Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pym_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 9.A N ASP 7.A OD1 no hydrogen 3.119 N/A GLU 10.A N ASP 7.A O no hydrogen 2.993 N/A VAL 11.A N VAL 85.A O no hydrogen 3.024 N/A ARG 13.A NH1 PRO 91.A O no hydrogen 2.637 N/A ARG 13.A NH2 PRO 91.A O no hydrogen 2.698 N/A LYS 15.A N ALA 12.A O no hydrogen 2.994 N/A ILE 16.A N ARG 13.A O no hydrogen 3.058 N/A THR 17.A N VAL 34.A O no hydrogen 3.050 N/A SER 19.A N GLU 32.A O no hydrogen 2.951 N/A LEU 22.A N VAL 30.A O no hydrogen 2.571 N/A GLY 23.A N VAL 30.A O no hydrogen 3.091 N/A GLN 24.A NE2 GLY 25.A O no hydrogen 3.123 N/A VAL 30.A N GLY 23.A O no hydrogen 2.665 N/A TYR 31.A N ILE 49.A O no hydrogen 2.927 N/A GLY 33.A N VAL 47.A O no hydrogen 3.191 N/A VAL 34.A N THR 17.A O no hydrogen 3.102 N/A ALA 35.A N THR 45.A O no hydrogen 2.785 N/A LYS 36.A N LYS 15.A O no hydrogen 3.068 N/A GLU 42.A N VAL 39.A O no hydrogen 3.014 N/A THR 45.A N ALA 35.A O no hydrogen 2.981 N/A THR 45.A OG1 GLU 42.A OE1 no hydrogen 2.541 N/A ARG 46.A NE GLU 32.A OE2 no hydrogen 3.048 N/A VAL 47.A N GLY 33.A O no hydrogen 3.287 N/A ALA 48.A N MET 96.A O no hydrogen 2.932 N/A ILE 49.A N TYR 31.A O no hydrogen 2.785 N/A LYS 50.A N VAL 94.A O no hydrogen 3.257 N/A THR 51.A N MET 29.A O no hydrogen 3.233 N/A THR 51.A OG1 MET 29.A O no hydrogen 2.573 N/A VAL 52.A N THR 92.A O no hydrogen 3.143 N/A ASN 53.A N PHE 27.A O no hydrogen 2.749 N/A ARG 61.A N SER 57.A O no hydrogen 3.263 N/A ILE 62.A N MET 58.A O no hydrogen 2.839 N/A GLU 63.A N ARG 59.A O no hydrogen 3.140 N/A PHE 64.A N ARG 61.A O no hydrogen 2.927 N/A LEU 65.A N ARG 61.A O no hydrogen 3.097 N/A ASN 66.A N ILE 62.A O no hydrogen 3.104 N/A SER 69.A N LEU 65.A O no hydrogen 2.716 N/A MET 71.A N ALA 68.A O no hydrogen 3.190 N/A LYS 72.A N SER 69.A O no hydrogen 3.348 N/A LYS 72.A NZ TYR 4.A OH no hydrogen 2.979 N/A LYS 72.A NZ ASP 7.A OD2 no hydrogen 3.202 N/A LYS 72.A NZ SER 69.A OG no hydrogen 2.842 N/A GLU 73.A N VAL 70.A O no hydrogen 3.405 N/A PHE 74.A N MET 71.A O no hydrogen 3.171 N/A ASN 75.A N TYR 133.A OH no hydrogen 2.711 N/A CYS 76.A SG ASP 129.A OD1 no hydrogen 3.030 N/A HIS 78.A ND1 VAL 157.A O no hydrogen 2.966 N/A VAL 79.A N CYS 76.A O no hydrogen 2.991 N/A VAL 80.A N ILE 159.A O no hydrogen 3.084 N/A ARG 81.A N GLU 97.A OE2 no hydrogen 3.392 N/A LEU 83.A N ILE 95.A O no hydrogen 3.246 N/A VAL 85.A N TRP 9.A O no hydrogen 3.231 N/A VAL 86.A N LEU 93.A O no hydrogen 2.862 N/A SER 87.A N GLU 10.A OE1 no hydrogen 2.833 N/A SER 87.A OG GLU 10.A OE1 no hydrogen 2.719 N/A SER 87.A OG GLU 10.A OE2 no hydrogen 2.687 N/A SER 87.A OG GLN 88.A OE1 no hydrogen 3.505 N/A GLN 88.A N GLU 10.A OE1 no hydrogen 3.188 N/A THR 92.A OG1 GLN 90.A O no hydrogen 3.455 N/A LEU 93.A N VAL 86.A O no hydrogen 3.348 N/A VAL 94.A N LYS 50.A O no hydrogen 3.198 N/A ILE 95.A N GLY 84.A O no hydrogen 2.967 N/A GLU 97.A N ARG 81.A O no hydrogen 2.831 N/A ARG 101.A NE GLU 153.A O no hydrogen 3.081 N/A GLY 102.A N MET 99.A O no hydrogen 2.953 N/A LEU 104.A N CYS 149.A O no hydrogen 2.866 N/A LYS 105.A NZ ASP 172.A OD1 no hydrogen 3.552 N/A LYS 105.A NZ ASP 172.A OD2 no hydrogen 3.038 N/A LYS 105.A NZ GLN 219.A OE1 no hydrogen 2.756 N/A SER 106.A N ASP 103.A OD1 no hydrogen 3.156 N/A SER 106.A OG ASP 103.A O no hydrogen 3.156 N/A SER 106.A OG ASP 103.A OD1 no hydrogen 3.021 N/A SER 106.A OG TYR 169.A OH no hydrogen 3.048 N/A TYR 107.A N ASP 103.A O no hydrogen 3.277 N/A LEU 108.A N LEU 104.A O no hydrogen 2.934 N/A ARG 109.A N LYS 105.A O no hydrogen 3.114 N/A ARG 109.A NE ALA 217.A O no hydrogen 3.099 N/A ARG 109.A NH2 ALA 217.A O no hydrogen 3.045 N/A ARG 109.A NH2 GLN 219.A OE1 no hydrogen 2.665 N/A SER 110.A N SER 106.A O no hydrogen 2.815 N/A SER 110.A OG TYR 107.A O no hydrogen 2.744 N/A LEU 111.A N LEU 108.A O no hydrogen 3.262 N/A ARG 112.A N ARG 109.A O no hydrogen 3.315 N/A ARG 112.A NE LEU 216.A O no hydrogen 3.116 N/A ARG 112.A NH2 LEU 216.A O no hydrogen 2.835 N/A MET 120.A N SER 116.A O no hydrogen 2.950 N/A ILE 121.A N LEU 117.A O no hydrogen 2.746 N/A GLN 122.A N SER 118.A O no hydrogen 2.891 N/A MET 123.A N LYS 119.A O no hydrogen 3.496 N/A ALA 124.A N MET 120.A O no hydrogen 2.993 N/A GLY 125.A N ILE 121.A O no hydrogen 2.913 N/A GLU 126.A N GLN 122.A O no hydrogen 2.906 N/A ILE 127.A N MET 123.A O no hydrogen 2.950 N/A ALA 128.A N ALA 124.A O no hydrogen 2.999 N/A ASP 129.A N GLY 125.A O no hydrogen 2.934 N/A GLY 130.A N GLU 126.A O no hydrogen 3.430 N/A MET 131.A N ILE 127.A O no hydrogen 3.087 N/A ALA 132.A N ALA 128.A O no hydrogen 2.838 N/A TYR 133.A N ASP 129.A O no hydrogen 3.030 N/A LEU 134.A N GLY 130.A O no hydrogen 2.965 N/A ASN 135.A N MET 131.A O no hydrogen 2.901 N/A ASN 135.A ND2 PHE 139.A O no hydrogen 3.064 N/A ASN 135.A ND2 ASP 202.A OD2 no hydrogen 3.498 N/A ALA 136.A N ALA 132.A O no hydrogen 3.072 N/A ASN 137.A N TYR 133.A O no hydrogen 3.000 N/A ASN 137.A ND2 TYR 133.A O no hydrogen 2.576 N/A LYS 138.A N ASN 135.A O no hydrogen 3.239 N/A PHE 139.A N LEU 134.A O no hydrogen 3.026 N/A HIS 141.A N ASP 202.A OD2 no hydrogen 2.983 N/A HIS 141.A NE2 GLY 160.A O no hydrogen 2.618 N/A ARG 142.A N ASP 202.A OD1 no hydrogen 3.219 N/A ASP 143.A N HIS 141.A ND1 no hydrogen 3.141 N/A ALA 146.A N GLU 212.A OE1 no hydrogen 2.965 N/A ARG 147.A NE TYR 173.A OH no hydrogen 2.833 N/A ARG 147.A NH1 ASP 172.A OD2 no hydrogen 3.009 N/A ARG 147.A NH2 TYR 173.A OH no hydrogen 2.929 N/A ASN 148.A N ALA 145.A O no hydrogen 3.049 N/A ASN 148.A ND2 ASP 143.A O no hydrogen 2.858 N/A CYS 149.A N ALA 145.A O no hydrogen 3.281 N/A CYS 149.A N ALA 146.A O no hydrogen 3.163 N/A CYS 149.A SG ALA 145.A O no hydrogen 3.318 N/A MET 150.A N LYS 158.A O no hydrogen 2.593 N/A VAL 151.A N GLY 102.A O no hydrogen 2.953 N/A ALA 152.A N THR 156.A O no hydrogen 2.882 N/A PHE 155.A N ALA 152.A O no hydrogen 2.751 N/A THR 156.A N ASP 154.A OD1 no hydrogen 2.973 N/A THR 156.A OG1 ASP 154.A OD1 no hydrogen 3.034 N/A VAL 157.A N GLU 126.A OE1 no hydrogen 2.892 N/A LYS 158.A N MET 150.A O no hydrogen 2.716 N/A LYS 158.A NZ HIS 77.A O no hydrogen 3.141 N/A LYS 158.A NZ GLU 97.A OE1 no hydrogen 2.921 N/A LYS 158.A NZ GLU 97.A OE2 no hydrogen 3.008 N/A ILE 159.A N HIS 78.A O no hydrogen 3.123 N/A PHE 162.A N ASN 148.A OD1 no hydrogen 2.937 N/A GLY 163.A N ASP 161.A OD1 no hydrogen 2.757 N/A THR 165.A OG1 GLN 24.A O no hydrogen 3.307 N/A ARG 166.A NH1 ARG 147.A O no hydrogen 3.338 N/A ARG 166.A NH2 ASP 103.A OD2 no hydrogen 2.789 N/A TYR 169.A N ARG 166.A O no hydrogen 3.179 N/A TYR 169.A OH ASP 103.A OD1 no hydrogen 2.814 N/A TYR 169.A OH ASP 103.A OD2 no hydrogen 3.304 N/A GLU 170.A N ASP 167.A O no hydrogen 3.351 N/A THR 171.A OG1 ASP 172.A OD1 no hydrogen 3.130 N/A ASP 172.A N TYR 169.A O no hydrogen 2.955 N/A TYR 173.A N GLU 170.A O no hydrogen 3.058 N/A TYR 173.A OH ASP 143.A OD2 no hydrogen 2.957 N/A TYR 174.A N LEU 182.A O no hydrogen 2.903 N/A TYR 174.A OH GLU 227.A OE2 no hydrogen 3.246 N/A ARG 175.A NH1 LYS 179.A O no hydrogen 2.734 N/A GLY 178.A N ARG 175.A O no hydrogen 2.858 N/A LYS 179.A N LYS 176.A O no hydrogen 2.839 N/A LYS 179.A NZ GLY 177.A O no hydrogen 3.135 N/A LEU 182.A N TYR 174.A O no hydrogen 2.782 N/A ARG 185.A NH1 PRO 220.A O no hydrogen 2.750 N/A ARG 185.A NH1 TYR 221.A O no hydrogen 3.104 N/A ARG 185.A NH2 LEU 224.A O no hydrogen 2.741 N/A TRP 186.A N PRO 183.A O no hydrogen 3.023 N/A TRP 186.A NE1 GLU 212.A OE1 no hydrogen 2.910 N/A MET 187.A N VAL 184.A O no hydrogen 3.071 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.993 N/A SER 191.A N SER 188.A OG no hydrogen 2.996 N/A SER 191.A OG SER 188.A OG no hydrogen 3.327 N/A SER 191.A OG VAL 196.A O no hydrogen 2.714 N/A LEU 192.A N SER 188.A O no hydrogen 3.165 N/A LYS 193.A N PRO 189.A O no hydrogen 2.876 N/A LYS 193.A NZ TYR 259.A OH no hydrogen 3.549 N/A ASP 194.A N GLU 190.A O no hydrogen 3.030 N/A VAL 196.A N GLU 190.A O no hydrogen 3.476 N/A THR 198.A N SER 201.A OG no hydrogen 2.567 N/A THR 198.A OG1 SER 201.A OG no hydrogen 3.382 N/A SER 201.A N THR 198.A O no hydrogen 3.078 N/A SER 201.A N THR 198.A OG1 no hydrogen 3.079 N/A SER 201.A OG THR 198.A O no hydrogen 2.544 N/A SER 201.A OG THR 198.A OG1 no hydrogen 3.382 N/A ASP 202.A N THR 198.A O no hydrogen 3.055 N/A VAL 203.A N THR 199.A O no hydrogen 2.935 N/A TRP 204.A N TYR 200.A O no hydrogen 3.173 N/A SER 205.A N SER 201.A O no hydrogen 3.204 N/A SER 205.A OG TRP 186.A O no hydrogen 2.687 N/A SER 205.A OG SER 201.A O no hydrogen 3.415 N/A PHE 206.A N ASP 202.A O no hydrogen 2.864 N/A GLY 207.A N VAL 203.A O no hydrogen 3.290 N/A VAL 208.A N TRP 204.A O no hydrogen 3.300 N/A VAL 209.A N SER 205.A O no hydrogen 2.866 N/A LEU 210.A N PHE 206.A O no hydrogen 2.993 N/A TRP 211.A N GLY 207.A O no hydrogen 3.081 N/A TRP 211.A NE1 ASP 240.A O no hydrogen 3.035 N/A GLU 212.A N VAL 208.A O no hydrogen 2.780 N/A ILE 213.A N VAL 209.A O no hydrogen 2.923 N/A ALA 214.A N LEU 210.A O no hydrogen 3.071 N/A THR 215.A N TRP 211.A O no hydrogen 3.076 N/A THR 215.A OG1 TRP 211.A O no hydrogen 2.870 N/A THR 215.A OG1 GLU 212.A O no hydrogen 2.943 N/A LEU 216.A N ILE 213.A O no hydrogen 3.268 N/A ALA 217.A N GLU 212.A O no hydrogen 2.578 N/A GLU 218.A N THR 215.A OG1 no hydrogen 3.265 N/A GLN 219.A NE2 ASP 172.A OD1 no hydrogen 2.961 N/A GLN 222.A N GLN 219.A O no hydrogen 3.265 N/A LEU 224.A N TYR 221.A O no hydrogen 2.977 N/A SER 225.A N GLN 228.A OE1 no hydrogen 2.996 N/A VAL 229.A N SER 225.A O no hydrogen 2.786 N/A LEU 230.A N ASN 226.A O no hydrogen 2.967 N/A ARG 231.A N GLU 227.A O no hydrogen 3.267 N/A PHE 232.A N GLN 228.A O no hydrogen 2.843 N/A VAL 233.A N VAL 229.A O no hydrogen 2.908 N/A MET 234.A N LEU 230.A O no hydrogen 2.904 N/A GLU 235.A N PHE 232.A O no hydrogen 3.155 N/A GLY 236.A N VAL 233.A O no hydrogen 3.039 N/A GLY 237.A N PHE 232.A O no hydrogen 3.074 N/A LYS 241.A NZ ASP 247.A OD1 no hydrogen 3.471 N/A CYS 245.A N PRO 242.A O no hydrogen 3.359 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.518 N/A LEU 249.A N PRO 246.A O no hydrogen 3.261 N/A PHE 250.A N PRO 246.A O no hydrogen 3.341 N/A GLU 251.A N ASP 247.A O no hydrogen 3.168 N/A LEU 252.A N MET 248.A O no hydrogen 3.482 N/A MET 253.A N LEU 249.A O no hydrogen 3.294 N/A ARG 254.A N PHE 250.A O no hydrogen 3.088 N/A MET 255.A N GLU 251.A O no hydrogen 3.167 N/A CYS 256.A N LEU 252.A O no hydrogen 2.987 N/A CYS 256.A SG LEU 252.A O no hydrogen 3.246 N/A TRP 257.A N MET 253.A O no hydrogen 3.060 N/A TRP 257.A N ARG 254.A O no hydrogen 2.775 N/A GLN 258.A N MET 255.A O no hydrogen 3.447 N/A GLN 258.A NE2 ARG 254.A O no hydrogen 3.539 N/A TYR 259.A OH MET 234.A O no hydrogen 2.678 N/A LYS 262.A N ASN 260.A OD1 no hydrogen 2.973 N/A MET 263.A N ASN 260.A O no hydrogen 3.072 N/A ARG 264.A N PRO 261.A O no hydrogen 3.341 N/A ARG 264.A NE GLN 258.A O no hydrogen 2.701 N/A ARG 264.A NH1 GLU 190.A OE2 no hydrogen 3.071 N/A ARG 264.A NH1 TYR 200.A O no hydrogen 2.799 N/A ARG 264.A NH2 GLU 190.A OE1 no hydrogen 2.815 N/A ARG 264.A NH2 GLU 190.A OE2 no hydrogen 3.415 N/A ARG 264.A NH2 GLN 258.A O no hydrogen 3.105 N/A ARG 264.A NH2 TYR 259.A O no hydrogen 3.003 N/A SER 266.A N GLU 269.A OE2 no hydrogen 2.933 N/A GLU 269.A N SER 266.A OG no hydrogen 3.113 N/A ILE 270.A N SER 266.A O no hydrogen 2.829 N/A ILE 271.A N PHE 267.A O no hydrogen 2.779 N/A SER 272.A N LEU 268.A O no hydrogen 3.143 N/A SER 273.A N GLU 269.A O no hydrogen 2.881 N/A ILE 274.A N ILE 270.A O no hydrogen 3.120 N/A LYS 275.A N ILE 271.A O no hydrogen 3.010 N/A LYS 275.A N SER 272.A O no hydrogen 2.985 N/A GLU 276.A N SER 272.A O no hydrogen 3.328 N/A GLU 277.A N ILE 274.A O no hydrogen 2.789 N/A