Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ptd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLN 15.A O no hydrogen 3.307 N/A ALA 1.A N PRO 16.A O no hydrogen 2.939 N/A SER 3.A N GLU 6.A OE2 no hydrogen 2.866 N/A ASN 5.A N SER 3.A OG no hydrogen 2.874 N/A ASN 5.A ND2 SER 3.A OG no hydrogen 2.693 N/A LEU 7.A N VAL 4.A O no hydrogen 3.258 N/A GLU 8.A N ASN 5.A O no hydrogen 3.189 N/A SER 11.A OG ASP 60.A OD1 no hydrogen 3.014 N/A LYS 12.A N ASN 9.A O no hydrogen 3.092 N/A TRP 13.A N TRP 10.A O no hydrogen 3.407 N/A TRP 13.A NE1 GLY 62.A O no hydrogen 2.892 N/A MET 14.A N GLU 108.A OE1 no hydrogen 3.386 N/A GLN 15.A N LYS 12.A O no hydrogen 2.753 N/A ILE 21.A N PRO 18.A O no hydrogen 3.057 N/A LEU 23.A N ILE 149.A O no hydrogen 2.789 N/A ARG 25.A NE ARG 25.A O no hydrogen 2.893 N/A ARG 25.A NH1 GLU 223.A OE2 no hydrogen 2.910 N/A ARG 25.A NH2 ARG 25.A O no hydrogen 3.325 N/A ARG 25.A NH2 ALA 266.A O no hydrogen 2.960 N/A SER 27.A N ASN 292.A OD1 no hydrogen 2.862 N/A ILE 28.A N GLY 269.A O no hydrogen 3.426 N/A GLY 30.A N VAL 271.A O no hydrogen 3.270 N/A THR 31.A N ILE 65.A O no hydrogen 3.014 N/A THR 31.A OG1 SER 34.A OG no hydrogen 2.730 N/A THR 31.A OG1 GLN 58.A OE1 no hydrogen 3.007 N/A HIS 32.A N GLN 273.A O no hydrogen 2.791 N/A HIS 32.A ND1 ASP 274.A OD1 no hydrogen 2.566 N/A ASP 33.A N ASP 67.A OD2 no hydrogen 2.774 N/A SER 34.A N ASP 67.A O no hydrogen 3.136 N/A SER 34.A OG THR 31.A O no hydrogen 3.242 N/A SER 34.A OG THR 31.A OG1 no hydrogen 2.730 N/A SER 34.A OG ASP 67.A O no hydrogen 3.347 N/A THR 36.A N ASP 33.A O no hydrogen 3.430 N/A THR 36.A OG1 ASP 33.A O no hydrogen 2.794 N/A THR 36.A OG1 THR 50.A OG1 no hydrogen 3.004 N/A LYS 38.A NZ TYR 88.A O no hydrogen 2.721 N/A LYS 38.A NZ GLU 93.A OE2 no hydrogen 2.644 N/A LEU 39.A N THR 36.A O no hydrogen 3.368 N/A LYS 44.A N ASN 41.A O no hydrogen 2.631 N/A GLN 45.A N ASN 41.A O no hydrogen 3.046 N/A GLN 45.A NE2 LEU 39.A O no hydrogen 3.099 N/A VAL 46.A N PRO 42.A O no hydrogen 3.128 N/A TRP 47.A N LYS 44.A O no hydrogen 3.081 N/A GLY 48.A N LYS 44.A O no hydrogen 2.603 N/A THR 50.A N THR 36.A OG1 no hydrogen 3.165 N/A THR 50.A OG1 HIS 32.A O no hydrogen 2.682 N/A THR 50.A OG1 THR 36.A OG1 no hydrogen 3.004 N/A GLN 51.A NE2 HIS 32.A O no hydrogen 3.168 N/A GLN 51.A NE2 GLN 273.A O no hydrogen 3.323 N/A ARG 56.A N ASP 54.A OD1 no hydrogen 3.045 N/A ARG 56.A NE ASP 60.A OD2 no hydrogen 3.138 N/A ARG 56.A NH2 ASP 104.A OD2 no hydrogen 3.255 N/A TYR 57.A N ASP 54.A OD1 no hydrogen 2.782 N/A GLN 58.A N ASP 54.A O no hydrogen 2.841 N/A GLN 58.A NE2 SER 34.A O no hydrogen 3.079 N/A GLN 58.A NE2 TYR 53.A O no hydrogen 3.050 N/A MET 59.A N PHE 55.A O no hydrogen 3.058 N/A ASP 60.A N ARG 56.A O no hydrogen 2.723 N/A HIS 61.A N GLN 58.A O no hydrogen 3.374 N/A GLY 62.A N MET 59.A O no hydrogen 3.192 N/A ALA 63.A N GLN 58.A O no hydrogen 3.104 N/A ARG 64.A N PRO 29.A O no hydrogen 2.988 N/A ARG 64.A NE GLU 108.A OE1 no hydrogen 2.877 N/A ARG 64.A NH1 MET 59.A O no hydrogen 2.946 N/A ARG 64.A NH1 ALA 63.A O no hydrogen 2.995 N/A ARG 64.A NH2 TRP 10.A O no hydrogen 2.868 N/A ARG 64.A NH2 GLU 108.A OE1 no hydrogen 2.473 N/A PHE 66.A N ILE 111.A O no hydrogen 2.873 N/A ASP 67.A N THR 31.A O no hydrogen 3.207 N/A ASP 67.A N SER 34.A OG no hydrogen 2.990 N/A ILE 68.A N SER 113.A O no hydrogen 2.942 N/A ARG 69.A NE ASP 67.A OD1 no hydrogen 3.061 N/A ARG 69.A NH1 GLU 117.A OE1 no hydrogen 3.277 N/A ARG 69.A NH1 GLU 117.A OE2 no hydrogen 3.537 N/A ARG 69.A NH2 ASP 67.A OD1 no hydrogen 3.280 N/A GLY 70.A N LYS 115.A O no hydrogen 2.909 N/A ARG 71.A N VAL 79.A O no hydrogen 3.007 N/A ARG 71.A NE GLU 119.A O no hydrogen 2.458 N/A ARG 71.A NH2 GLU 119.A O no hydrogen 2.793 N/A THR 73.A N THR 77.A O no hydrogen 2.898 N/A THR 73.A OG1 THR 77.A O no hydrogen 2.962 N/A THR 73.A OG1 THR 77.A OG1 no hydrogen 3.019 N/A ASN 76.A N THR 73.A O no hydrogen 3.274 N/A THR 77.A OG1 THR 73.A OG1 no hydrogen 3.019 N/A ILE 78.A N TYR 136.A OH no hydrogen 3.292 N/A VAL 79.A N ARG 71.A O no hydrogen 2.871 N/A LEU 80.A N VAL 89.A O no hydrogen 2.946 N/A HIS 81.A N ARG 69.A O no hydrogen 3.035 N/A HIS 82.A N LEU 85.A O no hydrogen 2.677 N/A GLY 83.A N GLU 117.A OE2 no hydrogen 2.871 N/A LEU 85.A N HIS 82.A O no hydrogen 3.266 N/A LEU 87.A N LEU 80.A O no hydrogen 2.879 N/A LEU 91.A N ILE 78.A O no hydrogen 3.261 N/A GLU 93.A N THR 90.A OG1 no hydrogen 3.226 N/A PHE 94.A N THR 90.A O no hydrogen 3.218 N/A ILE 95.A N LEU 91.A O no hydrogen 2.966 N/A ASN 96.A N HIS 92.A O no hydrogen 3.109 N/A ALA 98.A N PHE 94.A O no hydrogen 3.071 N/A LYS 99.A N ILE 95.A O no hydrogen 3.227 N/A LYS 99.A NZ ASP 139.A OD2 no hydrogen 2.681 N/A GLN 100.A N ASN 96.A O no hydrogen 2.797 N/A PHE 101.A N GLU 97.A O no hydrogen 2.878 N/A LEU 102.A N ALA 98.A O no hydrogen 2.880 N/A LYS 103.A N GLN 100.A O no hydrogen 3.171 N/A ASP 104.A N GLN 100.A O no hydrogen 3.113 N/A ASP 104.A N PHE 101.A O no hydrogen 2.975 N/A ASN 105.A N PHE 101.A O no hydrogen 3.101 N/A ASN 105.A ND2 PHE 101.A O no hydrogen 2.986 N/A SER 107.A OG GLU 108.A OE2 no hydrogen 3.089 N/A GLU 108.A N ASN 105.A O no hydrogen 2.978 N/A THR 109.A OG1 ALA 154.A O no hydrogen 3.407 N/A THR 109.A OG1 LYS 157.A O no hydrogen 3.282 N/A ILE 110.A N LYS 157.A O no hydrogen 3.503 N/A ILE 111.A N ARG 64.A O no hydrogen 2.836 N/A MET 112.A N VAL 159.A O no hydrogen 2.826 N/A SER 113.A N PHE 66.A O no hydrogen 2.917 N/A LEU 114.A N LEU 161.A O no hydrogen 3.195 N/A LYS 115.A N ILE 68.A O no hydrogen 3.053 N/A LYS 115.A NZ GLU 117.A OE1 no hydrogen 2.945 N/A GLU 117.A N GLY 70.A O no hydrogen 2.864 N/A ASP 120.A N GLU 119.A OE1 no hydrogen 3.276 N/A MET 121.A N LEU 72.A O no hydrogen 3.002 N/A GLY 123.A N ASP 74.A OD1 no hydrogen 3.132 N/A ALA 124.A N MET 121.A O no hydrogen 3.140 N/A GLU 125.A N ASN 76.A OD1 no hydrogen 2.953 N/A SER 127.A N ASP 126.A OD1 no hydrogen 2.950 N/A SER 127.A OG SER 129.A OG no hydrogen 3.258 N/A SER 127.A OG SER 130.A OG no hydrogen 2.754 N/A SER 129.A OG SER 127.A OG no hydrogen 3.258 N/A SER 129.A OG GLY 166.A O no hydrogen 2.843 N/A SER 130.A N SER 127.A OG no hydrogen 3.279 N/A SER 130.A OG SER 127.A O no hydrogen 3.183 N/A SER 130.A OG SER 127.A OG no hydrogen 2.754 N/A THR 131.A N SER 127.A O no hydrogen 2.933 N/A THR 131.A OG1 SER 127.A O no hydrogen 2.581 N/A PHE 132.A N PHE 128.A O no hydrogen 3.028 N/A GLU 133.A N SER 129.A O no hydrogen 2.909 N/A LYS 134.A N SER 130.A O no hydrogen 2.937 N/A LYS 134.A N THR 131.A O no hydrogen 3.193 N/A LYS 134.A NZ ASP 126.A OD2 no hydrogen 2.953 N/A LYS 135.A N THR 131.A O no hydrogen 2.986 N/A TYR 136.A N PHE 132.A O no hydrogen 3.152 N/A PHE 137.A N PHE 132.A O no hydrogen 2.842 N/A ASP 139.A N TYR 136.A O no hydrogen 2.731 N/A ILE 141.A N ASP 139.A OD1 no hydrogen 3.082 N/A LEU 143.A N ILE 158.A O no hydrogen 2.829 N/A LYS 144.A NZ PHE 137.A O no hydrogen 2.850 N/A LYS 144.A NZ ASP 139.A O no hydrogen 2.847 N/A LYS 144.A NZ PHE 142.A O no hydrogen 2.864 N/A LEU 151.A N ILE 21.A O no hydrogen 2.955 N/A GLY 152.A N ASP 19.A O no hydrogen 2.901 N/A ALA 154.A N LEU 151.A O no hydrogen 3.325 N/A ARG 155.A NE SER 107.A O no hydrogen 3.199 N/A ARG 155.A NH2 MET 14.A O no hydrogen 2.666 N/A ARG 155.A NH2 ILE 17.A O no hydrogen 3.480 N/A GLY 156.A N GLU 108.A O no hydrogen 3.171 N/A LYS 157.A N ALA 154.A O no hydrogen 2.728 N/A ILE 158.A N ILE 141.A O no hydrogen 2.734 N/A VAL 159.A N ILE 110.A O no hydrogen 2.698 N/A LEU 161.A N MET 112.A O no hydrogen 2.818 N/A LYS 162.A N TYR 173.A O no hydrogen 3.168 N/A LYS 162.A NZ SER 167.A OG no hydrogen 2.786 N/A LYS 162.A NZ GLU 169.A O no hydrogen 2.830 N/A ARG 163.A N LEU 114.A O no hydrogen 2.884 N/A TYR 164.A OH GLU 133.A OE2 no hydrogen 2.709 N/A SER 167.A OG GLU 133.A OE2 no hydrogen 3.080 N/A ASN 168.A N GLU 133.A OE1 no hydrogen 2.852 N/A GLU 169.A N GLU 133.A OE1 no hydrogen 3.174 N/A GLY 171.A N GLU 146.A OE2 no hydrogen 2.937 N/A GLY 172.A N THR 145.A O no hydrogen 2.697 N/A TYR 173.A N LEU 160.A O no hydrogen 2.700 N/A TRP 178.A NE1 ASP 198.A OD2 no hydrogen 2.967 N/A ASN 181.A ND2 LYS 201.A O no hydrogen 2.792 N/A PHE 184.A N VAL 196.A O no hydrogen 2.946 N/A THR 185.A OG1 VAL 194.A O no hydrogen 3.240 N/A THR 186.A N VAL 194.A O no hydrogen 2.900 N/A THR 187.A OG1 ASN 189.A O no hydrogen 3.420 N/A VAL 188.A N ALA 192.A O no hydrogen 3.430 N/A VAL 194.A N THR 186.A O no hydrogen 2.878 N/A THR 195.A N LEU 228.A O no hydrogen 2.963 N/A THR 195.A OG1 HIS 227.A NE2 no hydrogen 2.894 N/A VAL 196.A N PHE 184.A O no hydrogen 2.941 N/A GLN 197.A N ILE 230.A O no hydrogen 3.046 N/A ASP 198.A N GLU 182.A O no hydrogen 2.838 N/A LYS 199.A NZ GLU 206.A OE2 no hydrogen 3.315 N/A TYR 200.A OH ASP 180.A OD1 no hydrogen 2.322 N/A TYR 200.A OH ASP 180.A OD2 no hydrogen 3.370 N/A LYS 201.A N SER 236.A OG no hydrogen 3.223 N/A LYS 201.A NZ SER 237.A OG no hydrogen 3.366 N/A GLU 206.A N SER 203.A OG no hydrogen 3.318 N/A LYS 207.A N SER 203.A O no hydrogen 2.775 N/A LYS 207.A NZ LYS 199.A O no hydrogen 2.883 N/A LYS 207.A NZ PHE 232.A O no hydrogen 2.998 N/A LYS 207.A NZ SER 234.A O no hydrogen 2.866 N/A VAL 208.A N TYR 204.A O no hydrogen 2.884 N/A LYS 209.A N ASP 205.A O no hydrogen 3.423 N/A LYS 209.A N GLU 206.A O no hydrogen 3.170 N/A SER 210.A N GLU 206.A O no hydrogen 3.049 N/A SER 210.A OG GLU 206.A O no hydrogen 3.004 N/A ILE 211.A N LYS 207.A O no hydrogen 3.200 N/A LYS 212.A N VAL 208.A O no hydrogen 3.451 N/A LYS 212.A NZ GLU 255.A OE2 no hydrogen 2.997 N/A ASP 213.A N LYS 209.A O no hydrogen 2.714 N/A THR 214.A N SER 210.A O no hydrogen 3.013 N/A THR 214.A OG1 SER 210.A O no hydrogen 2.610 N/A MET 215.A N ILE 211.A O no hydrogen 2.632 N/A ASP 216.A N LYS 212.A O no hydrogen 2.657 N/A GLU 217.A N ASP 213.A O no hydrogen 3.140 N/A THR 218.A N THR 214.A O no hydrogen 3.263 N/A THR 218.A N MET 215.A O no hydrogen 2.932 N/A THR 218.A OG1 MET 215.A O no hydrogen 3.403 N/A THR 218.A OG1 ARG 267.A O no hydrogen 3.277 N/A MET 219.A N MET 215.A O no hydrogen 3.077 N/A ASN 220.A N ASP 216.A O no hydrogen 3.337 N/A ASN 221.A N GLU 217.A O no hydrogen 3.093 N/A SER 222.A OG MET 219.A O no hydrogen 3.496 N/A SER 222.A OG GLU 223.A OE1 no hydrogen 2.585 N/A ASP 224.A N ASN 221.A O no hydrogen 3.030 N/A HIS 227.A NE2 THR 195.A OG1 no hydrogen 2.894 N/A LEU 228.A N ASN 193.A O no hydrogen 2.783 N/A TYR 229.A OH GLU 217.A OE2 no hydrogen 3.333 N/A TYR 229.A OH ASN 221.A OD1 no hydrogen 2.634 N/A ILE 230.A N THR 195.A O no hydrogen 2.965 N/A ASN 231.A N TRP 270.A O no hydrogen 2.575 N/A ASN 231.A ND2 ILE 211.A O no hydrogen 3.247 N/A PHE 232.A N GLN 197.A O no hydrogen 3.217 N/A THR 233.A N ILE 272.A O no hydrogen 2.843 N/A SER 237.A OG SER 236.A O no hydrogen 3.204 N/A ASN 243.A ND2 GLY 238.A O no hydrogen 2.739 N/A TYR 248.A N SER 244.A O no hydrogen 3.335 N/A ALA 249.A N PRO 245.A O no hydrogen 2.897 N/A SER 250.A N TYR 246.A O no hydrogen 2.800 N/A SER 250.A OG TYR 246.A O no hydrogen 3.335 N/A SER 250.A OG TYR 247.A O no hydrogen 2.562 N/A TYR 251.A N TYR 248.A O no hydrogen 3.076 N/A ILE 252.A N TYR 248.A O no hydrogen 2.724 N/A ASN 253.A N ALA 249.A O no hydrogen 3.095 N/A ASN 253.A ND2 ASP 274.A O no hydrogen 3.444 N/A GLU 255.A N TYR 251.A O no hydrogen 3.105 N/A ILE 256.A N ILE 252.A O no hydrogen 3.172 N/A ALA 257.A N ASN 253.A O no hydrogen 2.778 N/A ASN 258.A N PRO 254.A O no hydrogen 2.930 N/A TYR 259.A N GLU 255.A O no hydrogen 3.046 N/A TYR 259.A OH ASP 216.A OD1 no hydrogen 2.589 N/A TYR 259.A OH ASP 216.A OD2 no hydrogen 2.953 N/A ILE 260.A N ILE 256.A O no hydrogen 3.254 N/A ILE 260.A N ALA 257.A O no hydrogen 3.169 N/A LYS 261.A N ALA 257.A O no hydrogen 3.262 N/A LYS 261.A NZ GLU 287.A OE2 no hydrogen 3.079 N/A GLN 262.A N ASN 258.A O no hydrogen 3.017 N/A LYS 263.A NZ TYR 259.A OH no hydrogen 3.206 N/A ARG 267.A NE SER 222.A O no hydrogen 3.419 N/A ARG 267.A NH1 HIS 227.A O no hydrogen 3.247 N/A ARG 267.A NH2 HIS 227.A O no hydrogen 3.366 N/A VAL 268.A N SER 27.A OG no hydrogen 3.070 N/A TRP 270.A N TYR 229.A O no hydrogen 2.813 N/A TRP 270.A NE1 LEU 23.A O no hydrogen 3.060 N/A VAL 271.A N ILE 28.A O no hydrogen 3.243 N/A GLN 273.A N GLY 30.A O no hydrogen 3.370 N/A GLN 273.A NE2 ASP 274.A O no hydrogen 3.386 N/A TYR 275.A N THR 50.A O no hydrogen 2.929 N/A TYR 275.A OH MET 49.A O no hydrogen 2.614 N/A ILE 276.A N GLN 51.A OE1 no hydrogen 3.283 N/A ASN 277.A ND2 GLU 52.A OE2 no hydrogen 2.931 N/A LYS 279.A N ASN 277.A OD1 no hydrogen 2.898 N/A LYS 279.A NZ GLU 52.A OE1 no hydrogen 2.911 N/A LYS 279.A NZ GLU 52.A OE2 no hydrogen 3.235 N/A TYR 285.A OH ASN 277.A O no hydrogen 2.479 N/A GLN 286.A NE2 GLU 8.A OE1 no hydrogen 3.470 N/A GLU 287.A N LEU 283.A O no hydrogen 3.269 N/A VAL 288.A N LEU 284.A O no hydrogen 3.060 N/A ILE 289.A N TYR 285.A O no hydrogen 3.117 N/A ARG 290.A N GLN 286.A O no hydrogen 3.083 N/A ARG 290.A NE GLU 8.A OE1 no hydrogen 3.352 N/A ARG 290.A NE GLU 8.A OE2 no hydrogen 2.883 N/A ARG 290.A NH1 GLU 287.A OE2 no hydrogen 3.355 N/A ARG 290.A NH2 GLU 8.A OE1 no hydrogen 2.930 N/A ALA 291.A N GLU 287.A O no hydrogen 3.141 N/A ASN 292.A N ILE 289.A O no hydrogen 2.808 N/A ASN 292.A ND2 SER 27.A O no hydrogen 2.759 N/A ASN 292.A ND2 ILE 289.A O no hydrogen 2.764 N/A LYS 293.A N ARG 290.A O no hydrogen 2.652 N/A LYS 293.A NZ ASN 264.A OD1 no hydrogen 3.519 N/A SER 294.A OG ALA 266.A O no hydrogen 2.774 N/A SER 294.A OG ALA 291.A O no hydrogen 3.133 N/A LEU 295.A N ASN 292.A O no hydrogen 2.847 N/A