Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iv3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N HIS 46.A ND1 no hydrogen 3.024 N/A LYS 3.A N ASP 81.A OD2 no hydrogen 3.050 N/A LYS 3.A NZ ASP 79.A O no hydrogen 2.797 N/A VAL 4.A N GLU 47.A O no hydrogen 2.691 N/A ALA 5.A N VAL 82.A O no hydrogen 2.775 N/A LEU 6.A N PHE 49.A O no hydrogen 2.714 N/A VAL 7.A N HIS 84.A O no hydrogen 2.886 N/A ASN 8.A N LEU 51.A O no hydrogen 2.855 N/A ASN 8.A ND2 GLY 52.A O no hydrogen 2.977 N/A ARG 12.A NH1 ASP 17.A O no hydrogen 2.458 N/A VAL 13.A N ALA 18.A O no hydrogen 2.849 N/A SER 16.A N VAL 13.A O no hydrogen 2.957 N/A ALA 18.A N SER 16.A OG no hydrogen 2.842 N/A ILE 20.A N LEU 11.A O no hydrogen 3.036 N/A SER 21.A N GLN 25.A OE1 no hydrogen 3.319 N/A SER 21.A OG PRO 23.A O no hydrogen 2.486 N/A VAL 22.A N SER 56.A OG no hydrogen 3.040 N/A GLN 25.A N GLN 25.A OE1 no hydrogen 2.435 N/A GLN 25.A NE2 TRP 19.A O no hydrogen 3.157 N/A TYR 27.A N GLU 214.A OE2 no hydrogen 2.901 N/A GLN 31.A N GLN 31.A OE1 no hydrogen 3.062 N/A VAL 33.A N GLY 29.A O no hydrogen 2.898 N/A VAL 34.A N ILE 30.A O no hydrogen 3.076 N/A ALA 35.A N GLN 31.A O no hydrogen 3.131 N/A ASN 36.A N TRP 32.A O no hydrogen 2.759 N/A LEU 37.A N VAL 33.A O no hydrogen 2.769 N/A MET 38.A N VAL 34.A O no hydrogen 2.711 N/A ASP 39.A N ALA 35.A O no hydrogen 3.080 N/A GLY 40.A N ASN 36.A O no hydrogen 3.273 N/A LEU 41.A N LEU 37.A O no hydrogen 2.768 N/A LEU 42.A N MET 38.A O no hydrogen 2.643 N/A GLU 43.A N ASP 39.A O no hydrogen 2.893 N/A LEU 44.A N GLY 40.A O no hydrogen 2.975 N/A GLY 45.A N LEU 42.A O no hydrogen 3.290 N/A HIS 46.A N LEU 41.A O no hydrogen 2.961 N/A GLU 47.A N LEU 2.A O no hydrogen 2.605 N/A VAL 48.A N GLY 59.A O no hydrogen 3.224 N/A PHE 49.A N VAL 4.A O no hydrogen 2.812 N/A LEU 50.A N THR 61.A O no hydrogen 2.748 N/A LEU 51.A N LEU 6.A O no hydrogen 3.090 N/A GLY 52.A N ALA 65.A O no hydrogen 3.079 N/A SER 56.A OG ALA 53.A O no hydrogen 2.783 N/A THR 61.A N VAL 48.A O no hydrogen 2.843 N/A VAL 63.A N LEU 50.A O no hydrogen 2.711 N/A GLU 67.A N GLU 70.A OE2 no hydrogen 3.082 N/A ILE 71.A N GLU 67.A O no hydrogen 2.765 N/A GLU 72.A N PRO 68.A O no hydrogen 2.865 N/A ARG 73.A N GLU 69.A O no hydrogen 2.962 N/A TRP 74.A N GLU 70.A O no hydrogen 3.257 N/A LEU 75.A N ILE 71.A O no hydrogen 2.973 N/A ARG 76.A N GLU 72.A O no hydrogen 3.000 N/A THR 77.A N TRP 74.A O no hydrogen 3.206 N/A THR 77.A OG1 TRP 74.A O no hydrogen 3.437 N/A ASP 81.A N LYS 3.A O no hydrogen 3.168 N/A VAL 82.A N LYS 3.A O no hydrogen 3.368 N/A VAL 83.A N ALA 101.A O no hydrogen 2.877 N/A HIS 84.A N ALA 5.A O no hydrogen 2.781 N/A HIS 84.A ND1 TYR 327.A OH no hydrogen 2.867 N/A HIS 84.A NE2 SER 105.A OG no hydrogen 2.751 N/A ASP 85.A N ILE 103.A O no hydrogen 2.718 N/A HIS 86.A N VAL 7.A O no hydrogen 2.890 N/A HIS 86.A ND1 HIS 107.A NE2 no hydrogen 3.035 N/A SER 87.A N ASP 85.A OD1 no hydrogen 3.030 N/A SER 87.A OG ASP 85.A OD1 no hydrogen 2.610 N/A SER 87.A OG ASP 85.A OD2 no hydrogen 3.072 N/A GLY 89.A N ASP 85.A OD2 no hydrogen 2.790 N/A LEU 96.A N PRO 93.A O no hydrogen 3.408 N/A THR 100.A N PRO 97.A O no hydrogen 3.002 N/A THR 100.A OG1 VAL 80.A O no hydrogen 3.111 N/A THR 100.A OG1 PRO 97.A O no hydrogen 3.179 N/A ALA 101.A N ASP 81.A O no hydrogen 2.846 N/A ILE 103.A N VAL 83.A O no hydrogen 2.951 N/A SER 104.A N GLY 117.A O no hydrogen 2.741 N/A SER 105.A N ASP 85.A O no hydrogen 2.773 N/A SER 105.A OG HIS 84.A NE2 no hydrogen 2.751 N/A SER 105.A OG TYR 323.A OH no hydrogen 2.490 N/A HIS 106.A N THR 119.A O no hydrogen 2.734 N/A HIS 106.A NE2 THR 110.A O no hydrogen 2.416 N/A HIS 107.A NE2 HIS 86.A ND1 no hydrogen 3.035 N/A THR 109.A OG1 CYS 246.A O no hydrogen 2.808 N/A ARG 111.A NE CYS 129.A O no hydrogen 3.191 N/A GLY 117.A N TRP 336.A O no hydrogen 3.211 N/A CYS 118.A SG THR 119.A O no hydrogen 3.592 N/A THR 119.A N SER 104.A O no hydrogen 3.001 N/A THR 119.A OG1 SER 104.A O no hydrogen 3.294 N/A THR 119.A OG1 TYR 323.A OH no hydrogen 3.360 N/A TYR 120.A N PRO 136.A O no hydrogen 3.112 N/A SER 121.A N GLN 125.A OE1 no hydrogen 2.809 N/A SER 121.A OG GLN 125.A OE1 no hydrogen 3.173 N/A SER 121.A OG PRO 248.A O no hydrogen 2.873 N/A SER 122.A OG PRO 248.A O no hydrogen 2.890 N/A ARG 123.A N GLU 273.A OE1 no hydrogen 3.063 N/A ALA 124.A N GLU 273.A OE2 no hydrogen 2.705 N/A GLN 125.A N SER 122.A OG no hydrogen 3.291 N/A GLN 125.A NE2 HIS 106.A O no hydrogen 2.793 N/A GLN 125.A NE2 PHE 108.A O no hydrogen 2.982 N/A ARG 126.A N SER 122.A O no hydrogen 2.942 N/A ARG 126.A NH1 ALA 135.A O no hydrogen 2.906 N/A ALA 127.A N ARG 123.A O no hydrogen 2.943 N/A HIS 128.A N ALA 124.A O no hydrogen 2.804 N/A CYS 129.A N GLN 125.A O no hydrogen 2.642 N/A CYS 129.A SG PHE 108.A O no hydrogen 3.805 N/A CYS 129.A SG THR 109.A O no hydrogen 3.801 N/A CYS 129.A SG THR 110.A O no hydrogen 3.324 N/A CYS 129.A SG GLN 125.A O no hydrogen 3.226 N/A GLY 130.A N ALA 127.A O no hydrogen 2.962 N/A GLY 131.A N ARG 126.A O no hydrogen 2.762 N/A ALA 135.A N GLY 132.A O no hydrogen 3.055 N/A ILE 138.A N TYR 120.A O no hydrogen 2.829 N/A VAL 142.A N TRP 314.A O no hydrogen 2.676 N/A ALA 145.A N ASP 143.A OD1 no hydrogen 3.234 N/A ARG 146.A N ASP 143.A O no hydrogen 2.977 N/A ARG 146.A NE ASP 39.A OD2 no hydrogen 2.939 N/A ARG 146.A NH2 ASP 39.A OD1 no hydrogen 2.967 N/A TYR 147.A N PRO 144.A O no hydrogen 3.048 N/A ARG 148.A NE ASP 222.A OD1 no hydrogen 2.829 N/A ARG 148.A NH1 GLU 218.A OE2 no hydrogen 3.487 N/A ARG 148.A NH2 ASP 222.A OD1 no hydrogen 2.696 N/A SER 149.A N ASP 152.A OD2 no hydrogen 2.846 N/A ASP 152.A N SER 149.A OG no hydrogen 3.178 N/A GLN 153.A N ALA 150.A O no hydrogen 2.851 N/A LYS 156.A NZ ALA 227.A O no hydrogen 3.064 N/A LYS 156.A NZ GLY 260.A O no hydrogen 2.809 N/A GLU 157.A N SER 226.A O no hydrogen 2.587 N/A LEU 160.A N ARG 185.A O no hydrogen 2.987 N/A LEU 161.A N ALA 229.A O no hydrogen 2.941 N/A PHE 162.A N VAL 187.A O no hydrogen 2.832 N/A GLY 164.A N ALA 189.A O no hydrogen 3.193 N/A VAL 166.A N PRO 191.A O no hydrogen 2.859 N/A SER 167.A N ARG 165.A O no hydrogen 2.682 N/A SER 167.A OG GLU 194.A OE2 no hydrogen 2.824 N/A LYS 170.A N SER 167.A O no hydrogen 3.223 N/A LYS 170.A NZ GLU 247.A OE1 no hydrogen 2.340 N/A GLY 171.A N PRO 168.A O no hydrogen 2.991 N/A LEU 173.A N TYR 197.A OH no hydrogen 2.859 N/A ALA 175.A N GLY 171.A O no hydrogen 2.946 N/A ALA 176.A N ALA 172.A O no hydrogen 2.915 N/A ALA 177.A N LEU 173.A O no hydrogen 2.863 N/A PHE 178.A N GLU 174.A O no hydrogen 2.597 N/A ALA 179.A N ALA 175.A O no hydrogen 2.825 N/A HIS 180.A N ALA 176.A O no hydrogen 3.037 N/A ALA 181.A N ALA 177.A O no hydrogen 3.199 N/A CYS 182.A N PHE 178.A O no hydrogen 3.179 N/A CYS 182.A SG PHE 178.A O no hydrogen 3.218 N/A GLY 183.A N HIS 180.A O no hydrogen 3.157 N/A ARG 184.A N ALA 179.A O no hydrogen 3.098 N/A ARG 184.A NH1 ASP 158.A O no hydrogen 2.504 N/A LEU 186.A N THR 208.A O no hydrogen 2.673 N/A VAL 187.A N LEU 160.A O no hydrogen 2.832 N/A LEU 188.A N GLU 210.A O no hydrogen 2.791 N/A ALA 189.A N PHE 162.A O no hydrogen 2.774 N/A GLY 190.A N GLY 213.A O no hydrogen 2.816 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.825 N/A TYR 197.A OH SER 167.A O no hydrogen 3.318 N/A PHE 198.A N GLU 194.A O no hydrogen 3.144 N/A ASP 199.A N PRO 195.A O no hydrogen 2.586 N/A ILE 201.A N TYR 197.A O no hydrogen 2.993 N/A THR 202.A N PHE 198.A O no hydrogen 3.066 N/A THR 202.A OG1 PHE 198.A O no hydrogen 3.561 N/A THR 202.A OG1 ASP 199.A O no hydrogen 3.247 N/A ARG 203.A N ASP 199.A O no hydrogen 3.063 N/A ARG 204.A N GLU 200.A O no hydrogen 3.077 N/A ARG 204.A NH2 THR 286.A OG1 no hydrogen 3.412 N/A TYR 205.A N ILE 201.A O no hydrogen 2.804 N/A THR 208.A N TYR 205.A O no hydrogen 3.191 N/A VAL 209.A N TYR 205.A O no hydrogen 3.109 N/A GLU 210.A N LEU 186.A O no hydrogen 2.844 N/A ILE 212.A N LEU 188.A O no hydrogen 3.214 N/A ARG 220.A N GLY 216.A O no hydrogen 3.012 N/A ARG 220.A NH1 TYR 147.A OH no hydrogen 3.566 N/A ARG 220.A NH2 TYR 147.A OH no hydrogen 2.945 N/A LEU 221.A N GLY 217.A O no hydrogen 3.272 N/A ASP 222.A N GLU 218.A O no hydrogen 3.013 N/A LEU 223.A N ARG 219.A O no hydrogen 2.914 N/A LEU 224.A N ARG 220.A O no hydrogen 2.947 N/A ALA 225.A N LEU 221.A O no hydrogen 3.145 N/A ALA 225.A N ASP 222.A O no hydrogen 3.107 N/A SER 226.A N ASP 222.A O no hydrogen 2.737 N/A SER 226.A OG ASP 222.A O no hydrogen 2.813 N/A ALA 227.A N LEU 223.A O no hydrogen 3.256 N/A HIS 228.A N PHE 159.A O no hydrogen 2.572 N/A VAL 230.A N PRO 262.A O no hydrogen 2.983 N/A LEU 231.A N LEU 161.A O no hydrogen 2.714 N/A ALA 232.A N VAL 264.A O no hydrogen 2.966 N/A SER 234.A OG GLU 247.A OE1 no hydrogen 2.954 N/A GLN 235.A N HIS 169.A O no hydrogen 3.041 N/A GLN 235.A NE2 MET 233.A O no hydrogen 2.790 N/A VAL 237.A N GLN 235.A O no hydrogen 2.728 N/A GLY 239.A N GLY 243.A O no hydrogen 3.007 N/A GLY 242.A N GLY 239.A O no hydrogen 2.636 N/A TRP 245.A N VAL 237.A O no hydrogen 2.667 N/A TRP 245.A NE1 GLU 247.A OE1 no hydrogen 2.992 N/A GLU 247.A N ASN 268.A OD1 no hydrogen 3.058 N/A THR 251.A OG1 GLU 255.A OE2 no hydrogen 3.087 N/A VAL 253.A N ALA 250.A O no hydrogen 3.279 N/A SER 254.A OG THR 251.A O no hydrogen 2.644 N/A GLU 255.A N THR 251.A O no hydrogen 3.462 N/A ALA 256.A N VAL 252.A O no hydrogen 2.929 N/A ALA 257.A N VAL 253.A O no hydrogen 2.916 N/A VAL 258.A N SER 254.A O no hydrogen 2.981 N/A SER 259.A N ALA 256.A O no hydrogen 2.830 N/A SER 259.A OG GLU 255.A O no hydrogen 2.525 N/A GLY 260.A N ALA 257.A O no hydrogen 3.054 N/A THR 261.A N ALA 256.A O no hydrogen 2.858 N/A THR 261.A OG1 LEU 224.A O no hydrogen 2.543 N/A THR 261.A OG1 ALA 227.A O no hydrogen 3.474 N/A VAL 263.A N VAL 278.A O no hydrogen 3.000 N/A VAL 264.A N VAL 230.A O no hydrogen 2.838 N/A GLY 265.A N GLU 280.A O no hydrogen 3.013 N/A THR 266.A N ALA 232.A O no hydrogen 3.202 N/A THR 266.A OG1 SER 234.A O no hydrogen 2.727 N/A ASN 268.A N THR 266.A OG1 no hydrogen 3.297 N/A ASN 268.A ND2 TRP 245.A O no hydrogen 3.417 N/A ASN 268.A ND2 TYR 284.A OH no hydrogen 2.781 N/A CYS 270.A N GLU 247.A O no hydrogen 2.621 N/A LEU 271.A N ASN 268.A O no hydrogen 2.973 N/A GLU 273.A N CYS 270.A O no hydrogen 2.551 N/A ILE 274.A N LEU 271.A O no hydrogen 3.103 N/A VAL 275.A N LEU 271.A O no hydrogen 3.022 N/A SER 277.A N ILE 274.A O no hydrogen 3.217 N/A VAL 278.A N VAL 275.A O no hydrogen 3.086 N/A GLU 280.A N VAL 263.A O no hydrogen 3.044 N/A VAL 282.A N GLY 265.A O no hydrogen 2.683 N/A GLY 285.A N GLN 235.A OE1 no hydrogen 3.021 N/A GLU 292.A N ALA 289.A O no hydrogen 2.917 N/A ALA 293.A N ALA 289.A O no hydrogen 3.055 N/A ALA 293.A N PRO 290.A O no hydrogen 3.004 N/A ARG 294.A N PRO 290.A O no hydrogen 2.868 N/A ARG 295.A N ASP 291.A O no hydrogen 2.913 N/A THR 296.A N GLU 292.A O no hydrogen 3.152 N/A THR 296.A OG1 GLU 280.A OE2 no hydrogen 2.704 N/A THR 296.A OG1 GLU 292.A O no hydrogen 2.915 N/A LEU 297.A N ALA 293.A O no hydrogen 2.754 N/A ALA 298.A N ARG 294.A O no hydrogen 2.981 N/A GLY 299.A N ARG 295.A O no hydrogen 2.852 N/A ALA 302.A N GLU 305.A OE1 no hydrogen 3.092 N/A SER 303.A OG GLY 260.A O no hydrogen 2.789 N/A VAL 306.A N ALA 302.A O no hydrogen 3.139 N/A ARG 307.A N SER 303.A O no hydrogen 3.098 N/A ARG 307.A NH1 VAL 258.A O no hydrogen 3.394 N/A ARG 308.A N ASP 304.A O no hydrogen 3.213 N/A ALA 309.A N GLU 305.A O no hydrogen 3.071 N/A ALA 310.A N VAL 306.A O no hydrogen 2.731 N/A VAL 311.A N ARG 307.A O no hydrogen 3.253 N/A ARG 312.A N ARG 308.A O no hydrogen 2.911 N/A LEU 313.A N ALA 309.A O no hydrogen 3.046 N/A TRP 314.A N ALA 310.A O no hydrogen 2.581 N/A GLY 315.A N VAL 311.A O no hydrogen 2.726 N/A HIS 316.A N VAL 142.A O no hydrogen 2.962 N/A HIS 316.A NE2 GLU 43.A OE1 no hydrogen 3.199 N/A ILE 319.A N GLY 315.A O no hydrogen 2.690 N/A ALA 320.A N HIS 316.A O no hydrogen 2.833 N/A ARG 322.A N THR 318.A O no hydrogen 3.425 N/A TYR 323.A N ILE 319.A O no hydrogen 3.342 N/A TYR 323.A OH SER 105.A OG no hydrogen 2.490 N/A TYR 323.A OH THR 119.A OG1 no hydrogen 3.360 N/A VAL 324.A N ALA 320.A O no hydrogen 2.988 N/A GLU 325.A N GLU 321.A O no hydrogen 2.900 N/A GLN 326.A N ARG 322.A O no hydrogen 3.210 N/A TYR 327.A N TYR 323.A O no hydrogen 2.755 N/A TYR 327.A OH HIS 84.A ND1 no hydrogen 2.867 N/A ARG 328.A N VAL 324.A O no hydrogen 3.037 N/A ARG 329.A N GLU 325.A O no hydrogen 3.250 N/A ARG 329.A NH1 GLN 326.A OE1 no hydrogen 2.738 N/A LEU 330.A N GLN 326.A O no hydrogen 3.062 N/A LEU 331.A N TYR 327.A O no hydrogen 3.032 N/A ALA 332.A N ARG 329.A O no hydrogen 3.105 N/A GLY 333.A N LEU 330.A O no hydrogen 2.600 N/A ALA 334.A N ARG 329.A O no hydrogen 2.962 N/A TRP 336.A NE1 CYS 118.A O no hydrogen 2.839 N/A