Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ukt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 545.A OE2 no hydrogen 3.013 N/A SER 5.A N PRO 2.A O no hydrogen 3.265 N/A ASN 8.A N SER 5.A O no hydrogen 3.029 N/A ASN 8.A ND2 ASP 3.A O no hydrogen 3.221 N/A ASN 8.A ND2 ASP 518.A OD1 no hydrogen 2.809 N/A LYS 9.A NZ GLY 222.A O no hydrogen 3.527 N/A LYS 9.A NZ VAL 223.A O no hydrogen 3.330 N/A LYS 9.A NZ ASP 224.A OD1 no hydrogen 2.974 N/A GLN 10.A NE2 PRO 251.A O no hydrogen 3.336 N/A ASN 11.A N ASN 8.A OD1 no hydrogen 2.890 N/A ASP 15.A N PHE 12.A O no hydrogen 2.920 N/A VAL 16.A N THR 72.A OG1 no hydrogen 2.937 N/A ILE 17.A N PRO 356.A O no hydrogen 2.984 N/A TYR 18.A N ALA 73.A O no hydrogen 2.719 N/A TYR 18.A OH GLU 363.A OE1 no hydrogen 2.552 N/A TYR 18.A OH GLU 363.A OE2 no hydrogen 3.411 N/A GLN 19.A N ILE 358.A O no hydrogen 2.824 N/A ILE 20.A N TRP 75.A O no hydrogen 2.843 N/A ARG 24.A N PHE 21.A O no hydrogen 2.673 N/A ARG 24.A NE ASP 23.A OD1 no hydrogen 2.771 N/A ARG 24.A NH1 LEU 46.A O no hydrogen 3.103 N/A ARG 24.A NH2 LEU 46.A O no hydrogen 2.716 N/A ARG 24.A NH2 LEU 48.A O no hydrogen 2.665 N/A PHE 25.A N THR 22.A O no hydrogen 3.336 N/A GLY 28.A N ASP 53.A OD1 no hydrogen 3.052 N/A ASN 29.A N ASP 27.A OD2 no hydrogen 3.337 N/A ASN 29.A N ASP 53.A OD2 no hydrogen 2.931 N/A ALA 31.A N ASN 29.A OD1 no hydrogen 2.866 N/A ASN 33.A N PRO 30.A O no hydrogen 2.811 N/A ASN 33.A ND2 ASP 27.A OD1 no hydrogen 2.941 N/A PHE 39.A N GLY 36.A O no hydrogen 3.386 N/A ASP 40.A N TYR 49.A O no hydrogen 2.803 N/A SER 42.A OG ASP 40.A OD1 no hydrogen 2.917 N/A SER 42.A OG THR 44.A OG1 no hydrogen 2.767 N/A CYS 43.A N ASP 40.A O no hydrogen 2.673 N/A THR 44.A OG1 SER 42.A O no hydrogen 3.248 N/A THR 44.A OG1 SER 42.A OG no hydrogen 2.767 N/A ASN 45.A N ASP 40.A OD2 no hydrogen 2.627 N/A ARG 47.A N ASN 45.A OD1 no hydrogen 3.499 N/A LEU 48.A N ASN 45.A O no hydrogen 3.328 N/A TYR 49.A N ALA 38.A O no hydrogen 3.110 N/A CYS 50.A N ASP 23.A OD1 no hydrogen 2.820 N/A CYS 50.A N ASP 23.A OD2 no hydrogen 3.136 N/A CYS 50.A SG ASP 40.A O no hydrogen 3.963 N/A CYS 50.A SG LEU 48.A O no hydrogen 3.821 N/A GLY 51.A N ASP 23.A OD2 no hydrogen 3.197 N/A GLY 52.A N ASP 23.A O no hydrogen 2.830 N/A ASP 53.A N SER 26.A O no hydrogen 3.182 N/A TRP 54.A N TYR 112.A O no hydrogen 2.769 N/A GLN 55.A NE2 GLN 55.A O no hydrogen 3.259 N/A GLN 55.A NE2 ASN 59.A OD1 no hydrogen 3.253 N/A GLY 56.A N ASP 53.A O no hydrogen 3.050 N/A ILE 57.A N TRP 54.A O no hydrogen 2.950 N/A ILE 58.A N TRP 54.A O no hydrogen 3.119 N/A ASN 59.A N GLN 55.A O no hydrogen 3.298 N/A ILE 61.A N ILE 57.A O no hydrogen 2.905 N/A ILE 61.A N ILE 58.A O no hydrogen 3.266 N/A ASN 62.A N ILE 58.A O no hydrogen 2.934 N/A ASP 63.A N ASN 59.A O no hydrogen 2.989 N/A TYR 65.A N ASP 63.A OD2 no hydrogen 3.189 N/A TYR 65.A OH GLU 363.A OE1 no hydrogen 2.677 N/A LEU 66.A N LYS 60.A O no hydrogen 3.072 N/A GLY 68.A N GLY 64.A O no hydrogen 2.819 N/A MET 69.A N LEU 66.A O no hydrogen 3.021 N/A GLY 70.A N THR 67.A O no hydrogen 2.853 N/A THR 72.A N VAL 16.A O no hydrogen 3.162 N/A THR 72.A OG1 ASP 15.A OD2 no hydrogen 3.125 N/A ILE 74.A N LYS 131.A O no hydrogen 2.855 N/A TRP 75.A N TYR 18.A O no hydrogen 2.910 N/A TRP 75.A NE1 ASP 135.A OD1 no hydrogen 2.735 N/A ILE 76.A N ILE 133.A O no hydrogen 3.072 N/A GLN 78.A NE2 GLY 99.A O no hydrogen 2.699 N/A GLU 81.A N LYS 107.A O no hydrogen 2.723 N/A ILE 83.A N TRP 101.A O no hydrogen 3.392 N/A TYR 84.A N GLU 153.A OE1 no hydrogen 3.238 N/A TYR 84.A OH GLU 81.A OE1 no hydrogen 2.908 N/A SER 85.A OG GLU 153.A OE1 no hydrogen 2.942 N/A ILE 87.A N ASN 94.A O no hydrogen 2.810 N/A ASN 88.A ND2 ASN 88.A O no hydrogen 2.931 N/A TYR 89.A OH ASP 196.A OD1 no hydrogen 2.527 N/A VAL 92.A N TYR 89.A O no hydrogen 3.267 N/A ASN 94.A ND2 VAL 92.A O no hydrogen 3.030 N/A THR 95.A N ARG 47.A O no hydrogen 3.020 N/A THR 95.A OG1 ARG 47.A O no hydrogen 2.770 N/A GLY 99.A N ALA 96.A O no hydrogen 3.115 N/A LEU 100.A N HIS 98.A ND1 no hydrogen 3.201 N/A ARG 103.A N GLU 81.A O no hydrogen 2.707 N/A ARG 103.A NE GLU 81.A OE2 no hydrogen 3.049 N/A ARG 103.A NH1 GLU 153.A OE2 no hydrogen 2.771 N/A ARG 103.A NH2 GLU 81.A OE2 no hydrogen 3.154 N/A ASP 104.A N GLU 81.A O no hydrogen 3.300 N/A PHE 105.A N TYR 210.A OH no hydrogen 3.012 N/A LYS 106.A N ASP 104.A OD2 no hydrogen 3.229 N/A LYS 106.A NZ TYR 210.A O no hydrogen 3.228 N/A LYS 107.A N ASP 104.A O no hydrogen 3.248 N/A THR 108.A OG1 GLY 113.A O no hydrogen 3.370 N/A ASN 109.A N PRO 79.A O no hydrogen 2.932 N/A ASN 109.A ND2 TYR 49.A OH no hydrogen 3.403 N/A ALA 111.A N ASN 109.A OD1 no hydrogen 3.185 N/A TYR 112.A N ASN 109.A O no hydrogen 3.004 N/A TYR 112.A OH TYR 97.A O no hydrogen 2.552 N/A GLY 113.A N ASN 109.A O no hydrogen 3.354 N/A GLY 113.A N PRO 110.A O no hydrogen 3.023 N/A GLN 116.A N THR 114.A OG1 no hydrogen 3.070 N/A GLN 116.A NE2 GLN 116.A O no hydrogen 3.310 N/A ASP 117.A N THR 114.A OG1 no hydrogen 3.246 N/A PHE 118.A N THR 114.A O no hydrogen 2.837 N/A LYS 119.A N MET 115.A O no hydrogen 3.317 N/A ASN 120.A N GLN 116.A O no hydrogen 3.069 N/A LEU 121.A N ASP 117.A O no hydrogen 3.148 N/A ILE 122.A N PHE 118.A O no hydrogen 2.931 N/A ASP 123.A N LYS 119.A O no hydrogen 2.740 N/A THR 124.A N ASN 120.A O no hydrogen 2.825 N/A THR 124.A OG1 ASN 120.A O no hydrogen 2.758 N/A ALA 125.A N LEU 121.A O no hydrogen 2.975 N/A HIS 126.A N ILE 122.A O no hydrogen 2.992 N/A HIS 126.A ND1 ILE 130.A O no hydrogen 3.222 N/A ALA 127.A N ASP 123.A O no hydrogen 2.952 N/A HIS 128.A N ALA 125.A O no hydrogen 3.007 N/A HIS 128.A ND1 THR 124.A O no hydrogen 2.804 N/A ASN 129.A N HIS 126.A O no hydrogen 2.662 N/A ASN 129.A ND2 HIS 126.A O no hydrogen 2.905 N/A ILE 130.A N ALA 125.A O no hydrogen 2.716 N/A LYS 131.A N THR 72.A O no hydrogen 3.355 N/A LYS 131.A NZ ASN 8.A O no hydrogen 2.715 N/A LYS 131.A NZ ASP 15.A OD1 no hydrogen 2.613 N/A LYS 131.A NZ ASP 15.A OD2 no hydrogen 3.432 N/A VAL 132.A N ASP 224.A OD2 no hydrogen 2.873 N/A ILE 133.A N ILE 74.A O no hydrogen 3.005 N/A ILE 134.A N GLY 225.A O no hydrogen 3.140 N/A PHE 136.A N ARG 227.A O no hydrogen 3.017 N/A ASN 139.A ND2 HIS 140.A ND1 no hydrogen 2.969 N/A HIS 140.A NE2 LEU 100.A O no hydrogen 3.165 N/A THR 141.A N ALA 198.A O no hydrogen 3.211 N/A THR 141.A OG1 GLY 155.A O no hydrogen 3.035 N/A ALA 144.A N ASP 196.A O no hydrogen 3.230 N/A SER 150.A N ASP 148.A OD1 no hydrogen 2.906 N/A SER 150.A OG ASP 148.A OD1 no hydrogen 3.139 N/A PHE 151.A N ASP 148.A O no hydrogen 3.048 N/A ASN 154.A N PHE 151.A O no hydrogen 2.919 N/A ASN 154.A ND2 THR 168.A OG1 no hydrogen 3.302 N/A ARG 156.A N GLU 153.A O no hydrogen 3.272 N/A LEU 157.A N GLY 165.A O no hydrogen 3.146 N/A TYR 158.A N ARG 103.A O no hydrogen 3.031 N/A ASP 159.A N ASN 162.A O no hydrogen 2.529 N/A ASN 160.A N ASP 104.A OD2 no hydrogen 2.886 N/A ASN 162.A N ASP 159.A O no hydrogen 3.023 N/A LEU 164.A N LEU 157.A O no hydrogen 2.777 N/A TYR 167.A N ASN 154.A O no hydrogen 2.891 N/A TYR 167.A OH HIS 176.A O no hydrogen 2.720 N/A THR 168.A N ASN 154.A OD1 no hydrogen 3.276 N/A THR 168.A OG1 SER 145.A O no hydrogen 3.469 N/A THR 168.A OG1 SER 146.A O no hydrogen 2.697 N/A GLN 172.A NE2 GLN 172.A O no hydrogen 2.507 N/A LEU 174.A N ASP 170.A OD2 no hydrogen 3.009 N/A PHE 175.A N ASP 170.A OD1 no hydrogen 2.968 N/A HIS 176.A N ASP 199.A O no hydrogen 2.827 N/A THR 181.A N ASN 193.A O no hydrogen 2.869 N/A THR 181.A OG1 ASN 188.A OD1 no hydrogen 2.702 N/A ASP 182.A N ASN 188.A OD1 no hydrogen 3.425 N/A PHE 183.A N THR 181.A OG1 no hydrogen 2.826 N/A SER 184.A N ASP 182.A OD1 no hydrogen 3.481 N/A SER 184.A OG ASP 182.A OD1 no hydrogen 2.951 N/A THR 185.A OG1 GLN 628.A OE1 no hydrogen 3.036 N/A ASN 188.A N THR 185.A OG1 no hydrogen 2.853 N/A GLY 189.A N THR 185.A O no hydrogen 2.917 N/A ILE 190.A N GLU 187.A O no hydrogen 2.995 N/A TYR 191.A N GLU 187.A O no hydrogen 3.425 N/A TYR 191.A OH ASP 639.A OD2 no hydrogen 2.694 N/A LYS 192.A N ASN 188.A O no hydrogen 3.269 N/A LYS 192.A NZ GLY 180.A O no hydrogen 3.354 N/A ASN 193.A N GLY 179.A O no hydrogen 3.054 N/A ASN 193.A ND2 TYR 167.A OH no hydrogen 2.949 N/A LEU 197.A N LEU 194.A O no hydrogen 3.104 N/A ALA 198.A N SER 142.A O no hydrogen 3.048 N/A LEU 200.A N ASN 139.A O no hydrogen 3.419 N/A ASN 201.A N LEU 174.A O no hydrogen 2.893 N/A ASN 201.A ND2 ASN 173.A O no hydrogen 2.976 N/A HIS 202.A NE2 PRO 138.A O no hydrogen 2.730 N/A ASN 203.A ND2 ASN 203.A O no hydrogen 2.634 N/A ASN 203.A ND2 THR 677.A OG1 no hydrogen 3.375 N/A ASN 204.A ND2 ASN 173.A O no hydrogen 3.151 N/A SER 205.A OG THR 677.A OG1 no hydrogen 3.301 N/A SER 206.A N ASN 204.A OD1 no hydrogen 2.940 N/A SER 206.A OG GLN 172.A OE1 no hydrogen 3.101 N/A ASP 208.A N ASN 204.A O no hydrogen 2.939 N/A VAL 209.A N SER 205.A O no hydrogen 2.814 N/A TYR 210.A N SER 206.A O no hydrogen 3.014 N/A TYR 210.A OH TYR 158.A O no hydrogen 2.548 N/A LEU 211.A N VAL 207.A O no hydrogen 2.962 N/A LYS 212.A N ASP 208.A O no hydrogen 3.204 N/A LYS 212.A NZ ASP 208.A OD2 no hydrogen 2.854 N/A LYS 212.A NZ SER 241.A OG no hydrogen 3.273 N/A ASP 213.A N VAL 209.A O no hydrogen 2.981 N/A ALA 214.A N TYR 210.A O no hydrogen 2.968 N/A ILE 215.A N LEU 211.A O no hydrogen 3.225 N/A LYS 216.A N LYS 212.A O no hydrogen 3.328 N/A MET 217.A N ASP 213.A O no hydrogen 3.124 N/A TRP 218.A N ALA 214.A O no hydrogen 3.282 N/A TRP 218.A NE1 PHE 105.A O no hydrogen 2.861 N/A LEU 219.A N ILE 215.A O no hydrogen 2.896 N/A ASP 220.A N LYS 216.A O no hydrogen 2.769 N/A LEU 221.A N MET 217.A O no hydrogen 3.119 N/A GLY 222.A N LEU 219.A O no hydrogen 3.130 N/A ASP 224.A N VAL 132.A O no hydrogen 2.784 N/A ILE 226.A N PHE 253.A O no hydrogen 2.842 N/A ARG 227.A N ILE 134.A O no hydrogen 2.930 N/A ARG 227.A NE ASP 135.A OD1 no hydrogen 3.491 N/A ARG 227.A NH1 GLU 257.A OE2 no hydrogen 3.073 N/A ARG 227.A NH2 ASP 135.A OD2 no hydrogen 3.363 N/A VAL 228.A N PHE 255.A O no hydrogen 2.845 N/A ASP 229.A N PHE 136.A O no hydrogen 2.926 N/A HIS 233.A N ALA 230.A O no hydrogen 2.923 N/A HIS 233.A ND1 GLY 189.A O no hydrogen 2.857 N/A TRP 238.A N PRO 235.A O no hydrogen 2.855 N/A TRP 238.A NE1 ASP 208.A OD2 no hydrogen 2.786 N/A GLN 239.A N PRO 235.A O no hydrogen 3.093 N/A LYS 240.A N PHE 236.A O no hydrogen 3.102 N/A LYS 240.A NZ GLU 580.A OE1 no hydrogen 3.187 N/A LYS 240.A NZ GLU 580.A OE2 no hydrogen 3.427 N/A SER 241.A OG TRP 238.A O no hydrogen 2.825 N/A SER 241.A OG THR 588.A OG1 no hydrogen 2.763 N/A PHE 242.A N TRP 238.A O no hydrogen 2.934 N/A MET 243.A N GLN 239.A O no hydrogen 2.782 N/A ALA 244.A N LYS 240.A O no hydrogen 2.814 N/A THR 245.A N SER 241.A O no hydrogen 3.176 N/A THR 245.A N PHE 242.A O no hydrogen 3.287 N/A THR 245.A OG1 SER 241.A O no hydrogen 2.851 N/A ILE 246.A N PHE 242.A O no hydrogen 3.228 N/A ASN 247.A N MET 243.A O no hydrogen 2.896 N/A ASN 248.A N ALA 244.A O no hydrogen 3.101 N/A TYR 249.A N ILE 246.A O no hydrogen 2.942 N/A TYR 249.A OH ASP 220.A OD1 no hydrogen 3.269 N/A TYR 249.A OH ASP 220.A OD2 no hydrogen 2.808 N/A LYS 250.A N ILE 246.A O no hydrogen 2.882 N/A LYS 250.A NZ ASP 220.A OD2 no hydrogen 2.863 N/A PHE 253.A N LYS 9.A O no hydrogen 2.749 N/A THR 254.A OG1 VAL 252.A O no hydrogen 2.941 N/A PHE 255.A N ILE 226.A O no hydrogen 2.891 N/A GLY 256.A N SER 279.A O no hydrogen 2.840 N/A GLU 257.A N VAL 228.A O no hydrogen 3.438 N/A GLY 261.A N GLU 264.A OE2 no hydrogen 3.263 N/A GLU 268.A N GLU 268.A OE2 no hydrogen 2.845 N/A TYR 269.A OH LEU 281.A O no hydrogen 3.251 N/A TYR 269.A OH TYR 314.A OH no hydrogen 2.915 N/A GLN 271.A N PRO 267.A O no hydrogen 2.824 N/A PHE 272.A N GLU 268.A O no hydrogen 2.966 N/A ALA 273.A N TYR 269.A O no hydrogen 3.378 N/A ASN 274.A N HIS 270.A O no hydrogen 2.786 N/A ASN 274.A ND2 ASP 313.A O no hydrogen 3.333 N/A GLU 275.A N GLN 271.A O no hydrogen 2.761 N/A SER 276.A N PHE 272.A O no hydrogen 2.869 N/A SER 276.A OG PHE 272.A O no hydrogen 2.835 N/A MET 278.A N SER 276.A OG no hydrogen 2.948 N/A SER 279.A OG THR 254.A O no hydrogen 3.470 N/A SER 279.A OG ASP 319.A O no hydrogen 2.959 N/A LEU 280.A N GLN 320.A OE1 no hydrogen 3.292 N/A LEU 281.A N GLY 256.A O no hydrogen 3.037 N/A ASP 282.A N VAL 321.A O no hydrogen 2.625 N/A PHE 283.A N TYR 269.A OH no hydrogen 3.295 N/A PHE 283.A N LEU 281.A O no hydrogen 2.805 N/A ARG 284.A NH1 ASP 313.A OD2 no hydrogen 3.081 N/A PHE 285.A N ASP 282.A O no hydrogen 3.047 N/A ALA 286.A N ASP 282.A O no hydrogen 3.135 N/A GLN 287.A N PHE 283.A O no hydrogen 3.221 N/A GLN 287.A NE2 LEU 260.A O no hydrogen 2.905 N/A LYS 288.A NZ ASN 263.A OD1 no hydrogen 3.423 N/A LYS 288.A NZ GLN 291.A OE1 no hydrogen 2.950 N/A LYS 288.A NZ ASP 298.A OD1 no hydrogen 2.871 N/A ALA 289.A N PHE 285.A O no hydrogen 2.804 N/A ARG 290.A N ALA 286.A O no hydrogen 3.065 N/A ARG 290.A NH1 GLU 330.A O no hydrogen 3.357 N/A ARG 290.A NH2 ILE 324.A O no hydrogen 3.100 N/A ARG 290.A NH2 GLU 330.A O no hydrogen 2.945 N/A GLN 291.A N GLN 287.A O no hydrogen 3.181 N/A GLN 291.A N LYS 288.A O no hydrogen 3.127 N/A VAL 292.A N LYS 288.A O no hydrogen 3.154 N/A PHE 293.A N ALA 289.A O no hydrogen 2.821 N/A ARG 294.A N ARG 290.A O no hydrogen 2.979 N/A ARG 294.A NE PHE 332.A O no hydrogen 3.109 N/A ARG 294.A NH2 ARG 331.A O no hydrogen 3.402 N/A ASP 295.A N ARG 290.A O no hydrogen 2.738 N/A THR 297.A N GLN 291.A O no hydrogen 2.746 N/A ASN 299.A N ASP 298.A OD2 no hydrogen 2.764 N/A MET 300.A N ASN 416.A O no hydrogen 3.178 N/A TYR 301.A N ASN 299.A OD1 no hydrogen 2.967 N/A GLY 302.A N ASN 299.A O no hydrogen 3.066 N/A LYS 304.A N MET 300.A O no hydrogen 2.917 N/A LYS 304.A NZ GLU 308.A OE1 no hydrogen 2.905 N/A LYS 304.A NZ GLU 411.A OE1 no hydrogen 3.161 N/A ALA 305.A N TYR 301.A O no hydrogen 3.133 N/A MET 306.A N GLY 302.A O no hydrogen 3.066 N/A LEU 307.A N LEU 303.A O no hydrogen 3.027 N/A GLU 308.A N LYS 304.A O no hydrogen 3.025 N/A GLY 309.A N ALA 305.A O no hydrogen 2.648 N/A SER 310.A N MET 306.A O no hydrogen 2.977 N/A SER 310.A OG MET 306.A O no hydrogen 2.972 N/A VAL 312.A N GLY 309.A O no hydrogen 3.416 N/A ASP 313.A N GLY 309.A O no hydrogen 3.058 N/A TYR 314.A N SER 310.A O no hydrogen 3.391 N/A TYR 314.A OH TYR 269.A OH no hydrogen 2.915 N/A TYR 314.A OH ASP 282.A OD2 no hydrogen 2.631 N/A ALA 315.A N ASN 274.A OD1 no hydrogen 2.899 N/A ASN 318.A ND2 TYR 406.A O no hydrogen 3.349 N/A ASN 318.A ND2 GLY 502.A O no hydrogen 3.013 N/A ASP 319.A N GLN 316.A O no hydrogen 3.313 N/A GLN 320.A N VAL 317.A O no hydrogen 3.330 N/A GLN 320.A NE2 GLN 316.A O no hydrogen 2.694 N/A VAL 321.A N LEU 280.A O no hydrogen 3.245 N/A THR 322.A N VAL 355.A O no hydrogen 2.807 N/A THR 322.A OG1 VAL 355.A O no hydrogen 3.236 N/A ASP 328.A N ASN 326.A OD1 no hydrogen 2.857 N/A MET 329.A N ASN 326.A O no hydrogen 3.440 N/A ARG 331.A N GLY 368.A O no hydrogen 2.971 N/A ARG 331.A NH1 TYR 360.A O no hydrogen 2.988 N/A ARG 331.A NH2 TYR 360.A O no hydrogen 3.549 N/A ARG 331.A NH2 ASN 374.A O no hydrogen 3.550 N/A PHE 332.A N ASP 325.A OD2 no hydrogen 2.694 N/A HIS 333.A ND1 TYR 365.A O no hydrogen 2.750 N/A THR 334.A OG1 ASN 336.A OD1 no hydrogen 2.934 N/A ARG 340.A NE GLY 485.A O no hydrogen 3.186 N/A LYS 341.A N ASP 338.A O no hydrogen 3.152 N/A LYS 341.A NZ ASP 338.A OD2 no hydrogen 2.749 N/A GLU 343.A N ARG 339.A O no hydrogen 2.843 N/A GLN 344.A N ARG 340.A O no hydrogen 2.835 N/A GLN 344.A NE2 ASN 435.A O no hydrogen 2.806 N/A GLN 344.A NE2 GLY 486.A O no hydrogen 3.300 N/A GLN 344.A NE2 THR 487.A OG1 no hydrogen 3.228 N/A ALA 345.A N LYS 341.A O no hydrogen 2.914 N/A LEU 346.A N LEU 342.A O no hydrogen 2.951 N/A ALA 347.A N GLU 343.A O no hydrogen 3.311 N/A PHE 348.A N GLN 344.A O no hydrogen 2.805 N/A THR 349.A N ALA 345.A O no hydrogen 3.025 N/A THR 349.A OG1 ALA 345.A O no hydrogen 2.825 N/A LEU 350.A N LEU 346.A O no hydrogen 2.885 N/A THR 351.A N ALA 347.A O no hydrogen 3.007 N/A THR 351.A OG1 ALA 347.A O no hydrogen 2.946 N/A THR 351.A OG1 TYR 421.A OH no hydrogen 2.510 N/A SER 352.A N PHE 348.A O no hydrogen 3.095 N/A SER 352.A OG PHE 348.A O no hydrogen 2.640 N/A ARG 353.A NH1 ASP 282.A OD1 no hydrogen 3.362 N/A ARG 353.A NH1 ARG 353.A O no hydrogen 2.756 N/A ARG 353.A NH2 ASP 282.A OD1 no hydrogen 3.352 N/A VAL 355.A N GLN 320.A O no hydrogen 2.982 N/A ALA 357.A N THR 322.A O no hydrogen 2.912 N/A ILE 358.A N ILE 17.A O no hydrogen 2.736 N/A TYR 359.A OH ASN 374.A O no hydrogen 2.689 N/A TYR 360.A N GLN 19.A O no hydrogen 2.858 N/A TYR 360.A OH ALA 376.A O no hydrogen 2.825 N/A GLY 361.A N TYR 18.A OH no hydrogen 3.336 N/A SER 362.A N TYR 359.A O no hydrogen 3.171 N/A SER 362.A OG TYR 359.A O no hydrogen 2.604 N/A GLU 363.A N GLU 363.A OE2 no hydrogen 2.684 N/A GLN 364.A N GLY 361.A O no hydrogen 3.144 N/A GLN 364.A NE2 SER 382.A O no hydrogen 3.117 N/A TYR 365.A OH GLU 343.A OE1 no hydrogen 2.851 N/A MET 366.A N GLY 361.A O no hydrogen 3.315 N/A SER 367.A OG HIS 333.A O no hydrogen 3.247 N/A ASP 373.A N ASN 370.A O no hydrogen 2.761 N/A ASN 374.A ND2 HIS 327.A O no hydrogen 3.296 N/A ASN 374.A ND2 MET 329.A O no hydrogen 3.123 N/A ARG 375.A N PRO 372.A O no hydrogen 2.836 N/A ARG 375.A NE ASN 374.A OD1 no hydrogen 3.520 N/A ARG 375.A NH1 TYR 97.A OH no hydrogen 3.188 N/A ARG 375.A NH2 HIS 327.A O no hydrogen 3.345 N/A ARG 377.A NH2 GLY 41.A O no hydrogen 3.295 N/A LEU 378.A N ARG 24.A O no hydrogen 3.317 N/A SER 380.A OG GLN 364.A OE1 no hydrogen 3.090 N/A THR 384.A OG1 SER 382.A OG no hydrogen 2.942 N/A THR 385.A OG1 GLU 363.A O no hydrogen 2.747 N/A ALA 387.A N TYR 365.A OH no hydrogen 2.693 N/A TYR 388.A N THR 385.A OG1 no hydrogen 3.282 N/A TYR 388.A OH TYR 65.A O no hydrogen 2.706 N/A GLN 389.A N THR 385.A O no hydrogen 3.178 N/A VAL 390.A N THR 386.A O no hydrogen 2.775 N/A ILE 391.A N ALA 387.A O no hydrogen 3.122 N/A GLN 392.A N TYR 388.A O no hydrogen 2.899 N/A GLN 392.A NE2 GLY 68.A O no hydrogen 3.407 N/A LYS 393.A N GLN 389.A O no hydrogen 2.792 N/A LYS 393.A N VAL 390.A O no hydrogen 3.198 N/A LEU 394.A N VAL 390.A O no hydrogen 2.946 N/A ALA 395.A N ILE 391.A O no hydrogen 2.807 N/A LEU 397.A N LEU 394.A O no hydrogen 2.892 N/A ARG 398.A N ALA 395.A O no hydrogen 3.299 N/A ARG 398.A NE LEU 350.A O no hydrogen 3.472 N/A ARG 398.A NH1 SER 13.A O no hydrogen 2.462 N/A LYS 399.A N PRO 396.A O no hydrogen 3.142 N/A LYS 399.A NZ THR 4.A O no hydrogen 2.817 N/A LYS 399.A NZ THR 14.A OG1 no hydrogen 3.233 N/A LYS 399.A NZ ASP 15.A OD2 no hydrogen 3.296 N/A SER 400.A N PRO 396.A O no hydrogen 3.243 N/A SER 400.A N LEU 397.A O no hydrogen 3.248 N/A SER 400.A OG PRO 396.A O no hydrogen 3.152 N/A SER 400.A OG LEU 397.A O no hydrogen 3.529 N/A ASN 401.A N LEU 397.A O no hydrogen 2.766 N/A ASN 401.A ND2 VAL 429.A O no hydrogen 3.234 N/A ALA 403.A N ASN 401.A OD1 no hydrogen 3.005 N/A ILE 404.A N ASN 401.A O no hydrogen 2.977 N/A TYR 406.A N PRO 402.A O no hydrogen 2.881 N/A TYR 406.A OH ASP 3.A OD2 no hydrogen 2.479 N/A GLY 407.A N ALA 403.A O no hydrogen 2.986 N/A SER 408.A N LYS 424.A O no hydrogen 3.354 N/A HIS 410.A N GLU 422.A O no hydrogen 2.841 N/A ARG 412.A N ILE 420.A O no hydrogen 2.824 N/A ARG 412.A NE GLU 422.A OE2 no hydrogen 3.403 N/A ARG 412.A NH2 GLU 422.A OE2 no hydrogen 3.481 N/A TRP 413.A N ILE 420.A O no hydrogen 3.318 N/A ASN 415.A N VAL 418.A O no hydrogen 2.867 N/A ILE 419.A N ILE 434.A O no hydrogen 3.061 N/A ILE 420.A N TRP 413.A O no hydrogen 2.815 N/A TYR 421.A N VAL 432.A O no hydrogen 3.050 N/A TYR 421.A OH THR 351.A OG1 no hydrogen 2.510 N/A GLU 422.A N HIS 410.A O no hydrogen 2.703 N/A ARG 423.A N ALA 430.A O no hydrogen 2.961 N/A ARG 423.A NE GLY 407.A O no hydrogen 3.358 N/A ARG 423.A NE SER 408.A O no hydrogen 3.234 N/A ARG 423.A NH1 ILE 404.A O no hydrogen 2.953 N/A ARG 423.A NH1 GLY 407.A O no hydrogen 2.829 N/A ARG 423.A NH2 THR 351.A O no hydrogen 2.562 N/A ARG 423.A NH2 ILE 404.A O no hydrogen 2.845 N/A PHE 425.A N ASN 428.A O no hydrogen 3.073 N/A ASN 427.A ND2 ASP 495.A O no hydrogen 3.235 N/A ASN 428.A N PHE 425.A O no hydrogen 3.335 N/A ASN 428.A ND2 PHE 425.A O no hydrogen 3.072 N/A ASN 428.A ND2 THR 494.A O no hydrogen 3.669 N/A VAL 429.A N TYR 492.A O no hydrogen 2.905 N/A ALA 430.A N ARG 423.A O no hydrogen 3.035 N/A VAL 431.A N TRP 490.A O no hydrogen 2.793 N/A VAL 432.A N TYR 421.A O no hydrogen 2.978 N/A ALA 433.A N ALA 488.A O no hydrogen 3.025 N/A ILE 434.A N ILE 419.A O no hydrogen 3.007 N/A ASN 435.A N GLY 486.A O no hydrogen 3.048 N/A ASN 435.A ND2 THR 440.A O no hydrogen 3.279 N/A ASN 435.A ND2 LEU 482.A O no hydrogen 3.413 N/A ASN 435.A ND2 ALA 483.A O no hydrogen 3.238 N/A ARG 436.A N ASP 417.A O no hydrogen 2.814 N/A ARG 436.A NE ASP 417.A OD2 no hydrogen 3.262 N/A ARG 436.A NH1 VAL 292.A O no hydrogen 2.779 N/A ARG 436.A NH1 ASP 298.A O no hydrogen 2.881 N/A ARG 436.A NH2 ASP 417.A OD2 no hydrogen 3.359 N/A ASN 437.A N ASN 435.A OD1 no hydrogen 3.058 N/A ASN 437.A ND2 ASP 417.A OD1 no hydrogen 3.511 N/A ASN 439.A N ASN 437.A OD1 no hydrogen 2.673 N/A THR 440.A N ASN 437.A OD1 no hydrogen 2.989 N/A ALA 442.A N LEU 482.A O no hydrogen 2.807 N/A ILE 444.A N PHE 480.A O no hydrogen 2.764 N/A GLY 446.A N ASN 479.A OD1 no hydrogen 3.445 N/A THR 449.A N GLY 475.A O no hydrogen 2.974 N/A THR 449.A OG1 GLY 475.A O no hydrogen 2.771 N/A SER 450.A N GLU 422.A OE1 no hydrogen 2.914 N/A SER 450.A OG GLU 422.A OE2 no hydrogen 2.950 N/A GLY 454.A N VAL 471.A O no hydrogen 2.736 N/A TYR 456.A N LEU 469.A O no hydrogen 2.704 N/A TYR 456.A OH PRO 452.A O no hydrogen 2.809 N/A VAL 459.A N VAL 489.A O no hydrogen 2.916 N/A LEU 460.A N ASP 458.A OD1 no hydrogen 2.877 N/A GLY 461.A N ASP 458.A O no hydrogen 3.215 N/A GLY 462.A N ASP 458.A OD2 no hydrogen 3.071 N/A ASN 465.A N GLY 462.A O no hydrogen 2.727 N/A ASN 465.A ND2 GLY 462.A O no hydrogen 3.674 N/A LEU 469.A N TYR 456.A O no hydrogen 2.706 N/A VAL 471.A N GLY 454.A O no hydrogen 2.627 N/A GLY 472.A N ALA 476.A O no hydrogen 2.698 N/A ALA 477.A N LEU 447.A O no hydrogen 3.007 N/A SER 478.A N THR 470.A O no hydrogen 3.124 N/A SER 478.A OG THR 470.A O no hydrogen 3.420 N/A PHE 480.A N ILE 444.A O no hydrogen 3.432 N/A LEU 482.A N ALA 442.A O no hydrogen 2.707 N/A GLY 485.A N ASN 437.A O no hydrogen 2.537 N/A GLY 486.A N ALA 483.A O no hydrogen 2.796 N/A THR 487.A N LEU 464.A O no hydrogen 3.150 N/A THR 487.A OG1 GLY 486.A O no hydrogen 2.819 N/A ALA 488.A N ALA 433.A O no hydrogen 2.992 N/A VAL 489.A N ASP 458.A OD1 no hydrogen 3.272 N/A TRP 490.A N VAL 431.A O no hydrogen 2.934 N/A TRP 490.A NE1 ASN 467.A O no hydrogen 2.883 N/A TYR 492.A N VAL 429.A O no hydrogen 2.930 N/A THR 493.A OG1 ASN 428.A OD1 no hydrogen 3.250 N/A THR 494.A N ASN 428.A OD1 no hydrogen 3.221 N/A ILE 500.A N ARG 520.A O no hydrogen 2.948 N/A ILE 501.A N ASN 574.A OD1 no hydrogen 2.950 N/A GLY 502.A N ASP 518.A O no hydrogen 2.643 N/A ASN 503.A N ASP 518.A O no hydrogen 3.229 N/A ASN 503.A ND2 ASP 319.A OD1 no hydrogen 3.411 N/A ASN 503.A ND2 ASP 319.A OD2 no hydrogen 3.409 N/A GLY 505.A N THR 516.A O no hydrogen 3.203 N/A ALA 509.A N GLU 580.A O no hydrogen 3.164 N/A LYS 510.A N ASN 248.A OD1 no hydrogen 3.154 N/A LYS 510.A NZ ASP 585.A OD1 no hydrogen 2.772 N/A GLY 512.A N ILE 553.A O no hydrogen 2.799 N/A VAL 513.A N LYS 510.A O no hydrogen 3.397 N/A ILE 515.A N VAL 551.A O no hydrogen 3.001 N/A THR 516.A N GLY 505.A O no hydrogen 2.938 N/A THR 516.A OG1 GLN 10.A OE1 no hydrogen 3.359 N/A THR 516.A OG1 GLN 550.A OE1 no hydrogen 3.376 N/A ILE 517.A N ILE 549.A O no hydrogen 2.845 N/A ASP 518.A N ASN 503.A O no hydrogen 2.909 N/A GLY 519.A N THR 547.A O no hydrogen 2.964 N/A ARG 520.A N ILE 500.A O no hydrogen 3.225 N/A ARG 520.A NH2 ASP 3.A OD2 no hydrogen 2.971 N/A ARG 520.A NH2 GLY 519.A O no hydrogen 2.727 N/A GLY 521.A N ASP 546.A OD1 no hydrogen 3.479 N/A PHE 522.A N ASP 546.A O no hydrogen 3.228 N/A GLY 523.A N ASP 546.A OD2 no hydrogen 3.065 N/A THR 528.A N ALA 566.A O no hydrogen 2.658 N/A VAL 529.A N VAL 536.A O no hydrogen 3.180 N/A TYR 530.A N ARG 564.A O no hydrogen 2.792 N/A PHE 531.A N THR 534.A O no hydrogen 2.771 N/A GLY 532.A N ASP 562.A O no hydrogen 3.007 N/A THR 534.A N PHE 531.A O no hydrogen 3.080 N/A VAL 536.A N VAL 529.A O no hydrogen 2.645 N/A ILE 541.A N GLY 538.A O no hydrogen 3.065 N/A ALA 543.A N GLN 550.A O no hydrogen 2.954 N/A TRP 544.A NE1 PHE 522.A O no hydrogen 2.883 N/A GLN 548.A NE2 ASP 518.A OD2 no hydrogen 3.030 N/A ILE 549.A N ILE 517.A O no hydrogen 3.011 N/A GLN 550.A N ALA 543.A O no hydrogen 2.735 N/A VAL 551.A N ILE 515.A O no hydrogen 3.246 N/A LYS 552.A N ASP 540.A O no hydrogen 2.962 N/A ILE 553.A N VAL 513.A O no hydrogen 2.855 N/A GLY 559.A N VAL 581.A O no hydrogen 3.043 N/A TYR 561.A N PHE 579.A O no hydrogen 2.808 N/A TYR 561.A OH PRO 557.A O no hydrogen 2.636 N/A ILE 563.A N TYR 576.A O no hydrogen 2.736 N/A ARG 564.A N TYR 530.A O no hydrogen 3.185 N/A ALA 566.A N THR 528.A O no hydrogen 2.703 N/A ASN 567.A N ALA 571.A O no hydrogen 2.996 N/A ALA 569.A N ASN 567.A OD1 no hydrogen 3.116 N/A GLY 570.A N ASN 567.A O no hydrogen 2.945 N/A ALA 571.A N ASN 567.A OD1 no hydrogen 2.805 N/A SER 573.A N VAL 565.A O no hydrogen 2.697 N/A SER 573.A OG VAL 565.A O no hydrogen 2.858 N/A ASN 574.A ND2 ILE 501.A O no hydrogen 3.645 N/A TYR 576.A N ILE 563.A O no hydrogen 2.903 N/A PHE 579.A N TYR 561.A O no hydrogen 2.954 N/A GLU 580.A N MET 507.A O no hydrogen 2.891 N/A VAL 581.A N GLY 559.A O no hydrogen 3.144 N/A LEU 582.A N ALA 509.A O no hydrogen 2.982 N/A THR 583.A N GLU 612.A OE1 no hydrogen 3.289 N/A THR 583.A OG1 GLU 612.A OE2 no hydrogen 2.467 N/A GLN 586.A NE2 GLU 612.A OE1 no hydrogen 3.308 N/A GLN 586.A NE2 SER 641.A OG no hydrogen 3.144 N/A VAL 587.A N VAL 642.A O no hydrogen 3.014 N/A VAL 589.A N VAL 640.A O no hydrogen 2.764 N/A ARG 590.A N ALA 678.A O no hydrogen 2.944 N/A ARG 590.A NE ASP 639.A OD1 no hydrogen 3.229 N/A PHE 591.A N TYR 638.A O no hydrogen 2.817 N/A VAL 592.A N VAL 680.A O no hydrogen 2.617 N/A ILE 593.A N TRP 636.A O no hydrogen 3.009 N/A ASN 594.A N VAL 682.A O no hydrogen 2.631 N/A ASN 594.A ND2 THR 635.A OG1 no hydrogen 3.000 N/A ALA 596.A N PRO 634.A O no hydrogen 3.119 N/A THR 598.A N TYR 633.A OH no hydrogen 2.756 N/A THR 598.A OG1 GLN 602.A O no hydrogen 3.479 N/A ALA 599.A N GLN 602.A OE1 no hydrogen 3.020 N/A GLN 602.A N ALA 599.A O no hydrogen 2.929 N/A ASN 603.A N LYS 655.A O no hydrogen 3.217 N/A PHE 605.A N LEU 653.A O no hydrogen 2.789 N/A LEU 606.A N ILE 622.A O no hydrogen 2.858 N/A THR 607.A N LYS 651.A O no hydrogen 3.207 N/A THR 607.A OG1 LEU 613.A O no hydrogen 2.859 N/A GLY 608.A N LEU 613.A O no hydrogen 2.916 N/A ASN 609.A N GLU 649.A O no hydrogen 2.942 N/A SER 611.A OG GLU 612.A OE2 no hydrogen 3.010 N/A GLU 612.A N GLU 612.A OE2 no hydrogen 2.625 N/A LEU 613.A N VAL 610.A O no hydrogen 2.902 N/A GLY 614.A N SER 611.A O no hydrogen 3.043 N/A ASN 615.A N VAL 610.A O no hydrogen 3.179 N/A TRP 616.A N GLY 608.A O no hydrogen 2.891 N/A ASP 617.A N GLY 614.A O no hydrogen 3.342 N/A ASN 619.A N ASP 617.A OD2 no hydrogen 2.988 N/A ASN 620.A N ASP 617.A O no hydrogen 2.831 N/A ILE 622.A N LEU 606.A O no hydrogen 2.776 N/A MET 625.A N VAL 604.A O no hydrogen 2.908 N/A TYR 626.A N TYR 637.A O no hydrogen 2.674 N/A GLN 628.A N GLU 187.A OE1 no hydrogen 2.983 N/A VAL 629.A N GLU 187.A OE1 no hydrogen 3.021 N/A VAL 630.A N TYR 637.A OH no hydrogen 3.068 N/A TYR 633.A N ASN 627.A O no hydrogen 2.968 N/A THR 635.A N GLN 632.A O no hydrogen 2.836 N/A TRP 636.A N ILE 593.A O no hydrogen 3.052 N/A TYR 637.A N TYR 626.A O no hydrogen 2.651 N/A TYR 637.A OH GLU 187.A OE1 no hydrogen 2.476 N/A TYR 638.A N PHE 591.A O no hydrogen 3.018 N/A VAL 640.A N VAL 589.A O no hydrogen 2.890 N/A VAL 642.A N VAL 587.A O no hydrogen 3.060 N/A ALA 644.A N ASP 585.A O no hydrogen 2.707 N/A GLY 645.A N PRO 673.A O no hydrogen 3.210 N/A GLN 646.A N THR 672.A OG1 no hydrogen 2.862 N/A THR 647.A OG1 THR 671.A OG1 no hydrogen 2.758 N/A ILE 648.A N PHE 670.A O no hydrogen 3.036 N/A GLU 649.A N ASN 609.A OD1 no hydrogen 2.940 N/A PHE 650.A N ARG 668.A O no hydrogen 2.902 N/A LYS 651.A N THR 607.A O no hydrogen 3.060 N/A LYS 651.A NZ GLU 663.A O no hydrogen 2.865 N/A LYS 651.A NZ GLY 665.A O no hydrogen 3.346 N/A PHE 652.A N GLU 663.A OE1 no hydrogen 3.173 N/A LEU 653.A N PHE 605.A O no hydrogen 2.940 N/A LYS 654.A N THR 661.A O no hydrogen 2.782 N/A LYS 654.A NZ THR 597.A O no hydrogen 2.575 N/A LYS 655.A N ASN 603.A O no hydrogen 2.997 N/A LYS 655.A NZ PRO 618.A O no hydrogen 3.120 N/A GLN 656.A N THR 659.A O no hydrogen 2.787 N/A THR 659.A N GLN 656.A O no hydrogen 2.898 N/A THR 661.A N LYS 654.A O no hydrogen 2.840 N/A THR 661.A OG1 GLN 656.A OE1 no hydrogen 3.186 N/A GLU 663.A N PHE 652.A O no hydrogen 3.417 N/A GLY 664.A N GLN 685.A O no hydrogen 2.774 N/A ASN 667.A ND2 GLU 649.A OE1 no hydrogen 3.115 N/A ARG 668.A N PHE 650.A O no hydrogen 3.057 N/A ARG 668.A NE GLU 663.A OE1 no hydrogen 3.235 N/A ARG 668.A NH1 GLU 663.A OE2 no hydrogen 2.783 N/A ARG 668.A NH1 ASN 683.A O no hydrogen 2.897 N/A PHE 670.A N ILE 648.A O no hydrogen 3.085 N/A THR 671.A OG1 THR 647.A OG1 no hydrogen 2.758 N/A THR 672.A N GLN 646.A O no hydrogen 2.986 N/A THR 672.A OG1 PRO 643.A O no hydrogen 2.673 N/A THR 672.A OG1 GLN 646.A O no hydrogen 3.018 N/A THR 677.A N SER 205.A OG no hydrogen 3.279 N/A THR 677.A OG1 ASN 203.A O no hydrogen 2.274 N/A THR 677.A OG1 SER 205.A OG no hydrogen 3.301 N/A THR 679.A OG1 ASN 203.A OD1 no hydrogen 3.467 N/A VAL 680.A N ARG 590.A O no hydrogen 2.785 N/A VAL 682.A N VAL 592.A O no hydrogen 2.927 N/A TRP 684.A N ASN 594.A O no hydrogen 2.766 N/A