Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5gwi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 8.A OD2 no hydrogen 3.079 N/A LYS 5.A NZ ASP 28.A OD1 no hydrogen 3.339 N/A ASP 7.A N VAL 48.A O no hydrogen 3.093 N/A ALA 9.A N TYR 98.A OH no hydrogen 3.005 N/A ASN 10.A N ARG 43.A O no hydrogen 3.087 N/A ASN 10.A ND2 ASP 44.A OD1 no hydrogen 3.373 N/A ASP 11.A N ASP 44.A O no hydrogen 3.053 N/A ALA 12.A N ALA 9.A O no hydrogen 3.340 N/A GLY 14.A N ASP 11.A O no hydrogen 3.479 N/A SER 17.A OG GLY 14.A O no hydrogen 2.777 N/A GLU 19.A N HIS 16.A O no hydrogen 3.200 N/A CYS 20.A N SER 17.A O no hydrogen 3.124 N/A CYS 20.A SG HIS 16.A O no hydrogen 3.192 N/A THR 21.A N ARG 45.A O no hydrogen 3.216 N/A LEU 22.A N LYS 100.A O no hydrogen 2.761 N/A ILE 23.A N GLY 47.A O no hydrogen 2.500 N/A LEU 24.A N MET 102.A O no hydrogen 2.995 N/A THR 25.A N PHE 49.A O no hydrogen 2.963 N/A THR 25.A OG1 GLY 27.A O no hydrogen 3.097 N/A THR 25.A OG1 PHE 49.A O no hydrogen 3.517 N/A LYS 31.A N GLY 27.A O no hydrogen 3.287 N/A LYS 31.A NZ ASP 7.A OD1 no hydrogen 2.970 N/A SER 32.A N ASP 28.A O no hydrogen 3.063 N/A LEU 33.A N SER 29.A O no hydrogen 3.399 N/A ALA 34.A N ALA 30.A O no hydrogen 3.054 N/A ALA 34.A N LYS 31.A O no hydrogen 3.112 N/A VAL 35.A N LYS 31.A O no hydrogen 3.150 N/A SER 36.A N SER 32.A O no hydrogen 3.476 N/A SER 36.A OG SER 32.A O no hydrogen 3.205 N/A SER 36.A OG LEU 33.A O no hydrogen 3.299 N/A GLY 37.A N LEU 33.A O no hydrogen 3.258 N/A LEU 38.A N ALA 34.A O no hydrogen 3.076 N/A GLY 42.A N LEU 38.A O no hydrogen 2.958 N/A GLY 47.A N THR 21.A O no hydrogen 3.000 N/A VAL 48.A N ASP 7.A O no hydrogen 3.223 N/A PHE 49.A N ILE 23.A O no hydrogen 2.844 N/A LEU 51.A N THR 25.A O no hydrogen 2.836 N/A ARG 52.A N GLU 71.A OE2 no hydrogen 2.662 N/A LYS 54.A NZ ASP 110.A OD1 no hydrogen 3.294 N/A LYS 54.A NZ HIS 113.A ND1 no hydrogen 3.106 N/A ASN 57.A ND2 PHE 172.A O no hydrogen 2.982 N/A ARG 59.A N ASN 57.A OD1 no hydrogen 3.470 N/A ARG 59.A NE ASN 120.A OD1 no hydrogen 2.791 N/A ARG 59.A NH2 ASN 120.A OD1 no hydrogen 2.671 N/A ARG 59.A NH2 HIS 123.A ND1 no hydrogen 3.245 N/A LYS 64.A NZ GLU 68.A OE1 no hydrogen 2.757 N/A LYS 64.A NZ GLU 68.A OE2 no hydrogen 3.220 N/A GLN 65.A N SER 62.A OG no hydrogen 3.219 N/A ILE 66.A N SER 62.A O no hydrogen 3.200 N/A MET 67.A N HIS 63.A O no hydrogen 3.392 N/A GLU 68.A N LYS 64.A O no hydrogen 3.313 N/A ASN 69.A N ILE 66.A O no hydrogen 3.409 N/A ILE 72.A N ASN 69.A OD1 no hydrogen 2.755 N/A ASN 73.A N ASN 69.A O no hydrogen 3.118 N/A ASN 73.A ND2 MET 67.A O no hydrogen 2.802 N/A ASN 74.A N ALA 70.A O no hydrogen 3.162 N/A ILE 75.A N GLU 71.A O no hydrogen 3.456 N/A ILE 76.A N ILE 72.A O no hydrogen 3.087 N/A LYS 77.A N ASN 73.A O no hydrogen 3.197 N/A ILE 78.A N ASN 74.A O no hydrogen 3.010 N/A VAL 79.A N ILE 75.A O no hydrogen 3.120 N/A GLY 80.A N ILE 76.A O no hydrogen 2.696 N/A LEU 81.A N ILE 76.A O no hydrogen 3.048 N/A LYS 85.A NZ THR 95.A OG1 no hydrogen 2.755 N/A SER 86.A OG ASP 88.A OD2 no hydrogen 3.530 N/A TYR 87.A N SER 128.A OG no hydrogen 2.944 N/A SER 92.A OG SER 86.A O no hydrogen 3.543 N/A LYS 94.A NZ ALA 90.A O no hydrogen 2.977 N/A LYS 94.A NZ GLU 91.A O no hydrogen 2.973 N/A THR 95.A OG1 SER 92.A O no hydrogen 2.947 N/A ARG 97.A N VAL 79.A O no hydrogen 2.721 N/A ARG 97.A NE ILE 78.A O no hydrogen 2.691 N/A ARG 97.A NH1 ASP 8.A OD2 no hydrogen 3.341 N/A ARG 97.A NH2 ASP 8.A OD1 no hydrogen 3.387 N/A ARG 97.A NH2 ASP 8.A OD2 no hydrogen 3.401 N/A ARG 97.A NH2 ILE 78.A O no hydrogen 2.925 N/A TYR 98.A OH ASP 8.A OD1 no hydrogen 2.277 N/A GLY 99.A N CYS 20.A O no hydrogen 2.901 N/A LYS 100.A N CYS 20.A O no hydrogen 3.190 N/A ILE 101.A N PHE 134.A O no hydrogen 2.958 N/A MET 102.A N LEU 22.A O no hydrogen 2.773 N/A ILE 103.A N GLU 136.A O no hydrogen 2.718 N/A MET 104.A N LEU 24.A O no hydrogen 2.961 N/A THR 105.A OG1 ASP 106.A O no hydrogen 3.235 N/A THR 105.A OG1 GLY 111.A O no hydrogen 3.299 N/A ASP 106.A N GLU 26.A OE1 no hydrogen 2.669 N/A GLN 109.A N GLN 109.A OE1 no hydrogen 2.491 N/A GLY 111.A N ASP 108.A OD1 no hydrogen 2.868 N/A SER 112.A N ASP 108.A O no hydrogen 3.355 N/A SER 112.A OG ASP 108.A O no hydrogen 3.383 N/A SER 112.A OG GLU 211.A OE2 no hydrogen 3.037 N/A HIS 113.A N GLN 109.A O no hydrogen 3.130 N/A ILE 114.A N ASP 110.A O no hydrogen 3.217 N/A LYS 115.A N GLY 111.A O no hydrogen 3.121 N/A LYS 115.A NZ GLU 137.A OE1 no hydrogen 2.722 N/A LYS 115.A NZ GLU 211.A OE2 no hydrogen 3.303 N/A GLY 116.A N SER 112.A O no hydrogen 3.014 N/A LEU 117.A N HIS 113.A O no hydrogen 2.916 N/A LEU 118.A N ILE 114.A O no hydrogen 3.006 N/A ILE 119.A N LYS 115.A O no hydrogen 2.805 N/A ASN 120.A N GLY 116.A O no hydrogen 2.625 N/A PHE 121.A N LEU 117.A O no hydrogen 2.907 N/A ILE 122.A N LEU 118.A O no hydrogen 3.068 N/A HIS 123.A N ILE 119.A O no hydrogen 2.824 N/A HIS 123.A NE2 ASP 165.A OD1 no hydrogen 2.708 N/A HIS 124.A N ASN 120.A O no hydrogen 3.163 N/A TRP 126.A N ILE 122.A O no hydrogen 2.808 N/A TRP 126.A NE1 GLN 82.A O no hydrogen 2.589 N/A LEU 129.A N TRP 126.A O no hydrogen 3.315 N/A LEU 130.A N PRO 127.A O no hydrogen 3.172 N/A LYS 131.A NZ TYR 87.A O no hydrogen 3.370 N/A LYS 131.A NZ ASP 88.A O no hydrogen 3.138 N/A LYS 131.A NZ SER 128.A O no hydrogen 3.083 N/A LYS 131.A NZ HIS 132.A NE2 no hydrogen 3.336 N/A GLY 133.A N LEU 130.A O no hydrogen 3.144 N/A GLU 136.A N ILE 101.A O no hydrogen 2.769 N/A GLU 137.A N ILE 155.A O no hydrogen 2.915 N/A PHE 138.A N ILE 103.A O no hydrogen 2.929 N/A ILE 139.A N HIS 153.A O no hydrogen 3.029 N/A LYS 144.A N LYS 141.A O no hydrogen 3.337 N/A GLU 145.A N GLU 142.A O no hydrogen 3.138 N/A TYR 146.A N GLU 142.A O no hydrogen 3.247 N/A PHE 147.A N ALA 143.A O no hydrogen 3.055 N/A ALA 148.A N LYS 144.A O no hydrogen 3.239 N/A ASP 149.A N GLU 145.A O no hydrogen 3.337 N/A ARG 152.A N ASP 149.A O no hydrogen 3.282 N/A HIS 153.A N MET 150.A O no hydrogen 2.889 N/A HIS 153.A ND1 ASP 149.A O no hydrogen 2.662 N/A ARG 154.A NE GLU 136.A OE1 no hydrogen 2.928 N/A ARG 154.A NH2 GLU 136.A OE1 no hydrogen 3.344 N/A ARG 154.A NH2 GLU 136.A OE2 no hydrogen 2.576 N/A ILE 155.A N GLU 137.A O no hydrogen 3.141 N/A LEU 156.A N LYS 200.A O no hydrogen 3.231 N/A PHE 157.A N LEU 135.A O no hydrogen 3.351 N/A ARG 158.A N LEU 202.A O no hydrogen 2.990 N/A TYR 159.A OH ASP 165.A OD2 no hydrogen 2.428 N/A ALA 160.A N ASP 164.A OD2 no hydrogen 2.467 N/A GLU 163.A N GLU 163.A OE2 no hydrogen 2.515 N/A ASP 164.A N GLY 161.A O no hydrogen 3.144 N/A ALA 166.A N PRO 162.A O no hydrogen 3.179 N/A ALA 167.A N GLU 163.A O no hydrogen 3.185 N/A ILE 168.A N ASP 164.A O no hydrogen 3.112 N/A THR 169.A N ASP 165.A O no hydrogen 3.039 N/A THR 169.A OG1 ASP 165.A O no hydrogen 2.723 N/A LEU 170.A N ALA 166.A O no hydrogen 2.718 N/A ALA 171.A N ILE 168.A O no hydrogen 3.213 N/A PHE 172.A N ILE 168.A O no hydrogen 3.250 N/A SER 173.A N THR 169.A O no hydrogen 3.094 N/A SER 173.A OG GLU 60.A OE2 no hydrogen 2.894 N/A LYS 175.A N SER 173.A OG no hydrogen 3.386 N/A LYS 176.A N SER 173.A O no hydrogen 3.171 N/A ARG 180.A N LYS 176.A O no hydrogen 3.043 N/A ARG 180.A NH1 LEU 170.A O no hydrogen 3.086 N/A ARG 180.A NH1 SER 173.A O no hydrogen 2.734 N/A ARG 180.A NH2 SER 173.A O no hydrogen 3.007 N/A LYS 181.A N ILE 177.A O no hydrogen 3.242 N/A LYS 181.A NZ GLY 368.A O no hydrogen 3.085 N/A GLU 182.A N ASP 178.A O no hydrogen 3.439 N/A TRP 183.A N ASP 179.A O no hydrogen 2.828 N/A TRP 183.A NE1 ASN 209.A OD1 no hydrogen 2.992 N/A LEU 184.A N ARG 180.A O no hydrogen 2.811 N/A THR 185.A N LYS 181.A O no hydrogen 2.658 N/A THR 185.A OG1 LYS 181.A O no hydrogen 2.586 N/A ASN 186.A N GLU 182.A O no hydrogen 3.001 N/A MET 188.A N LEU 184.A O no hydrogen 2.927 N/A GLU 189.A N THR 185.A O no hydrogen 2.969 N/A ASP 190.A N ASN 186.A O no hydrogen 2.910 N/A ARG 191.A N PHE 187.A O no hydrogen 2.750 N/A ARG 191.A NH1 GLU 221.A OE1 no hydrogen 3.222 N/A ARG 192.A N MET 188.A O no hydrogen 3.371 N/A GLN 193.A N GLU 189.A O no hydrogen 3.091 N/A ARG 194.A N ARG 191.A O no hydrogen 3.326 N/A HIS 197.A N ARG 194.A O no hydrogen 2.903 N/A LEU 202.A N LEU 156.A O no hydrogen 2.898 N/A THR 203.A OG1 ASP 206.A OD2 no hydrogen 3.513 N/A ASN 205.A N ASP 164.A OD1 no hydrogen 3.005 N/A ASN 205.A ND2 GLU 163.A O no hydrogen 3.290 N/A PHE 207.A N THR 203.A O no hydrogen 2.961 N/A ILE 208.A N TYR 204.A O no hydrogen 3.018 N/A ASN 209.A N ASN 205.A O no hydrogen 3.080 N/A ASN 209.A ND2 ASN 205.A O no hydrogen 2.702 N/A LYS 210.A NZ ASP 206.A OD1 no hydrogen 3.267 N/A GLU 211.A N PHE 207.A O no hydrogen 3.008 N/A LEU 212.A N PHE 207.A O no hydrogen 2.856 N/A ILE 213.A N ILE 208.A O no hydrogen 3.170 N/A LEU 214.A N GLU 211.A O no hydrogen 3.213 N/A PHE 215.A N LEU 212.A O no hydrogen 2.975 N/A SER 216.A N LEU 212.A O no hydrogen 3.158 N/A ASN 217.A N ILE 213.A O no hydrogen 3.065 N/A ASN 217.A ND2 GLU 221.A OE1 no hydrogen 2.863 N/A SER 218.A N LEU 214.A O no hydrogen 3.056 N/A SER 218.A OG.A LEU 214.A O no hydrogen 2.878 N/A ASP 219.A N PHE 215.A O no hydrogen 2.524 N/A ASN 220.A N SER 216.A O no hydrogen 3.321 N/A ASN 220.A ND2 THR 367.A O no hydrogen 2.791 N/A GLU 221.A N ASN 217.A O no hydrogen 3.086 N/A ARG 222.A N SER 218.A O no hydrogen 3.011 N/A ARG 222.A NH1 ASP 110.A OD1 no hydrogen 3.474 N/A ARG 222.A NH2 ASP 110.A OD1 no hydrogen 3.255 N/A ARG 222.A NH2 ASP 110.A OD2 no hydrogen 2.619 N/A SER 223.A N ASN 220.A O no hydrogen 3.302 N/A SER 223.A OG ASP 219.A O no hydrogen 3.068 N/A SER 223.A OG ASP 219.A OD1 no hydrogen 3.400 N/A SER 223.A OG ILE 365.A O no hydrogen 3.285 N/A ILE 224.A N ASN 220.A O no hydrogen 2.846 N/A SER 226.A N PHE 231.A O no hydrogen 2.981 N/A LEU 227.A N PHE 512.A O no hydrogen 2.851 N/A VAL 228.A N SER 226.A OG no hydrogen 3.294 N/A GLY 230.A N SER 226.A O no hydrogen 2.947 N/A PHE 231.A N ASP 229.A OD1 no hydrogen 2.921 N/A LYS 232.A N GLN 235.A OE1 no hydrogen 3.059 N/A LYS 232.A NZ GLU 363.A O no hydrogen 2.636 N/A ARG 236.A N LYS 232.A O no hydrogen 2.787 N/A ARG 236.A NE ASP 229.A OD2 no hydrogen 2.807 N/A ARG 236.A NH2 ASP 229.A OD1 no hydrogen 3.059 N/A ARG 236.A NH2 ASP 229.A OD2 no hydrogen 3.235 N/A LYS 237.A N PRO 233.A O no hydrogen 3.156 N/A LYS 237.A NZ SER 264.A O no hydrogen 2.759 N/A LYS 237.A NZ GLU 346.A OE1 no hydrogen 2.899 N/A VAL 238.A N GLY 234.A O no hydrogen 3.415 N/A LEU 239.A N GLN 235.A O no hydrogen 3.249 N/A PHE 240.A N ARG 236.A O no hydrogen 2.982 N/A THR 241.A N LYS 237.A O no hydrogen 3.101 N/A THR 241.A OG1 LYS 237.A O no hydrogen 3.086 N/A CYS 242.A N VAL 238.A O no hydrogen 3.012 N/A CYS 242.A SG VAL 238.A O no hydrogen 3.239 N/A PHE 243.A N LEU 239.A O no hydrogen 2.923 N/A LYS 244.A N PHE 240.A O no hydrogen 2.880 N/A ARG 245.A N THR 241.A O no hydrogen 2.818 N/A ARG 245.A NE ASP 247.A OD1 no hydrogen 3.043 N/A ARG 245.A NH1 SER 259.A OG no hydrogen 3.376 N/A ARG 245.A NH2 ASP 247.A OD1 no hydrogen 3.140 N/A ASN 246.A N CYS 242.A O no hydrogen 2.970 N/A VAL 251.A N THR 317.A O no hydrogen 3.207 N/A VAL 253.A N ILE 315.A O no hydrogen 3.062 N/A ALA 254.A N PRO 312.A O no hydrogen 3.201 N/A LEU 256.A N LYS 252.A O no hydrogen 2.811 N/A ALA 257.A N VAL 253.A O no hydrogen 2.822 N/A GLY 258.A N ALA 254.A O no hydrogen 3.235 N/A SER 259.A N GLN 255.A O no hydrogen 3.197 N/A VAL 260.A N LEU 256.A O no hydrogen 2.896 N/A ALA 261.A N ALA 257.A O no hydrogen 3.233 N/A GLU 262.A N GLY 258.A O no hydrogen 3.422 N/A MET 263.A N SER 259.A O no hydrogen 3.036 N/A SER 264.A N VAL 260.A O no hydrogen 2.893 N/A SER 264.A OG VAL 260.A O no hydrogen 2.346 N/A TYR 266.A N ALA 261.A O no hydrogen 3.322 N/A HIS 267.A NE2 ASP 340.A OD2 no hydrogen 2.902 N/A MET 274.A N GLU 270.A O no hydrogen 2.746 N/A MET 275.A N GLN 271.A O no hydrogen 3.017 N/A THR 276.A N ALA 272.A O no hydrogen 3.147 N/A THR 276.A OG1 LEU 273.A O no hydrogen 2.558 N/A ILE 277.A N LEU 273.A O no hydrogen 3.197 N/A VAL 278.A N MET 274.A O no hydrogen 3.219 N/A ASN 279.A N MET 275.A O no hydrogen 2.965 N/A LEU 280.A N THR 276.A O no hydrogen 2.730 N/A ALA 281.A N VAL 278.A O no hydrogen 3.135 N/A GLN 282.A N VAL 278.A O no hydrogen 3.182 N/A GLN 282.A NE2 PHE 299.A O no hydrogen 3.286 N/A SER 287.A N PHE 284.A O no hydrogen 3.090 N/A SER 287.A OG PHE 284.A O no hydrogen 2.728 N/A ASN 288.A ND2 ASN 279.A O no hydrogen 3.052 N/A ASN 288.A ND2 GLN 282.A O no hydrogen 2.696 N/A ASN 289.A ND2 TYR 376.A O no hydrogen 2.944 N/A ASN 289.A ND2 ASN 400.A O no hydrogen 2.876 N/A ILE 290.A N ASN 360.A OD1 no hydrogen 2.899 N/A ASN 291.A ND2 LEU 293.A O no hydrogen 2.790 N/A GLN 294.A N MET 318.A O no hydrogen 2.635 N/A GLN 294.A NE2 LEU 319.A O no hydrogen 3.022 N/A ILE 296.A N PHE 316.A O no hydrogen 3.141 N/A GLY 300.A N GLN 298.A OE1 no hydrogen 3.099 N/A THR 301.A N ASP 308.A OD1 no hydrogen 3.047 N/A THR 301.A OG1 ASP 308.A OD2 no hydrogen 2.783 N/A ARG 302.A NH1 THR 473.A O no hydrogen 2.732 N/A ARG 302.A NH2 GLU 434.A OE1 no hydrogen 2.692 N/A LEU 303.A N THR 301.A OG1 no hydrogen 3.236 N/A GLY 306.A N THR 301.A O no hydrogen 3.098 N/A LYS 307.A N HIS 304.A O no hydrogen 3.405 N/A ALA 309.A N GLY 306.A O no hydrogen 3.272 N/A ALA 310.A N GLN 298.A O no hydrogen 2.893 N/A TYR 314.A N SER 311.A O no hydrogen 3.036 N/A PHE 316.A N ILE 296.A O no hydrogen 2.784 N/A THR 317.A N VAL 251.A O no hydrogen 2.877 N/A THR 317.A OG1 GLN 294.A O no hydrogen 2.739 N/A SER 320.A N LEU 292.A O no hydrogen 2.948 N/A THR 321.A OG1 GLU 660.A OE1 no hydrogen 3.207 N/A LEU 322.A N SER 320.A OG no hydrogen 3.274 N/A ALA 323.A N SER 320.A O no hydrogen 3.079 N/A LEU 326.A N LEU 322.A O no hydrogen 2.889 N/A PHE 327.A N ALA 323.A O no hydrogen 2.811 N/A ASP 331.A N PRO 328.A O no hydrogen 3.110 N/A ASP 332.A N ALA 329.A O no hydrogen 3.102 N/A ASN 333.A N VAL 330.A O no hydrogen 3.442 N/A ASN 333.A ND2 VAL 330.A O no hydrogen 2.986 N/A LEU 334.A N ASP 331.A O no hydrogen 3.068 N/A LEU 335.A N ASP 332.A O no hydrogen 3.363 N/A LYS 336.A NZ GLU 348.A OE2 no hydrogen 3.523 N/A LEU 338.A N GLU 346.A O no hydrogen 2.378 N/A ASP 340.A N GLN 343.A O no hydrogen 2.846 N/A GLN 343.A NE2 GLU 262.A O no hydrogen 3.181 N/A VAL 345.A N LEU 338.A O no hydrogen 2.997 N/A GLU 348.A N LYS 336.A O no hydrogen 2.976 N/A TRP 349.A NE1 HIS 514.A O no hydrogen 3.227 N/A TYR 350.A N ASP 229.A OD2 no hydrogen 2.745 N/A ILE 353.A N LEU 326.A O no hydrogen 2.993 N/A LEU 358.A N PRO 355.A O no hydrogen 3.160 N/A ILE 359.A N MET 356.A O no hydrogen 3.249 N/A ASN 360.A ND2 ILE 290.A O no hydrogen 3.023 N/A ALA 362.A N VAL 357.A O no hydrogen 3.429 N/A GLY 364.A N CYS 371.A O no hydrogen 2.938 N/A GLY 366.A N TRP 369.A O no hydrogen 3.361 N/A THR 367.A N ASN 220.A OD1 no hydrogen 2.604 N/A THR 367.A OG1 ASP 219.A OD2 no hydrogen 2.967 N/A CYS 371.A N GLY 364.A O no hydrogen 2.766 N/A CYS 371.A SG ALA 362.A O no hydrogen 3.773 N/A CYS 371.A SG VAL 510.A O no hydrogen 3.165 N/A LYS 372.A N SER 508.A O no hydrogen 3.286 N/A ASN 375.A N TYR 401.A OH no hydrogen 3.497 N/A ASN 375.A ND2 SER 287.A O no hydrogen 2.780 N/A ASN 375.A ND2 ASN 289.A OD1 no hydrogen 3.016 N/A ARG 379.A NE ASP 662.A OD1 no hydrogen 3.245 N/A ARG 379.A NH1 GLU 665.A OE1 no hydrogen 2.678 N/A ARG 379.A NH1 GLU 665.A OE2 no hydrogen 3.539 N/A ARG 379.A NH2 ASP 662.A OD1 no hydrogen 2.648 N/A ARG 379.A NH2 GLU 665.A OE1 no hydrogen 2.816 N/A GLU 380.A N ASP 377.A OD2 no hydrogen 2.804 N/A ILE 381.A N ASP 377.A O no hydrogen 3.061 N/A VAL 382.A N ALA 378.A O no hydrogen 2.881 N/A ASN 383.A N ARG 379.A O no hydrogen 2.988 N/A ASN 384.A N GLU 380.A O no hydrogen 3.159 N/A ASN 384.A ND2 HIS 395.A O no hydrogen 3.441 N/A VAL 385.A N ILE 381.A O no hydrogen 3.032 N/A ARG 386.A N VAL 382.A O no hydrogen 2.942 N/A ARG 387.A N ASN 383.A O no hydrogen 2.936 N/A ARG 387.A NE ASP 393.A O no hydrogen 3.055 N/A ARG 387.A NH2 ASP 393.A O no hydrogen 3.024 N/A MET 388.A N ASN 384.A O no hydrogen 2.942 N/A LEU 389.A N VAL 385.A O no hydrogen 3.031 N/A ASP 390.A N ARG 387.A O no hydrogen 3.134 N/A GLY 391.A N MET 388.A O no hydrogen 3.361 N/A LEU 392.A N ARG 387.A O no hydrogen 2.977 N/A HIS 395.A N ASN 384.A OD1 no hydrogen 2.783 N/A ASN 400.A N ASN 375.A O no hydrogen 2.718 N/A LYS 402.A N ASN 289.A OD1 no hydrogen 3.195 N/A LYS 402.A NZ ASN 289.A O no hydrogen 3.388 N/A LYS 402.A NZ GLU 668.A OE1 no hydrogen 3.458 N/A PHE 404.A N TYR 401.A O no hydrogen 3.233 N/A LYS 405.A N GLU 434.A OE2 no hydrogen 2.801 N/A LYS 405.A NZ THR 433.A O no hydrogen 3.234 N/A THR 407.A N SER 419.A O no hydrogen 3.182 N/A GLN 409.A N ALA 417.A O no hydrogen 2.988 N/A LEU 411.A N GLN 415.A O no hydrogen 3.014 N/A GLY 412.A N GLN 415.A O no hydrogen 3.167 N/A ASN 414.A ND2 ASN 507.A OD1 no hydrogen 3.320 N/A ASN 414.A ND2 GLU 522.A O no hydrogen 2.746 N/A GLN 415.A N GLY 412.A O no hydrogen 3.317 N/A TYR 416.A N LEU 504.A O no hydrogen 2.695 N/A ALA 417.A N GLN 409.A O no hydrogen 2.751 N/A VAL 418.A N THR 502.A O no hydrogen 2.832 N/A SER 419.A N THR 407.A O no hydrogen 2.995 N/A GLY 420.A N LEU 500.A O no hydrogen 2.729 N/A GLU 421.A N GLU 434.A O no hydrogen 3.010 N/A PHE 423.A N GLU 431.A O no hydrogen 3.148 N/A VAL 425.A N THR 429.A O no hydrogen 2.990 N/A ASP 426.A N THR 429.A O no hydrogen 3.404 N/A ASN 428.A N ASP 426.A OD1 no hydrogen 2.714 N/A THR 429.A N ASP 426.A O no hydrogen 3.409 N/A THR 429.A OG1 ASP 426.A OD1 no hydrogen 3.004 N/A THR 429.A OG1 ASP 426.A OD2 no hydrogen 3.401 N/A VAL 430.A N VAL 479.A O no hydrogen 2.994 N/A GLU 431.A N PHE 423.A O no hydrogen 3.014 N/A ILE 432.A N PHE 477.A O no hydrogen 2.831 N/A THR 433.A N GLU 421.A O no hydrogen 3.213 N/A THR 433.A OG1 GLU 421.A OE2 no hydrogen 3.107 N/A LEU 435.A N GLU 434.A OE1 no hydrogen 2.962 N/A THR 439.A N PRO 436.A O no hydrogen 3.046 N/A THR 441.A N ARG 302.A O no hydrogen 3.128 N/A GLN 442.A N LEU 303.A O no hydrogen 2.859 N/A GLN 442.A NE2 GLU 446.A OE1 no hydrogen 2.730 N/A TYR 444.A N TRP 440.A O no hydrogen 2.871 N/A TYR 444.A OH PHE 498.A O no hydrogen 2.461 N/A LYS 445.A N THR 441.A O no hydrogen 2.920 N/A LYS 445.A NZ GLU 468.A OE2 no hydrogen 2.854 N/A GLU 446.A N GLN 442.A O no hydrogen 3.035 N/A GLN 447.A N VAL 443.A O no hydrogen 2.946 N/A VAL 448.A N TYR 444.A O no hydrogen 3.071 N/A LEU 449.A N TYR 444.A O no hydrogen 3.281 N/A GLU 450.A N LYS 445.A O no hydrogen 2.908 N/A MET 452.A N VAL 448.A O no hydrogen 3.164 N/A LEU 453.A N LEU 449.A O no hydrogen 2.874 N/A LEU 453.A N GLU 450.A O no hydrogen 3.151 N/A ASN 454.A N GLU 450.A O no hydrogen 2.962 N/A GLY 455.A N PRO 451.A O no hydrogen 2.766 N/A THR 456.A N THR 459.A O no hydrogen 2.886 N/A THR 456.A OG1 THR 459.A O no hydrogen 3.399 N/A THR 456.A OG1 THR 459.A OG1 no hydrogen 2.666 N/A LYS 458.A N THR 456.A OG1 no hydrogen 3.352 N/A THR 459.A N THR 456.A OG1 no hydrogen 2.905 N/A THR 459.A OG1 THR 456.A OG1 no hydrogen 2.666 N/A LEU 462.A N MET 452.A O no hydrogen 2.801 N/A ILE 463.A N MET 452.A O no hydrogen 3.218 N/A SER 464.A N LYS 480.A O no hydrogen 2.732 N/A ASP 465.A N LYS 480.A O no hydrogen 3.402 N/A TYR 466.A N ASP 465.A OD1 no hydrogen 2.784 N/A TYR 466.A OH GLU 450.A OE1 no hydrogen 2.252 N/A LYS 467.A N VAL 478.A O no hydrogen 2.817 N/A LYS 467.A NZ ASP 465.A OD2 no hydrogen 2.306 N/A TYR 469.A N LYS 476.A O no hydrogen 2.974 N/A THR 471.A N THR 474.A O no hydrogen 3.349 N/A THR 471.A OG1 THR 474.A OG1 no hydrogen 2.322 N/A THR 473.A N THR 471.A OG1 no hydrogen 3.336 N/A THR 474.A N THR 471.A OG1 no hydrogen 2.990 N/A THR 474.A OG1 THR 471.A OG1 no hydrogen 2.322 N/A LYS 476.A N HIS 470.A ND1 no hydrogen 3.018 N/A PHE 477.A N ILE 432.A O no hydrogen 2.776 N/A VAL 478.A N LYS 467.A O no hydrogen 3.127 N/A VAL 479.A N VAL 430.A O no hydrogen 2.904 N/A LYS 480.A N ASP 465.A O no hydrogen 2.563 N/A LYS 480.A NZ THR 429.A OG1 no hydrogen 2.605 N/A MET 481.A N ASN 428.A O no hydrogen 2.829 N/A LYS 485.A N THR 482.A OG1 no hydrogen 3.242 N/A LEU 486.A N THR 482.A O no hydrogen 2.966 N/A ALA 487.A N GLU 483.A O no hydrogen 3.200 N/A GLN 488.A N GLU 484.A O no hydrogen 3.239 N/A ALA 489.A N LYS 485.A O no hydrogen 3.061 N/A GLU 490.A N LEU 486.A O no hydrogen 3.004 N/A ALA 491.A N ALA 487.A O no hydrogen 3.160 N/A ALA 492.A N GLN 488.A O no hydrogen 3.214 N/A GLY 493.A N GLU 490.A O no hydrogen 3.347 N/A VAL 497.A N GLY 493.A O no hydrogen 2.875 N/A PHE 498.A N LEU 494.A O no hydrogen 3.071 N/A LYS 499.A N LYS 496.A O no hydrogen 3.405 N/A LEU 500.A N HIS 495.A O no hydrogen 2.936 N/A THR 502.A N VAL 418.A O no hydrogen 2.791 N/A LEU 504.A N TYR 416.A O no hydrogen 2.775 N/A CYS 506.A N ASN 414.A O no hydrogen 2.794 N/A SER 508.A OG ALA 370.A O no hydrogen 2.462 N/A LEU 511.A N LYS 519.A O no hydrogen 2.949 N/A PHE 512.A N PRO 225.A O no hydrogen 3.193 N/A ASP 513.A N CYS 517.A O no hydrogen 2.904 N/A GLY 516.A N ASP 513.A O no hydrogen 3.212 N/A CYS 517.A N ASP 513.A OD1 no hydrogen 2.540 N/A LYS 519.A N LEU 511.A O no hydrogen 2.877 N/A LYS 520.A NZ ASN 507.A O no hydrogen 2.344 N/A TYR 521.A N MET 509.A O no hydrogen 2.850 N/A TYR 521.A OH GLU 530.A OE1 no hydrogen 3.007 N/A TYR 521.A OH GLU 530.A OE2 no hydrogen 3.185 N/A GLN 525.A NE2.A HIS 395.A O no hydrogen 3.559 N/A ASP 526.A N THR 523.A OG1 no hydrogen 3.399 N/A LEU 528.A N VAL 524.A O no hydrogen 2.961 N/A LYS 529.A N GLN 525.A O no hydrogen 2.949 N/A LYS 529.A NZ ASP 533.A OD1 no hydrogen 3.313 N/A GLU 530.A N ASP 526.A O no hydrogen 3.162 N/A PHE 531.A N ILE 527.A O no hydrogen 3.094 N/A PHE 532.A N LEU 528.A O no hydrogen 2.942 N/A ASP 533.A N LYS 529.A O no hydrogen 3.179 N/A LEU 534.A N GLU 530.A O no hydrogen 3.485 N/A ARG 535.A N PHE 531.A O no hydrogen 2.903 N/A ARG 535.A NE ARG 535.A O no hydrogen 2.824 N/A ARG 535.A NH1 ASP 331.A OD2 no hydrogen 2.965 N/A ARG 535.A NH2 ASP 331.A OD1 no hydrogen 3.448 N/A LEU 536.A N PHE 532.A O no hydrogen 2.875 N/A SER 537.A N ASP 533.A O no hydrogen 3.108 N/A TYR 538.A N LEU 534.A O no hydrogen 3.027 N/A TYR 539.A N ARG 535.A O no hydrogen 3.043 N/A TYR 539.A OH ASP 653.A OD2 no hydrogen 2.655 N/A GLY 540.A N LEU 536.A O no hydrogen 3.387 N/A LEU 541.A N SER 537.A O no hydrogen 3.230 N/A ARG 542.A N TYR 538.A O no hydrogen 2.810 N/A ARG 542.A NE ASP 331.A OD1 no hydrogen 2.850 N/A ARG 542.A NH1 ASP 653.A OD2 no hydrogen 2.731 N/A ARG 542.A NH2 ASP 331.A OD1 no hydrogen 3.161 N/A ARG 542.A NH2 ASP 331.A OD2 no hydrogen 2.618 N/A ARG 542.A NH2 ASP 653.A OD2 no hydrogen 3.114 N/A LYS 543.A N TYR 539.A O no hydrogen 3.196 N/A LYS 543.A NZ LYS 642.A O no hydrogen 3.262 N/A LYS 543.A NZ LYS 644.A O no hydrogen 2.885 N/A GLU 544.A N GLY 540.A O no hydrogen 3.006 N/A TRP 545.A N LEU 541.A O no hydrogen 2.862 N/A LEU 546.A N ARG 542.A O no hydrogen 2.683 N/A VAL 547.A N LYS 543.A O no hydrogen 2.804 N/A MET 549.A N TRP 545.A O no hydrogen 2.963 N/A LEU 550.A N LEU 546.A O no hydrogen 2.874 N/A GLY 551.A N VAL 547.A O no hydrogen 2.985 N/A ALA 552.A N GLY 548.A O no hydrogen 2.905 N/A GLU 553.A N MET 549.A O no hydrogen 2.822 N/A SER 554.A N LEU 550.A O no hydrogen 2.860 N/A THR 555.A N GLY 551.A O no hydrogen 3.015 N/A THR 555.A OG1 GLY 551.A O no hydrogen 2.925 N/A LYS 556.A N ALA 552.A O no hydrogen 2.970 N/A LYS 556.A NZ ASP 594.A OD1 no hydrogen 3.410 N/A LEU 557.A N GLU 553.A O no hydrogen 3.110 N/A ASN 558.A N SER 554.A O no hydrogen 3.015 N/A ASN 559.A N THR 555.A O no hydrogen 3.171 N/A ASN 559.A ND2 THR 555.A O no hydrogen 2.722 N/A GLN 560.A N LYS 556.A O no hydrogen 2.970 N/A GLN 560.A NE2 TYR 610.A O no hydrogen 2.604 N/A ALA 561.A N LEU 557.A O no hydrogen 2.849 N/A ARG 562.A N ASN 558.A O no hydrogen 2.969 N/A ARG 562.A NE GLU 566.A OE1 no hydrogen 3.026 N/A ARG 562.A NH1 ARG 589.A O no hydrogen 3.020 N/A ARG 562.A NH2 ARG 589.A O no hydrogen 2.408 N/A PHE 563.A N ASN 559.A O no hydrogen 2.943 N/A ILE 564.A N GLN 560.A O no hydrogen 3.174 N/A LEU 565.A N ALA 561.A O no hydrogen 3.036 N/A GLU 566.A N ARG 562.A O no hydrogen 2.850 N/A LYS 567.A N PHE 563.A O no hydrogen 2.938 N/A LYS 567.A N ILE 564.A O no hydrogen 3.288 N/A LYS 567.A NZ GLU 575.A OE1 no hydrogen 3.061 N/A ILE 568.A N ILE 564.A O no hydrogen 3.077 N/A GLY 570.A N LYS 567.A O no hydrogen 3.284 N/A LYS 571.A NZ GLN 569.A OE1 no hydrogen 3.538 N/A ILE 572.A N GLU 566.A O no hydrogen 3.221 N/A ILE 574.A N GLU 575.A OE2 no hydrogen 2.993 N/A LEU 582.A N SER 578.A O no hydrogen 2.918 N/A ILE 583.A N LYS 579.A O no hydrogen 2.966 N/A GLN 584.A N LYS 580.A O no hydrogen 2.971 N/A MET 585.A N ASP 581.A O no hydrogen 3.129 N/A LEU 586.A N LEU 582.A O no hydrogen 3.087 N/A VAL 587.A N ILE 583.A O no hydrogen 3.112 N/A GLN 588.A N GLN 584.A O no hydrogen 3.176 N/A ARG 589.A N MET 585.A O no hydrogen 3.006 N/A ARG 589.A NE GLU 566.A OE2 no hydrogen 3.450 N/A ARG 589.A NH1 GLU 566.A OE1 no hydrogen 3.503 N/A ARG 589.A NH1 GLU 566.A OE2 no hydrogen 3.349 N/A GLY 590.A N VAL 587.A O no hydrogen 3.429 N/A TYR 591.A N LEU 586.A O no hydrogen 2.937 N/A TYR 591.A OH GLU 566.A OE2 no hydrogen 2.623 N/A GLU 592.A N ASN 559.A OD1 no hydrogen 3.127 N/A SER 593.A OG ASP 607.A O no hydrogen 3.428 N/A ASP 594.A N ASP 607.A O no hydrogen 2.961 N/A LYS 597.A N ASP 594.A OD1 no hydrogen 3.310 N/A ALA 598.A N ASP 594.A O no hydrogen 2.874 N/A TRP 599.A N PRO 595.A O no hydrogen 2.796 N/A LYS 600.A N VAL 596.A O no hydrogen 3.112 N/A GLU 601.A N LYS 597.A O no hydrogen 2.925 N/A ALA 602.A N ALA 598.A O no hydrogen 3.130 N/A GLN 603.A N LYS 600.A O no hydrogen 3.272 N/A ASP 607.A N SER 593.A OG no hydrogen 3.014 N/A ASN 609.A N ASP 607.A OD1 no hydrogen 3.084 N/A TYR 610.A OH GLU 592.A O no hydrogen 2.507 N/A ILE 611.A N PHE 608.A O no hydrogen 3.033 N/A LEU 612.A N PHE 608.A O no hydrogen 3.221 N/A ASN 613.A N ASN 609.A O no hydrogen 2.819 N/A SER 618.A N SER 615.A O no hydrogen 3.117 N/A SER 618.A OG SER 615.A O no hydrogen 3.094 N/A LEU 619.A N LEU 616.A O no hydrogen 3.284 N/A THR 620.A N TRP 617.A O no hydrogen 2.822 N/A THR 620.A OG1 TRP 617.A O no hydrogen 2.492 N/A LYS 621.A NZ GLU 625.A OE1 no hydrogen 2.589 N/A GLU 622.A N GLU 622.A OE2 no hydrogen 2.673 N/A LYS 623.A NZ GLU 626.A OE1 no hydrogen 3.387 N/A VAL 624.A N THR 620.A O no hydrogen 3.122 N/A GLU 625.A N LYS 621.A O no hydrogen 3.236 N/A GLU 626.A N GLU 622.A O no hydrogen 2.988 N/A LEU 627.A N LYS 623.A O no hydrogen 2.940 N/A ILE 628.A N VAL 624.A O no hydrogen 3.115 N/A LYS 629.A N GLU 625.A O no hydrogen 3.183 N/A GLN 630.A N GLU 626.A O no hydrogen 3.079 N/A ARG 631.A N LEU 627.A O no hydrogen 3.016 N/A ARG 631.A NE ASP 632.A OD1 no hydrogen 3.366 N/A ARG 631.A NH2 ASP 632.A OD1 no hydrogen 3.434 N/A ASP 632.A N ILE 628.A O no hydrogen 2.976 N/A ALA 633.A N LYS 629.A O no hydrogen 2.804 N/A LYS 634.A N GLN 630.A O no hydrogen 2.950 N/A LYS 634.A NZ GLU 553.A OE2 no hydrogen 3.026 N/A LYS 634.A NZ GLU 637.A OE1 no hydrogen 2.817 N/A GLY 635.A N ARG 631.A O no hydrogen 3.186 N/A ARG 636.A N ASP 632.A O no hydrogen 3.091 N/A GLU 637.A N ALA 633.A O no hydrogen 2.866 N/A VAL 638.A N LYS 634.A O no hydrogen 2.967 N/A ASN 639.A N GLY 635.A O no hydrogen 3.246 N/A ASP 640.A N ARG 636.A O no hydrogen 2.947 N/A LEU 641.A N GLU 637.A O no hydrogen 3.215 N/A LEU 641.A N VAL 638.A O no hydrogen 3.229 N/A LYS 642.A N VAL 638.A O no hydrogen 3.006 N/A ARG 643.A N ASN 639.A O no hydrogen 3.074 N/A LYS 644.A N LEU 641.A O no hydrogen 3.122 N/A LYS 644.A NZ GLU 652.A OE1 no hydrogen 3.327 N/A LYS 644.A NZ GLU 652.A OE2 no hydrogen 2.718 N/A SER 645.A N ASP 648.A OD2 no hydrogen 3.024 N/A ASP 648.A N SER 645.A OG no hydrogen 2.983 N/A LEU 649.A N SER 645.A O no hydrogen 2.885 N/A TRP 650.A N PRO 646.A O no hydrogen 3.155 N/A TRP 650.A NE1 ILE 353.A O no hydrogen 3.078 N/A LYS 651.A N SER 647.A O no hydrogen 2.913 N/A GLU 652.A N ASP 648.A O no hydrogen 3.042 N/A ASP 653.A N LEU 649.A O no hydrogen 3.275 N/A LEU 654.A N TRP 650.A O no hydrogen 2.901 N/A ALA 655.A N LYS 651.A O no hydrogen 2.948 N/A ALA 656.A N GLU 652.A O no hydrogen 2.992 N/A PHE 657.A N ASP 653.A O no hydrogen 2.984 N/A VAL 658.A N LEU 654.A O no hydrogen 3.025 N/A GLU 659.A N ALA 655.A O no hydrogen 3.102 N/A GLU 660.A N ALA 656.A O no hydrogen 3.397 N/A LEU 661.A N PHE 657.A O no hydrogen 2.814 N/A ASP 662.A N VAL 658.A O no hydrogen 2.969 N/A LYS 663.A N GLU 659.A O no hydrogen 3.325 N/A VAL 664.A N GLU 660.A O no hydrogen 2.876 N/A GLU 665.A N LEU 661.A O no hydrogen 3.043 N/A SER 666.A N ASP 662.A O no hydrogen 3.019 N/A SER 666.A OG ASP 662.A O no hydrogen 2.759 N/A GLN 667.A N LYS 663.A O no hydrogen 2.913 N/A GLU 668.A N VAL 664.A O no hydrogen 2.915 N/A ARG 669.A N GLU 665.A O no hydrogen 3.418 N/A GLU 670.A N SER 666.A O no hydrogen 3.267 N/A ASP 671.A N GLN 667.A O no hydrogen 2.804 N/A