Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1szm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 3.A OE1 no hydrogen 3.320 N/A LYS 7.A N GLU 3.A O no hydrogen 3.127 N/A ALA 8.A N PHE 4.A O no hydrogen 3.200 N/A LYS 9.A N LEU 5.A O no hydrogen 2.795 N/A ASP 11.A N LYS 7.A O no hydrogen 3.383 N/A PHE 12.A N ALA 8.A O no hydrogen 3.079 N/A LEU 13.A N LYS 9.A O no hydrogen 3.259 N/A LYS 14.A N GLU 10.A O no hydrogen 3.044 N/A TRP 16.A N PHE 12.A O no hydrogen 2.906 N/A GLU 17.A N LEU 13.A O no hydrogen 3.297 N/A ASN 18.A N LYS 14.A O no hydrogen 3.334 N/A ALA 20.A N GLN 82.A OE1 no hydrogen 2.983 N/A THR 23.A N SER 95.A O no hydrogen 2.948 N/A GLN 28.A N HIS 25.A O no hydrogen 3.254 N/A PHE 29.A N LEU 26.A O no hydrogen 3.285 N/A GLU 30.A N LYS 47.A O no hydrogen 2.978 N/A ILE 32.A N LEU 45.A O no hydrogen 3.220 N/A LYS 33.A N LEU 45.A O no hydrogen 3.365 N/A LEU 35.A N VAL 43.A O no hydrogen 3.118 N/A GLY 36.A N VAL 43.A O no hydrogen 3.439 N/A GLY 38.A N GLY 41.A O no hydrogen 3.201 N/A GLY 41.A N GLY 38.A O no hydrogen 3.088 N/A ARG 42.A N ILE 59.A O no hydrogen 3.263 N/A VAL 43.A N GLY 36.A O no hydrogen 3.031 N/A MET 44.A N MET 57.A O no hydrogen 2.717 N/A LEU 45.A N LYS 33.A O no hydrogen 2.817 N/A VAL 46.A N TYR 55.A O no hydrogen 2.950 N/A LYS 47.A N GLU 30.A O no hydrogen 3.067 N/A HIS 48.A N ASN 53.A O no hydrogen 3.115 N/A MET 49.A N GLN 28.A O no hydrogen 3.477 N/A THR 51.A N HIS 48.A O no hydrogen 3.445 N/A THR 51.A OG1 GLU 50.A O no hydrogen 3.088 N/A GLY 52.A N HIS 48.A O no hydrogen 2.943 N/A TYR 55.A N VAL 46.A O no hydrogen 2.959 N/A ALA 56.A N MET 106.A O no hydrogen 2.831 N/A MET 57.A N MET 44.A O no hydrogen 2.773 N/A LYS 58.A N MET 104.A O no hydrogen 2.791 N/A LYS 58.A NZ PHE 40.A O no hydrogen 2.636 N/A LYS 58.A NZ GLU 77.A OE1 no hydrogen 2.574 N/A ILE 59.A N ARG 42.A O no hydrogen 2.801 N/A LEU 60.A N LEU 102.A O no hydrogen 2.835 N/A LYS 62.A N SER 100.A O no hydrogen 3.081 N/A LYS 62.A NZ ASP 98.A O no hydrogen 2.778 N/A LYS 62.A NZ ASN 99.A O no hydrogen 2.614 N/A LYS 62.A NZ LYS 309.A O no hydrogen 2.673 N/A LYS 64.A N ASP 61.A OD2 no hydrogen 2.855 N/A VAL 65.A N ASP 61.A O no hydrogen 2.999 N/A VAL 66.A N LYS 62.A O no hydrogen 3.096 N/A LYS 67.A N GLN 63.A O no hydrogen 3.034 N/A LEU 68.A N LYS 64.A O no hydrogen 3.004 N/A LYS 69.A N VAL 66.A O no hydrogen 3.033 N/A GLN 70.A N VAL 65.A O no hydrogen 3.008 N/A THR 74.A N GLN 70.A O no hydrogen 3.088 N/A THR 74.A N ILE 71.A O no hydrogen 3.235 N/A THR 74.A OG1 GLN 70.A O no hydrogen 2.862 N/A LEU 75.A N ILE 71.A O no hydrogen 2.992 N/A ASN 76.A N GLU 72.A O no hydrogen 2.997 N/A ASN 76.A ND2 ALA 173.A O no hydrogen 2.731 N/A GLU 77.A N HIS 73.A O no hydrogen 2.985 N/A LYS 78.A N THR 74.A O no hydrogen 3.348 N/A LYS 78.A NZ ALA 20.A O no hydrogen 3.053 N/A LYS 78.A NZ PHE 317.A OXT no hydrogen 2.779 N/A ARG 79.A N LEU 75.A O no hydrogen 3.014 N/A ILE 80.A N ASN 76.A O no hydrogen 2.983 N/A LEU 81.A N GLU 77.A O no hydrogen 3.017 N/A GLN 82.A N LYS 78.A O no hydrogen 3.068 N/A GLN 82.A NE2 LYS 15.A O no hydrogen 2.680 N/A GLN 82.A NE2 ARG 79.A O no hydrogen 2.968 N/A ALA 83.A N ILE 80.A O no hydrogen 2.979 N/A VAL 84.A N LEU 81.A O no hydrogen 3.519 N/A ASN 85.A N TYR 141.A OH no hydrogen 2.597 N/A LEU 89.A N PHE 86.A O no hydrogen 3.328 N/A VAL 90.A N VAL 167.A O no hydrogen 3.224 N/A LYS 91.A NZ GLU 93.A OE2 no hydrogen 2.856 N/A GLU 93.A N VAL 105.A O no hydrogen 2.745 N/A PHE 94.A N VAL 105.A O no hydrogen 3.238 N/A SER 95.A N THR 23.A OG1 no hydrogen 3.410 N/A PHE 96.A N TYR 103.A O no hydrogen 3.229 N/A LYS 97.A NZ PHE 314.A O no hydrogen 2.803 N/A LYS 97.A NZ PHE 317.A O no hydrogen 2.895 N/A ASP 98.A N ASN 101.A O no hydrogen 3.251 N/A SER 100.A N ASP 98.A OD1 no hydrogen 3.031 N/A ASN 101.A N ASP 98.A OD1 no hydrogen 3.004 N/A ASN 101.A ND2 TYR 103.A OH no hydrogen 3.060 N/A LEU 102.A N LEU 60.A O no hydrogen 2.804 N/A TYR 103.A N PHE 96.A O no hydrogen 3.061 N/A TYR 103.A OH ASP 98.A OD2 no hydrogen 2.735 N/A MET 104.A N LYS 58.A O no hydrogen 2.926 N/A VAL 105.A N PHE 94.A O no hydrogen 2.767 N/A MET 106.A N ALA 56.A O no hydrogen 2.690 N/A GLU 107.A N LYS 91.A O no hydrogen 3.086 N/A MET 114.A N LEU 157.A O no hydrogen 2.821 N/A PHE 115.A N PRO 154.A O no hydrogen 3.011 N/A SER 116.A N GLU 113.A O no hydrogen 2.886 N/A SER 116.A N GLU 113.A OE2 no hydrogen 2.821 N/A SER 116.A OG GLU 113.A OE2 no hydrogen 3.389 N/A HIS 117.A N GLU 113.A O no hydrogen 3.309 N/A LEU 118.A N MET 114.A O no hydrogen 2.982 N/A ARG 119.A N PHE 115.A O no hydrogen 3.051 N/A ARG 120.A N SER 116.A O no hydrogen 3.236 N/A ILE 121.A N HIS 117.A O no hydrogen 2.874 N/A PHE 124.A N MET 215.A O no hydrogen 3.194 N/A HIS 127.A NE2 TYR 131.A OH no hydrogen 3.056 N/A ARG 129.A N GLU 125.A O no hydrogen 2.960 N/A ARG 129.A N PRO 126.A O no hydrogen 3.014 N/A ARG 129.A NE TRP 280.A O no hydrogen 2.655 N/A PHE 130.A N PRO 126.A O no hydrogen 3.100 N/A TYR 131.A OH HIS 127.A NE2 no hydrogen 3.056 N/A ALA 132.A N ALA 128.A O no hydrogen 3.259 N/A ALA 133.A N ARG 129.A O no hydrogen 3.303 N/A GLN 134.A NE2 PHE 130.A O no hydrogen 3.022 N/A ILE 135.A N TYR 131.A O no hydrogen 3.136 N/A VAL 136.A N ALA 132.A O no hydrogen 3.098 N/A LEU 137.A N ALA 133.A O no hydrogen 3.073 N/A THR 138.A N GLN 134.A O no hydrogen 2.903 N/A THR 138.A OG1 GLN 134.A O no hydrogen 2.736 N/A PHE 139.A N ILE 135.A O no hydrogen 2.766 N/A GLU 140.A N VAL 136.A O no hydrogen 2.891 N/A TYR 141.A N LEU 137.A O no hydrogen 3.183 N/A LEU 142.A N THR 138.A O no hydrogen 3.001 N/A HIS 143.A N PHE 139.A O no hydrogen 3.109 N/A SER 144.A N GLU 140.A O no hydrogen 3.050 N/A SER 144.A N TYR 141.A O no hydrogen 2.659 N/A SER 144.A OG TYR 141.A O no hydrogen 2.956 N/A LEU 145.A N TYR 141.A O no hydrogen 3.236 N/A ASP 146.A N HIS 143.A O no hydrogen 3.360 N/A LEU 147.A N LEU 142.A O no hydrogen 3.022 N/A ILE 148.A N LYS 174.A O no hydrogen 3.003 N/A TYR 149.A N ASP 204.A OD2 no hydrogen 2.750 N/A TYR 149.A OH THR 168.A O no hydrogen 2.548 N/A TYR 149.A OH ASP 169.A O no hydrogen 3.080 N/A ARG 150.A N ASP 204.A OD1 no hydrogen 3.154 N/A ARG 150.A NE PHE 172.A O no hydrogen 2.722 N/A ARG 150.A NH2 PHE 172.A O no hydrogen 2.936 N/A ASN 156.A N LYS 153.A O no hydrogen 3.062 N/A ASN 156.A ND2 ASP 151.A O no hydrogen 2.642 N/A LEU 157.A N PRO 154.A O no hydrogen 3.307 N/A MET 158.A N LYS 166.A O no hydrogen 2.995 N/A ILE 159.A N GLY 112.A O no hydrogen 3.018 N/A ASP 160.A N TYR 164.A O no hydrogen 2.838 N/A GLN 162.A N ASP 160.A OD1 no hydrogen 3.232 N/A GLY 163.A N ASP 160.A O no hydrogen 3.014 N/A TYR 164.A N ASP 160.A OD1 no hydrogen 3.111 N/A TYR 164.A OH VAL 294.A O no hydrogen 3.427 N/A ILE 165.A N GLN 134.A OE1 no hydrogen 2.707 N/A LYS 166.A N MET 158.A O no hydrogen 2.922 N/A VAL 167.A N PHE 88.A O no hydrogen 2.735 N/A THR 168.A N ASN 156.A O no hydrogen 2.876 N/A GLY 171.A N ASP 169.A OD2 no hydrogen 2.983 N/A ALA 173.A N PHE 170.A O no hydrogen 3.173 N/A LYS 174.A N ILE 148.A O no hydrogen 3.193 N/A LYS 174.A NZ THR 180.A OG1 no hydrogen 2.517 N/A ARG 175.A NE LEU 145.A O no hydrogen 3.010 N/A ARG 175.A NH2 ASP 146.A OD2 no hydrogen 3.253 N/A VAL 176.A N ASP 146.A O no hydrogen 2.862 N/A THR 180.A N TYR 199.A O no hydrogen 3.011 N/A THR 185.A OG1 ASP 151.A OD1 no hydrogen 3.498 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.456 N/A TYR 188.A N THR 185.A O no hydrogen 2.934 N/A TYR 188.A OH GLU 214.A OE1 no hydrogen 2.529 N/A LEU 189.A N PRO 186.A O no hydrogen 3.046 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.975 N/A ILE 193.A N ALA 190.A O no hydrogen 3.233 N/A LEU 195.A N PRO 191.A O no hydrogen 2.989 N/A SER 196.A N ILE 193.A O no hydrogen 3.240 N/A TYR 199.A N THR 180.A O no hydrogen 2.950 N/A LYS 201.A NZ HIS 143.A O no hydrogen 2.399 N/A VAL 203.A N ASN 200.A O no hydrogen 3.138 N/A ASP 204.A N LYS 201.A O no hydrogen 3.165 N/A TRP 205.A N ALA 202.A O no hydrogen 3.192 N/A TRP 206.A N ALA 202.A O no hydrogen 3.485 N/A ALA 207.A N VAL 203.A O no hydrogen 3.141 N/A LEU 208.A N ASP 204.A O no hydrogen 2.971 N/A GLY 209.A N TRP 205.A O no hydrogen 2.992 N/A VAL 210.A N TRP 206.A O no hydrogen 2.977 N/A LEU 211.A N ALA 207.A O no hydrogen 2.862 N/A ILE 212.A N LEU 208.A O no hydrogen 2.706 N/A TYR 213.A N GLY 209.A O no hydrogen 2.913 N/A TYR 213.A OH ARG 240.A O no hydrogen 2.736 N/A GLU 214.A N VAL 210.A O no hydrogen 2.905 N/A MET 215.A N LEU 211.A O no hydrogen 2.856 N/A ALA 216.A N ILE 212.A O no hydrogen 2.965 N/A ALA 217.A N TYR 213.A O no hydrogen 2.863 N/A GLY 218.A N GLU 214.A O no hydrogen 3.019 N/A ILE 230.A N GLN 226.A O no hydrogen 3.197 N/A TYR 231.A N PRO 227.A O no hydrogen 2.846 N/A GLU 232.A N ILE 228.A O no hydrogen 2.807 N/A ILE 234.A N ILE 230.A O no hydrogen 3.303 N/A VAL 235.A N TYR 231.A O no hydrogen 3.390 N/A SER 236.A N GLU 232.A O no hydrogen 3.236 N/A GLY 237.A N LYS 233.A O no hydrogen 2.936 N/A GLY 237.A N ILE 234.A O no hydrogen 3.287 N/A PHE 245.A N PRO 242.A O no hydrogen 3.017 N/A SER 246.A N GLU 125.A OE2 no hydrogen 2.962 N/A SER 246.A OG GLU 125.A OE1 no hydrogen 2.686 N/A LEU 249.A N SER 246.A OG no hydrogen 3.382 N/A LYS 250.A N SER 246.A O no hydrogen 3.233 N/A ASP 251.A N SER 247.A O no hydrogen 3.241 N/A LEU 252.A N LEU 249.A O no hydrogen 2.739 N/A LEU 253.A N LEU 249.A O no hydrogen 3.073 N/A ASN 255.A N LEU 252.A O no hydrogen 3.131 N/A ASN 255.A ND2 ASP 251.A O no hydrogen 2.765 N/A LEU 256.A N LEU 252.A O no hydrogen 3.142 N/A ASP 260.A N GLN 258.A OE1 no hydrogen 3.478 N/A ARG 264.A NE GLN 258.A O no hydrogen 2.982 N/A ARG 264.A NH1 GLU 192.A OE2 no hydrogen 3.158 N/A ARG 264.A NH2 GLU 192.A OE1 no hydrogen 3.167 N/A ARG 264.A NH2 GLN 258.A O no hydrogen 3.193 N/A PHE 265.A N ASN 255.A O no hydrogen 3.013 N/A GLY 266.A N GLY 271.A O no hydrogen 3.111 N/A ASN 267.A N ARG 264.A O no hydrogen 3.242 N/A ASN 270.A ND2 ASP 274.A OD1 no hydrogen 3.244 N/A ILE 275.A N VAL 272.A O no hydrogen 2.922 N/A LYS 276.A NZ GLU 140.A OE1 no hydrogen 3.239 N/A ASN 277.A N ASN 273.A O no hydrogen 2.566 N/A HIS 278.A NE2 ASP 251.A OD2 no hydrogen 3.302 N/A TRP 280.A N HIS 278.A ND1 no hydrogen 3.153 N/A TRP 280.A NE1 GLU 125.A OE1 no hydrogen 3.185 N/A PHE 281.A N HIS 278.A O no hydrogen 2.873 N/A ILE 289.A N ASP 285.A O no hydrogen 3.430 N/A GLN 291.A N ILE 287.A O no hydrogen 3.041 N/A ARG 292.A N ALA 288.A O no hydrogen 3.177 N/A ARG 292.A N ILE 289.A O no hydrogen 3.092 N/A ARG 292.A NH2 ASP 160.A OD2 no hydrogen 2.676 N/A LYS 293.A N ALA 288.A O no hydrogen 2.976 N/A LYS 309.A N ASN 99.A O no hydrogen 2.888 N/A GLU 313.A N GLU 313.A OE2 no hydrogen 2.771 N/A PHE 314.A N CYS 310.A O no hydrogen 3.404 N/A SER 315.A OG LYS 312.A O no hydrogen 3.316 N/A PHE 317.A N PHE 314.A O no hydrogen 3.038 N/A