Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3olh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N TYR 253.A OH no hydrogen 3.359 N/A VAL 5.A N LEU 119.A O no hydrogen 2.801 N/A TRP 9.A N SER 6.A OG no hydrogen 3.278 N/A GLU 12.A N GLN 8.A O no hydrogen 3.449 N/A ALA 13.A N TRP 9.A O no hydrogen 3.098 N/A LEU 14.A N VAL 10.A O no hydrogen 3.339 N/A ARG 15.A NE GLU 12.A OE2 no hydrogen 2.670 N/A ALA 16.A N GLU 12.A O no hydrogen 2.808 N/A GLN 24.A N HIS 88.A O no hydrogen 3.100 N/A GLN 24.A NE2 LEU 25.A O no hydrogen 2.892 N/A GLN 24.A NE2 GLY 48.A O no hydrogen 3.144 N/A LEU 26.A N VAL 90.A O no hydrogen 2.847 N/A ASP 27.A N ALA 50.A O no hydrogen 2.944 N/A ALA 28.A N TYR 92.A O no hydrogen 2.939 N/A SER 29.A N ASP 27.A OD2 no hydrogen 3.239 N/A SER 29.A OG TYR 31.A OH no hydrogen 2.816 N/A TRP 30.A NE1 ASP 55.A OD1 no hydrogen 3.108 N/A ARG 35.A NE GLU 40.A OE2 no hydrogen 3.479 N/A ARG 38.A N ASP 36.A OD2 no hydrogen 3.219 N/A ARG 38.A NH2 ASP 53.A OD2 no hydrogen 3.203 N/A ARG 39.A N ASP 36.A OD2 no hydrogen 3.074 N/A GLU 40.A N ASP 36.A O no hydrogen 2.959 N/A PHE 41.A N ALA 37.A O no hydrogen 3.253 N/A GLU 42.A N ARG 38.A O no hydrogen 3.342 N/A GLU 43.A N ARG 39.A O no hydrogen 3.141 N/A ARG 44.A N GLU 40.A O no hydrogen 2.947 N/A HIS 45.A N SER 134.A O no hydrogen 2.895 N/A HIS 45.A NE2 SER 135.A O no hydrogen 2.883 N/A ILE 46.A N TYR 92.A OH no hydrogen 3.211 N/A ALA 49.A N ILE 46.A O no hydrogen 2.911 N/A ALA 50.A N LEU 25.A O no hydrogen 3.190 N/A PHE 52.A N ASP 27.A O no hydrogen 3.032 N/A ASP 53.A N TYR 77.A OH no hydrogen 2.990 N/A CYS 57.A N ASP 53.A O no hydrogen 2.899 N/A SER 58.A N GLN 56.A O no hydrogen 2.965 N/A ASP 59.A N MET 67.A O no hydrogen 3.007 N/A THR 61.A N ASP 59.A OD1 no hydrogen 3.004 N/A SER 62.A N ASP 59.A OD1 no hydrogen 2.752 N/A TYR 64.A N SER 62.A OG no hydrogen 3.202 N/A HIS 66.A ND1 ASP 55.A OD2 no hydrogen 2.610 N/A HIS 66.A NE2 SER 241.A OG no hydrogen 2.719 N/A LEU 68.A N ASP 264.A OD2 no hydrogen 2.716 N/A PHE 74.A N GLY 70.A O no hydrogen 3.121 N/A ALA 75.A N ALA 71.A O no hydrogen 3.090 N/A GLU 76.A N GLU 72.A O no hydrogen 3.113 N/A TYR 77.A N HIS 73.A O no hydrogen 2.918 N/A ALA 78.A N PHE 74.A O no hydrogen 2.841 N/A GLY 79.A N ALA 75.A O no hydrogen 2.889 N/A ARG 80.A N GLU 76.A O no hydrogen 3.160 N/A LEU 81.A N ALA 78.A O no hydrogen 3.186 N/A GLY 82.A N GLY 79.A O no hydrogen 2.878 N/A VAL 83.A N ALA 78.A O no hydrogen 3.100 N/A GLY 84.A N THR 87.A OG1 no hydrogen 2.647 N/A HIS 88.A N PRO 22.A O no hydrogen 2.658 N/A HIS 88.A NE2 SER 118.A OG no hydrogen 2.770 N/A VAL 89.A N ALA 116.A O no hydrogen 3.269 N/A VAL 90.A N GLN 24.A O no hydrogen 3.124 N/A ILE 91.A N SER 118.A O no hydrogen 3.144 N/A TYR 92.A N LEU 26.A O no hydrogen 2.952 N/A ALA 94.A N SER 29.A OG no hydrogen 3.296 N/A SER 95.A N ASP 93.A OD1 no hydrogen 3.285 N/A GLN 97.A N SER 95.A OG no hydrogen 3.030 N/A GLN 97.A NE2 SER 95.A OG no hydrogen 2.733 N/A GLY 98.A N SER 95.A O no hydrogen 3.272 N/A TYR 100.A N ASP 93.A OD2 no hydrogen 2.958 N/A SER 101.A N ASP 93.A OD2 no hydrogen 3.183 N/A SER 101.A OG ALA 28.A O no hydrogen 2.698 N/A ALA 102.A N ASP 93.A OD2 no hydrogen 2.848 N/A ARG 104.A N SER 101.A O no hydrogen 3.191 N/A ARG 104.A NH1 GLY 242.A O no hydrogen 2.920 N/A ARG 104.A NH1 ASP 264.A OD1 no hydrogen 2.772 N/A ARG 104.A NH2 ASP 264.A OD1 no hydrogen 2.994 N/A VAL 105.A N ALA 102.A O no hydrogen 3.131 N/A TRP 106.A N ALA 102.A O no hydrogen 3.169 N/A TRP 107.A N PRO 103.A O no hydrogen 2.940 N/A MET 108.A N ARG 104.A O no hydrogen 3.076 N/A PHE 109.A N VAL 105.A O no hydrogen 3.183 N/A ARG 110.A NH2 PRO 258.A O no hydrogen 3.403 N/A ALA 111.A N TRP 107.A O no hydrogen 3.089 N/A PHE 112.A N MET 108.A O no hydrogen 3.247 N/A GLY 113.A N ARG 110.A O no hydrogen 3.435 N/A HIS 114.A N PHE 109.A O no hydrogen 2.845 N/A HIS 114.A NE2 THR 87.A O no hydrogen 2.932 N/A VAL 117.A N HIS 115.A O no hydrogen 2.812 N/A SER 118.A N VAL 89.A O no hydrogen 2.735 N/A SER 118.A OG HIS 88.A NE2 no hydrogen 2.770 N/A LEU 119.A N SER 3.A O no hydrogen 3.025 N/A LEU 120.A N ILE 91.A O no hydrogen 2.831 N/A ASP 121.A N VAL 5.A O no hydrogen 3.015 N/A GLY 123.A N LEU 120.A O no hydrogen 3.207 N/A LEU 124.A N ASP 93.A O no hydrogen 3.135 N/A ARG 125.A NH1 GLN 210.A O no hydrogen 3.107 N/A ARG 125.A NH2 GLN 210.A O no hydrogen 3.329 N/A HIS 126.A N GLY 122.A O no hydrogen 3.285 N/A HIS 126.A ND1 GLN 130.A OE1 no hydrogen 2.726 N/A GLN 130.A N HIS 126.A O no hydrogen 3.093 N/A GLN 130.A NE2 GLN 8.A OE1 no hydrogen 2.740 N/A SER 135.A OG GLU 43.A O no hydrogen 3.305 N/A GLY 136.A N GLU 42.A O no hydrogen 3.174 N/A SER 138.A OG ALA 49.A O no hydrogen 3.207 N/A SER 138.A OG LYS 137.A O no hydrogen 2.297 N/A SER 138.A OG GLN 139.A OE1 no hydrogen 3.530 N/A GLN 148.A N PHE 112.A O no hydrogen 2.939 N/A ASP 150.A N ALA 111.A O no hydrogen 2.866 N/A ALA 152.A N ASP 150.A OD2 no hydrogen 3.476 N/A PHE 153.A N ASP 150.A O no hydrogen 3.297 N/A ILE 154.A N PRO 151.A O no hydrogen 3.213 N/A LYS 155.A N ILE 262.A O no hydrogen 3.068 N/A THR 156.A N ASP 159.A OD2 no hydrogen 3.049 N/A THR 156.A OG1 ASP 159.A OD2 no hydrogen 3.284 N/A ASP 159.A N THR 156.A OG1 no hydrogen 3.391 N/A ILE 160.A N THR 156.A O no hydrogen 3.146 N/A LYS 161.A N TYR 157.A O no hydrogen 2.941 N/A LYS 161.A NZ GLU 158.A OE1 no hydrogen 3.565 N/A GLU 162.A N GLU 158.A O no hydrogen 2.910 N/A ASN 163.A N ASP 159.A O no hydrogen 2.937 N/A ASN 163.A ND2 PHE 169.A O no hydrogen 2.890 N/A LEU 164.A N LYS 161.A O no hydrogen 3.336 N/A GLU 165.A N GLU 162.A O no hydrogen 3.250 N/A SER 166.A N GLU 162.A O no hydrogen 3.101 N/A SER 166.A OG GLU 162.A O no hydrogen 2.971 N/A ARG 167.A N ASN 163.A O no hydrogen 2.768 N/A ARG 167.A NH1 ASN 163.A O no hydrogen 3.319 N/A ARG 167.A NH2 GLY 198.A O no hydrogen 3.099 N/A PHE 169.A N ASN 163.A OD1 no hydrogen 3.039 N/A GLN 170.A N PRO 234.A O no hydrogen 2.851 N/A GLN 170.A NE2 ASP 230.A O no hydrogen 2.723 N/A GLN 170.A NE2 LYS 233.A O no hydrogen 3.394 N/A GLN 170.A NE2 PRO 234.A O no hydrogen 3.180 N/A VAL 172.A N VAL 236.A O no hydrogen 2.958 N/A ASP 173.A N VAL 200.A O no hydrogen 2.812 N/A SER 174.A N THR 238.A O no hydrogen 2.974 N/A SER 174.A OG THR 238.A O no hydrogen 3.369 N/A SER 174.A OG THR 244.A OG1 no hydrogen 3.127 N/A ARG 175.A N ASP 173.A OD1 no hydrogen 2.982 N/A ARG 175.A NE ASP 173.A OD1 no hydrogen 3.135 N/A ARG 175.A NE ASP 173.A OD2 no hydrogen 3.273 N/A ARG 175.A NH1 GLU 186.A OE2 no hydrogen 2.782 N/A ARG 175.A NH1 GLY 194.A O no hydrogen 2.935 N/A ARG 175.A NH2 ASP 173.A OD2 no hydrogen 2.877 N/A ARG 175.A NH2 GLY 194.A O no hydrogen 2.682 N/A ARG 179.A NE GLU 186.A OE2 no hydrogen 2.897 N/A ARG 179.A NH2 GLU 186.A OE1 no hydrogen 2.663 N/A PHE 180.A N ALA 176.A O no hydrogen 3.176 N/A ARG 181.A N THR 177.A O no hydrogen 2.733 N/A ARG 181.A NH1 ASN 201.A OD1 no hydrogen 2.879 N/A GLY 182.A N GLY 178.A O no hydrogen 2.904 N/A THR 183.A N GLY 178.A O no hydrogen 2.772 N/A THR 183.A OG1 GLY 178.A O no hydrogen 3.353 N/A GLU 184.A N GLY 178.A O no hydrogen 3.089 N/A ILE 191.A N ARG 188.A O no hydrogen 3.181 N/A GLY 194.A N ARG 179.A O no hydrogen 2.801 N/A HIS 195.A ND1 PHE 180.A O no hydrogen 2.712 N/A THR 199.A N ILE 196.A O no hydrogen 3.350 N/A THR 199.A OG1 ILE 196.A O no hydrogen 2.885 N/A VAL 200.A N VAL 171.A O no hydrogen 2.905 N/A ASN 201.A ND2 ASP 173.A O no hydrogen 3.041 N/A ASN 201.A ND2 ARG 175.A O no hydrogen 3.057 N/A ILE 202.A N ASP 173.A O no hydrogen 2.980 N/A PHE 204.A N SER 174.A O no hydrogen 2.953 N/A ASP 206.A N PRO 203.A O no hydrogen 3.040 N/A PHE 207.A N PHE 204.A O no hydrogen 3.266 N/A LEU 208.A N THR 205.A O no hydrogen 3.145 N/A SER 209.A N LEU 213.A O no hydrogen 2.947 N/A GLY 212.A N SER 209.A O no hydrogen 3.179 N/A GLU 214.A N ASP 121.A OD1 no hydrogen 3.071 N/A LYS 215.A N PHE 207.A O no hydrogen 3.001 N/A LYS 215.A NZ ASP 206.A O no hydrogen 2.784 N/A SER 216.A N GLU 219.A OE1 no hydrogen 3.026 N/A SER 216.A OG GLU 219.A OE1 no hydrogen 3.276 N/A GLU 219.A N SER 216.A OG no hydrogen 3.115 N/A ILE 220.A N SER 216.A O no hydrogen 2.925 N/A ARG 221.A N PRO 217.A O no hydrogen 2.914 N/A HIS 222.A N GLU 218.A O no hydrogen 3.070 N/A LEU 223.A N GLU 219.A O no hydrogen 3.028 N/A PHE 224.A N ILE 220.A O no hydrogen 2.977 N/A GLN 225.A N ARG 221.A O no hydrogen 3.133 N/A GLU 226.A N HIS 222.A O no hydrogen 2.933 N/A LYS 227.A N LEU 223.A O no hydrogen 2.921 N/A LYS 228.A N GLN 225.A O no hydrogen 3.144 N/A VAL 229.A N PHE 224.A O no hydrogen 2.755 N/A ASP 230.A N GLN 170.A OE1 no hydrogen 2.697 N/A SER 232.A N ASP 230.A OD1 no hydrogen 3.278 N/A LYS 233.A N ASP 230.A O no hydrogen 2.974 N/A LYS 233.A NZ ASP 230.A OD2 no hydrogen 2.751 N/A VAL 236.A N GLN 170.A O no hydrogen 2.747 N/A ALA 237.A N PRO 261.A O no hydrogen 3.006 N/A THR 238.A N VAL 172.A O no hydrogen 2.825 N/A CYS 239.A N SER 266.A OG no hydrogen 3.226 N/A SER 241.A OG HIS 66.A NE2 no hydrogen 2.719 N/A THR 244.A OG1 SER 174.A OG no hydrogen 3.127 N/A CYS 246.A N VAL 243.A O no hydrogen 3.380 N/A CYS 246.A SG GLY 242.A O no hydrogen 3.749 N/A CYS 246.A SG VAL 243.A O no hydrogen 3.515 N/A HIS 247.A N THR 244.A O no hydrogen 3.087 N/A VAL 248.A N ALA 245.A O no hydrogen 3.063 N/A ALA 249.A N ALA 245.A O no hydrogen 3.376 N/A LEU 250.A N CYS 246.A O no hydrogen 2.813 N/A GLY 251.A N HIS 247.A O no hydrogen 2.965 N/A ALA 252.A N VAL 248.A O no hydrogen 3.057 N/A TYR 253.A N ALA 249.A O no hydrogen 2.945 N/A LEU 254.A N LEU 250.A O no hydrogen 2.926 N/A CYS 255.A N ALA 252.A O no hydrogen 3.182 N/A CYS 255.A SG PRO 217.A O no hydrogen 3.406 N/A CYS 255.A SG GLY 251.A O no hydrogen 3.295 N/A GLY 256.A N TYR 253.A O no hydrogen 3.043 N/A LYS 257.A N ALA 252.A O no hydrogen 2.850 N/A LYS 257.A NZ LEU 231.A O no hydrogen 3.016 N/A LYS 257.A NZ LYS 233.A O no hydrogen 2.876 N/A VAL 260.A N PRO 258.A O no hydrogen 3.166 N/A ILE 262.A N PHE 153.A O no hydrogen 2.940 N/A TYR 263.A N ALA 237.A O no hydrogen 2.930 N/A TYR 263.A OH GLU 269.A OE1 no hydrogen 2.769 N/A SER 266.A OG TYR 263.A O no hydrogen 2.646 N/A TRP 267.A N CYS 239.A O no hydrogen 2.806 N/A TRP 267.A NE1 GLU 192.A O no hydrogen 2.713 N/A VAL 268.A N GLY 240.A O no hydrogen 3.042 N/A GLU 269.A N GLY 265.A O no hydrogen 3.287 N/A TRP 270.A N SER 266.A O no hydrogen 2.998 N/A TYR 271.A N TRP 267.A O no hydrogen 2.708 N/A MET 272.A N VAL 268.A O no hydrogen 3.043 N/A ARG 273.A N GLU 269.A O no hydrogen 2.812 N/A ARG 273.A NH1 GLU 269.A OE2 no hydrogen 3.386 N/A ALA 274.A N TRP 270.A O no hydrogen 2.736 N/A ARG 275.A N TYR 271.A O no hydrogen 3.090 N/A ARG 275.A NE MET 272.A O no hydrogen 3.215 N/A