Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dar_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ALA 2.A O no hydrogen 3.144 N/A TYR 7.A OH ALA 344.A O no hydrogen 2.843 N/A ARG 11.A N ASP 8.A O no hydrogen 3.259 N/A ARG 11.A NH1 ASP 49.A O no hydrogen 3.395 N/A LEU 12.A N LEU 9.A O no hydrogen 3.066 N/A ARG 13.A N ARG 51.A O no hydrogen 2.813 N/A ARG 13.A NE VAL 249.A O no hydrogen 3.186 N/A ARG 13.A NE VAL 250.A O no hydrogen 3.307 N/A ARG 13.A NH1 LYS 10.A O no hydrogen 3.294 N/A ARG 13.A NH1 LEU 12.A O no hydrogen 2.587 N/A ARG 13.A NH2 VAL 250.A O no hydrogen 2.926 N/A ASN 14.A ND2 ASP 75.A OD2 no hydrogen 3.141 N/A ASN 14.A ND2 GLY 345.A O no hydrogen 2.979 N/A ILE 15.A N ASN 53.A O no hydrogen 3.088 N/A GLY 16.A N GLY 76.A O no hydrogen 2.999 N/A ALA 18.A N ILE 78.A O no hydrogen 3.079 N/A HIS 20.A ND1 ILE 21.A O no hydrogen 3.050 N/A ALA 23.A N HIS 20.A O no hydrogen 2.831 N/A THR 28.A N GLY 24.A O no hydrogen 3.136 N/A THR 29.A N LYS 25.A O no hydrogen 3.099 N/A THR 29.A OG1 LYS 25.A O no hydrogen 2.692 N/A GLU 30.A N THR 26.A O no hydrogen 2.711 N/A ARG 31.A N THR 27.A O no hydrogen 3.300 N/A ARG 31.A NH1 ASN 239.A OD1 no hydrogen 2.928 N/A ILE 32.A N THR 28.A O no hydrogen 2.885 N/A LEU 33.A N THR 29.A O no hydrogen 2.964 N/A TYR 34.A N GLU 30.A O no hydrogen 2.868 N/A TYR 35.A N ARG 31.A O no hydrogen 2.791 N/A TYR 35.A OH ASN 239.A OD1 no hydrogen 2.891 N/A THR 36.A N ILE 32.A O no hydrogen 2.958 N/A THR 36.A OG1 ILE 32.A O no hydrogen 2.750 N/A THR 36.A OG1 LEU 33.A O no hydrogen 3.312 N/A GLY 37.A N LEU 33.A O no hydrogen 3.065 N/A ARG 38.A N THR 36.A O no hydrogen 3.162 N/A THR 43.A N ILE 54.A O no hydrogen 3.229 N/A THR 44.A N MET 331.A O no hydrogen 3.152 N/A THR 44.A OG1 ASN 53.A OD1 no hydrogen 2.749 N/A CYS 45.A N ILE 52.A O no hydrogen 2.998 N/A CYS 45.A SG THR 36.A OG1 no hydrogen 3.097 N/A CYS 45.A SG ILE 52.A O no hydrogen 3.989 N/A TRP 47.A N HIS 50.A O no hydrogen 2.952 N/A TRP 47.A NE1 ASP 247.A OD1 no hydrogen 3.278 N/A LYS 48.A NZ ASP 247.A OD1 no hydrogen 3.013 N/A HIS 50.A N TRP 47.A O no hydrogen 2.715 N/A HIS 50.A ND1 LYS 48.A O no hydrogen 2.757 N/A ARG 51.A N ARG 11.A O no hydrogen 3.015 N/A ARG 51.A NH1 THR 44.A OG1 no hydrogen 2.947 N/A ILE 52.A N CYS 45.A O no hydrogen 2.895 N/A ASN 53.A N ARG 13.A O no hydrogen 2.920 N/A ASN 53.A ND2 ASN 14.A OD1 no hydrogen 2.922 N/A ASN 53.A ND2 ASP 346.A OD1 no hydrogen 3.314 N/A ILE 54.A N THR 43.A O no hydrogen 2.711 N/A ILE 55.A N ILE 15.A O no hydrogen 3.089 N/A ASP 56.A N ALA 41.A O no hydrogen 3.196 N/A THR 57.A OG1 ILE 17.A O no hydrogen 2.973 N/A HIS 60.A ND1 HIS 60.A O no hydrogen 2.668 N/A PHE 63.A N HIS 60.A O no hydrogen 3.192 N/A THR 64.A OG1 ASP 62.A O no hydrogen 3.276 N/A VAL 67.A N PHE 63.A O no hydrogen 2.954 N/A GLU 68.A N THR 64.A O no hydrogen 2.558 N/A ARG 69.A N ILE 65.A O no hydrogen 3.046 N/A ARG 69.A NE GLU 373.A OE2 no hydrogen 2.869 N/A SER 70.A N GLU 66.A O no hydrogen 2.835 N/A SER 70.A OG GLU 66.A O no hydrogen 2.743 N/A MET 71.A N VAL 67.A O no hydrogen 2.976 N/A MET 71.A N GLU 68.A O no hydrogen 3.097 N/A ARG 72.A N ARG 69.A O no hydrogen 2.611 N/A ARG 72.A NH2 LEU 372.A O no hydrogen 2.633 N/A VAL 73.A N ARG 69.A O no hydrogen 3.195 N/A LEU 74.A N SER 70.A O no hydrogen 3.370 N/A ASP 75.A N ASN 14.A O no hydrogen 2.798 N/A GLY 76.A N ASN 14.A O no hydrogen 3.263 N/A ALA 77.A N PRO 104.A O no hydrogen 2.890 N/A ILE 78.A N GLY 16.A O no hydrogen 3.003 N/A VAL 79.A N ILE 106.A O no hydrogen 2.910 N/A VAL 80.A N ALA 18.A O no hydrogen 2.929 N/A PHE 81.A N PHE 108.A O no hydrogen 2.806 N/A SER 83.A N ASN 110.A O no hydrogen 2.849 N/A SER 83.A OG ASN 110.A O no hydrogen 2.886 N/A SER 84.A N ASP 82.A OD1 no hydrogen 3.228 N/A SER 84.A OG ASP 82.A OD1 no hydrogen 2.878 N/A GLN 85.A N ASP 82.A O no hydrogen 2.891 N/A GLY 86.A N ASP 82.A O no hydrogen 3.132 N/A VAL 87.A N THR 125.A OG1 no hydrogen 2.863 N/A GLU 92.A N GLU 88.A O no hydrogen 2.838 N/A THR 93.A N PRO 89.A O no hydrogen 2.924 N/A THR 93.A OG1 PRO 89.A O no hydrogen 2.825 N/A THR 93.A OG1 GLN 90.A O no hydrogen 3.374 N/A VAL 94.A N GLN 90.A O no hydrogen 2.660 N/A TRP 95.A N SER 91.A O no hydrogen 2.786 N/A ARG 96.A N GLU 92.A O no hydrogen 2.874 N/A ARG 96.A NH2 GLU 92.A OE1 no hydrogen 3.127 N/A GLN 97.A N THR 93.A O no hydrogen 2.809 N/A ALA 98.A N VAL 94.A O no hydrogen 2.641 N/A GLU 99.A N TRP 95.A O no hydrogen 3.076 N/A GLU 99.A N ARG 96.A O no hydrogen 3.030 N/A LYS 100.A N ARG 96.A O no hydrogen 2.906 N/A TYR 101.A N GLN 97.A O no hydrogen 3.235 N/A LYS 102.A N GLU 99.A O no hydrogen 2.755 N/A VAL 103.A N ALA 98.A O no hydrogen 2.793 N/A ARG 105.A NH1 VAL 103.A O no hydrogen 2.606 N/A ARG 105.A NH2 GLU 99.A OE2 no hydrogen 2.857 N/A ILE 106.A N ALA 77.A O no hydrogen 3.344 N/A ALA 107.A N PRO 230.A O no hydrogen 3.005 N/A PHE 108.A N VAL 79.A O no hydrogen 2.890 N/A ALA 109.A N PHE 232.A O no hydrogen 2.763 N/A ASN 110.A N PHE 81.A O no hydrogen 2.865 N/A ASN 110.A ND2 ALA 23.A O no hydrogen 3.048 N/A LYS 111.A NZ ASP 22.A O no hydrogen 2.978 N/A MET 112.A N GLY 234.A O no hydrogen 3.160 N/A LYS 114.A N LYS 111.A O no hydrogen 2.831 N/A GLY 116.A N GLU 144.A OE2 no hydrogen 2.807 N/A ALA 117.A N LYS 114.A O no hydrogen 2.847 N/A ASP 118.A N SER 83.A O no hydrogen 2.813 N/A LEU 121.A N ASP 118.A O no hydrogen 3.117 N/A LEU 121.A N ASP 118.A OD2 no hydrogen 2.924 N/A VAL 122.A N ASP 118.A O no hydrogen 3.496 N/A ILE 123.A N LEU 119.A O no hydrogen 2.981 N/A ARG 124.A N TRP 120.A O no hydrogen 2.818 N/A THR 125.A N LEU 121.A O no hydrogen 3.032 N/A THR 125.A OG1 LEU 121.A O no hydrogen 2.918 N/A THR 125.A OG1 VAL 122.A O no hydrogen 2.922 N/A MET 126.A N VAL 122.A O no hydrogen 2.968 N/A GLN 127.A N ILE 123.A O no hydrogen 3.062 N/A GLU 128.A N ARG 124.A O no hydrogen 2.859 N/A ARG 129.A N THR 125.A O no hydrogen 2.901 N/A ARG 129.A NH1 GLU 92.A OE2 no hydrogen 3.413 N/A GLY 131.A N MET 126.A O no hydrogen 2.990 N/A ALA 132.A N MET 126.A O no hydrogen 3.188 N/A ARG 133.A NH2 ASP 195.A OD2 no hydrogen 2.909 N/A GLN 138.A NE2 LEU 233.A O no hydrogen 3.245 N/A LEU 139.A N ILE 151.A O no hydrogen 3.027 N/A GLY 142.A N TYR 178.A OH no hydrogen 2.863 N/A ARG 143.A N THR 146.A OG1 no hydrogen 2.723 N/A ARG 143.A NH1 GLU 144.A OE2 no hydrogen 3.292 N/A ARG 143.A NH2 ASP 118.A OD1 no hydrogen 3.181 N/A THR 146.A N ARG 143.A O no hydrogen 2.688 N/A THR 146.A OG1 ARG 143.A O no hydrogen 2.541 N/A PHE 147.A N GLU 144.A O no hydrogen 2.854 N/A SER 148.A N ILE 141.A O no hydrogen 2.995 N/A SER 148.A OG ILE 141.A O no hydrogen 3.481 N/A SER 148.A OG THR 146.A O no hydrogen 3.161 N/A ILE 150.A N TYR 159.A O no hydrogen 2.716 N/A ILE 151.A N LEU 139.A O no hydrogen 2.841 N/A ASP 152.A N LYS 157.A O no hydrogen 2.718 N/A VAL 153.A N MET 137.A O no hydrogen 3.029 N/A LEU 154.A N ASP 152.A OD1 no hydrogen 3.348 N/A ARG 155.A N ASP 152.A OD1 no hydrogen 3.350 N/A ARG 155.A NE ASP 152.A OD2 no hydrogen 2.680 N/A ARG 155.A NH1 GLU 212.A OE2 no hydrogen 2.993 N/A MET 156.A N ASP 152.A O no hydrogen 2.457 N/A LYS 157.A N ASP 152.A O no hydrogen 3.210 N/A LYS 157.A NZ GLU 171.A OE2 no hydrogen 3.117 N/A ALA 158.A N ILE 172.A O no hydrogen 3.368 N/A TYR 159.A N ILE 150.A O no hydrogen 2.733 N/A THR 160.A N ARG 170.A O no hydrogen 3.028 N/A THR 160.A OG1 SER 148.A O no hydrogen 3.481 N/A TYR 161.A N SER 148.A O no hydrogen 2.917 N/A GLY 162.A N ASP 168.A O no hydrogen 2.943 N/A THR 167.A OG1 ASN 163.A OD1 no hydrogen 3.025 N/A ARG 170.A N THR 160.A O no hydrogen 3.185 N/A ARG 170.A NE ASP 168.A OD1 no hydrogen 2.797 N/A ILE 172.A N ALA 158.A O no hydrogen 2.932 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.623 N/A TYR 178.A N PRO 175.A O no hydrogen 2.757 N/A LEU 179.A N PRO 175.A O no hydrogen 3.196 N/A LEU 179.A N GLU 176.A O no hydrogen 3.328 N/A ALA 182.A N TYR 178.A O no hydrogen 2.927 N/A ARG 183.A N LEU 179.A O no hydrogen 2.951 N/A GLU 184.A N ASP 180.A O no hydrogen 2.800 N/A TYR 185.A N GLN 181.A O no hydrogen 2.913 N/A HIS 186.A N ALA 182.A O no hydrogen 2.968 N/A HIS 186.A NE2 GLU 209.A OE2 no hydrogen 2.698 N/A GLU 187.A N ARG 183.A O no hydrogen 3.336 N/A LYS 188.A N GLU 184.A O no hydrogen 3.128 N/A LEU 189.A N TYR 185.A O no hydrogen 2.917 N/A VAL 190.A N HIS 186.A O no hydrogen 2.795 N/A GLU 191.A N GLU 187.A O no hydrogen 2.838 N/A VAL 192.A N LYS 188.A O no hydrogen 3.056 N/A ALA 193.A N LEU 189.A O no hydrogen 2.811 N/A ALA 194.A N VAL 190.A O no hydrogen 2.872 N/A ASP 195.A N VAL 192.A O no hydrogen 2.829 N/A PHE 196.A N ALA 193.A O no hydrogen 2.750 N/A ILE 200.A N ASP 197.A O no hydrogen 2.830 N/A MET 201.A N ASP 197.A O no hydrogen 3.352 N/A MET 201.A N GLU 198.A O no hydrogen 2.885 N/A LEU 202.A N GLU 198.A O no hydrogen 3.177 N/A LYS 203.A N ASN 199.A O no hydrogen 3.447 N/A LYS 203.A NZ GLU 214.A OE1 no hydrogen 3.399 N/A TYR 204.A N ILE 200.A O no hydrogen 2.810 N/A TYR 204.A OH GLU 191.A OE2 no hydrogen 2.475 N/A LEU 205.A N MET 201.A O no hydrogen 2.712 N/A GLU 206.A N LEU 202.A O no hydrogen 2.857 N/A GLY 207.A N TYR 204.A O no hydrogen 2.981 N/A GLU 208.A N LYS 203.A O no hydrogen 2.813 N/A THR 211.A N GLU 214.A OE1 no hydrogen 2.710 N/A THR 211.A OG1 GLU 214.A OE1 no hydrogen 2.983 N/A GLU 214.A N THR 211.A OG1 no hydrogen 3.040 N/A LEU 215.A N THR 211.A O no hydrogen 2.954 N/A VAL 216.A N GLU 212.A O no hydrogen 2.944 N/A ALA 217.A N GLU 213.A O no hydrogen 3.111 N/A ALA 218.A N GLU 214.A O no hydrogen 3.159 N/A ILE 219.A N LEU 215.A O no hydrogen 2.905 N/A ARG 220.A N VAL 216.A O no hydrogen 2.783 N/A ARG 220.A NH1 ASP 251.A O no hydrogen 2.856 N/A ARG 220.A NH2 LEU 253.A O no hydrogen 2.501 N/A ARG 220.A NH2 ASP 258.A OD2 no hydrogen 2.695 N/A LYS 221.A N ALA 217.A O no hydrogen 2.797 N/A LYS 221.A NZ ASP 225.A OD2 no hydrogen 3.353 N/A GLY 222.A N ALA 218.A O no hydrogen 2.910 N/A THR 223.A N ILE 219.A O no hydrogen 2.833 N/A THR 223.A OG1 ILE 219.A O no hydrogen 2.617 N/A ILE 224.A N ARG 220.A O no hydrogen 2.876 N/A ASP 225.A N LYS 221.A O no hydrogen 2.921 N/A LEU 226.A N THR 223.A O no hydrogen 3.279 N/A LYS 227.A N GLY 222.A O no hydrogen 3.059 N/A THR 229.A N ARG 133.A O no hydrogen 3.005 N/A VAL 231.A N VAL 135.A O no hydrogen 2.991 N/A PHE 232.A N ALA 107.A O no hydrogen 2.839 N/A GLY 234.A N ALA 109.A O no hydrogen 3.103 N/A SER 235.A N LYS 240.A O no hydrogen 2.826 N/A SER 235.A OG ASP 113.A OD1 no hydrogen 2.562 N/A ALA 236.A N ASN 110.A OD1 no hydrogen 2.775 N/A LYS 238.A N SER 235.A O no hydrogen 3.284 N/A LYS 238.A N SER 235.A OG no hydrogen 3.282 N/A ASN 239.A N ALA 236.A O no hydrogen 2.899 N/A ASN 239.A ND2 ASP 164.A O no hydrogen 3.333 N/A LYS 240.A N SER 235.A O no hydrogen 3.100 N/A LYS 240.A NZ ASP 164.A OD1 no hydrogen 3.129 N/A GLN 243.A N GLN 243.A OE1 no hydrogen 2.658 N/A LEU 245.A N GLY 241.A O no hydrogen 3.044 N/A LEU 246.A N VAL 242.A O no hydrogen 2.822 N/A ASP 247.A N GLN 243.A O no hydrogen 2.803 N/A ALA 248.A N LEU 244.A O no hydrogen 3.053 N/A VAL 249.A N LEU 245.A O no hydrogen 3.145 N/A VAL 250.A N LEU 246.A O no hydrogen 3.322 N/A ASP 251.A N ASP 247.A O no hydrogen 2.875 N/A TYR 252.A N ALA 248.A O no hydrogen 2.723 N/A LEU 253.A N VAL 249.A O no hydrogen 3.299 N/A SER 255.A N ASP 258.A OD2 no hydrogen 2.771 N/A SER 255.A OG ASP 258.A OD2 no hydrogen 3.383 N/A LEU 257.A N SER 255.A OG no hydrogen 2.773 N/A ASP 258.A N SER 255.A O no hydrogen 2.952 N/A GLY 264.A N VAL 272.A O no hydrogen 3.068 N/A THR 265.A N ILE 371.A O no hydrogen 2.932 N/A THR 265.A OG1 ILE 371.A O no hydrogen 3.395 N/A THR 266.A N GLU 270.A O no hydrogen 3.272 N/A THR 266.A OG1 GLU 270.A O no hydrogen 2.847 N/A GLY 269.A N THR 266.A OG1 no hydrogen 3.377 N/A VAL 272.A N GLY 264.A O no hydrogen 2.842 N/A ILE 274.A N ILE 262.A O no hydrogen 2.606 N/A ASP 277.A N HIS 275.A O no hydrogen 2.803 N/A ASN 279.A N ASP 277.A OD1 no hydrogen 3.274 N/A GLY 280.A N ASP 277.A O no hydrogen 3.238 N/A ALA 283.A N SER 305.A O no hydrogen 3.189 N/A ALA 284.A N LEU 362.A O no hydrogen 3.063 N/A LEU 285.A N ARG 302.A O no hydrogen 3.052 N/A ALA 286.A N ASP 360.A O no hydrogen 2.943 N/A PHE 287.A N PHE 300.A O no hydrogen 2.872 N/A MET 290.A N LEU 298.A O no hydrogen 2.943 N/A ASP 292.A N GLY 296.A O no hydrogen 3.070 N/A TYR 294.A N ASP 292.A OD1 no hydrogen 3.132 N/A GLY 296.A N ASP 292.A O no hydrogen 3.334 N/A ARG 297.A NH2 THR 356.A O no hydrogen 2.987 N/A LEU 298.A N MET 290.A O no hydrogen 2.669 N/A THR 299.A N VAL 350.A O no hydrogen 3.105 N/A PHE 300.A N LYS 288.A O no hydrogen 2.779 N/A ILE 301.A N GLY 348.A O no hydrogen 3.048 N/A ARG 302.A N LEU 285.A O no hydrogen 2.998 N/A ARG 302.A NE VAL 73.A O no hydrogen 2.868 N/A ARG 302.A NH2 VAL 73.A O no hydrogen 2.780 N/A VAL 303.A N ASP 346.A O no hydrogen 2.974 N/A TYR 304.A N ALA 283.A O no hydrogen 2.922 N/A TYR 304.A OH ARG 72.A O no hydrogen 3.067 N/A SER 305.A N ALA 283.A O no hydrogen 3.193 N/A SER 305.A OG ASP 277.A O no hydrogen 2.896 N/A SER 305.A OG PRO 281.A O no hydrogen 2.910 N/A GLY 306.A N ASP 277.A O no hydrogen 2.623 N/A THR 307.A OG1 PRO 278.A O no hydrogen 2.858 N/A LEU 308.A N LEU 342.A O no hydrogen 2.972 N/A SER 310.A N GLU 340.A O no hydrogen 2.895 N/A SER 312.A OG THR 309.A O no hydrogen 2.672 N/A VAL 314.A N GLU 323.A O no hydrogen 2.916 N/A TYR 315.A N VAL 363.A O no hydrogen 2.758 N/A TYR 315.A OH GLY 320.A O no hydrogen 3.143 N/A ASN 316.A N ARG 321.A O no hydrogen 2.903 N/A ASN 316.A ND2 THR 356.A OG1 no hydrogen 2.895 N/A ASN 316.A ND2 ASP 360.A OD2 no hydrogen 3.171 N/A THR 317.A N THR 361.A O no hydrogen 3.213 N/A THR 317.A OG1 VAL 370.A O no hydrogen 2.659 N/A THR 318.A OG1 ASN 316.A OD1 no hydrogen 3.531 N/A THR 318.A OG1 ASP 360.A OD1 no hydrogen 2.419 N/A LYS 319.A N ASN 316.A O no hydrogen 3.345 N/A LYS 319.A NZ GLU 355.A O no hydrogen 2.642 N/A GLU 323.A N VAL 314.A O no hydrogen 2.720 N/A VAL 325.A N SER 312.A O no hydrogen 2.837 N/A ARG 327.A N VAL 351.A O no hydrogen 3.126 N/A ARG 327.A NE GLU 338.A OE1 no hydrogen 3.177 N/A ARG 327.A NH2 GLU 338.A OE1 no hydrogen 3.343 N/A LEU 329.A N ALA 349.A O no hydrogen 2.856 N/A ARG 330.A N GLU 337.A O no hydrogen 2.653 N/A ARG 330.A NH1 ASP 346.A OD1 no hydrogen 3.279 N/A ARG 330.A NH2 ASP 346.A OD1 no hydrogen 3.461 N/A ARG 330.A NH2 ASP 346.A OD2 no hydrogen 3.096 N/A HIS 332.A N HIS 335.A O no hydrogen 2.780 N/A HIS 332.A ND1 ARG 330.A O no hydrogen 3.090 N/A GLU 337.A N ARG 330.A O no hydrogen 2.951 N/A VAL 339.A N LEU 328.A O no hydrogen 2.891 N/A LEU 342.A N LEU 308.A O no hydrogen 2.955 N/A ALA 344.A N GLY 306.A O no hydrogen 2.901 N/A GLY 345.A N VAL 303.A O no hydrogen 2.707 N/A ASP 346.A N LYS 343.A O no hydrogen 3.126 N/A LEU 347.A N ASP 346.A OD1 no hydrogen 2.743 N/A GLY 348.A N ILE 301.A O no hydrogen 3.397 N/A ALA 349.A N LEU 329.A O no hydrogen 2.887 N/A VAL 350.A N THR 299.A O no hydrogen 2.675 N/A VAL 351.A N ARG 327.A O no hydrogen 2.985 N/A LYS 354.A N GLU 323.A OE1 no hydrogen 2.962 N/A LYS 354.A N GLU 323.A OE2 no hydrogen 3.247 N/A GLU 355.A N GLU 323.A OE2 no hydrogen 2.738 N/A ILE 357.A N ASP 360.A OD2 no hydrogen 2.754 N/A THR 358.A OG1 GLU 376.A O no hydrogen 3.033 N/A GLY 359.A N ALA 286.A O no hydrogen 2.810 N/A ASP 360.A N ILE 357.A O no hydrogen 3.044 N/A LEU 362.A N ALA 284.A O no hydrogen 2.935 N/A VAL 363.A N TYR 315.A O no hydrogen 3.078 N/A ALA 367.A N GLY 364.A O no hydrogen 3.187 N/A ARG 369.A NH2 GLU 365.A O no hydrogen 3.000 N/A ILE 371.A N THR 265.A O no hydrogen 3.107 N/A LEU 372.A N THR 361.A OG1 no hydrogen 2.914 N/A SER 383.A N THR 387.A O no hydrogen 2.855 N/A SER 383.A N ILE 388.A O no hydrogen 3.020 N/A ILE 388.A N GLN 386.A O no hydrogen 3.030 N/A GLY 391.A N PHE 400.A O no hydrogen 3.163 N/A LYS 401.A N GLN 410.A O no hydrogen 2.780 N/A LYS 408.A NZ VAL 406.A O no hydrogen 3.142 N/A GLN 410.A N LYS 401.A O no hydrogen 3.360 N/A GLN 410.A NE2 LYS 401.A O no hydrogen 3.544 N/A ALA 412.A N GLU 399.A O no hydrogen 2.879 N/A ARG 414.A N LEU 532.A O no hydrogen 3.177 N/A ARG 414.A NH1 TYR 413.A O no hydrogen 2.663 N/A GLU 415.A N PRO 489.A O no hydrogen 2.991 N/A THR 416.A N VAL 530.A O no hydrogen 3.330 N/A THR 416.A OG1 VAL 491.A O no hydrogen 3.132 N/A THR 418.A N GLY 527.A O no hydrogen 2.808 N/A THR 418.A OG1 GLY 527.A O no hydrogen 3.441 N/A THR 418.A OG1 ASP 528.A O no hydrogen 2.527 N/A LYS 419.A N GLY 527.A O no hydrogen 2.975 N/A LYS 419.A NZ LYS 526.A O no hydrogen 3.384 N/A LYS 419.A NZ ASP 528.A OD2 no hydrogen 3.503 N/A GLY 425.A N VAL 440.A O no hydrogen 2.781 N/A PHE 427.A N GLY 438.A O no hydrogen 2.800 N/A ARG 429.A N GLN 436.A O no hydrogen 3.182 N/A THR 431.A OG1 GLY 433.A O no hydrogen 3.375 N/A GLY 433.A N THR 431.A OG1 no hydrogen 2.682 N/A ARG 434.A NE GLY 435.A O no hydrogen 3.170 N/A ARG 434.A NH2 ASP 506.A O no hydrogen 3.067 N/A ARG 434.A NH2 SER 507.A O no hydrogen 3.107 N/A GLN 436.A N ARG 429.A O no hydrogen 3.234 N/A GLN 436.A NE2 SER 508.A OG no hydrogen 2.456 N/A TYR 437.A OH SER 501.A OG no hydrogen 2.473 N/A GLY 438.A N PHE 427.A O no hydrogen 2.918 N/A HIS 439.A ND1 GLY 425.A O no hydrogen 3.215 N/A VAL 440.A N GLY 425.A O no hydrogen 3.093 N/A LYS 441.A N ASP 499.A O no hydrogen 2.720 N/A LYS 441.A NZ GLU 424.A OE1 no hydrogen 2.938 N/A ILE 442.A N VAL 423.A O no hydrogen 3.192 N/A LYS 443.A N THR 496.A O no hydrogen 3.004 N/A VAL 444.A N VAL 421.A O no hydrogen 2.948 N/A GLU 445.A N LYS 494.A O no hydrogen 3.197 N/A LEU 447.A N ASP 492.A O no hydrogen 3.148 N/A ARG 449.A NH1 ASP 492.A OD2 no hydrogen 2.907 N/A GLY 450.A N ASP 492.A OD2 no hydrogen 2.947 N/A SER 451.A N PRO 448.A O no hydrogen 2.944 N/A SER 451.A OG PRO 448.A O no hydrogen 3.086 N/A GLY 452.A N ASP 492.A OD1 no hydrogen 2.979 N/A GLU 454.A N ILE 493.A O no hydrogen 3.407 N/A VAL 456.A N VAL 495.A O no hydrogen 2.755 N/A ALA 458.A N LEU 497.A O no hydrogen 2.568 N/A ILE 459.A N ASN 457.A OD1 no hydrogen 3.247 N/A VAL 463.A N VAL 460.A O no hydrogen 3.056 N/A TYR 468.A N PRO 465.A O no hydrogen 2.705 N/A ALA 471.A N TYR 468.A O no hydrogen 2.720 N/A VAL 472.A N TYR 468.A O no hydrogen 2.998 N/A GLN 473.A N ILE 469.A O no hydrogen 3.038 N/A LYS 474.A N PRO 470.A O no hydrogen 3.103 N/A GLY 475.A N ALA 471.A O no hydrogen 2.986 N/A ILE 476.A N VAL 472.A O no hydrogen 2.861 N/A GLU 477.A N GLN 473.A O no hydrogen 2.795 N/A GLU 478.A N LYS 474.A O no hydrogen 3.080 N/A ALA 479.A N GLY 475.A O no hydrogen 3.104 N/A MET 480.A N ILE 476.A O no hydrogen 3.090 N/A GLN 481.A N GLU 478.A O no hydrogen 3.339 N/A GLN 481.A NE2 GLU 478.A O no hydrogen 3.494 N/A SER 482.A N ALA 479.A O no hydrogen 3.091 N/A GLY 483.A N PHE 488.A O no hydrogen 2.834 N/A LEU 485.A N GLU 415.A OE1 no hydrogen 3.097 N/A ILE 486.A N GLU 415.A OE2 no hydrogen 3.193 N/A PHE 488.A N GLU 415.A OE2 no hydrogen 2.825 N/A VAL 490.A N MET 480.A O no hydrogen 2.731 N/A VAL 491.A N GLU 415.A O no hydrogen 2.973 N/A ILE 493.A N GLY 452.A O no hydrogen 3.294 N/A LYS 494.A N GLU 445.A O no hydrogen 3.009 N/A VAL 495.A N GLU 454.A O no hydrogen 2.883 N/A THR 496.A N LYS 443.A O no hydrogen 2.993 N/A LEU 497.A N VAL 456.A O no hydrogen 2.685 N/A TYR 498.A N LYS 441.A O no hydrogen 3.118 N/A TYR 498.A OH ASP 422.A OD1 no hydrogen 2.729 N/A ASP 499.A N LYS 441.A O no hydrogen 3.370 N/A SER 501.A N HIS 439.A O no hydrogen 2.920 N/A SER 501.A OG TYR 437.A OH no hydrogen 2.473 N/A HIS 503.A N SER 507.A OG no hydrogen 2.716 N/A ASP 506.A N HIS 503.A ND1 no hydrogen 3.178 N/A SER 507.A N HIS 503.A O no hydrogen 2.897 N/A SER 507.A OG TYR 437.A O no hydrogen 3.255 N/A SER 507.A OG HIS 503.A O no hydrogen 3.131 N/A ALA 511.A N SER 508.A OG no hydrogen 3.053 N/A PHE 512.A N SER 508.A O no hydrogen 3.211 N/A LYS 513.A N GLU 509.A O no hydrogen 3.036 N/A LYS 513.A N MET 510.A O no hydrogen 2.907 N/A ILE 514.A N MET 510.A O no hydrogen 2.967 N/A ALA 515.A N ALA 511.A O no hydrogen 3.252 N/A GLY 516.A N LYS 513.A O no hydrogen 2.781 N/A SER 517.A N LYS 513.A O no hydrogen 3.059 N/A SER 517.A OG GLY 475.A O no hydrogen 3.126 N/A MET 518.A N ILE 514.A O no hydrogen 3.056 N/A ALA 519.A N ALA 515.A O no hydrogen 3.371 N/A ILE 520.A N GLY 516.A O no hydrogen 3.230 N/A LYS 521.A N SER 517.A O no hydrogen 2.968 N/A LYS 521.A NZ ALA 479.A O no hydrogen 2.660 N/A LYS 521.A NZ SER 482.A O no hydrogen 2.560 N/A GLU 522.A N MET 518.A O no hydrogen 3.179 N/A ALA 523.A N ALA 519.A O no hydrogen 2.928 N/A VAL 524.A N ILE 520.A O no hydrogen 2.953 N/A GLN 525.A N LYS 521.A O no hydrogen 3.241 N/A LYS 526.A N GLU 522.A O no hydrogen 2.813 N/A GLY 527.A N VAL 524.A O no hydrogen 3.066 N/A VAL 530.A N THR 416.A O no hydrogen 2.942 N/A LEU 532.A N ARG 414.A O no hydrogen 2.915 N/A GLU 533.A N GLN 607.A O no hydrogen 2.582 N/A ILE 535.A N HIS 605.A O no hydrogen 2.696 N/A MET 536.A N VAL 577.A O no hydrogen 3.225 N/A ARG 537.A N PHE 602.A O no hydrogen 2.638 N/A VAL 538.A N ALA 575.A O no hydrogen 2.821 N/A GLU 539.A N VAL 600.A O no hydrogen 2.788 N/A VAL 540.A N ILE 573.A O no hydrogen 3.060 N/A THR 541.A N SER 598.A O no hydrogen 2.540 N/A THR 542.A N GLN 571.A O no hydrogen 2.866 N/A THR 542.A OG1 PRO 543.A O no hydrogen 3.416 N/A TYR 546.A N PRO 543.A O no hydrogen 2.768 N/A MET 547.A N GLU 544.A O no hydrogen 3.371 N/A GLY 548.A N TYR 546.A O no hydrogen 2.603 N/A ASP 549.A N TYR 546.A O no hydrogen 3.118 N/A VAL 550.A N TYR 546.A O no hydrogen 3.390 N/A GLY 552.A N GLY 548.A O no hydrogen 3.400 N/A ASP 553.A N ASP 549.A O no hydrogen 2.880 N/A LEU 554.A N VAL 550.A O no hydrogen 2.908 N/A ASN 555.A N ILE 551.A O no hydrogen 3.010 N/A ALA 556.A N GLY 552.A O no hydrogen 3.128 N/A ALA 556.A N ASP 553.A O no hydrogen 2.868 N/A ARG 557.A N ASP 553.A O no hydrogen 2.960 N/A ARG 557.A N LEU 554.A O no hydrogen 2.647 N/A ARG 557.A NE ASP 553.A OD2 no hydrogen 3.072 N/A ARG 557.A NH2 ASP 588.A OD1 no hydrogen 3.225 N/A ARG 558.A NH1 GLU 581.A OE2 no hydrogen 3.480 N/A ARG 558.A NH2 GLU 533.A OE1 no hydrogen 2.987 N/A GLY 559.A N LEU 554.A O no hydrogen 3.083 N/A GLN 560.A NE2 ILE 561.A O no hydrogen 3.516 N/A LEU 562.A N ARG 574.A O no hydrogen 2.851 N/A ARG 567.A N ALA 570.A O no hydrogen 2.753 N/A ALA 570.A N ARG 567.A O no hydrogen 3.069 N/A GLN 571.A N THR 542.A O no hydrogen 2.808 N/A GLN 571.A NE2 ALA 570.A O no hydrogen 3.408 N/A VAL 572.A N GLU 565.A O no hydrogen 2.731 N/A ILE 573.A N VAL 540.A O no hydrogen 2.896 N/A ARG 574.A N GLY 563.A O no hydrogen 2.967 N/A ALA 575.A N VAL 538.A O no hydrogen 3.304 N/A PHE 576.A N GLN 560.A O no hydrogen 3.353 N/A VAL 577.A N MET 536.A O no hydrogen 3.032 N/A LEU 579.A N PRO 534.A O no hydrogen 3.275 N/A GLU 581.A N PRO 578.A O no hydrogen 2.728 N/A MET 582.A N PRO 578.A O no hydrogen 3.130 N/A THR 587.A OG1 GLY 584.A O no hydrogen 3.411 N/A ASP 588.A N GLY 584.A O no hydrogen 3.432 N/A LEU 589.A N TYR 585.A O no hydrogen 2.645 N/A LEU 589.A N ALA 586.A O no hydrogen 3.090 N/A ARG 590.A N ALA 586.A O no hydrogen 3.061 N/A SER 591.A OG THR 587.A O no hydrogen 3.167 N/A LYS 592.A N ASP 588.A O no hydrogen 3.227 N/A THR 593.A N LEU 589.A O no hydrogen 2.883 N/A THR 593.A N ARG 590.A O no hydrogen 2.884 N/A THR 593.A OG1 LEU 589.A O no hydrogen 2.755 N/A THR 593.A OG1 ARG 590.A O no hydrogen 3.511 N/A GLN 594.A N SER 591.A O no hydrogen 3.195 N/A GLN 594.A NE2 SER 591.A O no hydrogen 3.520 N/A GLY 595.A N ARG 590.A O no hydrogen 2.617 N/A ARG 596.A N THR 593.A O no hydrogen 2.892 N/A ARG 596.A NH1 GLU 92.A OE2 no hydrogen 2.974 N/A SER 598.A N THR 541.A O no hydrogen 2.954 N/A VAL 600.A N GLU 539.A O no hydrogen 3.016 N/A PHE 602.A N ARG 537.A O no hydrogen 2.728 N/A ASP 604.A N ILE 535.A O no hydrogen 2.786 N/A HIS 605.A N ILE 535.A O no hydrogen 2.973 N/A HIS 605.A ND1 ASP 604.A OD2 no hydrogen 2.771 N/A HIS 605.A NE2 GLN 607.A OE1 no hydrogen 3.287 N/A TYR 606.A OH ALA 412.A O no hydrogen 2.582 N/A GLN 607.A N GLU 533.A O no hydrogen 2.957 N/A VAL 609.A N ILE 531.A O no hydrogen 2.797 N/A GLN 614.A N PRO 610.A O no hydrogen 2.813 N/A GLN 614.A NE2 PRO 529.A O no hydrogen 3.187 N/A GLU 615.A N LYS 611.A O no hydrogen 2.796 N/A LYS 616.A N GLN 612.A O no hydrogen 3.017 N/A LEU 617.A N VAL 613.A O no hydrogen 2.791 N/A ILE 618.A N GLN 614.A O no hydrogen 2.681 N/A LYS 619.A N GLU 615.A O no hydrogen 3.146 N/A