Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3oc3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N LEU 1.A O no hydrogen 2.972 N/A GLN 5.A N LEU 1.A O no hydrogen 3.143 N/A SER 6.A N ASN 2.A O no hydrogen 2.812 N/A SER 6.A OG ASN 2.A O no hydrogen 3.068 N/A SER 6.A OG THR 3.A O no hydrogen 2.893 N/A LYS 7.A N THR 3.A O no hydrogen 2.947 N/A LYS 7.A N ALA 4.A O no hydrogen 3.134 N/A VAL 8.A N ALA 4.A O no hydrogen 3.030 N/A LEU 9.A N GLN 5.A O no hydrogen 3.251 N/A LYS 10.A N SER 6.A O no hydrogen 2.712 N/A GLY 11.A N LYS 7.A O no hydrogen 3.079 N/A THR 13.A OG1 THR 14.A OG1 no hydrogen 3.102 N/A THR 14.A OG1 THR 13.A OG1 no hydrogen 3.102 N/A SER 19.A OG GLU 16.A O no hydrogen 2.856 N/A SER 19.A OG GLU 23.A OE2 no hydrogen 2.801 N/A GLN 20.A N GLU 16.A O no hydrogen 2.897 N/A LYS 22.A N VAL 18.A O no hydrogen 2.848 N/A GLU 23.A N SER 19.A O no hydrogen 2.449 N/A TYR 24.A N ILE 21.A O no hydrogen 3.285 N/A THR 35.A N LEU 32.A O no hydrogen 2.628 N/A TYR 36.A N LEU 32.A O no hydrogen 3.441 N/A LEU 38.A N THR 35.A O no hydrogen 2.845 N/A LEU 39.A N THR 35.A O no hydrogen 3.326 N/A CYS 40.A N TYR 36.A O no hydrogen 3.203 N/A CYS 40.A SG TYR 36.A O no hydrogen 3.671 N/A GLY 41.A N LEU 38.A O no hydrogen 2.681 N/A GLN 42.A NE2 TYR 145.A OH no hydrogen 3.249 N/A ARG 47.A N ALA 43.A O no hydrogen 3.490 N/A ARG 47.A NE GLY 41.A O no hydrogen 3.244 N/A ARG 47.A NH2 GLN 42.A O no hydrogen 3.557 N/A ARG 48.A NH1 GLU 45.A OE2 no hydrogen 3.264 N/A ASN 49.A N GLU 45.A O no hydrogen 3.002 N/A GLY 50.A N ASP 46.A O no hydrogen 2.619 N/A ALA 51.A N ARG 47.A O no hydrogen 2.967 N/A ARG 52.A N ARG 48.A O no hydrogen 2.949 N/A ARG 52.A N ASN 49.A O no hydrogen 2.838 N/A ARG 52.A NH1 SER 19.A O no hydrogen 3.394 N/A ILE 53.A N ASN 49.A O no hydrogen 3.333 N/A ILE 53.A N GLY 50.A O no hydrogen 2.938 N/A LEU 54.A N GLY 50.A O no hydrogen 3.370 N/A ARG 55.A NE SER 159.A OG no hydrogen 2.914 N/A SER 56.A N ILE 53.A O no hydrogen 2.948 N/A SER 56.A OG ARG 52.A O no hydrogen 3.444 N/A SER 56.A OG ILE 53.A O no hydrogen 3.220 N/A LEU 57.A N LEU 54.A O no hydrogen 3.313 N/A MET 58.A N SER 56.A O no hydrogen 3.153 N/A LYS 62.A N ILE 163.A O no hydrogen 2.927 N/A VAL 64.A N ILE 165.A O no hydrogen 3.125 N/A LYS 68.A NZ SER 169.A OG no hydrogen 3.368 N/A TYR 71.A OH ASP 215.A OD1 no hydrogen 3.018 N/A SER 74.A OG GLU 177.A OE2 no hydrogen 2.719 N/A SER 76.A N SER 74.A OG no hydrogen 2.844 N/A SER 76.A OG GLU 177.A OE2 no hydrogen 3.559 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 2.741 N/A PHE 86.A N GLY 83.A O no hydrogen 2.869 N/A ASN 87.A N GLU 84.A O no hydrogen 3.334 N/A GLN 94.A N SER 92.A OG no hydrogen 2.773 N/A GLN 96.A NE2 PRO 91.A O no hydrogen 3.361 N/A ARG 98.A N GLN 94.A O no hydrogen 3.329 N/A MET 99.A N GLU 95.A O no hydrogen 3.318 N/A VAL 100.A N GLN 96.A O no hydrogen 2.960 N/A ARG 101.A N LYS 97.A O no hydrogen 2.955 N/A ARG 101.A NH1 VAL 109.A O no hydrogen 2.857 N/A LYS 102.A N ARG 98.A O no hydrogen 3.300 N/A ILE 103.A N MET 99.A O no hydrogen 2.996 N/A ALA 104.A N VAL 100.A O no hydrogen 2.979 N/A LYS 105.A N LYS 102.A O no hydrogen 3.091 N/A LEU 106.A N ARG 101.A O no hydrogen 2.862 N/A GLU 107.A N GLU 107.A OE2 no hydrogen 2.682 N/A SER 115.A N ASP 118.A OD2 no hydrogen 3.135 N/A PHE 119.A N ASP 116.A O no hydrogen 3.013 N/A LYS 120.A N ILE 117.A O no hydrogen 2.897 N/A GLU 126.A N ASP 130.A OD2 no hydrogen 3.265 N/A ASP 130.A N ASN 127.A O no hydrogen 2.836 N/A PHE 131.A N VAL 128.A O no hydrogen 2.893 N/A GLN 134.A N ASP 130.A O no hydrogen 3.304 N/A SER 136.A N PHE 132.A O no hydrogen 3.190 N/A SER 136.A OG PHE 132.A O no hydrogen 3.185 N/A ASP 137.A N GLU 133.A O no hydrogen 3.258 N/A ASN 138.A N GLN 134.A O no hydrogen 3.249 N/A ASN 138.A ND2 TYR 36.A OH no hydrogen 3.253 N/A LEU 139.A N ILE 135.A O no hydrogen 2.818 N/A LEU 140.A N ASP 137.A O no hydrogen 3.205 N/A SER 141.A N ASN 138.A O no hydrogen 2.890 N/A SER 141.A OG ASN 138.A O no hydrogen 3.428 N/A TRP 144.A N SER 80.A O no hydrogen 3.065 N/A LYS 146.A N GLU 143.A O no hydrogen 2.830 N/A ARG 147.A N GLU 143.A O no hydrogen 3.078 N/A ARG 147.A NH1 LEU 79.A O no hydrogen 3.266 N/A ARG 147.A NH1 SER 141.A O no hydrogen 2.693 N/A ARG 147.A NH2 LEU 79.A O no hydrogen 2.630 N/A ARG 147.A NH2 ASP 182.A OD1 no hydrogen 2.766 N/A HIS 148.A N TRP 144.A O no hydrogen 2.747 N/A HIS 148.A ND1 PRO 195.A O no hydrogen 3.196 N/A GLY 149.A N TYR 145.A O no hydrogen 2.836 N/A ALA 150.A N LYS 146.A O no hydrogen 2.843 N/A PHE 151.A N ARG 147.A O no hydrogen 2.961 N/A LEU 152.A N HIS 148.A O no hydrogen 2.678 N/A ALA 153.A N GLY 149.A O no hydrogen 3.069 N/A ALA 153.A N ALA 150.A O no hydrogen 3.100 N/A PHE 154.A N ALA 150.A O no hydrogen 3.453 N/A ALA 155.A N PHE 151.A O no hydrogen 3.366 N/A ALA 156.A N ALA 153.A O no hydrogen 2.771 N/A MET 157.A N ALA 153.A O no hydrogen 3.089 N/A PHE 158.A N PHE 154.A O no hydrogen 2.895 N/A SER 159.A N ALA 156.A O no hydrogen 3.004 N/A LYS 170.A N ASP 168.A OD1 no hydrogen 2.901 N/A SER 173.A OG LYS 68.A O no hydrogen 3.378 N/A LYS 174.A N LYS 170.A O no hydrogen 3.067 N/A LYS 174.A N LEU 171.A O no hydrogen 2.882 N/A LYS 174.A NZ SER 136.A O no hydrogen 2.758 N/A LYS 174.A NZ ASP 168.A OD2 no hydrogen 2.872 N/A ILE 175.A N LEU 171.A O no hydrogen 3.005 N/A TYR 176.A N PHE 172.A O no hydrogen 2.891 N/A GLU 177.A N SER 173.A O no hydrogen 3.142 N/A ILE 178.A N LYS 174.A O no hydrogen 2.975 N/A LEU 179.A N ILE 175.A O no hydrogen 2.923 N/A VAL 180.A N TYR 176.A O no hydrogen 3.266 N/A THR 181.A N GLU 177.A O no hydrogen 2.799 N/A THR 181.A N ILE 178.A O no hydrogen 2.990 N/A THR 181.A OG1 GLU 177.A O no hydrogen 2.968 N/A ASP 182.A N ILE 178.A O no hydrogen 2.700 N/A LYS 183.A N TYR 78.A O no hydrogen 2.986 N/A LYS 183.A NZ VAL 180.A O no hydrogen 2.899 N/A LYS 183.A NZ ASP 182.A O no hydrogen 3.395 N/A PHE 184.A N ASP 182.A OD2 no hydrogen 3.282 N/A ASP 186.A N VAL 193.A O no hydrogen 2.715 N/A VAL 188.A N ASP 186.A OD1 no hydrogen 3.107 N/A ARG 191.A NH2 GLU 273.A OE2 no hydrogen 2.667 N/A THR 192.A N ASP 266.A OD1 no hydrogen 2.983 N/A THR 192.A OG1 ASP 266.A OD2 no hydrogen 2.423 N/A VAL 193.A N ASP 186.A O no hydrogen 3.292 N/A ARG 197.A NE ASP 182.A OD2 no hydrogen 3.370 N/A ARG 197.A NH2 PHE 184.A O no hydrogen 3.135 N/A ARG 197.A NH2 ASN 185.A OD1 no hydrogen 2.675 N/A ASP 198.A N ALA 194.A O no hydrogen 2.789 N/A ALA 199.A N PRO 195.A O no hydrogen 3.379 N/A ALA 200.A N VAL 196.A O no hydrogen 2.829 N/A ALA 201.A N ARG 197.A O no hydrogen 2.825 N/A TYR 202.A N ASP 198.A O no hydrogen 3.019 N/A LEU 203.A N ALA 199.A O no hydrogen 3.348 N/A LEU 203.A N ALA 200.A O no hydrogen 2.719 N/A LEU 204.A N ALA 200.A O no hydrogen 3.334 N/A SER 205.A N TYR 202.A O no hydrogen 3.095 N/A SER 205.A OG TYR 202.A O no hydrogen 2.520 N/A ARG 206.A N LEU 203.A O no hydrogen 2.680 N/A ILE 207.A N LEU 203.A O no hydrogen 2.918 N/A TYR 208.A N LEU 204.A O no hydrogen 3.138 N/A ILE 211.A N PRO 209.A O no hydrogen 2.753 N/A ASN 214.A ND2 TYR 208.A OH no hydrogen 2.948 N/A LEU 220.A N ILE 216.A O no hydrogen 2.821 N/A VAL 221.A N ILE 217.A O no hydrogen 3.012 N/A GLY 222.A N GLN 219.A O no hydrogen 3.029 N/A PHE 223.A N LEU 220.A O no hydrogen 2.636 N/A LEU 224.A N VAL 221.A O no hydrogen 3.352 N/A ASP 225.A N GLY 222.A O no hydrogen 3.240 N/A SER 226.A N PHE 223.A O no hydrogen 3.018 N/A ASP 228.A N SER 226.A OG no hydrogen 2.993 N/A GLN 230.A N ASP 228.A OD1 no hydrogen 3.033 N/A VAL 231.A N ASP 228.A O no hydrogen 2.992 N/A GLN 232.A N ASP 228.A O no hydrogen 3.151 N/A GLN 232.A NE2 LEU 224.A O no hydrogen 2.943 N/A PHE 233.A N TRP 229.A O no hydrogen 2.722 N/A SER 234.A N GLN 230.A O no hydrogen 3.059 N/A SER 234.A OG LEU 179.A O no hydrogen 2.795 N/A SER 234.A OG GLN 230.A O no hydrogen 3.559 N/A GLY 235.A N VAL 231.A O no hydrogen 2.806 N/A LEU 236.A N GLN 232.A O no hydrogen 2.897 N/A ILE 237.A N PHE 233.A O no hydrogen 3.040 N/A ALA 238.A N SER 234.A O no hydrogen 3.169 N/A LEU 239.A N GLY 235.A O no hydrogen 2.943 N/A GLY 240.A N LEU 236.A O no hydrogen 2.907 N/A TYR 241.A N ILE 237.A O no hydrogen 3.276 N/A TYR 241.A OH ASP 198.A OD2 no hydrogen 3.379 N/A LEU 242.A N ALA 238.A O no hydrogen 3.087 N/A LEU 242.A N LEU 239.A O no hydrogen 3.137 N/A LYS 243.A N GLY 240.A O no hydrogen 3.475 N/A LYS 243.A NZ GLY 240.A O no hydrogen 3.042 N/A PHE 245.A N LEU 242.A O no hydrogen 2.791 N/A VAL 246.A N LYS 243.A O no hydrogen 3.405 N/A GLY 251.A N ASP 248.A O no hydrogen 2.886 N/A LEU 252.A N LYS 249.A O no hydrogen 2.949 N/A CYS 253.A N LYS 249.A O no hydrogen 2.838 N/A CYS 253.A SG LYS 249.A O no hydrogen 3.457 N/A ARG 254.A N ASP 250.A O no hydrogen 3.178 N/A LYS 255.A NZ ASP 225.A OD1 no hydrogen 3.318 N/A LYS 255.A NZ ASP 225.A OD2 no hydrogen 3.151 N/A LEU 256.A N LEU 252.A O no hydrogen 2.966 N/A VAL 257.A N CYS 253.A O no hydrogen 2.770 N/A SER 258.A N ARG 254.A O no hydrogen 3.261 N/A LEU 259.A N LYS 255.A O no hydrogen 2.895 N/A LEU 260.A N VAL 257.A O no hydrogen 3.214 N/A SER 261.A N SER 258.A O no hydrogen 3.313 N/A SER 262.A N LEU 259.A O no hydrogen 3.039 N/A ASP 264.A N SER 262.A OG no hydrogen 3.349 N/A ASP 266.A N ASP 264.A OD2 no hydrogen 3.207 N/A LYS 268.A N ASP 264.A O no hydrogen 3.136 N/A LYS 268.A NZ GLU 265.A OE2 no hydrogen 3.231 N/A LEU 269.A N GLU 265.A O no hydrogen 2.896 N/A LEU 270.A N ASP 266.A O no hydrogen 2.858 N/A SER 271.A N ILE 267.A O no hydrogen 2.948 N/A SER 271.A OG LEU 256.A O no hydrogen 3.371 N/A ALA 272.A N LYS 268.A O no hydrogen 3.104 N/A GLU 273.A N LEU 269.A O no hydrogen 2.963 N/A LEU 274.A N LEU 270.A O no hydrogen 3.124 N/A LEU 274.A N SER 271.A O no hydrogen 3.247 N/A LEU 275.A N SER 271.A O no hydrogen 3.075 N/A CYS 276.A N ALA 272.A O no hydrogen 3.081 N/A CYS 276.A SG ALA 272.A O no hydrogen 3.508 N/A HIS 277.A N LEU 274.A O no hydrogen 3.210 N/A PHE 278.A N LEU 275.A O no hydrogen 3.377 N/A LEU 286.A N SER 283.A O no hydrogen 2.776 N/A VAL 287.A N SER 283.A O no hydrogen 2.834 N/A LYS 290.A N LEU 286.A O no hydrogen 3.191 N/A LYS 290.A NZ VAL 257.A O no hydrogen 3.114 N/A CYS 291.A N VAL 287.A O no hydrogen 3.136 N/A CYS 291.A SG VAL 287.A O no hydrogen 3.139 N/A CYS 291.A SG ASN 308.A OD1 no hydrogen 3.904 N/A TRP 292.A N LEU 288.A O no hydrogen 2.939 N/A LYS 293.A N GLU 289.A O no hydrogen 3.013 N/A ASN 294.A N LYS 290.A O no hydrogen 2.928 N/A ASN 294.A ND2 LEU 260.A O no hydrogen 3.284 N/A ILE 295.A N CYS 291.A O no hydrogen 2.973 N/A GLU 296.A N TRP 292.A O no hydrogen 2.927 N/A GLU 296.A N LYS 293.A O no hydrogen 3.134 N/A SER 297.A N LYS 293.A O no hydrogen 3.005 N/A SER 297.A OG ASN 294.A O no hydrogen 3.058 N/A GLU 299.A N SER 297.A OG no hydrogen 3.372 N/A SER 304.A OG GLU 265.A OE2 no hydrogen 2.961 N/A LYS 305.A N SER 302.A O no hydrogen 3.286 N/A LYS 305.A NZ ILE 295.A O no hydrogen 2.853 N/A SER 307.A OG SER 304.A O no hydrogen 3.049 N/A ASN 308.A N SER 304.A O no hydrogen 2.852 N/A ASN 308.A ND2 SER 304.A O no hydrogen 2.993 N/A ASN 308.A ND2 SER 307.A OG no hydrogen 3.339 N/A LEU 309.A N LYS 305.A O no hydrogen 2.980 N/A SER 310.A N THR 306.A O no hydrogen 2.905 N/A SER 310.A OG THR 306.A O no hydrogen 3.175 N/A LEU 311.A N SER 307.A O no hydrogen 3.124 N/A LEU 312.A N ASN 308.A O no hydrogen 3.049 N/A THR 313.A N LEU 309.A O no hydrogen 2.917 N/A THR 313.A OG1 LEU 309.A O no hydrogen 3.213 N/A LYS 314.A N SER 310.A O no hydrogen 2.973 N/A LYS 314.A NZ CYS 276.A O no hydrogen 2.643 N/A LYS 314.A NZ PHE 278.A O no hydrogen 3.390 N/A LYS 314.A NZ GLU 318.A OE2 no hydrogen 3.253 N/A ILE 315.A N LEU 311.A O no hydrogen 3.154 N/A TYR 316.A N LEU 312.A O no hydrogen 2.967 N/A ARG 317.A N THR 313.A O no hydrogen 2.996 N/A GLU 318.A N LYS 314.A O no hydrogen 2.881 N/A ASN 319.A ND2 ILE 315.A O no hydrogen 2.644 N/A LEU 322.A N ASN 319.A O no hydrogen 2.910 N/A GLU 327.A N GLU 327.A OE1 no hydrogen 3.006 N/A ARG 328.A NH1 GLU 296.A OE1 no hydrogen 3.123 N/A LEU 329.A N PRO 326.A O no hydrogen 3.118 N/A LYS 330.A NZ ASP 331.A OD1 no hydrogen 3.142 N/A ASP 331.A N ARG 328.A O no hydrogen 3.043 N/A ILE 332.A N LEU 329.A O no hydrogen 3.186 N/A CYS 335.A N ILE 332.A O no hydrogen 3.063 N/A PHE 336.A N PHE 333.A O no hydrogen 3.308 N/A THR 337.A N PRO 334.A O no hydrogen 2.997 N/A THR 337.A OG1 SER 416.A OG no hydrogen 2.700 N/A SER 338.A N PRO 334.A O no hydrogen 3.082 N/A VAL 340.A N SER 338.A OG no hydrogen 3.274 N/A VAL 343.A N VAL 340.A O no hydrogen 3.176 N/A ARG 344.A N VAL 340.A O no hydrogen 3.373 N/A ARG 344.A NE GLU 370.A OE1 no hydrogen 2.809 N/A ARG 344.A NE GLU 370.A OE2 no hydrogen 3.285 N/A ARG 344.A NH1 SER 338.A O no hydrogen 3.090 N/A ARG 344.A NH1 PRO 339.A O no hydrogen 3.319 N/A ARG 344.A NH2 GLU 370.A OE2 no hydrogen 2.804 N/A THR 345.A N PRO 341.A O no hydrogen 2.947 N/A SER 346.A N GLU 342.A O no hydrogen 3.012 N/A ILE 347.A N VAL 343.A O no hydrogen 2.948 N/A LEU 348.A N ARG 344.A O no hydrogen 3.266 N/A ASN 349.A N SER 346.A O no hydrogen 3.186 N/A MET 350.A N SER 346.A O no hydrogen 3.088 N/A MET 350.A N ILE 347.A O no hydrogen 3.123 N/A VAL 351.A N ILE 347.A O no hydrogen 3.274 N/A LYS 352.A NZ ASN 353.A OD1 no hydrogen 3.222 N/A LEU 354.A N VAL 351.A O no hydrogen 3.250 N/A ASP 360.A N GLU 356.A O no hydrogen 2.826 N/A PHE 361.A N GLU 357.A O no hydrogen 2.825 N/A LEU 362.A N SER 358.A O no hydrogen 3.197 N/A VAL 363.A N ILE 359.A O no hydrogen 3.033 N/A VAL 363.A N ASP 360.A O no hydrogen 3.271 N/A ALA 364.A N ASP 360.A O no hydrogen 3.383 N/A GLU 365.A N PHE 361.A O no hydrogen 3.194 N/A VAL 366.A N LEU 362.A O no hydrogen 3.150 N/A VAL 367.A N VAL 363.A O no hydrogen 3.293 N/A LEU 368.A N ALA 364.A O no hydrogen 3.245 N/A LEU 368.A N GLU 365.A O no hydrogen 3.239 N/A ILE 369.A N GLU 365.A O no hydrogen 3.066 N/A LYS 372.A N GLU 370.A OE2 no hydrogen 3.118 N/A LYS 372.A NZ GLU 374.A OE1 no hydrogen 2.959 N/A ARG 376.A N LYS 372.A O no hydrogen 3.215 N/A ARG 376.A NE ASP 373.A OD1 no hydrogen 3.371 N/A ARG 376.A NH1 VAL 367.A O no hydrogen 3.198 N/A ARG 376.A NH1 GLU 370.A O no hydrogen 2.951 N/A ARG 376.A NH2 GLU 370.A O no hydrogen 3.154 N/A ARG 376.A NH2 ASP 373.A OD1 no hydrogen 2.636 N/A GLU 377.A N ASP 373.A O no hydrogen 2.915 N/A MET 378.A N ILE 375.A O no hydrogen 3.127 N/A ILE 380.A N ARG 376.A O no hydrogen 2.853 N/A LYS 381.A N GLU 377.A O no hydrogen 2.945 N/A LEU 382.A N MET 378.A O no hydrogen 3.284 N/A LEU 383.A N ILE 380.A O no hydrogen 3.040 N/A LYS 384.A N ILE 380.A O no hydrogen 3.011 N/A LYS 385.A NZ LYS 352.A O no hydrogen 3.020 N/A ARG 386.A N LEU 383.A O no hydrogen 3.122 N/A ARG 386.A NE ASP 388.A OD1 no hydrogen 2.923 N/A ARG 386.A NH1 ASP 360.A OD1 no hydrogen 3.229 N/A ARG 386.A NH2 ASP 360.A OD1 no hydrogen 3.296 N/A ARG 386.A NH2 ASP 360.A OD2 no hydrogen 3.341 N/A ARG 386.A NH2 ASP 388.A OD1 no hydrogen 3.557 N/A ARG 387.A NH1 LYS 384.A O no hydrogen 2.795 N/A ARG 387.A NH1 ARG 386.A O no hydrogen 3.205 N/A LEU 389.A N SER 449.A OG no hydrogen 2.678 N/A ASN 392.A ND2 GLU 357.A OE1 no hydrogen 2.806 N/A ASN 392.A ND2 GLU 357.A OE2 no hydrogen 3.335 N/A LEU 393.A N PRO 390.A O no hydrogen 2.989 N/A ILE 394.A N PRO 390.A O no hydrogen 3.215 N/A LEU 395.A N LYS 391.A O no hydrogen 2.788 N/A HIS 396.A N ASN 392.A O no hydrogen 3.083 N/A HIS 396.A NE2 ASP 413.A O no hydrogen 3.079 N/A PHE 397.A N LEU 393.A O no hydrogen 3.129 N/A MET 398.A N ILE 394.A O no hydrogen 3.001 N/A MET 398.A N LEU 395.A O no hydrogen 3.146 N/A ASN 399.A N HIS 396.A O no hydrogen 3.448 N/A VAL 400.A N HIS 396.A O no hydrogen 3.108 N/A ILE 401.A N PHE 397.A O no hydrogen 2.945 N/A GLY 403.A N VAL 400.A O no hydrogen 3.334 N/A TYR 406.A N SER 404.A OG no hydrogen 3.342 N/A TYR 406.A OH ASP 530.A OD2 no hydrogen 2.922 N/A TYR 409.A N TYR 421.A O no hydrogen 3.157 N/A ASP 412.A N SER 410.A OG no hydrogen 2.802 N/A ASP 413.A N SER 410.A O no hydrogen 2.754 N/A VAL 415.A N GLU 365.A OE1 no hydrogen 3.324 N/A VAL 415.A N GLU 365.A OE2 no hydrogen 2.868 N/A SER 416.A N GLU 365.A OE1 no hydrogen 2.887 N/A SER 416.A OG THR 337.A OG1 no hydrogen 2.700 N/A SER 416.A OG GLU 365.A OE1 no hydrogen 3.206 N/A TYR 417.A OH ASP 419.A OD1 no hydrogen 3.047 N/A TYR 421.A N GLU 418.A O no hydrogen 3.508 N/A THR 423.A OG1 ASP 419.A O no hydrogen 2.901 N/A GLY 426.A N THR 423.A O no hydrogen 3.043 N/A GLY 426.A N THR 423.A OG1 no hydrogen 2.852 N/A ILE 427.A N THR 423.A O no hydrogen 3.330 N/A VAL 429.A N GLY 426.A O no hydrogen 2.832 N/A VAL 430.A N GLY 426.A O no hydrogen 3.328 N/A GLY 431.A N ILE 427.A O no hydrogen 2.940 N/A LYS 432.A NZ SER 529.A OG no hydrogen 3.223 N/A LYS 432.A NZ ASP 530.A OD1 no hydrogen 2.701 N/A GLU 434.A N GLY 431.A O no hydrogen 3.189 N/A ILE 435.A N GLY 431.A O no hydrogen 3.344 N/A LEU 436.A N LYS 432.A O no hydrogen 2.744 N/A LYS 437.A N ASP 433.A O no hydrogen 3.365 N/A LYS 437.A NZ ASP 373.A OD1 no hydrogen 2.970 N/A LYS 437.A NZ ASP 373.A OD2 no hydrogen 3.429 N/A LYS 437.A NZ GLU 434.A OE2 no hydrogen 3.324 N/A ASN 438.A N GLU 434.A O no hydrogen 2.905 N/A ASN 438.A ND2 LEU 368.A O no hydrogen 3.252 N/A ASN 438.A ND2 GLU 434.A OE2 no hydrogen 3.468 N/A ARG 439.A N LEU 436.A O no hydrogen 3.055 N/A ARG 439.A NE TYR 409.A OH no hydrogen 2.934 N/A ARG 439.A NH1 ILE 401.A O no hydrogen 2.736 N/A ARG 439.A NH1 GLY 403.A O no hydrogen 3.132 N/A CYS 440.A N LEU 436.A O no hydrogen 2.998 N/A CYS 440.A SG LEU 436.A O no hydrogen 3.293 N/A LEU 441.A N LYS 437.A O no hydrogen 3.165 N/A LEU 442.A N ASN 438.A O no hydrogen 3.446 N/A PHE 443.A N ARG 439.A O no hydrogen 2.957 N/A GLU 444.A N LEU 441.A O no hydrogen 3.204 N/A CYS 445.A N LEU 442.A O no hydrogen 3.056 N/A CYS 445.A SG LEU 441.A O no hydrogen 3.371 N/A ILE 446.A N LEU 442.A O no hydrogen 3.286 N/A GLN 455.A NE2 ASP 453.A O no hydrogen 3.044 N/A THR 460.A OG1 GLY 402.A O no hydrogen 2.891 N/A THR 460.A OG1 THR 462.A OG1 no hydrogen 2.928 N/A THR 461.A N ASP 499.A OD1 no hydrogen 2.717 N/A THR 461.A N ASP 499.A OD2 no hydrogen 3.051 N/A THR 462.A OG1 GLY 402.A O no hydrogen 3.553 N/A THR 462.A OG1 GLY 403.A O no hydrogen 3.025 N/A THR 462.A OG1 THR 460.A OG1 no hydrogen 2.928 N/A SER 463.A N THR 460.A OG1 no hydrogen 2.900 N/A ARG 464.A N THR 460.A O no hydrogen 3.342 N/A THR 465.A N THR 461.A O no hydrogen 3.127 N/A THR 465.A OG1 THR 461.A O no hydrogen 3.207 N/A PHE 466.A N THR 462.A O no hydrogen 3.036 N/A ILE 467.A N SER 463.A O no hydrogen 3.062 N/A SER 468.A N ARG 464.A O no hydrogen 2.867 N/A SER 468.A OG ARG 464.A O no hydrogen 2.660 N/A LEU 469.A N THR 465.A O no hydrogen 3.186 N/A TYR 470.A N PHE 466.A O no hydrogen 2.724 N/A TYR 470.A OH PRO 452.A O no hydrogen 2.615 N/A ARG 471.A N ILE 467.A O no hydrogen 3.349 N/A SER 472.A N SER 468.A O no hydrogen 3.126 N/A SER 472.A OG SER 468.A O no hydrogen 3.118 N/A VAL 473.A N LEU 469.A O no hydrogen 2.854 N/A GLN 474.A N TYR 470.A O no hydrogen 2.966 N/A GLN 474.A NE2 LEU 451.A O no hydrogen 3.283 N/A ALA 475.A N ARG 471.A O no hydrogen 2.903 N/A LEU 476.A N SER 472.A O no hydrogen 2.964 N/A VAL 477.A N VAL 473.A O no hydrogen 3.262 N/A VAL 477.A N GLN 474.A O no hydrogen 3.030 N/A LYS 478.A N GLN 474.A O no hydrogen 3.264 N/A LYS 478.A N ALA 475.A O no hydrogen 3.202 N/A THR 480.A N ALA 475.A O no hydrogen 3.010 N/A GLU 488.A N TYR 493.A OH no hydrogen 2.868 N/A LEU 490.A N GLU 489.A OE2 no hydrogen 3.272 N/A PHE 494.A N LEU 490.A O no hydrogen 3.194 N/A ASP 495.A N GLU 491.A O no hydrogen 3.149 N/A ASP 495.A N TYR 492.A O no hydrogen 3.062 N/A ARG 496.A N TYR 492.A O no hydrogen 3.331 N/A ARG 496.A N TYR 493.A O no hydrogen 2.860 N/A CYS 497.A N TYR 493.A O no hydrogen 2.865 N/A CYS 497.A SG TYR 493.A O no hydrogen 3.722 N/A LYS 498.A N GLU 459.A O no hydrogen 3.392 N/A ASP 499.A N ASP 499.A OD1 no hydrogen 2.593 N/A LEU 500.A N CYS 497.A O no hydrogen 3.001 N/A LYS 501.A NZ ASP 495.A O no hydrogen 2.755 N/A PHE 508.A N PRO 504.A O no hydrogen 2.913 N/A LYS 509.A N LEU 505.A O no hydrogen 3.358 N/A LYS 510.A N LYS 506.A O no hydrogen 3.289 N/A LYS 511.A N GLU 507.A O no hydrogen 3.171 N/A LYS 511.A NZ ASP 525.A OD1 no hydrogen 2.871 N/A LEU 512.A N PHE 508.A O no hydrogen 2.800 N/A SER 513.A N LYS 509.A O no hydrogen 2.383 N/A SER 513.A OG LYS 509.A O no hydrogen 2.552 N/A ALA 514.A N LYS 510.A O no hydrogen 3.124 N/A LEU 527.A N MET 523.A O no hydrogen 3.222 N/A TYR 528.A N ASP 525.A O no hydrogen 2.954 N/A SER 529.A N PRO 526.A O no hydrogen 2.947 N/A SER 529.A OG PRO 526.A O no hydrogen 2.880 N/A ASP 530.A N PRO 526.A O no hydrogen 3.243 N/A TYR 531.A N TYR 528.A O no hydrogen 3.248 N/A THR 532.A N TYR 528.A O no hydrogen 3.007 N/A THR 532.A OG1 TYR 528.A O no hydrogen 3.135 N/A ARG 533.A N SER 529.A O no hydrogen 3.129 N/A ARG 533.A NE GLU 553.A OE2 no hydrogen 2.651 N/A ARG 533.A NH1 ASP 530.A OD1 no hydrogen 3.295 N/A ARG 533.A NH2 ASP 530.A OD1 no hydrogen 3.504 N/A ARG 533.A NH2 GLU 553.A OE2 no hydrogen 2.743 N/A MET 534.A N ASP 530.A O no hydrogen 3.215 N/A VAL 535.A N TYR 531.A O no hydrogen 3.073 N/A ALA 536.A N THR 532.A O no hydrogen 3.452 N/A SER 537.A N ARG 533.A O no hydrogen 3.006 N/A SER 537.A OG ARG 533.A O no hydrogen 2.649 N/A ILE 538.A N MET 534.A O no hydrogen 2.713 N/A GLU 539.A N VAL 535.A O no hydrogen 2.853 N/A GLY 542.A N GLU 539.A O no hydrogen 2.555 N/A ARG 545.A N GLU 539.A OE2 no hydrogen 3.028 N/A ARG 545.A NE GLU 539.A OE1 no hydrogen 2.997 N/A ARG 545.A NH2 GLU 539.A OE1 no hydrogen 3.394 N/A ALA 546.A N LEU 543.A O no hydrogen 3.241 N/A PHE 550.A N ALA 546.A O no hydrogen 3.147 N/A GLU 551.A N ALA 548.A O no hydrogen 2.855 N/A VAL 552.A N ALA 548.A O no hydrogen 3.242 N/A VAL 552.A N LEU 549.A O no hydrogen 3.236 N/A GLU 553.A N LEU 549.A O no hydrogen 2.931 N/A THR 554.A OG1 ASP 433.A OD1 no hydrogen 3.188 N/A CYS 555.A N GLU 553.A OE1 no hydrogen 2.814 N/A CYS 555.A SG ASP 433.A O no hydrogen 3.628 N/A HIS 560.A N LYS 556.A O no hydrogen 3.291 N/A HIS 560.A N GLN 557.A O no hydrogen 3.042 N/A LEU 561.A N GLN 557.A O no hydrogen 2.997 N/A PHE 562.A N PHE 558.A O no hydrogen 2.820 N/A SER 563.A N LEU 559.A O no hydrogen 3.061 N/A SER 563.A OG LEU 559.A O no hydrogen 2.694 N/A SER 563.A OG SER 597.A O no hydrogen 3.340 N/A LYS 564.A N HIS 560.A O no hydrogen 2.936 N/A LYS 564.A NZ GLU 444.A OE2 no hydrogen 3.282 N/A MET 565.A N LEU 561.A O no hydrogen 3.082 N/A ILE 566.A N PHE 562.A O no hydrogen 3.032 N/A THR 567.A N SER 563.A O no hydrogen 2.912 N/A THR 567.A OG1 SER 563.A O no hydrogen 2.759 N/A GLU 568.A N LYS 564.A O no hydrogen 2.719 N/A TYR 569.A N MET 565.A O no hydrogen 2.998 N/A TYR 569.A OH SER 472.A O no hydrogen 2.697 N/A TYR 570.A N ILE 566.A O no hydrogen 2.847 N/A TYR 570.A OH HIS 609.A ND1 no hydrogen 3.226 N/A ASP 571.A N THR 567.A O no hydrogen 2.922 N/A ALA 572.A N TYR 569.A O no hydrogen 3.120 N/A GLU 573.A N TYR 570.A O no hydrogen 3.042 N/A LYS 574.A N TYR 569.A O no hydrogen 2.990 N/A LYS 574.A NZ ASP 479.A OD2 no hydrogen 2.953 N/A SER 576.A OG ASP 578.A OD2 no hydrogen 3.213 N/A LEU 581.A N ILE 577.A O no hydrogen 2.739 N/A LEU 582.A N ASP 578.A O no hydrogen 3.172 N/A LYS 583.A N ASN 579.A O no hydrogen 3.016 N/A ALA 584.A N PHE 580.A O no hydrogen 2.826 N/A TYR 585.A N LEU 581.A O no hydrogen 2.711 N/A GLU 586.A N LEU 582.A O no hydrogen 3.010 N/A GLY 587.A N LYS 583.A O no hydrogen 3.245 N/A LEU 588.A N ALA 584.A O no hydrogen 2.887 N/A ALA 589.A N TYR 585.A O no hydrogen 3.028 N/A SER 590.A OG GLU 586.A O no hydrogen 3.344 N/A SER 590.A OG GLY 587.A O no hydrogen 3.270 N/A GLY 591.A N LEU 588.A O no hydrogen 3.146 N/A LYS 592.A N GLY 587.A O no hydrogen 2.773 N/A LEU 596.A N ASP 593.A O no hydrogen 3.010 N/A SER 597.A N GLY 594.A O no hydrogen 3.082 N/A PHE 598.A N PHE 595.A O no hydrogen 3.172 N/A PHE 599.A N PHE 595.A O no hydrogen 3.443 N/A GLU 600.A N LEU 596.A O no hydrogen 3.096 N/A PHE 602.A N PHE 598.A O no hydrogen 2.943 N/A ASN 603.A ND2 GLU 600.A O no hydrogen 3.572 N/A THR 604.A N ASN 603.A OD1 no hydrogen 2.447 N/A ARG 605.A N PHE 602.A O no hydrogen 3.139 N/A ARG 605.A NE PHE 602.A O no hydrogen 3.227 N/A ARG 605.A NH1 ASP 571.A OD1 no hydrogen 2.851 N/A ARG 605.A NH2 VAL 601.A O no hydrogen 3.489 N/A LEU 606.A N ASN 603.A O no hydrogen 3.296 N/A LEU 607.A N THR 604.A O no hydrogen 3.094 N/A HIS 609.A N LEU 606.A O no hydrogen 2.894 N/A HIS 609.A ND1 TYR 570.A OH no hydrogen 3.226 N/A PHE 612.A N HIS 609.A O no hydrogen 3.029 N/A HIS 613.A N SER 610.A O no hydrogen 3.074 N/A LYS 614.A N PHE 611.A O no hydrogen 2.844 N/A ILE 615.A N PHE 612.A O no hydrogen 3.095 N/A ASP 623.A N ASN 620.A O no hydrogen 3.065 N/A PHE 624.A N ARG 621.A O no hydrogen 3.033 N/A PHE 625.A N ARG 621.A O no hydrogen 3.069 N/A SER 626.A N LEU 622.A O no hydrogen 3.071 N/A LYS 627.A N PHE 624.A O no hydrogen 2.842 N/A LYS 627.A NZ ASP 593.A OD2 no hydrogen 3.505 N/A THR 628.A N PHE 625.A O no hydrogen 3.212 N/A THR 628.A OG1 PHE 624.A O no hydrogen 3.534 N/A ILE 629.A N PHE 625.A O no hydrogen 2.798 N/A HIS 630.A NE2 GLU 600.A OE2 no hydrogen 2.938 N/A ILE 631.A N THR 628.A O no hydrogen 2.873 N/A TYR 632.A N ILE 629.A O no hydrogen 3.338 N/A THR 633.A N ILE 629.A O no hydrogen 3.224 N/A THR 633.A OG1 GLY 659.A O no hydrogen 3.204 N/A THR 635.A N TYR 632.A O no hydrogen 3.175 N/A GLN 637.A N THR 635.A OG1 no hydrogen 2.980 N/A LYS 640.A NZ LEU 607.A O no hydrogen 3.406 N/A PHE 643.A N LYS 640.A O no hydrogen 3.348 N/A VAL 644.A N ILE 641.A O no hydrogen 3.329 N/A PHE 645.A N GLY 642.A O no hydrogen 3.159 N/A ASP 646.A N GLY 642.A O no hydrogen 3.450 N/A ALA 648.A N VAL 644.A O no hydrogen 3.041 N/A LEU 649.A N PHE 645.A O no hydrogen 3.414 N/A ARG 650.A N ASP 646.A O no hydrogen 3.283 N/A GLU 651.A N ASP 647.A O no hydrogen 2.989 N/A LYS 652.A N LEU 649.A O no hydrogen 2.500 N/A ASN 653.A N ALA 648.A O no hydrogen 2.738 N/A ILE 657.A N ASN 653.A O no hydrogen 3.079 N/A ILE 657.A N ILE 654.A O no hydrogen 2.732 N/A ASN 658.A N ILE 654.A O no hydrogen 2.839 N/A GLY 659.A N THR 655.A O no hydrogen 3.302 N/A MET 661.A N ASN 658.A O no hydrogen 2.835 N/A ASN 667.A N LEU 664.A O no hydrogen 2.816 N/A PHE 670.A N PHE 666.A O no hydrogen 2.831 N/A VAL 671.A N ASN 667.A O no hydrogen 2.769 N/A ARG 672.A N GLU 668.A O no hydrogen 3.318 N/A ARG 672.A NE GLU 668.A O no hydrogen 3.429 N/A LYS 673.A N PHE 670.A O no hydrogen 2.871 N/A ALA 674.A N PHE 670.A O no hydrogen 2.903 N/A LEU 675.A N VAL 671.A O no hydrogen 3.219 N/A GLU 676.A N LYS 673.A O no hydrogen 2.978 N/A ASP 677.A N ALA 674.A O no hydrogen 3.254 N/A ASP 679.A N ASP 677.A O no hydrogen 3.234 N/A LEU 683.A N ASP 679.A O no hydrogen 3.080 N/A ASP 684.A N VAL 680.A O no hydrogen 3.047 N/A ASP 684.A N GLU 681.A O no hydrogen 3.320 N/A ALA 685.A N LEU 682.A O no hydrogen 2.731 N/A VAL 686.A N LEU 683.A O no hydrogen 3.393 N/A LEU 687.A N LEU 683.A O no hydrogen 3.101 N/A SER 689.A N VAL 686.A O no hydrogen 2.904 N/A SER 689.A OG ASN 658.A OD1 no hydrogen 3.353 N/A GLY 690.A N LEU 687.A O no hydrogen 2.880 N/A SER 693.A OG ASP 691.A OD2 no hydrogen 3.415 N/A SER 693.A OG SER 729.A O no hydrogen 3.418 N/A PHE 694.A N ASP 691.A O no hydrogen 3.230 N/A ASN 695.A N HIS 692.A O no hydrogen 3.048 N/A ASN 695.A ND2 THR 725.A OG1 no hydrogen 2.776 N/A LEU 697.A N PHE 694.A O no hydrogen 2.929 N/A PHE 698.A N ASN 695.A O no hydrogen 2.625 N/A LEU 702.A N PHE 698.A O no hydrogen 3.121 N/A LEU 703.A N VAL 699.A O no hydrogen 3.094 N/A LEU 703.A N LYS 700.A O no hydrogen 3.046 N/A ARG 704.A N LYS 700.A O no hydrogen 3.169 N/A ASN 705.A N PRO 701.A O no hydrogen 3.389 N/A ASN 705.A ND2 SER 715.A OG no hydrogen 3.207 N/A ILE 706.A N LEU 703.A O no hydrogen 2.846 N/A SER 707.A N LEU 703.A O no hydrogen 2.428 N/A GLY 708.A N ARG 704.A O no hydrogen 2.887 N/A ILE 710.A N ASN 705.A O no hydrogen 2.815 N/A SER 715.A N ASP 711.A O no hydrogen 2.875 N/A SER 715.A OG ASP 711.A O no hydrogen 3.195 N/A SER 716.A N ARG 712.A O no hydrogen 3.025 N/A LYS 717.A N GLU 713.A O no hydrogen 2.901 N/A LYS 717.A NZ ASP 684.A OD2 no hydrogen 3.136 N/A VAL 718.A N ALA 714.A O no hydrogen 2.979 N/A LEU 719.A N SER 715.A O no hydrogen 2.841 N/A SER 720.A N SER 716.A O no hydrogen 3.205 N/A SER 720.A N LYS 717.A O no hydrogen 3.143 N/A SER 720.A OG LYS 717.A O no hydrogen 3.064 N/A LYS 721.A N VAL 718.A O no hydrogen 2.677 N/A LYS 721.A NZ ASP 684.A O no hydrogen 2.844 N/A LYS 721.A NZ ASP 684.A OD1 no hydrogen 3.486 N/A VAL 722.A N VAL 718.A O no hydrogen 2.930 N/A VAL 722.A N LEU 719.A O no hydrogen 3.309 N/A ILE 723.A N LEU 719.A O no hydrogen 3.054 N/A THR 725.A N VAL 722.A O no hydrogen 2.863 N/A THR 725.A OG1 VAL 722.A O no hydrogen 3.167 N/A LEU 726.A N ILE 723.A O no hydrogen 3.143 N/A ASN 731.A ND2 ASP 691.A OD1 no hydrogen 3.246 N/A LYS 733.A N ASN 731.A OD1 no hydrogen 2.842 N/A SER 735.A N GLU 668.A OE2 no hydrogen 2.790 N/A ASP 737.A N SER 735.A OG no hydrogen 3.039 N/A LEU 738.A N SER 735.A O no hydrogen 2.762 N/A LEU 739.A N SER 735.A O no hydrogen 3.255 N/A GLU 740.A N ASP 737.A O no hydrogen 3.154 N/A MET 741.A N LEU 738.A O no hydrogen 3.367 N/A ILE 742.A N LEU 738.A O no hydrogen 2.880 N/A GLU 743.A N LEU 739.A O no hydrogen 2.989 N/A GLU 745.A N MET 741.A O no hydrogen 2.837 N/A LYS 747.A N GLU 743.A O no hydrogen 2.854 N/A SER 748.A N ARG 744.A O no hydrogen 3.364 N/A SER 748.A OG GLU 745.A O no hydrogen 3.270 N/A LEU 749.A N GLU 745.A O no hydrogen 3.199 N/A GLU 750.A N LYS 747.A O no hydrogen 2.698 N/A SER 751.A N LYS 747.A O no hydrogen 3.148 N/A