Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6cgl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 VAL 4.A O no hydrogen 3.494 N/A LYS 6.A NZ ASP 37.A OD2 no hydrogen 3.397 N/A GLN 9.A N PRO 5.A O no hydrogen 3.009 N/A LEU 10.A N LYS 6.A O no hydrogen 2.878 N/A ASN 11.A N TRP 7.A O no hydrogen 2.919 N/A ASN 11.A ND2 ASP 27.A OD2 no hydrogen 2.763 N/A ASN 11.A ND2 TYR 595.A O no hydrogen 3.163 N/A ASN 12.A N ILE 8.A O no hydrogen 2.837 N/A GLU 13.A N GLN 9.A O no hydrogen 3.099 N/A ILE 14.A N ASN 11.A O no hydrogen 3.317 N/A MET 15.A N ASN 12.A O no hydrogen 3.142 N/A GLN 23.A N ILE 14.A O no hydrogen 3.167 N/A PHE 24.A N PHE 22.A O no hydrogen 3.083 N/A LYS 26.A N GLN 23.A O no hydrogen 3.414 N/A LYS 26.A NZ GLU 13.A OE1 no hydrogen 3.261 N/A LYS 26.A NZ GLU 29.A OE1 no hydrogen 3.517 N/A LYS 28.A N ASP 25.A O no hydrogen 3.280 N/A ALA 30.A N LYS 26.A O no hydrogen 2.767 N/A VAL 31.A N ASP 27.A O no hydrogen 2.912 N/A HIS 32.A N LYS 28.A O no hydrogen 3.388 N/A SER 33.A N GLU 29.A O no hydrogen 3.007 N/A SER 33.A OG ASP 37.A OD2 no hydrogen 2.845 N/A TYR 34.A N ALA 30.A O no hydrogen 2.982 N/A PHE 35.A N VAL 31.A O no hydrogen 3.074 N/A VAL 36.A N HIS 32.A O no hydrogen 3.055 N/A ASP 37.A N SER 33.A O no hydrogen 2.837 N/A ILE 39.A N TYR 34.A O no hydrogen 2.927 N/A ASN 40.A N PHE 35.A O no hydrogen 2.799 N/A ASN 42.A N ILE 39.A O no hydrogen 3.276 N/A THR 43.A OG1 ILE 39.A O no hydrogen 2.721 N/A VAL 44.A N ILE 112.A O no hydrogen 2.904 N/A GLU 51.A N ASN 48.A OD1 no hydrogen 3.253 N/A LYS 52.A N ASN 48.A O no hydrogen 3.170 N/A LYS 52.A NZ ASP 118.A OD2 no hydrogen 2.670 N/A LEU 53.A N LEU 49.A O no hydrogen 3.075 N/A ASP 54.A N LYS 50.A O no hydrogen 3.192 N/A TYR 55.A N GLU 51.A O no hydrogen 3.013 N/A LEU 56.A N LYS 52.A O no hydrogen 3.190 N/A VAL 57.A N LEU 53.A O no hydrogen 2.764 N/A GLU 58.A N ASP 54.A O no hydrogen 3.076 N/A ASN 59.A N TYR 55.A O no hydrogen 2.939 N/A ASN 59.A ND2 TYR 55.A O no hydrogen 2.824 N/A GLN 60.A N VAL 57.A O no hydrogen 3.294 N/A GLN 60.A NE2 VAL 57.A O no hydrogen 3.339 N/A TYR 61.A N LEU 56.A O no hydrogen 2.893 N/A TYR 62.A N LEU 56.A O no hydrogen 3.134 N/A TYR 62.A OH GLU 114.A OE2 no hydrogen 2.665 N/A GLU 63.A N GLY 158.A O no hydrogen 2.691 N/A SER 68.A OG GLU 65.A O no hydrogen 2.661 N/A TYR 70.A N LEU 67.A O no hydrogen 3.046 N/A TYR 70.A OH LEU 125.A O no hydrogen 2.581 N/A SER 71.A OG ASP 74.A OD2 no hydrogen 3.174 N/A ILE 75.A N SER 71.A O no hydrogen 3.137 N/A LYS 76.A N PHE 72.A O no hydrogen 3.013 N/A GLU 77.A N GLU 73.A O no hydrogen 3.302 N/A VAL 78.A N ASP 74.A O no hydrogen 2.946 N/A PHE 79.A N ILE 75.A O no hydrogen 2.929 N/A LYS 80.A N LYS 76.A O no hydrogen 2.832 N/A THR 81.A N GLU 77.A O no hydrogen 3.022 N/A THR 81.A OG1 GLU 77.A O no hydrogen 2.636 N/A ALA 82.A N VAL 78.A O no hydrogen 3.426 N/A ALA 82.A N PHE 79.A O no hydrogen 3.093 N/A TYR 83.A N PHE 79.A O no hydrogen 3.219 N/A TYR 83.A OH ASP 118.A OD1 no hydrogen 2.779 N/A TYR 83.A OH ASP 118.A OD2 no hydrogen 3.116 N/A ALA 84.A N LYS 80.A O no hydrogen 2.952 N/A LYS 85.A NZ ASN 144.A OD1 no hydrogen 3.071 N/A LYS 86.A N TYR 83.A O no hydrogen 3.141 N/A ARG 88.A NH1 PHE 87.A O no hydrogen 2.706 N/A SER 91.A OG SER 94.A OG no hydrogen 2.424 N/A PHE 92.A N ASP 27.A OD2 no hydrogen 3.405 N/A SER 94.A OG SER 91.A OG no hydrogen 2.424 N/A SER 94.A OG TYR 569.A O no hydrogen 3.482 N/A SER 94.A OG SER 572.A OG no hydrogen 3.092 N/A ALA 95.A N SER 91.A O no hydrogen 3.500 N/A PHE 96.A N PHE 92.A O no hydrogen 2.847 N/A LYS 97.A N MET 93.A O no hydrogen 2.878 N/A LYS 97.A NZ ASP 101.A OD2 no hydrogen 3.349 N/A LYS 97.A NZ SER 566.A OG no hydrogen 3.390 N/A PHE 98.A N SER 94.A O no hydrogen 3.341 N/A TYR 99.A N ALA 95.A O no hydrogen 2.877 N/A ASN 100.A N PHE 96.A O no hydrogen 2.761 N/A ASN 100.A ND2 ASP 101.A OD1 no hydrogen 2.748 N/A ASP 101.A N LYS 97.A O no hydrogen 3.253 N/A TYR 102.A N PHE 98.A O no hydrogen 2.811 N/A TYR 102.A OH THR 151.A OG1 no hydrogen 2.683 N/A ALA 103.A N PHE 98.A O no hydrogen 2.881 N/A LEU 104.A N GLU 114.A OE1 no hydrogen 3.188 N/A LYS 105.A NZ TYR 99.A O no hydrogen 2.623 N/A LYS 105.A NZ ASN 100.A O no hydrogen 3.201 N/A LYS 105.A NZ ALA 103.A O no hydrogen 3.252 N/A THR 106.A N LYS 111.A O no hydrogen 3.021 N/A THR 106.A OG1 ASP 108.A O no hydrogen 2.711 N/A THR 106.A OG1 LYS 111.A O no hydrogen 3.480 N/A ASN 107.A N TYR 61.A OH no hydrogen 2.959 N/A LYS 111.A N THR 106.A OG1 no hydrogen 3.270 N/A LYS 111.A NZ ASN 42.A OD1 no hydrogen 2.823 N/A ILE 112.A N ASN 42.A O no hydrogen 2.712 N/A LEU 113.A N LEU 104.A O no hydrogen 2.996 N/A GLU 114.A N LEU 104.A O no hydrogen 3.456 N/A ARG 115.A N ASP 118.A OD2 no hydrogen 2.957 N/A ARG 115.A NH1 ASN 40.A OD1 no hydrogen 2.826 N/A ARG 115.A NH1 THR 43.A OG1 no hydrogen 3.213 N/A ARG 115.A NH2 ASN 40.A OD1 no hydrogen 2.879 N/A TYR 116.A N TYR 99.A OH no hydrogen 3.077 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.775 N/A ARG 119.A N ARG 115.A O no hydrogen 3.193 N/A ILE 120.A N TYR 116.A O no hydrogen 3.394 N/A SER 121.A N GLU 117.A O no hydrogen 2.981 N/A SER 121.A OG GLU 117.A O no hydrogen 2.718 N/A ILE 122.A N ASP 118.A O no hydrogen 3.028 N/A VAL 123.A N ARG 119.A O no hydrogen 2.933 N/A ALA 124.A N ILE 120.A O no hydrogen 2.812 N/A LEU 125.A N SER 121.A O no hydrogen 2.796 N/A PHE 126.A N ILE 122.A O no hydrogen 2.905 N/A PHE 127.A N VAL 123.A O no hydrogen 3.024 N/A ALA 128.A N ALA 124.A O no hydrogen 3.223 N/A GLY 130.A N TYR 70.A OH no hydrogen 3.133 N/A ASP 131.A N ALA 128.A O no hydrogen 3.381 N/A LYS 134.A N ASP 131.A OD1 no hydrogen 3.118 N/A ALA 135.A N ASP 131.A O no hydrogen 3.128 N/A LYS 136.A N THR 132.A O no hydrogen 3.183 N/A LYS 136.A NZ GLU 133.A OE2 no hydrogen 3.295 N/A GLU 137.A N GLU 133.A O no hydrogen 3.325 N/A TYR 138.A N LYS 134.A O no hydrogen 2.955 N/A VAL 139.A N ALA 135.A O no hydrogen 2.859 N/A ASN 140.A N LYS 136.A O no hydrogen 3.043 N/A LEU 141.A N GLU 137.A O no hydrogen 2.823 N/A MET 142.A N TYR 138.A O no hydrogen 3.024 N/A ILE 143.A N VAL 139.A O no hydrogen 2.734 N/A ASN 144.A N ASN 140.A O no hydrogen 3.177 N/A ASN 144.A ND2 ASN 140.A O no hydrogen 2.695 N/A GLN 145.A N MET 142.A O no hydrogen 3.323 N/A GLU 146.A N LEU 141.A O no hydrogen 2.932 N/A TYR 147.A N LEU 141.A O no hydrogen 3.308 N/A GLN 148.A N SER 396.A O no hydrogen 3.088 N/A GLN 148.A NE2 PRO 149.A O no hydrogen 3.048 N/A SER 150.A N LEU 394.A O no hydrogen 3.456 N/A SER 150.A OG LEU 394.A O no hydrogen 3.255 N/A THR 151.A OG1 TYR 102.A OH no hydrogen 2.683 N/A PHE 154.A N SER 150.A O no hydrogen 2.795 N/A LEU 155.A N THR 151.A O no hydrogen 2.946 N/A ASN 156.A N PRO 152.A O no hydrogen 3.289 N/A ASN 156.A ND2 PRO 152.A O no hydrogen 3.052 N/A ALA 157.A N THR 153.A O no hydrogen 3.225 N/A ARG 159.A N ASN 156.A O no hydrogen 2.983 N/A LYS 160.A N TYR 61.A O no hydrogen 3.342 N/A VAL 163.A N GLU 161.A O no hydrogen 2.634 N/A PHE 166.A N GLY 193.A O no hydrogen 2.817 N/A LEU 167.A N ILE 390.A O no hydrogen 2.760 N/A LEU 168.A N SER 195.A O no hydrogen 2.811 N/A ASN 171.A ND2 SER 375.A O no hydrogen 3.078 N/A ASP 172.A N ASN 171.A OD1 no hydrogen 2.744 N/A SER 173.A OG ASP 176.A OD2 no hydrogen 3.172 N/A ILE 177.A N SER 173.A O no hydrogen 2.998 N/A SER 178.A N LEU 174.A O no hydrogen 2.894 N/A ARG 179.A N ASN 175.A O no hydrogen 3.006 N/A ALA 180.A N ASP 176.A O no hydrogen 2.876 N/A ILE 181.A N ILE 177.A O no hydrogen 2.935 N/A ASP 182.A N SER 178.A O no hydrogen 3.110 N/A ILE 183.A N ARG 179.A O no hydrogen 2.755 N/A SER 184.A N ALA 180.A O no hydrogen 3.132 N/A SER 184.A OG ALA 180.A O no hydrogen 2.687 N/A MET 185.A N ILE 181.A O no hydrogen 3.192 N/A GLN 186.A N ASP 182.A O no hydrogen 3.378 N/A LEU 187.A N ILE 183.A O no hydrogen 3.095 N/A SER 188.A N SER 184.A O no hydrogen 2.931 N/A SER 188.A OG GLY 228.A O no hydrogen 3.453 N/A LYS 189.A N MET 185.A O no hydrogen 3.482 N/A LEU 190.A N GLN 186.A O no hydrogen 3.380 N/A GLY 193.A N SER 164.A OG no hydrogen 3.327 N/A SER 195.A N PHE 166.A O no hydrogen 3.103 N/A SER 195.A OG SER 362.A O no hydrogen 2.726 N/A LEU 196.A N ALA 231.A O no hydrogen 2.861 N/A ASN 197.A N LEU 168.A O no hydrogen 3.251 N/A ASN 197.A ND2 GLU 169.A OE2 no hydrogen 2.860 N/A ASN 197.A ND2 ASP 298.A OD2 no hydrogen 2.928 N/A LEU 198.A N TYR 233.A O no hydrogen 3.024 N/A SER 199.A N ASN 197.A OD1 no hydrogen 3.494 N/A SER 199.A OG ASN 197.A OD1 no hydrogen 3.146 N/A LYS 200.A NZ GLU 169.A OE2 no hydrogen 3.233 N/A LYS 200.A NZ ASP 298.A OD2 no hydrogen 3.423 N/A LYS 200.A NZ GLU 299.A OE2 no hydrogen 2.870 N/A LEU 201.A N LEU 198.A O no hydrogen 3.129 N/A ARG 202.A N ASP 172.A OD1 no hydrogen 3.117 N/A ARG 202.A NE ASP 172.A OD1 no hydrogen 3.283 N/A ARG 202.A NE ASP 172.A OD2 no hydrogen 2.865 N/A ALA 203.A N GLU 206.A OE2 no hydrogen 3.092 N/A LYS 204.A N ASP 240.A OD1 no hydrogen 3.388 N/A LYS 204.A NZ ASP 243.A OD2 no hydrogen 3.120 N/A VAL 211.A N ASP 240.A OD2 no hydrogen 3.223 N/A MET 215.A N VAL 211.A O no hydrogen 3.053 N/A LYS 216.A N VAL 212.A O no hydrogen 2.814 N/A LEU 217.A N GLY 213.A O no hydrogen 3.200 N/A LEU 218.A N VAL 214.A O no hydrogen 2.840 N/A ASP 219.A N MET 215.A O no hydrogen 3.022 N/A ASN 220.A N LYS 216.A O no hydrogen 2.928 N/A ALA 221.A N LEU 217.A O no hydrogen 3.057 N/A PHE 222.A N LEU 218.A O no hydrogen 2.822 N/A ARG 223.A N ASP 219.A O no hydrogen 3.062 N/A TYR 224.A N ASN 220.A O no hydrogen 2.962 N/A ALA 231.A N VAL 194.A O no hydrogen 2.807 N/A ALA 232.A N SER 262.A O no hydrogen 3.048 N/A TYR 233.A N LEU 196.A O no hydrogen 2.839 N/A TYR 233.A OH ASN 363.A O no hydrogen 2.918 N/A LEU 234.A N GLY 264.A O no hydrogen 3.190 N/A ASN 235.A N SER 199.A OG no hydrogen 3.014 N/A ILE 236.A N VAL 266.A O no hydrogen 2.995 N/A PHE 237.A N ASN 235.A OD1 no hydrogen 2.983 N/A HIS 238.A N ASN 235.A O no hydrogen 3.094 N/A HIS 238.A NE2 LEU 201.A O no hydrogen 2.818 N/A ARG 239.A NE TYR 285.A OH no hydrogen 3.072 N/A ARG 239.A NH1 ARG 239.A O no hydrogen 3.006 N/A ILE 241.A N HIS 238.A O no hydrogen 3.357 N/A PHE 244.A N ASP 240.A O no hydrogen 2.760 N/A LEU 245.A N ILE 241.A O no hydrogen 3.002 N/A ASP 246.A N ASN 242.A O no hydrogen 2.866 N/A THR 247.A OG1 PHE 244.A O no hydrogen 2.652 N/A LYS 248.A N LEU 245.A O no hydrogen 3.373 N/A LYS 249.A N ASP 246.A O no hydrogen 3.310 N/A ARG 257.A N ASP 253.A O no hydrogen 3.189 N/A ARG 257.A NH2 ILE 250.A O no hydrogen 3.493 N/A LYS 259.A N ASP 219.A OD2 no hydrogen 3.464 N/A THR 260.A N ASP 219.A OD1 no hydrogen 2.905 N/A THR 260.A OG1 ASP 219.A OD1 no hydrogen 2.902 N/A SER 262.A N GLY 230.A O no hydrogen 3.278 N/A GLY 264.A N ALA 232.A O no hydrogen 3.033 N/A VAL 265.A N TYR 340.A O no hydrogen 2.711 N/A VAL 266.A N LEU 234.A O no hydrogen 3.065 N/A ILE 267.A N MET 342.A O no hydrogen 2.709 N/A ASP 269.A N ASP 345.A OD1 no hydrogen 2.762 N/A LYS 270.A NZ GLU 273.A OE2 no hydrogen 3.485 N/A PHE 271.A N PRO 268.A O no hydrogen 3.133 N/A GLU 273.A N ASP 269.A O no hydrogen 2.929 N/A LEU 274.A N LYS 270.A O no hydrogen 3.162 N/A ALA 275.A N PHE 271.A O no hydrogen 3.295 N/A ARG 276.A N VAL 272.A O no hydrogen 2.878 N/A GLU 277.A N GLU 273.A O no hydrogen 3.208 N/A ASP 278.A N ALA 275.A O no hydrogen 3.234 N/A LYS 279.A N LEU 274.A O no hydrogen 3.137 N/A ALA 281.A N ILE 320.A O no hydrogen 2.764 N/A VAL 283.A N GLU 318.A O no hydrogen 2.945 N/A PHE 284.A N PHE 237.A O no hydrogen 2.798 N/A TYR 285.A N LYS 316.A O no hydrogen 3.195 N/A THR 288.A N TYR 285.A O no hydrogen 3.074 N/A THR 288.A OG1 TYR 285.A O no hydrogen 2.604 N/A TYR 290.A N PRO 286.A O no hydrogen 3.040 N/A LYS 291.A N HIS 287.A O no hydrogen 3.032 N/A GLU 292.A N THR 288.A O no hydrogen 3.357 N/A TYR 293.A N ILE 289.A O no hydrogen 2.728 N/A TYR 293.A OH LYS 308.A O no hydrogen 3.308 N/A GLY 294.A N TYR 290.A O no hydrogen 2.928 N/A GLU 299.A N HIS 296.A O no hydrogen 3.258 N/A MET 300.A N MET 297.A O no hydrogen 3.302 N/A ASN 303.A ND2 ASP 345.A OD1 no hydrogen 3.239 N/A GLU 304.A N ASP 301.A OD1 no hydrogen 2.767 N/A MET 305.A N ASP 301.A O no hydrogen 3.045 N/A TYR 306.A N MET 302.A O no hydrogen 2.992 N/A PHE 309.A N MET 305.A O no hydrogen 2.895 N/A VAL 310.A N TYR 306.A O no hydrogen 3.109 N/A ASP 311.A N ASP 307.A O no hydrogen 3.058 N/A ASN 312.A N LYS 308.A O no hydrogen 3.240 N/A ASN 312.A ND2 GLU 292.A OE2 no hydrogen 3.272 N/A ASN 312.A ND2 TYR 293.A OH no hydrogen 3.542 N/A ARG 314.A N ASN 312.A OD1 no hydrogen 2.746 N/A LYS 316.A N THR 288.A OG1 no hydrogen 3.176 N/A LYS 317.A NZ PHE 309.A O no hydrogen 3.199 N/A LYS 317.A NZ VAL 310.A O no hydrogen 3.025 N/A LYS 317.A NZ VAL 315.A O no hydrogen 2.981 N/A LYS 319.A NZ TYR 282.A OH no hydrogen 3.256 N/A ILE 320.A N ALA 281.A O no hydrogen 2.802 N/A ARG 323.A NE ALA 275.A O no hydrogen 2.738 N/A ARG 323.A NH2 ALA 275.A O no hydrogen 3.150 N/A ARG 323.A NH2 ARG 276.A O no hydrogen 3.225 N/A LYS 324.A N ASN 321.A OD1 no hydrogen 3.422 N/A LEU 325.A N ASN 321.A O no hydrogen 3.142 N/A LEU 326.A N PRO 322.A O no hydrogen 2.926 N/A GLU 327.A N ARG 323.A O no hydrogen 3.247 N/A LYS 328.A N LYS 324.A O no hydrogen 3.092 N/A LYS 328.A NZ ASN 242.A OD1 no hydrogen 3.173 N/A LYS 328.A NZ ASP 246.A OD1 no hydrogen 2.694 N/A LEU 329.A N LEU 325.A O no hydrogen 3.172 N/A ALA 330.A N LEU 326.A O no hydrogen 3.178 N/A MET 331.A N GLU 327.A O no hydrogen 2.843 N/A LEU 332.A N LYS 328.A O no hydrogen 3.103 N/A ARG 333.A N LEU 329.A O no hydrogen 2.824 N/A ARG 333.A NE PRO 339.A O no hydrogen 3.136 N/A ARG 333.A NH2 TYR 666.A O no hydrogen 2.878 N/A SER 334.A N ALA 330.A O no hydrogen 2.934 N/A GLU 335.A N MET 331.A O no hydrogen 2.806 N/A SER 336.A N LEU 332.A O no hydrogen 2.818 N/A SER 336.A OG LEU 332.A O no hydrogen 2.706 N/A GLY 337.A N LEU 332.A O no hydrogen 3.322 N/A TYR 338.A N SER 336.A OG no hydrogen 3.140 N/A TYR 340.A N ILE 263.A O no hydrogen 2.923 N/A ILE 341.A N ILE 665.A O no hydrogen 3.041 N/A MET 342.A N VAL 265.A O no hydrogen 2.868 N/A PHE 343.A N LYS 663.A O no hydrogen 3.147 N/A GLN 344.A N ILE 267.A O no hydrogen 3.053 N/A ASN 346.A N PHE 343.A O no hydrogen 2.963 N/A ASN 346.A ND2 HIS 658.A O no hydrogen 2.870 N/A ASN 346.A ND2 ILE 662.A O no hydrogen 3.112 N/A VAL 347.A N PHE 343.A O no hydrogen 3.300 N/A ASN 348.A N GLN 344.A O no hydrogen 3.058 N/A ASN 348.A ND2 VAL 359.A O no hydrogen 3.289 N/A LYS 349.A N ASP 345.A O no hydrogen 3.076 N/A HIS 351.A N ASN 348.A O no hydrogen 3.432 N/A HIS 351.A ND1 ASN 354.A OD1 no hydrogen 3.037 N/A HIS 351.A NE2 TYR 557.A OH no hydrogen 2.662 N/A ASN 353.A ND2 SER 556.A O no hydrogen 3.618 N/A ASN 354.A ND2 ASN 348.A O no hydrogen 2.949 N/A ILE 356.A N ASN 353.A O no hydrogen 3.226 N/A SER 357.A N ASN 353.A O no hydrogen 3.300 N/A SER 357.A OG LYS 358.A O no hydrogen 2.646 N/A SER 357.A OG SER 372.A O no hydrogen 3.000 N/A VAL 359.A N ASN 348.A OD1 no hydrogen 2.792 N/A LYS 360.A NZ GLU 299.A OE1 no hydrogen 3.375 N/A LYS 360.A NZ GLU 299.A OE2 no hydrogen 3.347 N/A LYS 360.A NZ LYS 358.A O no hydrogen 3.225 N/A LYS 360.A NZ SER 372.A O no hydrogen 2.803 N/A SER 362.A OG ASN 363.A OD1 no hydrogen 3.503 N/A SER 362.A OG VAL 368.A O no hydrogen 2.709 N/A ASN 363.A N SER 362.A OG no hydrogen 2.774 N/A CYS 365.A SG TYR 666.A OH no hydrogen 3.714 N/A SER 366.A N ASN 363.A O no hydrogen 3.116 N/A SER 366.A OG CYS 365.A O no hydrogen 2.722 N/A GLU 367.A N ASN 363.A OD1 no hydrogen 2.933 N/A VAL 368.A N ASN 363.A OD1 no hydrogen 2.964 N/A LEU 369.A N GLN 633.A OE1 no hydrogen 3.298 N/A GLN 370.A NE2 GLN 633.A OE1 no hydrogen 3.270 N/A ALA 371.A N TYR 557.A OH no hydrogen 2.982 N/A SER 372.A N SER 357.A OG no hydrogen 3.236 N/A SER 372.A OG GLU 169.A OE1 no hydrogen 3.104 N/A GLN 373.A N LEU 388.A O no hydrogen 2.896 N/A GLN 373.A NE2 ILE 356.A O no hydrogen 3.620 N/A SER 376.A N GLU 385.A O no hydrogen 2.914 N/A TYR 377.A N ASP 176.A OD1 no hydrogen 3.060 N/A THR 378.A N ASP 384.A OD2 no hydrogen 2.758 N/A THR 378.A OG1 TYR 380.A O no hydrogen 2.688 N/A THR 378.A OG1 ASP 384.A OD2 no hydrogen 3.024 N/A GLU 383.A N TYR 380.A O no hydrogen 3.033 N/A ASP 384.A N ASP 381.A O no hydrogen 3.468 N/A GLU 385.A N SER 376.A O no hydrogen 3.231 N/A GLY 387.A N SER 375.A OG no hydrogen 3.235 N/A LEU 388.A N GLN 373.A O no hydrogen 3.035 N/A ASP 389.A N ALA 433.A O no hydrogen 3.414 N/A ILE 390.A N LEU 167.A O no hydrogen 3.052 N/A CYS 392.A N CYS 165.A O no hydrogen 3.346 N/A CYS 392.A SG ASN 393.A O no hydrogen 3.963 N/A ASN 393.A ND2 LEU 419.A O no hydrogen 3.389 N/A GLY 395.A N GLY 445.A O no hydrogen 3.291 N/A SER 396.A N GLN 148.A O no hydrogen 3.015 N/A LEU 397.A N GLY 447.A O no hydrogen 3.043 N/A ASN 398.A N GLU 146.A O no hydrogen 2.881 N/A ASN 398.A ND2 GLN 571.A OE1 no hydrogen 2.989 N/A ILE 399.A N MET 449.A O no hydrogen 3.048 N/A ASN 401.A N ASN 398.A OD1 no hydrogen 3.169 N/A ASN 401.A ND2 GLN 145.A O no hydrogen 2.730 N/A VAL 402.A N ASN 398.A O no hydrogen 2.874 N/A MET 403.A N ILE 399.A O no hydrogen 3.096 N/A GLU 404.A N LEU 400.A O no hydrogen 3.224 N/A HIS 405.A N ASN 401.A O no hydrogen 3.070 N/A LYS 406.A N MET 403.A O no hydrogen 3.231 N/A SER 407.A N VAL 402.A O no hydrogen 2.990 N/A SER 407.A OG GLU 146.A OE2 no hydrogen 2.598 N/A SER 407.A OG THR 411.A OG1 no hydrogen 2.961 N/A THR 411.A N SER 407.A O no hydrogen 3.018 N/A THR 411.A OG1 SER 407.A O no hydrogen 2.615 N/A THR 411.A OG1 SER 407.A OG no hydrogen 2.961 N/A LYS 413.A N GLU 409.A O no hydrogen 3.144 N/A LYS 413.A NZ GLU 409.A OE2 no hydrogen 3.127 N/A LYS 413.A NZ GLN 484.A OE1 no hydrogen 2.694 N/A LYS 413.A NZ GLU 488.A OE1 no hydrogen 3.537 N/A LYS 413.A NZ GLU 488.A OE2 no hydrogen 3.315 N/A LEU 414.A N LYS 410.A O no hydrogen 2.974 N/A ALA 415.A N THR 411.A O no hydrogen 3.188 N/A THR 416.A N VAL 412.A O no hydrogen 2.841 N/A THR 416.A OG1 VAL 412.A O no hydrogen 2.708 N/A ASP 417.A N LYS 413.A O no hydrogen 2.798 N/A SER 418.A N LEU 414.A O no hydrogen 2.787 N/A SER 418.A OG LEU 414.A O no hydrogen 3.564 N/A SER 418.A OG ALA 415.A O no hydrogen 2.789 N/A LEU 419.A N ALA 415.A O no hydrogen 2.857 N/A THR 420.A N THR 416.A O no hydrogen 2.987 N/A THR 420.A OG1 THR 416.A O no hydrogen 2.515 N/A THR 420.A OG1 HIS 555.A NE2 no hydrogen 3.095 N/A HIS 421.A N ASP 417.A O no hydrogen 3.004 N/A VAL 422.A N SER 418.A O no hydrogen 3.059 N/A SER 423.A N LEU 419.A O no hydrogen 3.002 N/A GLU 424.A N THR 420.A O no hydrogen 2.852 N/A THR 425.A N HIS 421.A O no hydrogen 2.920 N/A THR 425.A OG1 HIS 421.A O no hydrogen 2.896 N/A THR 425.A OG1 VAL 422.A O no hydrogen 3.179 N/A THR 426.A OG1 VAL 422.A O no hydrogen 2.547 N/A THR 426.A OG1 SER 423.A O no hydrogen 3.274 N/A ARG 435.A N ALA 431.A O no hydrogen 2.924 N/A ARG 436.A N PRO 432.A O no hydrogen 2.954 N/A ARG 436.A NH1 GLY 387.A O no hydrogen 2.979 N/A ALA 437.A N ALA 433.A O no hydrogen 3.142 N/A ASN 438.A N VAL 434.A O no hydrogen 3.228 N/A ASN 438.A ND2 SER 423.A O no hydrogen 3.410 N/A ASN 438.A ND2 SER 423.A OG no hydrogen 3.251 N/A LYS 439.A N ARG 435.A O no hydrogen 3.250 N/A ALA 440.A N ARG 436.A O no hydrogen 2.955 N/A MET 441.A N ALA 437.A O no hydrogen 2.766 N/A LYS 442.A NZ LYS 439.A O no hydrogen 2.755 N/A LYS 442.A NZ THR 496.A O no hydrogen 3.526 N/A SER 443.A OG GLN 370.A OE1 no hydrogen 3.444 N/A ILE 444.A N TYR 557.A O no hydrogen 3.164 N/A GLY 445.A N ASN 393.A O no hydrogen 3.062 N/A LEU 446.A N ARG 558.A O no hydrogen 2.872 N/A GLY 447.A N GLY 395.A O no hydrogen 2.699 N/A MET 449.A N LEU 397.A O no hydrogen 2.848 N/A ASN 450.A N THR 574.A O no hydrogen 2.983 N/A ASN 450.A ND2 ASN 398.A OD1 no hydrogen 3.216 N/A HIS 452.A NE2 PHE 608.A O no hydrogen 2.796 N/A GLY 453.A N THR 574.A OG1 no hydrogen 3.271 N/A TYR 454.A N ASN 450.A O no hydrogen 3.204 N/A LEU 455.A N LEU 451.A O no hydrogen 3.075 N/A ALA 456.A N HIS 452.A O no hydrogen 2.649 N/A GLN 457.A N GLY 453.A O no hydrogen 3.254 N/A ASN 458.A N TYR 454.A O no hydrogen 3.165 N/A ASN 458.A N LEU 455.A O no hydrogen 3.218 N/A ASN 458.A ND2 TYR 454.A O no hydrogen 2.722 N/A GLY 459.A N ALA 456.A O no hydrogen 3.455 N/A ILE 460.A N LEU 455.A O no hydrogen 2.867 N/A TYR 462.A OH VAL 577.A O no hydrogen 2.753 N/A SER 464.A N ALA 461.A O no hydrogen 3.253 N/A SER 464.A OG ALA 461.A O no hydrogen 2.713 N/A SER 464.A OG GLU 466.A OE1 no hydrogen 3.545 N/A GLU 466.A N GLU 466.A OE1 no hydrogen 2.817 N/A ALA 467.A N SER 464.A OG no hydrogen 3.408 N/A ARG 468.A N SER 464.A O no hydrogen 3.503 N/A ASP 469.A N PRO 465.A O no hydrogen 3.240 N/A PHE 470.A N GLU 466.A O no hydrogen 3.012 N/A ALA 471.A N ALA 467.A O no hydrogen 3.146 N/A ASN 472.A N ARG 468.A O no hydrogen 3.040 N/A THR 473.A N ASP 469.A O no hydrogen 3.354 N/A THR 473.A OG1 ASP 469.A O no hydrogen 3.416 N/A THR 473.A OG1 PHE 519.A O no hydrogen 2.970 N/A PHE 474.A N PHE 470.A O no hydrogen 2.804 N/A PHE 475.A N ALA 471.A O no hydrogen 3.018 N/A MET 476.A N ASN 472.A O no hydrogen 3.207 N/A MET 477.A N THR 473.A O no hydrogen 3.210 N/A VAL 478.A N PHE 474.A O no hydrogen 3.151 N/A ASN 479.A N PHE 475.A O no hydrogen 3.151 N/A ASN 479.A ND2 TYR 510.A OH no hydrogen 3.197 N/A ASN 479.A ND2 TYR 514.A OH no hydrogen 3.133 N/A PHE 480.A N MET 476.A O no hydrogen 2.934 N/A TYR 481.A N MET 477.A O no hydrogen 3.035 N/A TYR 481.A OH HIS 534.A O no hydrogen 3.385 N/A SER 482.A N VAL 478.A O no hydrogen 3.033 N/A ILE 483.A N ASN 479.A O no hydrogen 3.043 N/A GLN 484.A N PHE 480.A O no hydrogen 2.897 N/A ARG 485.A N TYR 481.A O no hydrogen 3.055 N/A SER 486.A N SER 482.A O no hydrogen 2.966 N/A ALA 487.A N ILE 483.A O no hydrogen 3.032 N/A GLU 488.A N GLN 484.A O no hydrogen 2.965 N/A ILE 489.A N ARG 485.A O no hydrogen 2.738 N/A ALA 490.A N SER 486.A O no hydrogen 3.047 N/A LYS 491.A N ALA 487.A O no hydrogen 2.833 N/A GLU 492.A N GLU 488.A O no hydrogen 2.982 N/A LYS 493.A N ILE 489.A O no hydrogen 2.877 N/A LYS 493.A NZ GLU 424.A OE1 no hydrogen 3.282 N/A LYS 493.A NZ GLU 424.A OE2 no hydrogen 3.396 N/A THR 496.A OG1 PHE 497.A O no hydrogen 3.556 N/A PHE 497.A N MET 553.A O no hydrogen 3.034 N/A ASP 498.A N ALA 440.A O no hydrogen 2.953 N/A TYR 500.A N PHE 497.A O no hydrogen 2.992 N/A GLU 501.A N GLU 501.A OE1 no hydrogen 3.131 N/A GLY 502.A N GLN 499.A O no hydrogen 3.190 N/A SER 503.A N TYR 500.A O no hydrogen 2.962 N/A SER 503.A OG TYR 500.A O no hydrogen 2.874 N/A THR 504.A N ALA 352.A O no hydrogen 3.288 N/A THR 507.A N SER 503.A O no hydrogen 2.999 N/A GLY 508.A N THR 504.A O no hydrogen 3.039 N/A TYR 510.A N THR 504.A O no hydrogen 3.050 N/A PHE 511.A N GLY 508.A O no hydrogen 3.365 N/A LYS 513.A NZ GLN 629.A O no hydrogen 3.162 N/A TYR 514.A OH HIS 630.A ND1 no hydrogen 2.880 N/A VAL 515.A N PHE 511.A O no hydrogen 2.784 N/A SER 516.A N ASP 512.A O no hydrogen 3.006 N/A SER 516.A OG ASP 512.A O no hydrogen 3.125 N/A SER 516.A OG LYS 513.A O no hydrogen 3.137 N/A THR 517.A N LYS 513.A O no hydrogen 2.882 N/A THR 517.A OG1 LYS 513.A O no hydrogen 2.883 N/A SER 520.A OG ASP 518.A OD1 no hydrogen 3.126 N/A SER 520.A OG ASP 518.A OD2 no hydrogen 2.676 N/A LYS 522.A N ASP 469.A OD1 no hydrogen 3.163 N/A TYR 523.A N ASP 469.A OD2 no hydrogen 3.305 N/A ILE 526.A N TYR 523.A O no hydrogen 3.340 N/A ALA 527.A N TYR 523.A O no hydrogen 3.262 N/A ASN 528.A N GLU 524.A O no hydrogen 3.350 N/A LEU 529.A N ILE 526.A O no hydrogen 3.180 N/A GLU 531.A N ASN 528.A O no hydrogen 3.235 N/A MET 533.A N PHE 530.A O no hydrogen 3.101 N/A HIS 534.A NE2 ASP 540.A OD2 no hydrogen 2.836 N/A THR 537.A N ASP 540.A OD2 no hydrogen 2.984 N/A THR 537.A OG1 ASP 540.A OD2 no hydrogen 3.118 N/A TRP 541.A N THR 537.A O no hydrogen 3.228 N/A LYS 542.A N THR 538.A O no hydrogen 2.987 N/A LYS 543.A N GLU 539.A O no hydrogen 3.227 N/A LYS 543.A NZ GLU 539.A OE2 no hydrogen 3.452 N/A LEU 544.A N ASP 540.A O no hydrogen 2.853 N/A LYS 545.A N TRP 541.A O no hydrogen 2.875 N/A LYS 545.A NZ GLY 508.A O no hydrogen 3.533 N/A ALA 546.A N LYS 542.A O no hydrogen 3.217 N/A PHE 547.A N LYS 543.A O no hydrogen 2.827 N/A VAL 548.A N LEU 544.A O no hydrogen 3.014 N/A ALA 549.A N LYS 545.A O no hydrogen 2.942 N/A GLU 550.A N ALA 546.A O no hydrogen 3.152 N/A HIS 551.A N PHE 547.A O no hydrogen 3.024 N/A GLY 552.A N VAL 548.A O no hydrogen 2.706 N/A TYR 554.A N SER 486.A O no hydrogen 3.194 N/A HIS 555.A N SER 486.A OG no hydrogen 3.089 N/A HIS 555.A ND1 LYS 442.A O no hydrogen 2.921 N/A SER 556.A N MET 441.A O no hydrogen 3.178 N/A SER 556.A OG MET 441.A O no hydrogen 2.669 N/A TYR 557.A OH HIS 351.A NE2 no hydrogen 2.662 N/A ARG 558.A N ASP 632.A OD2 no hydrogen 3.399 N/A ARG 558.A NH1 ASN 479.A OD1 no hydrogen 2.760 N/A ARG 558.A NH2 ASN 479.A OD1 no hydrogen 3.282 N/A ARG 558.A NH2 TYR 505.A OH no hydrogen 2.993 N/A ARG 558.A NH2 TYR 510.A OH no hydrogen 3.264 N/A LEU 559.A N ASP 632.A OD1 no hydrogen 3.062 N/A CYS 560.A N LEU 446.A O no hydrogen 3.316 N/A CYS 560.A SG GLU 367.A OE1 no hydrogen 3.637 N/A ILE 561.A N GLY 634.A O no hydrogen 3.259 N/A THR 564.A OG1 PRO 563.A O no hydrogen 2.724 N/A SER 568.A OG THR 564.A O no hydrogen 3.101 N/A SER 568.A OG GLY 565.A O no hydrogen 3.091 N/A TYR 569.A N SER 566.A O no hydrogen 2.871 N/A TYR 569.A OH GLU 585.A OE1 no hydrogen 2.737 N/A GLN 571.A N ILE 567.A O no hydrogen 3.083 N/A GLN 571.A NE2 GLN 148.A OE1 no hydrogen 2.829 N/A SER 572.A N TYR 569.A O no hydrogen 3.148 N/A SER 572.A OG SER 94.A OG no hydrogen 3.092 N/A SER 573.A N SER 568.A O no hydrogen 2.953 N/A SER 573.A OG SER 568.A O no hydrogen 3.054 N/A THR 574.A N ASN 450.A OD1 no hydrogen 3.283 N/A SER 576.A OG ALA 562.A O no hydrogen 2.996 N/A VAL 577.A N SER 576.A OG no hydrogen 2.595 N/A ARG 583.A NE TRP 606.A O no hydrogen 2.768 N/A ARG 583.A NH1 GLU 611.A OE2 no hydrogen 3.431 N/A ARG 583.A NH2 TRP 606.A O no hydrogen 2.848 N/A GLU 585.A N TYR 596.A O no hydrogen 3.022 N/A ARG 587.A N THR 594.A O no hydrogen 2.954 N/A ARG 587.A NH1 GLU 582.A OE1 no hydrogen 3.282 N/A ARG 587.A NH1 GLU 586.A O no hydrogen 3.033 N/A ARG 587.A NH2 GLU 582.A OE1 no hydrogen 3.108 N/A TYR 589.A N SER 592.A O no hydrogen 3.076 N/A GLY 590.A N SER 592.A O no hydrogen 3.478 N/A THR 594.A N ARG 587.A O no hydrogen 2.860 N/A THR 594.A OG1 ARG 587.A O no hydrogen 3.294 N/A TYR 595.A N ASN 11.A OD1 no hydrogen 2.664 N/A TYR 595.A OH GLU 586.A OE1 no hydrogen 2.721 N/A TYR 596.A N GLU 585.A O no hydrogen 3.129 N/A MET 598.A N ARG 583.A O no hydrogen 3.040 N/A LEU 601.A N MET 598.A O no hydrogen 3.108 N/A ALA 602.A N ASN 605.A OD1 no hydrogen 2.765 N/A ASN 605.A N ALA 602.A O no hydrogen 3.332 N/A ASN 605.A ND2 GLY 600.A O no hydrogen 2.785 N/A TYR 609.A N ASN 605.A O no hydrogen 3.053 N/A LYS 610.A NZ GLU 463.A OE2 no hydrogen 2.768 N/A ALA 612.A N ILE 580.A O no hydrogen 2.631 N/A ASP 614.A N GLU 611.A O no hydrogen 3.000 N/A MET 615.A N ALA 612.A O no hydrogen 3.199 N/A ASP 616.A N GLU 463.A OE1 no hydrogen 3.312 N/A VAL 620.A N ASP 616.A O no hydrogen 3.123 N/A VAL 621.A N MET 617.A O no hydrogen 2.871 N/A ASP 622.A N PHE 618.A O no hydrogen 3.040 N/A MET 623.A N LYS 619.A O no hydrogen 3.311 N/A ILE 624.A N VAL 620.A O no hydrogen 3.199 N/A ALA 625.A N VAL 621.A O no hydrogen 2.915 N/A THR 626.A N ASP 622.A O no hydrogen 3.167 N/A THR 626.A OG1 ASP 622.A O no hydrogen 3.286 N/A THR 626.A OG1 MET 623.A O no hydrogen 2.834 N/A ILE 627.A N MET 623.A O no hydrogen 3.059 N/A GLN 628.A N ILE 624.A O no hydrogen 2.731 N/A GLN 629.A N ALA 625.A O no hydrogen 3.378 N/A HIS 630.A N ILE 627.A O no hydrogen 3.160 N/A HIS 630.A ND1 TYR 514.A OH no hydrogen 2.880 N/A HIS 630.A NE2 ASN 472.A OD1 no hydrogen 2.913 N/A ILE 631.A N GLN 628.A O no hydrogen 3.173 N/A GLN 633.A N LEU 559.A O no hydrogen 3.289 N/A GLY 634.A N GLU 367.A O no hydrogen 2.883 N/A SER 636.A N ILE 561.A O no hydrogen 3.311 N/A SER 636.A OG CYS 365.A O no hydrogen 2.649 N/A LEU 641.A N ARG 669.A O no hydrogen 2.703 N/A ASP 643.A N LYS 671.A O no hydrogen 2.869 N/A MET 645.A N LYS 642.A O no hydrogen 3.379 N/A THR 646.A N ASP 649.A OD1 no hydrogen 3.010 N/A THR 646.A OG1 ASP 649.A OD1 no hydrogen 2.791 N/A ASP 649.A N THR 646.A OG1 no hydrogen 3.171 N/A LEU 650.A N THR 646.A O no hydrogen 3.081 N/A ASN 651.A N THR 647.A O no hydrogen 3.210 N/A ARG 652.A N ARG 648.A O no hydrogen 3.273 N/A ILE 653.A N ASP 649.A O no hydrogen 3.411 N/A ASP 654.A N LEU 650.A O no hydrogen 2.882 N/A LEU 655.A N ASN 651.A O no hydrogen 2.889 N/A TYR 656.A N ARG 652.A O no hydrogen 3.168 N/A TYR 656.A OH ASP 622.A OD1 no hydrogen 2.930 N/A TYR 656.A OH ASP 622.A OD2 no hydrogen 3.379 N/A ALA 657.A N ILE 653.A O no hydrogen 3.011 N/A HIS 658.A N ASP 654.A O no hydrogen 3.247 N/A HIS 658.A NE2 ASP 269.A OD2 no hydrogen 2.912 N/A HIS 659.A N LEU 655.A O no hydrogen 2.927 N/A ARG 660.A N TYR 656.A O no hydrogen 2.910 N/A GLY 661.A N HIS 658.A O no hydrogen 3.321 N/A ILE 662.A N ALA 657.A O no hydrogen 2.984 N/A LYS 663.A NZ ILE 631.A O no hydrogen 3.395 N/A LYS 663.A NZ GLN 633.A O no hydrogen 3.011 N/A THR 664.A OG1 SER 366.A O no hydrogen 2.687 N/A THR 664.A OG1 ILE 635.A O no hydrogen 3.353 N/A ILE 665.A N ILE 341.A O no hydrogen 2.746 N/A TYR 666.A N PHE 637.A O no hydrogen 2.772 N/A ALA 668.A N GLY 337.A O no hydrogen 3.205 N/A ARG 669.A N LEU 639.A O no hydrogen 2.875 N/A LYS 671.A N LEU 641.A O no hydrogen 3.026 N/A