Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hcy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 13.A OD2 no hydrogen 3.153 N/A THR 5.A OG1 GLU 95.A OE2 no hydrogen 3.043 N/A GLN 11.A N ASN 7.A O no hydrogen 2.558 N/A GLN 12.A NE2 ASP 544.A OD1 no hydrogen 2.515 N/A ASP 13.A N GLN 9.A O no hydrogen 2.616 N/A ILE 14.A N LYS 10.A O no hydrogen 3.009 N/A ASN 15.A N GLN 11.A O no hydrogen 2.970 N/A HIS 16.A N GLN 12.A O no hydrogen 2.876 N/A LEU 17.A N ASP 13.A O no hydrogen 3.105 N/A LEU 18.A N ILE 14.A O no hydrogen 2.873 N/A ASP 19.A N HIS 16.A O no hydrogen 3.212 N/A LYS 20.A NZ ASP 19.A OD2 no hydrogen 3.416 N/A THR 25.A N GLU 108.A OE2 no hydrogen 2.805 N/A THR 25.A OG1 GLU 108.A OE2 no hydrogen 2.589 N/A LYS 26.A NZ PRO 24.A O no hydrogen 3.545 N/A TYR 27.A OH ASP 19.A OD2 no hydrogen 3.198 N/A ASP 29.A N ASP 29.A OD1 no hydrogen 2.306 N/A LYS 31.A N TYR 27.A O no hydrogen 3.070 N/A ASP 32.A N PRO 28.A O no hydrogen 2.872 N/A ILE 33.A N ASP 29.A O no hydrogen 2.850 N/A ALA 34.A N LEU 30.A O no hydrogen 2.933 N/A GLU 35.A N LYS 31.A O no hydrogen 2.982 N/A GLU 35.A N ASP 32.A O no hydrogen 3.101 N/A ASN 36.A N ASP 32.A O no hydrogen 2.609 N/A PHE 37.A N ILE 33.A O no hydrogen 2.826 N/A GLY 41.A N ASN 38.A O no hydrogen 3.030 N/A SER 44.A OG ASP 42.A OD1 no hydrogen 3.367 N/A ILE 45.A N ASP 42.A O no hydrogen 3.265 N/A TYR 46.A OH PRO 39.A O no hydrogen 3.259 N/A TYR 46.A OH ASN 102.A OD1 no hydrogen 2.738 N/A ASN 47.A N GLN 92.A O no hydrogen 2.915 N/A ASN 47.A ND2 GLN 92.A O no hydrogen 3.506 N/A HIS 49.A N TYR 46.A O no hydrogen 3.315 N/A ALA 52.A N ASP 48.A OD2 no hydrogen 2.524 N/A GLU 54.A N GLY 50.A O no hydrogen 2.474 N/A THR 55.A N ALA 52.A O no hydrogen 2.516 N/A THR 55.A OG1 ALA 51.A O no hydrogen 3.335 N/A LEU 56.A N ALA 52.A O no hydrogen 3.324 N/A LEU 56.A N VAL 53.A O no hydrogen 3.086 N/A MET 57.A N VAL 53.A O no hydrogen 2.914 N/A GLU 59.A N THR 55.A O no hydrogen 3.359 N/A GLU 59.A N LEU 56.A O no hydrogen 2.718 N/A LEU 60.A N LEU 56.A O no hydrogen 2.840 N/A ASN 61.A N MET 57.A O no hydrogen 2.672 N/A ASN 61.A ND2 MET 57.A O no hydrogen 3.135 N/A ASP 62.A N LYS 58.A O no hydrogen 3.156 N/A ARG 64.A N GLU 59.A O no hydrogen 3.199 N/A LEU 66.A N GLU 82.A OE1 no hydrogen 2.633 N/A ARG 69.A N GLU 112.A OE2 no hydrogen 2.254 N/A ARG 69.A NE TYR 22.A O no hydrogen 2.918 N/A HIS 70.A ND1 TRP 71.A O no hydrogen 2.910 N/A SER 73.A N GLN 79.A OE1 no hydrogen 2.910 N/A PHE 75.A N SER 73.A OG no hydrogen 3.180 N/A ASN 76.A N SER 73.A O no hydrogen 3.332 N/A ARG 78.A NH1 GLU 82.A OE2 no hydrogen 2.520 N/A ARG 80.A N ASN 76.A O no hydrogen 2.829 N/A ARG 80.A NE LEU 74.A O no hydrogen 2.867 N/A ARG 80.A NH2 LEU 74.A O no hydrogen 3.547 N/A LYS 81.A N THR 77.A O no hydrogen 3.492 N/A GLU 82.A N ARG 78.A O no hydrogen 2.746 N/A ALA 83.A N GLN 79.A O no hydrogen 2.778 N/A LEU 84.A N ARG 80.A O no hydrogen 2.660 N/A MET 85.A N GLU 82.A O no hydrogen 2.688 N/A LEU 86.A N ALA 83.A O no hydrogen 3.112 N/A ALA 88.A N LEU 84.A O no hydrogen 3.434 N/A VAL 89.A N LEU 86.A O no hydrogen 2.965 N/A LEU 90.A N LEU 86.A O no hydrogen 3.162 N/A ASN 91.A N PHE 87.A O no hydrogen 2.743 N/A ASN 91.A ND2 TYR 209.A O no hydrogen 3.694 N/A LYS 94.A N ILE 45.A O no hydrogen 2.570 N/A CYS 98.A N GLU 95.A O no hydrogen 2.785 N/A CYS 98.A SG ASN 102.A OD1 no hydrogen 3.947 N/A ARG 100.A N TRP 96.A O no hydrogen 2.936 N/A ARG 100.A NE ASP 13.A OD1 no hydrogen 2.426 N/A ASN 102.A N CYS 98.A O no hydrogen 3.066 N/A ALA 103.A N PHE 99.A O no hydrogen 2.586 N/A ALA 104.A N ASN 102.A O no hydrogen 2.440 N/A TYR 105.A N SER 101.A O no hydrogen 2.718 N/A PHE 106.A N ASN 102.A O no hydrogen 2.847 N/A ARG 107.A NE LEU 17.A O no hydrogen 3.090 N/A ARG 107.A NH1 GLU 23.A O no hydrogen 3.260 N/A ARG 107.A NH1 GLU 108.A OE1 no hydrogen 2.995 N/A ARG 107.A NH2 LEU 17.A O no hydrogen 3.031 N/A ARG 107.A NH2 LYS 20.A O no hydrogen 3.153 N/A GLU 108.A N ALA 104.A O no hydrogen 3.154 N/A ARG 109.A N PHE 106.A O no hydrogen 2.434 N/A ARG 109.A NE TYR 105.A O no hydrogen 2.457 N/A ARG 109.A NH2 TYR 105.A O no hydrogen 3.483 N/A MET 110.A N PHE 106.A O no hydrogen 2.986 N/A ASN 111.A ND2 GLU 67.A O no hydrogen 2.558 N/A ASN 111.A ND2 HIS 70.A O no hydrogen 3.586 N/A GLY 113.A N ASN 111.A OD1 no hydrogen 2.702 N/A GLU 114.A N ASN 111.A OD1 no hydrogen 3.241 N/A PHE 115.A N ASN 111.A O no hydrogen 2.881 N/A VAL 116.A N GLU 112.A O no hydrogen 2.396 N/A TYR 117.A N GLY 113.A O no hydrogen 2.662 N/A ALA 118.A N GLU 114.A O no hydrogen 2.571 N/A LEU 119.A N PHE 115.A O no hydrogen 2.794 N/A TYR 120.A N VAL 116.A O no hydrogen 3.008 N/A TYR 120.A OH PRO 135.A O no hydrogen 2.910 N/A VAL 121.A N TYR 117.A O no hydrogen 3.254 N/A SER 122.A N ALA 118.A O no hydrogen 3.040 N/A SER 122.A OG ALA 118.A O no hydrogen 2.673 N/A VAL 123.A N LEU 119.A O no hydrogen 2.749 N/A ILE 124.A N TYR 120.A O no hydrogen 3.010 N/A HIS 125.A N VAL 121.A O no hydrogen 3.017 N/A HIS 125.A ND1 TYR 211.A OH no hydrogen 2.556 N/A HIS 125.A NE2 MET 199.A O no hydrogen 2.632 N/A SER 126.A N SER 122.A O no hydrogen 3.058 N/A LYS 127.A NZ HIS 125.A O no hydrogen 3.353 N/A LEU 128.A N SER 126.A OG no hydrogen 2.911 N/A GLY 129.A N SER 126.A O no hydrogen 2.876 N/A GLN 139.A N PRO 136.A O no hydrogen 2.638 N/A ILE 140.A N PRO 136.A O no hydrogen 3.312 N/A THR 141.A N LEU 137.A O no hydrogen 3.006 N/A THR 141.A OG1 THR 141.A O no hydrogen 2.394 N/A MET 144.A N THR 141.A O no hydrogen 3.447 N/A PHE 145.A N PRO 142.A O no hydrogen 3.237 N/A THR 146.A N PRO 142.A O no hydrogen 2.873 N/A THR 146.A OG1 PRO 142.A O no hydrogen 3.026 N/A THR 146.A OG1 TYR 431.A OH no hydrogen 2.350 N/A SER 148.A OG GLU 267.A OE2 no hydrogen 2.998 N/A ASP 152.A N SER 148.A O no hydrogen 3.105 N/A LYS 153.A N GLU 149.A O no hydrogen 2.856 N/A ALA 154.A N VAL 150.A O no hydrogen 2.836 N/A TYR 155.A N ILE 151.A O no hydrogen 3.023 N/A TYR 155.A OH HIS 143.A NE2 no hydrogen 2.884 N/A SER 156.A N ASP 152.A O no hydrogen 3.052 N/A ALA 157.A N LYS 153.A O no hydrogen 3.035 N/A LYS 158.A N ALA 154.A O no hydrogen 3.065 N/A MET 159.A N TYR 155.A O no hydrogen 2.958 N/A THR 160.A N SER 156.A O no hydrogen 2.932 N/A THR 160.A OG1 SER 156.A O no hydrogen 3.448 N/A THR 160.A OG1 ALA 157.A O no hydrogen 3.178 N/A GLN 161.A N LYS 158.A O no hydrogen 2.893 N/A GLN 161.A NE2 GLU 444.A O no hydrogen 3.195 N/A GLY 164.A N GLU 447.A O no hydrogen 3.457 N/A PHE 166.A N ASN 449.A O no hydrogen 2.956 N/A VAL 168.A N ARG 451.A O no hydrogen 2.779 N/A SER 169.A OG GLU 149.A OE1 no hydrogen 3.531 N/A THR 171.A OG1 GLU 186.A OE1 no hydrogen 3.067 N/A THR 171.A OG1 GLU 186.A OE2 no hydrogen 2.834 N/A ARG 177.A NH2 GLU 254.A OE2 no hydrogen 3.229 N/A GLN 179.A NE2 GLU 186.A OE2 no hydrogen 3.344 N/A ARG 180.A NE ASN 238.A O no hydrogen 2.907 N/A ARG 180.A NH2 ASN 238.A O no hydrogen 2.828 N/A TYR 183.A OH GLU 234.A OE1 no hydrogen 2.107 N/A PHE 184.A N VAL 181.A O no hydrogen 3.426 N/A GLU 186.A N ALA 182.A O no hydrogen 2.913 N/A GLY 189.A N ASP 187.A OD1 no hydrogen 2.164 N/A MET 190.A N ASP 187.A OD1 no hydrogen 2.862 N/A ASN 191.A N ASP 187.A O no hydrogen 2.849 N/A ASN 191.A ND2 GLY 185.A O no hydrogen 2.776 N/A ILE 192.A N ILE 188.A O no hydrogen 3.141 N/A HIS 193.A N GLY 189.A O no hydrogen 2.902 N/A HIS 193.A ND1 CYS 562.A O no hydrogen 2.639 N/A HIS 194.A N MET 190.A O no hydrogen 2.727 N/A HIS 194.A NE2 HIS 224.A NE2 no hydrogen 3.226 N/A VAL 195.A N ASN 191.A O no hydrogen 3.286 N/A THR 196.A N ILE 192.A O no hydrogen 2.762 N/A THR 196.A OG1 ILE 192.A O no hydrogen 3.216 N/A TRP 197.A N HIS 193.A O no hydrogen 2.605 N/A HIS 198.A N HIS 194.A O no hydrogen 3.369 N/A HIS 198.A NE2 HIS 194.A NE2 no hydrogen 2.770 N/A HIS 198.A NE2 HIS 224.A NE2 no hydrogen 3.212 N/A MET 199.A N THR 196.A O no hydrogen 2.575 N/A ASP 200.A N THR 196.A O no hydrogen 2.573 N/A PHE 201.A N TRP 197.A O no hydrogen 3.029 N/A TRP 204.A NE1 TYR 117.A OH no hydrogen 2.751 N/A TRP 205.A N PRO 202.A O no hydrogen 3.476 N/A TYR 209.A N GLU 206.A O no hydrogen 3.294 N/A GLY 210.A N ASP 207.A O no hydrogen 3.313 N/A TYR 211.A OH HIS 125.A ND1 no hydrogen 2.556 N/A TYR 211.A OH HIS 125.A O no hydrogen 2.917 N/A TYR 211.A OH VAL 602.A O no hydrogen 3.284 N/A LEU 213.A N TYR 333.A OH no hydrogen 3.253 N/A ARG 215.A NE GLU 218.A OE2 no hydrogen 2.445 N/A ARG 215.A NH2 ARG 611.A O no hydrogen 3.059 N/A LEU 219.A N ARG 215.A O no hydrogen 2.770 N/A PHE 221.A N GLY 217.A O no hydrogen 2.930 N/A TRP 222.A N GLU 218.A O no hydrogen 2.899 N/A VAL 223.A N LEU 219.A O no hydrogen 2.852 N/A HIS 224.A N PHE 220.A O no hydrogen 3.510 N/A HIS 224.A ND1 PHE 220.A O no hydrogen 3.248 N/A HIS 225.A NE2 TRP 500.A O no hydrogen 2.949 N/A GLN 226.A N TRP 222.A O no hydrogen 2.807 N/A LEU 227.A N VAL 223.A O no hydrogen 3.081 N/A THR 228.A N HIS 224.A O no hydrogen 2.534 N/A THR 228.A OG1 HIS 224.A O no hydrogen 2.301 N/A ALA 229.A N HIS 225.A O no hydrogen 2.785 N/A ARG 230.A N GLN 226.A O no hydrogen 2.648 N/A ARG 230.A NH1 GLU 504.A O no hydrogen 3.078 N/A ARG 230.A NH2 LEU 569.A O no hydrogen 2.585 N/A PHE 231.A N LEU 227.A O no hydrogen 2.731 N/A ASP 232.A N THR 228.A O no hydrogen 2.983 N/A PHE 233.A N ALA 229.A O no hydrogen 2.631 N/A GLU 234.A N ARG 230.A O no hydrogen 3.189 N/A ARG 235.A N PHE 231.A O no hydrogen 3.024 N/A ARG 235.A NH1 ASP 241.A O no hydrogen 2.803 N/A ARG 235.A NH2 GLU 178.A OE1 no hydrogen 3.002 N/A LEU 236.A N ASP 232.A O no hydrogen 3.085 N/A LEU 236.A N PHE 233.A O no hydrogen 2.640 N/A SER 237.A N PHE 233.A O no hydrogen 3.100 N/A SER 237.A OG PHE 233.A O no hydrogen 3.129 N/A ASN 238.A N ARG 235.A O no hydrogen 3.007 N/A ASN 238.A ND2 GLU 234.A O no hydrogen 2.816 N/A TRP 239.A N LEU 236.A O no hydrogen 2.998 N/A LEU 240.A N ARG 235.A O no hydrogen 2.662 N/A VAL 243.A N ASP 232.A OD1 no hydrogen 2.529 N/A LEU 246.A N ARG 382.A O no hydrogen 3.133 N/A TRP 248.A NE1 TYR 386.A OH no hydrogen 3.042 N/A ARG 250.A N HIS 247.A O no hydrogen 3.397 N/A ILE 252.A N ILE 275.A O no hydrogen 2.756 N/A THR 260.A OG1 PRO 258.A O no hydrogen 3.261 N/A SER 261.A OG SER 148.A OG no hydrogen 2.541 N/A TYR 262.A N GLY 266.A O no hydrogen 3.104 N/A TYR 262.A OH PRO 365.A O no hydrogen 3.142 N/A TYR 262.A OH HIS 370.A NE2 no hydrogen 2.318 N/A LYS 263.A NZ TYR 155.A OH no hydrogen 3.410 N/A LYS 263.A NZ ALA 436.A O no hydrogen 3.417 N/A LYS 263.A NZ ASP 438.A OD2 no hydrogen 2.772 N/A PHE 268.A N THR 260.A O no hydrogen 3.090 N/A ARG 271.A N PHE 256.A O no hydrogen 3.158 N/A ARG 271.A NH1 GLU 254.A O no hydrogen 3.382 N/A ASN 274.A N ARG 253.A O no hydrogen 3.102 N/A ASP 281.A N PRO 357.A O no hydrogen 3.317 N/A VAL 283.A N VAL 280.A O no hydrogen 3.144 N/A ALA 284.A N VAL 280.A O no hydrogen 3.200 N/A HIS 285.A ND1 ASP 279.A OD1 no hydrogen 2.869 N/A VAL 286.A N ASP 279.A OD1 no hydrogen 2.421 N/A ASP 288.A N HIS 285.A O no hydrogen 2.928 N/A LEU 289.A N VAL 286.A O no hydrogen 3.152 N/A GLU 290.A N VAL 286.A O no hydrogen 3.447 N/A ILE 291.A N HIS 287.A O no hydrogen 2.775 N/A THR 292.A N ASP 288.A O no hydrogen 3.216 N/A GLU 293.A N LEU 289.A O no hydrogen 2.800 N/A SER 294.A N ILE 291.A O no hydrogen 2.569 N/A SER 294.A OG GLU 290.A O no hydrogen 3.068 N/A SER 294.A OG ILE 291.A O no hydrogen 2.908 N/A ARG 295.A N ILE 291.A O no hydrogen 2.814 N/A ARG 295.A NE TYR 339.A O no hydrogen 3.044 N/A ILE 296.A N THR 292.A O no hydrogen 3.013 N/A HIS 297.A N GLU 293.A O no hydrogen 2.947 N/A GLU 298.A N ARG 295.A O no hydrogen 3.174 N/A ALA 299.A N ILE 296.A O no hydrogen 2.736 N/A ILE 300.A N ILE 296.A O no hydrogen 3.112 N/A HIS 302.A N GLU 298.A O no hydrogen 3.019 N/A HIS 302.A N ALA 299.A O no hydrogen 2.868 N/A GLY 303.A N ALA 299.A O no hydrogen 3.183 N/A ILE 305.A N ILE 313.A O no hydrogen 2.755 N/A THR 306.A N TYR 340.A OH no hydrogen 3.287 N/A THR 306.A OG1 ASP 307.A O no hydrogen 3.430 N/A ASP 307.A N HIS 311.A O no hydrogen 2.799 N/A ASP 309.A N ASP 307.A OD1 no hydrogen 2.337 N/A GLY 310.A N ASP 307.A OD1 no hydrogen 2.707 N/A HIS 311.A N ASP 307.A OD1 no hydrogen 2.844 N/A ILE 313.A N ILE 305.A O no hydrogen 2.880 N/A ILE 315.A N GLY 303.A O no hydrogen 3.072 N/A ARG 316.A N ASP 314.A OD1 no hydrogen 2.484 N/A GLN 317.A NE2 ASP 314.A O no hydrogen 3.120 N/A LYS 319.A N GLN 317.A OE1 no hydrogen 3.267 N/A LYS 319.A NZ GLU 322.A OE2 no hydrogen 2.559 N/A GLY 320.A N GLN 317.A O no hydrogen 2.640 N/A GLU 322.A N LYS 319.A O no hydrogen 3.005 N/A LEU 323.A N LYS 319.A O no hydrogen 3.056 N/A LEU 324.A N GLY 320.A O no hydrogen 2.972 N/A GLY 325.A N ILE 321.A O no hydrogen 3.309 N/A GLY 325.A N GLU 322.A O no hydrogen 2.570 N/A ASP 326.A N GLU 322.A O no hydrogen 2.968 N/A ASP 326.A N LEU 323.A O no hydrogen 3.204 N/A ILE 327.A N LEU 323.A O no hydrogen 3.445 N/A ILE 328.A N LEU 324.A O no hydrogen 2.811 N/A GLU 329.A N GLY 325.A O no hydrogen 3.412 N/A SER 330.A OG GLY 341.A O no hydrogen 2.795 N/A SER 330.A OG SER 342.A OG no hydrogen 2.371 N/A SER 331.A N ASP 326.A O no hydrogen 3.253 N/A LYS 332.A N PHE 203.A O no hydrogen 3.274 N/A TYR 333.A N SER 331.A OG no hydrogen 3.367 N/A TYR 333.A OH ASP 207.A OD1 no hydrogen 3.018 N/A TYR 333.A OH HIS 212.A ND1 no hydrogen 3.195 N/A SER 334.A N SER 331.A O no hydrogen 3.440 N/A SER 334.A OG ASP 326.A O no hydrogen 3.453 N/A ASN 336.A ND2 THR 306.A O no hydrogen 3.683 N/A TYR 339.A N ASN 336.A O no hydrogen 3.249 N/A TYR 340.A N ASN 336.A O no hydrogen 3.344 N/A SER 342.A OG SER 330.A OG no hydrogen 2.371 N/A HIS 344.A N ILE 328.A O no hydrogen 3.403 N/A HIS 344.A ND1 ASN 345.A OD1 no hydrogen 3.197 N/A HIS 344.A NE2 HIS 384.A NE2 no hydrogen 3.202 N/A THR 346.A N SER 342.A O no hydrogen 2.812 N/A THR 346.A OG1 SER 342.A O no hydrogen 3.335 N/A ALA 347.A N LEU 343.A O no hydrogen 2.896 N/A HIS 348.A N HIS 344.A O no hydrogen 2.999 N/A HIS 348.A N ASN 345.A O no hydrogen 2.650 N/A HIS 348.A ND1 MET 368.A O no hydrogen 2.623 N/A MET 350.A N THR 346.A O no hydrogen 2.605 N/A LEU 351.A N ALA 347.A O no hydrogen 3.206 N/A LEU 351.A N HIS 348.A O no hydrogen 2.929 N/A GLY 352.A N VAL 349.A O no hydrogen 3.377 N/A ARG 353.A NE GLU 369.A OE2 no hydrogen 2.426 N/A ARG 353.A NH2 GLU 369.A OE1 no hydrogen 2.894 N/A ASP 356.A N ARG 353.A O no hydrogen 2.400 N/A HIS 358.A ND1 ASP 281.A OD1 no hydrogen 2.731 N/A LYS 360.A N ASP 356.A OD1 no hydrogen 2.954 N/A PHE 361.A N ASP 356.A OD1 no hydrogen 3.400 N/A PHE 361.A N ASP 356.A OD2 no hydrogen 3.290 N/A ASN 362.A ND2 PHE 361.A O no hydrogen 3.056 N/A LEU 363.A N ASP 356.A OD2 no hydrogen 3.239 N/A GLU 369.A N GLY 366.A O no hydrogen 2.580 N/A HIS 370.A NE2 TYR 262.A OH no hydrogen 2.318 N/A THR 373.A N HIS 370.A O no hydrogen 3.290 N/A THR 373.A OG1 MET 144.A O no hydrogen 3.339 N/A ARG 376.A N THR 373.A O no hydrogen 3.297 N/A ARG 376.A NH1 PHE 145.A O no hydrogen 3.140 N/A ARG 376.A NH1 ASN 191.A OD1 no hydrogen 3.406 N/A ARG 376.A NH2 PHE 145.A O no hydrogen 3.404 N/A ASP 377.A N ALA 374.A O no hydrogen 3.226 N/A SER 379.A N ASP 377.A OD1 no hydrogen 3.453 N/A SER 379.A OG ASP 377.A OD2 no hydrogen 2.704 N/A PHE 380.A N ASP 377.A O no hydrogen 2.942 N/A ARG 382.A NH1 ASP 244.A OD2 no hydrogen 3.477 N/A ARG 382.A NH2 GLU 178.A OE1 no hydrogen 3.431 N/A ARG 382.A NH2 GLU 178.A OE2 no hydrogen 3.185 N/A LEU 383.A N SER 379.A O no hydrogen 2.732 N/A HIS 384.A N PHE 380.A O no hydrogen 3.186 N/A HIS 384.A ND1 PHE 380.A O no hydrogen 2.865 N/A LYS 385.A N PHE 381.A O no hydrogen 3.005 N/A LYS 385.A N ARG 382.A O no hydrogen 3.281 N/A LYS 385.A NZ ASP 232.A OD2 no hydrogen 3.461 N/A LYS 385.A NZ VAL 243.A O no hydrogen 2.964 N/A TYR 386.A N ARG 382.A O no hydrogen 3.348 N/A TYR 386.A OH GLU 293.A OE1 no hydrogen 2.472 N/A MET 387.A N LEU 383.A O no hydrogen 3.194 N/A ASP 388.A N HIS 384.A O no hydrogen 2.870 N/A ASN 389.A N LYS 385.A O no hydrogen 2.805 N/A ILE 390.A N MET 387.A O no hydrogen 3.001 N/A PHE 391.A N MET 387.A O no hydrogen 3.279 N/A PHE 391.A N ASP 388.A O no hydrogen 3.211 N/A LYS 392.A N ASP 388.A O no hydrogen 3.170 N/A LYS 392.A NZ ASP 396.A OD1 no hydrogen 2.944 N/A LYS 392.A NZ ASP 396.A OD2 no hydrogen 3.036 N/A LYS 393.A NZ HIS 297.A ND1 no hydrogen 2.902 N/A LYS 393.A NZ ASP 301.A OD1 no hydrogen 2.978 N/A LYS 393.A NZ ASP 301.A OD2 no hydrogen 2.329 N/A HIS 394.A N PHE 391.A O no hydrogen 2.727 N/A THR 395.A N PHE 391.A O no hydrogen 3.037 N/A ASP 396.A N LYS 392.A O no hydrogen 3.049 N/A SER 397.A N HIS 394.A O no hydrogen 2.988 N/A SER 397.A OG HIS 394.A O no hydrogen 3.209 N/A TYR 401.A OH GLU 618.A OE2 no hydrogen 2.554 N/A THR 402.A N ASN 405.A OD1 no hydrogen 3.187 N/A ASN 405.A N THR 402.A O no hydrogen 2.831 N/A LEU 406.A N THR 402.A O no hydrogen 3.281 N/A GLU 407.A N HIS 403.A O no hydrogen 3.325 N/A PHE 408.A N ASN 632.A OD1 no hydrogen 2.165 N/A VAL 412.A N SER 467.A O no hydrogen 3.117 N/A VAL 413.A N SER 631.A O no hydrogen 3.228 N/A ASN 414.A N THR 465.A O no hydrogen 2.940 N/A ASN 414.A ND2 SER 467.A OG no hydrogen 2.437 N/A GLY 415.A N THR 465.A O no hydrogen 2.794 N/A ALA 417.A N LYS 463.A O no hydrogen 2.637 N/A ASP 419.A N THR 461.A O no hydrogen 2.411 N/A THR 424.A N VAL 641.A O no hydrogen 2.818 N/A THR 424.A OG1 LYS 572.A O no hydrogen 2.482 N/A THR 424.A OG1 VAL 641.A O no hydrogen 3.470 N/A THR 424.A OG1 HIS 642.A ND1 no hydrogen 2.931 N/A PHE 425.A N ASN 456.A O no hydrogen 2.388 N/A PHE 429.A N VAL 452.A O no hydrogen 2.758 N/A TYR 431.A N ALA 450.A O no hydrogen 2.934 N/A TYR 431.A OH THR 146.A OG1 no hydrogen 2.350 N/A SER 432.A OG ILE 448.A O no hydrogen 3.562 N/A LEU 433.A N ILE 448.A O no hydrogen 3.268 N/A ASN 435.A ND2 ILE 140.A O no hydrogen 3.168 N/A ALA 436.A N LEU 433.A O no hydrogen 3.367 N/A VAL 437.A N ILE 434.A O no hydrogen 3.237 N/A ASN 449.A N GLY 164.A O no hydrogen 3.490 N/A ASN 449.A ND2 ILE 448.A O no hydrogen 2.693 N/A ALA 450.A N TYR 431.A O no hydrogen 2.857 N/A ARG 451.A N PHE 166.A O no hydrogen 2.524 N/A ARG 451.A NE ASN 167.A OD1 no hydrogen 2.242 N/A VAL 452.A N PHE 429.A O no hydrogen 2.430 N/A ARG 454.A NE ASP 187.A OD2 no hydrogen 2.699 N/A ARG 454.A NH1 ASP 532.A OD2 no hydrogen 3.133 N/A ARG 454.A NH2 ASP 187.A OD1 no hydrogen 3.543 N/A ASN 456.A ND2 HIS 457.A O no hydrogen 2.799 N/A HIS 457.A NE2 ASP 566.A O no hydrogen 2.634 N/A THR 461.A N ASP 419.A O no hydrogen 3.201 N/A THR 461.A OG1 TYR 462.A O no hydrogen 3.162 N/A THR 461.A OG1 ARG 521.A O no hydrogen 3.528 N/A TYR 462.A N ARG 521.A O no hydrogen 2.729 N/A LYS 463.A N ALA 417.A O no hydrogen 2.370 N/A ILE 464.A N ILE 519.A O no hydrogen 2.455 N/A THR 465.A N GLY 415.A O no hydrogen 2.889 N/A MET 466.A N GLU 517.A O no hydrogen 3.095 N/A SER 467.A N VAL 412.A O no hydrogen 3.261 N/A ASN 468.A ND2 PRO 513.A O no hydrogen 2.773 N/A ASN 470.A ND2 SER 409.A O no hydrogen 3.317 N/A ARG 474.A N VAL 512.A O no hydrogen 3.163 N/A ALA 476.A N GLN 510.A O no hydrogen 2.901 N/A THR 477.A N THR 587.A O no hydrogen 2.509 N/A THR 477.A OG1 ASP 592.A OD2 no hydrogen 2.838 N/A PHE 478.A N PHE 508.A O no hydrogen 2.895 N/A ARG 479.A N ALA 585.A O no hydrogen 2.934 N/A ARG 479.A NH1 ASP 592.A OD2 no hydrogen 2.674 N/A ARG 479.A NH2 ASP 592.A OD2 no hydrogen 3.204 N/A ILE 480.A N ASP 506.A O no hydrogen 2.807 N/A PHE 481.A N TYR 583.A O no hydrogen 3.045 N/A LEU 482.A N ILE 503.A O no hydrogen 3.093 N/A CYS 483.A N ASN 581.A O no hydrogen 3.270 N/A ASN 488.A ND2 TRP 239.A O no hydrogen 3.634 N/A THR 494.A N GLU 497.A OE1 no hydrogen 2.920 N/A THR 494.A OG1 GLU 497.A OE1 no hydrogen 2.862 N/A GLU 497.A N THR 494.A OG1 no hydrogen 2.553 N/A ARG 499.A NE ARG 619.A O no hydrogen 2.548 N/A ARG 499.A NH1 ASP 396.A OD1 no hydrogen 3.251 N/A ARG 499.A NH1 ASP 496.A OD1 no hydrogen 3.374 N/A ARG 499.A NH2 ASP 396.A OD1 no hydrogen 3.221 N/A ARG 499.A NH2 GLU 618.A O no hydrogen 2.884 N/A TRP 500.A NE1 ASP 388.A OD2 no hydrogen 3.011 N/A PHE 501.A N ALA 498.A O no hydrogen 3.185 N/A CYS 502.A SG ALA 498.A O no hydrogen 3.519 N/A CYS 502.A SG ARG 499.A O no hydrogen 3.419 N/A GLU 504.A N GLN 226.A OE1 no hydrogen 3.080 N/A LEU 505.A N ILE 480.A O no hydrogen 3.029 N/A LYS 507.A N ASP 506.A OD1 no hydrogen 2.444 N/A LYS 507.A NZ TYR 607.A OH no hydrogen 3.502 N/A LYS 507.A NZ ASP 609.A OD2 no hydrogen 3.005 N/A PHE 508.A N PHE 478.A O no hydrogen 3.065 N/A VAL 512.A N ARG 474.A O no hydrogen 2.988 N/A SER 514.A OG ASN 470.A O no hydrogen 3.031 N/A SER 514.A OG ASP 471.A O no hydrogen 2.447 N/A GLU 517.A N MET 466.A O no hydrogen 3.228 N/A THR 518.A OG1 GLU 517.A O no hydrogen 2.891 N/A ARG 521.A N TYR 462.A O no hydrogen 2.612 N/A ARG 521.A NE ASP 506.A OD2 no hydrogen 2.515 N/A ARG 521.A NH2 ASP 506.A OD1 no hydrogen 3.201 N/A SER 523.A N PHE 460.A O no hydrogen 2.764 N/A LYS 524.A N SER 522.A OG no hydrogen 3.012 N/A LYS 524.A NZ GLU 459.A OE2 no hydrogen 3.194 N/A SER 526.A OG LEU 505.A O no hydrogen 2.813 N/A SER 527.A N ASP 506.A OD1 no hydrogen 3.252 N/A SER 527.A OG ASP 506.A OD1 no hydrogen 3.377 N/A SER 527.A OG LYS 507.A O no hydrogen 2.635 N/A VAL 528.A N SER 526.A OG no hydrogen 2.929 N/A THR 529.A OG1 ILE 564.A O no hydrogen 3.348 N/A VAL 530.A N ILE 564.A O no hydrogen 2.574 N/A SER 535.A OG GLN 139.A OE1 no hydrogen 3.161 N/A PHE 536.A N GLN 139.A OE1 no hydrogen 2.396 N/A SER 538.A N SER 535.A OG no hydrogen 2.925 N/A LEU 539.A N SER 535.A O no hydrogen 2.753 N/A LYS 540.A N GLN 537.A O no hydrogen 2.235 N/A LYS 540.A NZ ASP 19.A OD1 no hydrogen 2.911 N/A GLU 541.A N GLN 537.A O no hydrogen 2.738 N/A GLN 542.A N SER 538.A O no hydrogen 3.256 N/A GLN 542.A NE2 SER 538.A OG no hydrogen 3.234 N/A ASP 544.A N LYS 540.A O no hydrogen 2.852 N/A ASN 545.A N GLU 541.A O no hydrogen 2.758 N/A ALA 546.A N ALA 543.A O no hydrogen 3.047 N/A VAL 547.A N ASP 544.A O no hydrogen 2.697 N/A ASN 548.A N ASP 544.A O no hydrogen 3.249 N/A SER 556.A N ASP 554.A OD1 no hydrogen 3.004 N/A TYR 558.A N LEU 555.A O no hydrogen 3.094 N/A ARG 560.A NH1 HIS 597.A O no hydrogen 3.533 N/A ARG 560.A NH1 CYS 600.A O no hydrogen 3.379 N/A ARG 560.A NH1 GLU 605.A OE2 no hydrogen 3.356 N/A ARG 560.A NH2 GLU 605.A OE2 no hydrogen 3.373 N/A ILE 564.A N VAL 528.A O no hydrogen 3.164 N/A ASP 566.A N VAL 530.A O no hydrogen 2.912 N/A ARG 567.A NE ASP 532.A OD1 no hydrogen 3.301 N/A ARG 567.A NE ASP 532.A OD2 no hydrogen 3.065 N/A ARG 567.A NH1 LEU 455.A O no hydrogen 2.962 N/A ARG 567.A NH2 ASP 532.A OD2 no hydrogen 3.153 N/A MET 568.A N PRO 565.A O no hydrogen 2.585 N/A LEU 569.A N ASP 566.A O no hydrogen 2.796 N/A LYS 572.A N GLU 234.A OE1 no hydrogen 3.050 N/A LYS 572.A NZ SER 573.A O no hydrogen 3.318 N/A SER 573.A OG LYS 574.A O no hydrogen 3.468 N/A SER 573.A OG ILE 640.A O no hydrogen 3.434 N/A MET 578.A N ILE 640.A O no hydrogen 2.842 N/A ASN 581.A N CYS 483.A O no hydrogen 3.459 N/A LEU 582.A N VAL 636.A O no hydrogen 3.022 N/A TYR 583.A N PHE 481.A O no hydrogen 3.091 N/A VAL 584.A N LYS 634.A O no hydrogen 3.117 N/A ALA 585.A N ARG 479.A O no hydrogen 3.013 N/A VAL 586.A N ASN 632.A O no hydrogen 2.479 N/A THR 587.A N THR 477.A O no hydrogen 3.143 N/A THR 587.A OG1 ASP 592.A OD2 no hydrogen 2.417 N/A GLY 589.A N LEU 475.A O no hydrogen 3.076 N/A LYS 591.A N ASP 588.A O no hydrogen 2.758 N/A LYS 591.A NZ ASP 588.A OD2 no hydrogen 3.173 N/A ASP 592.A N ASP 588.A O no hydrogen 3.206 N/A ASP 592.A N GLY 589.A O no hydrogen 3.074 N/A THR 593.A N GLY 589.A O no hydrogen 3.062 N/A THR 593.A OG1 GLY 589.A O no hydrogen 2.305 N/A CYS 600.A SG ASP 200.A OD2 no hydrogen 2.932 N/A HIS 603.A N GLU 605.A OE1 no hydrogen 2.791 N/A GLY 604.A N GLY 601.A O no hydrogen 2.894 N/A TYR 607.A N ASP 214.A OD2 no hydrogen 2.932 N/A ASN 610.A ND2 ASP 592.A O no hydrogen 2.405 N/A ARG 611.A N ASP 609.A OD1 no hydrogen 2.709 N/A LEU 617.A N GLY 614.A O no hydrogen 2.395 N/A GLU 618.A N GLU 618.A OE1 no hydrogen 2.722 N/A ARG 619.A NH1 PRO 399.A O no hydrogen 3.068 N/A ARG 620.A NH1 ASP 396.A O no hydrogen 2.571 N/A ARG 620.A NH1 PHE 398.A O no hydrogen 3.029 N/A ILE 621.A N ASP 496.A OD1 no hydrogen 3.045 N/A VAL 626.A N ASP 623.A O no hydrogen 3.303 N/A ASP 628.A N GLU 624.A O no hydrogen 3.003 N/A GLY 629.A N VAL 626.A O no hydrogen 2.955 N/A SER 631.A N GLU 407.A OE1 no hydrogen 3.156 N/A SER 631.A N GLU 407.A OE2 no hydrogen 3.407 N/A SER 631.A OG GLU 407.A OE1 no hydrogen 2.932 N/A SER 631.A OG MET 411.A O no hydrogen 2.563 N/A ASN 632.A ND2 LEU 406.A O no hydrogen 3.243 N/A LYS 634.A N VAL 584.A O no hydrogen 3.067 N/A VAL 636.A N LEU 582.A O no hydrogen 2.841 N/A VAL 638.A N PHE 580.A O no hydrogen 3.044 N/A ILE 640.A N MET 578.A O no hydrogen 2.884 N/A VAL 641.A N LEU 422.A O no hydrogen 2.755 N/A HIS 642.A ND1 THR 424.A O no hydrogen 2.234 N/A HIS 642.A ND1 THR 424.A OG1 no hydrogen 2.931 N/A HIS 643.A N THR 424.A O no hydrogen 2.854 N/A