Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f76_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ILE 315.A O no hydrogen 2.719 N/A PHE 4.A N TYR 1.A O no hydrogen 2.948 N/A VAL 5.A N TYR 1.A O no hydrogen 3.316 N/A ARG 6.A N TYR 2.A O no hydrogen 2.675 N/A ARG 6.A NH1 PHE 316.A O no hydrogen 3.357 N/A LYS 7.A N PRO 3.A O no hydrogen 2.926 N/A ALA 8.A N PHE 4.A O no hydrogen 3.035 N/A LEU 9.A N VAL 5.A O no hydrogen 2.946 N/A PHE 10.A N ARG 6.A O no hydrogen 2.736 N/A GLN 11.A N ALA 8.A O no hydrogen 3.001 N/A LEU 12.A N LEU 9.A O no hydrogen 2.991 N/A ARG 16.A N ASP 13.A OD1 no hydrogen 2.936 N/A ALA 17.A N ASP 13.A O no hydrogen 2.805 N/A HIS 18.A N PRO 14.A O no hydrogen 3.135 N/A HIS 18.A NE2 LEU 62.A O no hydrogen 3.253 N/A GLU 19.A N GLU 15.A O no hydrogen 2.792 N/A PHE 20.A N ARG 16.A O no hydrogen 2.952 N/A THR 21.A N ALA 17.A O no hydrogen 3.004 N/A THR 21.A OG1 ALA 17.A O no hydrogen 2.848 N/A PHE 22.A N HIS 18.A O no hydrogen 2.870 N/A GLN 23.A N GLU 19.A O no hydrogen 2.900 N/A GLN 24.A N PHE 20.A O no hydrogen 3.166 N/A LEU 25.A N THR 21.A O no hydrogen 2.993 N/A ARG 26.A N PHE 22.A O no hydrogen 2.898 N/A ARG 26.A NH2 GLN 23.A OE1 no hydrogen 2.354 N/A ARG 27.A N GLN 23.A O no hydrogen 3.175 N/A ARG 27.A NH1 GLN 24.A OE1 no hydrogen 3.013 N/A ILE 28.A N LEU 25.A O no hydrogen 2.901 N/A THR 29.A N LEU 25.A O no hydrogen 2.711 N/A GLY 30.A N GLU 34.A OE2 no hydrogen 2.798 N/A THR 31.A N ILE 28.A O no hydrogen 2.976 N/A THR 31.A OG1 ILE 28.A O no hydrogen 2.809 N/A PHE 33.A N THR 31.A OG1 no hydrogen 3.096 N/A GLU 34.A N THR 31.A O no hydrogen 3.088 N/A ALA 35.A N PRO 32.A O no hydrogen 3.290 N/A LEU 36.A N PHE 33.A O no hydrogen 2.708 N/A VAL 37.A N GLU 34.A O no hydrogen 3.102 N/A ARG 38.A N GLU 34.A O no hydrogen 3.228 N/A GLN 39.A N ALA 74.A O no hydrogen 3.175 N/A LYS 44.A N LYS 53.A O no hydrogen 2.817 N/A LYS 44.A NZ VAL 326.A O no hydrogen 2.972 N/A LYS 44.A NZ THR 327.A O no hydrogen 3.196 N/A LYS 44.A NZ ILE 329.A O no hydrogen 2.594 N/A VAL 46.A N PHE 52.A O no hydrogen 2.867 N/A CYS 48.A N LEU 50.A O no hydrogen 2.937 N/A LEU 50.A N CYS 48.A O no hydrogen 2.914 N/A THR 51.A OG1 ASN 47.A OD1 no hydrogen 2.684 N/A PHE 52.A N VAL 46.A O no hydrogen 2.819 N/A LYS 53.A NZ ASP 129.A OD1 no hydrogen 3.132 N/A ASN 54.A ND2 GLY 75.A O no hydrogen 2.930 N/A LEU 56.A N ASN 54.A OD1 no hydrogen 2.837 N/A GLY 57.A N VAL 308.A O no hydrogen 2.810 N/A LEU 58.A N SER 78.A O no hydrogen 3.016 N/A ALA 59.A N ILE 310.A O no hydrogen 3.016 N/A GLY 61.A N GLY 82.A O no hydrogen 2.911 N/A GLY 66.A N ASP 63.A O no hydrogen 3.329 N/A GLU 67.A N ASP 63.A OD1 no hydrogen 2.773 N/A CYS 68.A N ASP 63.A OD2 no hydrogen 2.813 N/A ALA 71.A N THR 29.A OG1 no hydrogen 3.129 N/A LEU 72.A N CYS 68.A O no hydrogen 3.070 N/A GLY 73.A N ILE 69.A O no hydrogen 2.954 N/A ALA 74.A N ASP 70.A O no hydrogen 2.969 N/A GLY 77.A N LEU 56.A O no hydrogen 2.635 N/A ILE 79.A N VAL 131.A O no hydrogen 2.953 N/A GLU 80.A N LEU 58.A O no hydrogen 3.017 N/A ILE 81.A N GLY 133.A O no hydrogen 2.879 N/A GLY 82.A N ASP 63.A O no hydrogen 3.294 N/A THR 83.A OG1 ASN 135.A OD1 no hydrogen 2.430 N/A VAL 84.A N ASN 135.A O no hydrogen 2.960 N/A THR 85.A OG1 ARG 87.A O no hydrogen 2.797 N/A THR 85.A OG1 ASN 113.A OD1 no hydrogen 2.990 N/A THR 85.A OG1 ASN 139.A OD1 no hydrogen 3.321 N/A GLN 89.A N ASN 113.A O no hydrogen 3.042 N/A GLN 89.A NE2 ASN 139.A OD1 no hydrogen 2.981 N/A ASN 92.A ND2 ARG 109.A O no hydrogen 2.665 N/A ASN 92.A ND2 ASN 172.A O no hydrogen 3.656 N/A ARG 96.A NE ASN 92.A O no hydrogen 3.001 N/A ARG 96.A NH1 GLU 15.A OE2 no hydrogen 3.090 N/A ARG 96.A NH2 PRO 90.A O no hydrogen 2.664 N/A ARG 96.A NH2 ASN 92.A O no hydrogen 2.695 N/A PHE 98.A N ILE 107.A O no hydrogen 2.796 N/A ARG 99.A NH2 LEU 12.A O no hydrogen 2.503 N/A LEU 100.A N GLY 105.A O no hydrogen 2.899 N/A ALA 103.A N LEU 100.A O no hydrogen 2.987 N/A GLU 104.A N VAL 101.A O no hydrogen 3.125 N/A GLY 105.A N LEU 100.A O no hydrogen 3.064 N/A LEU 106.A N SER 260.A O no hydrogen 3.199 N/A ILE 107.A N PHE 98.A O no hydrogen 3.008 N/A ASN 108.A N GLY 258.A O no hydrogen 3.036 N/A ARG 109.A N ARG 96.A O no hydrogen 2.887 N/A ARG 109.A NH1 GLN 255.A OE1 no hydrogen 3.307 N/A ARG 109.A NH2 GLN 255.A OE1 no hydrogen 3.092 N/A ARG 109.A NH2 THR 256.A O no hydrogen 2.772 N/A ASN 113.A N GLN 89.A O no hydrogen 3.047 N/A LEU 114.A N ASP 65.A OD1 no hydrogen 2.750 N/A VAL 116.A N THR 85.A O no hydrogen 2.979 N/A LEU 119.A N GLY 115.A O no hydrogen 3.240 N/A VAL 120.A N VAL 116.A O no hydrogen 2.949 N/A GLU 121.A N ASP 117.A O no hydrogen 3.229 N/A ASN 122.A N ASN 118.A O no hydrogen 3.071 N/A ASN 122.A ND2 ASP 65.A O no hydrogen 2.764 N/A VAL 123.A N LEU 119.A O no hydrogen 2.938 N/A LYS 124.A N VAL 120.A O no hydrogen 3.083 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 3.166 N/A LYS 125.A N ASN 122.A O no hydrogen 3.086 N/A ALA 126.A N VAL 123.A O no hydrogen 3.050 N/A HIS 127.A N ASP 70.A OD1 no hydrogen 2.659 N/A HIS 127.A N ASP 70.A OD2 no hydrogen 3.382 N/A TYR 128.A OH PHE 76.A O no hydrogen 2.903 N/A VAL 131.A N GLY 77.A O no hydrogen 3.399 N/A GLY 133.A N ILE 79.A O no hydrogen 2.800 N/A ILE 134.A N TYR 163.A O no hydrogen 3.002 N/A ASN 135.A N ILE 81.A O no hydrogen 2.864 N/A ASN 135.A ND2 GLU 80.A OE1 no hydrogen 2.914 N/A ILE 136.A N ALA 165.A O no hydrogen 2.888 N/A GLY 137.A N VAL 84.A O no hydrogen 2.999 N/A LYS 138.A NZ ASN 139.A O no hydrogen 2.770 N/A LYS 138.A NZ THR 142.A O no hydrogen 2.651 N/A ASN 139.A N ASP 150.A OD2 no hydrogen 3.038 N/A THR 142.A N ASN 139.A O no hydrogen 3.266 N/A THR 142.A OG1 ASP 150.A OD1 no hydrogen 3.566 N/A THR 142.A OG1 ASP 150.A OD2 no hydrogen 2.534 N/A GLN 146.A N PRO 143.A O no hydrogen 2.569 N/A GLY 147.A N VAL 144.A O no hydrogen 3.195 N/A ASP 149.A N GLN 146.A O no hydrogen 3.369 N/A ASP 150.A N GLY 147.A O no hydrogen 2.929 N/A TYR 151.A OH ASN 167.A O no hydrogen 2.702 N/A LEU 152.A N LYS 148.A O no hydrogen 3.090 N/A ILE 153.A N ASP 149.A O no hydrogen 2.821 N/A CYS 154.A N ASP 150.A O no hydrogen 3.141 N/A CYS 154.A SG ASP 150.A O no hydrogen 3.401 N/A LYS 156.A NZ ASP 117.A OD1 no hydrogen 3.164 N/A LYS 156.A NZ ASP 117.A OD2 no hydrogen 3.462 N/A ILE 157.A N CYS 154.A O no hydrogen 3.005 N/A TYR 158.A OH LYS 204.A O no hydrogen 2.616 N/A TYR 160.A N ILE 157.A O no hydrogen 2.709 N/A GLY 162.A N LEU 132.A O no hydrogen 2.610 N/A TYR 163.A N LEU 132.A O no hydrogen 3.245 N/A TYR 163.A OH GLU 80.A OE2 no hydrogen 2.568 N/A ILE 164.A N PRO 207.A O no hydrogen 2.932 N/A ALA 165.A N ILE 134.A O no hydrogen 2.757 N/A ILE 166.A N ALA 209.A O no hydrogen 2.749 N/A ASN 167.A N ILE 136.A O no hydrogen 2.979 N/A ASN 167.A ND2 THR 83.A OG1 no hydrogen 2.936 N/A SER 169.A N ASN 167.A OD1 no hydrogen 2.950 N/A SER 169.A OG ASN 167.A OD1 no hydrogen 3.489 N/A SER 169.A OG LYS 211.A O no hydrogen 2.584 N/A SER 170.A N ASN 167.A OD1 no hydrogen 3.190 N/A ASN 172.A N SER 170.A OG no hydrogen 3.139 N/A ASN 172.A ND2 ASN 108.A O no hydrogen 3.318 N/A LEU 176.A N THR 173.A O no hydrogen 3.001 N/A ARG 177.A NE SER 169.A O no hydrogen 2.747 N/A ARG 177.A NH1 ASP 215.A OD2 no hydrogen 3.006 N/A ARG 177.A NH2 SER 169.A O no hydrogen 3.179 N/A ARG 177.A NH2 THR 241.A O no hydrogen 2.740 N/A THR 178.A N GLY 175.A O no hydrogen 3.072 N/A THR 178.A OG1 GLY 175.A O no hydrogen 2.515 N/A LEU 179.A N LEU 176.A O no hydrogen 3.422 N/A GLN 180.A N ARG 177.A O no hydrogen 3.136 N/A GLN 180.A NE2 ARG 177.A O no hydrogen 3.080 N/A TYR 181.A N THR 178.A O no hydrogen 3.205 N/A LEU 185.A N GLY 182.A O no hydrogen 3.016 N/A ASP 186.A N GLY 182.A O no hydrogen 3.191 N/A ASP 187.A N GLU 183.A O no hydrogen 2.789 N/A LEU 188.A N ALA 184.A O no hydrogen 3.314 N/A LEU 189.A N LEU 185.A O no hydrogen 2.908 N/A THR 190.A N ASP 186.A O no hydrogen 2.930 N/A THR 190.A OG1 ASP 186.A O no hydrogen 2.759 N/A ALA 191.A N ASP 187.A O no hydrogen 3.080 N/A ILE 192.A N LEU 188.A O no hydrogen 2.907 N/A LYS 193.A N LEU 189.A O no hydrogen 2.910 N/A LYS 193.A NZ GLN 196.A OE1 no hydrogen 2.687 N/A LYS 193.A NZ ASN 232.A O no hydrogen 3.117 N/A ASN 194.A N THR 190.A O no hydrogen 3.067 N/A LYS 195.A N ALA 191.A O no hydrogen 2.834 N/A LYS 195.A NZ GLU 155.A OE2 no hydrogen 2.741 N/A GLN 196.A N ILE 192.A O no hydrogen 2.915 N/A GLN 196.A NE2 VAL 206.A O no hydrogen 2.895 N/A GLN 196.A NE2 ASP 234.A OD2 no hydrogen 3.032 N/A ASN 197.A N LYS 193.A O no hydrogen 2.919 N/A ASP 198.A N ASN 194.A O no hydrogen 3.031 N/A LEU 199.A N LYS 195.A O no hydrogen 2.889 N/A GLN 200.A N GLN 196.A O no hydrogen 2.899 N/A ALA 201.A N ASN 197.A O no hydrogen 3.331 N/A LYS 204.A N GLN 200.A O no hydrogen 3.336 N/A TYR 205.A OH ASP 234.A OD1 no hydrogen 2.631 N/A TYR 205.A OH ASP 234.A OD2 no hydrogen 3.240 N/A VAL 206.A N TYR 158.A OH no hydrogen 3.033 N/A ILE 208.A N ASP 234.A OD2 no hydrogen 2.683 N/A ALA 209.A N ILE 164.A O no hydrogen 2.784 N/A VAL 210.A N GLY 235.A O no hydrogen 3.018 N/A LYS 211.A N ILE 166.A O no hydrogen 2.988 N/A ILE 212.A N ILE 237.A O no hydrogen 3.105 N/A ALA 213.A N GLN 180.A OE1 no hydrogen 3.332 N/A SER 217.A N GLU 220.A OE1 no hydrogen 2.651 N/A GLU 220.A N SER 217.A OG no hydrogen 3.321 N/A LEU 221.A N SER 217.A O no hydrogen 2.804 N/A ILE 222.A N GLU 218.A O no hydrogen 3.073 N/A GLN 223.A N GLU 219.A O no hydrogen 3.043 N/A VAL 224.A N GLU 220.A O no hydrogen 2.911 N/A ALA 225.A N LEU 221.A O no hydrogen 3.063 N/A ASP 226.A N ILE 222.A O no hydrogen 2.954 N/A SER 227.A N GLN 223.A O no hydrogen 2.900 N/A SER 227.A OG ASP 186.A OD1 no hydrogen 2.700 N/A LEU 228.A N VAL 224.A O no hydrogen 2.893 N/A VAL 229.A N ALA 225.A O no hydrogen 3.088 N/A ARG 230.A N ASP 226.A O no hydrogen 2.923 N/A ARG 230.A NH2 ASP 186.A OD1 no hydrogen 2.999 N/A HIS 231.A N SER 227.A O no hydrogen 3.054 N/A HIS 231.A NE2 ASP 186.A OD1 no hydrogen 3.220 N/A ASN 232.A N VAL 229.A O no hydrogen 3.041 N/A ILE 233.A N LEU 228.A O no hydrogen 2.971 N/A GLY 235.A N ILE 208.A O no hydrogen 3.182 N/A VAL 236.A N PRO 284.A O no hydrogen 3.159 N/A ILE 237.A N VAL 210.A O no hydrogen 2.816 N/A ALA 238.A N ILE 286.A O no hydrogen 2.913 N/A THR 239.A N VAL 288.A O no hydrogen 2.776 N/A ASN 240.A N ILE 212.A O no hydrogen 3.090 N/A ASN 240.A ND2 SER 169.A OG no hydrogen 2.873 N/A THR 241.A N ASN 240.A OD1 no hydrogen 2.646 N/A THR 241.A OG1 ASN 240.A OD1 no hydrogen 3.494 N/A THR 242.A N LEU 259.A O no hydrogen 3.077 N/A THR 242.A OG1 ASP 215.A OD1 no hydrogen 2.608 N/A THR 242.A OG1 ASP 215.A OD2 no hydrogen 3.410 N/A LEU 243.A N ASP 215.A OD2 no hydrogen 2.893 N/A ASP 244.A N THR 242.A OG1 no hydrogen 2.915 N/A ARG 245.A NE CYS 253.A O no hydrogen 3.178 N/A ARG 245.A NH1 THR 242.A O no hydrogen 3.397 N/A ARG 245.A NH1 ASP 244.A O no hydrogen 2.994 N/A ARG 245.A NH2 GLN 255.A O no hydrogen 3.016 N/A ARG 245.A NH2 GLY 257.A O no hydrogen 2.864 N/A SER 246.A N ASP 244.A OD2 no hydrogen 2.908 N/A SER 246.A OG ASP 244.A OD1 no hydrogen 3.128 N/A SER 246.A OG ASP 244.A OD2 no hydrogen 3.196 N/A VAL 248.A N ARG 245.A O no hydrogen 3.138 N/A ASN 252.A ND2 ARG 99.A O no hydrogen 2.975 N/A GLN 255.A N ASN 252.A O no hydrogen 3.227 N/A GLY 258.A N ASN 108.A O no hydrogen 2.734 N/A LEU 259.A N THR 242.A O no hydrogen 2.774 N/A SER 260.A N LEU 106.A O no hydrogen 2.782 N/A SER 260.A OG LEU 106.A O no hydrogen 3.469 N/A SER 260.A OG SER 312.A OG no hydrogen 2.766 N/A ARG 262.A N GLU 104.A O no hydrogen 3.156 N/A ARG 262.A NH2 ARG 262.A O no hydrogen 2.883 N/A LEU 264.A N GLY 261.A O no hydrogen 2.884 N/A GLN 265.A N ARG 262.A O no hydrogen 3.109 N/A GLN 265.A NE2 GLY 290.A O no hydrogen 2.775 N/A SER 268.A N LEU 264.A O no hydrogen 2.953 N/A SER 268.A OG VAL 288.A O no hydrogen 2.731 N/A THR 269.A N GLN 265.A O no hydrogen 3.072 N/A THR 269.A OG1 GLN 265.A O no hydrogen 3.045 N/A GLU 270.A N LEU 266.A O no hydrogen 2.930 N/A ILE 271.A N LYS 267.A O no hydrogen 3.043 N/A ILE 272.A N SER 268.A O no hydrogen 3.010 N/A ARG 273.A N THR 269.A O no hydrogen 3.040 N/A ARG 273.A NH1 GLU 270.A OE1 no hydrogen 3.229 N/A ARG 274.A N GLU 270.A O no hydrogen 3.107 N/A LEU 275.A N ILE 271.A O no hydrogen 2.811 N/A SER 276.A N ILE 272.A O no hydrogen 2.737 N/A LEU 277.A N ARG 273.A O no hydrogen 3.063 N/A GLU 278.A N ARG 274.A O no hydrogen 3.143 N/A LEU 279.A N LEU 275.A O no hydrogen 2.883 N/A ASN 280.A N SER 276.A O no hydrogen 2.992 N/A ARG 282.A N LEU 279.A O no hydrogen 2.990 N/A ARG 282.A NE LEU 279.A O no hydrogen 2.961 N/A ARG 282.A NH2 GLU 278.A O no hydrogen 2.920 N/A ILE 286.A N VAL 236.A O no hydrogen 2.861 N/A GLY 287.A N LEU 307.A O no hydrogen 2.814 N/A VAL 288.A N ALA 238.A O no hydrogen 2.665 N/A ALA 296.A N SER 293.A OG no hydrogen 3.185 N/A ALA 297.A N SER 293.A O no hydrogen 3.049 N/A ARG 298.A N VAL 294.A O no hydrogen 2.947 N/A ARG 298.A NE HIS 328.A O no hydrogen 3.185 N/A ARG 298.A NE ILE 329.A OXT no hydrogen 3.294 N/A ARG 298.A NH2 HIS 328.A O no hydrogen 2.542 N/A GLU 299.A N ILE 295.A O no hydrogen 2.837 N/A LYS 300.A N ALA 296.A O no hydrogen 3.212 N/A LYS 300.A NZ GLN 265.A O no hydrogen 3.236 N/A LYS 300.A NZ THR 269.A OG1 no hydrogen 2.725 N/A LYS 300.A NZ GLY 289.A O no hydrogen 2.909 N/A ILE 301.A N ALA 297.A O no hydrogen 3.067 N/A ALA 302.A N ARG 298.A O no hydrogen 2.886 N/A ALA 303.A N GLU 299.A O no hydrogen 2.832 N/A GLY 304.A N LYS 300.A O no hydrogen 3.205 N/A GLY 304.A N ILE 301.A O no hydrogen 3.079 N/A ALA 305.A N LYS 300.A O no hydrogen 3.107 N/A SER 306.A N ILE 285.A O no hydrogen 2.776 N/A VAL 308.A N PRO 55.A O no hydrogen 2.882 N/A GLN 309.A N GLY 287.A O no hydrogen 2.991 N/A GLN 309.A NE2 GLU 80.A OE2 no hydrogen 3.009 N/A ILE 310.A N GLY 57.A O no hydrogen 3.019 N/A TYR 311.A OH GLY 61.A O no hydrogen 3.278 N/A SER 312.A OG SER 260.A OG no hydrogen 2.766 N/A PHE 314.A N TYR 311.A O no hydrogen 2.844 N/A ILE 315.A N TYR 311.A O no hydrogen 3.204 N/A ILE 315.A N SER 312.A O no hydrogen 2.835 N/A PHE 316.A N SER 312.A O no hydrogen 3.032 N/A LYS 317.A N GLY 313.A O no hydrogen 2.842 N/A GLY 318.A N PHE 314.A O no hydrogen 2.720 N/A LEU 321.A N GLY 318.A O no hydrogen 3.076 N/A LYS 323.A N PRO 319.A O no hydrogen 3.427 N/A LYS 323.A NZ LYS 40.A O no hydrogen 2.986 N/A GLU 324.A N PRO 320.A O no hydrogen 2.959 N/A ILE 325.A N LEU 321.A O no hydrogen 2.974 N/A VAL 326.A N ILE 322.A O no hydrogen 3.067 N/A THR 327.A N LYS 323.A O no hydrogen 2.977 N/A THR 327.A OG1 LYS 323.A O no hydrogen 2.657 N/A HIS 328.A N GLU 324.A O no hydrogen 2.963 N/A ILE 329.A N ILE 325.A O no hydrogen 2.630 N/A