Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ip3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N ARG 20.A O no hydrogen 2.869 N/A VAL 6.A N PHE 18.A O no hydrogen 2.881 N/A THR 7.A N ILE 69.A O no hydrogen 2.916 N/A LYS 8.A N THR 16.A O no hydrogen 2.855 N/A PHE 9.A N LEU 67.A O no hydrogen 2.884 N/A ASP 10.A N ASN 14.A O no hydrogen 3.243 N/A GLY 13.A N ASP 10.A O no hydrogen 3.112 N/A ASN 14.A ND2 ASP 10.A OD2 no hydrogen 3.015 N/A THR 16.A N LYS 8.A O no hydrogen 2.931 N/A SER 17.A OG TYR 72.A OH no hydrogen 2.256 N/A PHE 18.A N VAL 6.A O no hydrogen 2.924 N/A ARG 20.A N PHE 4.A O no hydrogen 2.933 N/A LYS 22.A N PRO 2.A O no hydrogen 3.170 N/A LEU 25.A N LYS 21.A O no hydrogen 2.942 N/A TYR 26.A N LYS 22.A O no hydrogen 2.893 N/A GLN 27.A N THR 23.A O no hydrogen 2.927 N/A GLU 28.A N GLU 24.A O no hydrogen 2.893 N/A LEU 29.A N LEU 25.A O no hydrogen 2.916 N/A GLY 30.A N GLN 27.A O no hydrogen 3.443 N/A LEU 31.A N TYR 26.A O no hydrogen 3.023 N/A GLN 32.A N ASP 35.A OD2 no hydrogen 3.037 N/A ASP 35.A N GLN 32.A O no hydrogen 3.269 N/A ARG 37.A NE ARG 34.A O no hydrogen 3.012 N/A SER 43.A N ARG 54.A O no hydrogen 2.908 N/A THR 45.A N ILE 52.A O no hydrogen 2.922 N/A THR 45.A OG1 ILE 52.A O no hydrogen 3.468 N/A ARG 47.A N ARG 50.A O no hydrogen 2.886 N/A ASN 49.A ND2 VAL 188.A O no hydrogen 3.178 N/A ARG 50.A N ARG 47.A O no hydrogen 2.902 N/A ARG 50.A NH1 ASN 49.A O no hydrogen 3.350 N/A ILE 51.A N ILE 62.A O no hydrogen 2.927 N/A ILE 52.A N THR 45.A O no hydrogen 2.876 N/A MET 53.A N ALA 60.A O no hydrogen 2.922 N/A ARG 54.A N SER 43.A O no hydrogen 2.887 N/A MET 55.A N LEU 58.A O no hydrogen 2.876 N/A TYR 57.A OH TYR 113.A OH no hydrogen 3.129 N/A LEU 58.A N MET 55.A O no hydrogen 2.914 N/A ALA 60.A N MET 53.A O no hydrogen 2.893 N/A VAL 61.A N LEU 68.A O no hydrogen 2.879 N/A ILE 62.A N ILE 51.A O no hydrogen 2.835 N/A THR 63.A N CYS 66.A O no hydrogen 2.838 N/A THR 63.A OG1 CYS 66.A O no hydrogen 2.511 N/A CYS 66.A N THR 63.A OG1 no hydrogen 2.638 N/A CYS 66.A SG THR 63.A OG1 no hydrogen 2.956 N/A LEU 67.A N PHE 9.A O no hydrogen 2.884 N/A LEU 68.A N VAL 61.A O no hydrogen 2.891 N/A ILE 69.A N THR 7.A O no hydrogen 2.886 N/A LEU 70.A N LYS 59.A O no hydrogen 2.916 N/A ASP 71.A N THR 5.A O no hydrogen 3.170 N/A LEU 81.A N LEU 77.A O no hydrogen 2.852 N/A PHE 82.A N GLU 78.A O no hydrogen 2.934 N/A ARG 83.A N GLN 79.A O no hydrogen 2.947 N/A ARG 83.A NE GLN 79.A OE1 no hydrogen 3.121 N/A GLU 84.A N TRP 80.A O no hydrogen 2.881 N/A LEU 85.A N LEU 81.A O no hydrogen 3.011 N/A SER 87.A OG ARG 83.A O no hydrogen 3.332 N/A SER 87.A OG GLU 84.A O no hydrogen 2.488 N/A GLN 88.A N GLU 84.A O no hydrogen 2.764 N/A LEU 89.A N LEU 85.A O no hydrogen 2.890 N/A SER 90.A N PRO 86.A O no hydrogen 2.919 N/A SER 90.A OG GLN 12.A O no hydrogen 3.020 N/A GLY 93.A N SER 87.A O no hydrogen 3.138 N/A VAL 96.A N GLU 108.A OE1 no hydrogen 3.312 N/A VAL 96.A N GLU 108.A OE2 no hydrogen 3.080 N/A THR 97.A OG1 GLU 108.A OE1 no hydrogen 2.582 N/A LEU 100.A N THR 97.A O no hydrogen 3.165 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.802 N/A PHE 104.A N PRO 101.A O no hydrogen 3.257 N/A ARG 105.A NH1 TYR 98.A O no hydrogen 3.498 N/A ALA 106.A N PHE 102.A O no hydrogen 2.926 N/A ILE 107.A N GLU 103.A O no hydrogen 2.893 N/A GLU 108.A N PHE 104.A O no hydrogen 2.901 N/A ALA 109.A N ARG 105.A O no hydrogen 2.879 N/A LEU 110.A N ALA 106.A O no hydrogen 2.959 N/A LEU 111.A N ILE 107.A O no hydrogen 2.918 N/A GLN 112.A N GLU 108.A O no hydrogen 2.842 N/A GLN 112.A NE2 ASN 116.A OD1 no hydrogen 2.976 N/A TYR 113.A N ALA 109.A O no hydrogen 2.906 N/A TYR 113.A OH TYR 57.A OH no hydrogen 3.129 N/A TRP 114.A N LEU 110.A O no hydrogen 2.980 N/A ILE 115.A N LEU 111.A O no hydrogen 2.882 N/A ASN 116.A N GLN 112.A O no hydrogen 2.865 N/A THR 117.A N TYR 113.A O no hydrogen 2.901 N/A THR 117.A OG1 TYR 113.A O no hydrogen 2.952 N/A LEU 118.A N TRP 114.A O no hydrogen 2.956 N/A GLN 119.A N ILE 115.A O no hydrogen 2.856 N/A GLY 120.A N ASN 116.A O no hydrogen 2.848 N/A LYS 121.A N THR 117.A O no hydrogen 2.947 N/A LEU 122.A N LEU 118.A O no hydrogen 2.934 N/A SER 123.A N GLN 119.A O no hydrogen 2.842 N/A SER 123.A OG GLN 119.A O no hydrogen 2.965 N/A ILE 124.A N GLY 120.A O no hydrogen 2.906 N/A ILE 124.A N LYS 121.A O no hydrogen 3.285 N/A LEU 125.A N LYS 121.A O no hydrogen 2.933 N/A GLN 126.A N LEU 122.A O no hydrogen 2.874 N/A ILE 129.A N LEU 125.A O no hydrogen 2.944 N/A LEU 130.A N GLN 126.A O no hydrogen 2.885 N/A GLU 131.A N PRO 127.A O no hydrogen 2.912 N/A THR 132.A N LEU 128.A O no hydrogen 2.928 N/A THR 132.A OG1 LEU 128.A O no hydrogen 2.808 N/A LEU 133.A N ILE 129.A O no hydrogen 2.890 N/A ASP 134.A N LEU 130.A O no hydrogen 2.903 N/A ALA 135.A N GLU 131.A O no hydrogen 2.928 N/A LEU 136.A N THR 132.A O no hydrogen 2.909 N/A VAL 137.A N LEU 133.A O no hydrogen 2.902 N/A LYS 140.A NZ HIS 141.A NE2 no hydrogen 3.051 N/A HIS 141.A N ASP 138.A O no hydrogen 3.447 N/A SER 147.A OG ASP 145.A OD1 no hydrogen 3.025 N/A LYS 148.A NZ ASP 145.A OD2 no hydrogen 3.555 N/A LEU 149.A N ASP 145.A O no hydrogen 3.096 N/A HIS 150.A N ARG 146.A O no hydrogen 2.919 N/A ILE 151.A N SER 147.A O no hydrogen 2.952 N/A LEU 152.A N LYS 148.A O no hydrogen 2.852 N/A LEU 153.A N LEU 149.A O no hydrogen 2.887 N/A GLN 154.A N HIS 150.A O no hydrogen 2.970 N/A ASN 155.A N ILE 151.A O no hydrogen 2.915 N/A GLY 156.A N LEU 152.A O no hydrogen 2.825 N/A LYS 157.A N LEU 153.A O no hydrogen 2.954 N/A SER 158.A N GLN 154.A O no hydrogen 2.965 N/A SER 158.A OG GLN 154.A O no hydrogen 3.255 N/A LEU 159.A N ASN 155.A O no hydrogen 2.843 N/A SER 160.A N GLY 156.A O no hydrogen 2.887 N/A SER 160.A OG GLY 156.A O no hydrogen 3.504 N/A SER 160.A OG LYS 157.A O no hydrogen 2.597 N/A GLU 161.A N LYS 157.A O no hydrogen 2.982 N/A LEU 162.A N SER 158.A O no hydrogen 2.900 N/A GLU 163.A N LEU 159.A O no hydrogen 2.853 N/A THR 164.A N SER 160.A O no hydrogen 2.931 N/A THR 164.A OG1 SER 160.A O no hydrogen 3.179 N/A ASP 165.A N GLU 161.A O no hydrogen 2.953 N/A ILE 166.A N LEU 162.A O no hydrogen 2.902 N/A LYS 167.A N GLU 163.A O no hydrogen 2.876 N/A ILE 168.A N THR 164.A O no hydrogen 2.934 N/A PHE 169.A N ASP 165.A O no hydrogen 2.959 N/A LYS 170.A N ILE 166.A O no hydrogen 2.899 N/A GLU 171.A N LYS 167.A O no hydrogen 2.876 N/A SER 172.A N ILE 168.A O no hydrogen 2.938 N/A SER 172.A OG ILE 168.A O no hydrogen 3.308 N/A SER 172.A OG PHE 169.A O no hydrogen 2.732 N/A ILE 173.A N PHE 169.A O no hydrogen 2.983 N/A LEU 174.A N LYS 170.A O no hydrogen 2.853 N/A GLU 175.A N GLU 171.A O no hydrogen 2.898 N/A ILE 176.A N SER 172.A O no hydrogen 2.978 N/A LEU 177.A N ILE 173.A O no hydrogen 2.897 N/A ASP 178.A N LEU 174.A O no hydrogen 2.887 N/A GLU 184.A N GLU 180.A O no hydrogen 2.913 N/A GLU 185.A N GLU 181.A O no hydrogen 2.885 N/A LEU 186.A N LEU 182.A O no hydrogen 2.927 N/A CYS 187.A N GLU 184.A O no hydrogen 3.278 N/A CYS 187.A SG LEU 183.A O no hydrogen 3.380 N/A VAL 188.A N LEU 186.A O no hydrogen 2.963 N/A SER 189.A OG GLU 103.A OE1 no hydrogen 2.307 N/A LYS 190.A NZ GLU 184.A OE1 no hydrogen 2.869 N/A TRP 191.A N CYS 187.A O no hydrogen 3.382 N/A TRP 191.A NE1 GLU 184.A O no hydrogen 2.499 N/A SER 192.A N VAL 188.A O no hydrogen 2.901 N/A SER 192.A OG SER 189.A O no hydrogen 2.888 N/A SER 192.A OG ASP 193.A OD1 no hydrogen 3.225 N/A PHE 197.A N ASP 193.A O no hydrogen 3.149 N/A GLU 198.A N PRO 194.A O no hydrogen 2.900 N/A LYS 199.A N VAL 196.A O no hydrogen 3.291 N/A SER 200.A N VAL 196.A O no hydrogen 2.901 N/A SER 201.A N PHE 197.A O no hydrogen 3.371 N/A GLY 203.A N SER 201.A O no hydrogen 2.884 N/A GLU 209.A N ASP 205.A O no hydrogen 3.213 N/A MET 210.A N HIS 206.A O no hydrogen 2.920 N/A GLU 211.A N ALA 207.A O no hydrogen 2.890 N/A LEU 212.A N GLU 208.A O no hydrogen 2.906 N/A LEU 213.A N GLU 209.A O no hydrogen 2.946 N/A LEU 214.A N MET 210.A O no hydrogen 2.935 N/A GLU 215.A N GLU 211.A O no hydrogen 2.857 N/A ASN 216.A N LEU 212.A O no hydrogen 2.915 N/A TYR 217.A N LEU 213.A O no hydrogen 3.038 N/A TYR 217.A OH GLN 112.A OE1 no hydrogen 2.968 N/A TYR 218.A N LEU 214.A O no hydrogen 2.843 N/A ARG 219.A N GLU 215.A O no hydrogen 2.891 N/A LEU 220.A N ASN 216.A O no hydrogen 2.995 N/A ALA 221.A N TYR 217.A O no hydrogen 2.936 N/A ASP 222.A N TYR 218.A O no hydrogen 2.846 N/A ASP 223.A N ARG 219.A O no hydrogen 2.943 N/A LEU 224.A N LEU 220.A O no hydrogen 2.990 N/A SER 225.A N ALA 221.A O no hydrogen 2.868 N/A SER 225.A OG ASP 222.A O no hydrogen 2.639 N/A ASN 226.A N ASP 222.A O no hydrogen 2.911 N/A ALA 227.A N ASP 223.A O no hydrogen 2.972 N/A ALA 228.A N LEU 224.A O no hydrogen 2.934 N/A ARG 229.A N SER 225.A O no hydrogen 2.890 N/A ARG 229.A NH2 ASN 226.A OD1 no hydrogen 3.379 N/A GLU 230.A N ASN 226.A O no hydrogen 2.920 N/A LEU 231.A N ALA 227.A O no hydrogen 2.946 N/A ARG 232.A N ALA 228.A O no hydrogen 2.944 N/A VAL 233.A N ARG 229.A O no hydrogen 2.924 N/A LEU 234.A N GLU 230.A O no hydrogen 2.902 N/A ILE 235.A N LEU 231.A O no hydrogen 2.913 N/A ASP 236.A N ARG 232.A O no hydrogen 2.977 N/A ASP 237.A N VAL 233.A O no hydrogen 2.929 N/A SER 238.A N LEU 234.A O no hydrogen 2.877 N/A SER 238.A OG LEU 234.A O no hydrogen 2.806 N/A GLN 239.A N ILE 235.A O no hydrogen 2.922 N/A SER 240.A N ASP 236.A O no hydrogen 2.985 N/A SER 240.A OG ASP 236.A O no hydrogen 3.418 N/A ILE 241.A N ASP 237.A O no hydrogen 2.935 N/A ILE 242.A N SER 238.A O no hydrogen 2.862 N/A PHE 243.A N GLN 239.A O no hydrogen 2.946 N/A ILE 244.A N SER 240.A O no hydrogen 2.975 N/A ASN 245.A N ILE 241.A O no hydrogen 2.877 N/A LEU 246.A N ILE 242.A O no hydrogen 2.916 N/A ASP 247.A N PHE 243.A O no hydrogen 2.955 N/A SER 248.A N ILE 244.A O no hydrogen 2.888 N/A HIS 249.A N ASN 245.A O no hydrogen 2.938 N/A HIS 249.A NE2 PRO 139.A O no hydrogen 3.149 N/A ARG 250.A N LEU 246.A O no hydrogen 2.916 N/A ARG 250.A NE ASN 251.A OD1 no hydrogen 3.083 N/A ARG 250.A NH2 ASN 251.A OD1 no hydrogen 3.075 N/A ASN 251.A N ASP 247.A O no hydrogen 2.899 N/A VAL 252.A N SER 248.A O no hydrogen 2.945 N/A MET 253.A N HIS 249.A O no hydrogen 2.949 N/A MET 254.A N ARG 250.A O no hydrogen 2.864 N/A ARG 255.A N ASN 251.A O no hydrogen 2.900 N/A LEU 256.A N VAL 252.A O no hydrogen 3.009 N/A ASN 257.A N MET 253.A O no hydrogen 2.888 N/A LEU 258.A N MET 254.A O no hydrogen 2.843 N/A GLN 259.A N ARG 255.A O no hydrogen 2.963 N/A LEU 260.A N LEU 256.A O no hydrogen 2.976 N/A THR 261.A N ASN 257.A O no hydrogen 2.830 N/A THR 261.A OG1 ASN 257.A O no hydrogen 2.584 N/A THR 261.A OG1 ASN 257.A OD1 no hydrogen 3.397 N/A MET 262.A N LEU 258.A O no hydrogen 2.900 N/A GLY 263.A N GLN 259.A O no hydrogen 3.001 N/A THR 264.A N LEU 260.A O no hydrogen 2.869 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.866 N/A PHE 265.A N THR 261.A O no hydrogen 2.831 N/A SER 266.A N MET 262.A O no hydrogen 2.996 N/A SER 266.A OG MET 262.A O no hydrogen 3.311 N/A SER 266.A OG GLY 263.A O no hydrogen 2.650 N/A SER 266.A OG SER 303.A O no hydrogen 3.560 N/A LEU 267.A N GLY 263.A O no hydrogen 2.945 N/A SER 268.A N THR 264.A O no hydrogen 2.814 N/A SER 268.A OG THR 264.A O no hydrogen 2.774 N/A LEU 269.A N PHE 265.A O no hydrogen 2.899 N/A PHE 270.A N SER 266.A O no hydrogen 3.057 N/A GLY 271.A N LEU 267.A O no hydrogen 2.812 N/A LEU 272.A N SER 268.A O no hydrogen 2.834 N/A MET 273.A N LEU 269.A O no hydrogen 3.013 N/A GLY 274.A N PHE 270.A O no hydrogen 2.912 N/A VAL 275.A N GLY 271.A O no hydrogen 2.847 N/A ALA 276.A N LEU 272.A O no hydrogen 2.894 N/A PHE 277.A N MET 273.A O no hydrogen 2.950 N/A GLY 278.A N VAL 275.A O no hydrogen 3.200 N/A LEU 281.A N MET 279.A O no hydrogen 2.715 N/A SER 283.A N GLU 286.A OE1 no hydrogen 3.235 N/A LEU 294.A N ARG 290.A O no hydrogen 2.917 N/A ILE 295.A N ILE 291.A O no hydrogen 2.860 N/A THR 296.A N PHE 292.A O no hydrogen 2.973 N/A GLY 297.A N TRP 293.A O no hydrogen 2.900 N/A ILE 298.A N LEU 294.A O no hydrogen 2.918 N/A MET 299.A N ILE 295.A O no hydrogen 2.891 N/A PHE 300.A N THR 296.A O no hydrogen 2.978 N/A MET 301.A N GLY 297.A O no hydrogen 2.912 N/A GLY 302.A N ILE 298.A O no hydrogen 2.835 N/A SER 303.A N MET 299.A O no hydrogen 2.914 N/A SER 303.A OG MET 299.A O no hydrogen 2.716 N/A GLY 304.A N PHE 300.A O no hydrogen 2.986 N/A LEU 305.A N MET 301.A O no hydrogen 2.887 N/A ILE 306.A N GLY 302.A O no hydrogen 2.855 N/A TRP 307.A N SER 303.A O no hydrogen 2.932 N/A TRP 307.A NE1 GLN 259.A O no hydrogen 3.102 N/A ARG 308.A N GLY 304.A O no hydrogen 2.938 N/A ARG 309.A N LEU 305.A O no hydrogen 2.890 N/A LEU 310.A N ILE 306.A O no hydrogen 2.880 N/A LEU 311.A N TRP 307.A O no hydrogen 2.906 N/A SER 312.A N ARG 308.A O no hydrogen 2.928 N/A SER 312.A OG ARG 308.A O no hydrogen 3.516 N/A SER 312.A OG ARG 309.A O no hydrogen 2.515 N/A PHE 313.A N ARG 309.A O no hydrogen 2.886 N/A LEU 314.A N LEU 310.A O no hydrogen 2.896 N/A GLY 315.A N LEU 311.A O no hydrogen 2.927 N/A ARG 316.A N SER 312.A O no hydrogen 2.905 N/A GLN 317.A N PHE 313.A O no hydrogen 2.888 N/A LEU 318.A N LEU 314.A O no hydrogen 2.917 N/A GLU 319.A N ARG 316.A O no hydrogen 3.238 N/A