Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3grf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 GLU 16.A OE1 no hydrogen 3.107 N/A ARG 4.A NH2 GLU 16.A OE1 no hydrogen 2.990 N/A ARG 4.A NH2 GLU 16.A OE2 no hydrogen 2.217 N/A LEU 6.A N CYS 111.A O no hydrogen 2.914 N/A THR 8.A OG1 SER 10.A OG no hydrogen 2.958 N/A ILE 9.A N ASP 163.A OD1 no hydrogen 2.994 N/A SER 10.A OG THR 8.A OG1 no hydrogen 2.958 N/A SER 10.A OG GLU 194.A OE2 no hydrogen 2.683 N/A ALA 11.A N THR 8.A O no hydrogen 3.242 N/A LEU 12.A N ILE 9.A O no hydrogen 3.049 N/A CYS 13.A N GLU 16.A OE1 no hydrogen 3.086 N/A LEU 17.A N CYS 13.A O no hydrogen 3.131 N/A ALA 18.A N PRO 14.A O no hydrogen 3.099 N/A TYR 19.A N LYS 15.A O no hydrogen 2.817 N/A LEU 20.A N GLU 16.A O no hydrogen 2.961 N/A ILE 21.A N LEU 17.A O no hydrogen 3.150 N/A ASP 22.A N ALA 18.A O no hydrogen 3.200 N/A ARG 23.A N TYR 19.A O no hydrogen 2.849 N/A ARG 23.A NE ASP 297.A OD2 no hydrogen 3.251 N/A ARG 23.A NH2 ASP 297.A OD2 no hydrogen 2.927 N/A ALA 24.A N LEU 20.A O no hydrogen 2.821 N/A LEU 25.A N ILE 21.A O no hydrogen 2.929 N/A ASP 26.A N ASP 22.A O no hydrogen 2.919 N/A MET 27.A N ARG 23.A O no hydrogen 2.762 N/A LYS 28.A N ALA 24.A O no hydrogen 2.910 N/A LYS 28.A NZ GLU 133.A OE1 no hydrogen 3.467 N/A LYS 28.A NZ GLU 133.A OE2 no hydrogen 2.734 N/A LYS 28.A NZ ASN 287.A OD1 no hydrogen 3.055 N/A LYS 29.A N LEU 25.A O no hydrogen 3.253 N/A ASN 30.A N ASP 26.A O no hydrogen 2.809 N/A ASN 30.A ND2 ASP 26.A O no hydrogen 3.613 N/A ASN 30.A ND2 ASP 26.A OD2 no hydrogen 2.597 N/A LYS 33.A N ASN 30.A O no hydrogen 3.203 N/A TYR 34.A N PRO 31.A O no hydrogen 2.970 N/A TYR 34.A OH ASP 26.A OD1 no hydrogen 2.626 N/A ARG 37.A N TYR 34.A O no hydrogen 3.294 N/A ARG 37.A NE ASP 297.A OD1 no hydrogen 2.977 N/A ARG 37.A NH2 ASP 297.A OD1 no hydrogen 3.501 N/A ARG 37.A NH2 ASP 297.A OD2 no hydrogen 3.321 N/A ALA 38.A N LEU 65.A O no hydrogen 2.837 N/A ALA 39.A N ALA 36.A O no hydrogen 3.329 N/A LYS 41.A N ALA 38.A O no hydrogen 2.935 N/A THR 42.A N ASP 88.A OD1 no hydrogen 2.995 N/A LEU 43.A N HIS 68.A O no hydrogen 2.835 N/A LEU 44.A N ILE 89.A O no hydrogen 2.925 N/A ALA 45.A N ILE 70.A O no hydrogen 2.819 N/A PHE 46.A N THR 91.A O no hydrogen 3.041 N/A PHE 47.A N TYR 72.A O no hydrogen 3.034 N/A ALA 48.A N ARG 93.A O no hydrogen 2.941 N/A LYS 49.A NZ PRO 50.A O no hydrogen 3.086 N/A SER 51.A OG THR 54.A OG1 no hydrogen 3.206 N/A THR 54.A N SER 51.A OG no hydrogen 3.052 N/A THR 54.A OG1 SER 51.A OG no hydrogen 3.206 N/A ARG 55.A N SER 51.A O no hydrogen 2.773 N/A ARG 55.A NH1 GLU 59.A OE1 no hydrogen 2.891 N/A VAL 56.A N LEU 52.A O no hydrogen 2.820 N/A SER 57.A N ARG 53.A O no hydrogen 3.152 N/A SER 57.A OG ARG 53.A O no hydrogen 2.796 N/A SER 57.A OG THR 54.A O no hydrogen 3.118 N/A LEU 58.A N THR 54.A O no hydrogen 3.099 N/A GLU 59.A N ARG 55.A O no hydrogen 3.046 N/A THR 60.A N VAL 56.A O no hydrogen 2.984 N/A THR 60.A OG1 VAL 56.A O no hydrogen 2.605 N/A ALA 61.A N SER 57.A O no hydrogen 2.819 N/A MET 62.A N LEU 58.A O no hydrogen 3.210 N/A THR 63.A N GLU 59.A O no hydrogen 3.282 N/A THR 63.A OG1 GLU 59.A O no hydrogen 3.178 N/A ARG 64.A N THR 60.A O no hydrogen 2.936 N/A LEU 65.A N ALA 61.A O no hydrogen 3.206 N/A LEU 65.A N MET 62.A O no hydrogen 3.169 N/A GLY 66.A N MET 62.A O no hydrogen 2.811 N/A GLY 66.A N THR 63.A O no hydrogen 3.064 N/A GLY 67.A N MET 62.A O no hydrogen 2.785 N/A HIS 68.A N LYS 41.A O no hydrogen 3.153 N/A ILE 70.A N LEU 43.A O no hydrogen 2.768 N/A TYR 72.A N ALA 45.A O no hydrogen 2.703 N/A GLU 73.A N GLU 73.A OE2 no hydrogen 2.965 N/A LEU 74.A N PHE 47.A O no hydrogen 2.836 N/A THR 79.A N THR 75.A O no hydrogen 2.958 N/A THR 79.A OG1 THR 75.A O no hydrogen 2.707 N/A ALA 80.A N VAL 76.A O no hydrogen 2.807 N/A GLU 81.A N GLN 77.A O no hydrogen 2.720 N/A VAL 82.A N ASP 78.A O no hydrogen 2.912 N/A PHE 83.A N THR 79.A O no hydrogen 2.816 N/A SER 84.A N ALA 80.A O no hydrogen 3.110 N/A SER 84.A OG ALA 80.A O no hydrogen 2.480 N/A ARG 85.A N VAL 82.A O no hydrogen 3.369 N/A ARG 85.A NH1 GLU 81.A O no hydrogen 2.808 N/A ARG 85.A NH1 GLU 81.A OE2 no hydrogen 2.949 N/A MET 86.A N PHE 83.A O no hydrogen 3.030 N/A VAL 87.A N PHE 83.A O no hydrogen 2.847 N/A ASP 88.A N THR 42.A O no hydrogen 3.183 N/A CYS 90.A N PRO 110.A O no hydrogen 3.049 N/A CYS 90.A SG LEU 44.A O no hydrogen 3.709 N/A CYS 90.A SG THR 91.A O no hydrogen 3.645 N/A THR 91.A N LEU 44.A O no hydrogen 2.992 N/A ALA 92.A N ILE 112.A O no hydrogen 3.094 N/A ARG 93.A N PHE 46.A O no hydrogen 3.008 N/A LYS 97.A N ASP 117.A OD2 no hydrogen 2.912 N/A LYS 97.A NZ GLU 98.A OE1 no hydrogen 2.843 N/A MET 100.A N THR 96.A O no hydrogen 3.484 N/A ARG 101.A N LYS 97.A O no hydrogen 2.853 N/A GLU 102.A N GLU 98.A O no hydrogen 2.768 N/A MET 103.A N MET 99.A O no hydrogen 3.012 N/A ALA 104.A N MET 100.A O no hydrogen 3.021 N/A GLN 105.A N ARG 101.A O no hydrogen 2.794 N/A HIS 106.A N MET 103.A O no hydrogen 3.257 N/A ALA 107.A N MET 103.A O no hydrogen 3.101 N/A ALA 107.A N ALA 104.A O no hydrogen 3.173 N/A SER 108.A N SER 84.A OG no hydrogen 2.997 N/A CYS 111.A N HIS 5.A ND1 no hydrogen 2.829 N/A CYS 111.A SG VAL 109.A O no hydrogen 3.762 N/A ILE 112.A N CYS 90.A O no hydrogen 3.012 N/A ASN 113.A N LEU 6.A O no hydrogen 2.937 N/A ASN 113.A ND2 LEU 7.A O no hydrogen 3.015 N/A ASN 113.A ND2 ASP 116.A OD1 no hydrogen 2.753 N/A ASN 113.A ND2 GLY 119.A O no hydrogen 3.397 N/A ALA 114.A N ALA 92.A O no hydrogen 2.845 N/A LEU 115.A N ASN 113.A OD1 no hydrogen 2.852 N/A ASP 116.A N GLY 119.A O no hydrogen 3.334 N/A PHE 118.A N ASP 116.A OD1 no hydrogen 3.048 N/A GLY 119.A N ASP 116.A OD1 no hydrogen 2.910 N/A HIS 120.A N ASP 163.A OD2 no hydrogen 2.645 N/A GLN 123.A NE2 ASP 127.A OD1 no hydrogen 3.392 N/A GLN 123.A NE2 ASP 127.A OD2 no hydrogen 2.847 N/A MET 124.A N HIS 120.A O no hydrogen 3.076 N/A VAL 125.A N PRO 121.A O no hydrogen 3.001 N/A CYS 126.A N LEU 122.A O no hydrogen 3.317 N/A CYS 126.A SG GLU 284.A O no hydrogen 2.780 N/A ASP 127.A N GLN 123.A O no hydrogen 2.852 N/A PHE 128.A N MET 124.A O no hydrogen 3.094 N/A MET 129.A N VAL 125.A O no hydrogen 3.148 N/A THR 130.A N CYS 126.A O no hydrogen 2.923 N/A THR 130.A OG1 CYS 126.A O no hydrogen 2.853 N/A ILE 131.A N ASP 127.A O no hydrogen 2.804 N/A LYS 132.A N PHE 128.A O no hydrogen 2.881 N/A LYS 132.A NZ ASP 22.A OD1 no hydrogen 2.464 N/A GLU 133.A N MET 129.A O no hydrogen 2.909 N/A LYS 134.A N THR 130.A O no hydrogen 2.860 N/A LYS 134.A NZ ASP 283.A OD1 no hydrogen 2.989 N/A PHE 135.A N ILE 131.A O no hydrogen 3.102 N/A THR 136.A N LYS 132.A O no hydrogen 3.003 N/A THR 136.A OG1 LYS 132.A O no hydrogen 2.728 N/A ALA 137.A N GLU 133.A O no hydrogen 3.315 N/A ALA 137.A N LYS 134.A O no hydrogen 3.276 N/A ALA 138.A N LYS 134.A O no hydrogen 3.301 N/A GLY 139.A N THR 136.A O no hydrogen 3.217 N/A GLU 140.A N PHE 135.A O no hydrogen 2.787 N/A GLY 144.A N PHE 141.A O no hydrogen 3.113 N/A GLY 147.A N ASN 143.A O no hydrogen 3.308 N/A ILE 148.A N PHE 145.A O no hydrogen 3.060 N/A LYS 149.A N ASP 222.A OD1 no hydrogen 2.655 N/A LYS 149.A NZ GLY 220.A O no hydrogen 3.434 N/A PHE 150.A N GLU 174.A O no hydrogen 2.911 N/A ALA 151.A N VAL 223.A O no hydrogen 2.871 N/A TYR 152.A N HIS 176.A O no hydrogen 2.897 N/A TYR 152.A OH ASP 155.A O no hydrogen 3.282 N/A TYR 152.A OH ASP 227.A OD2 no hydrogen 2.469 N/A CYS 153.A N TYR 225.A O no hydrogen 2.904 N/A GLY 154.A N CYS 178.A O no hydrogen 2.926 N/A SER 156.A N PHE 185.A O no hydrogen 2.980 N/A SER 156.A OG GLY 154.A O no hydrogen 2.902 N/A MET 157.A N ASP 155.A OD1 no hydrogen 3.213 N/A ASN 158.A ND2 ASP 155.A O no hydrogen 3.239 N/A ASN 158.A ND2 ASP 227.A OD2 no hydrogen 2.816 N/A ASN 159.A ND2 GLY 119.A O no hydrogen 2.913 N/A VAL 160.A N ASN 158.A OD1 no hydrogen 2.727 N/A THR 161.A OG1 ASP 155.A O no hydrogen 3.528 N/A TYR 162.A N ASN 158.A O no hydrogen 2.875 N/A ASP 163.A N ASN 159.A O no hydrogen 3.095 N/A LEU 164.A N VAL 160.A O no hydrogen 2.965 N/A MET 165.A N THR 161.A O no hydrogen 2.912 N/A ARG 166.A N TYR 162.A O no hydrogen 3.101 N/A ARG 166.A NE GLU 194.A OE1 no hydrogen 2.925 N/A ARG 166.A NH1 PHE 118.A O no hydrogen 2.863 N/A ARG 166.A NH1 ASP 163.A OD1 no hydrogen 2.846 N/A ARG 166.A NH2 PHE 118.A O no hydrogen 3.066 N/A GLY 167.A N ASP 163.A O no hydrogen 2.939 N/A CYS 168.A N LEU 164.A O no hydrogen 2.909 N/A CYS 168.A SG LEU 164.A O no hydrogen 3.506 N/A ALA 169.A N MET 165.A O no hydrogen 2.903 N/A LEU 170.A N ARG 166.A O no hydrogen 3.012 N/A LEU 171.A N GLY 167.A O no hydrogen 2.844 N/A GLY 172.A N CYS 168.A O no hydrogen 2.726 N/A MET 173.A N CYS 168.A O no hydrogen 2.962 N/A CYS 175.A N SER 207.A O no hydrogen 2.789 N/A CYS 175.A SG LEU 164.A O no hydrogen 3.949 N/A HIS 176.A N PHE 150.A O no hydrogen 2.824 N/A VAL 177.A N LYS 209.A O no hydrogen 2.694 N/A CYS 178.A N TYR 152.A O no hydrogen 2.669 N/A CYS 179.A N PHE 211.A O no hydrogen 3.008 N/A ASP 184.A N HIS 182.A ND1 no hydrogen 3.033 N/A PHE 185.A N HIS 182.A O no hydrogen 2.744 N/A LYS 186.A NZ ASP 181.A OD2 no hydrogen 3.036 N/A LYS 189.A NZ ASP 193.A OD1 no hydrogen 3.212 N/A LYS 189.A NZ ASP 193.A OD2 no hydrogen 3.151 N/A VAL 191.A N ILE 188.A O no hydrogen 2.940 N/A ILE 192.A N ILE 188.A O no hydrogen 3.275 N/A ASP 193.A N LYS 189.A O no hydrogen 2.851 N/A GLU 194.A N GLU 190.A O no hydrogen 2.960 N/A CYS 195.A N VAL 191.A O no hydrogen 3.024 N/A CYS 195.A SG VAL 191.A O no hydrogen 3.318 N/A GLU 196.A N ILE 192.A O no hydrogen 2.886 N/A GLU 197.A N ASP 193.A O no hydrogen 2.919 N/A ILE 198.A N GLU 194.A O no hydrogen 2.858 N/A ILE 199.A N CYS 195.A O no hydrogen 3.047 N/A ALA 200.A N GLU 196.A O no hydrogen 2.981 N/A LYS 201.A N GLU 197.A O no hydrogen 2.846 N/A HIS 202.A N ILE 198.A O no hydrogen 3.021 N/A HIS 202.A ND1 ILE 198.A O no hydrogen 3.127 N/A GLY 203.A N ALA 200.A O no hydrogen 3.428 N/A THR 204.A N ILE 199.A O no hydrogen 3.112 N/A THR 204.A OG1 ALA 169.A O no hydrogen 2.591 N/A GLY 206.A N THR 204.A OG1 no hydrogen 3.187 N/A SER 207.A N MET 173.A O no hydrogen 2.925 N/A SER 207.A OG GLU 174.A OE1 no hydrogen 2.593 N/A LYS 209.A N CYS 175.A O no hydrogen 2.914 N/A LYS 209.A NZ GLU 174.A OE2 no hydrogen 3.314 N/A PHE 211.A N VAL 177.A O no hydrogen 2.781 N/A LYS 216.A N ASP 213.A OD2 no hydrogen 3.250 N/A GLY 217.A N ASP 213.A O no hydrogen 2.802 N/A CYS 218.A N CYS 214.A O no hydrogen 2.661 N/A CYS 218.A SG CYS 214.A O no hydrogen 3.139 N/A GLY 220.A N VAL 250.A O no hydrogen 2.938 N/A VAL 221.A N CYS 218.A O no hydrogen 3.034 N/A ASP 222.A N LYS 149.A O no hydrogen 2.758 N/A VAL 223.A N LYS 149.A O no hydrogen 3.204 N/A VAL 224.A N ILE 256.A O no hydrogen 3.001 N/A TYR 225.A N ALA 151.A O no hydrogen 2.872 N/A TYR 225.A OH ASP 127.A OD1 no hydrogen 2.417 N/A THR 226.A N MET 258.A O no hydrogen 3.115 N/A THR 226.A OG1 CYS 153.A O no hydrogen 2.855 N/A MET 230.A N SER 228.A OG no hydrogen 3.056 N/A ARG 234.A NH1 ASP 155.A OD2 no hydrogen 2.808 N/A ARG 234.A NH1 TRP 229.A O no hydrogen 2.775 N/A ARG 234.A NH2 ASP 155.A OD2 no hydrogen 2.869 N/A LEU 235.A N GLU 232.A O no hydrogen 3.411 N/A LEU 238.A N ARG 234.A O no hydrogen 2.871 N/A THR 239.A N LEU 235.A O no hydrogen 3.051 N/A THR 239.A OG1 LEU 235.A O no hydrogen 2.354 N/A PHE 241.A N LEU 238.A O no hydrogen 2.742 N/A GLN 242.A N THR 239.A O no hydrogen 3.260 N/A GLN 242.A NE2 GLU 267.A O no hydrogen 2.825 N/A VAL 243.A N GLU 268.A O no hydrogen 2.799 N/A VAL 247.A N ASP 244.A OD2 no hydrogen 2.961 N/A MET 248.A N ASP 244.A O no hydrogen 3.016 N/A ALA 249.A N ASP 245.A O no hydrogen 2.807 N/A VAL 250.A N VAL 247.A O no hydrogen 3.137 N/A THR 251.A N MET 248.A O no hydrogen 3.136 N/A THR 251.A OG1 MET 248.A O no hydrogen 2.809 N/A THR 251.A OG1 SER 252.A O no hydrogen 3.463 N/A THR 251.A OG1 SER 255.A OG no hydrogen 2.563 N/A SER 252.A N VAL 221.A O no hydrogen 2.906 N/A SER 252.A OG VAL 221.A O no hydrogen 3.498 N/A SER 252.A OG ASP 222.A OD2 no hydrogen 3.022 N/A ARG 254.A NH1 ASP 222.A OD2 no hydrogen 3.174 N/A SER 255.A N SER 252.A O no hydrogen 3.206 N/A SER 255.A OG THR 251.A OG1 no hydrogen 2.563 N/A SER 255.A OG SER 252.A O no hydrogen 2.952 N/A ILE 256.A N ASP 222.A O no hydrogen 2.898 N/A PHE 257.A N LYS 278.A O no hydrogen 2.743 N/A MET 258.A N VAL 224.A O no hydrogen 2.945 N/A ASN 259.A N GLU 284.A OE1 no hydrogen 3.288 N/A CYS 260.A SG ASP 227.A OD1 no hydrogen 3.695 N/A CYS 260.A SG LEU 261.A O no hydrogen 4.027 N/A THR 264.A N GLU 268.A OE1 no hydrogen 2.807 N/A ARG 265.A NH1 ASP 275.A OD1 no hydrogen 2.582 N/A ARG 265.A NH2 ASP 275.A OD1 no hydrogen 3.386 N/A GLU 267.A N THR 264.A O no hydrogen 2.915 N/A GLU 268.A N GLU 268.A OE2 no hydrogen 2.891 N/A THR 270.A N VAL 243.A O no hydrogen 3.211 N/A THR 270.A OG1 SER 272.A OG no hydrogen 2.873 N/A SER 272.A OG ASP 245.A OD1 no hydrogen 2.626 N/A SER 272.A OG THR 270.A OG1 no hydrogen 2.873 N/A VAL 273.A N THR 270.A O no hydrogen 3.121 N/A ILE 274.A N THR 270.A O no hydrogen 3.278 N/A ASP 275.A N ALA 271.A O no hydrogen 2.804 N/A GLY 276.A N VAL 273.A O no hydrogen 3.082 N/A LYS 278.A NZ SER 252.A O no hydrogen 3.335 N/A LYS 278.A NZ LYS 253.A O no hydrogen 3.291 N/A LYS 278.A NZ SER 255.A O no hydrogen 3.489 N/A LYS 278.A NZ SER 255.A OG no hydrogen 2.632 N/A SER 279.A OG ILE 274.A O no hydrogen 2.883 N/A VAL 280.A N PHE 257.A O no hydrogen 2.869 N/A CYS 281.A N SER 279.A OG no hydrogen 3.284 N/A CYS 281.A SG ASN 259.A O no hydrogen 3.919 N/A CYS 281.A SG SER 279.A OG no hydrogen 3.490 N/A GLU 284.A N VAL 280.A O no hydrogen 2.910 N/A ALA 285.A N CYS 281.A O no hydrogen 2.961 N/A GLY 286.A N TYR 282.A O no hydrogen 3.042 N/A ASN 287.A N ASP 283.A O no hydrogen 3.093 N/A ASN 287.A N GLU 284.A O no hydrogen 3.210 N/A ASN 287.A ND2 THR 130.A OG1 no hydrogen 2.847 N/A ASN 287.A ND2 GLU 133.A OE1 no hydrogen 3.092 N/A ARG 288.A N ALA 285.A O no hydrogen 3.167 N/A ARG 288.A NH1 GLN 123.A OE1 no hydrogen 2.944 N/A ARG 288.A NH2 THR 54.A OG1 no hydrogen 2.879 N/A LEU 289.A N GLY 286.A O no hydrogen 3.114 N/A SER 291.A N ASN 287.A O no hydrogen 2.986 N/A SER 291.A OG ASN 287.A O no hydrogen 2.541 N/A SER 291.A OG ARG 288.A O no hydrogen 3.106 N/A ALA 292.A N ARG 288.A O no hydrogen 2.967 N/A ALA 292.A N LEU 289.A O no hydrogen 3.107 N/A MET 293.A N LEU 289.A O no hydrogen 3.040 N/A ALA 294.A N HIS 290.A O no hydrogen 3.233 N/A VAL 295.A N SER 291.A O no hydrogen 3.125 N/A LEU 296.A N ALA 292.A O no hydrogen 2.977 N/A ASP 297.A N MET 293.A O no hydrogen 2.985 N/A PHE 298.A N ALA 294.A O no hydrogen 3.026 N/A PHE 299.A N VAL 295.A O no hydrogen 2.948 N/A LEU 300.A N LEU 296.A O no hydrogen 2.867 N/A HIS 301.A N ASP 297.A O no hydrogen 3.166 N/A HIS 301.A ND1 ASP 297.A O no hydrogen 2.741 N/A