Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1szr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N ALA 238.A O no hydrogen 3.003 N/A PHE 5.A N THR 340.A O no hydrogen 2.990 N/A VAL 6.A N THR 236.A O no hydrogen 2.922 N/A ALA 7.A N TYR 342.A O no hydrogen 2.881 N/A ASP 8.A N ALA 234.A O no hydrogen 2.788 N/A LEU 9.A N VAL 344.A O no hydrogen 3.074 N/A GLY 10.A N ASP 8.A OD1 no hydrogen 3.290 N/A ASP 11.A N ASP 8.A O no hydrogen 3.185 N/A ILE 12.A N LEU 9.A O no hydrogen 3.147 N/A VAL 13.A N LEU 9.A O no hydrogen 3.389 N/A ARG 14.A N GLY 10.A O no hydrogen 3.270 N/A ARG 14.A NH2 ASP 8.A OD2 no hydrogen 3.362 N/A LYS 15.A N ASP 11.A O no hydrogen 3.096 N/A LYS 15.A NZ GLY 191.A O no hydrogen 2.814 N/A LYS 15.A NZ TYR 229.A O no hydrogen 2.603 N/A LYS 15.A NZ SER 233.A OG no hydrogen 3.117 N/A HIS 16.A N ILE 12.A O no hydrogen 3.115 N/A HIS 16.A ND1 TYR 230.A OH no hydrogen 2.787 N/A GLU 17.A N VAL 13.A O no hydrogen 3.018 N/A THR 18.A N ARG 14.A O no hydrogen 3.028 N/A THR 18.A OG1 ARG 14.A O no hydrogen 3.124 N/A TRP 19.A N LYS 15.A O no hydrogen 3.019 N/A TRP 19.A NE1 VAL 26.A O no hydrogen 3.059 N/A LYS 20.A N HIS 16.A O no hydrogen 3.057 N/A LYS 21.A N GLU 17.A O no hydrogen 3.235 N/A CYS 22.A N THR 18.A O no hydrogen 3.033 N/A CYS 22.A SG THR 18.A O no hydrogen 3.453 N/A LEU 23.A N TRP 19.A O no hydrogen 2.865 N/A ARG 25.A NH1 PHE 214.A O no hydrogen 3.287 N/A ARG 25.A NH2 PHE 214.A O no hydrogen 2.792 N/A VAL 26.A N LEU 23.A O no hydrogen 3.138 N/A THR 27.A N ILE 222.A O no hydrogen 2.992 N/A PHE 29.A N ALA 224.A O no hydrogen 2.777 N/A TYR 30.A N GLY 50.A O no hydrogen 2.996 N/A TYR 30.A OH ASN 35.A O no hydrogen 2.587 N/A ALA 31.A N PRO 226.A O no hydrogen 2.947 N/A VAL 32.A N ASP 52.A O no hydrogen 3.200 N/A LYS 33.A NZ TYR 325.A OH no hydrogen 3.413 N/A CYS 34.A N ALA 31.A O no hydrogen 3.114 N/A VAL 40.A N ASP 37.A OD1 no hydrogen 3.159 N/A LEU 41.A N ASP 37.A O no hydrogen 3.015 N/A GLY 42.A N TRP 38.A O no hydrogen 2.928 N/A THR 43.A N ARG 39.A O no hydrogen 3.102 N/A THR 43.A OG1 ARG 39.A O no hydrogen 2.615 N/A LEU 44.A N VAL 40.A O no hydrogen 3.141 N/A ALA 45.A N LEU 41.A O no hydrogen 2.904 N/A ALA 46.A N GLY 42.A O no hydrogen 3.123 N/A LEU 47.A N THR 43.A O no hydrogen 3.048 N/A GLY 48.A N LEU 44.A O no hydrogen 3.137 N/A GLY 48.A N ALA 45.A O no hydrogen 3.213 N/A THR 49.A N LEU 44.A O no hydrogen 3.194 N/A THR 49.A OG1 LEU 44.A O no hydrogen 3.261 N/A THR 49.A OG1 GLY 50.A O no hydrogen 3.020 N/A GLY 50.A N PRO 28.A O no hydrogen 2.900 N/A PHE 51.A N LYS 71.A O no hydrogen 2.861 N/A ASP 52.A N TYR 30.A O no hydrogen 2.708 N/A CYS 53.A N ILE 73.A O no hydrogen 2.929 N/A ALA 54.A N GLU 58.A OE1 no hydrogen 3.098 N/A GLU 58.A N SER 55.A OG no hydrogen 3.222 N/A ILE 59.A N SER 55.A O no hydrogen 3.058 N/A GLN 60.A N ASN 56.A O no hydrogen 2.930 N/A ARG 61.A N THR 57.A O no hydrogen 3.048 N/A ARG 61.A NE ASP 36.A O no hydrogen 3.052 N/A ARG 61.A NH2 ASP 36.A O no hydrogen 3.105 N/A VAL 62.A N GLU 58.A O no hydrogen 3.143 N/A ARG 63.A N ILE 59.A O no hydrogen 2.975 N/A ARG 63.A NE VAL 67.A O no hydrogen 3.304 N/A ARG 63.A NH2 VAL 67.A O no hydrogen 3.558 N/A GLY 64.A N GLN 60.A O no hydrogen 2.947 N/A ILE 65.A N VAL 62.A O no hydrogen 3.344 N/A GLY 66.A N ARG 63.A O no hydrogen 3.142 N/A VAL 67.A N VAL 62.A O no hydrogen 3.333 N/A GLU 70.A N GLU 70.A OE2 no hydrogen 3.110 N/A LYS 71.A N PRO 68.A O no hydrogen 3.122 N/A ILE 72.A N PRO 69.A O no hydrogen 3.250 N/A ILE 73.A N PHE 51.A O no hydrogen 3.027 N/A TYR 74.A N VAL 94.A O no hydrogen 2.884 N/A ALA 75.A N CYS 53.A O no hydrogen 3.135 N/A LYS 79.A N GLU 102.A OE2 no hydrogen 2.932 N/A LYS 79.A NZ ASN 76.A O no hydrogen 2.566 N/A LYS 79.A NZ THR 96.A O no hydrogen 2.927 N/A LYS 79.A NZ GLU 102.A OE2 no hydrogen 2.674 N/A ILE 84.A N GLN 80.A O no hydrogen 3.098 N/A ARG 85.A N ILE 81.A O no hydrogen 3.080 N/A TYR 86.A N SER 82.A O no hydrogen 3.002 N/A ALA 87.A N HIS 83.A O no hydrogen 3.105 N/A ARG 88.A N ILE 84.A O no hydrogen 2.971 N/A ARG 88.A NE ASP 89.A OD1 no hydrogen 3.253 N/A ARG 88.A NH1 THR 109.A O no hydrogen 3.036 N/A ARG 88.A NH2 ASP 89.A OD1 no hydrogen 3.239 N/A ASP 89.A N ARG 85.A O no hydrogen 3.071 N/A SER 90.A N TYR 86.A O no hydrogen 3.048 N/A SER 90.A N ALA 87.A O no hydrogen 3.130 N/A SER 90.A OG TYR 86.A O no hydrogen 2.567 N/A GLY 91.A N ARG 88.A O no hydrogen 3.199 N/A VAL 92.A N ALA 87.A O no hydrogen 2.848 N/A MET 95.A N LYS 114.A O no hydrogen 3.121 N/A THR 96.A N TYR 74.A O no hydrogen 3.294 N/A PHE 97.A N VAL 116.A O no hydrogen 2.981 N/A GLU 104.A N VAL 100.A O no hydrogen 3.040 N/A LYS 105.A N ASP 101.A O no hydrogen 3.273 N/A LYS 105.A NZ LYS 79.A O no hydrogen 2.576 N/A LYS 105.A NZ GLU 102.A OE1 no hydrogen 2.868 N/A VAL 106.A N GLU 102.A O no hydrogen 3.079 N/A ALA 107.A N LEU 103.A O no hydrogen 2.880 N/A THR 109.A OG1 LYS 105.A O no hydrogen 2.872 N/A HIS 110.A N VAL 106.A O no hydrogen 2.848 N/A ALA 113.A N HIS 110.A O no hydrogen 3.121 N/A LYS 114.A N ASP 93.A O no hydrogen 2.982 N/A LYS 114.A NZ LYS 112.A O no hydrogen 3.086 N/A MET 115.A N ASP 141.A O no hydrogen 3.016 N/A VAL 116.A N MET 95.A O no hydrogen 2.884 N/A LEU 117.A N GLY 144.A O no hydrogen 3.051 N/A ARG 118.A N PHE 97.A O no hydrogen 2.773 N/A ILE 119.A N SER 146.A O no hydrogen 2.901 N/A SER 120.A N ALA 123.A O no hydrogen 2.952 N/A THR 121.A OG1 HIS 148.A O no hydrogen 3.035 N/A GLY 122.A N ASP 98.A OD2 no hydrogen 3.194 N/A ALA 123.A N ARG 118.A O no hydrogen 2.970 N/A ASP 127.A N LYS 124.A O no hydrogen 3.030 N/A CYS 128.A N VAL 125.A O no hydrogen 3.304 N/A CYS 128.A SG LYS 124.A O no hydrogen 3.334 N/A ARG 129.A NH1 GLU 175.A OE2 no hydrogen 3.450 N/A ARG 129.A NH2 GLU 175.A OE1 no hydrogen 3.400 N/A ILE 131.A N ASP 127.A O no hydrogen 3.144 N/A LEU 132.A N CYS 128.A O no hydrogen 3.094 N/A GLU 133.A N ARG 129.A O no hydrogen 3.062 N/A GLN 134.A N PHE 130.A O no hydrogen 3.153 N/A ALA 135.A N ILE 131.A O no hydrogen 3.043 N/A LYS 136.A N LEU 132.A O no hydrogen 3.007 N/A LYS 137.A N GLU 133.A O no hydrogen 3.269 N/A LEU 138.A N GLN 134.A O no hydrogen 3.236 N/A ASN 139.A N LYS 136.A O no hydrogen 3.066 N/A ILE 140.A N ALA 135.A O no hydrogen 3.008 N/A THR 143.A N MET 115.A O no hydrogen 2.883 N/A VAL 145.A N ILE 182.A O no hydrogen 2.987 N/A SER 146.A N LEU 117.A O no hydrogen 2.868 N/A PHE 147.A N ASP 184.A O no hydrogen 3.023 N/A SER 153.A OG THR 158.A OG1 no hydrogen 3.326 N/A SER 157.A N ASP 155.A OD2 no hydrogen 3.315 N/A THR 158.A OG1 SER 153.A OG no hydrogen 3.326 N/A THR 158.A OG1 ASP 155.A O no hydrogen 3.210 N/A PHE 159.A N ALA 156.A O no hydrogen 3.102 N/A GLN 161.A N SER 157.A O no hydrogen 3.038 N/A GLN 161.A NE2 ASP 165.A OD2 no hydrogen 2.513 N/A ALA 162.A N THR 158.A O no hydrogen 3.113 N/A ILE 163.A N PHE 159.A O no hydrogen 3.020 N/A SER 164.A N ALA 160.A O no hydrogen 3.165 N/A ASP 165.A N GLN 161.A O no hydrogen 3.037 N/A SER 166.A N ALA 162.A O no hydrogen 2.907 N/A SER 166.A OG ALA 162.A O no hydrogen 2.679 N/A ARG 167.A N ILE 163.A O no hydrogen 3.073 N/A ARG 167.A NE ASP 171.A OD1 no hydrogen 3.245 N/A ARG 167.A NH1 HIS 213.A O no hydrogen 3.210 N/A ARG 167.A NH2 ASP 171.A OD1 no hydrogen 3.156 N/A PHE 168.A N SER 164.A O no hydrogen 3.291 N/A VAL 169.A N ASP 165.A O no hydrogen 3.170 N/A PHE 170.A N SER 166.A O no hydrogen 2.792 N/A ASP 171.A N ARG 167.A O no hydrogen 2.984 N/A MET 172.A N PHE 168.A O no hydrogen 3.335 N/A GLY 173.A N VAL 169.A O no hydrogen 3.020 N/A THR 174.A N PHE 170.A O no hydrogen 3.110 N/A THR 174.A OG1 PHE 170.A O no hydrogen 3.152 N/A GLU 175.A N ASP 171.A O no hydrogen 3.013 N/A LEU 176.A N MET 172.A O no hydrogen 3.195 N/A GLY 177.A N THR 174.A O no hydrogen 3.007 N/A PHE 178.A N GLY 173.A O no hydrogen 3.024 N/A HIS 181.A N THR 143.A O no hydrogen 2.794 N/A ILE 182.A N THR 143.A O no hydrogen 2.875 N/A LEU 183.A N THR 221.A O no hydrogen 3.113 N/A ASP 184.A N VAL 145.A O no hydrogen 2.867 N/A ILE 185.A N VAL 223.A O no hydrogen 2.865 N/A GLY 186.A N ASP 184.A OD1 no hydrogen 3.151 N/A GLY 187.A N HIS 148.A ND1 no hydrogen 3.043 N/A LYS 198.A N GLU 201.A OE2 no hydrogen 3.446 N/A LYS 198.A NZ ALA 195.A O no hydrogen 2.860 N/A ILE 202.A N LYS 198.A O no hydrogen 3.174 N/A ALA 203.A N PHE 199.A O no hydrogen 2.976 N/A GLY 204.A N GLU 200.A O no hydrogen 3.195 N/A VAL 205.A N GLU 201.A O no hydrogen 3.237 N/A ILE 206.A N ILE 202.A O no hydrogen 2.968 N/A ASN 207.A N ALA 203.A O no hydrogen 2.878 N/A ASN 208.A N GLY 204.A O no hydrogen 3.161 N/A ALA 209.A N VAL 205.A O no hydrogen 3.174 N/A LEU 210.A N ILE 206.A O no hydrogen 2.917 N/A GLU 211.A N ASN 207.A O no hydrogen 2.921 N/A LYS 212.A N ASN 208.A O no hydrogen 3.071 N/A HIS 213.A N ALA 209.A O no hydrogen 2.951 N/A HIS 213.A ND1 ALA 209.A O no hydrogen 3.191 N/A PHE 214.A N LEU 210.A O no hydrogen 2.695 N/A LYS 219.A N ASP 217.A OD1 no hydrogen 2.974 N/A LEU 220.A N ASP 217.A O no hydrogen 2.998 N/A THR 221.A N HIS 181.A O no hydrogen 2.990 N/A VAL 223.A N LEU 183.A O no hydrogen 2.839 N/A ALA 224.A N THR 27.A O no hydrogen 3.002 N/A GLU 225.A N GLY 186.A O no hydrogen 2.886 N/A ARG 228.A NH1 ASP 268.A OD1 no hydrogen 3.094 N/A ARG 228.A NH2 ASP 268.A OD2 no hydrogen 3.190 N/A TYR 229.A OH LYS 15.A O no hydrogen 2.646 N/A TYR 230.A N GLY 227.A O no hydrogen 3.217 N/A TYR 230.A OH HIS 16.A ND1 no hydrogen 2.787 N/A VAL 231.A N ARG 228.A O no hydrogen 3.239 N/A ALA 232.A N ARG 228.A O no hydrogen 2.917 N/A SER 233.A OG ASP 11.A OD2 no hydrogen 2.771 N/A SER 233.A OG GLY 191.A O no hydrogen 3.362 N/A ALA 234.A N VAL 231.A O no hydrogen 3.190 N/A THR 236.A N VAL 6.A O no hydrogen 3.092 N/A LEU 237.A N PHE 319.A O no hydrogen 2.896 N/A ALA 238.A N PHE 4.A O no hydrogen 2.802 N/A VAL 239.A N LEU 317.A O no hydrogen 2.918 N/A ASN 240.A N ASN 255.A OD1 no hydrogen 3.008 N/A ASN 240.A ND2 VAL 241.A O no hydrogen 2.981 N/A VAL 241.A N GLU 315.A O no hydrogen 2.954 N/A ILE 242.A N TYR 253.A O no hydrogen 2.890 N/A ALA 243.A N TYR 253.A O no hydrogen 3.468 N/A LYS 244.A NZ GLU 310.A OE1 no hydrogen 2.982 N/A LYS 244.A NZ MET 311.A O no hydrogen 2.758 N/A ALA 245.A N MET 251.A O no hydrogen 3.013 N/A THR 247.A N SER 249.A O no hydrogen 3.359 N/A SER 249.A OG PRO 288.A O no hydrogen 3.328 N/A PHE 250.A N PRO 288.A O no hydrogen 3.268 N/A MET 251.A N ALA 245.A O no hydrogen 3.019 N/A TYR 252.A N SER 290.A O no hydrogen 2.928 N/A TYR 252.A OH PRO 309.A O no hydrogen 3.371 N/A TYR 253.A N ALA 243.A O no hydrogen 3.049 N/A VAL 254.A N TRP 292.A O no hydrogen 2.835 N/A ASN 255.A N ASN 240.A O no hydrogen 3.288 N/A ASN 255.A ND2 GLY 1.A O no hydrogen 2.779 N/A GLY 257.A N ASP 256.A OD1 no hydrogen 2.908 N/A VAL 258.A N ASP 300.A OD1 no hydrogen 3.101 N/A TYR 259.A OH ASP 297.A OD2 no hydrogen 2.671 N/A GLY 260.A N GLY 257.A O no hydrogen 2.986 N/A SER 261.A N ASP 256.A OD1 no hydrogen 3.063 N/A SER 261.A OG ASP 256.A OD2 no hydrogen 2.491 N/A PHE 262.A N GLY 257.A O no hydrogen 3.010 N/A ASN 263.A N GLY 260.A O no hydrogen 3.255 N/A ASN 263.A ND2 GLY 260.A O no hydrogen 2.715 N/A ASN 263.A ND2 THR 326.A O no hydrogen 2.840 N/A CYS 264.A SG SER 261.A O no hydrogen 3.570 N/A ILE 265.A N PHE 262.A O no hydrogen 3.080 N/A LEU 266.A N ASN 263.A O no hydrogen 2.958 N/A TYR 267.A N ASN 263.A O no hydrogen 3.005 N/A ASP 268.A N CYS 264.A O no hydrogen 2.880 N/A ALA 270.A N CYS 264.A O no hydrogen 3.134 N/A LEU 275.A N LEU 318.A O no hydrogen 2.860 N/A GLN 277.A N TRP 316.A O no hydrogen 3.279 N/A GLN 277.A NE2 GLN 277.A O no hydrogen 2.629 N/A ARG 278.A NE GLU 315.A OE2 no hydrogen 3.235 N/A ARG 278.A NH2 GLU 315.A OE1 no hydrogen 3.258 N/A TYR 287.A N LEU 308.A O no hydrogen 2.965 N/A SER 289.A N TYR 306.A O no hydrogen 3.060 N/A SER 289.A OG TYR 287.A O no hydrogen 3.028 N/A SER 290.A N PHE 250.A O no hydrogen 3.105 N/A VAL 291.A N VAL 303.A O no hydrogen 3.113 N/A TRP 292.A N TYR 252.A O no hydrogen 2.756 N/A TRP 292.A NE1 SER 290.A OG no hydrogen 2.862 N/A GLY 293.A N ASP 300.A O no hydrogen 3.081 N/A THR 295.A N ASP 300.A OD2 no hydrogen 3.234 N/A THR 295.A OG1 ASP 300.A OD2 no hydrogen 2.638 N/A CYS 296.A N ASN 334.A OD1 no hydrogen 3.268 N/A CYS 296.A SG ASN 334.A OD1 no hydrogen 3.986 N/A LEU 299.A N ASP 297.A OD1 no hydrogen 3.073 N/A ASP 300.A N ASP 297.A O no hydrogen 3.287 N/A GLN 301.A N LEU 299.A O no hydrogen 2.938 N/A GLN 301.A NE2 VAL 303.A O no hydrogen 3.350 N/A ILE 302.A N VAL 291.A O no hydrogen 2.840 N/A VAL 303.A N VAL 291.A O no hydrogen 3.162 N/A TYR 306.A N SER 289.A O no hydrogen 2.934 N/A LEU 308.A N TYR 287.A O no hydrogen 3.204 N/A MET 311.A N TYR 252.A OH no hydrogen 3.013 N/A GLN 312.A N GLU 315.A OE1 no hydrogen 2.889 N/A GLY 314.A N VAL 241.A O no hydrogen 2.996 N/A GLU 315.A N GLN 312.A O no hydrogen 3.237 N/A LEU 317.A N VAL 239.A O no hydrogen 2.912 N/A LEU 318.A N LEU 275.A O no hydrogen 2.734 N/A PHE 319.A N LEU 237.A O no hydrogen 2.833 N/A MET 322.A N PHE 235.A O no hydrogen 3.035 N/A GLY 323.A N ALA 232.A O no hydrogen 3.009 N/A TYR 325.A N CYS 34.A O no hydrogen 3.035 N/A THR 326.A OG1 MET 322.A O no hydrogen 2.646 N/A GLY 329.A N THR 326.A O no hydrogen 3.292 N/A THR 330.A OG1 VAL 327.A O no hydrogen 3.044 N/A SER 331.A N TYR 259.A O no hydrogen 2.864 N/A SER 331.A OG TYR 259.A O no hydrogen 3.020 N/A GLY 335.A N SER 332.A O no hydrogen 2.914 N/A PHE 336.A N PHE 333.A O no hydrogen 3.232 N/A GLN 337.A NE2 GLY 335.A O no hydrogen 3.008 N/A TYR 342.A N PHE 5.A O no hydrogen 2.944 N/A TYR 343.A OH ASP 37.A OD1 no hydrogen 3.224 N/A TYR 343.A OH ASP 37.A OD2 no hydrogen 2.436 N/A VAL 344.A N ALA 7.A O no hydrogen 3.061 N/A