Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5w0p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ASN 1.A OD1 no hydrogen 3.178 N/A MET 5.A N ASN 1.A O no hydrogen 3.097 N/A LEU 6.A N ILE 2.A O no hydrogen 3.283 N/A ARG 7.A N PHE 3.A O no hydrogen 3.087 N/A ARG 7.A NH1 SER 441.A OG no hydrogen 2.604 N/A ARG 7.A NH2 SER 441.A OG no hydrogen 3.289 N/A ILE 8.A N GLU 4.A O no hydrogen 3.418 N/A ASP 9.A N MET 5.A O no hydrogen 3.055 N/A GLU 10.A N LEU 6.A O no hydrogen 3.029 N/A GLY 11.A N ARG 7.A O no hydrogen 2.973 N/A ARG 13.A N GLY 27.A O no hydrogen 3.201 N/A TYR 17.A N THR 25.A O no hydrogen 2.760 N/A TYR 17.A OH GLU 10.A OE2 no hydrogen 2.580 N/A ASP 19.A N TYR 23.A O no hydrogen 3.218 N/A GLY 22.A N ASP 19.A O no hydrogen 2.648 N/A TYR 23.A N ASP 19.A OD1 no hydrogen 2.554 N/A THR 25.A N TYR 17.A O no hydrogen 2.805 N/A THR 25.A OG1 TYR 23.A O no hydrogen 2.932 N/A ILE 26.A N HIS 30.A O no hydrogen 3.143 N/A GLY 27.A N ARG 13.A O no hydrogen 2.764 N/A HIS 30.A N ILE 26.A O no hydrogen 3.348 N/A LEU 32.A N TYR 24.A O no hydrogen 3.464 N/A SER 35.A N THR 33.A OG1 no hydrogen 3.212 N/A ALA 41.A N SER 37.A O no hydrogen 3.363 N/A LYS 42.A N LEU 38.A O no hydrogen 3.304 N/A SER 43.A N ASN 39.A O no hydrogen 3.018 N/A GLU 44.A N ALA 40.A O no hydrogen 3.125 N/A LEU 45.A N ALA 41.A O no hydrogen 3.073 N/A ASP 46.A N LYS 42.A O no hydrogen 2.774 N/A LYS 47.A N SER 43.A O no hydrogen 3.201 N/A LYS 47.A NZ GLU 44.A OE1 no hydrogen 3.003 N/A LYS 47.A NZ GLU 44.A OE2 no hydrogen 2.961 N/A ILE 49.A N LEU 45.A O no hydrogen 2.966 N/A GLY 50.A N ASP 46.A O no hydrogen 2.781 N/A THR 53.A N ASP 46.A OD1 no hydrogen 3.263 N/A THR 53.A OG1 ASP 46.A OD1 no hydrogen 2.665 N/A ILE 57.A N LEU 14.A O no hydrogen 3.318 N/A GLU 63.A N LYS 59.A O no hydrogen 2.820 N/A LYS 64.A N ASP 60.A O no hydrogen 3.192 N/A LEU 65.A N GLU 61.A O no hydrogen 3.224 N/A PHE 66.A N ALA 62.A O no hydrogen 3.016 N/A ASN 67.A N GLU 63.A O no hydrogen 3.069 N/A GLN 68.A N LYS 64.A O no hydrogen 3.207 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.378 N/A ASP 69.A N LEU 65.A O no hydrogen 3.290 N/A VAL 70.A N PHE 66.A O no hydrogen 2.926 N/A ASP 71.A N ASN 67.A O no hydrogen 2.947 N/A ALA 72.A N GLN 68.A O no hydrogen 3.126 N/A ALA 73.A N ASP 69.A O no hydrogen 2.909 N/A VAL 74.A N VAL 70.A O no hydrogen 3.096 N/A ARG 75.A N ALA 72.A O no hydrogen 3.108 N/A GLY 76.A N ALA 72.A O no hydrogen 3.006 N/A ILE 77.A N ALA 73.A O no hydrogen 3.210 N/A LEU 78.A N VAL 74.A O no hydrogen 3.377 N/A ARG 79.A N ARG 75.A O no hydrogen 2.636 N/A ASN 80.A N GLY 76.A O no hydrogen 3.204 N/A ASN 80.A ND2 GLU 107.A OE2 no hydrogen 3.309 N/A LYS 82.A N ASN 80.A OD1 no hydrogen 2.872 N/A LEU 83.A N ASN 80.A OD1 no hydrogen 3.389 N/A LYS 84.A N ASN 80.A O no hydrogen 3.301 N/A LYS 84.A NZ ASP 88.A OD2 no hydrogen 3.049 N/A TYR 87.A N LEU 83.A O no hydrogen 2.847 N/A ASP 88.A N LYS 84.A O no hydrogen 2.802 N/A SER 89.A N PRO 85.A O no hydrogen 3.028 N/A SER 89.A OG GLN 121.A O no hydrogen 3.486 N/A LEU 90.A N VAL 86.A O no hydrogen 3.012 N/A ARG 94.A NE PHE 152.A O no hydrogen 3.083 N/A ARG 94.A NH1 ASP 91.A OD1 no hydrogen 2.907 N/A ARG 94.A NH2 PHE 152.A O no hydrogen 3.519 N/A ARG 95.A N ASP 91.A O no hydrogen 2.776 N/A ARG 95.A NE TYR 87.A O no hydrogen 2.705 N/A ARG 95.A NE LEU 90.A O no hydrogen 2.914 N/A ARG 95.A NH2 ASP 88.A O no hydrogen 3.332 N/A ALA 96.A N ALA 92.A O no hydrogen 3.383 N/A LEU 98.A N ARG 94.A O no hydrogen 3.214 N/A ILE 99.A N ARG 95.A O no hydrogen 3.031 N/A ASN 100.A N ALA 96.A O no hydrogen 3.144 N/A ASN 100.A ND2 ASP 9.A OD2 no hydrogen 3.183 N/A MET 101.A N ALA 97.A O no hydrogen 3.296 N/A VAL 102.A N LEU 98.A O no hydrogen 3.038 N/A PHE 103.A N ILE 99.A O no hydrogen 2.653 N/A GLN 104.A N ASN 100.A O no hydrogen 3.136 N/A MET 105.A N MET 101.A O no hydrogen 3.078 N/A GLY 106.A N VAL 102.A O no hydrogen 2.980 N/A VAL 110.A N GLY 106.A O no hydrogen 3.379 N/A ALA 111.A N GLU 107.A O no hydrogen 3.279 N/A GLY 112.A N GLY 109.A O no hydrogen 3.342 N/A PHE 113.A N VAL 110.A O no hydrogen 3.050 N/A ARG 118.A N THR 114.A O no hydrogen 3.161 N/A MET 119.A N ASN 115.A O no hydrogen 3.229 N/A LEU 120.A N SER 116.A O no hydrogen 3.430 N/A GLN 121.A NE2 PRO 85.A O no hydrogen 3.645 N/A GLN 122.A N ARG 118.A O no hydrogen 3.297 N/A LYS 123.A N LEU 120.A O no hydrogen 3.386 N/A ARG 124.A N MET 119.A O no hydrogen 2.709 N/A ASN 131.A N GLU 127.A O no hydrogen 3.337 N/A LEU 132.A N ALA 128.A O no hydrogen 3.061 N/A ALA 133.A N ALA 129.A O no hydrogen 2.934 N/A LYS 134.A N VAL 130.A O no hydrogen 2.976 N/A SER 135.A OG LEU 132.A O no hydrogen 2.680 N/A GLN 140.A N ARG 136.A O no hydrogen 2.953 N/A THR 141.A N TRP 137.A O no hydrogen 3.520 N/A ARG 144.A NE ASP 9.A O no hydrogen 3.368 N/A ARG 144.A NH2 ASP 9.A O no hydrogen 3.229 N/A ARG 144.A NH2 GLU 10.A OE1 no hydrogen 2.780 N/A ALA 145.A N THR 141.A O no hydrogen 3.088 N/A LYS 146.A N PRO 142.A O no hydrogen 3.153 N/A ARG 147.A NE ASP 9.A OD1 no hydrogen 2.915 N/A ARG 147.A NH2 ASP 9.A OD1 no hydrogen 2.555 N/A VAL 148.A N ARG 144.A O no hydrogen 3.382 N/A ILE 149.A N ALA 145.A O no hydrogen 2.770 N/A THR 150.A N LYS 146.A O no hydrogen 3.068 N/A THR 150.A OG1 LYS 146.A O no hydrogen 2.611 N/A THR 151.A OG1 ARG 147.A O no hydrogen 2.622 N/A PHE 152.A N VAL 148.A O no hydrogen 3.373 N/A ARG 153.A N ILE 149.A O no hydrogen 3.142 N/A THR 154.A N THR 150.A O no hydrogen 2.867 N/A THR 154.A OG1 THR 150.A O no hydrogen 2.620 N/A THR 154.A OG1 THR 156.A OG1 no hydrogen 3.042 N/A GLY 155.A N THR 151.A O no hydrogen 2.838 N/A THR 156.A OG1 THR 154.A OG1 no hydrogen 3.042 N/A TYR 160.A OH ASP 9.A OD2 no hydrogen 3.040 N/A THR 164.A N PHE 173.A O no hydrogen 2.997 N/A THR 164.A OG1 PHE 173.A O no hydrogen 2.721 N/A GLY 166.A N PHE 169.A O no hydrogen 2.933 N/A VAL 171.A N THR 164.A O no hydrogen 3.105 N/A ALA 176.A N SER 174.A OG no hydrogen 3.412 N/A VAL 180.A N ASN 175.A OD1 no hydrogen 3.233 N/A ARG 181.A N TYR 190.A OH no hydrogen 3.347 N/A ARG 181.A NH1 GLY 178.A O no hydrogen 2.930 N/A ARG 181.A NH1 VAL 180.A O no hydrogen 3.009 N/A PHE 184.A N SER 182.A OG no hydrogen 3.395 N/A GLU 185.A N SER 182.A O no hydrogen 3.397 N/A TYR 186.A N SER 182.A O no hydrogen 2.952 N/A GLN 188.A NE2 ARG 181.A O no hydrogen 3.145 N/A GLN 188.A NE2 TYR 186.A O no hydrogen 3.027 N/A TYR 189.A OH HIS 260.A O no hydrogen 2.699 N/A TYR 190.A OH ARG 181.A O no hydrogen 3.234 N/A LEU 191.A N GLN 188.A O no hydrogen 3.064 N/A TRP 195.A NE1 GLU 193.A OE1 no hydrogen 2.667 N/A GLN 196.A N GLU 193.A O no hydrogen 2.912 N/A PHE 197.A N PRO 194.A O no hydrogen 3.271 N/A SER 198.A OG TRP 195.A O no hydrogen 2.812 N/A MET 199.A N TRP 195.A O no hydrogen 2.944 N/A LEU 200.A N GLN 196.A O no hydrogen 3.126 N/A ALA 201.A N PHE 197.A O no hydrogen 2.906 N/A ALA 202.A N SER 198.A O no hydrogen 2.934 N/A TYR 203.A N MET 199.A O no hydrogen 2.898 N/A TYR 203.A OH PHE 453.A O no hydrogen 2.742 N/A TYR 203.A OH SER 457.A OG no hydrogen 2.698 N/A MET 204.A N LEU 200.A O no hydrogen 2.653 N/A PHE 205.A N ALA 201.A O no hydrogen 3.016 N/A LEU 206.A N ALA 202.A O no hydrogen 3.109 N/A LEU 207.A N TYR 203.A O no hydrogen 3.195 N/A ILE 208.A N MET 204.A O no hydrogen 3.365 N/A VAL 209.A N PHE 205.A O no hydrogen 2.935 N/A LEU 210.A N LEU 206.A O no hydrogen 2.936 N/A GLY 211.A N LEU 207.A O no hydrogen 2.779 N/A PHE 212.A N ILE 208.A O no hydrogen 3.276 N/A ASN 215.A N GLY 211.A O no hydrogen 3.181 N/A ASN 215.A ND2 GLY 211.A O no hydrogen 2.762 N/A ASN 215.A ND2 ALA 459.A O no hydrogen 3.505 N/A PHE 216.A N PHE 212.A O no hydrogen 2.913 N/A LEU 217.A N PRO 213.A O no hydrogen 2.765 N/A THR 218.A N ILE 214.A O no hydrogen 3.376 N/A THR 218.A OG1 ILE 214.A O no hydrogen 2.949 N/A TYR 220.A N PHE 216.A O no hydrogen 2.785 N/A VAL 221.A N LEU 217.A O no hydrogen 2.889 N/A THR 222.A OG1 THR 218.A O no hydrogen 2.574 N/A VAL 223.A N LEU 219.A O no hydrogen 3.384 N/A GLN 224.A N TYR 220.A O no hydrogen 3.357 N/A HIS 225.A N VAL 221.A O no hydrogen 2.781 N/A ARG 229.A N LYS 226.A O no hydrogen 3.178 N/A ASN 233.A ND2 LEU 228.A O no hydrogen 3.059 N/A TYR 234.A N PRO 231.A O no hydrogen 3.276 N/A LEU 237.A N ASN 233.A O no hydrogen 2.976 N/A ASN 238.A N TYR 234.A O no hydrogen 3.153 N/A VAL 241.A N LEU 237.A O no hydrogen 3.193 N/A ALA 242.A N ASN 238.A O no hydrogen 2.886 N/A ASP 243.A N LEU 239.A O no hydrogen 2.958 N/A LEU 244.A N ALA 240.A O no hydrogen 3.084 N/A PHE 245.A N VAL 241.A O no hydrogen 3.288 N/A VAL 247.A N ASP 243.A O no hydrogen 3.193 N/A LEU 248.A N LEU 244.A O no hydrogen 2.676 N/A GLY 249.A N PHE 245.A O no hydrogen 3.046 N/A GLY 250.A N PHE 245.A O no hydrogen 3.323 N/A PHE 251.A N MET 246.A O no hydrogen 2.734 N/A THR 252.A N VAL 247.A O no hydrogen 3.127 N/A THR 252.A OG1 VAL 247.A O no hydrogen 2.771 N/A THR 252.A OG1 LEU 248.A O no hydrogen 3.014 N/A SER 253.A OG GLY 249.A O no hydrogen 2.936 N/A THR 254.A N GLY 250.A O no hydrogen 2.963 N/A THR 254.A OG1 GLY 250.A O no hydrogen 2.576 N/A THR 254.A OG1 GLN 273.A OE1 no hydrogen 2.900 N/A LEU 255.A N PHE 251.A O no hydrogen 2.812 N/A TYR 256.A N THR 252.A O no hydrogen 3.378 N/A THR 257.A N SER 253.A O no hydrogen 3.109 N/A THR 257.A OG1 SER 253.A O no hydrogen 3.399 N/A THR 257.A OG1 THR 254.A O no hydrogen 2.864 N/A THR 257.A OG1 CYS 345.A O no hydrogen 2.554 N/A SER 258.A N THR 254.A O no hydrogen 3.078 N/A SER 258.A OG THR 254.A O no hydrogen 2.723 N/A SER 258.A OG LEU 255.A O no hydrogen 2.697 N/A LEU 259.A N LEU 255.A O no hydrogen 2.995 N/A GLY 261.A N THR 257.A O no hydrogen 2.776 N/A PHE 263.A N PRO 183.A O no hydrogen 3.000 N/A CYS 270.A N GLY 266.A O no hydrogen 2.863 N/A CYS 270.A SG TYR 338.A O no hydrogen 3.801 N/A ASN 271.A N PRO 267.A O no hydrogen 2.975 N/A LEU 272.A N THR 268.A O no hydrogen 3.379 N/A GLN 273.A N GLY 269.A O no hydrogen 2.995 N/A GLY 274.A N CYS 270.A O no hydrogen 3.007 N/A PHE 275.A N ASN 271.A O no hydrogen 2.863 N/A PHE 276.A N LEU 272.A O no hydrogen 3.005 N/A ALA 277.A N GLN 273.A O no hydrogen 3.000 N/A THR 278.A N GLY 274.A O no hydrogen 3.122 N/A THR 278.A OG1 GLY 274.A O no hydrogen 2.675 N/A LEU 279.A N PHE 275.A O no hydrogen 2.723 N/A GLY 280.A N PHE 276.A O no hydrogen 2.733 N/A GLY 281.A N ALA 277.A O no hydrogen 3.236 N/A GLU 282.A N THR 278.A O no hydrogen 2.785 N/A ILE 283.A N LEU 279.A O no hydrogen 2.754 N/A ALA 284.A N GLY 280.A O no hydrogen 3.396 N/A LEU 285.A N GLY 281.A O no hydrogen 2.934 N/A TRP 286.A N GLU 282.A O no hydrogen 3.176 N/A SER 287.A N ILE 283.A O no hydrogen 2.933 N/A SER 287.A OG ILE 283.A O no hydrogen 2.668 N/A LEU 288.A N LEU 285.A O no hydrogen 3.111 N/A VAL 289.A N LEU 285.A O no hydrogen 3.263 N/A VAL 290.A N TRP 286.A O no hydrogen 2.912 N/A LEU 291.A N SER 287.A O no hydrogen 2.821 N/A ALA 292.A N LEU 288.A O no hydrogen 2.992 N/A ILE 293.A N VAL 289.A O no hydrogen 2.942 N/A GLU 294.A N VAL 290.A O no hydrogen 2.720 N/A ARG 295.A N LEU 291.A O no hydrogen 2.860 N/A ARG 295.A NH1 TYR 417.A OH no hydrogen 2.915 N/A ARG 295.A NH2 ASN 470.A OD1 no hydrogen 3.531 N/A TYR 296.A N ALA 292.A O no hydrogen 3.137 N/A VAL 297.A N ILE 293.A O no hydrogen 3.130 N/A VAL 298.A N GLU 294.A O no hydrogen 3.057 N/A CYS 300.A SG TYR 296.A O no hydrogen 3.412 N/A CYS 300.A SG THR 389.A OG1 no hydrogen 3.716 N/A LYS 301.A N VAL 297.A O no hydrogen 3.144 N/A SER 304.A N LYS 301.A O no hydrogen 3.232 N/A ASN 305.A N PRO 302.A O no hydrogen 3.395 N/A PHE 306.A N MET 303.A O no hydrogen 3.233 N/A ARG 307.A N MET 303.A O no hydrogen 3.454 N/A PHE 308.A N ASN 305.A O no hydrogen 3.318 N/A ALA 313.A N GLY 309.A O no hydrogen 3.291 N/A ILE 314.A N GLU 310.A O no hydrogen 2.846 N/A MET 315.A N ASN 311.A O no hydrogen 2.956 N/A GLY 316.A N HIS 312.A O no hydrogen 3.208 N/A VAL 317.A N ALA 313.A O no hydrogen 2.983 N/A ALA 318.A N ILE 314.A O no hydrogen 2.786 N/A PHE 319.A N MET 315.A O no hydrogen 3.127 N/A THR 320.A N GLY 316.A O no hydrogen 3.231 N/A THR 320.A OG1 GLY 316.A O no hydrogen 2.744 N/A TRP 321.A N VAL 317.A O no hydrogen 3.316 N/A TRP 321.A NE1 ASN 238.A OD1 no hydrogen 3.090 N/A VAL 322.A N ALA 318.A O no hydrogen 2.952 N/A MET 323.A N PHE 319.A O no hydrogen 3.030 N/A ALA 324.A N THR 320.A O no hydrogen 2.786 N/A LEU 325.A N TRP 321.A O no hydrogen 2.997 N/A ALA 326.A N VAL 322.A O no hydrogen 3.017 N/A CYS 327.A N MET 323.A O no hydrogen 3.389 N/A CYS 327.A SG GLU 282.A OE1 no hydrogen 3.805 N/A ALA 328.A N ALA 324.A O no hydrogen 2.938 N/A ALA 329.A N LEU 325.A O no hydrogen 2.943 N/A ALA 333.A N ALA 329.A O no hydrogen 2.940 N/A SER 336.A N VAL 358.A O no hydrogen 2.719 N/A SER 336.A OG ASP 350.A O no hydrogen 3.553 N/A ARG 337.A NE ASP 350.A OD2 no hydrogen 3.086 N/A TYR 338.A OH ALA 328.A O no hydrogen 2.607 N/A ILE 339.A N GLY 348.A O no hydrogen 3.079 N/A GLU 341.A N SER 346.A O no hydrogen 2.665 N/A GLN 344.A N GLU 341.A O no hydrogen 3.121 N/A GLN 344.A NE2 PRO 340.A O no hydrogen 2.781 N/A GLN 344.A NE2 GLY 342.A O no hydrogen 3.250 N/A CYS 345.A SG THR 257.A O no hydrogen 3.871 N/A CYS 345.A SG GLY 261.A O no hydrogen 3.236 N/A CYS 345.A SG LEU 343.A O no hydrogen 3.831 N/A CYS 347.A N GLN 273.A OE1 no hydrogen 3.073 N/A GLY 348.A N ILE 339.A O no hydrogen 2.993 N/A ASP 350.A N ARG 337.A O no hydrogen 3.077 N/A TYR 351.A OH GLU 341.A OE1 no hydrogen 3.218 N/A THR 353.A N ASP 350.A OD1 no hydrogen 2.954 N/A THR 353.A OG1 ASP 350.A OD1 no hydrogen 3.361 N/A LYS 355.A N ASN 360.A OD1 no hydrogen 3.189 N/A ASN 360.A N LYS 355.A O no hydrogen 3.304 N/A VAL 364.A N ASN 360.A O no hydrogen 3.082 N/A TYR 366.A N SER 362.A O no hydrogen 2.857 N/A TYR 366.A OH HIS 371.A NE2 no hydrogen 3.047 N/A MET 367.A N PHE 363.A O no hydrogen 2.726 N/A PHE 368.A N VAL 364.A O no hydrogen 2.720 N/A VAL 369.A N ILE 365.A O no hydrogen 2.915 N/A VAL 370.A N TYR 366.A O no hydrogen 2.997 N/A HIS 371.A ND1 GLU 282.A OE2 no hydrogen 2.688 N/A HIS 371.A NE2 TYR 366.A OH no hydrogen 3.047 N/A THR 373.A N PHE 368.A O no hydrogen 2.988 N/A THR 373.A OG1 PHE 368.A O no hydrogen 2.586 N/A ILE 374.A N VAL 369.A O no hydrogen 3.168 N/A MET 376.A N PHE 372.A O no hydrogen 2.983 N/A ILE 377.A N THR 373.A O no hydrogen 2.924 N/A ILE 378.A N ILE 374.A O no hydrogen 3.043 N/A ILE 379.A N PRO 375.A O no hydrogen 3.091 N/A PHE 380.A N MET 376.A O no hydrogen 3.214 N/A PHE 381.A N ILE 377.A O no hydrogen 2.758 N/A CYS 382.A N ILE 378.A O no hydrogen 2.772 N/A CYS 382.A SG ILE 378.A O no hydrogen 3.237 N/A TYR 383.A N ILE 379.A O no hydrogen 3.077 N/A GLY 384.A N PHE 380.A O no hydrogen 3.027 N/A GLN 385.A N PHE 381.A O no hydrogen 2.799 N/A LEU 386.A N CYS 382.A O no hydrogen 2.822 N/A VAL 387.A N TYR 383.A O no hydrogen 3.211 N/A PHE 388.A N GLY 384.A O no hydrogen 3.194 N/A THR 389.A N GLN 385.A O no hydrogen 2.952 N/A THR 389.A OG1 GLN 385.A O no hydrogen 2.522 N/A VAL 390.A N LEU 386.A O no hydrogen 3.162 N/A LYS 391.A N VAL 387.A O no hydrogen 2.761 N/A GLU 392.A N PHE 388.A O no hydrogen 3.186 N/A ALA 393.A N THR 389.A O no hydrogen 2.943 N/A ALA 394.A N VAL 390.A O no hydrogen 2.830 N/A ALA 395.A N LYS 391.A O no hydrogen 3.251 N/A GLN 396.A N GLU 392.A O no hydrogen 3.276 N/A GLN 397.A N ALA 393.A O no hydrogen 3.320 N/A GLN 397.A NE2 ASP 568.A O no hydrogen 3.630 N/A GLU 399.A N GLU 399.A OE1 no hydrogen 2.712 N/A SER 400.A OG THR 402.A OG1 no hydrogen 3.084 N/A THR 402.A OG1 SER 400.A OG no hydrogen 3.084 N/A THR 403.A OG1 SER 400.A O no hydrogen 2.663 N/A GLN 404.A NE2 ALA 394.A O no hydrogen 2.912 N/A GLN 404.A NE2 GLN 397.A O no hydrogen 2.788 N/A LYS 405.A N ALA 401.A O no hydrogen 3.252 N/A LYS 405.A NZ ASP 648.A OD2 no hydrogen 2.850 N/A ALA 406.A N THR 402.A O no hydrogen 3.382 N/A GLU 407.A N THR 403.A O no hydrogen 3.488 N/A LYS 408.A N GLN 404.A O no hydrogen 3.369 N/A GLU 409.A N LYS 405.A O no hydrogen 3.056 N/A VAL 410.A N ALA 406.A O no hydrogen 2.670 N/A THR 411.A N GLU 407.A O no hydrogen 3.107 N/A THR 411.A OG1 GLU 407.A O no hydrogen 2.749 N/A THR 411.A OG1 GLU 407.A OE2 no hydrogen 3.129 N/A ARG 412.A N LYS 408.A O no hydrogen 3.128 N/A MET 413.A N GLU 409.A O no hydrogen 3.223 N/A VAL 414.A N VAL 410.A O no hydrogen 3.088 N/A ILE 415.A N THR 411.A O no hydrogen 3.301 N/A ILE 416.A N ARG 412.A O no hydrogen 3.164 N/A TYR 417.A N MET 413.A O no hydrogen 2.772 N/A VAL 418.A N VAL 414.A O no hydrogen 2.827 N/A ILE 419.A N ILE 415.A O no hydrogen 2.939 N/A ALA 420.A N ILE 416.A O no hydrogen 2.750 N/A PHE 421.A N TYR 417.A O no hydrogen 3.057 N/A LEU 422.A N VAL 418.A O no hydrogen 2.795 N/A ILE 423.A N ILE 419.A O no hydrogen 2.888 N/A CYS 424.A N ALA 420.A O no hydrogen 3.355 N/A TRP 425.A N PHE 421.A O no hydrogen 3.130 N/A VAL 426.A N LEU 422.A O no hydrogen 3.207 N/A ALA 429.A N TRP 425.A O no hydrogen 3.103 N/A SER 430.A N VAL 426.A O no hydrogen 2.640 N/A VAL 431.A N PRO 427.A O no hydrogen 2.989 N/A ALA 432.A N TYR 428.A O no hydrogen 2.901 N/A TYR 434.A N SER 430.A O no hydrogen 2.881 N/A ILE 435.A N VAL 431.A O no hydrogen 2.731 N/A PHE 436.A N ALA 432.A O no hydrogen 2.972 N/A THR 437.A N PHE 433.A O no hydrogen 3.047 N/A THR 437.A OG1 PHE 433.A O no hydrogen 2.934 N/A HIS 438.A N TYR 434.A O no hydrogen 2.775 N/A HIS 438.A ND1 TYR 434.A O no hydrogen 3.126 N/A GLN 439.A N GLN 439.A OE1 no hydrogen 2.738 N/A SER 441.A N HIS 438.A O no hydrogen 2.644 N/A THR 449.A N ILE 446.A O no hydrogen 3.185 N/A THR 449.A OG1 PRO 445.A O no hydrogen 2.701 N/A ILE 450.A N ILE 446.A O no hydrogen 3.318 N/A PHE 453.A N THR 449.A O no hydrogen 2.834 N/A ALA 455.A N PRO 451.A O no hydrogen 3.234 N/A LYS 456.A N ALA 452.A O no hydrogen 3.387 N/A LYS 456.A NZ SER 346.A OG no hydrogen 3.071 N/A SER 457.A N PHE 453.A O no hydrogen 2.914 N/A SER 457.A OG TYR 203.A OH no hydrogen 2.698 N/A SER 457.A OG PHE 453.A O no hydrogen 2.609 N/A ALA 458.A N PHE 454.A O no hydrogen 3.017 N/A ALA 458.A N ALA 455.A O no hydrogen 3.313 N/A ALA 459.A N LYS 456.A O no hydrogen 3.420 N/A ILE 460.A N SER 457.A O no hydrogen 2.928 N/A TYR 461.A N SER 457.A O no hydrogen 3.280 N/A TYR 461.A OH PHE 454.A O no hydrogen 3.404 N/A ASN 462.A N ALA 458.A O no hydrogen 3.200 N/A VAL 464.A N ILE 460.A O no hydrogen 3.293 N/A ILE 465.A N TYR 461.A O no hydrogen 2.694 N/A TYR 466.A N ASN 462.A O no hydrogen 2.963 N/A ILE 467.A N PRO 463.A O no hydrogen 2.915 N/A MET 468.A N PRO 463.A O no hydrogen 3.291 N/A MET 469.A N VAL 464.A O no hydrogen 2.993 N/A ASN 470.A N ILE 467.A O no hydrogen 3.022 N/A GLN 472.A NE2 LYS 227.A O no hydrogen 3.241 N/A ARG 474.A N ASN 470.A O no hydrogen 2.984 N/A ASN 475.A N LYS 471.A O no hydrogen 3.116 N/A CYS 476.A N GLN 472.A O no hydrogen 3.320 N/A CYS 476.A SG GLN 472.A O no hydrogen 3.289 N/A MET 477.A N PHE 473.A O no hydrogen 3.041 N/A LEU 478.A N ARG 474.A O no hydrogen 3.220 N/A THR 479.A N ASN 475.A O no hydrogen 3.187 N/A THR 479.A OG1 ASN 475.A O no hydrogen 3.333 N/A THR 479.A OG1 CYS 476.A O no hydrogen 2.488 N/A THR 480.A N CYS 476.A O no hydrogen 3.233 N/A THR 480.A OG1 CYS 476.A O no hydrogen 3.053 N/A ILE 481.A N MET 477.A O no hydrogen 3.413 N/A CYS 482.A N LEU 478.A O no hydrogen 2.811 N/A CYS 482.A SG LEU 478.A O no hydrogen 3.169 N/A CYS 483.A N THR 480.A O no hydrogen 3.140 N/A CYS 483.A SG THR 480.A O no hydrogen 3.523 N/A CYS 483.A SG ILE 481.A O no hydrogen 3.769 N/A GLY 484.A N THR 479.A O no hydrogen 2.858 N/A SER 489.A OG ASP 486.A O no hydrogen 3.474 N/A SER 489.A OG ALA 488.A O no hydrogen 2.476 N/A GLU 494.A N ILE 498.A O no hydrogen 3.085 N/A ILE 498.A N GLU 494.A O no hydrogen 3.249 N/A LYS 500.A N LYS 492.A O no hydrogen 3.399 N/A LYS 501.A N ILE 510.A O no hydrogen 3.152 N/A LYS 501.A NZ ARG 657.A O no hydrogen 3.000 N/A SER 503.A N VAL 508.A O no hydrogen 3.214 N/A SER 503.A OG ASP 505.A OD1 no hydrogen 2.647 N/A SER 503.A OG VAL 508.A O no hydrogen 3.078 N/A ASP 505.A N LYS 653.A O no hydrogen 3.001 N/A SER 507.A N ASP 505.A OD1 no hydrogen 3.223 N/A SER 507.A OG ASP 505.A OD1 no hydrogen 3.031 N/A SER 507.A OG ASP 505.A OD2 no hydrogen 2.674 N/A VAL 508.A N SER 503.A OG no hydrogen 3.341 N/A THR 509.A N LEU 532.A O no hydrogen 2.909 N/A ILE 510.A N LYS 501.A O no hydrogen 3.122 N/A TYR 511.A N VAL 530.A O no hydrogen 2.913 N/A LEU 512.A N PHE 499.A O no hydrogen 3.270 N/A LYS 514.A NZ GLU 525.A OE1 no hydrogen 2.990 N/A LYS 514.A NZ GLU 525.A OE2 no hydrogen 3.318 N/A ARG 515.A NH1 LEU 659.A O no hydrogen 3.563 N/A TYR 517.A N ARG 661.A O no hydrogen 2.776 N/A VAL 518.A N GLU 525.A OE1 no hydrogen 3.235 N/A ASP 519.A N VAL 663.A O no hydrogen 2.728 N/A GLU 525.A N VAL 518.A O no hydrogen 3.311 N/A VAL 527.A N LEU 606.A O no hydrogen 2.916 N/A VAL 530.A N TYR 511.A O no hydrogen 3.336 N/A VAL 531.A N TYR 602.A O no hydrogen 2.837 N/A LEU 532.A N THR 509.A O no hydrogen 2.806 N/A VAL 533.A N ASN 600.A O no hydrogen 3.378 N/A ASP 534.A N SER 507.A O no hydrogen 2.953 N/A GLU 536.A N ASP 534.A OD1 no hydrogen 3.161 N/A LEU 537.A N ASP 534.A OD1 no hydrogen 3.515 N/A VAL 538.A N ASP 534.A O no hydrogen 2.806 N/A LYS 541.A NZ ASP 641.A OD1 no hydrogen 2.730 N/A LYS 541.A NZ ASP 641.A OD2 no hydrogen 3.522 N/A LYS 542.A N SER 640.A O no hydrogen 2.929 N/A LYS 542.A NZ ASP 641.A O no hydrogen 3.357 N/A VAL 543.A N TYR 577.A O no hydrogen 2.771 N/A TYR 544.A N PHE 638.A O no hydrogen 2.854 N/A VAL 545.A N VAL 574.A O no hydrogen 3.169 N/A THR 546.A N LYS 636.A O no hydrogen 2.734 N/A THR 546.A OG1 THR 548.A OG1 no hydrogen 3.368 N/A THR 546.A OG1 LYS 636.A O no hydrogen 3.556 N/A LEU 547.A N SER 572.A O no hydrogen 3.216 N/A THR 548.A N GLU 634.A O no hydrogen 2.776 N/A THR 548.A OG1 THR 546.A OG1 no hydrogen 3.368 N/A THR 548.A OG1 GLU 634.A O no hydrogen 3.555 N/A CYS 549.A N TYR 570.A O no hydrogen 2.964 N/A ALA 550.A N ASP 632.A O no hydrogen 3.202 N/A PHE 551.A N ARG 567.A O no hydrogen 3.192 N/A ARG 552.A N GLY 630.A O no hydrogen 2.974 N/A GLN 555.A NE2 GLY 626.A O no hydrogen 3.341 N/A ASP 559.A N GLN 555.A O no hydrogen 3.277 N/A MET 561.A N ASP 557.A O no hydrogen 3.149 N/A GLY 562.A N ASP 559.A O no hydrogen 3.218 N/A THR 564.A OG1 PHE 565.A O no hydrogen 3.427 N/A ARG 566.A NH1 ASP 568.A OD1 no hydrogen 2.581 N/A ARG 567.A NE GLN 397.A OE1 no hydrogen 2.983 N/A ARG 567.A NH2 GLN 396.A OE1 no hydrogen 3.429 N/A LEU 569.A N CYS 549.A O no hydrogen 2.814 N/A TYR 570.A N CYS 549.A O no hydrogen 3.113 N/A SER 572.A N LEU 547.A O no hydrogen 3.223 N/A ARG 573.A NH1 ASP 644.A O no hydrogen 3.045 N/A ARG 573.A NH2 ASP 644.A O no hydrogen 2.435 N/A VAL 574.A N VAL 545.A O no hydrogen 3.250 N/A VAL 576.A N VAL 543.A O no hydrogen 3.062 N/A TYR 577.A N VAL 543.A O no hydrogen 3.269 N/A THR 587.A N GLN 590.A OE1 no hydrogen 3.205 N/A GLN 590.A N THR 587.A OG1 no hydrogen 3.229 N/A GLN 590.A NE2 GLY 529.A O no hydrogen 3.218 N/A GLU 591.A N THR 587.A O no hydrogen 3.179 N/A SER 592.A OG GLN 588.A O no hydrogen 2.968 N/A LEU 593.A N LEU 589.A O no hydrogen 3.029 N/A LEU 594.A N GLN 590.A O no hydrogen 3.073 N/A LYS 595.A N GLU 591.A O no hydrogen 3.430 N/A LYS 596.A N SER 592.A O no hydrogen 2.911 N/A LYS 596.A NZ SER 496.A OG no hydrogen 3.095 N/A LEU 597.A N LEU 593.A O no hydrogen 2.845 N/A THR 601.A OG1 GLY 598.A O no hydrogen 3.322 N/A TYR 602.A N VAL 531.A O no hydrogen 3.006 N/A PHE 604.A N GLY 529.A O no hydrogen 3.278 N/A LEU 606.A N VAL 527.A O no hydrogen 3.175 N/A SER 615.A N LYS 662.A O no hydrogen 3.099 N/A MET 617.A N LEU 781.A O no hydrogen 2.874 N/A LEU 618.A N CYS 629.A O no hydrogen 3.169 N/A GLN 619.A N ILE 779.A O no hydrogen 2.712 N/A GLN 619.A NE2 ASN 773.A O no hydrogen 2.939 N/A GLN 619.A NE2 ARG 776.A O no hydrogen 3.501 N/A GLN 623.A N GLN 623.A OE1 no hydrogen 2.707 N/A LYS 627.A NZ PHE 306.A O no hydrogen 2.868 N/A CYS 629.A SG ARG 552.A O no hydrogen 3.424 N/A GLY 630.A N ARG 552.A O no hydrogen 2.750 N/A VAL 631.A N VAL 616.A O no hydrogen 2.605 N/A ASP 632.A N ALA 550.A O no hydrogen 3.332 N/A GLU 634.A N THR 548.A O no hydrogen 2.685 N/A VAL 635.A N LEU 658.A O no hydrogen 3.009 N/A LYS 636.A N THR 546.A O no hydrogen 3.403 N/A ALA 637.A N VAL 656.A O no hydrogen 2.767 N/A PHE 638.A N TYR 544.A O no hydrogen 3.231 N/A SER 640.A N LYS 542.A O no hydrogen 3.065 N/A ILE 642.A N SER 640.A OG no hydrogen 3.170 N/A LYS 649.A N ASP 648.A OD1 no hydrogen 2.707 N/A LYS 652.A NZ ASP 485.A OD2 no hydrogen 2.931 N/A SER 654.A OG ALA 639.A O no hydrogen 2.778 N/A SER 654.A OG PRO 651.A O no hydrogen 3.396 N/A SER 655.A OG PRO 651.A O no hydrogen 3.275 N/A SER 655.A OG LYS 652.A O no hydrogen 2.840 N/A VAL 656.A N ALA 637.A O no hydrogen 2.728 N/A LEU 658.A N VAL 635.A O no hydrogen 2.925 N/A ILE 660.A N PHE 633.A O no hydrogen 3.100 N/A ARG 661.A N ARG 515.A O no hydrogen 2.795 N/A ARG 661.A NE ASP 516.A OD1 no hydrogen 2.889 N/A ARG 661.A NH1 GLY 783.A O no hydrogen 2.754 N/A ARG 661.A NH2 ASP 516.A OD1 no hydrogen 3.197 N/A LYS 662.A N SER 615.A OG no hydrogen 2.892 N/A LYS 662.A NZ ASP 519.A OD2 no hydrogen 2.884 N/A LYS 662.A NZ LEU 612.A O no hydrogen 3.341 N/A LYS 662.A NZ PRO 613.A O no hydrogen 3.282 N/A VAL 663.A N TYR 517.A O no hydrogen 3.110 N/A GLN 664.A NE2 ASP 519.A OD2 no hydrogen 2.674 N/A GLN 664.A NE2 ILE 797.A O no hydrogen 3.030 N/A HIS 665.A ND1 PRO 844.A O no hydrogen 3.038 N/A ALA 666.A N HIS 843.A O no hydrogen 2.796 N/A GLN 673.A NE2 LEU 695.A O no hydrogen 3.304 N/A ALA 676.A N VAL 693.A O no hydrogen 3.009 N/A ALA 678.A N LEU 691.A O no hydrogen 3.100 N/A TRP 680.A N LEU 689.A O no hydrogen 2.918 N/A PHE 682.A N SER 685.A O no hydrogen 3.007 N/A SER 685.A OG ASP 717.A OD2 no hydrogen 3.279 N/A LYS 687.A NZ ASP 717.A OD1 no hydrogen 3.121 N/A LEU 689.A N TRP 680.A O no hydrogen 2.878 N/A ASN 690.A N THR 713.A O no hydrogen 3.154 N/A LEU 691.A N ALA 678.A O no hydrogen 3.030 N/A SER 692.A N THR 711.A O no hydrogen 3.024 N/A VAL 693.A N ALA 676.A O no hydrogen 2.822 N/A SER 694.A N THR 709.A O no hydrogen 2.708 N/A LEU 695.A N PRO 674.A O no hydrogen 3.038 N/A SER 696.A N TYR 700.A OH no hydrogen 3.324 N/A SER 696.A OG TYR 700.A OH no hydrogen 2.683 N/A LYS 697.A N TYR 700.A OH no hydrogen 3.247 N/A LYS 697.A NZ GLU 704.A OE2 no hydrogen 2.736 N/A TYR 700.A N ARG 840.A O no hydrogen 2.764 N/A TYR 700.A OH SER 696.A OG no hydrogen 2.683 N/A PHE 701.A N GLU 704.A OE1 no hydrogen 2.888 N/A GLU 704.A N PHE 701.A O no hydrogen 3.065 N/A ILE 706.A N LEU 766.A O no hydrogen 3.110 N/A VAL 708.A N LEU 764.A O no hydrogen 2.869 N/A THR 709.A N SER 694.A O no hydrogen 2.771 N/A THR 709.A OG1 THR 763.A OG1 no hydrogen 3.418 N/A VAL 710.A N LYS 762.A O no hydrogen 2.897 N/A THR 711.A N SER 692.A O no hydrogen 2.935 N/A VAL 712.A N LEU 760.A O no hydrogen 2.938 N/A THR 713.A N ASN 690.A O no hydrogen 2.874 N/A ASN 714.A ND2 LYS 718.A O no hydrogen 3.013 N/A ASN 714.A ND2 VAL 754.A O no hydrogen 3.245 N/A THR 716.A N ASN 714.A OD1 no hydrogen 2.916 N/A VAL 720.A N VAL 754.A O no hydrogen 3.249 N/A LYS 721.A N THR 820.A O no hydrogen 2.842 N/A LYS 722.A N THR 820.A O no hydrogen 3.499 N/A LYS 722.A NZ GLU 749.A OE1 no hydrogen 2.954 N/A ILE 723.A N THR 750.A O no hydrogen 2.945 N/A LYS 724.A N LYS 818.A O no hydrogen 2.797 N/A VAL 725.A N GLU 748.A O no hydrogen 2.724 N/A SER 726.A N LYS 816.A O no hydrogen 2.801 N/A VAL 727.A N ALA 746.A O no hydrogen 2.631 N/A GLU 728.A N HIS 814.A O no hydrogen 3.042 N/A GLN 729.A N LYS 743.A O no hydrogen 3.216 N/A GLN 729.A NE2 ALA 780.A O no hydrogen 3.033 N/A ILE 730.A N SER 812.A O no hydrogen 2.668 N/A ALA 731.A N TYR 741.A O no hydrogen 2.952 N/A ASN 732.A N LEU 810.A O no hydrogen 2.664 N/A VAL 733.A N ASP 739.A O no hydrogen 2.914 N/A VAL 734.A N GLY 808.A O no hydrogen 2.858 N/A SER 737.A OG ASP 739.A OD2 no hydrogen 3.106 N/A SER 738.A OG ASN 732.A OD1 no hydrogen 3.305 N/A ASP 739.A N VAL 733.A O no hydrogen 2.992 N/A TYR 741.A N ALA 731.A O no hydrogen 3.284 N/A LYS 743.A N GLN 729.A O no hydrogen 3.463 N/A VAL 745.A N VAL 727.A O no hydrogen 2.842 N/A ALA 746.A N VAL 727.A O no hydrogen 3.326 N/A GLU 748.A N VAL 725.A O no hydrogen 2.880 N/A THR 750.A N ILE 723.A O no hydrogen 2.777 N/A VAL 754.A N VAL 720.A O no hydrogen 3.351 N/A SER 758.A N ASN 714.A O no hydrogen 3.263 N/A LEU 760.A N VAL 712.A O no hydrogen 3.041 N/A LYS 762.A N VAL 710.A O no hydrogen 2.972 N/A THR 763.A OG1 THR 709.A OG1 no hydrogen 3.418 N/A LEU 764.A N VAL 708.A O no hydrogen 3.085 N/A LEU 766.A N ILE 706.A O no hydrogen 2.999 N/A ASN 773.A ND2 VAL 745.A O no hydrogen 2.679 N/A ASN 773.A ND2 LEU 769.A O no hydrogen 2.682 N/A ARG 776.A NH1 PRO 744.A O no hydrogen 3.173 N/A ARG 776.A NH1 ASN 773.A OD1 no hydrogen 2.598 N/A ARG 776.A NH2 PRO 744.A O no hydrogen 3.474 N/A GLY 778.A N GLN 619.A O no hydrogen 3.282 N/A ALA 780.A N GLN 729.A OE1 no hydrogen 3.239 N/A LEU 781.A N MET 617.A O no hydrogen 2.719 N/A ASP 782.A N ASN 791.A O no hydrogen 3.157 N/A GLY 783.A N SER 615.A O no hydrogen 3.138 N/A LYS 784.A NZ HIS 787.A ND1 no hydrogen 3.015 N/A GLU 788.A N ILE 785.A O no hydrogen 3.230 N/A THR 790.A OG1 ASP 782.A O no hydrogen 2.724 N/A THR 790.A OG1 ASN 791.A O no hydrogen 3.358 N/A ALA 793.A N ALA 780.A O no hydrogen 3.025 N/A SER 794.A N ASP 782.A OD1 no hydrogen 3.027 N/A SER 794.A OG ASP 782.A OD1 no hydrogen 3.410 N/A SER 794.A OG ASP 782.A OD2 no hydrogen 3.080 N/A SER 795.A N LEU 841.A O no hydrogen 2.964 N/A SER 795.A OG LEU 841.A O no hydrogen 3.277 N/A THR 796.A N VAL 811.A O no hydrogen 3.253 N/A THR 796.A OG1 VAL 811.A O no hydrogen 3.136 N/A ILE 797.A N GLN 664.A OE1 no hydrogen 2.830 N/A LYS 799.A NZ SER 522.A O no hydrogen 3.023 N/A ARG 804.A NH2 GLU 399.A OE2 no hydrogen 3.281 N/A GLY 808.A N VAL 734.A O no hydrogen 2.783 N/A LEU 810.A N ASN 732.A O no hydrogen 2.717 N/A SER 812.A N ILE 730.A O no hydrogen 2.767 N/A TYR 813.A OH ALA 793.A O no hydrogen 2.696 N/A HIS 814.A N GLU 728.A O no hydrogen 3.246 N/A HIS 814.A NE2 GLU 728.A OE1 no hydrogen 2.874 N/A ILE 815.A N VAL 837.A O no hydrogen 2.881 N/A LYS 816.A N SER 726.A O no hydrogen 2.741 N/A LYS 816.A NZ GLU 728.A OE2 no hydrogen 2.926 N/A VAL 817.A N THR 835.A O no hydrogen 3.179 N/A LYS 818.A N LYS 724.A O no hydrogen 2.530 N/A LYS 818.A NZ GLU 832.A OE1 no hydrogen 3.429 N/A LYS 818.A NZ GLU 832.A OE2 no hydrogen 3.426 N/A LEU 819.A N VAL 833.A O no hydrogen 2.623 N/A THR 820.A N LYS 722.A O no hydrogen 3.093 N/A VAL 821.A N SER 831.A O no hydrogen 3.405 N/A SER 822.A N VAL 719.A O no hydrogen 3.246 N/A GLY 823.A N THR 829.A O no hydrogen 2.660 N/A SER 831.A N VAL 821.A O no hydrogen 2.995 N/A VAL 833.A N LEU 819.A O no hydrogen 2.992 N/A THR 835.A N VAL 817.A O no hydrogen 3.455 N/A VAL 837.A N ILE 815.A O no hydrogen 3.234 N/A PHE 839.A N TYR 813.A O no hydrogen 3.233 N/A ARG 840.A N GLU 698.A O no hydrogen 3.201 N/A LEU 841.A N SER 795.A OG no hydrogen 2.834 N/A MET 842.A N TYR 700.A O no hydrogen 3.173 N/A