Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1krh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N ILE 19.A O no hydrogen 2.805 N/A HIS 3.A NE2 GLN 21.A OE1 no hydrogen 2.785 N/A GLN 4.A N ASP 89.A OD1 no hydrogen 2.919 N/A VAL 5.A N ILE 17.A O no hydrogen 2.855 N/A ALA 6.A N ALA 90.A O no hydrogen 2.885 N/A LEU 7.A N ARG 15.A O no hydrogen 2.744 N/A GLN 8.A N PHE 92.A O no hydrogen 2.761 N/A PHE 9.A N VAL 13.A O no hydrogen 2.925 N/A GLU 10.A N ALA 96.A O no hydrogen 3.076 N/A GLY 12.A N PHE 9.A O no hydrogen 3.164 N/A ARG 15.A N LEU 7.A O no hydrogen 3.036 N/A ILE 17.A N VAL 5.A O no hydrogen 2.804 N/A CYS 18.A N GLN 32.A OE1 no hydrogen 2.930 N/A ILE 19.A N HIS 3.A O no hydrogen 2.827 N/A ALA 20.A N GLU 23.A OE2 no hydrogen 2.956 N/A GLU 23.A N ALA 20.A O no hydrogen 2.921 N/A LEU 25.A N CYS 84.A O no hydrogen 2.768 N/A SER 26.A N ALA 81.A O no hydrogen 3.013 N/A SER 26.A OG ALA 81.A O no hydrogen 3.359 N/A ASP 27.A N THR 24.A OG1 no hydrogen 3.100 N/A ALA 28.A N THR 24.A O no hydrogen 3.011 N/A ALA 29.A N LEU 25.A O no hydrogen 2.942 N/A TYR 30.A N SER 26.A O no hydrogen 2.947 N/A TYR 30.A OH ILE 36.A O no hydrogen 2.626 N/A ARG 31.A N ASP 27.A O no hydrogen 2.923 N/A ARG 31.A NE GLU 23.A OE1 no hydrogen 2.725 N/A ARG 31.A NH2 CYS 18.A O no hydrogen 2.928 N/A ARG 31.A NH2 GLU 23.A OE1 no hydrogen 3.358 N/A ARG 31.A NH2 GLU 23.A OE2 no hydrogen 2.925 N/A GLN 32.A N ALA 28.A O no hydrogen 3.096 N/A GLN 32.A NE2 CYS 18.A O no hydrogen 2.673 N/A GLN 32.A NE2 ALA 28.A O no hydrogen 3.005 N/A GLN 33.A N TYR 30.A O no hydrogen 2.889 N/A ILE 34.A N ALA 29.A O no hydrogen 2.835 N/A ASN 35.A N CYS 101.A O no hydrogen 2.849 N/A ASN 35.A ND2 THR 103.A O no hydrogen 2.772 N/A ILE 36.A N ILE 34.A O no hydrogen 3.043 N/A CYS 45.A SG THR 47.A OG1 no hydrogen 3.328 N/A THR 47.A OG1 TYR 143.A OH no hydrogen 2.778 N/A ARG 49.A N GLY 46.A O no hydrogen 3.351 N/A ARG 49.A NH1 GLU 73.A OE2 no hydrogen 2.785 N/A ALA 50.A N VAL 79.A O no hydrogen 2.776 N/A PHE 51.A N GLN 93.A O no hydrogen 3.063 N/A CYS 52.A N GLY 77.A O no hydrogen 2.887 N/A CYS 52.A SG SER 54.A O no hydrogen 3.236 N/A CYS 52.A SG GLY 55.A O no hydrogen 3.965 N/A CYS 52.A SG VAL 91.A O no hydrogen 3.890 N/A GLU 53.A N VAL 91.A O no hydrogen 2.777 N/A SER 54.A N VAL 91.A O no hydrogen 3.369 N/A ASN 56.A N SER 88.A OG no hydrogen 2.888 N/A ASP 58.A N ARG 85.A O no hydrogen 2.854 N/A ASN 63.A N PRO 60.A O no hydrogen 2.906 N/A ILE 65.A N GLY 43.A O no hydrogen 3.020 N/A ALA 68.A N ILE 65.A O no hydrogen 3.027 N/A LEU 69.A N ILE 65.A O no hydrogen 3.132 N/A THR 70.A N GLU 73.A OE1 no hydrogen 2.861 N/A THR 70.A OG1 GLU 72.A OE1 no hydrogen 3.283 N/A THR 70.A OG1 GLU 73.A OE1 no hydrogen 3.037 N/A GLU 73.A N THR 70.A OG1 no hydrogen 3.294 N/A ALA 74.A N THR 70.A O no hydrogen 3.025 N/A GLN 75.A N PRO 71.A O no hydrogen 2.966 N/A GLN 76.A N GLU 72.A O no hydrogen 3.221 N/A GLY 77.A N ALA 74.A O no hydrogen 3.069 N/A TYR 78.A N GLU 73.A O no hydrogen 3.063 N/A VAL 79.A N ALA 50.A O no hydrogen 2.758 N/A ALA 81.A N CYS 48.A O no hydrogen 3.221 N/A GLN 83.A N LEU 80.A O no hydrogen 2.947 N/A ARG 85.A N ASP 58.A O no hydrogen 2.873 N/A ARG 85.A NE GLY 22.A O no hydrogen 2.986 N/A THR 87.A N ASN 56.A O no hydrogen 2.854 N/A SER 88.A OG ASP 89.A O no hydrogen 2.893 N/A ALA 90.A N GLN 4.A O no hydrogen 3.240 N/A VAL 91.A N SER 54.A O no hydrogen 2.857 N/A PHE 92.A N ALA 6.A O no hydrogen 2.873 N/A GLN 93.A N PHE 51.A O no hydrogen 2.758 N/A ILE 94.A N GLN 8.A O no hydrogen 2.847 N/A SER 98.A N ASP 11.A OD1 no hydrogen 3.257 N/A SER 98.A N ASP 11.A OD2 no hydrogen 3.089 N/A SER 98.A OG ASP 11.A OD1 no hydrogen 2.545 N/A SER 98.A OG ASP 11.A OD2 no hydrogen 3.563 N/A VAL 100.A N SER 97.A OG no hydrogen 3.182 N/A CYS 101.A N SER 97.A O no hydrogen 3.448 N/A CYS 101.A SG ASN 35.A O no hydrogen 3.630 N/A CYS 101.A SG SER 97.A O no hydrogen 3.566 N/A LYS 102.A N GLU 99.A O no hydrogen 3.014 N/A LYS 102.A NZ GLU 99.A OE2 no hydrogen 3.138 N/A THR 103.A N VAL 100.A O no hydrogen 3.183 N/A THR 103.A OG1 VAL 100.A O no hydrogen 2.710 N/A HIS 106.A N GLY 198.A O no hydrogen 3.002 N/A HIS 107.A ND1 THR 197.A OG1 no hydrogen 2.865 N/A PHE 108.A N PHE 196.A O no hydrogen 2.728 N/A GLY 110.A N MET 194.A O no hydrogen 2.828 N/A THR 111.A N GLN 128.A O no hydrogen 2.889 N/A LEU 112.A N ASP 192.A O no hydrogen 2.757 N/A ALA 113.A N ASP 126.A O no hydrogen 2.898 N/A ARG 114.A NE ASP 126.A OD2 no hydrogen 3.011 N/A ARG 114.A NH1 THR 124.A O no hydrogen 3.396 N/A ARG 114.A NH1 THR 124.A OG1 no hydrogen 2.946 N/A ARG 114.A NH2 THR 124.A OG1 no hydrogen 3.368 N/A ARG 114.A NH2 ASP 126.A OD2 no hydrogen 3.461 N/A GLU 116.A N THR 124.A O no hydrogen 2.850 N/A ASN 117.A ND2 SER 185.A O no hydrogen 3.031 N/A SER 119.A N THR 122.A O no hydrogen 3.315 N/A SER 119.A OG SER 121.A OG no hydrogen 3.005 N/A SER 119.A OG CYS 250.A O no hydrogen 2.753 N/A SER 121.A N SER 119.A OG no hydrogen 2.916 N/A SER 121.A OG SER 119.A OG no hydrogen 3.005 N/A SER 121.A OG THR 122.A OG1 no hydrogen 3.178 N/A SER 121.A OG CYS 250.A O no hydrogen 3.143 N/A SER 121.A OG ASP 251.A OD1 no hydrogen 2.623 N/A THR 122.A N SER 119.A OG no hydrogen 2.993 N/A THR 122.A OG1 SER 121.A OG no hydrogen 3.178 N/A ILE 123.A N VAL 172.A O no hydrogen 2.733 N/A THR 124.A N GLU 116.A O no hydrogen 2.962 N/A PHE 125.A N PHE 170.A O no hydrogen 3.200 N/A ASP 126.A N ARG 114.A O no hydrogen 2.891 N/A ILE 127.A N THR 168.A O no hydrogen 2.882 N/A GLN 128.A N THR 111.A O no hydrogen 2.838 N/A GLN 128.A NE2 LEU 129.A O no hydrogen 3.117 N/A LEU 129.A N ARG 166.A O no hydrogen 3.058 N/A ASP 130.A N GLU 109.A O no hydrogen 2.916 N/A GLN 133.A N ASP 130.A O no hydrogen 2.969 N/A LEU 139.A N GLN 142.A OE1 no hydrogen 2.906 N/A GLN 142.A N LEU 139.A O no hydrogen 2.950 N/A GLN 142.A NE2 GLY 201.A O no hydrogen 2.892 N/A TYR 143.A N PHE 200.A O no hydrogen 2.964 N/A TYR 143.A OH ASP 39.A OD2 no hydrogen 2.614 N/A TYR 143.A OH THR 47.A OG1 no hydrogen 2.778 N/A VAL 144.A N TYR 157.A O no hydrogen 2.942 N/A ASN 145.A N THR 197.A O no hydrogen 2.818 N/A ASN 145.A ND2 ASP 39.A OD1 no hydrogen 3.231 N/A ASN 145.A ND2 ASP 39.A OD2 no hydrogen 3.217 N/A VAL 146.A N ARG 155.A O no hydrogen 2.869 N/A THR 147.A N SER 195.A O no hydrogen 2.906 N/A THR 147.A OG1 SER 195.A OG no hydrogen 3.119 N/A LEU 148.A N GLU 153.A O no hydrogen 2.902 N/A THR 151.A N LEU 148.A O no hydrogen 3.034 N/A ARG 155.A N VAL 146.A O no hydrogen 2.830 N/A ARG 155.A NH1 GLU 153.A OE1 no hydrogen 3.161 N/A ARG 155.A NH1 THR 154.A O no hydrogen 3.029 N/A SER 156.A N ASN 337.A OD1 no hydrogen 2.884 N/A SER 156.A OG ASN 145.A OD1 no hydrogen 2.611 N/A SER 156.A OG ASN 337.A OD1 no hydrogen 3.356 N/A TYR 157.A N VAL 144.A O no hydrogen 2.968 N/A PHE 159.A N GLN 142.A O no hydrogen 3.266 N/A SER 160.A N GLY 169.A O no hydrogen 2.868 N/A GLN 162.A NE2 GLN 233.A OE1 no hydrogen 2.800 N/A ASN 165.A N GLN 162.A O no hydrogen 3.130 N/A ARG 166.A NH1 GLN 133.A O no hydrogen 3.019 N/A ARG 166.A NH1 ASP 135.A OD1 no hydrogen 2.875 N/A ARG 166.A NH2 GLN 133.A O no hydrogen 2.717 N/A LEU 167.A N ASN 165.A OD1 no hydrogen 2.901 N/A THR 168.A N ILE 127.A O no hydrogen 2.909 N/A THR 168.A OG1 ILE 127.A O no hydrogen 2.779 N/A GLY 169.A N SER 161.A OG no hydrogen 2.848 N/A PHE 170.A N PHE 125.A O no hydrogen 2.958 N/A VAL 172.A N ILE 123.A O no hydrogen 2.686 N/A ARG 173.A NH1 SER 121.A O no hydrogen 2.942 N/A ASN 174.A N SER 121.A O no hydrogen 2.757 N/A VAL 175.A N SER 181.A OG no hydrogen 2.815 N/A GLY 178.A N VAL 175.A O no hydrogen 2.813 N/A SER 181.A OG ARG 173.A O no hydrogen 3.266 N/A GLU 182.A N GLY 178.A O no hydrogen 2.913 N/A TYR 183.A N LYS 179.A O no hydrogen 3.062 N/A TYR 183.A OH ASP 192.A OD2 no hydrogen 2.748 N/A LEU 184.A N MET 180.A O no hydrogen 2.871 N/A SER 185.A N SER 181.A O no hydrogen 2.937 N/A SER 185.A OG SER 181.A O no hydrogen 2.643 N/A VAL 186.A N GLU 182.A O no hydrogen 2.973 N/A GLN 187.A N GLU 182.A O no hydrogen 3.504 N/A ALA 188.A N TYR 183.A O no hydrogen 2.575 N/A LYS 189.A N ASP 192.A OD2 no hydrogen 3.109 N/A GLY 191.A N LEU 112.A O no hydrogen 2.656 N/A ASP 192.A N LYS 189.A O no hydrogen 3.072 N/A MET 194.A N GLY 110.A O no hydrogen 2.861 N/A SER 195.A OG HIS 107.A NE2 no hydrogen 3.200 N/A SER 195.A OG THR 147.A OG1 no hydrogen 3.119 N/A PHE 196.A N PHE 108.A O no hydrogen 3.018 N/A THR 197.A N ASN 145.A O no hydrogen 2.956 N/A THR 197.A OG1 HIS 107.A ND1 no hydrogen 2.865 N/A GLY 198.A N HIS 106.A O no hydrogen 3.000 N/A PHE 200.A N TYR 143.A O no hydrogen 2.771 N/A SER 202.A OG GLN 95.A OE1 no hydrogen 3.378 N/A LEU 205.A N ALA 140.A O no hydrogen 3.250 N/A ARG 206.A N TYR 304.A OH no hydrogen 3.125 N/A ARG 206.A NE GLU 10.A OE1 no hydrogen 2.842 N/A ARG 206.A NH1 SER 202.A O no hydrogen 2.695 N/A ARG 206.A NH1 TYR 204.A O no hydrogen 2.916 N/A ARG 206.A NH2 GLU 10.A OE1 no hydrogen 3.380 N/A ARG 206.A NH2 GLU 10.A OE2 no hydrogen 2.804 N/A ARG 206.A NH2 SER 202.A O no hydrogen 2.965 N/A ARG 210.A NE GLU 300.A OE1 no hydrogen 3.349 N/A ARG 210.A NH1 ASP 302.A OD1 no hydrogen 3.029 N/A ARG 210.A NH1 ASP 302.A OD2 no hydrogen 3.104 N/A VAL 212.A N PRO 239.A O no hydrogen 2.966 N/A LEU 213.A N ASP 302.A O no hydrogen 2.860 N/A MET 214.A N ARG 241.A O no hydrogen 2.755 N/A LEU 215.A N TYR 304.A O no hydrogen 2.712 N/A ALA 216.A N VAL 243.A O no hydrogen 2.921 N/A GLY 217.A N CYS 306.A O no hydrogen 2.943 N/A GLY 218.A N GLY 245.A O no hydrogen 2.836 N/A GLY 220.A N GLY 217.A O no hydrogen 2.830 N/A ILE 221.A N GLY 218.A O no hydrogen 3.366 N/A ALA 222.A N THR 219.A O no hydrogen 2.976 N/A LEU 225.A N ILE 221.A O no hydrogen 3.108 N/A LEU 225.A N ALA 222.A O no hydrogen 3.044 N/A SER 226.A N ALA 222.A O no hydrogen 3.441 N/A SER 226.A OG SER 161.A O no hydrogen 2.695 N/A MET 227.A N PRO 223.A O no hydrogen 2.916 N/A LEU 228.A N PHE 224.A O no hydrogen 2.771 N/A GLN 229.A N LEU 225.A O no hydrogen 3.124 N/A GLN 229.A N SER 226.A O no hydrogen 3.148 N/A GLN 229.A NE2 LEU 225.A O no hydrogen 3.510 N/A VAL 230.A N SER 226.A O no hydrogen 3.198 N/A LEU 231.A N MET 227.A O no hydrogen 2.937 N/A GLU 232.A N LEU 228.A O no hydrogen 2.826 N/A GLN 233.A N VAL 230.A O no hydrogen 3.224 N/A LYS 234.A N VAL 230.A O no hydrogen 3.004 N/A GLY 235.A N LEU 231.A O no hydrogen 2.711 N/A SER 236.A OG HIS 238.A O no hydrogen 2.614 N/A HIS 238.A N SER 236.A OG no hydrogen 3.132 N/A VAL 240.A N TRP 267.A O no hydrogen 2.810 N/A ARG 241.A N VAL 212.A O no hydrogen 2.935 N/A LEU 242.A N GLU 269.A O no hydrogen 2.993 N/A VAL 243.A N MET 214.A O no hydrogen 2.824 N/A PHE 244.A N ARG 271.A O no hydrogen 2.792 N/A GLY 245.A N ALA 216.A O no hydrogen 2.776 N/A VAL 246.A N VAL 273.A O no hydrogen 2.870 N/A GLN 248.A N ASP 251.A OD2 no hydrogen 3.335 N/A CYS 250.A SG SER 121.A OG no hydrogen 3.760 N/A CYS 250.A SG ASP 251.A OD1 no hydrogen 3.649 N/A ASP 251.A N GLN 248.A O no hydrogen 2.948 N/A LEU 252.A N ASP 249.A O no hydrogen 3.089 N/A GLU 256.A N GLU 256.A OE2 no hydrogen 2.521 N/A LEU 258.A N ALA 254.A O no hydrogen 2.916 N/A ASP 259.A N LEU 255.A O no hydrogen 2.761 N/A ALA 260.A N GLU 256.A O no hydrogen 2.957 N/A LEU 261.A N GLN 257.A O no hydrogen 3.206 N/A GLN 262.A N LEU 258.A O no hydrogen 3.048 N/A GLN 263.A N ASP 259.A O no hydrogen 2.997 N/A LYS 264.A N ALA 260.A O no hydrogen 3.052 N/A LYS 264.A NZ GLU 232.A OE2 no hydrogen 2.674 N/A LEU 265.A N LEU 261.A O no hydrogen 2.777 N/A PHE 268.A N LEU 265.A O no hydrogen 3.174 N/A GLU 269.A N VAL 240.A O no hydrogen 3.267 N/A TYR 270.A N GLN 262.A OE1 no hydrogen 2.904 N/A TYR 270.A OH ASP 259.A OD1 no hydrogen 2.599 N/A ARG 271.A N LEU 242.A O no hydrogen 2.842 N/A ARG 271.A NH2 GLU 292.A OE2 no hydrogen 2.801 N/A VAL 273.A N PHE 244.A O no hydrogen 2.825 N/A VAL 274.A N ARG 283.A O no hydrogen 2.957 N/A ALA 275.A N VAL 246.A O no hydrogen 2.934 N/A HIS 276.A N THR 247.A O no hydrogen 2.895 N/A GLU 278.A N ASP 249.A OD2 no hydrogen 3.269 N/A HIS 281.A N SER 279.A OG no hydrogen 3.417 N/A GLY 285.A N VAL 274.A O no hydrogen 3.037 N/A GLY 289.A N TYR 286.A O no hydrogen 3.155 N/A HIS 290.A N VAL 287.A O no hydrogen 2.903 N/A HIS 290.A NE2 LYS 284.A O no hydrogen 2.808 N/A TRP 295.A N GLU 292.A O no hydrogen 2.900 N/A LEU 296.A N TYR 293.A O no hydrogen 3.059 N/A ASN 297.A N ASP 294.A O no hydrogen 2.959 N/A ASN 297.A ND2 GLU 300.A O no hydrogen 2.860 N/A GLY 299.A N LEU 296.A O no hydrogen 2.784 N/A GLU 300.A N ASN 297.A O no hydrogen 2.918 N/A VAL 301.A N GLY 299.A O no hydrogen 2.806 N/A ASP 302.A N PRO 211.A O no hydrogen 2.926 N/A VAL 303.A N ASN 328.A O no hydrogen 2.904 N/A TYR 304.A N LEU 213.A O no hydrogen 2.845 N/A LEU 305.A N LEU 330.A O no hydrogen 2.862 N/A CYS 306.A N LEU 215.A O no hydrogen 2.967 N/A CYS 306.A SG GLY 220.A O no hydrogen 3.699 N/A CYS 306.A SG GLU 332.A O no hydrogen 3.665 N/A GLY 307.A N GLU 332.A O no hydrogen 3.414 N/A VAL 312.A N PRO 308.A O no hydrogen 3.052 N/A GLU 313.A N VAL 309.A O no hydrogen 2.935 N/A ALA 314.A N PRO 310.A O no hydrogen 2.935 N/A VAL 315.A N MET 311.A O no hydrogen 3.029 N/A ARG 316.A N VAL 312.A O no hydrogen 2.953 N/A ARG 316.A NH1 GLU 73.A OE2 no hydrogen 3.309 N/A ARG 316.A NH1 GLU 313.A OE2 no hydrogen 2.973 N/A ARG 316.A NH2 GLU 73.A OE2 no hydrogen 2.630 N/A SER 317.A N GLU 313.A O no hydrogen 2.887 N/A TRP 318.A N ALA 314.A O no hydrogen 3.015 N/A LEU 319.A N VAL 315.A O no hydrogen 2.863 N/A ASP 320.A N ARG 316.A O no hydrogen 2.989 N/A THR 321.A N SER 317.A O no hydrogen 2.827 N/A THR 321.A OG1 SER 317.A O no hydrogen 3.195 N/A GLN 322.A N TRP 318.A O no hydrogen 2.891 N/A GLY 323.A N ASP 320.A O no hydrogen 3.068 N/A ILE 324.A N LEU 319.A O no hydrogen 2.932 N/A ALA 327.A N VAL 301.A O no hydrogen 2.976 N/A ASN 328.A ND2 ASP 302.A OD2 no hydrogen 2.878 N/A LEU 330.A N VAL 303.A O no hydrogen 2.846 N/A GLU 332.A N LEU 305.A O no hydrogen 2.917 N/A LYS 333.A NZ GLU 66.A O no hydrogen 3.359 N/A LYS 333.A NZ ASP 67.A O no hydrogen 3.433 N/A LYS 333.A NZ GLU 313.A OE2 no hydrogen 3.129 N/A PHE 334.A N GLY 307.A O no hydrogen 2.878 N/A ASN 337.A ND2 SER 335.A O no hydrogen 2.897 N/A