Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kpq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 126.A OD2 no hydrogen 2.902 N/A SER 2.A OG ASP 129.A OD1 no hydrogen 3.310 N/A SER 2.A OG ASP 129.A OD2 no hydrogen 2.716 N/A LEU 4.A N SER 2.A OG no hydrogen 3.163 N/A LYS 6.A NZ ASP 10.A OD1 no hydrogen 3.292 N/A GLN 9.A N PRO 5.A O no hydrogen 3.074 N/A GLN 9.A NE2 SER 2.A O no hydrogen 3.654 N/A GLN 9.A NE2 LEU 4.A O no hydrogen 2.679 N/A ASP 10.A N LYS 6.A O no hydrogen 2.867 N/A LEU 11.A N PRO 7.A O no hydrogen 3.074 N/A ILE 12.A N VAL 8.A O no hydrogen 3.052 N/A LYS 13.A N GLN 9.A O no hydrogen 3.042 N/A LYS 13.A NZ ASP 10.A OD1 no hydrogen 3.559 N/A MET 14.A N ASP 10.A O no hydrogen 3.040 N/A ILE 15.A N LEU 11.A O no hydrogen 3.051 N/A PHE 16.A N ILE 12.A O no hydrogen 3.260 N/A ASP 17.A N MET 14.A O no hydrogen 3.407 N/A GLU 19.A N ASP 17.A OD1 no hydrogen 3.208 N/A MET 21.A N ASP 17.A O no hydrogen 3.265 N/A LYS 22.A N VAL 18.A O no hydrogen 3.259 N/A LYS 23.A N GLU 19.A O no hydrogen 2.944 N/A LYS 23.A NZ ASP 252.A OD2 no hydrogen 3.134 N/A ALA 24.A N SER 20.A O no hydrogen 3.059 N/A MET 25.A N MET 21.A O no hydrogen 3.105 N/A VAL 26.A N LYS 22.A O no hydrogen 3.112 N/A GLU 27.A N LYS 23.A O no hydrogen 3.056 N/A TYR 28.A N ALA 24.A O no hydrogen 3.313 N/A TYR 28.A N MET 25.A O no hydrogen 3.035 N/A TYR 28.A OH GLU 101.A OE2 no hydrogen 3.008 N/A GLU 29.A N VAL 26.A O no hydrogen 3.034 N/A ILE 30.A N MET 25.A O no hydrogen 3.332 N/A ASP 31.A N PRO 79.A O no hydrogen 3.051 N/A LYS 34.A N ASP 31.A OD1 no hydrogen 3.224 N/A MET 35.A N ASP 31.A O no hydrogen 2.743 N/A LYS 39.A N PRO 36.A O no hydrogen 3.059 N/A LEU 40.A N LEU 37.A O no hydrogen 3.409 N/A ILE 45.A N SER 41.A O no hydrogen 3.157 N/A GLN 46.A N LYS 42.A O no hydrogen 2.718 N/A ALA 47.A N ARG 43.A O no hydrogen 3.009 N/A ALA 48.A N GLN 44.A O no hydrogen 3.050 N/A TYR 49.A N ILE 45.A O no hydrogen 2.965 N/A TYR 49.A OH ASP 104.A OD1 no hydrogen 2.615 N/A SER 50.A N GLN 46.A O no hydrogen 3.059 N/A SER 50.A OG GLN 46.A O no hydrogen 3.400 N/A ILE 51.A N ALA 47.A O no hydrogen 2.956 N/A LEU 52.A N ALA 48.A O no hydrogen 2.805 N/A SER 53.A N TYR 49.A O no hydrogen 2.740 N/A SER 53.A OG TYR 49.A O no hydrogen 3.217 N/A SER 53.A OG GLU 221.A O no hydrogen 2.656 N/A GLU 54.A N SER 50.A O no hydrogen 3.123 N/A VAL 55.A N ILE 51.A O no hydrogen 3.102 N/A GLN 56.A N LEU 52.A O no hydrogen 3.060 N/A GLN 56.A NE2 SER 53.A O no hydrogen 3.197 N/A GLN 57.A N SER 53.A O no hydrogen 3.188 N/A ALA 58.A N GLU 54.A O no hydrogen 3.131 N/A VAL 59.A N VAL 55.A O no hydrogen 3.022 N/A SER 60.A N GLN 56.A O no hydrogen 3.053 N/A SER 60.A OG GLN 56.A O no hydrogen 3.275 N/A GLN 61.A N GLN 57.A O no hydrogen 3.213 N/A GLY 62.A N VAL 59.A O no hydrogen 3.419 N/A ILE 67.A N SER 63.A O no hydrogen 3.370 N/A ASP 69.A N GLN 66.A O no hydrogen 3.072 N/A LEU 70.A N GLN 66.A O no hydrogen 3.463 N/A SER 71.A N ILE 67.A O no hydrogen 2.770 N/A ASN 72.A N LEU 68.A O no hydrogen 2.847 N/A ARG 73.A N ASP 69.A O no hydrogen 3.076 N/A PHE 74.A N LEU 70.A O no hydrogen 3.220 N/A TYR 75.A N SER 71.A O no hydrogen 3.294 N/A TYR 75.A OH PRO 88.A O no hydrogen 2.771 N/A THR 76.A N ASN 72.A O no hydrogen 2.977 N/A THR 76.A OG1 ASN 72.A O no hydrogen 2.845 N/A LEU 77.A N ARG 73.A O no hydrogen 3.319 N/A ILE 78.A N PHE 74.A O no hydrogen 3.153 N/A HIS 80.A ND1 ILE 78.A O no hydrogen 2.743 N/A ASP 81.A N GLU 29.A O no hydrogen 3.010 N/A PHE 82.A N HIS 80.A O no hydrogen 3.086 N/A LYS 85.A N PHE 82.A O no hydrogen 2.816 N/A LEU 90.A N SER 71.A OG no hydrogen 2.997 N/A SER 95.A N ASN 92.A OD1 no hydrogen 2.791 N/A SER 95.A OG ASN 92.A OD1 no hydrogen 3.036 N/A VAL 96.A N ASN 92.A O no hydrogen 3.265 N/A GLN 97.A N ALA 93.A O no hydrogen 3.110 N/A ALA 98.A N ASP 94.A O no hydrogen 2.822 N/A LYS 99.A N SER 95.A O no hydrogen 3.116 N/A LYS 99.A NZ HIS 80.A NE2 no hydrogen 3.432 N/A ALA 100.A N VAL 96.A O no hydrogen 2.971 N/A GLU 101.A N GLN 97.A O no hydrogen 3.002 N/A MET 102.A N ALA 98.A O no hydrogen 3.263 N/A LEU 103.A N LYS 99.A O no hydrogen 3.001 N/A ASP 104.A N ALA 100.A O no hydrogen 3.006 N/A ASN 105.A N GLU 101.A O no hydrogen 3.160 N/A ASN 105.A ND2 GLU 101.A O no hydrogen 2.675 N/A LEU 106.A N MET 102.A O no hydrogen 2.793 N/A LEU 107.A N LEU 103.A O no hydrogen 3.052 N/A ASP 108.A N ASP 104.A O no hydrogen 3.431 N/A ILE 109.A N ASN 105.A O no hydrogen 3.062 N/A GLU 110.A N LEU 106.A O no hydrogen 2.893 N/A VAL 111.A N LEU 107.A O no hydrogen 3.335 N/A ALA 112.A N ASP 108.A O no hydrogen 3.216 N/A TYR 113.A N ILE 109.A O no hydrogen 2.853 N/A SER 114.A N GLU 110.A O no hydrogen 2.797 N/A SER 114.A OG GLU 110.A O no hydrogen 3.140 N/A SER 114.A OG VAL 111.A O no hydrogen 2.672 N/A LEU 115.A N VAL 111.A O no hydrogen 3.072 N/A LEU 116.A N ALA 112.A O no hydrogen 3.131 N/A ARG 117.A N TYR 113.A O no hydrogen 2.913 N/A GLY 118.A N SER 114.A O no hydrogen 2.759 N/A SER 124.A N ASP 122.A OD1 no hydrogen 3.092 N/A SER 124.A OG ASP 122.A OD1 no hydrogen 2.641 N/A SER 124.A OG ASP 122.A OD2 no hydrogen 3.523 N/A LYS 125.A N ASP 122.A O no hydrogen 3.171 N/A ILE 128.A N ASP 126.A OD1 no hydrogen 3.214 N/A VAL 130.A N ASP 126.A O no hydrogen 3.164 N/A ASN 131.A N PRO 127.A O no hydrogen 2.898 N/A TYR 132.A N ILE 128.A O no hydrogen 2.839 N/A GLU 133.A N ASP 129.A O no hydrogen 3.062 N/A LYS 134.A N ASN 131.A O no hydrogen 3.213 N/A LYS 134.A NZ LEU 115.A O no hydrogen 2.728 N/A LYS 134.A NZ GLY 118.A O no hydrogen 3.085 N/A LEU 135.A N TYR 132.A O no hydrogen 3.353 N/A LYS 136.A N GLU 133.A O no hydrogen 3.228 N/A THR 137.A OG1 LEU 135.A O no hydrogen 2.649 N/A ASP 138.A N GLU 178.A O no hydrogen 3.069 N/A ILE 139.A N TYR 132.A OH no hydrogen 3.029 N/A LYS 140.A N LYS 176.A O no hydrogen 2.933 N/A VAL 142.A N ILE 174.A O no hydrogen 2.858 N/A ARG 144.A NH2 ILE 172.A O no hydrogen 2.994 N/A SER 146.A N ASP 143.A O no hydrogen 3.393 N/A SER 146.A OG ASP 143.A O no hydrogen 2.831 N/A GLU 150.A N SER 146.A O no hydrogen 3.214 N/A ILE 151.A N GLU 147.A O no hydrogen 3.078 N/A ILE 152.A N GLU 148.A O no hydrogen 3.192 N/A ARG 153.A N ALA 149.A O no hydrogen 2.913 N/A ARG 153.A NH1 ARG 144.A O no hydrogen 3.089 N/A ARG 153.A NH2 ARG 144.A O no hydrogen 2.874 N/A LYS 154.A N GLU 150.A O no hydrogen 3.129 N/A TYR 155.A N ILE 151.A O no hydrogen 2.870 N/A TYR 155.A OH LEU 197.A O no hydrogen 2.794 N/A VAL 156.A N ILE 152.A O no hydrogen 3.064 N/A LYS 157.A N ARG 153.A O no hydrogen 2.833 N/A ASN 158.A N LYS 154.A O no hydrogen 2.921 N/A ASN 158.A ND2 LEU 309.A O no hydrogen 2.786 N/A THR 159.A OG1 TYR 155.A O no hydrogen 2.587 N/A HIS 160.A NE2 HIS 164.A O no hydrogen 2.651 N/A ALA 161.A N SER 240.A OG no hydrogen 2.992 N/A THR 163.A OG1 TYR 324.A OH no hydrogen 2.539 N/A HIS 164.A N ALA 161.A O no hydrogen 2.960 N/A HIS 164.A ND1 SER 240.A OG no hydrogen 2.737 N/A TYR 167.A OH ASN 244.A OD1 no hydrogen 2.934 N/A ASP 168.A N ASN 346.A O no hydrogen 3.142 N/A GLU 170.A N LYS 344.A O no hydrogen 2.991 N/A ILE 172.A N LYS 342.A O no hydrogen 2.862 N/A ASP 173.A N LYS 342.A O no hydrogen 3.470 N/A PHE 175.A N LEU 340.A O no hydrogen 2.764 N/A LYS 176.A N LYS 140.A O no hydrogen 2.720 N/A LYS 176.A NZ LYS 338.A O no hydrogen 3.567 N/A ILE 177.A N LYS 338.A O no hydrogen 3.000 N/A GLU 178.A N ASP 138.A O no hydrogen 3.036 N/A ARG 179.A NE GLU 182.A OE2 no hydrogen 2.713 N/A ARG 179.A NH2 GLU 182.A OE2 no hydrogen 3.181 N/A GLU 180.A N LYS 136.A O no hydrogen 3.083 N/A GLU 182.A N ARG 179.A O no hydrogen 3.253 N/A CYS 183.A SG.A ASN 336.A OD1 no hydrogen 3.516 N/A ARG 185.A N GLY 181.A O no hydrogen 3.102 N/A ARG 185.A NH2 VAL 335.A O no hydrogen 3.569 N/A TYR 186.A N GLU 182.A O no hydrogen 2.748 N/A TYR 186.A OH GLU 261.A OE2 no hydrogen 2.654 N/A LYS 187.A NZ GLN 184.A OE1 no hydrogen 3.261 N/A PHE 189.A N TYR 186.A O no hydrogen 2.758 N/A LYS 190.A N LYS 187.A O no hydrogen 3.258 N/A LEU 192.A N PHE 189.A O no hydrogen 3.046 N/A ASN 194.A ND2.A GLY 265.A O no hydrogen 2.950 N/A ASN 194.A ND2.B GLY 265.A O no hydrogen 2.973 N/A ARG 195.A NE LEU 192.A O no hydrogen 2.663 N/A ARG 195.A NH1 GLY 304.A O no hydrogen 3.401 N/A ARG 196.A N VAL 262.A O no hydrogen 3.040 N/A ARG 196.A NE ASN 194.A OD1.B no hydrogen 3.340 N/A ARG 196.A NH2 ASN 194.A OD1.B no hydrogen 2.709 N/A LEU 197.A N ASP 306.A O no hydrogen 2.973 N/A LEU 198.A N GLY 260.A O no hydrogen 2.956 N/A TRP 199.A N ALA 236.A O no hydrogen 2.875 N/A HIS 200.A N LEU 258.A O no hydrogen 3.095 N/A HIS 200.A ND1 TYR 234.A O no hydrogen 2.684 N/A ASN 206.A N ARG 203.A O no hydrogen 2.972 N/A ASN 206.A ND2 ASN 105.A OD1 no hydrogen 2.833 N/A ASN 206.A ND2 SER 202.A OG no hydrogen 2.800 N/A PHE 207.A N THR 204.A O no hydrogen 3.145 N/A ILE 210.A N ASN 206.A O no hydrogen 3.026 N/A LEU 211.A N PHE 207.A O no hydrogen 2.768 N/A SER 212.A N ALA 208.A O no hydrogen 2.887 N/A SER 212.A OG ALA 208.A O no hydrogen 2.840 N/A SER 212.A OG GLY 209.A O no hydrogen 3.136 N/A GLN 213.A N GLY 209.A O no hydrogen 2.723 N/A GLY 214.A N ILE 210.A O no hydrogen 2.645 N/A ARG 216.A NH2 ASP 108.A OD1 no hydrogen 2.884 N/A GLU 221.A N GLU 221.A OE2 no hydrogen 3.002 N/A ALA 222.A N PRO 219.A O no hydrogen 3.227 N/A THR 225.A N GLN 56.A OE1 no hydrogen 3.179 N/A THR 225.A OG1 GLN 56.A OE1 no hydrogen 2.797 N/A GLY 226.A N PRO 223.A O no hydrogen 2.846 N/A TYR 227.A N VAL 224.A O no hydrogen 3.457 N/A TYR 227.A OH ASP 104.A OD1 no hydrogen 2.874 N/A TYR 227.A OH ASP 104.A OD2 no hydrogen 3.322 N/A PHE 229.A N TYR 234.A OH no hydrogen 2.819 N/A GLY 230.A N TYR 227.A O no hydrogen 3.255 N/A LYS 231.A NZ PRO 219.A O no hydrogen 2.869 N/A LYS 231.A NZ ALA 222.A O no hydrogen 2.764 N/A GLY 232.A N GLY 230.A O no hydrogen 3.236 N/A ILE 233.A N VAL 329.A O no hydrogen 2.815 N/A TYR 234.A OH GLY 230.A O no hydrogen 2.640 N/A PHE 235.A N TYR 327.A O no hydrogen 2.706 N/A ALA 236.A N TRP 199.A O no hydrogen 3.045 N/A VAL 239.A N THR 159.A OG1 no hydrogen 3.011 N/A SER 240.A OG HIS 164.A ND1 no hydrogen 2.737 N/A LYS 241.A NZ TYR 324.A O no hydrogen 2.933 N/A LYS 241.A NZ ASN 325.A O no hydrogen 2.967 N/A LYS 241.A NZ GLU 326.A OE2 no hydrogen 2.954 N/A ALA 243.A N VAL 239.A O no hydrogen 2.775 N/A ASN 244.A N SER 240.A O no hydrogen 2.934 N/A TYR 245.A N SER 242.A O no hydrogen 3.007 N/A CYS 246.A N ALA 243.A O no hydrogen 3.057 N/A CYS 246.A SG SER 202.A O no hydrogen 3.997 N/A CYS 246.A SG LEU 256.A O no hydrogen 3.330 N/A HIS 247.A N ASN 244.A O no hydrogen 3.344 N/A SER 249.A N ASP 252.A O no hydrogen 3.128 N/A GLN 250.A N GLN 250.A OE1 no hydrogen 2.659 N/A GLN 250.A NE2 THR 349.A O no hydrogen 3.145 N/A ASP 252.A N SER 249.A O no hydrogen 3.048 N/A GLY 255.A N LEU 343.A O no hydrogen 2.827 N/A ILE 257.A N LEU 341.A O no hydrogen 3.121 N/A LEU 258.A N HIS 200.A O no hydrogen 2.820 N/A LEU 259.A N TYR 339.A O no hydrogen 2.980 N/A GLY 260.A N LEU 198.A O no hydrogen 3.028 N/A GLU 261.A N ASN 336.A O no hydrogen 2.733 N/A VAL 262.A N ARG 196.A O no hydrogen 2.875 N/A ALA 263.A N GLN 334.A O no hydrogen 3.029 N/A LEU 264.A N ASN 194.A O no hydrogen 3.032 N/A GLY 265.A N ASN 194.A O no hydrogen 3.380 N/A ASN 266.A ND2 GLY 282.A O no hydrogen 2.945 N/A TYR 268.A N SER 285.A O no hydrogen 2.774 N/A LEU 270.A N LYS 287.A O no hydrogen 2.985 N/A HIS 272.A ND1 SER 321.A OG no hydrogen 2.972 N/A SER 274.A N MET 228.A O no hydrogen 2.947 N/A HIS 275.A ND1 TYR 227.A O no hydrogen 2.702 N/A ILE 276.A N SER 274.A O no hydrogen 2.775 N/A LYS 283.A N PRO 280.A O no hydrogen 3.094 N/A LYS 283.A NZ ASN 266.A OD1 no hydrogen 3.158 N/A LYS 283.A NZ MET 267.A O no hydrogen 3.425 N/A HIS 284.A N ASN 266.A O no hydrogen 3.056 N/A SER 285.A OG LEU 264.A O no hydrogen 2.683 N/A VAL 286.A N ILE 328.A O no hydrogen 2.910 N/A LYS 287.A N TYR 268.A O no hydrogen 3.054 N/A GLY 288.A N GLU 326.A O no hydrogen 2.716 N/A LEU 289.A N LEU 270.A O no hydrogen 2.855 N/A GLY 290.A N ASN 325.A OD1 no hydrogen 2.871 N/A LYS 291.A N LEU 322.A O no hydrogen 2.895 N/A THR 292.A N LEU 323.A O no hydrogen 2.748 N/A THR 293.A N ILE 313.A O no hydrogen 2.832 N/A ASP 295.A N THR 311.A O no hydrogen 3.012 N/A SER 297.A N ASP 295.A OD1 no hydrogen 3.307 N/A SER 297.A OG ASP 295.A OD1 no hydrogen 2.924 N/A ALA 298.A N ASP 295.A O no hydrogen 3.046 N/A ILE 300.A N VAL 307.A O no hydrogen 3.236 N/A LEU 302.A N VAL 305.A O no hydrogen 2.906 N/A VAL 305.A N LEU 302.A O no hydrogen 3.123 N/A VAL 307.A N ILE 300.A O no hydrogen 2.620 N/A LEU 309.A N VAL 307.A O no hydrogen 2.880 N/A ILE 313.A N THR 293.A O no hydrogen 2.742 N/A SER 315.A N LYS 291.A O no hydrogen 2.961 N/A SER 315.A OG GLY 290.A O no hydrogen 2.657 N/A SER 315.A OG LYS 291.A O no hydrogen 2.796 N/A GLY 316.A N SER 314.A OG no hydrogen 3.255 N/A THR 320.A OG1 LYS 271.A O no hydrogen 3.360 N/A THR 320.A OG1 LEU 289.A O no hydrogen 2.549 N/A SER 321.A N LYS 271.A O no hydrogen 2.908 N/A SER 321.A OG LYS 271.A O no hydrogen 3.445 N/A SER 321.A OG HIS 272.A ND1 no hydrogen 2.972 N/A LEU 322.A N THR 320.A OG1 no hydrogen 3.276 N/A TYR 324.A OH THR 163.A OG1 no hydrogen 2.539 N/A ASN 325.A ND2 ASP 237.A OD2 no hydrogen 2.910 N/A ASN 325.A ND2 THR 293.A OG1 no hydrogen 2.921 N/A TYR 327.A N PHE 235.A O no hydrogen 2.771 N/A TYR 327.A OH ASP 237.A OD2 no hydrogen 2.751 N/A ILE 328.A N VAL 286.A O no hydrogen 2.977 N/A VAL 329.A N ILE 233.A O no hydrogen 3.226 N/A TYR 330.A OH PHE 229.A O no hydrogen 2.528 N/A ALA 333.A N ASP 331.A OD1 no hydrogen 3.239 N/A GLN 334.A N ASP 331.A O no hydrogen 3.039 N/A GLN 334.A NE2 ALA 263.A O no hydrogen 2.750 N/A GLN 334.A NE2 HIS 284.A O no hydrogen 3.024 N/A VAL 335.A N ILE 332.A O no hydrogen 3.346 N/A ASN 336.A N GLU 261.A O no hydrogen 2.949 N/A ASN 336.A ND2 GLU 182.A OE1 no hydrogen 2.910 N/A LEU 337.A N GLU 182.A OE1 no hydrogen 2.713 N/A LYS 338.A N LEU 259.A O no hydrogen 2.988 N/A LYS 338.A NZ GLU 261.A OE1 no hydrogen 3.025 N/A LYS 338.A NZ ASN 336.A OD1 no hydrogen 2.907 N/A TYR 339.A N LEU 259.A O no hydrogen 2.953 N/A TYR 339.A OH GLU 148.A OE1 no hydrogen 3.060 N/A LEU 340.A N PHE 175.A O no hydrogen 2.908 N/A LEU 341.A N ILE 257.A O no hydrogen 2.865 N/A LYS 342.A N ASP 173.A O no hydrogen 2.952 N/A LEU 343.A N GLY 255.A O no hydrogen 2.804 N/A LYS 344.A N GLU 170.A O no hydrogen 2.967 N/A LYS 344.A NZ GLU 170.A OE1 no hydrogen 3.119 N/A LYS 344.A NZ GLU 170.A OE2 no hydrogen 3.162 N/A PHE 345.A N PRO 253.A O no hydrogen 2.838 N/A ASN 346.A N ASP 168.A O no hydrogen 2.826 N/A ASN 346.A ND2.A GLU 170.A OE2 no hydrogen 3.267 N/A ASN 346.A ND2.A LYS 344.A O no hydrogen 3.318 N/A ASN 346.A ND2.B ASP 168.A OD2 no hydrogen 3.217 N/A LYS 348.A N ALA 166.A O no hydrogen 2.925 N/A