Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vf7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N VAL 23.A O no hydrogen 2.737 N/A GLN 7.A N ASP 79.A O no hydrogen 2.873 N/A GLN 7.A NE2 VAL 8.A O no hydrogen 3.333 N/A VAL 8.A N VAL 21.A O no hydrogen 2.818 N/A ARG 9.A N ALA 77.A O no hydrogen 2.919 N/A ALA 11.A N ILE 19.A O no hydrogen 3.093 N/A ARG 12.A N ASP 74.A O no hydrogen 3.079 N/A ARG 12.A NH1 ASP 18.A OD2 no hydrogen 2.611 N/A ARG 12.A NH1 ASP 76.A OD2 no hydrogen 3.463 N/A ARG 12.A NH2 ASP 76.A OD1 no hydrogen 3.050 N/A GLN 13.A NE2 HIS 14.A NE2 no hydrogen 3.392 N/A HIS 14.A ND1 SER 41.A OG no hydrogen 2.480 N/A ASN 15.A ND2 GLY 36.A O no hydrogen 3.506 N/A ASN 15.A ND2 SER 37.A O no hydrogen 3.353 N/A ASN 15.A ND2 GLY 448.A O no hydrogen 2.850 N/A LEU 16.A N GLN 13.A O no hydrogen 3.010 N/A LYS 17.A N GLY 452.A O no hydrogen 2.975 N/A LYS 17.A NZ GLU 449.A O no hydrogen 3.086 N/A ILE 19.A N ALA 11.A O no hydrogen 2.956 N/A VAL 21.A N VAL 8.A O no hydrogen 2.979 N/A VAL 23.A N VAL 6.A O no hydrogen 2.998 N/A ARG 25.A N GLY 4.A O no hydrogen 2.664 N/A ARG 25.A NE GLY 80.A O no hydrogen 3.269 N/A ARG 25.A NH2 GLY 80.A O no hydrogen 2.638 N/A ASP 26.A N SER 423.A OG no hydrogen 2.724 N/A LEU 28.A N ASP 438.A OD1 no hydrogen 2.951 N/A VAL 29.A N LEU 424.A O no hydrogen 2.885 N/A VAL 30.A N TRP 439.A O no hydrogen 3.115 N/A PHE 31.A N VAL 426.A O no hydrogen 2.737 N/A THR 32.A N VAL 441.A O no hydrogen 2.790 N/A THR 32.A OG1 ASP 442.A OD2 no hydrogen 2.556 N/A SER 35.A N ASP 741.A OD2 no hydrogen 3.208 N/A SER 35.A OG ASP 741.A OD2 no hydrogen 3.076 N/A SER 37.A N VAL 34.A O no hydrogen 3.273 N/A SER 37.A OG VAL 34.A O no hydrogen 3.070 N/A SER 37.A OG VAL 443.A O no hydrogen 3.207 N/A LYS 39.A NZ GLY 33.A O no hydrogen 2.807 N/A LYS 39.A NZ VAL 34.A O no hydrogen 2.957 N/A LYS 39.A NZ HIS 429.A NE2 no hydrogen 3.347 N/A SER 41.A OG HIS 14.A ND1 no hydrogen 2.480 N/A LEU 42.A N GLY 38.A O no hydrogen 3.186 N/A ALA 43.A N LYS 39.A O no hydrogen 3.025 N/A PHE 44.A N SER 40.A O no hydrogen 2.874 N/A GLY 45.A N SER 40.A O no hydrogen 2.895 N/A THR 46.A OG1 SER 41.A O no hydrogen 2.843 N/A LEU 47.A N LEU 42.A O no hydrogen 2.887 N/A TYR 48.A N ALA 43.A O no hydrogen 3.034 N/A ALA 49.A N PHE 44.A O no hydrogen 3.173 N/A GLU 50.A N THR 46.A O no hydrogen 2.992 N/A ALA 51.A N LEU 47.A O no hydrogen 3.116 N/A GLN 52.A N TYR 48.A O no hydrogen 2.978 N/A ARG 53.A N ALA 49.A O no hydrogen 3.113 N/A ARG 54.A N GLU 50.A O no hydrogen 3.155 N/A ARG 54.A NE GLU 50.A OE2 no hydrogen 3.132 N/A ARG 54.A NH1 ILE 78.A O no hydrogen 3.126 N/A ARG 54.A NH2 GLU 50.A OE2 no hydrogen 3.352 N/A ARG 54.A NH2 ILE 78.A O no hydrogen 3.017 N/A TYR 55.A N ALA 51.A O no hydrogen 3.491 N/A LEU 56.A N GLN 52.A O no hydrogen 3.104 N/A GLU 57.A N ARG 53.A O no hydrogen 3.212 N/A SER 58.A N ARG 54.A O no hydrogen 3.242 N/A SER 58.A N TYR 55.A O no hydrogen 2.958 N/A SER 58.A OG ARG 54.A O no hydrogen 3.193 N/A VAL 59.A N TYR 55.A O no hydrogen 2.977 N/A SER 60.A N LEU 56.A O no hydrogen 2.894 N/A PHE 67.A N ARG 64.A O no hydrogen 3.146 N/A GLN 69.A N LEU 66.A O no hydrogen 2.821 N/A GLY 71.A N PHE 67.A O no hydrogen 2.784 N/A ASP 74.A N GLN 13.A OE1 no hydrogen 2.838 N/A ASP 76.A N GLY 10.A O no hydrogen 3.414 N/A ALA 77.A N ARG 9.A O no hydrogen 3.167 N/A ASP 79.A N GLN 7.A O no hydrogen 2.925 N/A VAL 85.A N VAL 392.A O no hydrogen 2.869 N/A LEU 87.A N VAL 394.A O no hydrogen 3.214 N/A THR 93.A N ALA 90.A O no hydrogen 3.082 N/A THR 93.A OG1 GLN 89.A OE1 no hydrogen 2.986 N/A THR 93.A OG1 ALA 90.A O no hydrogen 2.770 N/A SER 98.A N THR 367.A OG1 no hydrogen 2.954 N/A SER 99.A OG SER 102.A OG no hydrogen 3.145 N/A VAL 100.A N ARG 365.A O no hydrogen 2.905 N/A GLY 101.A N LEU 363.A O no hydrogen 3.109 N/A SER 102.A N SER 99.A O no hydrogen 3.324 N/A SER 102.A OG SER 99.A OG no hydrogen 3.145 N/A VAL 103.A N SER 99.A O no hydrogen 3.303 N/A THR 104.A N VAL 100.A O no hydrogen 3.078 N/A THR 104.A OG1 VAL 100.A O no hydrogen 2.681 N/A THR 105.A N SER 102.A O no hydrogen 3.334 N/A SER 107.A N GLY 101.A O no hydrogen 2.899 N/A LEU 110.A N LEU 106.A O no hydrogen 3.186 N/A ARG 111.A N SER 107.A O no hydrogen 3.243 N/A ARG 111.A N ASN 108.A O no hydrogen 2.971 N/A MET 112.A N ASN 108.A O no hydrogen 3.291 N/A LEU 113.A N LEU 109.A O no hydrogen 3.102 N/A TYR 114.A N LEU 110.A O no hydrogen 3.283 N/A TYR 114.A OH LEU 297.A O no hydrogen 2.757 N/A SER 115.A N ARG 111.A O no hydrogen 2.962 N/A SER 115.A OG VAL 127.A O no hydrogen 2.805 N/A ALA 117.A N LEU 113.A O no hydrogen 2.978 N/A ASP 119.A N THR 293.A O no hydrogen 3.042 N/A GLN 124.A NE2 GLU 288.A O no hydrogen 3.146 N/A VAL 127.A N TYR 120.A OH no hydrogen 2.794 N/A GLY 131.A N TYR 128.A O no hydrogen 2.718 N/A THR 136.A OG1 GLU 130.A O no hydrogen 2.417 N/A THR 136.A OG1 SER 133.A O no hydrogen 3.113 N/A GLY 139.A N THR 136.A O no hydrogen 3.007 N/A ALA 140.A N THR 136.A O no hydrogen 2.787 N/A CYS 141.A N ARG 284.A O no hydrogen 3.158 N/A HIS 145.A N CYS 141.A O no hydrogen 2.724 N/A ARG 149.A NE SER 274.A OG no hydrogen 2.957 N/A ARG 149.A NH2 SER 274.A OG no hydrogen 2.770 N/A VAL 150.A N GLU 275.A O no hydrogen 2.694 N/A THR 152.A N ILE 273.A O no hydrogen 3.218 N/A THR 154.A N SER 157.A OG no hydrogen 2.862 N/A THR 154.A OG1 SER 157.A OG no hydrogen 3.093 N/A SER 157.A N THR 154.A OG1 no hydrogen 3.181 N/A SER 157.A OG THR 154.A O no hydrogen 3.074 N/A SER 157.A OG THR 154.A OG1 no hydrogen 3.093 N/A SER 157.A OG TYR 271.A O no hydrogen 3.131 N/A MET 158.A N THR 154.A O no hydrogen 3.079 N/A VAL 159.A N GLU 155.A O no hydrogen 2.664 N/A SER 163.A N ASP 161.A OD1 no hydrogen 3.073 N/A SER 163.A OG ASP 161.A OD1 no hydrogen 2.370 N/A THR 165.A N GLU 168.A OE2 no hydrogen 3.009 N/A ARG 167.A N VAL 194.A O no hydrogen 2.892 N/A ARG 167.A NE ASP 195.A OD1 no hydrogen 2.510 N/A ARG 167.A NH2 ASP 195.A OD2 no hydrogen 3.007 N/A GLU 168.A N THR 165.A O no hydrogen 2.911 N/A ARG 169.A N ILE 166.A O no hydrogen 3.015 N/A ARG 169.A NH1 ALA 177.A O no hydrogen 3.488 N/A ARG 169.A NH2 ALA 177.A O no hydrogen 3.001 N/A ALA 170.A N THR 165.A O no hydrogen 3.058 N/A TRP 174.A N VAL 171.A O no hydrogen 3.162 N/A TRP 174.A NE1 SER 246.A O no hydrogen 3.119 N/A GLY 180.A N ALA 177.A O no hydrogen 3.132 N/A GLN 181.A N TRP 178.A O no hydrogen 3.085 N/A ASN 182.A N TRP 178.A O no hydrogen 2.994 N/A GLN 183.A NE2 ASN 182.A OD1 no hydrogen 3.675 N/A GLN 183.A NE2 THR 244.A O no hydrogen 3.233 N/A ARG 184.A NH1 ASP 185.A OD1 no hydrogen 2.960 N/A ASP 185.A N GLN 181.A O no hydrogen 2.720 N/A ILE 186.A N ASN 182.A O no hydrogen 2.887 N/A LEU 187.A N GLN 183.A O no hydrogen 3.017 N/A VAL 188.A N ARG 184.A O no hydrogen 3.219 N/A THR 189.A N ASP 185.A O no hydrogen 3.388 N/A THR 189.A OG1 ASP 185.A O no hydrogen 3.563 N/A THR 189.A OG1 PRO 219.A O no hydrogen 2.867 N/A LEU 190.A N ILE 186.A O no hydrogen 3.123 N/A GLY 191.A N VAL 188.A O no hydrogen 3.128 N/A ILE 192.A N LEU 187.A O no hydrogen 3.053 N/A ASP 195.A N ASP 193.A OD1 no hydrogen 3.177 N/A TRP 198.A N LEU 164.A O no hydrogen 2.876 N/A TRP 198.A NE1 GLU 155.A OE2 no hydrogen 2.688 N/A ARG 199.A N PRO 162.A O no hydrogen 3.341 N/A GLU 200.A N PRO 197.A O no hydrogen 2.989 N/A LEU 201.A N TRP 198.A O no hydrogen 2.744 N/A ARG 206.A N PRO 202.A O no hydrogen 2.980 N/A ARG 206.A NE GLU 155.A OE2 no hydrogen 3.378 N/A ARG 206.A NH1 LEU 201.A O no hydrogen 2.789 N/A HIS 207.A N GLU 203.A O no hydrogen 2.854 N/A TRP 208.A N GLU 204.A O no hydrogen 3.061 N/A TRP 208.A NE1 GLU 214.A OE1 no hydrogen 3.137 N/A ILE 209.A N THR 205.A O no hydrogen 3.000 N/A LEU 210.A N ARG 206.A O no hydrogen 3.262 N/A PHE 211.A N HIS 207.A O no hydrogen 2.719 N/A THR 212.A N TRP 208.A O no hydrogen 3.024 N/A GLU 214.A N THR 212.A OG1 no hydrogen 3.060 N/A GLN 215.A NE2 PHE 245.A O no hydrogen 3.280 N/A VAL 218.A N GLY 243.A O no hydrogen 2.932 N/A VAL 220.A N TYR 241.A O no hydrogen 2.726 N/A TYR 221.A OH MET 237.A O no hydrogen 2.986 N/A THR 225.A N GLU 228.A OE2 no hydrogen 3.154 N/A THR 229.A N THR 225.A O no hydrogen 2.818 N/A THR 229.A OG1 THR 225.A O no hydrogen 3.009 N/A GLN 230.A N PRO 226.A O no hydrogen 3.134 N/A ARG 231.A N ALA 227.A O no hydrogen 3.348 N/A ALA 232.A N GLU 228.A O no hydrogen 3.147 N/A LEU 233.A N THR 229.A O no hydrogen 3.015 N/A LYS 234.A N GLN 230.A O no hydrogen 3.113 N/A LYS 235.A N ARG 231.A O no hydrogen 3.014 N/A LYS 235.A N ALA 232.A O no hydrogen 3.248 N/A MET 237.A N ALA 232.A O no hydrogen 3.318 N/A SER 240.A N VAL 220.A O no hydrogen 3.059 N/A GLY 243.A N VAL 218.A O no hydrogen 2.835 N/A PHE 245.A N PRO 216.A O no hydrogen 2.981 N/A SER 246.A N GLN 183.A OE1 no hydrogen 2.854 N/A SER 246.A OG SER 247.A O no hydrogen 3.100 N/A SER 247.A OG THR 212.A O no hydrogen 2.763 N/A ALA 248.A N ILE 209.A O no hydrogen 3.159 N/A ARG 249.A N LEU 210.A O no hydrogen 3.028 N/A ARG 250.A N SER 247.A OG no hydrogen 3.267 N/A HIS 251.A N SER 247.A O no hydrogen 3.136 N/A VAL 252.A N ALA 248.A O no hydrogen 3.087 N/A LEU 253.A N ARG 249.A O no hydrogen 3.016 N/A HIS 254.A N ARG 250.A O no hydrogen 2.965 N/A THR 255.A N HIS 251.A O no hydrogen 2.993 N/A THR 255.A OG1 HIS 251.A O no hydrogen 2.552 N/A PHE 256.A N VAL 252.A O no hydrogen 2.989 N/A ALA 257.A N LEU 253.A O no hydrogen 3.117 N/A ASN 258.A ND2 HIS 254.A O no hydrogen 2.994 N/A THR 259.A N THR 255.A O no hydrogen 3.307 N/A THR 259.A OG1 THR 255.A O no hydrogen 2.723 N/A SER 263.A OG SER 261.A OG no hydrogen 3.417 N/A LYS 265.A NZ.A PHE 256.A O no hydrogen 3.510 N/A ARG 267.A N SER 263.A O no hydrogen 3.087 N/A ARG 267.A NH2 TRP 174.A O no hydrogen 2.646 N/A VAL 268.A N MET 264.A O no hydrogen 3.069 N/A GLN 269.A N LYS 265.A O no hydrogen 3.123 N/A GLY 270.A N ARG 267.A O no hydrogen 2.880 N/A TYR 271.A N VAL 268.A O no hydrogen 3.079 N/A MET 272.A N GLN 269.A O no hydrogen 3.343 N/A ILE 273.A N THR 152.A O no hydrogen 3.040 N/A GLU 275.A N VAL 150.A O no hydrogen 3.260 N/A CYS 277.A N GLY 148.A O no hydrogen 3.074 N/A CYS 280.A SG LYS 283.A O no hydrogen 3.167 N/A GLY 282.A N CYS 280.A O no hydrogen 2.448 N/A LYS 283.A NZ ASP 298.A OD2 no hydrogen 3.243 N/A LYS 283.A NZ GLU 301.A OE2 no hydrogen 3.439 N/A ARG 284.A NH1 GLY 146.A O no hydrogen 3.019 N/A ARG 286.A N GLY 139.A O no hydrogen 3.238 N/A ARG 286.A NH1 PRO 137.A O no hydrogen 3.067 N/A ARG 286.A NH2 PRO 137.A O no hydrogen 3.141 N/A THR 293.A N ASP 119.A O no hydrogen 3.189 N/A PHE 294.A N LEU 297.A O no hydrogen 2.604 N/A LEU 297.A N PHE 294.A O no hydrogen 2.781 N/A GLU 301.A N ASP 298.A O no hydrogen 3.085 N/A LEU 302.A N ASP 298.A O no hydrogen 3.378 N/A SER 303.A N ILE 299.A O no hydrogen 2.998 N/A SER 303.A OG ILE 299.A O no hydrogen 2.900 N/A LEU 305.A N LEU 302.A O no hydrogen 3.168 N/A LEU 307.A N LEU 361.A O no hydrogen 2.905 N/A ALA 308.A N GLY 359.A O no hydrogen 3.177 N/A ARG 309.A N PRO 306.A O no hydrogen 2.977 N/A ARG 309.A NH1 GLU 312.A OE2.A no hydrogen 3.142 N/A VAL 310.A N PRO 306.A O no hydrogen 3.097 N/A SER 311.A N LEU 307.A O no hydrogen 3.023 N/A GLU 312.A N ALA 308.A O no hydrogen 3.311 N/A LEU 313.A N ARG 309.A O no hydrogen 3.150 N/A LEU 314.A N VAL 310.A O no hydrogen 3.010 N/A LEU 314.A N SER 311.A O no hydrogen 3.008 N/A ARG 315.A N SER 311.A O no hydrogen 3.139 N/A TYR 317.A N LEU 314.A O no hydrogen 3.199 N/A GLU 319.A N ARG 315.A O no hydrogen 2.779 N/A ARG 321.A N PRO 316.A O no hydrogen 2.699 N/A HIS 325.A ND1 GLU 322.A OE1 no hydrogen 3.118 N/A HIS 325.A ND1 GLU 322.A OE2 no hydrogen 2.850 N/A LYS 330.A NZ GLU 327.A O no hydrogen 2.681 N/A ILE 337.A N GLU 334.A O no hydrogen 2.769 N/A ALA 338.A N GLN 335.A O no hydrogen 2.936 N/A LEU 339.A N GLN 335.A O no hydrogen 2.693 N/A GLN 340.A N ALA 336.A O no hydrogen 3.147 N/A GLN 340.A NE2 ALA 318.A O no hydrogen 2.856 N/A MET 342.A N ALA 338.A O no hydrogen 3.299 N/A ALA 343.A N LEU 339.A O no hydrogen 3.183 N/A ALA 344.A N GLN 340.A O no hydrogen 3.410 N/A LEU 346.A N MET 342.A O no hydrogen 2.733 N/A VAL 347.A N ALA 343.A O no hydrogen 3.198 N/A LYS 348.A N ALA 344.A O no hydrogen 2.998 N/A ARG 349.A N ASP 345.A O no hydrogen 3.509 N/A ARG 349.A NE ASP 345.A O no hydrogen 3.359 N/A ARG 349.A NE ASP 345.A OD1 no hydrogen 3.277 N/A ARG 349.A NH2 ASP 345.A OD1 no hydrogen 3.052 N/A LEU 350.A N LEU 346.A O no hydrogen 2.994 N/A ASP 351.A N VAL 347.A O no hydrogen 3.131 N/A VAL 352.A N ARG 349.A O no hydrogen 3.213 N/A LEU 354.A N LEU 350.A O no hydrogen 2.942 N/A HIS 355.A N ASP 351.A O no hydrogen 2.842 N/A LEU 356.A N VAL 352.A O no hydrogen 3.276 N/A LEU 356.A N LEU 353.A O no hydrogen 3.172 N/A GLY 357.A N LEU 354.A O no hydrogen 3.040 N/A LEU 358.A N LEU 353.A O no hydrogen 3.142 N/A TYR 360.A OH GLU 374.A OE2 no hydrogen 2.448 N/A ARG 365.A N GLY 362.A O no hydrogen 3.043 N/A ARG 365.A NE THR 369.A OG1 no hydrogen 2.665 N/A ARG 365.A NH2 THR 369.A O no hydrogen 2.931 N/A THR 367.A N SER 98.A O no hydrogen 3.074 N/A THR 367.A OG1 ALA 96.A O no hydrogen 3.314 N/A THR 367.A OG1 SER 98.A O no hydrogen 3.322 N/A THR 369.A N SER 366.A O no hydrogen 3.180 N/A THR 369.A OG1 SER 366.A O no hydrogen 2.732 N/A LEU 370.A N THR 367.A O no hydrogen 3.320 N/A SER 371.A N GLU 374.A OE1 no hydrogen 3.243 N/A GLU 374.A N SER 371.A OG no hydrogen 3.237 N/A LEU 375.A N SER 371.A O no hydrogen 3.221 N/A GLN 376.A N PRO 372.A O no hydrogen 3.376 N/A GLN 376.A NE2 ASP 396.A O no hydrogen 3.119 N/A GLN 376.A NE2 GLU 397.A O no hydrogen 3.669 N/A ARG 377.A N GLU 374.A O no hydrogen 3.181 N/A ARG 377.A NE PRO 398.A O no hydrogen 3.419 N/A ARG 377.A NH2 ALA 400.A O no hydrogen 2.663 N/A LEU 378.A N GLU 374.A O no hydrogen 3.002 N/A LEU 380.A N GLN 376.A O no hydrogen 3.103 N/A ALA 381.A N ARG 377.A O no hydrogen 3.097 N/A THR 382.A OG1 VAL 103.A O no hydrogen 3.128 N/A THR 382.A OG1 LEU 378.A O no hydrogen 2.762 N/A GLN 383.A N ARG 379.A O no hydrogen 3.237 N/A GLN 383.A N LEU 380.A O no hydrogen 3.187 N/A GLN 383.A NE2 ARG 379.A O no hydrogen 3.240 N/A LEU 384.A N LEU 380.A O no hydrogen 3.254 N/A LEU 384.A N ALA 381.A O no hydrogen 3.065 N/A TYR 385.A N THR 382.A O no hydrogen 3.476 N/A TYR 385.A OH.A THR 104.A O no hydrogen 2.562 N/A SER 386.A N GLN 383.A O no hydrogen 3.191 N/A SER 386.A OG GLN 383.A O no hydrogen 3.497 N/A LEU 388.A N SER 386.A OG no hydrogen 3.137 N/A VAL 392.A N PRO 83.A O no hydrogen 2.914 N/A TYR 393.A N SER 423.A O no hydrogen 2.758 N/A TYR 393.A OH GLN 383.A OE1 no hydrogen 3.033 N/A VAL 394.A N VAL 85.A O no hydrogen 2.978 N/A LEU 395.A N PHE 425.A O no hydrogen 2.802 N/A ASP 396.A N GLN 376.A OE1 no hydrogen 2.906 N/A GLU 397.A N VAL 427.A O no hydrogen 2.762 N/A SER 399.A OG GLU 428.A OE1 no hydrogen 2.613 N/A ALA 400.A N GLU 397.A O no hydrogen 3.366 N/A LEU 402.A N SER 399.A O no hydrogen 3.000 N/A ASP 406.A N HIS 403.A O no hydrogen 2.881 N/A THR 407.A OG1 GLU 408.A OE2 no hydrogen 3.293 N/A ALA 409.A N ASP 406.A O no hydrogen 3.138 N/A LEU 410.A N ASP 406.A O no hydrogen 3.412 N/A LEU 411.A N THR 407.A O no hydrogen 2.714 N/A SER 412.A N GLU 408.A O no hydrogen 3.085 N/A ALA 413.A N ALA 409.A O no hydrogen 3.379 N/A ALA 413.A N LEU 410.A O no hydrogen 3.194 N/A LEU 414.A N LEU 410.A O no hydrogen 3.144 N/A GLU 415.A N LEU 411.A O no hydrogen 3.224 N/A ASN 416.A N SER 412.A O no hydrogen 3.203 N/A LEU 417.A N ALA 413.A O no hydrogen 3.173 N/A LYS 418.A N LEU 414.A O no hydrogen 2.956 N/A LYS 418.A NZ GLU 415.A OE1.A no hydrogen 3.269 N/A LYS 418.A NZ ASP 438.A OD1 no hydrogen 3.019 N/A ARG 419.A N GLU 415.A O no hydrogen 2.818 N/A GLY 420.A N LEU 417.A O no hydrogen 3.317 N/A GLY 421.A N LYS 418.A O no hydrogen 2.970 N/A ASN 422.A N LYS 418.A O no hydrogen 3.152 N/A ASN 422.A ND2 LEU 417.A O no hydrogen 2.868 N/A SER 423.A N VAL 391.A O no hydrogen 3.145 N/A LEU 424.A N ALA 27.A O no hydrogen 3.097 N/A PHE 425.A N TYR 393.A O no hydrogen 2.767 N/A VAL 426.A N VAL 29.A O no hydrogen 2.770 N/A VAL 427.A N LEU 395.A O no hydrogen 3.030 N/A GLU 428.A N PHE 31.A O no hydrogen 3.387 N/A HIS 429.A N GLU 428.A OE2 no hydrogen 3.007 N/A HIS 429.A ND1 GLU 397.A OE1 no hydrogen 2.999 N/A ASP 430.A N GLU 428.A OE2 no hydrogen 3.166 N/A ASP 432.A N ASP 430.A OD1 no hydrogen 2.946 N/A VAL 433.A N ASP 430.A O no hydrogen 3.254 N/A ILE 434.A N ASP 430.A O no hydrogen 3.081 N/A ARG 435.A N LEU 431.A O no hydrogen 3.061 N/A ARG 435.A NH2 LEU 475.A O no hydrogen 3.409 N/A ARG 436.A N VAL 433.A O no hydrogen 2.789 N/A ARG 436.A NH1 GLU 408.A OE1 no hydrogen 3.001 N/A ALA 437.A N ILE 434.A O no hydrogen 3.359 N/A ASP 438.A N LEU 28.A O no hydrogen 3.033 N/A TRP 439.A N LEU 28.A O no hydrogen 3.377 N/A TRP 439.A NE1 SER 457.A OG no hydrogen 2.789 N/A LEU 440.A N GLY 458.A O no hydrogen 2.809 N/A VAL 441.A N VAL 30.A O no hydrogen 2.922 N/A ASP 442.A N TYR 456.A O no hydrogen 3.035 N/A VAL 443.A N THR 32.A O no hydrogen 2.847 N/A GLY 444.A N GLU 453.A O no hydrogen 2.401 N/A GLU 446.A N LYS 450.A O no hydrogen 3.190 N/A GLY 448.A N GLY 36.A O no hydrogen 2.843 N/A GLY 451.A N GLY 448.A O no hydrogen 2.926 N/A LEU 455.A N ASP 442.A O no hydrogen 2.698 N/A TYR 456.A OH PRO 459.A O no hydrogen 2.699 N/A SER 457.A OG LYS 22.A O no hydrogen 2.829 N/A GLY 458.A N LEU 440.A O no hydrogen 3.232 N/A GLY 462.A N PRO 459.A O no hydrogen 3.252 N/A LEU 463.A N PRO 460.A O no hydrogen 3.042 N/A LYS 464.A NZ GLU 461.A OE1 no hydrogen 3.233 N/A HIS 465.A N GLY 462.A O no hydrogen 3.315 N/A VAL 466.A N LEU 463.A O no hydrogen 3.182 N/A SER 469.A N VAL 466.A O no hydrogen 3.443 N/A SER 469.A OG ASP 442.A OD1 no hydrogen 3.114 N/A THR 471.A OG1 ASP 442.A OD2 no hydrogen 2.523 N/A GLY 472.A N SER 469.A OG no hydrogen 2.863 N/A GLN 473.A NE2 PRO 467.A O no hydrogen 3.219 N/A TYR 474.A N GLN 470.A O no hydrogen 3.387 N/A TYR 474.A OH GLU 743.A OE1 no hydrogen 2.440 N/A LEU 475.A N THR 471.A O no hydrogen 2.926 N/A PHE 476.A N GLY 472.A O no hydrogen 2.951 N/A ALA 477.A N GLN 473.A O no hydrogen 2.865 N/A ARG 479.A NE TYR 474.A OH no hydrogen 3.079 N/A ARG 479.A NH2 TYR 474.A OH no hydrogen 2.616 N/A HIS 484.A NE2 ASP 773.A OD1 no hydrogen 2.752 N/A ARG 487.A N ASP 773.A OD1 no hydrogen 2.767 N/A ARG 487.A NH1 ASP 773.A OD2 no hydrogen 3.443 N/A ALA 490.A N LEU 512.A O no hydrogen 2.905 N/A TRP 492.A N ASP 552.A OD2 no hydrogen 2.924 N/A LEU 493.A N PHE 510.A O no hydrogen 2.802 N/A GLU 494.A N GLY 550.A O no hydrogen 3.032 N/A LEU 495.A N VAL 508.A O no hydrogen 3.004 N/A ASN 496.A N ARG 548.A O no hydrogen 2.870 N/A GLY 497.A N ASP 507.A OD2 no hydrogen 2.980 N/A VAL 498.A N LEU 506.A O no hydrogen 3.095 N/A ARG 500.A N LEU 503.A O no hydrogen 3.060 N/A ASN 502.A ND2 SER 524.A O no hydrogen 2.783 N/A ASN 502.A ND2 GLY 783.A O no hydrogen 2.677 N/A LEU 503.A N ARG 500.A O no hydrogen 2.898 N/A ASN 505.A N ASN 505.A OD1 no hydrogen 2.559 N/A LEU 506.A N ASP 504.A O no hydrogen 2.789 N/A VAL 508.A N LEU 495.A O no hydrogen 2.954 N/A PHE 510.A N LEU 493.A O no hydrogen 2.872 N/A LEU 512.A N GLY 491.A O no hydrogen 2.834 N/A MET 515.A N ASP 773.A OD2 no hydrogen 3.253 N/A THR 516.A N VAL 759.A O no hydrogen 2.949 N/A SER 517.A N TRP 774.A O no hydrogen 3.320 N/A SER 517.A OG SER 772.A OG no hydrogen 2.531 N/A VAL 518.A N ALA 761.A O no hydrogen 2.976 N/A THR 519.A N LEU 776.A O no hydrogen 2.966 N/A THR 519.A OG1 ASP 777.A OD1 no hydrogen 3.066 N/A SER 522.A OG GLY 401.A O no hydrogen 3.038 N/A SER 524.A N VAL 521.A O no hydrogen 3.108 N/A SER 524.A OG VAL 521.A O no hydrogen 2.482 N/A SER 524.A OG GLY 781.A O no hydrogen 3.381 N/A LYS 526.A NZ GLY 520.A O no hydrogen 3.079 N/A LYS 526.A NZ VAL 521.A O no hydrogen 3.080 N/A LEU 529.A N GLY 525.A O no hydrogen 2.645 N/A VAL 530.A N LYS 526.A O no hydrogen 2.696 N/A GLN 532.A N SER 527.A O no hydrogen 3.002 N/A ALA 533.A N THR 528.A O no hydrogen 3.000 N/A LEU 534.A N LEU 529.A O no hydrogen 2.778 N/A VAL 535.A N VAL 530.A O no hydrogen 3.408 N/A ASP 536.A N GLN 532.A O no hydrogen 3.323 N/A ALA 537.A N LEU 534.A O no hydrogen 2.781 N/A LEU 538.A N LEU 534.A O no hydrogen 3.207 N/A ALA 539.A N VAL 535.A O no hydrogen 2.977 N/A HIS 541.A N ALA 537.A O no hydrogen 3.333 N/A SER 546.A N THR 499.A O no hydrogen 2.763 N/A GLY 550.A N GLU 494.A O no hydrogen 2.965 N/A ASP 552.A N TRP 492.A O no hydrogen 2.845 N/A LEU 553.A N GLY 551.A O no hydrogen 3.066 N/A ILE 556.A N LEU 553.A O no hydrogen 2.776 N/A THR 557.A N GLY 725.A O no hydrogen 2.681 N/A ARG 558.A N GLY 725.A O no hydrogen 3.331 N/A ARG 558.A NH2 GLU 717.A OE1 no hydrogen 3.019 N/A VAL 560.A N VAL 727.A O no hydrogen 2.931 N/A VAL 562.A N VAL 729.A O no hydrogen 2.948 N/A ARG 572.A NE ASN 608.A OD1 no hydrogen 2.546 N/A ARG 572.A NH2 PHE 607.A O no hydrogen 2.495 N/A ARG 572.A NH2 ASN 608.A OD1 no hydrogen 3.339 N/A ARG 572.A NH2 GLN 618.A O no hydrogen 2.380 N/A ALA 576.A N LEU 697.A O no hydrogen 2.993 N/A THR 577.A N ASN 574.A O no hydrogen 3.348 N/A TYR 578.A N ASN 574.A O no hydrogen 3.026 N/A THR 579.A N MET 575.A O no hydrogen 2.907 N/A THR 579.A OG1 MET 575.A O no hydrogen 2.800 N/A THR 579.A OG1 ALA 576.A O no hydrogen 3.502 N/A PHE 582.A N ALA 576.A O no hydrogen 2.958 N/A GLN 584.A NE2 GLY 580.A O no hydrogen 2.967 N/A ARG 586.A N PHE 582.A O no hydrogen 3.046 N/A ARG 586.A NH1 ALA 602.A O no hydrogen 2.892 N/A LYS 587.A N ASP 583.A O no hydrogen 3.414 N/A LYS 587.A NZ GLN 584.A O no hydrogen 2.941 N/A LEU 588.A N GLN 584.A O no hydrogen 2.986 N/A LEU 588.A N VAL 585.A O no hydrogen 3.206 N/A PHE 589.A N VAL 585.A O no hydrogen 3.266 N/A ALA 590.A N ARG 586.A O no hydrogen 2.989 N/A THR 592.A N PHE 589.A O no hydrogen 3.323 N/A THR 592.A OG1 PHE 589.A O no hydrogen 2.642 N/A LYS 596.A N THR 592.A O no hydrogen 2.892 N/A LYS 597.A N PRO 593.A O no hydrogen 3.274 N/A ARG 598.A N LEU 594.A O no hydrogen 3.313 N/A ARG 598.A NE TYR 600.A OH no hydrogen 3.301 N/A ARG 598.A NH2 GLU 651.A OE2 no hydrogen 3.113 N/A TYR 600.A N ALA 595.A O no hydrogen 3.481 N/A TYR 600.A N ARG 598.A O no hydrogen 2.866 N/A TYR 600.A OH GLU 648.A OE2 no hydrogen 2.830 N/A ARG 604.A N ASN 601.A O no hydrogen 3.053 N/A ARG 604.A NE THR 649.A OG1 no hydrogen 3.034 N/A ARG 604.A NH2 ASN 646.A OD1 no hydrogen 3.311 N/A ARG 604.A NH2 THR 649.A OG1 no hydrogen 3.193 N/A PHE 605.A N ALA 602.A O no hydrogen 2.990 N/A SER 606.A N GLY 603.A O no hydrogen 3.095 N/A ASN 608.A N SER 606.A OG no hydrogen 3.250 N/A ARG 613.A NE GLU 615.A OE1 no hydrogen 2.966 N/A ARG 613.A NE GLU 615.A OE2 no hydrogen 2.956 N/A ARG 613.A NH1 PHE 607.A O no hydrogen 3.376 N/A ARG 613.A NH2 GLU 615.A OE2 no hydrogen 2.533 N/A CYS 614.A N ARG 644.A O no hydrogen 2.966 N/A CYS 617.A SG CYS 614.A O no hydrogen 3.782 N/A GLY 619.A N CYS 614.A O no hydrogen 2.798 N/A GLU 620.A N CYS 617.A O no hydrogen 3.186 N/A VAL 623.A N ALA 635.A O no hydrogen 2.720 N/A VAL 625.A N VAL 633.A O no hydrogen 2.976 N/A LEU 628.A N VAL 625.A O no hydrogen 3.165 N/A SER 632.A OG VAL 625.A O no hydrogen 2.724 N/A ALA 635.A N VAL 623.A O no hydrogen 2.879 N/A CYS 637.A N GLY 621.A O no hydrogen 2.967 N/A HIS 641.A N CYS 637.A O no hydrogen 2.806 N/A THR 643.A N CYS 640.A O no hydrogen 3.385 N/A THR 643.A OG1 CYS 640.A O no hydrogen 3.465 N/A THR 643.A OG1 TYR 645.A O no hydrogen 3.436 N/A ARG 644.A NH1 PRO 571.A O no hydrogen 2.867 N/A ARG 644.A NH1 ARG 572.A O no hydrogen 3.563 N/A ARG 644.A NH1 GLY 619.A O no hydrogen 3.182 N/A ARG 644.A NH2 PRO 571.A O no hydrogen 3.032 N/A ARG 644.A NH2 GLY 698.A O no hydrogen 2.937 N/A TYR 645.A OH PHE 605.A O no hydrogen 2.753 N/A ASN 646.A N GLY 612.A O no hydrogen 3.209 N/A ASN 646.A ND2 GLY 611.A O no hydrogen 3.463 N/A THR 649.A N ASN 646.A OD1 no hydrogen 3.012 N/A THR 649.A OG1 GLY 612.A O no hydrogen 2.792 N/A THR 649.A OG1 ASN 646.A OD1 no hydrogen 2.600 N/A LEU 650.A N ALA 647.A O no hydrogen 3.258 N/A TYR 654.A N LYS 657.A O no hydrogen 3.054 N/A ARG 655.A NE TYR 654.A OH no hydrogen 3.320 N/A ARG 655.A NH1 PHE 673.A O no hydrogen 2.953 N/A ARG 655.A NH2 TYR 654.A OH no hydrogen 3.111 N/A ARG 655.A NH2 PHE 673.A O no hydrogen 2.612 N/A LYS 657.A N TYR 654.A O no hydrogen 3.226 N/A ASN 658.A N ASP 661.A OD1 no hydrogen 2.851 N/A ASN 658.A ND2 LEU 650.A O no hydrogen 3.561 N/A ASP 661.A N ASN 658.A OD1 no hydrogen 2.649 N/A VAL 662.A N ASN 658.A O no hydrogen 3.225 N/A LEU 663.A N ILE 659.A O no hydrogen 3.270 N/A ALA 664.A N ALA 660.A O no hydrogen 3.002 N/A LEU 665.A N VAL 662.A O no hydrogen 3.032 N/A THR 666.A N GLU 669.A OE2 no hydrogen 2.947 N/A VAL 667.A N LEU 695.A O no hydrogen 2.742 N/A ASP 668.A N GLY 693.A O no hydrogen 3.180 N/A ALA 670.A N THR 666.A O no hydrogen 2.911 N/A ASP 672.A N ASP 668.A O no hydrogen 3.477 N/A PHE 673.A N GLU 669.A O no hydrogen 3.168 N/A PHE 674.A N ALA 670.A O no hydrogen 3.079 N/A ALA 675.A N ASP 672.A O no hydrogen 3.406 N/A GLU 677.A N PHE 674.A O no hydrogen 2.956 N/A PHE 681.A N GLU 677.A O no hydrogen 2.961 N/A ARG 682.A N SER 678.A O no hydrogen 3.103 N/A ALA 683.A N ALA 679.A O no hydrogen 3.423 N/A LEU 684.A N ILE 680.A O no hydrogen 3.122 N/A THR 686.A N ARG 682.A O no hydrogen 3.434 N/A THR 686.A OG1 ALA 683.A O no hydrogen 2.730 N/A THR 686.A OG1 ALA 715.A O no hydrogen 3.288 N/A LEU 687.A N ALA 683.A O no hydrogen 3.361 N/A ARG 688.A N LEU 684.A O no hydrogen 3.083 N/A ARG 688.A N ASP 685.A O no hydrogen 3.171 N/A GLU 689.A N ASP 685.A O no hydrogen 2.885 N/A GLY 691.A N ARG 688.A O no hydrogen 3.126 N/A LEU 692.A N LEU 687.A O no hydrogen 3.094 N/A TYR 694.A OH GLU 708.A OE2 no hydrogen 2.650 N/A LEU 695.A N LEU 692.A O no hydrogen 3.168 N/A ARG 696.A N GLN 699.A OE1 no hydrogen 3.360 N/A LEU 697.A N LEU 665.A O no hydrogen 2.789 N/A GLY 698.A N LEU 663.A O no hydrogen 2.780 N/A GLN 699.A N ARG 696.A O no hydrogen 2.864 N/A GLN 699.A NE2 GLU 703.A OE2 no hydrogen 3.302 N/A ALA 701.A N SER 573.A O no hydrogen 3.049 N/A GLU 703.A N PRO 700.A O no hydrogen 3.256 N/A LEU 704.A N ALA 701.A O no hydrogen 3.189 N/A SER 705.A N GLU 708.A OE1 no hydrogen 3.289 N/A ALA 709.A N SER 705.A O no hydrogen 3.308 N/A GLN 710.A N GLY 706.A O no hydrogen 2.955 N/A GLN 710.A NE2 ASP 731.A O no hydrogen 2.821 N/A ARG 711.A N GLY 707.A O no hydrogen 3.210 N/A ARG 711.A NE GLY 707.A O no hydrogen 3.083 N/A ILE 712.A N GLU 708.A O no hydrogen 3.255 N/A LYS 713.A N ALA 709.A O no hydrogen 3.256 N/A LYS 713.A NZ ASP 563.A OD2 no hydrogen 3.207 N/A LYS 713.A NZ PRO 566.A O no hydrogen 3.435 N/A LEU 714.A N GLN 710.A O no hydrogen 3.039 N/A ALA 715.A N ARG 711.A O no hydrogen 3.082 N/A THR 716.A N ILE 712.A O no hydrogen 3.061 N/A THR 716.A OG1 ILE 712.A O no hydrogen 2.711 N/A GLU 717.A N LYS 713.A O no hydrogen 3.301 N/A GLU 717.A N LEU 714.A O no hydrogen 3.001 N/A LEU 718.A N ALA 715.A O no hydrogen 3.147 N/A SER 721.A OG LEU 718.A O no hydrogen 2.709 N/A GLY 722.A N ARG 720.A O no hydrogen 2.752 N/A GLY 725.A N GLY 756.A O no hydrogen 3.155 N/A VAL 727.A N ARG 558.A O no hydrogen 2.876 N/A TYR 728.A N THR 758.A O no hydrogen 2.598 N/A TYR 728.A OH GLU 717.A O no hydrogen 3.259 N/A VAL 729.A N VAL 560.A O no hydrogen 2.979 N/A LEU 730.A N ILE 760.A O no hydrogen 2.778 N/A THR 734.A N GLU 732.A OE1 no hydrogen 3.197 N/A THR 734.A OG1 GLU 732.A OE1 no hydrogen 2.962 N/A THR 734.A OG1 GLU 732.A OE2 no hydrogen 3.011 N/A THR 735.A N GLU 732.A O no hydrogen 3.104 N/A THR 735.A OG1 GLN 710.A OE1 no hydrogen 3.373 N/A LEU 737.A N THR 734.A O no hydrogen 3.067 N/A HIS 738.A N ASP 741.A OD2 no hydrogen 3.111 N/A ALA 740.A N HIS 738.A ND1 no hydrogen 3.051 N/A ASP 741.A N HIS 738.A O no hydrogen 2.814 N/A VAL 742.A N HIS 738.A O no hydrogen 3.141 N/A ARG 744.A NH1 GLU 689.A O no hydrogen 2.973 N/A LEU 745.A N ASP 741.A O no hydrogen 3.142 N/A GLN 746.A N VAL 742.A O no hydrogen 2.775 N/A ARG 747.A N GLU 743.A O no hydrogen 3.411 N/A GLN 748.A N LEU 745.A O no hydrogen 3.071 N/A GLN 748.A NE2 ARG 744.A O no hydrogen 2.880 N/A LEU 749.A N LEU 745.A O no hydrogen 3.234 N/A VAL 750.A N GLN 746.A O no hydrogen 2.963 N/A LYS 751.A N ARG 747.A O no hydrogen 3.146 N/A LYS 751.A NZ GLU 689.A OE2.A no hydrogen 2.388 N/A LEU 752.A N GLN 748.A O no hydrogen 3.209 N/A VAL 753.A N LEU 749.A O no hydrogen 3.374 N/A VAL 753.A N VAL 750.A O no hydrogen 3.190 N/A ASP 754.A N VAL 750.A O no hydrogen 2.977 N/A ALA 755.A N LYS 751.A O no hydrogen 3.155 N/A GLY 756.A N VAL 753.A O no hydrogen 3.063 N/A ASN 757.A ND2 THR 726.A O no hydrogen 3.432 N/A THR 758.A N THR 726.A O no hydrogen 3.119 N/A ILE 760.A N TYR 728.A O no hydrogen 2.815 N/A ALA 761.A N THR 516.A O no hydrogen 2.953 N/A VAL 762.A N LEU 730.A O no hydrogen 2.807 N/A GLU 763.A N VAL 518.A O no hydrogen 3.129 N/A HIS 764.A N GLU 763.A OE2 no hydrogen 3.130 N/A LYS 765.A N GLU 763.A OE2 no hydrogen 3.198 N/A LYS 765.A NZ THR 734.A O no hydrogen 3.357 N/A LYS 765.A NZ THR 734.A OG1 no hydrogen 3.152 N/A GLN 767.A NE2 PRO 739.A O no hydrogen 2.911 N/A VAL 768.A N LYS 765.A O no hydrogen 3.209 N/A VAL 769.A N LYS 765.A O no hydrogen 3.215 N/A ALA 770.A N MET 766.A O no hydrogen 2.930 N/A ALA 771.A N VAL 768.A O no hydrogen 3.234 N/A SER 772.A N VAL 769.A O no hydrogen 3.481 N/A SER 772.A OG SER 517.A OG no hydrogen 2.531 N/A SER 772.A OG VAL 768.A O no hydrogen 3.411 N/A SER 772.A OG VAL 769.A O no hydrogen 3.494 N/A ASP 773.A N MET 515.A O no hydrogen 2.951 N/A TRP 774.A N MET 515.A O no hydrogen 3.346 N/A VAL 775.A N GLY 793.A O no hydrogen 2.606 N/A LEU 776.A N SER 517.A O no hydrogen 2.973 N/A ASP 777.A N ALA 791.A O no hydrogen 2.729 N/A ILE 778.A N THR 519.A O no hydrogen 2.850 N/A GLY 779.A N ARG 788.A O no hydrogen 2.302 N/A GLY 781.A N ASP 785.A O no hydrogen 3.051 N/A GLY 783.A N GLY 523.A O no hydrogen 2.795 N/A ASP 785.A N ALA 782.A O no hydrogen 3.023 N/A GLY 786.A N GLY 783.A O no hydrogen 3.204 N/A VAL 790.A N ASP 777.A O no hydrogen 2.835 N/A ALA 791.A N ASP 777.A O no hydrogen 3.376 N/A GLY 793.A N VAL 775.A O no hydrogen 3.098 N/A THR 794.A N GLU 797.A OE1 no hydrogen 3.321 N/A GLU 797.A N THR 794.A OG1 no hydrogen 3.338 N/A VAL 798.A N THR 794.A O no hydrogen 2.935 N/A GLN 800.A N GLU 797.A O no hydrogen 3.211 N/A ALA 801.A N VAL 798.A O no hydrogen 3.324 N/A SER 804.A OG ASP 777.A OD2 no hydrogen 2.715 N/A LEU 810.A N THR 806.A O no hydrogen 2.868 N/A ARG 811.A N ALA 807.A O no hydrogen 2.870 N/A ARG 811.A NE ALA 799.A O no hydrogen 3.154 N/A ARG 811.A NH2 ALA 799.A O no hydrogen 3.410 N/A ALA 812.A N PRO 808.A O no hydrogen 3.030 N/A ALA 813.A N TYR 809.A O no hydrogen 3.220 N/A LEU 814.A N LEU 810.A O no hydrogen 2.951 N/A LEU 814.A N ARG 811.A O no hydrogen 3.206 N/A ARG 815.A NE ALA 813.A O no hydrogen 3.259 N/A