Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nio_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N THR 13.A O no hydrogen 3.006 N/A CYS 6.A N SER 11.A O no hydrogen 2.709 N/A CYS 6.A SG PHE 25.A O no hydrogen 3.883 N/A VAL 7.A N PHE 25.A O no hydrogen 2.601 N/A CYS 9.A SG SER 11.A OG no hydrogen 3.520 N/A ASN 10.A N CYS 6.A O no hydrogen 2.850 N/A THR 13.A N GLY 4.A O no hydrogen 2.758 N/A THR 13.A OG1 SER 11.A O no hydrogen 3.006 N/A ARG 16.A N LEU 44.A O no hydrogen 2.810 N/A ARG 16.A NH2 SER 45.A O no hydrogen 3.189 N/A CYS 17.A N PRO 24.A O no hydrogen 3.265 N/A CYS 17.A SG HIS 34.A NE2 no hydrogen 3.634 N/A CYS 17.A SG HIS 40.A ND1 no hydrogen 3.582 N/A GLY 18.A N LEU 42.A O no hydrogen 2.789 N/A CYS 20.A SG HIS 34.A NE2 no hydrogen 3.621 N/A CYS 20.A SG HIS 40.A ND1 no hydrogen 3.379 N/A ARG 22.A NE GLU 137.A OE1 no hydrogen 3.020 N/A ARG 22.A NH1 VAL 229.A O no hydrogen 2.964 N/A ARG 22.A NH2 GLU 137.A OE1 no hydrogen 2.968 N/A ARG 22.A NH2 VAL 229.A O no hydrogen 3.139 N/A ARG 23.A N CYS 20.A O no hydrogen 2.898 N/A LEU 26.A N LEU 15.A O no hydrogen 3.160 N/A CYS 28.A SG VAL 90.A O no hydrogen 3.348 N/A CYS 28.A SG LEU 93.A O no hydrogen 3.846 N/A CYS 31.A N CYS 27.A O no hydrogen 2.729 N/A TYR 32.A N CYS 28.A O no hydrogen 3.483 N/A ASP 33.A N LYS 29.A O no hydrogen 3.028 N/A HIS 34.A N CYS 30.A O no hydrogen 2.937 N/A HIS 34.A ND1 ASN 108.A OD1 no hydrogen 2.793 N/A HIS 34.A NE2 HIS 40.A ND1 no hydrogen 3.147 N/A VAL 35.A N CYS 31.A O no hydrogen 2.876 N/A ILE 36.A N TYR 32.A O no hydrogen 3.026 N/A SER 37.A OG ASP 33.A O no hydrogen 2.450 N/A THR 38.A OG1 HIS 34.A O no hydrogen 2.479 N/A LYS 41.A NZ VAL 35.A O no hydrogen 2.429 N/A LYS 41.A NZ THR 38.A O no hydrogen 3.113 N/A LEU 44.A N ARG 16.A O no hydrogen 2.705 N/A SER 45.A N ASN 47.A O no hydrogen 2.934 N/A SER 45.A OG SER 14.A O no hydrogen 2.852 N/A TYR 49.A N VAL 43.A O no hydrogen 2.799 N/A TYR 49.A OH PHE 91.A O no hydrogen 2.879 N/A CYS 51.A N VAL 58.A O no hydrogen 3.096 N/A CYS 51.A SG HIS 76.A ND1 no hydrogen 3.636 N/A ASN 52.A N TYR 71.A O no hydrogen 2.760 N/A CYS 56.A N ALA 53.A O no hydrogen 3.218 N/A VAL 61.A N LYS 41.A O no hydrogen 2.860 N/A THR 62.A N ASP 60.A OD1 no hydrogen 2.752 N/A THR 62.A OG1 ASP 60.A OD1 no hydrogen 2.216 N/A GLN 63.A N ASP 60.A O no hydrogen 2.945 N/A LEU 64.A N VAL 61.A O no hydrogen 3.432 N/A TYR 65.A N TYR 72.A O no hydrogen 2.723 N/A LEU 66.A N PHE 82.A O no hydrogen 2.926 N/A GLY 67.A N SER 70.A O no hydrogen 3.030 N/A SER 70.A N GLY 67.A O no hydrogen 3.008 N/A TYR 71.A N SER 70.A OG no hydrogen 2.761 N/A TYR 72.A N TYR 65.A O no hydrogen 3.010 N/A CYS 73.A SG HIS 76.A ND1 no hydrogen 3.338 N/A HIS 76.A N CYS 73.A O no hydrogen 3.361 N/A LYS 77.A NZ PRO 78.A O no hydrogen 3.190 N/A LYS 77.A NZ SER 81.A OG no hydrogen 2.683 N/A SER 81.A OG PRO 78.A O no hydrogen 3.544 N/A PHE 82.A N LEU 66.A O no hydrogen 3.283 N/A LEU 84.A N LEU 64.A O no hydrogen 3.132 N/A ALA 86.A N GLN 89.A O no hydrogen 2.980 N/A GLN 89.A N ALA 86.A O no hydrogen 3.121 N/A VAL 90.A N CYS 28.A O no hydrogen 2.897 N/A PHE 91.A N LEU 84.A O no hydrogen 2.647 N/A LEU 93.A N SER 14.A OG no hydrogen 3.002 N/A THR 97.A N TYR 94.A O no hydrogen 3.304 N/A THR 97.A OG1 TYR 94.A O no hydrogen 3.503 N/A CYS 98.A SG TYR 94.A O no hydrogen 3.066 N/A VAL 99.A N SER 11.A OG no hydrogen 3.108 N/A ASN 108.A N VAL 104.A O no hydrogen 2.771 N/A ALA 109.A N THR 105.A O no hydrogen 3.072 N/A ILE 110.A N ASP 106.A O no hydrogen 2.917 N/A ALA 111.A N PHE 107.A O no hydrogen 2.849 N/A THR 112.A OG1 ASN 108.A O no hydrogen 2.528 N/A CYS 113.A N ALA 109.A O no hydrogen 3.278 N/A CYS 113.A SG ALA 109.A O no hydrogen 3.164 N/A CYS 113.A SG ILE 110.A O no hydrogen 3.305 N/A THR 116.A OG1 ASP 114.A OD1 no hydrogen 3.151 N/A THR 116.A OG1 ASP 114.A OD2 no hydrogen 2.735 N/A ALA 118.A N LYS 411.A O no hydrogen 2.807 N/A ASP 120.A N ASN 117.A O no hydrogen 3.237 N/A TYR 121.A N ALA 118.A O no hydrogen 3.248 N/A TYR 121.A OH TRP 115.A O no hydrogen 2.882 N/A ILE 122.A N ALA 118.A O no hydrogen 3.175 N/A LEU 123.A N GLY 119.A O no hydrogen 3.203 N/A ALA 124.A N ASP 120.A O no hydrogen 3.226 N/A ASN 125.A N ILE 122.A O no hydrogen 3.206 N/A THR 126.A N LEU 123.A O no hydrogen 3.180 N/A THR 126.A OG1 ILE 122.A O no hydrogen 2.982 N/A THR 126.A OG1 LEU 123.A O no hydrogen 3.472 N/A CYS 127.A SG LEU 123.A O no hydrogen 3.158 N/A CYS 127.A SG ALA 124.A O no hydrogen 3.636 N/A CYS 127.A SG THR 128.A O no hydrogen 3.732 N/A ARG 130.A NH2 ARG 130.A O no hydrogen 3.429 N/A LEU 131.A N THR 128.A O no hydrogen 3.061 N/A LYS 132.A N THR 128.A O no hydrogen 3.021 N/A LYS 132.A NZ CYS 127.A O no hydrogen 3.430 N/A LEU 133.A N GLU 129.A O no hydrogen 3.346 N/A PHE 134.A N ARG 130.A O no hydrogen 3.188 N/A ALA 135.A N LEU 131.A O no hydrogen 2.695 N/A ALA 136.A N LYS 132.A O no hydrogen 2.707 N/A GLU 137.A N LEU 133.A O no hydrogen 2.850 N/A THR 138.A N PHE 134.A O no hydrogen 2.854 N/A THR 138.A OG1 PHE 134.A O no hydrogen 2.650 N/A LEU 139.A N ALA 135.A O no hydrogen 2.997 N/A LYS 140.A N ALA 136.A O no hydrogen 2.947 N/A ALA 141.A N GLU 137.A O no hydrogen 2.845 N/A THR 142.A N THR 138.A O no hydrogen 2.981 N/A THR 142.A OG1 THR 138.A O no hydrogen 2.424 N/A GLU 143.A N LEU 139.A O no hydrogen 2.977 N/A GLU 144.A N LYS 140.A O no hydrogen 3.038 N/A THR 145.A N ALA 141.A O no hydrogen 2.942 N/A THR 145.A OG1 ALA 141.A O no hydrogen 2.881 N/A PHE 146.A N THR 142.A O no hydrogen 2.871 N/A LYS 147.A N GLU 143.A O no hydrogen 3.003 N/A LYS 147.A NZ GLU 144.A OE1 no hydrogen 3.366 N/A LEU 148.A N THR 145.A O no hydrogen 3.067 N/A SER 149.A N PHE 146.A O no hydrogen 3.048 N/A SER 149.A OG PHE 146.A O no hydrogen 2.474 N/A TYR 150.A N LYS 147.A O no hydrogen 3.243 N/A GLY 151.A N PRO 173.A O no hydrogen 2.714 N/A ILE 152.A N GLU 169.A OE1 no hydrogen 3.004 N/A ALA 153.A N PHE 222.A O no hydrogen 3.196 N/A THR 154.A N SER 167.A O no hydrogen 2.620 N/A VAL 155.A N ASP 220.A O no hydrogen 2.791 N/A ARG 156.A N HIS 165.A O no hydrogen 3.080 N/A LEU 159.A N GLU 163.A O no hydrogen 3.079 N/A SER 160.A N GLU 163.A O no hydrogen 3.199 N/A ARG 162.A N SER 160.A OG no hydrogen 3.032 N/A GLU 163.A N SER 160.A OG no hydrogen 3.039 N/A LEU 164.A N VAL 206.A O no hydrogen 2.954 N/A HIS 165.A N GLU 157.A O no hydrogen 2.797 N/A SER 167.A N THR 154.A O no hydrogen 2.451 N/A GLU 169.A N ILE 152.A O no hydrogen 3.227 N/A ASN 178.A N PRO 176.A O no hydrogen 3.206 N/A ASN 180.A N ASN 178.A OD1 no hydrogen 2.916 N/A PHE 183.A N TYR 199.A O no hydrogen 2.734 N/A THR 184.A N VAL 223.A O no hydrogen 2.760 N/A THR 184.A OG1 THR 225.A OG1 no hydrogen 2.413 N/A GLY 185.A N GLY 197.A O no hydrogen 2.892 N/A TYR 186.A N TYR 221.A O no hydrogen 2.856 N/A ARG 187.A N VAL 194.A O no hydrogen 3.035 N/A ARG 187.A NE ASP 220.A OD1 no hydrogen 3.304 N/A THR 189.A OG1 ASN 191.A O no hydrogen 2.492 N/A SER 192.A OG LYS 193.A O no hydrogen 3.409 N/A LYS 193.A N SER 192.A OG no hydrogen 2.534 N/A VAL 194.A N ARG 187.A O no hydrogen 3.062 N/A ILE 196.A N GLY 185.A O no hydrogen 3.098 N/A TYR 199.A N PHE 183.A O no hydrogen 2.771 N/A TYR 199.A OH ILE 196.A O no hydrogen 2.599 N/A THR 200.A N ARG 209.A O no hydrogen 2.866 N/A THR 200.A OG1 ARG 209.A O no hydrogen 3.501 N/A VAL 206.A N LEU 164.A O no hydrogen 3.056 N/A VAL 207.A N GLU 202.A O no hydrogen 2.981 N/A TYR 208.A N ARG 162.A O no hydrogen 3.032 N/A ARG 209.A N THR 200.A O no hydrogen 2.946 N/A THR 211.A N GLU 198.A O no hydrogen 2.621 N/A THR 213.A N THR 212.A OG1 no hydrogen 2.386 N/A ASN 217.A N ASP 220.A OD2 no hydrogen 2.952 N/A GLY 219.A N VAL 155.A O no hydrogen 2.842 N/A TYR 221.A N TYR 186.A O no hydrogen 3.084 N/A PHE 222.A N ALA 153.A O no hydrogen 2.888 N/A VAL 223.A N THR 184.A O no hydrogen 3.157 N/A THR 225.A N VAL 182.A O no hydrogen 3.062 N/A THR 225.A OG1 VAL 182.A O no hydrogen 3.517 N/A THR 225.A OG1 THR 184.A OG1 no hydrogen 2.413 N/A THR 225.A OG1 GLU 198.A OE2 no hydrogen 3.402 N/A HIS 227.A N GLU 144.A OE2 no hydrogen 2.810 N/A LEU 232.A N GLU 137.A OE2 no hydrogen 2.537 N/A THR 236.A N GLU 129.A OE2 no hydrogen 2.606 N/A THR 236.A OG1 GLU 129.A OE2 no hydrogen 2.841 N/A THR 236.A OG1 SER 421.A OG no hydrogen 2.558 N/A GLN 240.A NE2 TYR 274.A O no hydrogen 3.102 N/A GLU 241.A N GLN 240.A OE1 no hydrogen 3.107 N/A TYR 243.A N MET 271.A O no hydrogen 2.501 N/A THR 247.A N GLY 270.A O no hydrogen 3.187 N/A THR 247.A OG1 ARG 245.A O no hydrogen 2.849 N/A THR 252.A OG1 ASN 254.A O no hydrogen 2.756 N/A GLU 258.A N SER 256.A OG no hydrogen 2.974 N/A SER 260.A OG ASP 257.A O no hydrogen 3.252 N/A ASN 262.A ND2 TYR 266.A OH no hydrogen 3.397 N/A VAL 263.A N SER 260.A O no hydrogen 3.248 N/A TYR 266.A N ASN 262.A O no hydrogen 2.689 N/A TYR 266.A OH PHE 288.A O no hydrogen 2.768 N/A GLN 267.A N VAL 263.A O no hydrogen 2.974 N/A GLN 267.A NE2 TYR 295.A OH no hydrogen 2.941 N/A LYS 268.A N ALA 264.A O no hydrogen 3.030 N/A VAL 269.A N ASN 265.A O no hydrogen 3.023 N/A GLY 270.A N GLN 267.A O no hydrogen 3.147 N/A MET 271.A N LYS 268.A O no hydrogen 3.459 N/A GLN 272.A NE2 TYR 274.A O no hydrogen 2.905 N/A GLN 272.A NE2 ASP 432.A OD1 no hydrogen 2.921 N/A LYS 273.A NZ ALA 390.A O no hydrogen 3.570 N/A LYS 273.A NZ LYS 391.A O no hydrogen 3.357 N/A TYR 274.A N GLN 240.A OE1 no hydrogen 2.971 N/A SER 275.A N TYR 393.A O no hydrogen 2.671 N/A SER 275.A OG TYR 393.A O no hydrogen 3.249 N/A THR 276.A N ASP 432.A OD2 no hydrogen 2.715 N/A THR 276.A OG1 ASP 432.A OD2 no hydrogen 3.164 N/A LEU 277.A N TYR 395.A O no hydrogen 2.662 N/A GLN 278.A N MET 433.A O no hydrogen 3.033 N/A GLN 278.A NE2 ASP 398.A OD1 no hydrogen 3.090 N/A GLY 279.A N GLY 397.A O no hydrogen 2.814 N/A THR 283.A OG1 PRO 281.A O no hydrogen 3.189 N/A THR 283.A OG1 LEU 435.A O no hydrogen 3.529 N/A THR 283.A OG1 THR 437.A O no hydrogen 3.536 N/A GLY 284.A N GLY 282.A O no hydrogen 2.348 N/A LYS 285.A NZ GLY 279.A O no hydrogen 2.433 N/A HIS 287.A NE2 GLU 258.A OE1 no hydrogen 2.803 N/A PHE 288.A N GLY 284.A O no hydrogen 3.308 N/A ALA 289.A N LYS 285.A O no hydrogen 2.912 N/A ILE 290.A N SER 286.A O no hydrogen 2.968 N/A GLY 291.A N HIS 287.A O no hydrogen 3.104 N/A LEU 292.A N PHE 288.A O no hydrogen 3.023 N/A ALA 293.A N ILE 290.A O no hydrogen 2.918 N/A LEU 294.A N GLY 291.A O no hydrogen 2.962 N/A TYR 295.A N GLY 291.A O no hydrogen 3.189 N/A TYR 296.A N LEU 292.A O no hydrogen 3.468 N/A TYR 296.A OH TYR 266.A O no hydrogen 2.324 N/A ALA 299.A N TYR 296.A O no hydrogen 3.018 N/A ARG 300.A N ASP 366.A OD1 no hydrogen 2.578 N/A ARG 300.A NE THR 364.A O no hydrogen 2.521 N/A ARG 300.A NH1 THR 348.A O no hydrogen 2.811 N/A ARG 300.A NH2 THR 348.A O no hydrogen 2.774 N/A ARG 300.A NH2 THR 363.A OG1 no hydrogen 2.756 N/A ARG 300.A NH2 THR 364.A O no hydrogen 3.347 N/A ILE 301.A N GLN 351.A O no hydrogen 2.950 N/A VAL 302.A N ILE 367.A O no hydrogen 3.050 N/A TYR 303.A N VAL 353.A O no hydrogen 2.675 N/A TYR 303.A OH ALA 289.A O no hydrogen 2.413 N/A THR 304.A N VAL 369.A O no hydrogen 2.817 N/A THR 304.A OG1 CYS 355.A O no hydrogen 3.035 N/A CYS 306.A SG ASP 380.A OD2 no hydrogen 3.339 N/A ALA 310.A N SER 307.A OG no hydrogen 3.151 N/A VAL 311.A N SER 307.A O no hydrogen 3.279 N/A ASP 312.A N HIS 308.A O no hydrogen 2.657 N/A ALA 313.A N ALA 309.A O no hydrogen 2.984 N/A LEU 314.A N ALA 310.A O no hydrogen 3.427 N/A CYS 315.A N VAL 311.A O no hydrogen 3.102 N/A CYS 315.A SG VAL 311.A O no hydrogen 3.256 N/A GLU 316.A N ASP 312.A O no hydrogen 3.059 N/A LYS 317.A N ALA 313.A O no hydrogen 3.043 N/A ALA 318.A N LEU 314.A O no hydrogen 2.779 N/A LEU 319.A N CYS 315.A O no hydrogen 2.781 N/A LYS 320.A N LYS 317.A O no hydrogen 3.132 N/A TYR 321.A N ALA 318.A O no hydrogen 3.208 N/A TYR 321.A OH GLU 258.A OE1 no hydrogen 3.125 N/A TYR 321.A OH GLU 258.A OE2 no hydrogen 3.285 N/A LEU 322.A N ALA 318.A O no hydrogen 2.693 N/A ASP 325.A N ASP 325.A OD1 no hydrogen 2.253 N/A LYS 326.A N PRO 323.A O no hydrogen 3.094 N/A LYS 326.A NZ ASP 325.A O no hydrogen 3.122 N/A CYS 327.A N ILE 324.A O no hydrogen 3.416 N/A CYS 327.A SG PRO 323.A O no hydrogen 3.226 N/A SER 328.A N TYR 352.A O no hydrogen 2.871 N/A SER 328.A OG LYS 344.A O no hydrogen 3.285 N/A SER 328.A OG SER 347.A O no hydrogen 3.227 N/A ARG 329.A N LYS 344.A O no hydrogen 2.885 N/A ARG 329.A NE ASP 312.A OD1 no hydrogen 3.463 N/A ARG 329.A NH2 HIS 308.A ND1 no hydrogen 3.088 N/A ARG 329.A NH2 ASP 312.A OD1 no hydrogen 3.124 N/A ILE 330.A N PHE 354.A O no hydrogen 2.810 N/A ILE 331.A N ASN 346.A OD1 no hydrogen 2.742 N/A ARG 336.A NE ALA 333.A O no hydrogen 3.146 N/A CYS 339.A SG PHE 340.A O no hydrogen 3.868 N/A PHE 340.A N ASP 312.A OD1 no hydrogen 3.273 N/A LYS 344.A NZ ASP 325.A O no hydrogen 3.236 N/A LYS 344.A NZ GLU 350.A OE1 no hydrogen 3.243 N/A ASN 346.A N ARG 329.A O no hydrogen 3.187 N/A ASN 346.A ND2 ILE 331.A O no hydrogen 2.934 N/A SER 347.A N SER 328.A OG no hydrogen 2.750 N/A SER 347.A OG GLU 350.A OE1 no hydrogen 3.279 N/A GLU 350.A N SER 347.A O no hydrogen 3.236 N/A GLN 351.A NE2 PRO 297.A O no hydrogen 2.562 N/A GLN 351.A NE2 ALA 299.A O no hydrogen 3.177 N/A TYR 352.A N LYS 326.A O no hydrogen 2.853 N/A VAL 353.A N ILE 301.A O no hydrogen 3.086 N/A PHE 354.A N SER 328.A O no hydrogen 2.868 N/A CYS 355.A N TYR 303.A O no hydrogen 3.026 N/A CYS 355.A SG THR 356.A O no hydrogen 3.222 N/A THR 356.A OG1 ASN 358.A OD1 no hydrogen 2.637 N/A VAL 357.A N ALA 305.A O no hydrogen 2.981 N/A ALA 359.A N THR 356.A O no hydrogen 3.169 N/A LEU 360.A N VAL 357.A O no hydrogen 3.197 N/A THR 363.A N ARG 387.A O no hydrogen 3.063 N/A THR 363.A OG1 THR 364.A O no hydrogen 3.348 N/A THR 364.A N THR 363.A OG1 no hydrogen 2.603 N/A ASP 366.A N ARG 300.A O no hydrogen 2.664 N/A ILE 367.A N ARG 300.A O no hydrogen 3.131 N/A VAL 368.A N HIS 392.A O no hydrogen 2.915 N/A VAL 369.A N VAL 302.A O no hydrogen 3.006 N/A PHE 370.A N VAL 394.A O no hydrogen 2.802 N/A ASP 371.A N THR 304.A O no hydrogen 2.936 N/A ILE 373.A N ILE 396.A O no hydrogen 2.730 N/A SER 374.A OG LEU 402.A O no hydrogen 2.663 N/A MET 375.A N GLU 372.A O no hydrogen 3.058 N/A ALA 376.A N ILE 373.A O no hydrogen 3.178 N/A THR 377.A N ASP 380.A OD2 no hydrogen 2.968 N/A THR 377.A OG1 ASP 380.A OD2 no hydrogen 3.222 N/A TYR 379.A OH MET 230.A O no hydrogen 3.105 N/A LEU 381.A N THR 377.A O no hydrogen 3.151 N/A SER 382.A N ASN 378.A O no hydrogen 3.042 N/A SER 382.A OG ALA 234.A O no hydrogen 2.839 N/A VAL 383.A N TYR 379.A O no hydrogen 2.990 N/A VAL 384.A N ASP 380.A O no hydrogen 2.982 N/A ASN 385.A N LEU 381.A O no hydrogen 3.314 N/A ASN 385.A ND2 PRO 235.A O no hydrogen 2.951 N/A ALA 386.A N SER 382.A O no hydrogen 3.048 N/A ARG 387.A N VAL 383.A O no hydrogen 2.874 N/A ARG 387.A NE LEU 360.A O no hydrogen 3.429 N/A LEU 388.A N VAL 384.A O no hydrogen 2.870 N/A ARG 389.A N THR 363.A O no hydrogen 3.160 N/A ALA 390.A N TYR 393.A OH no hydrogen 2.996 N/A LYS 391.A N ALA 365.A O no hydrogen 3.078 N/A HIS 392.A ND1 GLN 272.A O no hydrogen 3.103 N/A HIS 392.A NE2 THR 247.A O no hydrogen 2.944 N/A TYR 393.A N LYS 273.A O no hydrogen 2.948 N/A TYR 393.A OH LEU 388.A O no hydrogen 2.575 N/A VAL 394.A N VAL 368.A O no hydrogen 2.723 N/A TYR 395.A N SER 275.A O no hydrogen 2.906 N/A ILE 396.A N PHE 370.A O no hydrogen 2.710 N/A GLY 397.A N LEU 277.A O no hydrogen 3.111 N/A GLN 401.A N ASP 398.A O no hydrogen 2.889 N/A GLN 401.A NE2 ASP 398.A OD2 no hydrogen 2.879 N/A LEU 402.A N GLN 534.A OE1 no hydrogen 3.264 N/A ARG 406.A NH2 PHE 419.A O no hydrogen 2.609 N/A LEU 409.A N ARG 406.A O no hydrogen 3.122 N/A THR 410.A N THR 116.A O no hydrogen 3.247 N/A LYS 411.A N THR 116.A O no hydrogen 2.793 N/A LYS 411.A NZ ASN 117.A OD1 no hydrogen 2.613 N/A TYR 418.A N GLU 415.A O no hydrogen 2.679 N/A PHE 419.A N PRO 416.A O no hydrogen 3.190 N/A ASN 420.A ND2 ILE 373.A O no hydrogen 3.134 N/A ASN 420.A ND2 ALA 376.A O no hydrogen 3.129 N/A SER 421.A N ASN 378.A OD1 no hydrogen 2.835 N/A SER 421.A OG THR 236.A OG1 no hydrogen 2.558 N/A SER 421.A OG ASN 378.A OD1 no hydrogen 3.022 N/A VAL 422.A N ASN 420.A OD1 no hydrogen 2.630 N/A CYS 423.A N ASN 420.A OD1 no hydrogen 3.134 N/A ARG 424.A N ASN 420.A O no hydrogen 3.060 N/A ARG 424.A NH1 GLU 417.A OE1 no hydrogen 3.325 N/A LEU 425.A N SER 421.A O no hydrogen 3.113 N/A MET 426.A N VAL 422.A O no hydrogen 3.022 N/A LYS 427.A N CYS 423.A O no hydrogen 2.880 N/A THR 428.A N ARG 424.A O no hydrogen 3.126 N/A THR 428.A N LEU 425.A O no hydrogen 3.340 N/A THR 428.A OG1 ARG 424.A O no hydrogen 2.678 N/A THR 428.A OG1 LEU 425.A O no hydrogen 3.463 N/A ASP 432.A N THR 276.A OG1 no hydrogen 2.688 N/A MET 433.A N THR 276.A O no hydrogen 2.969 N/A LEU 435.A N GLN 278.A O no hydrogen 3.280 N/A CYS 438.A N LYS 459.A O no hydrogen 2.896 N/A CYS 438.A SG PRO 281.A O no hydrogen 3.545 N/A ARG 439.A NH1 HIS 461.A NE2 no hydrogen 3.488 N/A ARG 440.A NE GLU 537.A OE1 no hydrogen 2.608 N/A ARG 440.A NH1 THR 563.A O no hydrogen 3.095 N/A CYS 441.A SG THR 563.A O no hydrogen 3.858 N/A CYS 441.A SG ALA 565.A O no hydrogen 3.991 N/A ALA 443.A N ASP 463.A O no hydrogen 3.008 N/A GLU 444.A N GLU 444.A OE1 no hydrogen 2.541 N/A ILE 445.A N PRO 442.A O no hydrogen 2.939 N/A VAL 446.A N PRO 442.A O no hydrogen 3.351 N/A ASP 447.A N ALA 443.A O no hydrogen 2.945 N/A THR 448.A N GLU 444.A O no hydrogen 3.158 N/A THR 448.A OG1 GLU 444.A O no hydrogen 2.734 N/A VAL 449.A N ILE 445.A O no hydrogen 3.065 N/A SER 450.A N VAL 446.A O no hydrogen 2.775 N/A SER 450.A OG LEU 458.A O no hydrogen 2.904 N/A ALA 451.A N ASP 447.A O no hydrogen 3.040 N/A LEU 452.A N VAL 449.A O no hydrogen 3.207 N/A VAL 453.A N VAL 449.A O no hydrogen 2.907 N/A TYR 454.A N SER 450.A O no hydrogen 3.284 N/A TYR 454.A OH ASP 398.A OD2 no hydrogen 2.446 N/A ASN 456.A N SER 450.A O no hydrogen 2.606 N/A LYS 457.A N TYR 454.A O no hydrogen 3.054 N/A LEU 458.A N SER 450.A OG no hydrogen 2.728 N/A LYS 459.A N GLY 436.A O no hydrogen 2.757 N/A LYS 459.A NZ ASN 456.A O no hydrogen 3.174 N/A HIS 461.A N CYS 438.A O no hydrogen 3.059 N/A LYS 462.A NZ ARG 440.A O no hydrogen 2.807 N/A LYS 462.A NZ LYS 566.A O no hydrogen 2.897 N/A SER 465.A N GLU 444.A OE1 no hydrogen 3.139 N/A SER 465.A OG VAL 567.A O no hydrogen 2.793 N/A ALA 466.A N GLU 444.A OE2 no hydrogen 2.875 N/A GLN 467.A N SER 465.A OG no hydrogen 3.347 N/A CYS 468.A SG SER 465.A OG no hydrogen 3.615 N/A PHE 469.A N ILE 569.A O no hydrogen 2.735 N/A LYS 470.A N THR 585.A O no hydrogen 2.913 N/A LYS 470.A NZ TYR 579.A O no hydrogen 2.869 N/A LYS 470.A NZ LEU 582.A O no hydrogen 2.635 N/A MET 471.A N.A CYS 571.A O no hydrogen 2.631 N/A MET 471.A N.B CYS 571.A O no hydrogen 2.623 N/A TYR 473.A N MET 573.A O no hydrogen 2.965 N/A VAL 476.A N ASN 486.A OD1 no hydrogen 3.252 N/A THR 478.A N ILE 485.A O no hydrogen 2.861 N/A THR 478.A OG1 ILE 485.A O no hydrogen 3.364 N/A ASP 480.A N SER 483.A O no hydrogen 3.253 N/A SER 483.A OG SER 482.A O no hydrogen 2.641 N/A ILE 485.A N THR 478.A O no hydrogen 2.666 N/A ASN 486.A N GLN 515.A OE1 no hydrogen 2.344 N/A ASN 486.A ND2 LYS 474.A O no hydrogen 2.761 N/A ASN 486.A ND2 THR 546.A O no hydrogen 2.627 N/A GLN 489.A NE2 TYR 473.A O no hydrogen 2.613 N/A GLN 489.A NE2 SER 574.A OG no hydrogen 2.945 N/A ILE 490.A N ASN 486.A O no hydrogen 3.311 N/A GLY 491.A N ARG 487.A O no hydrogen 2.710 N/A VAL 492.A N PRO 488.A O no hydrogen 2.834 N/A VAL 492.A N GLN 489.A O no hydrogen 3.236 N/A VAL 493.A N GLN 489.A O no hydrogen 3.211 N/A ARG 494.A N ILE 490.A O no hydrogen 3.045 N/A GLU 495.A N GLY 491.A O no hydrogen 3.449 N/A PHE 496.A N VAL 492.A O no hydrogen 3.124 N/A LEU 497.A N VAL 493.A O no hydrogen 2.555 N/A THR 498.A N ARG 494.A O no hydrogen 3.182 N/A THR 498.A OG1 GLU 495.A O no hydrogen 3.535 N/A ASN 500.A N PHE 496.A O no hydrogen 2.846 N/A TRP 503.A N ASN 500.A O no hydrogen 3.215 N/A ARG 504.A N PRO 501.A O no hydrogen 3.234 N/A ALA 506.A N TRP 503.A O no hydrogen 3.174 N/A VAL 507.A N TYR 540.A O no hydrogen 2.970 N/A PHE 508.A N PRO 526.A O no hydrogen 3.068 N/A ILE 509.A N ILE 542.A O no hydrogen 2.998 N/A SER 510.A OG TYR 512.A O no hydrogen 2.645 N/A SER 510.A OG ASN 516.A OD1 no hydrogen 2.325 N/A TYR 512.A OH THR 547.A OG1 no hydrogen 2.491 N/A SER 514.A OG ASP 480.A OD2 no hydrogen 3.483 N/A GLN 515.A NE2 ASN 486.A O no hydrogen 2.566 N/A ASN 516.A N TYR 512.A O no hydrogen 3.321 N/A ASN 516.A ND2 GLN 528.A O no hydrogen 2.391 N/A ALA 517.A N ASN 513.A O no hydrogen 2.969 N/A VAL 518.A N SER 514.A O no hydrogen 3.133 N/A ALA 519.A N GLN 515.A O no hydrogen 3.170 N/A ALA 519.A N ASN 516.A O no hydrogen 2.954 N/A SER 520.A N ASN 516.A O no hydrogen 3.290 N/A SER 520.A OG ASN 516.A O no hydrogen 3.364 N/A LEU 523.A N ALA 519.A O no hydrogen 2.964 N/A GLY 524.A N ALA 519.A O no hydrogen 3.278 N/A GLN 528.A N PHE 508.A O no hydrogen 2.731 N/A THR 529.A N SER 532.A OG no hydrogen 2.639 N/A THR 529.A OG1 SER 532.A OG no hydrogen 2.563 N/A SER 532.A N THR 529.A OG1 no hydrogen 3.112 N/A SER 532.A OG THR 529.A O no hydrogen 3.055 N/A SER 532.A OG THR 529.A OG1 no hydrogen 2.563 N/A SER 533.A OG THR 529.A O no hydrogen 3.135 N/A SER 533.A OG VAL 530.A O no hydrogen 3.366 N/A GLN 534.A NE2 GLU 372.A OE1 no hydrogen 3.342 N/A SER 536.A OG SER 533.A O no hydrogen 3.476 N/A SER 536.A OG TYR 538.A OH no hydrogen 2.890 N/A TYR 538.A N ARG 564.A O no hydrogen 2.771 N/A TYR 540.A OH GLN 467.A OE1 no hydrogen 2.623 N/A VAL 541.A N GLY 568.A O no hydrogen 3.205 N/A ILE 542.A N VAL 507.A O no hydrogen 2.820 N/A PHE 543.A N LEU 570.A O no hydrogen 2.647 N/A THR 544.A N ILE 509.A O no hydrogen 3.305 N/A GLN 545.A N ILE 572.A O no hydrogen 3.043 N/A GLN 545.A NE2 SER 552.A O no hydrogen 3.302 N/A THR 546.A N GLN 489.A OE1 no hydrogen 2.948 N/A THR 546.A OG1 THR 544.A O no hydrogen 3.268 N/A THR 547.A N GLN 545.A O no hydrogen 2.605 N/A THR 547.A OG1 TYR 512.A OH no hydrogen 2.491 N/A THR 547.A OG1 THR 549.A OG1 no hydrogen 3.394 N/A THR 549.A OG1 TYR 512.A OH no hydrogen 2.774 N/A THR 549.A OG1 THR 547.A OG1 no hydrogen 3.394 N/A HIS 551.A N THR 549.A OG1 no hydrogen 3.240 N/A SER 552.A N THR 549.A OG1 no hydrogen 3.209 N/A SER 552.A OG THR 547.A O no hydrogen 2.630 N/A SER 552.A OG THR 549.A O no hydrogen 3.447 N/A CYS 553.A N THR 549.A O no hydrogen 2.952 N/A CYS 553.A SG GLU 548.A O no hydrogen 3.483 N/A CYS 553.A SG THR 549.A O no hydrogen 3.427 N/A CYS 553.A SG ASP 575.A OD2 no hydrogen 3.216 N/A ASN 556.A ND2 PRO 399.A O no hydrogen 2.613 N/A ASN 556.A ND2 GLN 401.A O no hydrogen 2.921 N/A ARG 557.A N ASN 554.A OD1 no hydrogen 2.847 N/A ARG 557.A NH1 HIS 551.A O no hydrogen 2.970 N/A PHE 558.A N ASN 554.A O no hydrogen 2.896 N/A ASN 559.A N VAL 555.A O no hydrogen 2.847 N/A ASN 559.A ND2 ALA 400.A O no hydrogen 2.939 N/A ASN 559.A ND2 TYR 454.A OH no hydrogen 2.692 N/A VAL 560.A N ASN 556.A O no hydrogen 3.012 N/A ALA 561.A N ARG 557.A O no hydrogen 2.859 N/A ILE 562.A N PHE 558.A O no hydrogen 3.197 N/A THR 563.A OG1 ASN 559.A O no hydrogen 2.578 N/A THR 563.A OG1 VAL 560.A O no hydrogen 3.095 N/A ARG 564.A N ALA 561.A O no hydrogen 3.456 N/A ARG 564.A NE VAL 560.A O no hydrogen 2.817 N/A ARG 564.A NH1 SER 533.A O no hydrogen 3.329 N/A ARG 564.A NH2 THR 563.A OG1 no hydrogen 3.238 N/A LYS 566.A N TYR 538.A O no hydrogen 2.612 N/A LYS 566.A N ASP 539.A O no hydrogen 3.172 N/A LYS 566.A NZ ASP 539.A OD1 no hydrogen 2.532 N/A VAL 567.A N ASP 539.A O no hydrogen 2.900 N/A GLY 568.A N ASP 539.A O no hydrogen 3.366 N/A ILE 569.A N GLN 467.A O no hydrogen 3.026 N/A LEU 570.A N VAL 541.A O no hydrogen 2.894 N/A CYS 571.A N PHE 469.A O no hydrogen 3.029 N/A ILE 572.A N PHE 543.A O no hydrogen 2.833 N/A MET 573.A N MET 471.A O.A no hydrogen 2.607 N/A MET 573.A N MET 471.A O.B no hydrogen 2.608 N/A SER 574.A N GLN 545.A OE1 no hydrogen 2.612 N/A ASP 575.A N GLN 545.A OE1 no hydrogen 2.623 N/A ARG 576.A NE ASP 580.A OD1 no hydrogen 3.342 N/A ARG 576.A NE ASP 580.A OD2 no hydrogen 2.846 N/A ASP 577.A N ASP 575.A OD1 no hydrogen 2.926 N/A TYR 579.A N ASP 575.A O no hydrogen 3.042 N/A ASP 580.A N ARG 576.A O no hydrogen 3.072 N/A LYS 581.A N ASP 577.A O no hydrogen 3.200 N/A LYS 581.A NZ ASP 577.A OD2 no hydrogen 2.841 N/A LEU 582.A N LEU 578.A O no hydrogen 3.071 N/A LEU 582.A N TYR 579.A O no hydrogen 3.157 N/A GLN 583.A N THR 448.A OG1 no hydrogen 3.308 N/A THR 585.A N CYS 468.A O no hydrogen 2.975 N/A