Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dle_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A NE1 ASP 44.A OD2 no hydrogen 2.562 N/A PHE 9.A N ALA 29.A O no hydrogen 2.927 N/A VAL 10.A N ARG 49.A O no hydrogen 2.730 N/A GLY 11.A N ALA 27.A O no hydrogen 2.388 N/A VAL 13.A N ALA 25.A O no hydrogen 3.060 N/A SER 15.A N ASP 22.A O no hydrogen 3.271 N/A ARG 16.A NE GLU 18.A OE1 no hydrogen 2.611 N/A ARG 16.A NH2 GLU 18.A OE2 no hydrogen 2.974 N/A LYS 17.A NZ ASP 266.A OD2 no hydrogen 3.552 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.626 N/A TRP 20.A N GLU 18.A O no hydrogen 3.004 N/A ASP 22.A N SER 15.A OG no hydrogen 2.752 N/A LEU 23.A N TYR 39.A OH no hydrogen 2.984 N/A LEU 24.A N VAL 13.A O no hydrogen 2.995 N/A ALA 25.A N VAL 13.A O no hydrogen 3.471 N/A ALA 27.A N GLY 11.A O no hydrogen 2.745 N/A ALA 28.A N HIS 35.A O no hydrogen 3.142 N/A ALA 29.A N PHE 9.A O no hydrogen 2.447 N/A ARG 30.A N ARG 33.A O no hydrogen 3.423 N/A ARG 33.A N ARG 30.A O no hydrogen 2.882 N/A ARG 36.A NE GLU 3.A OE2 no hydrogen 2.997 N/A ARG 36.A NH1 GLU 96.A OE2 no hydrogen 2.312 N/A ALA 37.A N LEU 26.A O no hydrogen 3.173 N/A TYR 39.A OH ASP 22.A OD1 no hydrogen 2.311 N/A LYS 40.A N GLU 38.A OE1 no hydrogen 2.591 N/A ALA 41.A N GLU 38.A O no hydrogen 2.920 N/A ARG 43.A N LYS 40.A O no hydrogen 3.113 N/A ASP 44.A N ALA 41.A O no hydrogen 3.180 N/A LYS 46.A NZ ASP 44.A O no hydrogen 3.318 N/A ARG 49.A NE ASP 69.A OD2 no hydrogen 3.412 N/A ARG 49.A NH2 ASP 69.A OD2 no hydrogen 2.768 N/A GLY 50.A N ASP 69.A O no hydrogen 2.739 N/A LEU 51.A N SER 104.A OG no hydrogen 3.064 N/A LEU 52.A N ASP 70.A OD1 no hydrogen 3.233 N/A ALA 53.A N ASP 70.A OD2 no hydrogen 3.087 N/A ASP 55.A N LEU 52.A O no hydrogen 3.242 N/A SER 57.A N ALA 53.A O no hydrogen 3.135 N/A SER 57.A OG LEU 67.A O no hydrogen 2.516 N/A VAL 58.A N LYS 54.A O no hydrogen 2.856 N/A LEU 59.A N ASP 55.A O no hydrogen 3.145 N/A ALA 60.A N LEU 56.A O no hydrogen 2.909 N/A LEU 61.A N SER 57.A O no hydrogen 2.729 N/A ARG 62.A N VAL 58.A O no hydrogen 2.805 N/A ARG 62.A N LEU 59.A O no hydrogen 3.246 N/A ARG 62.A NE GLU 63.A OE2 no hydrogen 2.892 N/A ARG 62.A NH1 MET 19.A O no hydrogen 3.201 N/A ARG 62.A NH1 ALA 21.A O no hydrogen 3.005 N/A ARG 62.A NH2 ALA 21.A O no hydrogen 3.378 N/A ARG 62.A NH2 GLU 63.A OE2 no hydrogen 2.961 N/A GLU 63.A N LEU 59.A O no hydrogen 3.287 N/A GLU 63.A N ALA 60.A O no hydrogen 3.043 N/A LEU 65.A N ALA 60.A O no hydrogen 2.838 N/A ASP 70.A N TYR 125.A OH no hydrogen 3.393 N/A LEU 72.A N ASP 70.A O no hydrogen 2.897 N/A LEU 73.A N ASP 70.A O no hydrogen 3.333 N/A TYR 75.A N MET 71.A O no hydrogen 3.039 N/A TYR 75.A OH THR 257.A O no hydrogen 2.390 N/A LEU 76.A N LEU 72.A O no hydrogen 3.162 N/A LEU 76.A N LEU 73.A O no hydrogen 3.210 N/A LEU 77.A N LEU 73.A O no hydrogen 2.993 N/A ASP 78.A N ALA 74.A O no hydrogen 2.863 N/A SER 79.A OG ASP 78.A OD1 no hydrogen 2.937 N/A ASN 80.A N ASP 78.A O no hydrogen 3.112 N/A ASN 80.A ND2 ALA 74.A O no hydrogen 2.755 N/A ASN 80.A ND2 TYR 89.A OH no hydrogen 3.169 N/A GLY 84.A N THR 82.A O no hydrogen 3.090 N/A VAL 85.A N THR 82.A O no hydrogen 3.086 N/A ARG 88.A N VAL 85.A O no hydrogen 3.056 N/A ARG 88.A NH2 ASN 80.A OD1 no hydrogen 2.710 N/A TYR 89.A N VAL 85.A O no hydrogen 3.045 N/A GLU 95.A N THR 94.A OG1 no hydrogen 2.317 N/A GLY 98.A N GLU 96.A OE2 no hydrogen 2.907 N/A ARG 100.A N GLU 96.A O no hydrogen 2.797 N/A ARG 100.A NE THR 94.A O no hydrogen 2.738 N/A ARG 100.A NH1 PHE 12.A O no hydrogen 2.714 N/A ARG 100.A NH2 THR 94.A O no hydrogen 3.073 N/A ALA 101.A N ALA 97.A O no hydrogen 2.868 N/A ALA 102.A N GLY 98.A O no hydrogen 2.868 N/A LEU 103.A N GLU 99.A O no hydrogen 3.114 N/A SER 104.A N ARG 100.A O no hydrogen 3.115 N/A SER 104.A OG ARG 100.A O no hydrogen 2.965 N/A GLU 105.A N ALA 101.A O no hydrogen 3.274 N/A ARG 106.A N ALA 102.A O no hydrogen 3.295 N/A ARG 106.A NE ALA 102.A O no hydrogen 3.331 N/A LEU 107.A N LEU 103.A O no hydrogen 2.714 N/A PHE 108.A N SER 104.A O no hydrogen 3.186 N/A ALA 109.A N GLU 105.A O no hydrogen 3.182 N/A ASN 110.A N ARG 106.A O no hydrogen 3.207 N/A ASN 110.A ND2 TYR 89.A O no hydrogen 3.229 N/A LEU 111.A N LEU 107.A O no hydrogen 3.040 N/A TRP 112.A N PHE 108.A O no hydrogen 2.743 N/A GLY 113.A N ALA 109.A O no hydrogen 2.988 N/A ARG 114.A N ASN 110.A O no hydrogen 2.866 N/A GLU 116.A N GLY 113.A O no hydrogen 3.485 N/A GLU 118.A N LEU 115.A O no hydrogen 3.406 N/A GLU 119.A N GLY 117.A O no hydrogen 2.915 N/A ARG 120.A NH1 GLU 402.A OE2 no hydrogen 3.350 N/A ARG 120.A NH2 LEU 404.A O no hydrogen 3.206 N/A LEU 121.A N GLU 118.A O no hydrogen 2.973 N/A LEU 122.A N GLU 118.A O no hydrogen 2.748 N/A TRP 123.A N GLU 119.A O no hydrogen 2.886 N/A TYR 125.A N LEU 122.A O no hydrogen 3.071 N/A TYR 125.A OH ASP 69.A OD1 no hydrogen 2.727 N/A ARG 126.A N LEU 122.A O no hydrogen 2.820 N/A GLU 127.A N TRP 123.A O no hydrogen 3.095 N/A GLU 129.A N LEU 124.A O no hydrogen 3.148 N/A ARG 130.A N TYR 125.A O no hydrogen 2.871 N/A SER 132.A N GLU 129.A O no hydrogen 3.014 N/A SER 132.A OG ARG 130.A O no hydrogen 2.649 N/A LEU 135.A N LEU 131.A O no hydrogen 2.860 N/A ALA 136.A N SER 132.A O no hydrogen 3.321 N/A HIS 137.A N ALA 133.A O no hydrogen 3.230 N/A MET 138.A N VAL 134.A O no hydrogen 3.038 N/A GLU 139.A N LEU 135.A O no hydrogen 2.923 N/A ALA 140.A N ALA 136.A O no hydrogen 3.128 N/A THR 141.A N HIS 137.A O no hydrogen 3.083 N/A THR 141.A OG1 HIS 137.A O no hydrogen 2.538 N/A GLY 142.A N MET 138.A O no hydrogen 3.034 N/A VAL 143.A N LEU 248.A O no hydrogen 2.947 N/A ARG 144.A NH1 ALA 285.A O no hydrogen 2.927 N/A ASP 146.A N ALA 282.A O no hydrogen 2.698 N/A TYR 149.A N ASP 146.A OD1 no hydrogen 3.449 N/A TYR 149.A OH ARG 278.A O no hydrogen 3.241 N/A LEU 150.A N ASP 146.A O no hydrogen 3.399 N/A ARG 151.A N VAL 147.A O no hydrogen 2.962 N/A ARG 151.A NH2 ASP 240.A OD1 no hydrogen 3.227 N/A ALA 152.A N ALA 148.A O no hydrogen 3.203 N/A LEU 153.A N TYR 149.A O no hydrogen 3.001 N/A SER 154.A N LEU 150.A O no hydrogen 2.873 N/A SER 154.A N ARG 151.A O no hydrogen 3.175 N/A SER 154.A OG ASP 238.A OD1 no hydrogen 2.812 N/A GLU 156.A N ALA 152.A O no hydrogen 3.201 N/A VAL 157.A N LEU 153.A O no hydrogen 3.067 N/A ALA 158.A N SER 154.A O no hydrogen 2.902 N/A GLU 159.A N LEU 155.A O no hydrogen 3.435 N/A ILE 161.A N VAL 157.A O no hydrogen 2.912 N/A ALA 162.A N ALA 158.A O no hydrogen 3.086 N/A ARG 163.A N GLU 159.A O no hydrogen 3.133 N/A LEU 164.A N GLU 160.A O no hydrogen 3.317 N/A GLU 165.A N ILE 161.A O no hydrogen 2.838 N/A ALA 166.A N ALA 162.A O no hydrogen 2.880 N/A GLU 167.A N ARG 163.A O no hydrogen 2.948 N/A VAL 168.A N GLU 165.A O no hydrogen 3.167 N/A PHE 169.A N GLU 165.A O no hydrogen 3.054 N/A ALA 172.A N VAL 168.A O no hydrogen 3.183 N/A GLY 173.A N ARG 170.A O no hydrogen 2.985 N/A HIS 174.A NE2 GLU 190.A OE1 no hydrogen 2.768 N/A HIS 174.A NE2 GLU 190.A OE2 no hydrogen 3.062 N/A ASN 176.A N GLN 182.A OE1 no hydrogen 2.869 N/A ASN 178.A N ASN 176.A OD1 no hydrogen 2.996 N/A SER 179.A N ASN 176.A O no hydrogen 3.110 N/A ARG 180.A NE ASP 181.A OD1 no hydrogen 2.644 N/A ARG 180.A NH1 ASP 181.A OD1 no hydrogen 3.501 N/A LEU 183.A N SER 179.A O no hydrogen 3.059 N/A GLU 184.A N ARG 180.A O no hydrogen 2.965 N/A ARG 185.A N ASP 181.A O no hydrogen 3.413 N/A VAL 186.A N GLN 182.A O no hydrogen 3.235 N/A LEU 187.A N LEU 183.A O no hydrogen 2.958 N/A PHE 188.A N GLU 184.A O no hydrogen 3.061 N/A ASP 189.A N ARG 185.A O no hydrogen 2.941 N/A GLU 190.A N ARG 185.A O no hydrogen 2.884 N/A LEU 191.A N VAL 186.A O no hydrogen 2.865 N/A THR 198.A N LYS 203.A O no hydrogen 2.702 N/A THR 198.A OG1 THR 201.A OG1 no hydrogen 3.146 N/A THR 198.A OG1 LYS 203.A O no hydrogen 3.311 N/A THR 201.A OG1 THR 198.A OG1 no hydrogen 3.146 N/A LYS 203.A N THR 198.A OG1 no hydrogen 2.678 N/A LYS 203.A NZ ASP 181.A OD1 no hydrogen 2.639 N/A LYS 203.A NZ ASP 181.A OD2 no hydrogen 3.440 N/A ARG 204.A N GLU 184.A OE2 no hydrogen 2.998 N/A ARG 204.A NE GLU 184.A OE2 no hydrogen 2.822 N/A ARG 204.A NH1 ASP 189.A OD1 no hydrogen 2.538 N/A ARG 204.A NH2 GLU 184.A OE2 no hydrogen 3.461 N/A ARG 204.A NH2 ASP 189.A OD1 no hydrogen 3.236 N/A ARG 204.A NH2 ASP 189.A OD2 no hydrogen 2.849 N/A SER 205.A N GLY 196.A O no hydrogen 2.736 N/A SER 205.A OG SER 207.A OG no hydrogen 3.222 N/A SER 207.A N SER 205.A OG no hydrogen 3.166 N/A SER 207.A OG SER 205.A OG no hydrogen 3.222 N/A VAL 210.A N SER 207.A OG no hydrogen 3.426 N/A LEU 211.A N SER 207.A O no hydrogen 2.905 N/A GLU 212.A N ALA 208.A O no hydrogen 2.684 N/A ALA 213.A N VAL 210.A O no hydrogen 3.261 N/A LEU 214.A N LEU 211.A O no hydrogen 3.104 N/A ARG 215.A NE GLU 221.A OE1 no hydrogen 2.956 N/A ARG 215.A NH1 GLU 212.A OE2 no hydrogen 3.024 N/A ALA 217.A N LEU 214.A O no hydrogen 3.336 N/A VAL 220.A N HIS 218.A O no hydrogen 3.358 N/A ILE 223.A N ILE 219.A O no hydrogen 3.017 N/A LEU 224.A N VAL 220.A O no hydrogen 3.181 N/A GLN 225.A NE2 GLU 221.A OE2 no hydrogen 3.279 N/A TYR 226.A N LYS 222.A O no hydrogen 2.822 N/A TYR 226.A OH ASN 178.A OD1 no hydrogen 3.023 N/A ARG 227.A N ILE 223.A O no hydrogen 2.673 N/A ARG 227.A NH1 THR 206.A O no hydrogen 2.948 N/A ARG 227.A NH2 THR 206.A O no hydrogen 3.218 N/A ARG 227.A NH2 THR 206.A OG1 no hydrogen 3.015 N/A GLU 228.A N LEU 224.A O no hydrogen 3.136 N/A LEU 229.A N GLN 225.A O no hydrogen 3.214 N/A THR 230.A N TYR 226.A O no hydrogen 3.099 N/A THR 230.A OG1 TYR 226.A O no hydrogen 2.901 N/A THR 230.A OG1 ARG 227.A O no hydrogen 3.332 N/A LYS 231.A N ARG 227.A O no hydrogen 3.063 N/A LEU 232.A N GLU 228.A O no hydrogen 3.292 N/A LYS 233.A N LEU 229.A O no hydrogen 2.925 N/A LYS 233.A NZ ASP 238.A OD2 no hydrogen 2.654 N/A SER 234.A N THR 230.A O no hydrogen 2.962 N/A SER 234.A OG THR 230.A O no hydrogen 2.594 N/A THR 235.A N LYS 231.A O no hydrogen 3.254 N/A THR 235.A OG1 LYS 231.A O no hydrogen 2.947 N/A TYR 236.A N LEU 232.A O no hydrogen 3.081 N/A TYR 236.A OH ASN 270.A O no hydrogen 2.667 N/A ILE 237.A N LEU 232.A O no hydrogen 2.976 N/A ASP 238.A N LYS 233.A O no hydrogen 3.046 N/A LEU 241.A N LEU 239.A O no hydrogen 3.111 N/A HIS 243.A N ARG 247.A O no hydrogen 3.128 N/A THR 245.A N HIS 243.A O no hydrogen 3.315 N/A THR 245.A OG1 HIS 249.A NE2 no hydrogen 2.732 N/A GLY 246.A N HIS 243.A O no hydrogen 2.662 N/A ARG 247.A N THR 245.A OG1 no hydrogen 3.181 N/A ARG 247.A NH2 GLU 468.A OE1 no hydrogen 2.946 N/A ARG 247.A NH2 GLU 468.A OE2 no hydrogen 2.813 N/A LEU 248.A N VAL 143.A O no hydrogen 2.656 N/A HIS 249.A ND1 GLU 139.A O no hydrogen 2.737 N/A HIS 249.A NE2 THR 245.A OG1 no hydrogen 2.732 N/A THR 250.A OG1 SER 264.A OG no hydrogen 2.474 N/A THR 250.A OG1 SER 265.A O no hydrogen 3.477 N/A ARG 251.A N SER 265.A O no hydrogen 2.961 N/A PHE 252.A N GLU 139.A OE1 no hydrogen 2.488 N/A ASN 253.A N SER 263.A O no hydrogen 2.645 N/A GLN 254.A NE2 GLU 129.A O no hydrogen 2.953 N/A GLN 254.A NE2 GLU 129.A OE1 no hydrogen 2.634 N/A THR 255.A OG1 THR 81.A O no hydrogen 3.173 N/A THR 255.A OG1 THR 255.A O no hydrogen 2.455 N/A THR 257.A OG1 TYR 75.A OH no hydrogen 3.166 N/A THR 257.A OG1 ARG 261.A O no hydrogen 2.536 N/A THR 259.A OG1 GLN 433.A OE1 no hydrogen 2.744 N/A SER 263.A OG ASN 253.A OD1 no hydrogen 3.561 N/A SER 264.A OG THR 250.A OG1 no hydrogen 2.474 N/A SER 265.A N ARG 251.A O no hydrogen 3.065 N/A SER 265.A OG ASN 253.A OD1 no hydrogen 3.031 N/A LEU 268.A N SER 264.A OG no hydrogen 2.951 N/A GLN 269.A N ASN 267.A OD1 no hydrogen 2.889 N/A GLN 269.A NE2 GLN 460.A O no hydrogen 2.738 N/A THR 274.A OG1 GLU 228.A OE2 no hydrogen 3.417 N/A GLY 276.A N THR 274.A OG1 no hydrogen 3.051 N/A GLN 277.A N THR 274.A O no hydrogen 2.918 N/A GLN 277.A NE2 VAL 272.A O no hydrogen 3.548 N/A ARG 278.A NH1 GLU 156.A OE2 no hydrogen 2.663 N/A ARG 278.A NH2 GLU 156.A OE1 no hydrogen 2.797 N/A ARG 278.A NH2 GLU 156.A OE2 no hydrogen 2.971 N/A ILE 279.A N LEU 275.A O no hydrogen 3.326 N/A ARG 280.A N GLY 276.A O no hydrogen 3.033 N/A ARG 281.A N GLN 277.A O no hydrogen 3.181 N/A ALA 282.A N ILE 279.A O no hydrogen 3.121 N/A PHE 283.A N ARG 280.A O no hydrogen 3.361 N/A ILE 284.A N ARG 144.A O no hydrogen 3.201 N/A ALA 285.A N GLU 500.A O no hydrogen 3.295 N/A GLU 286.A N.A GLU 468.A OE2 no hydrogen 2.958 N/A GLU 286.A N.B GLU 468.A OE2 no hydrogen 2.960 N/A GLU 287.A N GLU 286.A OE1.A no hydrogen 2.718 N/A TRP 289.A N GLU 286.A O.A no hydrogen 2.800 N/A TRP 289.A N GLU 286.A O.B no hydrogen 2.837 N/A LEU 290.A N ALA 469.A O no hydrogen 2.690 N/A LEU 291.A N GLY 499.A O no hydrogen 2.958 N/A VAL 292.A N LEU 467.A O no hydrogen 2.778 N/A ALA 293.A N GLY 497.A O no hydrogen 3.099 N/A LEU 294.A N LEU 465.A O no hydrogen 2.906 N/A ASP 295.A N GLU 495.A O no hydrogen 3.056 N/A TYR 296.A N ASP 463.A O no hydrogen 3.104 N/A TYR 296.A OH MET 484.A O no hydrogen 2.450 N/A SER 297.A N GLU 493.A O no hydrogen 3.031 N/A GLN 298.A NE2 ARG 321.A O no hydrogen 3.487 N/A ARG 302.A N GLN 298.A O no hydrogen 3.082 N/A ARG 302.A NE SER 297.A O no hydrogen 2.464 N/A ARG 302.A NH2 SER 297.A O no hydrogen 3.476 N/A VAL 303.A N ILE 299.A O no hydrogen 2.991 N/A LEU 304.A N GLU 300.A O no hydrogen 2.731 N/A ALA 305.A N LEU 301.A O no hydrogen 3.058 N/A HIS 306.A N ARG 302.A O no hydrogen 3.052 N/A LEU 307.A N VAL 303.A O no hydrogen 2.862 N/A SER 308.A N LEU 304.A O no hydrogen 2.969 N/A SER 308.A OG LEU 304.A O no hydrogen 2.523 N/A GLY 309.A N ALA 305.A O no hydrogen 2.893 N/A GLU 311.A N GLU 311.A OE1 no hydrogen 2.719 N/A LEU 313.A N ASP 310.A OD1 no hydrogen 2.399 N/A ILE 314.A N ASP 310.A O no hydrogen 2.826 N/A ARG 315.A N GLU 311.A O no hydrogen 3.181 N/A VAL 316.A N ASN 312.A O no hydrogen 3.075 N/A GLN 318.A N ILE 314.A O no hydrogen 3.116 N/A GLU 319.A N ARG 315.A O no hydrogen 2.921 N/A GLU 319.A N VAL 316.A O no hydrogen 3.357 N/A GLY 320.A N PHE 317.A O no hydrogen 2.847 N/A ARG 321.A N VAL 316.A O no hydrogen 3.073 N/A ARG 321.A NE GLU 326.A OE1.B no hydrogen 3.550 N/A ARG 321.A NE GLU 326.A OE2.A no hydrogen 2.593 N/A ARG 321.A NH1 GLU 319.A OE1 no hydrogen 3.459 N/A ARG 321.A NH2 GLU 326.A OE1.A no hydrogen 3.373 N/A ARG 321.A NH2 GLU 326.A OE1.B no hydrogen 3.391 N/A ILE 323.A N GLN 298.A OE1 no hydrogen 2.734 N/A THR 325.A N ASP 322.A OD1 no hydrogen 3.235 N/A GLU 326.A N ASP 322.A O no hydrogen 3.015 N/A THR 327.A N ILE 323.A O no hydrogen 3.025 N/A THR 327.A OG1 ILE 323.A O no hydrogen 2.546 N/A THR 327.A OG1 ASN 349.A OD1 no hydrogen 3.016 N/A ALA 328.A N HIS 324.A O no hydrogen 3.117 N/A SER 329.A N THR 325.A O no hydrogen 2.885 N/A SER 329.A OG VAL 334.A O no hydrogen 2.281 N/A TRP 330.A N GLU 326.A O no hydrogen 3.147 N/A TRP 330.A N THR 327.A O no hydrogen 3.176 N/A MET 331.A N THR 327.A O no hydrogen 3.214 N/A PHE 332.A N ALA 328.A O no hydrogen 3.333 N/A MET 341.A N ASP 339.A OD1 no hydrogen 2.485 N/A ARG 342.A N ASP 339.A O no hydrogen 3.131 N/A ARG 342.A NE ASP 322.A OD1 no hydrogen 3.279 N/A ARG 342.A NE ASP 322.A OD2 no hydrogen 2.867 N/A ARG 342.A NH2 ASP 322.A OD1 no hydrogen 3.278 N/A ARG 342.A NH2 ASP 322.A OD2 no hydrogen 3.151 N/A ALA 345.A N ARG 342.A O no hydrogen 3.018 N/A LYS 346.A N ARG 343.A O no hydrogen 3.140 N/A ASN 349.A N ALA 345.A O no hydrogen 2.935 N/A ASN 349.A ND2 THR 327.A OG1 no hydrogen 2.870 N/A PHE 350.A N LYS 346.A O no hydrogen 2.855 N/A GLY 351.A N THR 347.A O no hydrogen 2.996 N/A VAL 352.A N ILE 348.A O no hydrogen 2.842 N/A LEU 353.A N ASN 349.A O no hydrogen 3.124 N/A TYR 354.A N PHE 350.A O no hydrogen 3.243 N/A TYR 354.A N GLY 351.A O no hydrogen 3.193 N/A TYR 354.A OH GLU 300.A OE1 no hydrogen 2.595 N/A GLY 355.A N VAL 352.A O no hydrogen 3.287 N/A MET 356.A N GLY 351.A O no hydrogen 3.104 N/A ARG 360.A N SER 357.A OG no hydrogen 3.061 N/A ARG 360.A NE GLU 364.A OE2 no hydrogen 2.943 N/A LEU 361.A N SER 357.A O no hydrogen 3.149 N/A SER 362.A N ALA 358.A O no hydrogen 2.910 N/A SER 362.A OG ILE 367.A O no hydrogen 2.524 N/A GLN 363.A N HIS 359.A O no hydrogen 3.328 N/A GLU 364.A N ARG 360.A O no hydrogen 3.158 N/A LEU 365.A N LEU 361.A O no hydrogen 3.178 N/A ALA 366.A N GLN 363.A O no hydrogen 3.337 N/A ILE 367.A N SER 362.A O no hydrogen 2.981 N/A GLN 372.A N TYR 368.A O no hydrogen 3.168 N/A PHE 374.A N ALA 371.A O no hydrogen 3.126 N/A GLU 376.A N GLN 372.A O no hydrogen 3.179 N/A ARG 377.A N ALA 373.A O no hydrogen 3.106 N/A TYR 378.A N PHE 374.A O no hydrogen 2.491 N/A PHE 379.A N ILE 375.A O no hydrogen 3.114 N/A GLN 380.A N ARG 377.A O no hydrogen 3.303 N/A SER 381.A N ARG 377.A O no hydrogen 3.176 N/A SER 381.A OG ARG 377.A O no hydrogen 3.078 N/A TRP 387.A N LYS 383.A O no hydrogen 3.258 N/A ILE 388.A N VAL 384.A O no hydrogen 2.898 N/A GLU 389.A N ARG 385.A O no hydrogen 3.085 N/A LYS 390.A N ALA 386.A O no hydrogen 3.208 N/A LYS 390.A NZ GLU 394.A OE2 no hydrogen 2.547 N/A THR 391.A N TRP 387.A O no hydrogen 2.766 N/A THR 391.A OG1 TRP 387.A O no hydrogen 2.697 N/A LEU 392.A N ILE 388.A O no hydrogen 2.992 N/A GLU 393.A N GLU 389.A O no hydrogen 2.956 N/A GLU 394.A N LYS 390.A O no hydrogen 3.059 N/A GLY 395.A N THR 391.A O no hydrogen 2.849 N/A ARG 396.A N LEU 392.A O no hydrogen 2.803 N/A ARG 397.A N GLU 393.A O no hydrogen 3.180 N/A ARG 397.A NH2.A GLU 393.A OE1 no hydrogen 2.601 N/A ARG 398.A N GLU 394.A O no hydrogen 3.076 N/A ARG 398.A NH2 GLU 394.A OE1 no hydrogen 3.373 N/A GLY 399.A N GLY 395.A O no hydrogen 2.797 N/A VAL 401.A N ARG 409.A O no hydrogen 3.154 N/A THR 403.A N ARG 407.A O no hydrogen 2.851 N/A THR 403.A OG1 ASP 438.A OD2 no hydrogen 2.782 N/A LEU 404.A N THR 435.A OG1 no hydrogen 3.319 N/A GLY 406.A N THR 403.A OG1 no hydrogen 3.386 N/A ARG 407.A N THR 403.A OG1 no hydrogen 3.014 N/A ARG 407.A NE ASP 438.A OD1 no hydrogen 2.697 N/A ARG 407.A NH1 GLU 129.A OE2 no hydrogen 3.100 N/A ARG 407.A NH2 GLU 129.A OE2 no hydrogen 2.492 N/A ARG 407.A NH2 ASP 438.A OD1 no hydrogen 3.142 N/A ARG 409.A N VAL 401.A O no hydrogen 2.813 N/A VAL 411.A N GLY 399.A O no hydrogen 3.124 N/A ALA 415.A N ASP 412.A O no hydrogen 3.367 N/A LYS 418.A NZ GLU 422.A OE1 no hydrogen 3.445 N/A LYS 418.A NZ GLU 422.A OE2 no hydrogen 3.045 N/A ARG 421.A N VAL 417.A O no hydrogen 2.789 N/A ARG 421.A NH1 ALA 415.A O no hydrogen 3.017 N/A GLU 422.A N LYS 418.A O no hydrogen 3.070 N/A ALA 423.A N SER 419.A O no hydrogen 2.993 N/A ALA 424.A N VAL 420.A O no hydrogen 3.151 N/A GLU 425.A N ARG 421.A O no hydrogen 3.019 N/A ARG 426.A N GLU 422.A O no hydrogen 3.171 N/A MET 427.A N ALA 423.A O no hydrogen 3.377 N/A ALA 428.A N GLU 425.A O no hydrogen 2.952 N/A PHE 429.A N GLU 425.A O no hydrogen 3.189 N/A MET 431.A N MET 427.A O no hydrogen 3.394 N/A GLN 433.A N ASN 430.A O no hydrogen 2.962 N/A GLY 434.A N MET 431.A O no hydrogen 2.682 N/A ALA 436.A N VAL 432.A O no hydrogen 3.395 N/A ALA 437.A N GLN 433.A O no hydrogen 3.121 N/A ASP 438.A N GLY 434.A O no hydrogen 2.853 N/A LEU 439.A N THR 435.A O no hydrogen 2.843 N/A MET 440.A N ALA 436.A O no hydrogen 3.047 N/A LYS 441.A N ALA 437.A O no hydrogen 3.006 N/A LYS 441.A NZ GLU 129.A OE1 no hydrogen 3.540 N/A LYS 441.A NZ GLU 129.A OE2 no hydrogen 2.949 N/A LYS 441.A NZ GLY 260.A O no hydrogen 2.862 N/A LEU 442.A N ASP 438.A O no hydrogen 2.964 N/A ALA 443.A N LEU 439.A O no hydrogen 2.914 N/A MET 444.A N MET 440.A O no hydrogen 2.978 N/A VAL 445.A N LYS 441.A O no hydrogen 3.144 N/A LYS 446.A N LEU 442.A O no hydrogen 3.108 N/A LYS 446.A NZ VAL 487.A O no hydrogen 2.528 N/A LEU 447.A N ALA 443.A O no hydrogen 2.900 N/A PHE 448.A N MET 444.A O no hydrogen 3.009 N/A ARG 449.A NE GLU 452.A OE1 no hydrogen 3.528 N/A LEU 450.A N PHE 448.A O no hydrogen 3.076 N/A MET 453.A N LEU 450.A O no hydrogen 3.089 N/A ALA 455.A N LEU 450.A O no hydrogen 2.779 N/A ARG 456.A N GLU 468.A O no hydrogen 2.834 N/A ARG 456.A NH1 GLU 286.A OE1.B no hydrogen 3.133 N/A ARG 456.A NH1 GLU 468.A OE1 no hydrogen 3.286 N/A ARG 456.A NH2 GLU 286.A OE1.B no hydrogen 3.435 N/A LEU 458.A N VAL 466.A O no hydrogen 2.899 N/A LEU 459.A N VAL 466.A O no hydrogen 3.140 N/A VAL 461.A N GLU 464.A O no hydrogen 2.616 N/A ASP 463.A N VAL 461.A O no hydrogen 2.532 N/A GLU 464.A N VAL 461.A O no hydrogen 3.044 N/A LEU 465.A N LEU 294.A O no hydrogen 2.816 N/A VAL 466.A N LEU 459.A O no hydrogen 2.852 N/A LEU 467.A N VAL 292.A O no hydrogen 2.654 N/A GLU 468.A N ARG 456.A O no hydrogen 2.943 N/A ALA 469.A N LEU 290.A O no hydrogen 3.020 N/A LYS 470.A NZ GLU 500.A OE1 no hydrogen 3.166 N/A VAL 476.A N ARG 472.A O no hydrogen 3.004 N/A ALA 477.A N ALA 473.A O no hydrogen 3.322 N/A ARG 478.A N GLU 474.A O no hydrogen 3.196 N/A LEU 479.A N ALA 475.A O no hydrogen 2.976 N/A ALA 480.A N VAL 476.A O no hydrogen 2.753 N/A LYS 481.A N ALA 477.A O no hydrogen 2.957 N/A LYS 481.A NZ GLU 485.A OE2 no hydrogen 2.437 N/A GLU 482.A N ARG 478.A O no hydrogen 3.322 N/A VAL 483.A N LEU 479.A O no hydrogen 3.004 N/A MET 484.A N ALA 480.A O no hydrogen 3.123 N/A GLU 485.A N LYS 481.A O no hydrogen 3.037 N/A GLY 486.A N GLU 482.A O no hydrogen 3.174 N/A ALA 490.A N HIS 306.A ND1 no hydrogen 3.057 N/A VAL 494.A N GLU 485.A OE2 no hydrogen 3.030 N/A GLU 495.A N ASP 295.A O no hydrogen 2.926 N/A GLY 497.A N ALA 293.A O no hydrogen 3.072 N/A GLY 499.A N LEU 291.A O no hydrogen 3.092 N/A TRP 502.A N PHE 283.A O no hydrogen 2.846 N/A TRP 502.A NE1 GLU 464.A OE2 no hydrogen 3.047 N/A SER 504.A N ASP 501.A OD1 no hydrogen 2.893 N/A SER 504.A OG ASP 501.A OD1 no hydrogen 3.161 N/A SER 504.A OG ASP 501.A OD2 no hydrogen 2.524 N/A ALA 505.A N ASP 501.A O no hydrogen 2.992 N/A ALA 505.A N TRP 502.A O no hydrogen 3.120 N/A LYS 506.A N LEU 503.A O no hydrogen 3.327 N/A LYS 506.A NZ GLU 464.A OE1 no hydrogen 3.336 N/A GLU 507.A N SER 504.A O no hydrogen 3.384 N/A