THR 31.A N ASP 27.A O no hydrogen 3.502 N/A LEU 32.A N PHE 29.A O no hydrogen 3.052 N/A VAL 33.A N PHE 29.A O no hydrogen 3.157 N/A ASP 34.A N THR 30.A O no hydrogen 3.450 N/A LEU 35.A N LEU 32.A O no hydrogen 3.247 N/A ASN 40.A N LYS 36.A O no hydrogen 2.833 N/A ASN 40.A ND2 LEU 32.A O no hydrogen 3.135 N/A LEU 41.A N TRP 37.A O no hydrogen 2.586 N/A LEU 42.A N ARG 38.A O no hydrogen 2.914 N/A ILE 43.A N PHE 39.A O no hydrogen 3.143 N/A PHE 44.A N ASN 40.A O no hydrogen 3.070 N/A VAL 45.A N LEU 41.A O no hydrogen 3.162 N/A MET 46.A N LEU 42.A O no hydrogen 2.725 N/A VAL 47.A N ILE 43.A O no hydrogen 3.019 N/A THR 49.A N VAL 45.A O no hydrogen 3.440 N/A THR 49.A OG1 VAL 45.A O no hydrogen 3.386 N/A THR 49.A OG1 MET 46.A O no hydrogen 3.255 N/A VAL 50.A N MET 46.A O no hydrogen 3.152 N/A THR 51.A N VAL 47.A O no hydrogen 3.003 N/A THR 51.A N TYR 48.A O no hydrogen 3.150 N/A THR 51.A OG1 VAL 47.A O no hydrogen 2.381 N/A TRP 52.A N TYR 48.A O no hydrogen 2.972 N/A TRP 52.A NE1 GLU 98.A OE1 no hydrogen 2.295 N/A LEU 53.A N THR 49.A O no hydrogen 3.205 N/A PHE 55.A N THR 51.A O no hydrogen 3.095 N/A GLY 56.A N TRP 52.A O no hydrogen 2.642 N/A MET 57.A N LEU 53.A O no hydrogen 2.927 N/A ILE 58.A N PHE 54.A O no hydrogen 3.325 N/A TRP 59.A N PHE 55.A O no hydrogen 2.666 N/A TRP 60.A N GLY 56.A O no hydrogen 2.893 N/A LEU 61.A N MET 57.A O no hydrogen 2.813 N/A ILE 62.A N ILE 58.A O no hydrogen 3.149 N/A ALA 63.A N TRP 60.A O no hydrogen 2.939 N/A TYR 64.A N LEU 61.A O no hydrogen 3.096 N/A ILE 65.A N LEU 61.A O no hydrogen 3.099 N/A ARG 66.A N ILE 62.A O no hydrogen 3.243 N/A ASP 68.A N ALA 63.A O no hydrogen 2.967 N/A THR 78.A OG1 PRO 79.A O no hydrogen 3.558 N/A THR 82.A N VAL 107.A O no hydrogen 3.052 N/A LEU 84.A N VAL 81.A O no hydrogen 3.378 N/A ALA 90.A N GLY 86.A O no hydrogen 2.621 N/A PHE 91.A N PHE 87.A O no hydrogen 2.784 N/A LEU 92.A N VAL 88.A O no hydrogen 3.325 N/A PHE 93.A N SER 89.A O no hydrogen 2.936 N/A PHE 93.A N ALA 90.A O no hydrogen 3.223 N/A SER 94.A N PHE 91.A O no hydrogen 3.323 N/A SER 94.A OG TRP 52.A O no hydrogen 3.217 N/A SER 94.A OG ALA 90.A O no hydrogen 3.291 N/A GLU 96.A N LEU 92.A O no hydrogen 3.338 N/A THR 97.A N SER 94.A O no hydrogen 3.052 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.744 N/A GLU 98.A N SER 94.A O no hydrogen 2.558 N/A THR 99.A N ILE 95.A O no hydrogen 3.422 N/A THR 99.A OG1 ILE 95.A O no hydrogen 2.250 N/A THR 100.A N THR 97.A O no hydrogen 3.035 N/A THR 100.A OG1 THR 99.A O no hydrogen 2.529 N/A GLY 102.A N GLU 96.A O no hydrogen 2.464 N/A THR 109.A N CYS 80.A O no hydrogen 2.744 N/A THR 109.A OG1 PRO 79.A O no hydrogen 2.264 N/A THR 109.A OG1 CYS 80.A O no hydrogen 3.025 N/A ILE 117.A N GLU 114.A O no hydrogen 3.245 N/A LEU 119.A N GLY 115.A O no hydrogen 2.826 N/A ILE 121.A N ILE 117.A O no hydrogen 3.135 N/A GLN 122.A N LEU 118.A O no hydrogen 3.142 N/A SER 123.A N LEU 119.A O no hydrogen 3.124 N/A VAL 124.A N LEU 120.A O no hydrogen 2.482 N/A GLY 126.A N GLN 122.A O no hydrogen 2.740 N/A SER 127.A N SER 123.A O no hydrogen 3.317 N/A VAL 129.A N LEU 125.A O no hydrogen 3.097 N/A ASN 130.A N GLY 126.A O no hydrogen 3.011 N/A ALA 131.A N SER 127.A O no hydrogen 2.821 N/A PHE 132.A N ILE 128.A O no hydrogen 2.685 N/A MET 133.A N ASN 130.A O no hydrogen 2.873 N/A VAL 134.A N ASN 130.A O no hydrogen 2.480 N/A GLY 135.A N ALA 131.A O no hydrogen 3.392 N/A MET 137.A N MET 133.A O no hydrogen 2.986 N/A VAL 139.A N GLY 135.A O no hydrogen 3.079 N/A LYS 140.A N CYS 136.A O no hydrogen 3.393 N/A LYS 140.A NZ VAL 33.A O no hydrogen 2.531 N/A LYS 140.A NZ LEU 35.A O no hydrogen 2.519 N/A ILE 141.A N PHE 138.A O no hydrogen 2.847 N/A SER 142.A N PHE 138.A O no hydrogen 2.772 N/A SER 142.A OG PHE 138.A O no hydrogen 3.476 N/A ARG 147.A N PRO 144.A O no hydrogen 2.999 N/A ARG 147.A NH1 ARG 147.A O no hydrogen 3.325 N/A ARG 147.A NH1 ASP 174.A OD1 no hydrogen 3.163 N/A ARG 147.A NH2 ASP 174.A OD1 no hydrogen 3.175 N/A ARG 147.A NH2 ASP 174.A OD2 no hydrogen 3.207 N/A GLU 149.A N LYS 146.A O no hydrogen 3.247 N/A THR 150.A N ARG 147.A O no hydrogen 3.063 N/A THR 150.A OG1 ARG 147.A O no hydrogen 2.852 N/A LEU 151.A N ALA 148.A O no hydrogen 3.250 N/A VAL 152.A N GLY 173.A O no hydrogen 2.910 N/A SER 154.A N ARG 171.A O no hydrogen 2.751 N/A SER 154.A OG HIS 156.A O no hydrogen 2.666 N/A THR 155.A N HIS 303.A ND1 no hydrogen 3.276 N/A THR 155.A OG1 HIS 156.A ND1 no hydrogen 3.347 N/A HIS 156.A N SER 154.A OG no hydrogen 3.341 N/A ALA 157.A N GLU 277.A O no hydrogen 3.185 N/A VAL 158.A N MET 169.A O no hydrogen 2.726 N/A ILE 159.A N LEU 279.A O no hydrogen 2.686 N/A SER 160.A N CYS 167.A O no hydrogen 3.135 N/A CYS 167.A N SER 160.A O no hydrogen 3.153 N/A CYS 167.A SG LYS 165.A O no hydrogen 3.425 N/A LEU 168.A N HIS 229.A O no hydrogen 2.818 N/A MET 169.A N VAL 158.A O no hydrogen 2.701 N/A PHE 170.A N ILE 227.A O no hydrogen 3.202 N/A ARG 171.A NE PHE 302.A O no hydrogen 3.058 N/A ARG 171.A NH1 THR 285.A O no hydrogen 2.541 N/A ARG 171.A NH2 THR 285.A O no hydrogen 2.903 N/A ARG 171.A NH2 PHE 302.A O no hydrogen 2.704 N/A VAL 172.A N LEU 225.A O no hydrogen 3.398 N/A GLY 173.A N VAL 152.A O no hydrogen 2.988 N/A LEU 175.A N THR 150.A O no hydrogen 2.865 N/A ASN 177.A N ASN 177.A OD1 no hydrogen 2.380 N/A SER 178.A OG GLU 261.A OE1 no hydrogen 2.391 N/A HIS 179.A N GLU 261.A OE1 no hydrogen 2.501 N/A SER 184.A N GLU 257.A O no hydrogen 2.637 N/A SER 184.A OG ASP 217.A OD2 no hydrogen 3.525 N/A ILE 185.A N ASP 217.A O no hydrogen 3.019 N/A ARG 186.A N ILE 255.A O no hydrogen 3.050 N/A LYS 188.A N VAL 253.A O no hydrogen 2.720 N/A LYS 188.A NZ GLN 205.A OE1 no hydrogen 3.264 N/A LEU 189.A N THR 206.A O no hydrogen 2.441 N/A ILE 190.A N GLU 251.A O no hydrogen 2.976 N/A LYS 191.A N ASN 204.A O no hydrogen 3.213 N/A LYS 191.A NZ GLU 248.A OE1 no hydrogen 3.293 N/A SER 192.A OG PRO 202.A O no hydrogen 2.324 N/A LYS 193.A N ILE 201.A O no hydrogen 3.190 N/A THR 195.A N GLU 199.A O no hydrogen 3.219 N/A THR 195.A OG1 GLU 199.A O no hydrogen 2.647 N/A GLY 198.A N THR 195.A O no hydrogen 3.426 N/A ILE 201.A N LYS 193.A O no hydrogen 2.942 N/A ASN 204.A N LYS 191.A O no hydrogen 3.066 N/A THR 206.A N LEU 189.A O no hydrogen 2.583 N/A ILE 208.A N ALA 187.A O no hydrogen 2.890 N/A GLY 211.A N ASN 209.A OD1 no hydrogen 3.346 N/A TYR 212.A N ASN 209.A OD1 no hydrogen 3.080 N/A THR 214.A OG1 ASP 216.A OD2 no hydrogen 2.830 N/A ASP 217.A N GLY 211.A O no hydrogen 2.882 N/A LEU 219.A N ALA 183.A O no hydrogen 2.781 N/A LEU 225.A N VAL 172.A O no hydrogen 3.237 N/A ILE 227.A N PHE 170.A O no hydrogen 2.851 N/A HIS 229.A N LEU 168.A O no hydrogen 2.703 N/A HIS 229.A ND1 ASN 209.A O no hydrogen 2.967 N/A ILE 231.A N LEU 166.A O no hydrogen 2.859 N/A SER 235.A N ASN 232.A O no hydrogen 3.112 N/A SER 235.A OG ASN 232.A O no hydrogen 2.456 N/A ILE 240.A N PHE 237.A O no hydrogen 3.517 N/A SER 241.A N GLN 244.A OE1 no hydrogen 2.784 N/A SER 241.A OG GLU 317.A OE1 no hydrogen 3.089 N/A LYS 242.A N SER 312.A O no hydrogen 3.198 N/A GLN 244.A N SER 241.A O no hydrogen 3.260 N/A LEU 245.A N SER 241.A O no hydrogen 3.333 N/A LYS 247.A N GLN 244.A O no hydrogen 2.738 N/A ILE 252.A N TYR 273.A O no hydrogen 2.612 N/A VAL 253.A N LYS 188.A O no hydrogen 2.707 N/A VAL 254.A N SER 271.A O no hydrogen 2.947 N/A ILE 255.A N ARG 186.A O no hydrogen 2.893 N/A LEU 256.A N ALA 269.A O no hydrogen 2.867 N/A GLU 257.A N SER 184.A O no hydrogen 2.908 N/A GLY 258.A N CYS 267.A O no hydrogen 3.331 N/A MET 259.A N VAL 181.A O no hydrogen 2.843 N/A VAL 260.A N MET 265.A O no hydrogen 2.610 N/A MET 265.A N THR 263.A OG1 no hydrogen 2.978 N/A CYS 267.A N GLY 258.A O no hydrogen 2.772 N/A CYS 267.A SG PRO 144.A O no hydrogen 3.593 N/A GLN 268.A NE2 GLU 257.A OE2 no hydrogen 2.442 N/A ALA 269.A N LEU 256.A O no hydrogen 2.955 N/A ARG 270.A NE GLY 9.A O no hydrogen 2.791 N/A ARG 270.A NH1 GLN 268.A OE1 no hydrogen 2.710 N/A ARG 270.A NH2 GLY 9.A O no hydrogen 3.339 N/A SER 271.A N VAL 254.A O no hydrogen 3.055 N/A SER 271.A OG SER 272.A O no hydrogen 3.562 N/A SER 272.A OG GLU 251.A OE2 no hydrogen 2.974 N/A SER 272.A OG ILE 252.A O no hydrogen 3.221 N/A TYR 273.A N ILE 252.A O no hydrogen 2.942 N/A TYR 273.A OH SER 154.A O no hydrogen 2.729 N/A GLU 277.A N ILE 274.A O no hydrogen 2.693 N/A LEU 279.A N ALA 157.A O no hydrogen 2.742 N/A TRP 280.A NE1 PRO 311.A O no hydrogen 3.007 N/A GLY 281.A N ILE 159.A O no hydrogen 2.920 N/A TYR 282.A OH GLU 307.A OE2 no hydrogen 3.106 N/A ARG 283.A N TYR 306.A O no hydrogen 2.951 N/A ARG 283.A NH2 SER 160.A OG no hydrogen 2.954 N/A THR 285.A N GLU 304.A O no hydrogen 2.800 N/A THR 285.A OG1 GLU 304.A O no hydrogen 2.716 N/A THR 289.A N GLU 296.A O no hydrogen 2.948 N/A GLU 291.A N PHE 294.A O no hydrogen 2.906 N/A PHE 294.A N GLU 291.A O no hydrogen 3.308 N/A GLU 296.A N THR 289.A O no hydrogen 2.675 N/A ASP 298.A N VAL 287.A O no hydrogen 3.122 N/A SER 301.A N ASP 298.A OD1 no hydrogen 2.838 N/A SER 301.A OG PRO 286.A O no hydrogen 3.566 N/A SER 301.A OG SER 301.A O no hydrogen 2.285 N/A PHE 302.A N TYR 299.A O no hydrogen 3.345 N/A GLU 304.A N SER 301.A O no hydrogen 3.462 N/A TYR 306.A N ARG 283.A O no hydrogen 2.923 N/A THR 308.A N GLY 281.A O no hydrogen 2.661 N/A SER 314.A N GLU 317.A OE1 no hydrogen 2.607 N/A SER 314.A OG GLU 317.A OE1 no hydrogen 2.702 N/A LYS 316.A N TRP 238.A O no hydrogen 3.035 N/A GLU 317.A N SER 314.A OG no hydrogen 3.429 N/A LEU 318.A N SER 314.A O no hydrogen 2.844 N/A ALA 319.A N ALA 315.A O no hydrogen 3.186 N/A LEU 321.A N GLU 317.A O no hydrogen 2.714 N/A ALA 322.A N LEU 318.A O no hydrogen 3.148 N/A ASN 323.A N ALA 319.A O no hydrogen 2.736 N/A ARG 324.A N GLU 320.A O no hydrogen 2.965 N/A ARG 324.A N LEU 321.A O no hydrogen 3.259 N/A ALA 325.A N ALA 322.A O no hydrogen 3.088 N/A