Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2grm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N PHE 2.A O no hydrogen 2.610 N/A GLY 5.A N ASP 38.A OD1 no hydrogen 2.952 N/A SER 6.A N ASP 38.A OD2 no hydrogen 3.167 N/A VAL 7.A N LYS 3.A O no hydrogen 3.304 N/A LEU 8.A N ILE 4.A O no hydrogen 2.956 N/A LYS 9.A N GLY 5.A O no hydrogen 3.026 N/A GLN 10.A N SER 6.A O no hydrogen 3.038 N/A ILE 11.A N VAL 7.A O no hydrogen 2.784 N/A ARG 12.A N LEU 8.A O no hydrogen 2.702 N/A ARG 12.A NE GLU 36.A OE2 no hydrogen 2.684 N/A ARG 12.A NH1 TYR 17.A O no hydrogen 3.330 N/A ARG 12.A NH2 GLU 36.A OE1 no hydrogen 2.630 N/A ARG 12.A NH2 GLU 36.A OE2 no hydrogen 3.349 N/A GLN 13.A N LYS 9.A O no hydrogen 2.713 N/A GLU 14.A N GLN 10.A O no hydrogen 2.965 N/A LEU 15.A N ILE 11.A O no hydrogen 2.890 N/A ASN 16.A N GLN 13.A O no hydrogen 3.068 N/A TYR 17.A N ARG 12.A O no hydrogen 2.909 N/A HIS 18.A N ASP 21.A OD2 no hydrogen 2.862 N/A ASP 21.A N HIS 18.A O no hydrogen 2.617 N/A LEU 22.A N GLN 19.A O no hydrogen 2.827 N/A TYR 23.A N GLN 19.A O no hydrogen 3.198 N/A SER 24.A N ILE 20.A O no hydrogen 3.207 N/A SER 24.A OG ILE 20.A O no hydrogen 2.593 N/A ILE 26.A N TYR 23.A O no hydrogen 2.848 N/A MET 27.A N TYR 23.A O no hydrogen 2.755 N/A SER 28.A OG SER 30.A OG no hydrogen 3.354 N/A SER 30.A OG SER 28.A OG no hydrogen 3.354 N/A VAL 31.A N SER 28.A OG no hydrogen 3.231 N/A TYR 32.A N SER 28.A O no hydrogen 2.806 N/A TYR 32.A OH GLU 36.A OE2 no hydrogen 2.616 N/A ILE 33.A N LYS 29.A O no hydrogen 3.269 N/A LYS 34.A N SER 30.A O no hydrogen 3.242 N/A VAL 35.A N VAL 31.A O no hydrogen 2.891 N/A GLU 36.A N TYR 32.A O no hydrogen 2.745 N/A ASP 38.A N VAL 35.A O no hydrogen 2.800 N/A SER 39.A N LYS 34.A O no hydrogen 3.162 N/A SER 39.A OG LYS 34.A O no hydrogen 2.612 N/A ARG 40.A N LYS 34.A O no hydrogen 3.063 N/A ARG 40.A NE PRO 41.A O no hydrogen 3.083 N/A ARG 40.A NH1 PRO 41.A O no hydrogen 3.280 N/A ARG 40.A NH1 GLU 46.A OE2 no hydrogen 2.678 N/A SER 43.A N GLU 46.A OE1 no hydrogen 2.827 N/A GLU 46.A N SER 43.A OG no hydrogen 2.866 N/A LEU 47.A N SER 43.A O no hydrogen 2.913 N/A SER 48.A N VAL 44.A O no hydrogen 2.726 N/A LYS 49.A N GLU 45.A O no hydrogen 3.127 N/A PHE 50.A N GLU 46.A O no hydrogen 2.951 N/A SER 51.A N LEU 47.A O no hydrogen 2.786 N/A SER 51.A OG VAL 56.A O no hydrogen 2.824 N/A GLU 52.A N SER 48.A O no hydrogen 3.181 N/A ARG 53.A N LYS 49.A O no hydrogen 2.914 N/A ARG 53.A NH1 ASP 21.A O no hydrogen 3.499 N/A LEU 54.A N PHE 50.A O no hydrogen 2.892 N/A GLY 55.A N SER 51.A O no hydrogen 3.021 N/A GLU 60.A N ASN 57.A OD1 no hydrogen 2.920 N/A ILE 61.A N ASN 57.A O no hydrogen 2.964 N/A LEU 62.A N PHE 58.A O no hydrogen 3.048 N/A ASN 63.A N PHE 59.A O no hydrogen 2.893 N/A ARG 64.A N GLU 60.A O no hydrogen 2.738 N/A ARG 64.A NE GLU 60.A OE1 no hydrogen 2.823 N/A ARG 64.A NH2 GLU 60.A OE1 no hydrogen 2.980 N/A ALA 65.A N ILE 61.A O no hydrogen 2.913 N/A ALA 65.A N LEU 62.A O no hydrogen 2.863 N/A GLY 66.A N ASN 63.A O no hydrogen 2.838 N/A MET 67.A N LEU 62.A O no hydrogen 3.285 N/A SER 71.A N THR 69.A O no hydrogen 2.629 N/A THR 75.A OG1 ASN 73.A OD1 no hydrogen 2.894 N/A GLY 76.A N ASN 73.A O no hydrogen 2.934 N/A GLY 76.A N ASN 73.A OD1 no hydrogen 3.378 N/A LYS 77.A N ASN 73.A O no hydrogen 3.475 N/A GLU 78.A N GLU 74.A O no hydrogen 3.292 N/A LYS 79.A N THR 75.A O no hydrogen 3.119 N/A LYS 79.A N GLY 76.A O no hydrogen 3.197 N/A LYS 79.A NZ GLU 154.A OE1 no hydrogen 3.208 N/A LYS 79.A NZ GLU 154.A OE2 no hydrogen 3.499 N/A LEU 80.A N GLY 76.A O no hydrogen 3.218 N/A LEU 81.A N LYS 77.A O no hydrogen 2.997 N/A ILE 82.A N GLU 78.A O no hydrogen 3.316 N/A ILE 82.A N LYS 79.A O no hydrogen 3.254 N/A SER 83.A OG GLU 315.A OE1 no hydrogen 3.279 N/A ILE 85.A N LEU 81.A O no hydrogen 2.800 N/A PHE 86.A N SER 83.A O no hydrogen 3.120 N/A THR 87.A N LYS 84.A O no hydrogen 3.107 N/A THR 87.A OG1 SER 83.A O no hydrogen 3.274 N/A THR 87.A OG1 LYS 84.A O no hydrogen 3.234 N/A ASN 88.A ND2 LYS 84.A O no hydrogen 3.185 N/A LEU 91.A N ASN 88.A O no hydrogen 2.921 N/A PHE 96.A N PHE 92.A O no hydrogen 2.769 N/A GLN 97.A N ASP 93.A O no hydrogen 2.958 N/A GLN 97.A NE2 ASP 93.A O no hydrogen 3.243 N/A ARG 98.A N ASN 95.A O no hydrogen 2.909 N/A ARG 98.A NE GLU 78.A OE2 no hydrogen 3.444 N/A ARG 98.A NH2 GLU 78.A OE1 no hydrogen 3.123 N/A ARG 98.A NH2 GLU 78.A OE2 no hydrogen 3.162 N/A ILE 99.A N ASN 95.A O no hydrogen 3.185 N/A GLU 100.A N PHE 96.A O no hydrogen 2.988 N/A LYS 102.A N ILE 99.A O no hydrogen 2.728 N/A ARG 103.A N GLU 100.A O no hydrogen 3.278 N/A ARG 103.A NE ASP 137.A OD2 no hydrogen 3.423 N/A ARG 103.A NH1 GLU 100.A O no hydrogen 3.246 N/A THR 105.A N LYS 102.A O no hydrogen 2.974 N/A THR 105.A OG1 LYS 102.A O no hydrogen 2.764 N/A TYR 109.A N SER 106.A OG no hydrogen 3.341 N/A TYR 109.A OH GLU 74.A OE1 no hydrogen 3.089 N/A PHE 110.A N SER 106.A O no hydrogen 3.143 N/A SER 111.A N LEU 107.A O no hydrogen 2.998 N/A SER 111.A OG GLU 154.A OE1 no hydrogen 2.455 N/A SER 111.A OG ASN 158.A OD1 no hydrogen 3.504 N/A ILE 112.A N GLN 108.A O no hydrogen 3.124 N/A TYR 113.A N TYR 109.A O no hydrogen 2.779 N/A LEU 114.A N PHE 110.A O no hydrogen 2.870 N/A GLY 115.A N SER 111.A O no hydrogen 2.897 N/A TYR 116.A N ILE 112.A O no hydrogen 3.073 N/A ILE 117.A N TYR 113.A O no hydrogen 3.049 N/A SER 118.A N LEU 114.A O no hydrogen 3.005 N/A SER 118.A N GLY 115.A O no hydrogen 3.134 N/A SER 118.A OG LEU 114.A O no hydrogen 3.338 N/A ILE 119.A N GLY 115.A O no hydrogen 3.342 N/A ALA 120.A N TYR 116.A O no hydrogen 2.945 N/A HIS 121.A N ILE 117.A O no hydrogen 3.156 N/A HIS 122.A N SER 118.A O no hydrogen 3.021 N/A HIS 122.A NE2 PRO 309.A O no hydrogen 2.776 N/A TYR 123.A N ILE 119.A O no hydrogen 3.037 N/A TYR 123.A OH PHE 86.A O no hydrogen 2.423 N/A ASN 124.A N HIS 121.A O no hydrogen 3.050 N/A ASN 124.A ND2 HIS 121.A O no hydrogen 2.921 N/A ILE 125.A N ALA 120.A O no hydrogen 2.649 N/A PHE 130.A N VAL 127.A O no hydrogen 3.301 N/A LYS 132.A N PRO 128.A O no hydrogen 3.291 N/A THR 133.A N THR 129.A O no hydrogen 3.112 N/A THR 133.A N PHE 130.A O no hydrogen 2.858 N/A THR 133.A OG1 THR 129.A O no hydrogen 2.608 N/A THR 133.A OG1 ASP 137.A OD2 no hydrogen 3.348 N/A ILE 134.A N PHE 130.A O no hydrogen 2.842 N/A ASP 137.A N THR 133.A O no hydrogen 2.853 N/A LEU 138.A N ILE 134.A O no hydrogen 2.843 N/A LYS 139.A N THR 135.A O no hydrogen 3.086 N/A HIS 140.A N SER 136.A O no hydrogen 2.971 N/A LEU 141.A N ASP 137.A O no hydrogen 2.805 N/A TYR 142.A N LEU 138.A O no hydrogen 2.650 N/A TYR 142.A OH ASP 152.A OD2 no hydrogen 2.811 N/A ARG 145.A NH1 ASP 152.A OD2 no hydrogen 3.372 N/A ARG 145.A NH2 THR 147.A O no hydrogen 3.176 N/A ARG 145.A NH2 ASP 152.A OD1 no hydrogen 2.577 N/A ARG 145.A NH2 ASP 152.A OD2 no hydrogen 3.544 N/A PHE 149.A N ASP 152.A OD1 no hydrogen 2.746 N/A ASP 152.A N PHE 149.A O no hydrogen 2.955 N/A TYR 153.A N PHE 149.A O no hydrogen 3.423 N/A TYR 153.A OH MET 175.A O no hydrogen 2.607 N/A GLU 154.A N GLY 150.A O no hydrogen 3.065 N/A ILE 155.A N ILE 151.A O no hydrogen 2.828 N/A VAL 156.A N ASP 152.A O no hydrogen 3.107 N/A SER 157.A N TYR 153.A O no hydrogen 2.943 N/A SER 157.A OG TYR 153.A O no hydrogen 2.758 N/A ASN 158.A N GLU 154.A O no hydrogen 3.196 N/A LEU 159.A N ILE 155.A O no hydrogen 2.908 N/A LEU 160.A N VAL 156.A O no hydrogen 3.036 N/A ASN 161.A N ASN 158.A O no hydrogen 3.021 N/A ASN 161.A ND2 SER 118.A OG no hydrogen 3.097 N/A VAL 162.A N LEU 159.A O no hydrogen 3.119 N/A TYR 165.A OH GLU 209.A OE1 no hydrogen 3.052 N/A TYR 165.A OH TYR 213.A OH no hydrogen 2.662 N/A GLU 167.A N PRO 164.A O no hydrogen 2.775 N/A VAL 168.A N TYR 165.A O no hydrogen 2.937 N/A SER 169.A N TYR 165.A O no hydrogen 2.811 N/A ILE 171.A N VAL 168.A O no hydrogen 2.999 N/A ILE 172.A N VAL 168.A O no hydrogen 3.310 N/A ILE 172.A N SER 169.A O no hydrogen 3.069 N/A LYS 173.A N SER 169.A O no hydrogen 3.385 N/A LYS 173.A NZ GLU 209.A OE1 no hydrogen 2.878 N/A LYS 173.A NZ GLU 209.A OE2 no hydrogen 3.138 N/A MET 175.A N ILE 172.A O no hydrogen 2.588 N/A TYR 176.A N LYS 173.A O no hydrogen 3.418 N/A TYR 176.A OH ILE 190.A O no hydrogen 2.640 N/A SER 181.A OG ASP 187.A OD1 no hydrogen 2.569 N/A SER 181.A OG ASP 187.A OD2 no hydrogen 2.810 N/A SER 181.A OG ASN 225.A O no hydrogen 3.341 N/A ASP 187.A N GLY 183.A O no hydrogen 2.740 N/A LEU 188.A N LYS 184.A O no hydrogen 2.911 N/A LEU 188.A N ASP 185.A O no hydrogen 3.196 N/A THR 189.A N ASP 185.A O no hydrogen 3.017 N/A THR 189.A OG1 GLY 150.A O no hydrogen 3.262 N/A THR 189.A OG1 ASP 185.A O no hydrogen 3.507 N/A THR 189.A OG1 TYR 186.A O no hydrogen 3.340 N/A ILE 190.A N TYR 186.A O no hydrogen 3.057 N/A GLN 191.A N LEU 188.A O no hydrogen 3.221 N/A GLN 191.A NE2 ASP 187.A O no hydrogen 2.846 N/A GLN 191.A NE2 SER 227.A O no hydrogen 2.856 N/A THR 192.A N LEU 188.A O no hydrogen 3.143 N/A THR 192.A OG1 LEU 188.A O no hydrogen 2.948 N/A THR 192.A OG1 TYR 232.A OH no hydrogen 3.136 N/A VAL 193.A N THR 189.A O no hydrogen 3.333 N/A LYS 195.A N GLN 191.A O no hydrogen 2.847 N/A LYS 195.A NZ GLU 235.A OE1 no hydrogen 3.547 N/A LYS 195.A NZ GLU 235.A OE2 no hydrogen 3.214 N/A ASN 196.A N THR 192.A O no hydrogen 2.786 N/A ASN 196.A ND2 SER 157.A O no hydrogen 3.382 N/A ALA 197.A N VAL 193.A O no hydrogen 2.853 N/A LEU 198.A N LEU 194.A O no hydrogen 2.830 N/A THR 199.A N LYS 195.A O no hydrogen 3.211 N/A THR 199.A OG1 LYS 195.A O no hydrogen 2.841 N/A ILE 200.A N ASN 196.A O no hydrogen 3.071 N/A SER 201.A N ALA 197.A O no hydrogen 2.957 N/A SER 201.A OG ALA 197.A O no hydrogen 2.974 N/A ILE 202.A N LEU 198.A O no hydrogen 3.123 N/A MET 203.A N THR 199.A O no hydrogen 2.925 N/A ASN 204.A N ILE 200.A O no hydrogen 3.038 N/A ASN 204.A N SER 201.A O no hydrogen 2.954 N/A ARG 205.A N ILE 202.A O no hydrogen 2.918 N/A ARG 205.A NE GLU 287.A OE1 no hydrogen 2.943 N/A ARG 205.A NH2 LEU 246.A O no hydrogen 3.532 N/A ARG 205.A NH2 GLU 287.A OE2 no hydrogen 3.065 N/A ASN 206.A N SER 201.A O no hydrogen 2.929 N/A GLU 209.A N ASN 206.A OD1 no hydrogen 3.093 N/A ALA 210.A N ASN 206.A O no hydrogen 3.177 N/A GLN 211.A N LEU 207.A O no hydrogen 2.849 N/A GLN 211.A NE2 GLN 211.A O no hydrogen 3.376 N/A TYR 212.A N LYS 208.A O no hydrogen 3.396 N/A TYR 213.A N GLU 209.A O no hydrogen 2.949 N/A TYR 213.A OH TYR 165.A OH no hydrogen 2.662 N/A ILE 214.A N ALA 210.A O no hydrogen 2.997 N/A ASN 215.A N GLN 211.A O no hydrogen 3.007 N/A GLN 216.A N TYR 212.A O no hydrogen 2.911 N/A PHE 217.A N TYR 213.A O no hydrogen 2.922 N/A GLU 218.A N ILE 214.A O no hydrogen 2.843 N/A HIS 219.A N ASN 215.A O no hydrogen 2.870 N/A HIS 219.A NE2 ILE 178.A O no hydrogen 3.058 N/A LEU 220.A N GLN 216.A O no hydrogen 3.301 N/A LYS 221.A N GLU 218.A O no hydrogen 3.285 N/A LYS 221.A NZ GLU 218.A OE2 no hydrogen 3.153 N/A LYS 221.A NZ ASP 233.A OD1 no hydrogen 2.516 N/A THR 222.A N HIS 219.A O no hydrogen 2.830 N/A ILE 223.A N LEU 220.A O no hydrogen 3.158 N/A SER 227.A N ASP 187.A OD2 no hydrogen 3.322 N/A ASN 229.A N GLN 191.A OE1 no hydrogen 2.993 N/A TYR 232.A N ASN 229.A OD1 no hydrogen 3.040 N/A TYR 232.A OH THR 192.A OG1 no hydrogen 3.136 N/A ASP 233.A N ASN 229.A O no hydrogen 2.962 N/A LEU 234.A N GLY 230.A O no hydrogen 2.980 N/A LEU 234.A N CYS 231.A O no hydrogen 2.848 N/A GLU 235.A N CYS 231.A O no hydrogen 2.812 N/A ILE 236.A N TYR 232.A O no hydrogen 2.585 N/A ASN 237.A N ASP 233.A O no hydrogen 3.279 N/A ASN 237.A ND2 ASP 233.A O no hydrogen 3.599 N/A TYR 238.A N LEU 234.A O no hydrogen 3.013 N/A LEU 239.A N GLU 235.A O no hydrogen 3.048 N/A LYS 240.A N ILE 236.A O no hydrogen 2.862 N/A LYS 240.A NZ GLU 218.A OE1 no hydrogen 3.478 N/A GLN 241.A N ASN 237.A O no hydrogen 3.102 N/A ILE 242.A N TYR 238.A O no hydrogen 3.077 N/A TYR 243.A N LEU 239.A O no hydrogen 2.903 N/A GLN 244.A N LYS 240.A O no hydrogen 2.989 N/A GLN 244.A NE2 LYS 240.A O no hydrogen 3.420 N/A PHE 245.A N GLN 241.A O no hydrogen 2.993 N/A LEU 246.A N ILE 242.A O no hydrogen 2.966 N/A THR 247.A N TYR 243.A O no hydrogen 3.033 N/A THR 247.A OG1 TYR 243.A O no hydrogen 3.089 N/A ASP 248.A N GLN 244.A O no hydrogen 3.016 N/A LYS 249.A NZ GLU 287.A OE2 no hydrogen 2.564 N/A SER 253.A N ASN 250.A OD1 no hydrogen 3.047 N/A TYR 254.A OH SER 284.A OG no hydrogen 2.869 N/A LEU 255.A N ILE 251.A O no hydrogen 2.910 N/A ASN 256.A N ASP 252.A O no hydrogen 2.883 N/A ALA 257.A N SER 253.A O no hydrogen 3.028 N/A VAL 258.A N TYR 254.A O no hydrogen 3.027 N/A ASN 259.A N LEU 255.A O no hydrogen 2.726 N/A ILE 260.A N ASN 256.A O no hydrogen 2.744 N/A ILE 261.A N ALA 257.A O no hydrogen 3.050 N/A ASN 262.A N VAL 258.A O no hydrogen 3.000 N/A ILE 263.A N ASN 259.A O no hydrogen 3.063 N/A PHE 264.A N ILE 260.A O no hydrogen 3.261 N/A LYS 265.A N ASN 262.A O no hydrogen 2.755 N/A LYS 265.A NZ ASN 262.A OD1 no hydrogen 3.398 N/A LYS 265.A NZ TYR 298.A OH no hydrogen 2.960 N/A ILE 266.A N ASN 262.A O no hydrogen 3.057 N/A ILE 267.A N ILE 263.A O no hydrogen 2.933 N/A GLY 268.A N LYS 265.A O no hydrogen 3.121 N/A LYS 269.A N PHE 264.A O no hydrogen 2.849 N/A GLU 270.A N GLY 268.A O no hydrogen 2.756 N/A HIS 273.A N LYS 269.A O no hydrogen 3.009 N/A HIS 273.A ND1 TYR 302.A OH no hydrogen 2.595 N/A ARG 274.A N GLU 270.A O no hydrogen 2.992 N/A SER 275.A N ASP 271.A O no hydrogen 2.698 N/A LEU 276.A N ILE 272.A O no hydrogen 2.877 N/A VAL 277.A N HIS 273.A O no hydrogen 2.908 N/A GLU 278.A N ARG 274.A O no hydrogen 3.208 N/A GLU 279.A N SER 275.A O no hydrogen 3.045 N/A LEU 280.A N LEU 276.A O no hydrogen 3.006 N/A THR 281.A N VAL 277.A O no hydrogen 2.859 N/A THR 281.A OG1 VAL 277.A O no hydrogen 3.052 N/A LYS 282.A N GLU 278.A O no hydrogen 3.388 N/A ILE 283.A N GLU 279.A O no hydrogen 3.017 N/A SER 284.A N LEU 280.A O no hydrogen 2.993 N/A SER 284.A OG TYR 254.A OH no hydrogen 2.869 N/A SER 284.A OG LEU 280.A O no hydrogen 2.962 N/A ALA 285.A N THR 281.A O no hydrogen 2.872 N/A LYS 286.A N LYS 282.A O no hydrogen 3.051 N/A LYS 286.A NZ MET 203.A O no hydrogen 3.185 N/A GLU 287.A N SER 284.A O no hydrogen 2.904 N/A LYS 288.A N ALA 285.A O no hydrogen 2.764 N/A PHE 289.A N SER 284.A O no hydrogen 2.957 N/A THR 296.A N PRO 292.A O no hydrogen 3.100 N/A MET 297.A N GLU 294.A O no hydrogen 2.622 N/A TYR 298.A N GLU 294.A O no hydrogen 2.740 N/A TYR 299.A N VAL 295.A O no hydrogen 3.195 N/A TYR 302.A N TYR 298.A O no hydrogen 2.674 N/A TYR 302.A OH HIS 273.A ND1 no hydrogen 2.595 N/A VAL 303.A N TYR 299.A O no hydrogen 2.707 N/A ILE 305.A N TYR 302.A O no hydrogen 2.846 N/A ASN 307.A ND2 ALA 304.A O no hydrogen 3.357 N/A ASN 308.A N GLU 306.A O no hydrogen 2.627 N/A