Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8sm9_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N THR 81.A OG1 no hydrogen 3.205 N/A VAL 2.A N THR 81.A OG1 no hydrogen 3.222 N/A ILE 3.A N LEU 334.A O no hydrogen 2.830 N/A ASP 4.A N TYR 82.A O no hydrogen 2.818 N/A THR 5.A N PHE 305.A O no hydrogen 3.100 N/A THR 5.A OG1 PHE 305.A O no hydrogen 2.539 N/A ASP 6.A N ASP 4.A OD1 no hydrogen 3.105 N/A HIS 8.A N TYR 309.A O no hydrogen 2.740 N/A HIS 8.A ND1 GLY 87.A O no hydrogen 2.651 N/A HIS 8.A NE2 HIS 184.A NE2 no hydrogen 3.036 N/A HIS 9.A NE2 THR 113.A OG1 no hydrogen 2.915 N/A ASP 10.A N GLY 64.A O no hydrogen 2.886 N/A ILE 11.A N ASP 10.A OD1 no hydrogen 2.714 N/A ALA 12.A N ASP 16.A OD2 no hydrogen 2.846 N/A ASP 15.A N SER 13.A OG no hydrogen 3.001 N/A ASP 16.A N SER 13.A O no hydrogen 2.896 N/A LEU 17.A N VAL 14.A O no hydrogen 3.210 N/A VAL 18.A N ASP 15.A O no hydrogen 3.376 N/A TYR 20.A N LEU 17.A O no hydrogen 2.777 N/A LEU 21.A N VAL 18.A O no hydrogen 3.185 N/A LYS 26.A N SER 22.A O no hydrogen 2.956 N/A LYS 26.A NZ VAL 18.A O no hydrogen 2.990 N/A LYS 26.A NZ LEU 21.A O no hydrogen 3.005 N/A ARG 27.A N HIS 24.A O no hydrogen 3.378 N/A TYR 28.A N TRP 25.A O no hydrogen 3.168 N/A ILE 29.A N LYS 26.A O no hydrogen 3.019 N/A THR 30.A N LYS 26.A O no hydrogen 2.775 N/A THR 30.A OG1 LYS 26.A O no hydrogen 3.266 N/A GLU 31.A N ARG 27.A O no hydrogen 2.706 N/A TYR 32.A N ARG 27.A O no hydrogen 2.980 N/A TRP 34.A N TYR 28.A O no hydrogen 2.842 N/A LYS 35.A NZ ASN 33.A OD1 no hydrogen 3.147 N/A LYS 35.A NZ TRP 34.A O no hydrogen 2.841 N/A THR 39.A N ASP 188.A OD1 no hydrogen 2.942 N/A THR 39.A OG1 ASP 188.A OD1 no hydrogen 2.934 N/A THR 40.A OG1 ALA 187.A O no hydrogen 2.572 N/A GLN 44.A N GLN 44.A OE1 no hydrogen 2.694 N/A ARG 46.A N GLN 44.A O no hydrogen 2.891 N/A ARG 46.A NE THR 49.A O no hydrogen 2.981 N/A THR 49.A N ARG 46.A O no hydrogen 3.079 N/A TYR 51.A N GLY 48.A O no hydrogen 2.897 N/A ARG 52.A N PRO 310.A O no hydrogen 2.871 N/A SER 55.A N ARG 52.A O no hydrogen 3.357 N/A SER 55.A OG ARG 52.A O no hydrogen 2.954 N/A LYS 60.A NZ GLU 58.A O no hydrogen 3.305 N/A SER 65.A N PRO 62.A O no hydrogen 2.931 N/A SER 65.A OG PRO 62.A O no hydrogen 2.570 N/A GLU 68.A N ASP 66.A OD1 no hydrogen 2.998 N/A LEU 70.A N ASP 66.A O no hydrogen 3.130 N/A LYS 71.A N PHE 67.A O no hydrogen 2.826 N/A LYS 71.A NZ ASP 76.A OD2 no hydrogen 3.452 N/A LYS 72.A N GLU 68.A O no hydrogen 2.805 N/A GLN 73.A N LEU 69.A O no hydrogen 2.664 N/A GLN 73.A NE2 ASP 54.A O no hydrogen 2.659 N/A LEU 74.A N LEU 70.A O no hydrogen 2.984 N/A LEU 75.A N LEU 70.A O no hydrogen 3.152 N/A ASP 76.A N LYS 71.A O no hydrogen 2.596 N/A GLU 77.A N LYS 72.A O no hydrogen 2.869 N/A HIS 78.A N LEU 74.A O no hydrogen 2.945 N/A HIS 78.A ND1 GLN 73.A O no hydrogen 3.294 N/A GLU 79.A N ASP 76.A O no hydrogen 2.992 N/A ILE 80.A N LEU 75.A O no hydrogen 3.019 N/A THR 81.A N VAL 2.A O no hydrogen 2.791 N/A THR 81.A OG1 VAL 2.A O no hydrogen 3.305 N/A TYR 82.A N VAL 2.A O no hydrogen 3.441 N/A GLY 83.A N ARG 123.A O no hydrogen 2.789 N/A VAL 84.A N ASP 4.A O no hydrogen 2.821 N/A LEU 85.A N LEU 125.A O no hydrogen 2.743 N/A GLY 86.A N ILE 7.A O no hydrogen 2.642 N/A GLY 87.A N HIS 9.A ND1 no hydrogen 3.251 N/A HIS 90.A ND1 SER 156.A OG no hydrogen 2.752 N/A ALA 92.A N PHE 89.A O no hydrogen 3.206 N/A THR 93.A OG1 ILE 130.A O no hydrogen 2.744 N/A THR 93.A OG1 SER 156.A OG no hydrogen 3.199 N/A VAL 94.A N HIS 90.A O no hydrogen 2.896 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.768 N/A ALA 102.A N TRP 98.A O no hydrogen 3.064 N/A ALA 103.A N PHE 99.A O no hydrogen 2.903 N/A ALA 104.A N GLU 100.A O no hydrogen 3.268 N/A ARG 105.A N PHE 101.A O no hydrogen 2.929 N/A ARG 105.A NE GLU 91.A OE1 no hydrogen 3.176 N/A ARG 105.A NE GLU 91.A OE2 no hydrogen 3.106 N/A ARG 105.A NH2 GLU 91.A OE1 no hydrogen 2.699 N/A ALA 106.A N ALA 102.A O no hydrogen 3.087 N/A ALA 107.A N ALA 103.A O no hydrogen 3.173 N/A ALA 108.A N ALA 104.A O no hydrogen 2.996 N/A TYR 109.A N ARG 105.A O no hydrogen 2.701 N/A TYR 109.A OH GLU 91.A OE2 no hydrogen 2.261 N/A ASN 110.A N ALA 106.A O no hydrogen 3.073 N/A ASN 110.A ND2 THR 129.A O no hydrogen 2.743 N/A ASN 110.A ND2 GLU 140.A OE2 no hydrogen 2.783 N/A ASP 111.A N ALA 107.A O no hydrogen 2.884 N/A TYR 112.A N ALA 108.A O no hydrogen 2.883 N/A TYR 112.A OH ASP 10.A O no hydrogen 2.635 N/A THR 113.A N TYR 109.A O no hydrogen 2.759 N/A THR 113.A OG1 HIS 9.A NE2 no hydrogen 2.915 N/A THR 113.A OG1 TYR 109.A O no hydrogen 2.965 N/A ILE 114.A N ASN 110.A O no hydrogen 2.758 N/A GLU 115.A N ASP 111.A O no hydrogen 2.889 N/A GLN 116.A N TYR 112.A O no hydrogen 2.945 N/A TRP 117.A N THR 113.A O no hydrogen 3.078 N/A TRP 117.A NE1 TYR 112.A OH no hydrogen 3.229 N/A LEU 118.A N THR 113.A O no hydrogen 2.880 N/A ASN 119.A N ILE 114.A O no hydrogen 2.973 N/A LYS 120.A N TRP 117.A O no hydrogen 3.076 N/A LYS 120.A NZ GLN 116.A O no hydrogen 2.910 N/A LYS 120.A NZ GLN 116.A OE1 no hydrogen 3.513 N/A ASP 121.A N LEU 118.A O no hydrogen 3.528 N/A ARG 123.A N ASP 121.A OD1 no hydrogen 2.973 N/A ARG 123.A NE ASP 121.A OD1 no hydrogen 3.143 N/A ARG 123.A NH1 ASP 76.A OD1 no hydrogen 2.676 N/A ARG 123.A NH2 ASP 76.A OD1 no hydrogen 3.080 N/A ARG 123.A NH2 ASP 121.A OD2 no hydrogen 3.085 N/A LEU 124.A N ASP 121.A O no hydrogen 3.464 N/A LEU 125.A N GLY 83.A O no hydrogen 2.607 N/A GLY 126.A N GLN 149.A O no hydrogen 2.926 N/A SER 127.A OG LEU 85.A O no hydrogen 2.608 N/A ILE 128.A N GLN 152.A O no hydrogen 2.698 N/A THR 129.A N ASN 110.A OD1 no hydrogen 2.585 N/A ALA 136.A N ASP 133.A OD2 no hydrogen 3.099 N/A ALA 137.A N ASP 133.A O no hydrogen 2.742 N/A VAL 138.A N PRO 134.A O no hydrogen 2.914 N/A ARG 139.A N VAL 135.A O no hydrogen 3.061 N/A GLU 140.A N ALA 136.A O no hydrogen 3.089 N/A ILE 141.A N ALA 137.A O no hydrogen 2.891 N/A ASP 142.A N VAL 138.A O no hydrogen 2.771 N/A ARG 143.A N GLU 140.A O no hydrogen 3.142 N/A ARG 143.A NE GLU 140.A OE1 no hydrogen 2.731 N/A ARG 143.A NE GLU 140.A OE2 no hydrogen 3.349 N/A ARG 143.A NH1 ASP 111.A OD1 no hydrogen 2.792 N/A ARG 143.A NH2 ASP 111.A OD1 no hydrogen 2.607 N/A ARG 143.A NH2 GLU 140.A OE2 no hydrogen 2.874 N/A VAL 144.A N GLU 140.A O no hydrogen 3.096 N/A GLY 145.A N ILE 141.A O no hydrogen 2.687 N/A HIS 147.A N VAL 144.A O no hydrogen 2.878 N/A HIS 147.A NE2 ASN 119.A OD1 no hydrogen 3.332 N/A GLN 149.A N HIS 147.A ND1 no hydrogen 2.877 N/A GLN 149.A NE2 LEU 118.A O no hydrogen 3.003 N/A GLN 149.A NE2 ASP 121.A O no hydrogen 3.274 N/A GLN 149.A NE2 LEU 124.A O no hydrogen 2.749 N/A MET 150.A N HIS 147.A O no hydrogen 3.056 N/A VAL 151.A N GLY 126.A O no hydrogen 3.096 N/A GLN 152.A NE2 SER 127.A OG no hydrogen 2.989 N/A VAL 153.A N ALA 180.A O no hydrogen 2.859 N/A MET 154.A N ILE 128.A O no hydrogen 2.992 N/A MET 155.A N GLY 182.A O no hydrogen 2.749 N/A SER 156.A OG HIS 90.A ND1 no hydrogen 2.752 N/A ILE 157.A N HIS 184.A O no hydrogen 2.871 N/A ASN 159.A ND2 ASP 188.A O no hydrogen 2.925 N/A TRP 162.A N GLN 214.A OE1 no hydrogen 2.973 N/A TRP 162.A NE1 SER 156.A O no hydrogen 2.776 N/A ASP 164.A N ALA 161.A O no hydrogen 3.208 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 3.265 N/A PHE 167.A N ASP 164.A O no hydrogen 2.712 N/A HIS 168.A N PRO 165.A O no hydrogen 3.208 N/A HIS 168.A NE2 GLY 163.A O no hydrogen 2.896 N/A ILE 170.A N PHE 167.A O no hydrogen 2.939 N/A GLU 172.A N HIS 168.A O no hydrogen 2.972 N/A ALA 173.A N PRO 169.A O no hydrogen 2.935 N/A ALA 174.A N ILE 170.A O no hydrogen 2.924 N/A GLU 175.A N PHE 171.A O no hydrogen 2.946 N/A ARG 176.A N GLU 172.A O no hydrogen 2.821 N/A HIS 177.A N ALA 173.A O no hydrogen 3.151 N/A HIS 177.A NE2 ASP 142.A OD1 no hydrogen 2.874 N/A GLY 178.A N GLU 175.A O no hydrogen 2.683 N/A LEU 179.A N ALA 174.A O no hydrogen 2.805 N/A ALA 180.A N VAL 151.A O no hydrogen 3.225 N/A ILE 181.A N LYS 231.A O no hydrogen 2.982 N/A GLY 182.A N VAL 153.A O no hydrogen 2.660 N/A MET 183.A N ALA 233.A O no hydrogen 2.852 N/A HIS 184.A ND1 LEU 185.A O no hydrogen 2.777 N/A HIS 184.A NE2 GLU 236.A OE1 no hydrogen 2.881 N/A LEU 185.A N TYR 211.A OH no hydrogen 2.689 N/A SER 186.A N ILE 157.A O no hydrogen 3.218 N/A SER 186.A OG ILE 157.A O no hydrogen 2.874 N/A ASP 188.A N SER 186.A OG no hydrogen 3.324 N/A THR 190.A N ASN 159.A OD1 no hydrogen 2.978 N/A THR 190.A OG1 ASN 159.A OD1 no hydrogen 3.016 N/A PHE 191.A N GLU 195.A O no hydrogen 3.188 N/A GLY 194.A N PHE 191.A O no hydrogen 2.509 N/A ARG 198.A NE TYR 199.A OH no hydrogen 3.491 N/A ARG 198.A NH2 TYR 199.A OH no hydrogen 3.494 N/A TYR 199.A N LEU 197.A O no hydrogen 2.851 N/A TRP 203.A N TYR 199.A O no hydrogen 3.045 N/A TRP 203.A NE1 ILE 189.A O no hydrogen 2.709 N/A ARG 204.A N TYR 200.A O no hydrogen 2.758 N/A ARG 204.A NH1 TYR 200.A OH no hydrogen 3.158 N/A ARG 204.A NH1 ASP 313.A OD2 no hydrogen 3.382 N/A ARG 204.A NH2 ASP 313.A OD2 no hydrogen 2.760 N/A ALA 205.A N VAL 201.A O no hydrogen 3.073 N/A ALA 206.A N ALA 202.A O no hydrogen 3.002 N/A ALA 206.A N TRP 203.A O no hydrogen 3.068 N/A HIS 207.A N TRP 203.A O no hydrogen 3.044 N/A GLN 209.A N ALA 206.A O no hydrogen 2.862 N/A ALA 210.A N HIS 207.A O no hydrogen 3.088 N/A TYR 211.A OH ILE 235.A O no hydrogen 2.668 N/A MET 212.A N PRO 208.A O no hydrogen 3.071 N/A THR 213.A N GLN 209.A O no hydrogen 3.007 N/A THR 213.A OG1 GLN 209.A O no hydrogen 3.501 N/A GLN 214.A N ALA 210.A O no hydrogen 3.092 N/A GLN 214.A NE2 PHE 160.A O no hydrogen 2.799 N/A VAL 215.A N TYR 211.A O no hydrogen 3.101 N/A ILE 216.A N MET 212.A O no hydrogen 3.112 N/A SER 217.A N THR 213.A O no hydrogen 2.805 N/A LEU 218.A N GLN 214.A O no hydrogen 2.827 N/A ILE 219.A N VAL 215.A O no hydrogen 3.078 N/A THR 220.A N ILE 216.A O no hydrogen 3.033 N/A THR 220.A OG1 ILE 216.A O no hydrogen 2.660 N/A ASN 221.A N SER 217.A O no hydrogen 3.164 N/A ASN 221.A ND2 SER 217.A O no hydrogen 3.134 N/A GLY 222.A N ILE 219.A O no hydrogen 2.877 N/A VAL 223.A N LEU 218.A O no hydrogen 3.109 N/A LYS 226.A N GLY 222.A O no hydrogen 2.916 N/A LYS 226.A NZ HIS 168.A ND1 no hydrogen 2.865 N/A TYR 227.A N VAL 223.A O no hydrogen 3.029 N/A LEU 230.A N TYR 227.A O no hydrogen 3.248 N/A VAL 232.A N ASN 274.A O no hydrogen 2.777 N/A ALA 233.A N ILE 181.A O no hydrogen 2.706 N/A LEU 234.A N ARG 276.A O no hydrogen 2.908 N/A ILE 235.A N MET 183.A O no hydrogen 2.993 N/A TRP 241.A NE1 GLY 237.A O no hydrogen 2.818 N/A VAL 242.A N PHE 239.A O no hydrogen 2.791 N/A MET 245.A N TRP 241.A O no hydrogen 3.023 N/A MET 246.A N VAL 242.A O no hydrogen 2.788 N/A ASN 247.A N PRO 243.A O no hydrogen 2.992 N/A ARG 248.A N PHE 244.A O no hydrogen 2.940 N/A MET 249.A N MET 245.A O no hydrogen 2.901 N/A ASP 250.A N MET 246.A O no hydrogen 2.999 N/A ALA 251.A N ASN 247.A O no hydrogen 2.921 N/A ALA 252.A N ARG 248.A O no hydrogen 3.092 N/A TYR 253.A N MET 249.A O no hydrogen 3.119 N/A TYR 253.A OH THR 260.A OG1 no hydrogen 2.750 N/A LYS 254.A N ASP 250.A O no hydrogen 3.168 N/A LYS 254.A N ALA 251.A O no hydrogen 3.213 N/A LEU 256.A N ALA 252.A O no hydrogen 3.159 N/A ARG 257.A NH1 VAL 263.A O no hydrogen 2.645 N/A ARG 257.A NH1 ARG 265.A O no hydrogen 2.760 N/A ARG 257.A NH2 ARG 265.A O no hydrogen 3.260 N/A GLN 258.A N GLN 258.A OE1 no hydrogen 2.588 N/A GLN 258.A NE2 GLY 255.A O no hydrogen 3.160 N/A GLU 259.A N LEU 256.A O no hydrogen 3.118 N/A THR 260.A N ARG 257.A O no hydrogen 3.033 N/A THR 260.A OG1 TYR 253.A OH no hydrogen 2.750 N/A TRP 262.A NE1 THR 220.A O no hydrogen 2.653 N/A VAL 263.A N THR 260.A O no hydrogen 3.068 N/A LYS 264.A N ASP 225.A OD1 no hydrogen 2.843 N/A ARG 265.A N TYR 270.A OH no hydrogen 2.907 N/A ARG 265.A NH1 ASP 273.A OD2 no hydrogen 2.434 N/A MET 266.A N ASP 269.A OD2 no hydrogen 2.692 N/A SER 268.A N ASP 250.A OD1 no hydrogen 2.974 N/A SER 268.A OG ASP 250.A OD1 no hydrogen 3.317 N/A SER 268.A OG ASP 250.A OD2 no hydrogen 2.587 N/A ASP 269.A N MET 266.A O no hydrogen 2.610 N/A TYR 270.A N PRO 267.A O no hydrogen 2.725 N/A TYR 270.A OH ASP 225.A OD1 no hydrogen 2.382 N/A PHE 271.A N PRO 267.A O no hydrogen 3.357 N/A ARG 272.A N SER 268.A O no hydrogen 3.202 N/A ARG 272.A NE MET 297.A O no hydrogen 2.850 N/A ASP 273.A N ASP 269.A O no hydrogen 2.886 N/A ASN 274.A N TYR 270.A O no hydrogen 2.760 N/A ASN 274.A ND2 PRO 228.A O no hydrogen 3.331 N/A ASN 274.A ND2 LEU 230.A O no hydrogen 2.930 N/A MET 275.A N PHE 271.A O no hydrogen 3.361 N/A ARG 276.A N VAL 232.A O no hydrogen 2.833 N/A ARG 276.A NH1 ARG 272.A O no hydrogen 2.620 N/A ARG 276.A NH1 MET 275.A O no hydrogen 2.734 N/A ARG 276.A NH2 ARG 272.A O no hydrogen 3.433 N/A PHE 277.A N MET 302.A O no hydrogen 2.736 N/A SER 278.A N LEU 234.A O no hydrogen 3.065 N/A SER 278.A OG SER 306.A OG no hydrogen 2.607 N/A THR 279.A N MET 304.A O no hydrogen 2.811 N/A THR 279.A OG1 MET 304.A O no hydrogen 3.373 N/A GLN 280.A N SER 278.A OG no hydrogen 3.245 N/A GLN 280.A NE2 ASP 313.A O no hydrogen 2.971 N/A TRP 282.A N ASP 315.A OD2 no hydrogen 2.908 N/A HIS 289.A N SER 286.A OG no hydrogen 3.095 N/A PHE 290.A N SER 286.A O no hydrogen 2.895 N/A LEU 291.A N ALA 287.A O no hydrogen 2.764 N/A ASP 292.A N LYS 288.A O no hydrogen 2.737 N/A ILE 293.A N HIS 289.A O no hydrogen 2.963 N/A ILE 294.A N PHE 290.A O no hydrogen 2.995 N/A ASP 295.A N LEU 291.A O no hydrogen 3.042 N/A MET 296.A N ASP 292.A O no hydrogen 2.945 N/A MET 297.A N ILE 293.A O no hydrogen 2.988 N/A MET 297.A N ILE 294.A O no hydrogen 3.208 N/A GLY 298.A N ILE 294.A O no hydrogen 3.263 N/A GLY 298.A N ASP 295.A O no hydrogen 2.990 N/A LYS 301.A N SER 299.A OG no hydrogen 2.911 N/A MET 304.A N PHE 277.A O no hydrogen 2.699 N/A SER 306.A OG SER 278.A OG no hydrogen 2.607 N/A THR 307.A N ASP 4.A OD1 no hydrogen 2.843 N/A THR 307.A OG1 ASP 4.A OD2 no hydrogen 2.266 N/A TYR 309.A N THR 307.A OG1 no hydrogen 3.302 N/A TYR 309.A OH GLN 73.A OE1 no hydrogen 2.489 N/A HIS 311.A N ASP 308.A O no hydrogen 2.669 N/A TRP 312.A N LYS 50.A O no hydrogen 2.577 N/A PHE 314.A N HIS 311.A O no hydrogen 2.936 N/A ASP 315.A N THR 307.A O no hydrogen 3.054 N/A ARG 319.A N ALA 316.A O no hydrogen 2.860 N/A ILE 325.A N PRO 322.A O no hydrogen 3.249 N/A LEU 329.A N SER 326.A OG no hydrogen 3.054 N/A LYS 330.A N SER 326.A O no hydrogen 2.960 N/A ASN 331.A N ASP 327.A O no hydrogen 3.044 N/A LYS 332.A N ASP 328.A O no hydrogen 3.094 N/A LYS 332.A NZ ASP 300.A OD2 no hydrogen 2.658 N/A LYS 332.A NZ ASP 328.A OD2 no hydrogen 3.264 N/A ILE 333.A N LEU 329.A O no hydrogen 3.009 N/A LEU 334.A N LYS 330.A O no hydrogen 2.870 N/A TYR 335.A N ASN 331.A O no hydrogen 2.898 N/A GLU 336.A N ASN 331.A O no hydrogen 2.926 N/A ASN 337.A N LYS 332.A O no hydrogen 2.834 N/A ASN 337.A ND2 ASP 300.A O no hydrogen 2.851 N/A ASN 337.A ND2 LEU 303.A O no hydrogen 2.970 N/A ARG 339.A N TYR 335.A O no hydrogen 2.855 N/A ARG 339.A NE GLU 336.A OE2 no hydrogen 2.937 N/A ARG 339.A NH1 LEU 344.A O no hydrogen 2.899 N/A ARG 339.A NH2 GLU 336.A OE2 no hydrogen 3.137 N/A GLU 340.A N GLU 336.A O no hydrogen 2.865 N/A LEU 341.A N ASN 337.A O no hydrogen 3.121 N/A TYR 342.A N ALA 338.A O no hydrogen 2.942 N/A TYR 342.A OH GLN 152.A OE1 no hydrogen 2.345 N/A ASN 343.A N GLU 340.A O no hydrogen 3.402 N/A LEU 344.A N ARG 339.A O no hydrogen 3.041 N/A