Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xrm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG VAL 3.A O no hydrogen 3.510 N/A GLU 8.A N MET 5.A O no hydrogen 2.850 N/A ILE 9.A N MET 5.A O no hydrogen 2.816 N/A VAL 10.A N GLY 6.A O no hydrogen 3.431 N/A GLU 11.A N GLU 8.A O no hydrogen 2.870 N/A ALA 12.A N VAL 7.A O no hydrogen 3.234 N/A ALA 14.A N GLU 11.A O no hydrogen 3.216 N/A VAL 15.A N ALA 12.A O no hydrogen 2.926 N/A TRP 16.A N ALA 12.A O no hydrogen 3.199 N/A TRP 16.A NE1 VAL 88.A O no hydrogen 3.070 N/A SER 19.A N VAL 15.A O no hydrogen 2.848 N/A SER 19.A N TRP 16.A O no hydrogen 3.173 N/A SER 19.A OG VAL 15.A O no hydrogen 2.697 N/A SER 19.A OG TRP 16.A O no hydrogen 3.176 N/A ALA 20.A N ARG 17.A O no hydrogen 3.473 N/A LYS 21.A N TRP 16.A O no hydrogen 3.050 N/A LYS 21.A NZ GLU 80.A OE2 no hydrogen 2.623 N/A GLY 22.A N SER 19.A O no hydrogen 3.428 N/A ALA 23.A N ALA 20.A O no hydrogen 2.832 N/A GLN 25.A N GLY 22.A O no hydrogen 3.085 N/A ILE 27.A N ASP 93.A O no hydrogen 2.585 N/A GLY 28.A N ILE 131.A O no hydrogen 2.946 N/A VAL 29.A N PHE 95.A O no hydrogen 2.936 N/A ILE 30.A N THR 133.A O no hydrogen 2.935 N/A ASP 31.A N ILE 97.A O no hydrogen 3.007 N/A THR 32.A N ASP 31.A OD1 no hydrogen 3.031 N/A THR 32.A OG1 ASP 64.A OD1 no hydrogen 2.139 N/A CYS 34.A N PHE 62.A O no hydrogen 3.062 N/A GLN 35.A N THR 70.A OG1 no hydrogen 2.673 N/A GLN 35.A NE2 SER 223.A OG no hydrogen 2.994 N/A HIS 38.A N GLN 35.A O no hydrogen 2.992 N/A HIS 38.A NE2 GLY 224.A O no hydrogen 2.862 N/A ASP 40.A N HIS 38.A ND1 no hydrogen 3.114 N/A LEU 41.A N HIS 38.A O no hydrogen 2.892 N/A ALA 42.A N HIS 38.A O no hydrogen 3.060 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.451 N/A ARG 44.A N LEU 41.A O no hydrogen 2.896 N/A ARG 44.A NE ALA 92.A O no hydrogen 3.035 N/A ILE 45.A N LEU 41.A O no hydrogen 3.107 N/A ILE 46.A N LEU 94.A O no hydrogen 3.199 N/A VAL 49.A N ILE 96.A O no hydrogen 2.693 N/A ASN 50.A N GLU 59.A O no hydrogen 2.717 N/A ASN 50.A ND2 ASP 54.A O no hydrogen 3.264 N/A ASN 50.A ND2 ASP 58.A O no hydrogen 2.730 N/A LEU 51.A N LYS 98.A O no hydrogen 3.056 N/A THR 52.A N ASN 50.A OD1 no hydrogen 2.884 N/A THR 52.A OG1 ASN 50.A OD1 no hydrogen 2.630 N/A TYR 55.A OH SER 63.A O no hydrogen 3.253 N/A THR 60.A N ASP 58.A OD1 no hydrogen 3.401 N/A ASN 61.A N ASP 58.A O no hydrogen 3.188 N/A SER 63.A N ASN 61.A OD1 no hydrogen 3.267 N/A SER 63.A OG TYR 55.A OH no hydrogen 3.318 N/A SER 63.A OG ASN 61.A OD1 no hydrogen 2.787 N/A ASN 66.A ND2 GLY 102.A O no hydrogen 3.449 N/A HIS 68.A N ASN 66.A OD1 no hydrogen 3.186 N/A HIS 68.A ND1 ASP 31.A OD1 no hydrogen 2.558 N/A GLY 69.A N THR 32.A OG1 no hydrogen 3.361 N/A THR 70.A OG1 ASP 64.A OD2 no hydrogen 3.319 N/A HIS 71.A N GLY 67.A O no hydrogen 3.170 N/A HIS 71.A NE2 ALA 226.A O no hydrogen 2.786 N/A VAL 72.A N HIS 68.A O no hydrogen 3.090 N/A ALA 73.A N THR 70.A O no hydrogen 3.252 N/A GLY 74.A N THR 70.A O no hydrogen 3.290 N/A GLY 74.A N HIS 71.A O no hydrogen 3.078 N/A THR 75.A N HIS 71.A O no hydrogen 3.225 N/A THR 75.A OG1 HIS 71.A O no hydrogen 3.504 N/A VAL 76.A N VAL 72.A O no hydrogen 3.080 N/A ALA 77.A N ALA 73.A O no hydrogen 2.902 N/A ALA 78.A N GLY 74.A O no hydrogen 2.607 N/A ALA 79.A N ASP 40.A O no hydrogen 3.139 N/A THR 81.A N GLU 2.A OE1 no hydrogen 3.167 N/A THR 81.A OG1 GLU 2.A OE2 no hydrogen 2.720 N/A THR 81.A OG1 ASP 40.A OD1 no hydrogen 2.818 N/A THR 81.A OG1 ALA 79.A O no hydrogen 3.279 N/A THR 81.A OG1 SER 83.A O no hydrogen 3.023 N/A THR 81.A OG1 SER 83.A OG no hydrogen 2.794 N/A GLY 82.A N GLU 2.A OE1 no hydrogen 3.216 N/A SER 83.A N THR 81.A OG1 no hydrogen 3.200 N/A SER 83.A OG ASP 40.A OD1 no hydrogen 3.500 N/A SER 83.A OG THR 81.A OG1 no hydrogen 2.794 N/A VAL 85.A N ASP 40.A OD2 no hydrogen 3.056 N/A GLY 87.A N ALA 78.A O no hydrogen 2.630 N/A VAL 88.A N THR 75.A O no hydrogen 2.934 N/A ALA 89.A N VAL 76.A O no hydrogen 2.925 N/A LYS 91.A N LYS 21.A O no hydrogen 3.018 N/A ALA 92.A N ALA 89.A O no hydrogen 2.743 N/A ASP 93.A N GLN 25.A O no hydrogen 2.772 N/A LEU 94.A N ARG 44.A O no hydrogen 3.121 N/A PHE 95.A N ILE 27.A O no hydrogen 2.943 N/A ILE 96.A N GLY 47.A O no hydrogen 2.969 N/A ILE 97.A N VAL 29.A O no hydrogen 2.851 N/A LYS 98.A N VAL 49.A O no hydrogen 3.076 N/A LYS 98.A NZ THR 32.A O no hydrogen 3.365 N/A LYS 98.A NZ ASN 65.A OD1 no hydrogen 3.190 N/A LYS 98.A NZ LEU 100.A O no hydrogen 2.456 N/A ALA 99.A N ASP 31.A O no hydrogen 2.813 N/A LEU 100.A N ASP 31.A O no hydrogen 3.065 N/A SER 101.A N SER 105.A O no hydrogen 3.036 N/A SER 101.A OG ASP 54.A OD1 no hydrogen 2.779 N/A SER 101.A OG SER 105.A O no hydrogen 3.329 N/A GLY 102.A N ASP 54.A OD2 no hydrogen 3.132 N/A GLY 104.A N SER 101.A O no hydrogen 2.557 N/A SER 105.A OG ASP 103.A OD2 no hydrogen 2.877 N/A TRP 110.A N GLU 107.A O no hydrogen 2.676 N/A ALA 112.A N MET 108.A O no hydrogen 3.078 N/A LYS 113.A N GLY 109.A O no hydrogen 3.398 N/A ALA 114.A N TRP 110.A O no hydrogen 3.099 N/A ILE 115.A N ILE 111.A O no hydrogen 3.023 N/A ARG 116.A N ALA 112.A O no hydrogen 3.245 N/A ARG 116.A NH2 GLU 144.A O no hydrogen 3.447 N/A TYR 117.A N LYS 113.A O no hydrogen 2.556 N/A ALA 118.A N ALA 114.A O no hydrogen 3.160 N/A VAL 119.A N ILE 115.A O no hydrogen 3.069 N/A ASP 120.A N ARG 116.A O no hydrogen 2.946 N/A TRP 121.A N TYR 117.A O no hydrogen 2.681 N/A GLY 123.A N GLU 127.A O no hydrogen 3.198 N/A GLY 126.A N GLY 123.A O no hydrogen 2.576 N/A ARG 130.A N ILE 26.A O no hydrogen 3.397 N/A ARG 130.A NH1 GLU 250.A OE2 no hydrogen 3.389 N/A ARG 130.A NH2 LEU 257.A O no hydrogen 3.367 N/A ILE 132.A N SER 158.A O no hydrogen 2.861 N/A THR 133.A N GLY 28.A O no hydrogen 2.827 N/A MET 134.A N VAL 160.A O no hydrogen 2.841 N/A SER 135.A OG ALA 232.A O no hydrogen 2.845 N/A GLY 138.A N TYR 178.A O no hydrogen 2.886 N/A LEU 145.A N SER 142.A O no hydrogen 3.068 N/A ALA 148.A N GLU 144.A O no hydrogen 3.318 N/A VAL 149.A N LEU 145.A O no hydrogen 2.965 N/A LYS 150.A N HIS 146.A O no hydrogen 2.803 N/A TYR 151.A N ASP 147.A O no hydrogen 2.610 N/A TYR 151.A OH ASP 120.A OD1 no hydrogen 2.375 N/A ALA 152.A N ALA 148.A O no hydrogen 2.870 N/A VAL 153.A N VAL 149.A O no hydrogen 2.926 N/A SER 154.A N LYS 150.A O no hydrogen 3.178 N/A SER 154.A OG LYS 150.A O no hydrogen 2.990 N/A ASN 155.A N ALA 152.A O no hydrogen 2.896 N/A VAL 157.A N ALA 152.A O no hydrogen 3.164 N/A SER 158.A N ARG 130.A O no hydrogen 2.761 N/A SER 158.A OG GLU 259.A OE1 no hydrogen 2.865 N/A SER 158.A OG GLU 259.A OE2 no hydrogen 2.533 N/A VAL 160.A N ILE 132.A O no hydrogen 2.842 N/A CYS 161.A N ILE 186.A O no hydrogen 2.765 N/A ALA 162.A N MET 134.A O no hydrogen 3.209 N/A ALA 163.A N VAL 188.A O no hydrogen 2.803 N/A GLY 164.A N THR 231.A OG1 no hydrogen 3.157 N/A GLY 167.A N PHE 200.A O no hydrogen 2.958 N/A ASP 168.A N GLU 175.A OE2 no hydrogen 3.230 N/A ARG 170.A N ASP 168.A OD2 no hydrogen 2.545 N/A THR 173.A OG1 ASP 168.A OD1 no hydrogen 2.784 N/A THR 173.A OG1 ASP 168.A OD2 no hydrogen 3.077 N/A GLU 175.A N THR 203.A O no hydrogen 2.793 N/A TYR 178.A N GLY 138.A O no hydrogen 2.750 N/A TYR 182.A N PRO 179.A O no hydrogen 2.874 N/A TYR 182.A OH ASP 141.A OD2 no hydrogen 2.756 N/A ASN 183.A ND2 GLU 206.A OE1 no hydrogen 2.729 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.965 N/A VAL 185.A N TYR 182.A O no hydrogen 3.420 N/A ILE 186.A N VAL 159.A O no hydrogen 2.572 N/A ALA 187.A N ASP 208.A OD2 no hydrogen 2.740 N/A VAL 188.A N CYS 161.A O no hydrogen 2.762 N/A GLY 189.A N ILE 209.A O no hydrogen 3.083 N/A ALA 190.A N THR 201.A OG1 no hydrogen 3.131 N/A VAL 191.A N ALA 211.A O no hydrogen 3.176 N/A ASP 192.A N ARG 196.A O no hydrogen 3.084 N/A ASP 194.A N ASP 192.A OD1 no hydrogen 2.650 N/A LEU 195.A N ASP 192.A O no hydrogen 2.999 N/A ARG 196.A N ASP 192.A OD1 no hydrogen 3.005 N/A SER 198.A OG ALA 190.A O no hydrogen 3.556 N/A ASN 202.A N GLY 164.A O no hydrogen 2.822 N/A ASN 202.A ND2 PHE 200.A O no hydrogen 3.480 N/A THR 203.A OG1 GLU 171.A O no hydrogen 3.207 N/A THR 203.A OG1 GLU 175.A OE1 no hydrogen 2.986 N/A ASN 204.A N GLN 278.A O no hydrogen 2.961 N/A ASN 204.A ND2 GLU 175.A O no hydrogen 2.984 N/A GLU 206.A N ASN 204.A OD1 no hydrogen 2.978 N/A ASP 208.A N ALA 187.A O no hydrogen 2.848 N/A ILE 209.A N ALA 187.A O no hydrogen 3.397 N/A VAL 210.A N GLY 283.A O no hydrogen 2.958 N/A ALA 211.A N GLY 189.A O no hydrogen 3.160 N/A GLY 213.A N VAL 191.A O no hydrogen 2.879 N/A GLY 215.A N SER 229.A OG no hydrogen 2.437 N/A ILE 216.A N LEU 228.A O no hydrogen 2.671 N/A SER 218.A N ALA 226.A O no hydrogen 2.943 N/A SER 218.A OG HIS 71.A O no hydrogen 2.836 N/A SER 218.A OG THR 219.A OG1 no hydrogen 3.314 N/A THR 219.A OG1 THR 70.A O no hydrogen 2.699 N/A THR 219.A OG1 SER 218.A OG no hydrogen 3.314 N/A TYR 220.A N GLY 224.A O no hydrogen 2.904 N/A SER 223.A N GLN 35.A OE1 no hydrogen 2.755 N/A GLY 224.A N TYR 220.A O no hydrogen 3.019 N/A GLY 224.A N LEU 221.A O no hydrogen 3.046 N/A TYR 225.A OH ASP 40.A OD2 no hydrogen 2.974 N/A ALA 226.A N SER 218.A O no hydrogen 2.987 N/A LEU 228.A N ILE 216.A O no hydrogen 3.104 N/A GLY 230.A N GLY 213.A O no hydrogen 2.797 N/A THR 231.A N ASN 165.A OD1 no hydrogen 2.826 N/A THR 231.A OG1 ASN 165.A OD1 no hydrogen 2.492 N/A MET 233.A N GLY 230.A O no hydrogen 2.804 N/A ALA 235.A N THR 231.A O no hydrogen 3.121 N/A HIS 237.A N ALA 234.A O no hydrogen 2.917 N/A HIS 237.A ND1 MET 233.A O no hydrogen 2.900 N/A HIS 237.A ND1 ALA 234.A O no hydrogen 3.298 N/A ALA 239.A N ALA 235.A O no hydrogen 2.989 N/A GLY 240.A N PRO 236.A O no hydrogen 2.858 N/A ALA 241.A N HIS 237.A O no hydrogen 2.789 N/A LEU 242.A N VAL 238.A O no hydrogen 3.095 N/A LEU 242.A N ALA 239.A O no hydrogen 3.034 N/A ALA 243.A N GLY 240.A O no hydrogen 2.776 N/A LEU 244.A N GLY 240.A O no hydrogen 3.265 N/A ILE 245.A N ALA 241.A O no hydrogen 2.905 N/A ILE 246.A N LEU 242.A O no hydrogen 2.979 N/A ASN 247.A N ALA 243.A O no hydrogen 3.249 N/A ASN 247.A ND2 SER 19.A O no hydrogen 2.720 N/A ASN 247.A ND2 ALA 23.A O no hydrogen 2.879 N/A LEU 248.A N LEU 244.A O no hydrogen 2.963 N/A ALA 249.A N ILE 245.A O no hydrogen 2.971 N/A GLU 250.A N ILE 246.A O no hydrogen 2.720 N/A ASP 251.A N ASN 247.A O no hydrogen 3.027 N/A ALA 252.A N LEU 248.A O no hydrogen 3.158 N/A PHE 253.A N ALA 249.A O no hydrogen 2.885 N/A LYS 254.A N GLU 250.A O no hydrogen 2.861 N/A ARG 255.A NH1 SER 256.A O no hydrogen 2.666 N/A ARG 255.A NH1 GLU 261.A OE1 no hydrogen 3.317 N/A ARG 255.A NH1 GLU 261.A OE2 no hydrogen 2.903 N/A ARG 255.A NH2 GLU 261.A OE1 no hydrogen 2.692 N/A LEU 257.A N GLU 250.A OE2 no hydrogen 3.183 N/A SER 258.A N GLU 261.A OE2 no hydrogen 2.795 N/A GLU 259.A N ASN 156.A OD1 no hydrogen 3.129 N/A GLU 261.A N SER 258.A OG no hydrogen 3.152 N/A ILE 262.A N SER 258.A O no hydrogen 2.904 N/A TYR 263.A N GLU 259.A O no hydrogen 3.030 N/A TYR 263.A OH ASP 208.A OD1 no hydrogen 2.816 N/A ALA 264.A N THR 260.A O no hydrogen 3.023 N/A GLN 265.A N GLU 261.A O no hydrogen 3.115 N/A LEU 266.A N ILE 262.A O no hydrogen 2.786 N/A VAL 267.A N TYR 263.A O no hydrogen 2.909 N/A ARG 268.A N ALA 264.A O no hydrogen 2.919 N/A ARG 268.A NE GLN 265.A OE1 no hydrogen 3.550 N/A ARG 269.A N LEU 266.A O no hydrogen 2.684 N/A ARG 269.A NH1 GLN 265.A O no hydrogen 2.862 N/A ARG 269.A NH1 GLN 265.A OE1 no hydrogen 2.813 N/A ALA 270.A N VAL 267.A O no hydrogen 3.157 N/A THR 271.A N PHE 284.A O no hydrogen 2.827 N/A THR 271.A OG1 THR 286.A OG1 no hydrogen 2.754 N/A ILE 273.A N GLU 280.A OE1 no hydrogen 2.687 N/A ILE 273.A N GLU 280.A OE2 no hydrogen 3.097 N/A THR 276.A N GLU 171.A OE1 no hydrogen 2.945 N/A THR 276.A OG1 GLU 171.A OE1 no hydrogen 3.061 N/A ALA 279.A N THR 276.A O no hydrogen 3.009 N/A GLU 280.A N THR 276.A O no hydrogen 2.876 N/A GLY 281.A N ALA 277.A O no hydrogen 2.747 N/A ASN 282.A N ASP 208.A O no hydrogen 2.826 N/A ASN 282.A ND2 ASP 208.A O no hydrogen 2.915 N/A ASN 282.A ND2 TYR 263.A OH no hydrogen 3.230 N/A GLY 283.A N GLU 280.A O no hydrogen 2.891 N/A PHE 284.A N THR 271.A O no hydrogen 2.701 N/A LEU 285.A N VAL 210.A O no hydrogen 3.169 N/A THR 286.A N ARG 269.A O no hydrogen 2.694 N/A THR 286.A OG1 ARG 269.A O no hydrogen 3.236 N/A THR 286.A OG1 THR 271.A OG1 no hydrogen 2.754 N/A THR 286.A OG1 THR 286.A O no hydrogen 2.542 N/A LEU 287.A N VAL 10.A O no hydrogen 2.817 N/A ASP 288.A N GLU 11.A OE1 no hydrogen 2.743 N/A LEU 289.A N THR 286.A O no hydrogen 3.187 N/A ARG 292.A N ASP 288.A O no hydrogen 3.099 N/A ARG 292.A NH1 GLU 11.A OE1 no hydrogen 3.528 N/A ARG 292.A NH1 GLU 11.A OE2 no hydrogen 3.250 N/A ARG 292.A NH2 GLU 11.A OE1 no hydrogen 2.783 N/A ILE 293.A N LEU 289.A O no hydrogen 3.095 N/A ILE 293.A N VAL 290.A O no hydrogen 3.063 N/A THR 294.A N VAL 290.A O no hydrogen 3.054 N/A THR 294.A N GLU 291.A O no hydrogen 2.827 N/A GLY 295.A N GLU 291.A O no hydrogen 2.826 N/A THR 298.A OG1 GLU 299.A O no hydrogen 3.107 N/A