Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pf1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N LEU 2.A O no hydrogen 3.330 N/A GLY 6.A N TYR 3.A O no hydrogen 3.174 N/A PHE 9.A N GLY 6.A O no hydrogen 3.223 N/A SER 10.A N SER 7.A O no hydrogen 3.047 N/A SER 10.A OG SER 7.A O no hydrogen 2.824 N/A ALA 11.A N ASP 91.A OD2 no hydrogen 2.885 N/A LYS 12.A NZ GLU 41.A OE2 no hydrogen 3.062 N/A ARG 13.A N SER 10.A O no hydrogen 3.112 N/A ARG 13.A N SER 10.A OG no hydrogen 3.408 N/A LEU 14.A N ALA 11.A O no hydrogen 2.989 N/A ARG 18.A N ASP 277.A OD1 no hydrogen 2.811 N/A LEU 19.A N ASP 277.A OD2 no hydrogen 3.193 N/A GLY 20.A N THR 17.A OG1 no hydrogen 2.993 N/A THR 21.A N THR 17.A O no hydrogen 2.860 N/A THR 21.A OG1 THR 17.A O no hydrogen 2.964 N/A PHE 22.A N ARG 18.A O no hydrogen 2.990 N/A LEU 23.A N LEU 19.A O no hydrogen 3.038 N/A GLU 24.A N GLY 20.A O no hydrogen 3.068 N/A ASN 25.A N THR 21.A O no hydrogen 2.881 N/A ARG 26.A N PHE 22.A O no hydrogen 3.218 N/A ARG 26.A NH1 GLU 144.A OE1 no hydrogen 3.009 N/A ARG 26.A NH1 GLU 198.A OE1 no hydrogen 3.308 N/A ARG 26.A NH2 GLU 198.A OE1 no hydrogen 3.459 N/A ARG 26.A NH2 GLU 198.A OE2 no hydrogen 2.602 N/A VAL 27.A N LEU 23.A O no hydrogen 2.972 N/A ASN 28.A N GLU 24.A O no hydrogen 2.836 N/A ASN 28.A ND2 GLU 24.A O no hydrogen 3.098 N/A ASN 28.A ND2 VAL 42.A O no hydrogen 2.766 N/A ASP 29.A N ASN 25.A O no hydrogen 2.961 N/A PHE 30.A N ARG 26.A O no hydrogen 3.095 N/A LEU 31.A N VAL 27.A O no hydrogen 2.947 N/A ARG 32.A N ASN 28.A O no hydrogen 2.777 N/A ARG 32.A NH1 ASP 29.A OD1 no hydrogen 3.322 N/A ARG 33.A N ASP 29.A O no hydrogen 3.105 N/A GLN 34.A N PHE 30.A O no hydrogen 3.318 N/A GLN 34.A N LEU 31.A O no hydrogen 3.175 N/A ASN 35.A N LEU 31.A O no hydrogen 3.208 N/A GLU 38.A N HIS 36.A ND1 no hydrogen 3.230 N/A SER 39.A N HIS 36.A O no hydrogen 3.334 N/A SER 39.A OG HIS 36.A O no hydrogen 3.050 N/A GLY 40.A N GLU 85.A OE2 no hydrogen 2.907 N/A VAL 42.A N ASN 28.A OD1 no hydrogen 2.898 N/A THR 43.A N PHE 84.A O no hydrogen 2.861 N/A VAL 44.A N GLU 24.A OE1 no hydrogen 3.211 N/A ARG 45.A N PHE 82.A O no hydrogen 3.059 N/A ARG 45.A NE LEU 14.A O no hydrogen 3.025 N/A ARG 45.A NH1 GLU 24.A OE1 no hydrogen 2.918 N/A ARG 45.A NH1 VAL 44.A O no hydrogen 2.832 N/A ARG 45.A NH2 LYS 12.A O no hydrogen 2.831 N/A VAL 47.A N ALA 80.A O no hydrogen 2.801 N/A HIS 48.A ND1 CYS 282.A O no hydrogen 2.972 N/A HIS 48.A NE2 SER 50.A OG no hydrogen 2.816 N/A ALA 49.A N ILE 280.A O no hydrogen 2.958 N/A SER 50.A N THR 78.A O no hydrogen 3.157 N/A SER 50.A OG HIS 48.A NE2 no hydrogen 2.816 N/A LYS 52.A N TYR 76.A O no hydrogen 2.838 N/A LYS 52.A NZ ASP 286.A OD1 no hydrogen 2.599 N/A LYS 52.A NZ ASP 286.A OD2 no hydrogen 3.061 N/A VAL 54.A N PHE 74.A O no hydrogen 2.939 N/A VAL 56.A N GLU 72.A O no hydrogen 2.765 N/A LYS 57.A N TYR 224.A OH no hydrogen 3.042 N/A GLY 59.A N GLU 235.A OE2 no hydrogen 2.842 N/A MET 60.A N GLU 235.A OE1 no hydrogen 2.917 N/A LYS 61.A N LYS 57.A O no hydrogen 2.847 N/A LYS 61.A NZ ASP 66.A OD1 no hydrogen 3.219 N/A ALA 62.A N PRO 58.A O no hydrogen 2.744 N/A ARG 63.A N GLY 59.A O no hydrogen 3.016 N/A ARG 63.A NH1 ARG 63.A O no hydrogen 3.196 N/A ARG 63.A NH1 GLU 69.A OE2 no hydrogen 3.196 N/A PHE 64.A N MET 60.A O no hydrogen 2.890 N/A VAL 65.A N LYS 61.A O no hydrogen 2.806 N/A ASP 66.A N LYS 61.A O no hydrogen 3.092 N/A SER 67.A OG ARG 63.A O no hydrogen 3.083 N/A SER 67.A OG PHE 64.A O no hydrogen 3.150 N/A SER 67.A OG GLU 69.A OE2 no hydrogen 3.068 N/A GLY 68.A N VAL 65.A O no hydrogen 3.124 N/A GLU 69.A N PHE 64.A O no hydrogen 2.867 N/A PHE 74.A N VAL 54.A O no hydrogen 2.946 N/A TYR 76.A N LYS 52.A O no hydrogen 3.040 N/A ARG 77.A N GLU 101.A O no hydrogen 2.961 N/A ARG 77.A NE ASP 51.A OD1 no hydrogen 2.834 N/A ARG 77.A NH2 ASP 51.A OD1 no hydrogen 3.338 N/A ARG 77.A NH2 ASP 51.A OD2 no hydrogen 3.110 N/A THR 78.A N SER 50.A O no hydrogen 2.999 N/A THR 78.A OG1 VAL 99.A O no hydrogen 3.165 N/A LYS 79.A N VAL 99.A O no hydrogen 3.082 N/A LYS 79.A NZ ASP 275.A OD2 no hydrogen 3.006 N/A ALA 80.A N HIS 48.A O no hydrogen 3.034 N/A LEU 81.A N MET 97.A O no hydrogen 3.005 N/A PHE 82.A N ARG 45.A O no hydrogen 3.011 N/A ALA 83.A N PHE 95.A O no hydrogen 2.915 N/A PHE 84.A N THR 43.A O no hydrogen 2.733 N/A GLU 85.A N LEU 92.A O no hydrogen 2.944 N/A GLU 86.A N GLU 41.A O no hydrogen 3.105 N/A ILE 87.A N VAL 90.A O no hydrogen 2.706 N/A VAL 90.A N ILE 87.A O no hydrogen 3.186 N/A LEU 92.A N GLU 85.A O no hydrogen 2.915 N/A CYS 93.A N THR 312.A OG1 no hydrogen 3.000 N/A CYS 93.A SG ALA 83.A O no hydrogen 3.919 N/A PHE 94.A N ALA 83.A O no hydrogen 3.170 N/A PHE 95.A N ALA 83.A O no hydrogen 3.486 N/A GLY 96.A N ASP 120.A O no hydrogen 2.882 N/A MET 97.A N LEU 81.A O no hydrogen 3.123 N/A HIS 98.A N TYR 118.A O no hydrogen 2.765 N/A VAL 99.A N LYS 79.A O no hydrogen 2.956 N/A GLN 100.A N TYR 115.A O no hydrogen 2.838 N/A GLN 100.A NE2 GLU 226.A O no hydrogen 2.790 N/A GLU 101.A N ARG 77.A O no hydrogen 2.905 N/A TYR 102.A N ARG 113.A O no hydrogen 2.767 N/A TYR 102.A OH GLN 100.A OE1 no hydrogen 2.634 N/A CYS 106.A SG PRO 75.A O no hydrogen 3.839 N/A CYS 106.A SG PRO 107.A O no hydrogen 3.665 N/A ASN 110.A N PRO 107.A O no hydrogen 3.103 N/A ASN 110.A ND2 TYR 224.A O no hydrogen 2.571 N/A GLN 111.A NE2 CYS 106.A O no hydrogen 3.070 N/A ARG 112.A N GLY 103.A O no hydrogen 3.096 N/A ARG 112.A NH1 GLY 150.A O no hydrogen 2.819 N/A ARG 112.A NH1 PRO 271.A O no hydrogen 3.553 N/A ARG 112.A NH2 PRO 271.A O no hydrogen 2.808 N/A ARG 113.A N TYR 102.A O no hydrogen 2.931 N/A ARG 113.A NE PRO 109.A O no hydrogen 2.604 N/A ARG 113.A NH1 HIS 155.A NE2 no hydrogen 3.087 N/A ARG 113.A NH2 PRO 109.A O no hydrogen 2.721 N/A VAL 114.A N THR 153.A O no hydrogen 2.988 N/A TYR 115.A N GLN 100.A O no hydrogen 2.876 N/A ILE 116.A N HIS 155.A O no hydrogen 3.144 N/A SER 117.A OG HIS 98.A O no hydrogen 3.278 N/A TYR 118.A N HIS 98.A O no hydrogen 3.345 N/A ASP 120.A N GLY 96.A O no hydrogen 2.887 N/A SER 121.A N ASP 120.A OD1 no hydrogen 2.905 N/A SER 121.A OG TYR 135.A OH no hydrogen 3.264 N/A VAL 122.A N PHE 94.A O no hydrogen 2.905 N/A HIS 123.A N GLN 176.A OE1 no hydrogen 3.086 N/A PHE 124.A N VAL 122.A O no hydrogen 2.941 N/A ARG 126.A N GLU 85.A OE1 no hydrogen 2.964 N/A LEU 130.A N PRO 127.A O no hydrogen 3.035 N/A ARG 131.A N LYS 128.A O no hydrogen 3.357 N/A VAL 134.A N LEU 130.A O no hydrogen 3.055 N/A TYR 135.A N ARG 131.A O no hydrogen 3.089 N/A HIS 136.A N THR 132.A O no hydrogen 2.978 N/A GLU 137.A N ALA 133.A O no hydrogen 2.872 N/A ILE 138.A N VAL 134.A O no hydrogen 2.993 N/A LEU 139.A N TYR 135.A O no hydrogen 3.092 N/A ILE 140.A N HIS 136.A O no hydrogen 2.847 N/A GLY 141.A N GLU 137.A O no hydrogen 2.952 N/A TYR 142.A N ILE 138.A O no hydrogen 2.898 N/A TYR 142.A OH GLU 101.A OE2 no hydrogen 2.593 N/A LEU 143.A N LEU 139.A O no hydrogen 3.046 N/A GLU 144.A N ILE 140.A O no hydrogen 2.828 N/A TYR 145.A N GLY 141.A O no hydrogen 2.821 N/A VAL 146.A N TYR 142.A O no hydrogen 3.035 N/A LYS 147.A N LEU 143.A O no hydrogen 2.960 N/A LYS 147.A NZ ARG 199.A O no hydrogen 3.275 N/A LYS 147.A NZ ILE 200.A O no hydrogen 2.701 N/A LYS 147.A NZ LEU 261.A O no hydrogen 2.978 N/A LYS 148.A N GLU 144.A O no hydrogen 2.994 N/A LEU 149.A N TYR 145.A O no hydrogen 3.217 N/A GLY 150.A N VAL 146.A O no hydrogen 3.241 N/A GLY 150.A N LYS 147.A O no hydrogen 2.831 N/A TYR 151.A N VAL 146.A O no hydrogen 2.987 N/A THR 152.A N ARG 112.A O no hydrogen 2.866 N/A THR 152.A OG1 ARG 112.A O no hydrogen 3.449 N/A THR 152.A OG1 THR 153.A OG1 no hydrogen 2.927 N/A THR 153.A N ARG 112.A O no hydrogen 3.237 N/A THR 153.A OG1 THR 152.A OG1 no hydrogen 2.927 N/A GLY 154.A N ILE 259.A O no hydrogen 2.817 N/A ILE 156.A N PHE 257.A O no hydrogen 3.184 N/A ALA 158.A N VAL 255.A O no hydrogen 2.875 N/A CYS 159.A SG PRO 160.A O no hydrogen 3.752 N/A ASP 165.A N SER 162.A O no hydrogen 2.964 N/A TYR 167.A OH CYS 159.A O no hydrogen 2.694 N/A ILE 168.A N ASP 120.A OD2 no hydrogen 2.832 N/A PHE 169.A N ASP 120.A OD2 no hydrogen 3.177 N/A CYS 171.A N ASP 166.A OD2 no hydrogen 2.988 N/A HIS 172.A ND1 ASP 166.A OD1 no hydrogen 2.998 N/A HIS 172.A NE2 ASP 120.A OD1 no hydrogen 2.843 N/A GLN 176.A N PRO 173.A O no hydrogen 2.853 N/A GLN 176.A NE2 SER 121.A O no hydrogen 2.999 N/A LYS 182.A NZ GLU 186.A OE2 no hydrogen 3.158 N/A LEU 184.A N LYS 180.A O no hydrogen 3.113 N/A GLN 185.A N PRO 181.A O no hydrogen 2.899 N/A GLU 186.A N LYS 182.A O no hydrogen 3.003 N/A TRP 187.A N ARG 183.A O no hydrogen 2.987 N/A PHE 188.A N LEU 184.A O no hydrogen 3.136 N/A LYS 189.A N GLN 185.A O no hydrogen 3.052 N/A LYS 189.A NZ GLU 186.A OE2 no hydrogen 2.930 N/A LYS 190.A N GLU 186.A O no hydrogen 2.928 N/A MET 191.A N TRP 187.A O no hydrogen 3.292 N/A LEU 192.A N PHE 188.A O no hydrogen 2.923 N/A ASP 193.A N LYS 189.A O no hydrogen 2.737 N/A LYS 194.A N LYS 190.A O no hydrogen 3.188 N/A LYS 194.A NZ GLU 137.A OE2 no hydrogen 2.831 N/A ALA 195.A N MET 191.A O no hydrogen 2.999 N/A VAL 196.A N LEU 192.A O no hydrogen 2.697 N/A SER 197.A N ASP 193.A O no hydrogen 3.008 N/A SER 197.A OG LYS 194.A O no hydrogen 2.828 N/A GLU 198.A N LYS 194.A O no hydrogen 3.193 N/A ARG 199.A N VAL 196.A O no hydrogen 3.007 N/A ARG 199.A NH1 VAL 196.A O no hydrogen 3.087 N/A ILE 200.A N ALA 195.A O no hydrogen 2.911 N/A VAL 201.A N ALA 195.A O no hydrogen 3.180 N/A HIS 202.A N ARG 260.A O no hydrogen 2.813 N/A TYR 204.A OH ASP 193.A OD1 no hydrogen 2.543 N/A LYS 205.A N VAL 258.A O no hydrogen 3.027 N/A ILE 207.A N PHE 256.A O no hydrogen 3.207 N/A LYS 209.A N ASP 206.A OD1 no hydrogen 2.789 N/A GLN 210.A N ASP 206.A O no hydrogen 3.034 N/A GLN 210.A NE2 ASP 214.A OD1 no hydrogen 3.298 N/A GLN 210.A NE2 ASP 214.A OD2 no hydrogen 3.425 N/A ALA 211.A N ILE 207.A O no hydrogen 2.958 N/A THR 212.A N PHE 208.A O no hydrogen 2.943 N/A THR 212.A OG1 PHE 208.A O no hydrogen 2.862 N/A GLU 213.A N LYS 209.A O no hydrogen 2.911 N/A ASP 214.A N GLN 210.A O no hydrogen 2.823 N/A ARG 215.A N THR 212.A O no hydrogen 2.846 N/A LEU 216.A N ALA 211.A O no hydrogen 3.247 N/A THR 217.A N GLU 221.A OE1 no hydrogen 2.820 N/A THR 217.A OG1 GLU 221.A OE1 no hydrogen 3.182 N/A SER 218.A N GLU 221.A OE1 no hydrogen 3.046 N/A LYS 220.A N SER 218.A OG no hydrogen 3.305 N/A LYS 220.A NZ GLU 69.A O no hydrogen 3.520 N/A GLU 221.A N SER 218.A O no hydrogen 3.156 N/A LEU 222.A N ALA 219.A O no hydrogen 3.039 N/A TYR 224.A N ASN 110.A OD1 no hydrogen 2.810 N/A GLU 226.A N GLN 100.A OE1 no hydrogen 3.132 N/A TRP 230.A N ASP 228.A OD2 no hydrogen 3.415 N/A VAL 233.A N PHE 229.A O no hydrogen 3.043 N/A LEU 234.A N TRP 230.A O no hydrogen 3.187 N/A GLU 235.A N PRO 231.A O no hydrogen 3.249 N/A GLU 236.A N ASN 232.A O no hydrogen 2.962 N/A SER 237.A N VAL 233.A O no hydrogen 2.803 N/A ILE 238.A N LEU 234.A O no hydrogen 2.916 N/A LYS 239.A N GLU 235.A O no hydrogen 3.082 N/A SER 241.A N ILE 238.A O no hydrogen 3.235 N/A TYR 246.A N SER 242.A O no hydrogen 3.235 N/A TYR 246.A OH LEU 216.A O no hydrogen 2.425 N/A ALA 247.A N GLN 243.A O no hydrogen 3.278 N/A THR 248.A N LYS 244.A O no hydrogen 3.302 N/A THR 248.A OG1 LYS 244.A O no hydrogen 2.609 N/A MET 249.A N LEU 245.A O no hydrogen 2.857 N/A GLU 250.A N TYR 246.A O no hydrogen 2.776 N/A LYS 251.A N ALA 247.A O no hydrogen 3.239 N/A HIS 252.A N THR 248.A O no hydrogen 3.175 N/A LYS 253.A N GLU 250.A O no hydrogen 3.253 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 3.180 N/A VAL 255.A N HIS 252.A O no hydrogen 3.002 N/A PHE 256.A N LYS 253.A O no hydrogen 3.410 N/A PHE 257.A N ILE 156.A O no hydrogen 2.993 N/A VAL 258.A N LYS 205.A O no hydrogen 2.993 N/A ILE 259.A N GLY 154.A O no hydrogen 2.815 N/A ARG 260.A N ASP 203.A O no hydrogen 2.822 N/A ARG 260.A NE ASP 203.A OD1 no hydrogen 2.903 N/A ARG 260.A NH2 ASP 203.A OD1 no hydrogen 3.317 N/A ARG 260.A NH2 ASP 203.A OD2 no hydrogen 2.977 N/A LEU 261.A N THR 152.A O no hydrogen 2.790 N/A ILE 262.A N THR 152.A O no hydrogen 3.264 N/A ALA 267.A N GLY 264.A O no hydrogen 3.171 N/A ASN 268.A N PRO 265.A O no hydrogen 3.341 N/A ILE 273.A N SER 104.A OG no hydrogen 2.843 N/A ASP 277.A N ASP 275.A OD1 no hydrogen 3.140 N/A ILE 280.A N ALA 49.A O no hydrogen 2.907 N/A MET 285.A N CYS 282.A O no hydrogen 3.085 N/A ASP 286.A N ASP 283.A O no hydrogen 3.270 N/A ARG 288.A NE TYR 167.A O no hydrogen 2.765 N/A ARG 288.A NH1 ASP 166.A O no hydrogen 2.760 N/A LEU 292.A N ARG 288.A O no hydrogen 3.438 N/A THR 293.A N ASP 289.A O no hydrogen 2.748 N/A THR 293.A OG1 ASP 289.A O no hydrogen 2.889 N/A LEU 294.A N ALA 290.A O no hydrogen 2.983 N/A ALA 295.A N PHE 291.A O no hydrogen 3.046 N/A ARG 296.A N LEU 292.A O no hydrogen 2.878 N/A ASP 297.A N THR 293.A O no hydrogen 3.033 N/A LYS 298.A N LEU 294.A O no hydrogen 2.888 N/A LEU 300.A N ALA 295.A O no hydrogen 2.808 N/A PHE 302.A N HIS 170.A O no hydrogen 3.062 N/A PHE 302.A N CYS 171.A O no hydrogen 3.150 N/A SER 303.A OG GLU 301.A OE1 no hydrogen 2.912 N/A ARG 307.A N SER 304.A OG no hydrogen 3.175 N/A ARG 307.A NH1 HIS 299.A O no hydrogen 3.337 N/A ALA 308.A N SER 304.A O no hydrogen 2.768 N/A GLN 309.A N LEU 305.A O no hydrogen 2.944 N/A TRP 310.A N ARG 306.A O no hydrogen 3.275 N/A SER 311.A N ARG 307.A O no hydrogen 2.865 N/A SER 311.A OG GLU 301.A O no hydrogen 2.567 N/A SER 311.A OG ARG 307.A O no hydrogen 3.145 N/A THR 312.A N ALA 308.A O no hydrogen 2.756 N/A THR 312.A OG1 ALA 308.A O no hydrogen 2.660 N/A MET 313.A N GLN 309.A O no hydrogen 2.971 N/A CYS 314.A N TRP 310.A O no hydrogen 3.082 N/A CYS 314.A SG TRP 310.A O no hydrogen 3.429 N/A MET 315.A N SER 311.A O no hydrogen 3.058 N/A LEU 316.A N THR 312.A O no hydrogen 2.859 N/A VAL 317.A N MET 313.A O no hydrogen 3.050 N/A GLU 318.A N CYS 314.A O no hydrogen 3.182 N/A LEU 319.A N MET 315.A O no hydrogen 3.013 N/A HIS 320.A N LEU 316.A O no hydrogen 2.824 N/A HIS 320.A NE2 SER 10.A O no hydrogen 2.893 N/A THR 321.A N VAL 317.A O no hydrogen 2.970 N/A THR 321.A N GLU 318.A O no hydrogen 3.123 N/A THR 321.A OG1 VAL 317.A O no hydrogen 2.684 N/A THR 321.A OG1 GLU 318.A O no hydrogen 3.223 N/A GLN 322.A N GLU 318.A O no hydrogen 2.877 N/A