Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w4w_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASP 3.A OD1 no hydrogen 3.062 N/A ASP 5.A N ASP 5.A OD1 no hydrogen 2.484 N/A PHE 6.A N ASP 3.A O no hydrogen 2.902 N/A GLN 7.A N PRO 4.A O no hydrogen 3.236 N/A LEU 9.A N PHE 6.A O no hydrogen 3.235 N/A ALA 10.A N PHE 6.A O no hydrogen 3.170 N/A THR 14.A OG1 GLN 13.A O no hydrogen 2.744 N/A THR 14.A OG1 GLN 13.A OE1 no hydrogen 3.106 N/A LYS 20.A N ASP 18.A OD1 no hydrogen 2.876 N/A LYS 21.A N ASP 18.A O no hydrogen 3.057 N/A LYS 21.A NZ ILE 37.A O no hydrogen 2.969 N/A ASN 22.A N ASP 18.A O no hydrogen 2.985 N/A ASN 22.A ND2 ALA 35.A O no hydrogen 2.681 N/A CYS 23.A N ALA 35.A O no hydrogen 2.761 N/A CYS 23.A SG TRP 24.A O no hydrogen 3.627 N/A CYS 23.A SG GLN 64.A O no hydrogen 2.270 N/A TRP 24.A N GLN 64.A O no hydrogen 2.836 N/A VAL 25.A N ALA 33.A O no hydrogen 2.895 N/A ASP 27.A N GLY 31.A O no hydrogen 3.133 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.336 N/A LYS 29.A N ASP 27.A OD1 no hydrogen 2.468 N/A GLU 30.A N ASP 27.A OD1 no hydrogen 2.744 N/A ALA 33.A N VAL 25.A O no hydrogen 2.597 N/A ALA 35.A N CYS 23.A O no hydrogen 2.821 N/A GLU 36.A N LYS 48.A O no hydrogen 2.971 N/A ILE 37.A N LYS 21.A O no hydrogen 2.667 N/A GLN 38.A N THR 46.A O no hydrogen 2.640 N/A SER 39.A N THR 46.A O no hydrogen 3.126 N/A SER 39.A OG SER 40.A O no hydrogen 3.077 N/A ASP 43.A N LYS 41.A O no hydrogen 2.965 N/A GLU 44.A N LYS 41.A O no hydrogen 3.241 N/A ILE 45.A N VAL 58.A O no hydrogen 3.322 N/A THR 46.A N SER 39.A O no hydrogen 2.877 N/A THR 46.A OG1 SER 39.A O no hydrogen 2.976 N/A VAL 47.A N ARG 56.A O no hydrogen 2.851 N/A LYS 48.A N GLU 36.A O no hydrogen 2.851 N/A LYS 48.A NZ SER 53.A O no hydrogen 2.714 N/A LYS 48.A NZ SER 53.A OG no hydrogen 2.440 N/A ILE 49.A N SER 54.A O no hydrogen 2.969 N/A VAL 50.A N SER 34.A O no hydrogen 3.144 N/A SER 53.A OG SER 53.A O no hydrogen 2.535 N/A SER 54.A OG ASP 52.A OD1 no hydrogen 2.776 N/A THR 55.A OG1 VAL 47.A O no hydrogen 3.328 N/A ARG 56.A N VAL 47.A O no hydrogen 3.188 N/A ARG 56.A NH1 PRO 26.A O no hydrogen 2.748 N/A ARG 56.A NH2 PRO 26.A O no hydrogen 2.742 N/A VAL 58.A N ILE 45.A O no hydrogen 2.831 N/A LYS 59.A NZ ASP 43.A OD2 no hydrogen 2.808 N/A LYS 60.A N ASP 43.A OD1 no hydrogen 3.094 N/A ASP 62.A N LYS 59.A O no hydrogen 3.181 N/A ILE 63.A N LYS 60.A O no hydrogen 3.456 N/A GLN 64.A N TRP 24.A O no hydrogen 2.787 N/A ASN 67.A ND2 TYR 82.A O no hydrogen 3.049 N/A PHE 71.A N PRO 68.A O no hydrogen 2.936 N/A LYS 73.A NZ ASP 12.A OD1 no hydrogen 2.283 N/A LYS 73.A NZ ASP 12.A OD2 no hydrogen 2.962 N/A MET 77.A N TYR 104.A O no hydrogen 2.965 N/A ALA 78.A N ASP 76.A OD1 no hydrogen 2.981 N/A ASN 79.A N ASP 76.A O no hydrogen 3.251 N/A ASN 79.A ND2 ASP 76.A O no hydrogen 3.344 N/A MET 80.A N MET 77.A O no hydrogen 3.061 N/A THR 81.A OG1 ASN 67.A OD1 no hydrogen 2.714 N/A TYR 82.A N ASN 67.A OD1 no hydrogen 2.657 N/A ASN 84.A N SER 87.A OG no hydrogen 2.788 N/A ASN 84.A ND2 SER 65.A O no hydrogen 3.496 N/A ALA 86.A N ASN 84.A OD1 no hydrogen 3.191 N/A SER 87.A N ASN 84.A O no hydrogen 2.579 N/A SER 87.A OG TYR 82.A O no hydrogen 2.576 N/A SER 87.A OG ASN 84.A O no hydrogen 2.875 N/A VAL 88.A N ASN 84.A O no hydrogen 3.047 N/A TYR 90.A N ALA 86.A O no hydrogen 3.261 N/A ASN 91.A N SER 87.A O no hydrogen 3.009 N/A ASN 91.A ND2 PHE 71.A O no hydrogen 3.334 N/A LEU 92.A N VAL 88.A O no hydrogen 3.030 N/A ARG 93.A N LEU 89.A O no hydrogen 3.194 N/A ARG 93.A NH2 VAL 623.A O no hydrogen 2.840 N/A SER 94.A N TYR 90.A O no hydrogen 2.903 N/A SER 94.A OG TYR 90.A O no hydrogen 2.198 N/A ARG 95.A N ASN 91.A O no hydrogen 3.020 N/A ARG 95.A NH1 GLU 75.A OE1 no hydrogen 2.219 N/A ARG 95.A NH2 TYR 102.A O no hydrogen 2.557 N/A TYR 96.A N LEU 92.A O no hydrogen 2.829 N/A THR 97.A N ARG 93.A O no hydrogen 3.352 N/A THR 97.A OG1 ARG 93.A O no hydrogen 3.270 N/A THR 97.A OG1 SER 94.A O no hydrogen 3.060 N/A SER 98.A N ARG 95.A O no hydrogen 2.604 N/A SER 98.A OG SER 94.A O no hydrogen 3.204 N/A GLY 99.A N TYR 96.A O no hydrogen 2.910 N/A THR 103.A N ILE 110.A O no hydrogen 3.034 N/A TYR 104.A N GLU 75.A O no hydrogen 2.940 N/A SER 105.A N PHE 108.A O no hydrogen 2.875 N/A SER 105.A OG SER 105.A O no hydrogen 2.499 N/A SER 105.A OG PHE 108.A O no hydrogen 3.078 N/A CYS 109.A N PHE 608.A O no hydrogen 2.853 N/A CYS 109.A SG PHE 608.A O no hydrogen 3.225 N/A ILE 110.A N THR 103.A O no hydrogen 2.754 N/A ALA 111.A N ARG 610.A O no hydrogen 2.831 N/A VAL 112.A N ILE 101.A O no hydrogen 2.986 N/A ASN 113.A N ILE 612.A O no hydrogen 3.234 N/A TYR 115.A OH GLN 619.A OE1 no hydrogen 3.323 N/A THR 122.A OG1 SER 124.A OG no hydrogen 2.321 N/A SER 124.A OG THR 122.A OG1 no hydrogen 2.321 N/A VAL 125.A N THR 122.A OG1 no hydrogen 3.091 N/A ILE 126.A N THR 122.A O no hydrogen 3.068 N/A ALA 127.A N ASP 123.A O no hydrogen 3.210 N/A LYS 128.A NZ ASP 3.A OD2 no hydrogen 2.695 N/A TYR 129.A N VAL 125.A O no hydrogen 3.326 N/A TYR 129.A N ILE 126.A O no hydrogen 3.279 N/A ARG 130.A N ILE 126.A O no hydrogen 3.286 N/A ARG 130.A NH2 VAL 185.A O no hydrogen 2.364 N/A GLY 131.A N ASP 146.A OD2 no hydrogen 2.748 N/A LYS 132.A N TYR 129.A O no hydrogen 3.167 N/A LYS 132.A NZ ARG 130.A O no hydrogen 3.003 N/A ARG 133.A NH2 GLU 136.A OE1 no hydrogen 2.328 N/A GLU 136.A N ARG 133.A O no hydrogen 2.512 N/A HIS 140.A N TYR 104.A OH no hydrogen 3.117 N/A HIS 140.A NE2 ILE 120.A O no hydrogen 3.176 N/A PHE 142.A N HIS 140.A ND1 no hydrogen 2.627 N/A SER 143.A OG GLU 708.A OE2 no hydrogen 3.568 N/A VAL 144.A N HIS 140.A O no hydrogen 3.446 N/A ALA 145.A N LEU 141.A O no hydrogen 3.035 N/A ASP 146.A N PHE 142.A O no hydrogen 2.484 N/A ASN 147.A N SER 143.A O no hydrogen 2.792 N/A ASN 147.A ND2 SER 143.A O no hydrogen 2.564 N/A ALA 148.A N VAL 144.A O no hydrogen 3.058 N/A TYR 149.A N ALA 145.A O no hydrogen 3.046 N/A TYR 149.A OH GLY 225.A O no hydrogen 2.205 N/A GLN 150.A N ASP 146.A O no hydrogen 3.189 N/A GLN 150.A NE2 GLU 656.A O no hydrogen 2.891 N/A ASN 151.A N ASN 147.A O no hydrogen 3.036 N/A MET 152.A N ALA 148.A O no hydrogen 3.049 N/A VAL 153.A N TYR 149.A O no hydrogen 2.964 N/A THR 154.A N GLN 150.A O no hydrogen 2.772 N/A THR 154.A OG1 GLN 150.A O no hydrogen 2.956 N/A THR 154.A OG1 GLN 150.A OE1 no hydrogen 3.050 N/A THR 154.A OG1 ASP 155.A OD2 no hydrogen 3.336 N/A ASP 155.A N ASN 151.A O no hydrogen 2.646 N/A ARG 156.A N VAL 153.A O no hydrogen 3.264 N/A GLU 157.A N MET 152.A O no hydrogen 3.312 N/A GLN 159.A N TYR 418.A O no hydrogen 3.100 N/A SER 160.A N HIS 607.A NE2 no hydrogen 2.516 N/A SER 160.A OG GLN 159.A O no hydrogen 2.238 N/A CYS 161.A N GLY 420.A O no hydrogen 3.316 N/A CYS 161.A SG CYS 161.A O no hydrogen 2.866 N/A CYS 161.A SG GLY 420.A O no hydrogen 3.583 N/A LEU 162.A N HIS 607.A O no hydrogen 3.249 N/A ILE 163.A N LEU 422.A O no hydrogen 3.357 N/A THR 164.A N VAL 609.A O no hydrogen 2.758 N/A THR 164.A OG1 VAL 609.A O no hydrogen 3.462 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.344 N/A SER 167.A OG PHE 427.A O no hydrogen 2.566 N/A ALA 169.A N GLU 166.A O no hydrogen 3.303 N/A LYS 171.A NZ ILE 424.A O no hydrogen 2.246 N/A ASN 174.A N GLY 170.A O no hydrogen 2.997 N/A THR 175.A N LYS 171.A O no hydrogen 2.988 N/A THR 175.A OG1 THR 172.A O no hydrogen 2.488 N/A LYS 176.A N THR 172.A O no hydrogen 2.906 N/A LYS 177.A N GLU 173.A O no hydrogen 3.052 N/A LYS 177.A NZ HIS 140.A NE2 no hydrogen 2.918 N/A VAL 178.A N ASN 174.A O no hydrogen 3.138 N/A VAL 178.A N THR 175.A O no hydrogen 3.192 N/A ILE 179.A N THR 175.A O no hydrogen 3.239 N/A MET 180.A N LYS 176.A O no hydrogen 2.755 N/A TYR 181.A N LYS 177.A O no hydrogen 2.899 N/A TYR 181.A OH ALA 145.A O no hydrogen 2.679 N/A LEU 182.A N VAL 178.A O no hydrogen 2.841 N/A ALA 183.A N ILE 179.A O no hydrogen 2.705 N/A LYS 184.A N MET 180.A O no hydrogen 3.129 N/A GLN 188.A N GLN 188.A OE1 no hydrogen 2.405 N/A ILE 190.A N GLU 186.A O no hydrogen 3.257 N/A GLN 191.A N ASP 187.A O no hydrogen 3.191 N/A ALA 192.A N ILE 189.A O no hydrogen 2.785 N/A ASN 193.A ND2 ILE 190.A O no hydrogen 3.141 N/A LEU 196.A N ALA 192.A O no hydrogen 3.138 N/A GLU 197.A N ASN 193.A O no hydrogen 2.723 N/A ALA 198.A N PRO 194.A O no hydrogen 3.333 N/A ALA 198.A N VAL 195.A O no hydrogen 3.216 N/A TYR 199.A N VAL 195.A O no hydrogen 3.221 N/A GLY 200.A N LEU 196.A O no hydrogen 2.766 N/A ASN 201.A ND2 SER 210.A O no hydrogen 3.101 N/A ALA 202.A N SER 210.A O no hydrogen 2.968 N/A LYS 203.A NZ ASN 208.A OD1 no hydrogen 3.327 N/A LYS 203.A NZ ASP 290.A OD1 no hydrogen 2.769 N/A THR 204.A N ASN 207.A O no hydrogen 2.774 N/A THR 204.A OG1 ASN 207.A O no hydrogen 2.631 N/A THR 204.A OG1 SER 210.A OG no hydrogen 2.201 N/A ASN 207.A N THR 204.A OG1 no hydrogen 2.713 N/A SER 210.A N ALA 202.A O no hydrogen 2.777 N/A SER 210.A OG THR 204.A OG1 no hydrogen 2.201 N/A SER 210.A OG ASN 207.A O no hydrogen 2.905 N/A SER 211.A OG PHE 213.A O no hydrogen 3.235 N/A ARG 212.A N GLY 200.A O no hydrogen 2.898 N/A GLY 214.A N TYR 235.A O no hydrogen 2.466 N/A LYS 215.A N ASP 423.A O no hydrogen 3.059 N/A LYS 215.A NZ GLU 197.A OE1 no hydrogen 3.106 N/A PHE 216.A N GLU 233.A O no hydrogen 2.884 N/A ILE 217.A N VAL 421.A O no hydrogen 3.084 N/A ARG 218.A N ASP 231.A O no hydrogen 3.002 N/A ARG 218.A NH1 SER 160.A OG no hydrogen 2.937 N/A ILE 219.A N ILE 419.A O no hydrogen 3.117 N/A HIS 220.A N GLY 229.A O no hydrogen 3.268 N/A PHE 221.A N TYR 417.A O no hydrogen 2.865 N/A GLY 222.A N LYS 226.A O no hydrogen 2.759 N/A GLY 225.A N GLY 222.A O no hydrogen 2.776 N/A ALA 228.A N HIS 220.A O no hydrogen 3.024 N/A ASP 231.A N ARG 218.A O no hydrogen 3.098 N/A GLU 233.A N PHE 216.A O no hydrogen 2.894 N/A TYR 235.A N GLY 214.A O no hydrogen 2.619 N/A GLU 238.A N ARG 212.A O no hydrogen 2.970 N/A LYS 239.A N LEU 237.A O no hydrogen 2.489 N/A SER 240.A OG GLU 436.A OE2 no hydrogen 2.907 N/A ARG 241.A N GLU 238.A O no hydrogen 2.985 N/A ARG 241.A NE GLN 245.A OE1 no hydrogen 2.382 N/A ARG 241.A NE ARG 250.A O no hydrogen 2.920 N/A TYR 244.A N SER 240.A O no hydrogen 3.214 N/A GLN 245.A NE2 ARG 241.A O no hydrogen 2.635 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.402 N/A GLU 249.A N GLN 246.A O no hydrogen 3.194 N/A ARG 250.A N LYS 203.A O no hydrogen 3.059 N/A ARG 250.A NE ASN 251.A O no hydrogen 3.012 N/A ASN 251.A N TYR 256.A OH no hydrogen 3.196 N/A HIS 253.A N ASN 201.A O no hydrogen 3.061 N/A ILE 254.A N ALA 198.A O no hydrogen 2.976 N/A TYR 256.A N HIS 253.A O no hydrogen 3.058 N/A TYR 256.A OH ILE 282.A O no hydrogen 2.651 N/A TYR 256.A OH CYS 286.A O no hydrogen 2.987 N/A GLN 257.A N HIS 253.A O no hydrogen 3.213 N/A ILE 258.A N ILE 254.A O no hydrogen 2.823 N/A CYS 259.A SG PHE 255.A O no hydrogen 3.643 N/A CYS 259.A SG TYR 256.A O no hydrogen 3.394 N/A SER 260.A N GLN 257.A O no hydrogen 3.100 N/A SER 260.A OG GLN 257.A O no hydrogen 2.864 N/A LEU 266.A N ILE 263.A O no hydrogen 2.929 N/A ASN 267.A N PRO 264.A O no hydrogen 2.873 N/A VAL 269.A N LEU 266.A O no hydrogen 2.781 N/A MET 270.A N LEU 266.A O no hydrogen 3.021 N/A LEU 271.A N ASN 267.A O no hydrogen 2.793 N/A VAL 272.A N ASN 267.A O no hydrogen 3.062 N/A ASP 275.A N THR 273.A O no hydrogen 2.443 N/A TYR 279.A N SER 276.A O no hydrogen 2.961 N/A SER 280.A OG GLY 329.A O no hydrogen 3.109 N/A ILE 282.A N TYR 279.A O no hydrogen 3.030 N/A ASN 283.A N SER 280.A O no hydrogen 3.115 N/A GLN 284.A N GLN 284.A OE1 no hydrogen 2.403 N/A GLN 284.A NE2 PHE 281.A O no hydrogen 3.628 N/A CYS 286.A N GLU 249.A O no hydrogen 2.657 N/A CYS 286.A SG THR 288.A O no hydrogen 2.574 N/A GLU 296.A N ASP 293.A OD1 no hydrogen 2.788 N/A GLU 297.A N ASP 293.A O no hydrogen 2.884 N/A PHE 298.A N ASP 294.A O no hydrogen 2.977 N/A LYS 299.A N VAL 295.A O no hydrogen 3.128 N/A LEU 300.A N GLU 296.A O no hydrogen 2.963 N/A CYS 301.A N GLU 297.A O no hydrogen 2.827 N/A CYS 301.A SG PHE 298.A O no hydrogen 2.405 N/A CYS 301.A SG ASP 302.A OD2 no hydrogen 3.465 N/A ASP 302.A N PHE 298.A O no hydrogen 2.788 N/A GLU 303.A N LYS 299.A O no hydrogen 2.681 N/A ALA 304.A N LEU 300.A O no hydrogen 2.797 N/A PHE 305.A N CYS 301.A O no hydrogen 3.235 N/A PHE 305.A N ASP 302.A O no hydrogen 2.928 N/A ASP 306.A N ASP 302.A O no hydrogen 3.367 N/A ILE 307.A N GLU 303.A O no hydrogen 3.364 N/A LEU 308.A N ALA 304.A O no hydrogen 3.136 N/A GLY 309.A N ASP 306.A O no hydrogen 2.630 N/A PHE 310.A N PHE 305.A O no hydrogen 3.029 N/A LYS 312.A NZ ASP 306.A OD1 no hydrogen 3.093 N/A GLU 314.A N THR 311.A OG1 no hydrogen 3.127 N/A LYS 315.A N THR 311.A O no hydrogen 3.071 N/A LYS 315.A NZ CYS 301.A O no hydrogen 2.707 N/A GLN 316.A N GLU 313.A O no hydrogen 2.781 N/A SER 317.A N GLU 313.A O no hydrogen 2.766 N/A SER 317.A N GLU 314.A O no hydrogen 3.092 N/A SER 317.A OG GLU 313.A O no hydrogen 2.712 N/A MET 318.A N GLU 314.A O no hydrogen 3.153 N/A LYS 320.A N GLN 316.A O no hydrogen 3.132 N/A CYS 321.A N SER 317.A O no hydrogen 2.992 N/A CYS 321.A SG SER 317.A O no hydrogen 3.426 N/A CYS 321.A SG MET 318.A O no hydrogen 2.615 N/A THR 322.A N MET 318.A O no hydrogen 3.089 N/A THR 322.A OG1 PHE 319.A O no hydrogen 3.043 N/A ALA 323.A N PHE 319.A O no hydrogen 3.156 N/A SER 324.A N LYS 320.A O no hydrogen 2.700 N/A SER 324.A OG LYS 320.A O no hydrogen 2.439 N/A ILE 325.A N CYS 321.A O no hydrogen 3.355 N/A LEU 326.A N THR 322.A O no hydrogen 3.444 N/A HIS 327.A N SER 324.A O no hydrogen 2.599 N/A MET 328.A N SER 324.A O no hydrogen 3.129 N/A GLU 330.A N HIS 327.A O no hydrogen 2.548 N/A LYS 334.A N GLU 343.A O no hydrogen 2.904 N/A ARG 336.A NH2 GLN 341.A OE1 no hydrogen 3.359 N/A GLU 343.A N LYS 334.A O no hydrogen 2.911 N/A SER 344.A OG GLY 346.A O no hydrogen 2.406 N/A THR 347.A OG1 GLY 346.A O no hydrogen 2.480 N/A GLU 349.A N GLU 349.A OE1 no hydrogen 2.342 N/A ALA 354.A N ALA 350.A O no hydrogen 3.461 N/A PHE 355.A N GLU 351.A O no hydrogen 2.598 N/A LEU 356.A N LYS 352.A O no hydrogen 3.087 N/A CYS 357.A N VAL 353.A O no hydrogen 3.117 N/A CYS 357.A SG VAL 353.A O no hydrogen 3.073 N/A CYS 357.A SG ALA 354.A O no hydrogen 3.167 N/A GLY 358.A N PHE 355.A O no hydrogen 2.876 N/A ILE 359.A N ALA 354.A O no hydrogen 2.780 N/A ASN 360.A ND2 ASP 363.A OD2 no hydrogen 2.375 N/A LEU 364.A N ASN 360.A O no hydrogen 2.935 N/A LEU 365.A N ALA 361.A O no hydrogen 3.263 N/A LYS 366.A N GLY 362.A O no hydrogen 3.099 N/A ALA 367.A N ASP 363.A O no hydrogen 3.193 N/A LEU 369.A N LEU 365.A O no hydrogen 3.142 N/A LEU 369.A N LYS 366.A O no hydrogen 3.146 N/A LYS 370.A N LYS 366.A O no hydrogen 3.181 N/A GLN 377.A N LEU 369.A O no hydrogen 3.322 N/A MET 379.A N GLU 340.A OE2 no hydrogen 2.712 N/A ASN 380.A N ASN 378.A OD1 no hydrogen 2.839 N/A GLN 381.A N ASN 378.A OD1 no hydrogen 3.037 N/A ASN 384.A N ASN 380.A O no hydrogen 2.852 N/A SER 385.A N VAL 382.A O no hydrogen 2.582 N/A SER 385.A OG GLN 381.A O no hydrogen 3.452 N/A SER 385.A OG VAL 382.A O no hydrogen 2.755 N/A VAL 386.A N VAL 382.A O no hydrogen 2.823 N/A ALA 388.A N ASN 384.A O no hydrogen 3.002 N/A LEU 389.A N SER 385.A O no hydrogen 3.010 N/A LEU 389.A N VAL 386.A O no hydrogen 2.931 N/A ALA 390.A N VAL 386.A O no hydrogen 2.900 N/A LYS 391.A N GLY 387.A O no hydrogen 2.973 N/A SER 392.A N ALA 388.A O no hydrogen 3.097 N/A SER 392.A OG ALA 388.A O no hydrogen 3.064 N/A SER 392.A OG LEU 389.A O no hydrogen 2.733 N/A LEU 393.A N LEU 389.A O no hydrogen 2.859 N/A LEU 393.A N ALA 390.A O no hydrogen 3.009 N/A TYR 394.A N ALA 390.A O no hydrogen 3.063 N/A ASP 395.A N LYS 391.A O no hydrogen 2.968 N/A ARG 396.A N SER 392.A O no hydrogen 3.292 N/A ARG 396.A NH1 VAL 581.A O no hydrogen 2.399 N/A MET 397.A N LEU 393.A O no hydrogen 2.831 N/A PHE 398.A N TYR 394.A O no hydrogen 3.136 N/A ASN 399.A N ASP 395.A O no hydrogen 3.046 N/A TRP 400.A N ARG 396.A O no hydrogen 2.722 N/A LEU 401.A N MET 397.A O no hydrogen 2.638 N/A VAL 402.A N PHE 398.A O no hydrogen 3.171 N/A ARG 403.A N ASN 399.A O no hydrogen 3.215 N/A ARG 403.A NE ASN 399.A O no hydrogen 3.084 N/A ARG 404.A N TRP 400.A O no hydrogen 2.944 N/A VAL 405.A N LEU 401.A O no hydrogen 3.063 N/A ASN 406.A N ARG 403.A O no hydrogen 3.305 N/A LYS 407.A N ARG 404.A O no hydrogen 2.906 N/A THR 408.A N ARG 404.A O no hydrogen 3.231 N/A THR 408.A OG1 VAL 405.A O no hydrogen 2.646 N/A LEU 409.A N ASN 406.A O no hydrogen 3.084 N/A ASP 410.A N ASN 406.A O no hydrogen 2.703 N/A THR 411.A N LEU 409.A O no hydrogen 2.545 N/A ARG 415.A NH2 ASP 410.A OD2 no hydrogen 2.767 N/A ASN 416.A N PHE 221.A O no hydrogen 2.750 N/A TYR 418.A N ASN 158.A OD1 no hydrogen 3.117 N/A ILE 419.A N ILE 219.A O no hydrogen 3.147 N/A VAL 421.A N ILE 217.A O no hydrogen 2.945 N/A LEU 422.A N CYS 161.A O no hydrogen 2.994 N/A ASP 423.A N LYS 215.A O no hydrogen 2.925 N/A PHE 430.A N ASN 433.A OD1 no hydrogen 2.943 N/A ASN 433.A ND2 PHE 430.A O no hydrogen 3.301 N/A GLN 437.A NE2 GLU 428.A O no hydrogen 2.565 N/A LEU 438.A N SER 434.A O no hydrogen 3.129 N/A CYS 439.A N PHE 435.A O no hydrogen 3.096 N/A CYS 439.A SG PHE 435.A O no hydrogen 3.034 N/A ILE 440.A N GLU 436.A O no hydrogen 3.162 N/A ASN 441.A N GLN 437.A O no hydrogen 2.743 N/A TYR 442.A N LEU 438.A O no hydrogen 2.665 N/A THR 443.A N CYS 439.A O no hydrogen 3.088 N/A THR 443.A OG1 CYS 439.A O no hydrogen 2.499 N/A ASN 444.A N ILE 440.A O no hydrogen 2.847 N/A ASN 444.A ND2 ALA 425.A O no hydrogen 2.412 N/A GLU 445.A N ASN 441.A O no hydrogen 2.893 N/A ARG 446.A N TYR 442.A O no hydrogen 3.290 N/A LEU 447.A N THR 443.A O no hydrogen 3.431 N/A GLN 448.A N ASN 444.A O no hydrogen 3.273 N/A GLN 448.A NE2 CYS 634.A O no hydrogen 3.513 N/A GLN 449.A N GLU 445.A O no hydrogen 3.041 N/A PHE 450.A N ARG 446.A O no hydrogen 3.286 N/A PHE 450.A N LEU 447.A O no hydrogen 2.596 N/A PHE 451.A N LEU 447.A O no hydrogen 3.275 N/A ASN 452.A N GLN 448.A O no hydrogen 3.035 N/A HIS 453.A N GLN 449.A O no hydrogen 2.884 N/A HIS 454.A N PHE 450.A O no hydrogen 2.940 N/A MET 455.A N PHE 451.A O no hydrogen 2.918 N/A PHE 456.A N ASN 452.A O no hydrogen 3.043 N/A LEU 458.A N HIS 453.A O no hydrogen 2.632 N/A GLU 461.A N LEU 458.A O no hydrogen 2.658 N/A GLU 462.A N LEU 458.A O no hydrogen 3.295 N/A LYS 464.A N GLN 460.A O no hydrogen 3.211 N/A LYS 465.A N GLU 461.A O no hydrogen 2.828 N/A GLU 466.A N GLU 462.A O no hydrogen 2.944 N/A ILE 468.A N TYR 463.A O no hydrogen 2.920 N/A GLN 480.A N ASP 478.A OD1 no hydrogen 2.712 N/A CYS 482.A SG GLU 445.A OE2 no hydrogen 3.207 N/A CYS 482.A SG LEU 479.A O no hydrogen 2.774 N/A ILE 483.A N LEU 479.A O no hydrogen 2.850 N/A ASP 484.A N GLN 480.A O no hydrogen 2.359 N/A LEU 485.A N MET 481.A O no hydrogen 2.548 N/A ILE 486.A N CYS 482.A O no hydrogen 3.171 N/A ILE 486.A N ILE 483.A O no hydrogen 3.205 N/A GLU 487.A N ILE 483.A O no hydrogen 2.749 N/A LYS 488.A N ASP 484.A O no hydrogen 3.071 N/A GLY 491.A N LYS 488.A O no hydrogen 2.500 N/A ILE 492.A N LEU 485.A O no hydrogen 2.827 N/A LEU 493.A N ILE 486.A O no hydrogen 3.324 N/A SER 494.A OG PRO 489.A O no hydrogen 2.881 N/A SER 494.A OG GLY 491.A O no hydrogen 2.840 N/A ILE 495.A N GLY 491.A O no hydrogen 3.166 N/A LEU 496.A N ILE 492.A O no hydrogen 3.074 N/A GLU 497.A N LEU 493.A O no hydrogen 2.653 N/A GLU 498.A N SER 494.A O no hydrogen 3.126 N/A GLU 499.A N LEU 496.A O no hydrogen 2.992 N/A CYS 500.A N LEU 496.A O no hydrogen 3.097 N/A CYS 500.A SG GLU 497.A O no hydrogen 2.560 N/A ASP 506.A N SER 509.A OG no hydrogen 3.240 N/A SER 509.A OG ASP 506.A O no hydrogen 3.244 N/A PHE 510.A N ASP 506.A O no hydrogen 3.134 N/A ASP 512.A N LYS 508.A O no hydrogen 2.851 N/A LYS 513.A N SER 509.A O no hydrogen 2.887 N/A LYS 513.A NZ GLU 499.A OE1 no hydrogen 2.464 N/A TYR 515.A N GLN 511.A O no hydrogen 3.512 N/A GLN 516.A N ASP 512.A O no hydrogen 2.874 N/A ASN 517.A N LEU 514.A O no hydrogen 2.933 N/A HIS 518.A N LEU 514.A O no hydrogen 2.973 N/A MET 519.A N TYR 515.A O no hydrogen 2.989 N/A LYS 521.A N HIS 518.A O no hydrogen 3.058 N/A ASN 522.A N HIS 518.A O no hydrogen 3.233 N/A PHE 525.A N ASN 522.A O no hydrogen 3.254 N/A THR 526.A N GLU 542.A O no hydrogen 3.222 N/A THR 526.A N GLU 542.A OE1 no hydrogen 2.921 N/A THR 526.A OG1 GLU 542.A OE2 no hydrogen 0.684 N/A THR 526.A OG1 HIS 544.A NE2 no hydrogen 3.358 N/A HIS 540.A N TYR 552.A O no hydrogen 2.723 N/A PHE 541.A N TYR 552.A O no hydrogen 3.326 N/A GLU 542.A N THR 526.A O no hydrogen 2.951 N/A LEU 543.A N VAL 550.A O no hydrogen 2.885 N/A HIS 545.A N GLY 548.A O no hydrogen 2.691 N/A TYR 546.A N GLU 445.A OE2 no hydrogen 3.455 N/A GLY 548.A N HIS 545.A O no hydrogen 2.731 N/A ASN 549.A ND2 LEU 543.A O no hydrogen 2.615 N/A VAL 550.A N LEU 543.A O no hydrogen 2.764 N/A TYR 552.A N PHE 541.A O no hydrogen 2.712 N/A TYR 552.A OH GLN 437.A OE1 no hydrogen 2.360 N/A SER 553.A N ASN 433.A O no hydrogen 2.915 N/A ILE 554.A N HIS 540.A ND1 no hydrogen 2.387 N/A GLY 556.A N ASP 507.A OD2 no hydrogen 3.295 N/A TRP 557.A N ILE 554.A O no hydrogen 3.445 N/A LYS 560.A N GLY 556.A O no hydrogen 3.281 N/A LYS 560.A NZ SER 434.A OG no hydrogen 3.296 N/A LYS 562.A N GLU 559.A O no hydrogen 3.306 N/A VAL 570.A N ASN 566.A O no hydrogen 3.179 N/A ALA 571.A N ASN 568.A O no hydrogen 2.782 N/A LEU 572.A N ASN 568.A O no hydrogen 3.183 N/A LEU 573.A N VAL 569.A O no hydrogen 2.949 N/A ALA 575.A N LEU 572.A O no hydrogen 3.197 N/A SER 576.A N LEU 573.A O no hydrogen 3.183 N/A SER 576.A OG LEU 573.A O no hydrogen 3.332 N/A SER 576.A OG GLU 578.A O no hydrogen 3.350 N/A LYS 577.A N GLY 358.A O no hydrogen 2.675 N/A LEU 580.A N GLU 578.A OE1 no hydrogen 2.230 N/A VAL 581.A N GLU 578.A OE2 no hydrogen 2.818 N/A ALA 582.A N GLU 578.A O no hydrogen 3.294 N/A GLU 583.A N PRO 579.A O no hydrogen 3.370 N/A THR 585.A OG1 GLU 497.A OE2 no hydrogen 1.632 N/A ILE 586.A N ASN 561.A O no hydrogen 3.451 N/A SER 587.A OG ASN 561.A OD1 no hydrogen 2.231 N/A ALA 588.A N GLU 497.A OE2 no hydrogen 2.782 N/A ALA 588.A N THR 585.A OG1 no hydrogen 3.098 N/A VAL 589.A N THR 585.A O no hydrogen 2.872 N/A HIS 590.A N ILE 586.A O no hydrogen 2.744 N/A ARG 591.A N SER 587.A O no hydrogen 2.796 N/A ARG 591.A NH1 GLU 487.A OE1 no hydrogen 3.053 N/A GLU 592.A N ALA 588.A O no hydrogen 3.085 N/A SER 593.A N VAL 589.A O no hydrogen 2.916 N/A SER 593.A OG HIS 590.A O no hydrogen 2.599 N/A LEU 594.A N HIS 590.A O no hydrogen 2.857 N/A ASN 595.A N ARG 591.A O no hydrogen 2.918 N/A LYS 596.A N GLU 592.A O no hydrogen 2.938 N/A LYS 596.A NZ GLU 592.A OE2 no hydrogen 3.078 N/A LEU 597.A N SER 593.A O no hydrogen 2.826 N/A MET 598.A N LEU 594.A O no hydrogen 2.986 N/A LYS 599.A N ASN 595.A O no hydrogen 3.078 N/A ASN 600.A N LYS 596.A O no hydrogen 3.126 N/A LEU 601.A N LEU 597.A O no hydrogen 3.022 N/A LEU 601.A N MET 598.A O no hydrogen 3.120 N/A TYR 602.A N MET 598.A O no hydrogen 3.077 N/A SER 603.A OG ASN 600.A O no hydrogen 2.790 N/A THR 604.A OG1 LEU 601.A O no hydrogen 2.210 N/A HIS 607.A N SER 160.A O no hydrogen 2.917 N/A VAL 609.A N LEU 162.A O no hydrogen 2.994 N/A ARG 610.A N CYS 109.A O no hydrogen 2.811 N/A ARG 610.A NH1 GLN 631.A OE1 no hydrogen 3.281 N/A CYS 611.A N THR 164.A O no hydrogen 2.535 N/A CYS 611.A SG THR 164.A O no hydrogen 3.020 N/A CYS 611.A SG GLU 166.A O no hydrogen 3.703 N/A CYS 611.A SG GLU 166.A OE1 no hydrogen 2.916 N/A ASN 615.A ND2 GLN 619.A O no hydrogen 3.182 N/A LEU 617.A N ASN 615.A OD1 no hydrogen 2.826 N/A LYS 618.A NZ ASP 290.A OD2 no hydrogen 2.886 N/A ASP 624.A N PRO 614.A O no hydrogen 2.918 N/A LEU 627.A N ASP 624.A OD1 no hydrogen 3.262 N/A VAL 628.A N ASP 624.A O no hydrogen 2.838 N/A LEU 629.A N ALA 625.A O no hydrogen 2.653 N/A HIS 630.A N GLU 626.A O no hydrogen 2.746 N/A GLN 631.A N LEU 627.A O no hydrogen 2.969 N/A GLN 631.A N VAL 628.A O no hydrogen 2.654 N/A LEU 632.A N VAL 628.A O no hydrogen 2.896 N/A GLN 633.A N HIS 630.A O no hydrogen 3.160 N/A CYS 634.A N HIS 630.A O no hydrogen 3.366 N/A CYS 634.A SG TYR 546.A O no hydrogen 2.690 N/A CYS 634.A SG HIS 630.A NE2 no hydrogen 3.895 N/A CYS 634.A SG GLN 633.A OE1 no hydrogen 3.660 N/A ASN 635.A N GLN 631.A O no hydrogen 3.276 N/A ASN 635.A ND2 LEU 632.A O no hydrogen 2.304 N/A GLY 636.A N GLN 633.A O no hydrogen 3.378 N/A GLY 640.A N GLY 636.A O no hydrogen 2.726 N/A ILE 641.A N LEU 638.A O no hydrogen 2.595 N/A ARG 642.A N LEU 638.A O no hydrogen 2.902 N/A CYS 644.A SG ILE 641.A O no hydrogen 2.224 N/A ARG 645.A N ILE 641.A O no hydrogen 3.103 N/A ARG 645.A N ARG 642.A O no hydrogen 2.897 N/A LYS 646.A N ARG 642.A O no hydrogen 2.344 N/A LEU 652.A N VAL 697.A O no hydrogen 2.828 N/A TYR 654.A N THR 695.A O no hydrogen 3.465 N/A TYR 654.A OH GLY 693.A O no hydrogen 3.133 N/A TYR 654.A OH LYS 696.A O no hydrogen 3.404 N/A GLU 656.A N ILE 653.A O no hydrogen 2.726 N/A PHE 657.A N ILE 653.A O no hydrogen 2.935 N/A LYS 658.A N TYR 654.A O no hydrogen 2.829 N/A ARG 660.A N PHE 657.A O no hydrogen 3.182 N/A ARG 660.A NE GLU 656.A O no hydrogen 2.535 N/A ARG 660.A NH1 ASN 151.A OD1 no hydrogen 3.239 N/A TYR 661.A N PHE 657.A O no hydrogen 2.797 N/A SER 662.A OG LYS 658.A O no hydrogen 2.312 N/A LEU 664.A N SER 662.A O no hydrogen 2.503 N/A ALA 665.A N SER 662.A O no hydrogen 3.108 N/A LYS 673.A N ASP 671.A OD1 no hydrogen 2.676 N/A LYS 673.A NZ THR 694.A O no hydrogen 2.244 N/A THR 674.A N ASP 671.A O no hydrogen 3.290 N/A THR 674.A OG1 ASP 671.A O no hydrogen 3.071 N/A VAL 675.A N ASP 671.A O no hydrogen 3.104 N/A SER 676.A OG GLY 672.A O no hydrogen 3.511 N/A SER 676.A OG LYS 673.A O no hydrogen 3.257 N/A LYS 678.A N THR 674.A O no hydrogen 2.756 N/A ILE 679.A N VAL 675.A O no hydrogen 2.797 N/A LEU 680.A N SER 676.A O no hydrogen 3.082 N/A GLY 682.A N LYS 678.A O no hydrogen 2.506 N/A LEU 683.A N ILE 679.A O no hydrogen 2.930 N/A GLN 684.A N ALA 681.A O no hydrogen 2.765 N/A MET 685.A N LEU 680.A O no hydrogen 3.205 N/A ALA 688.A N ASP 686.A OD1 no hydrogen 2.416 N/A TYR 690.A N ALA 688.A O no hydrogen 2.566 N/A TYR 690.A OH MET 685.A O no hydrogen 3.320 N/A ARG 691.A N PHE 698.A O no hydrogen 2.571 N/A VAL 697.A N LEU 652.A O no hydrogen 2.616 N/A PHE 698.A N ARG 691.A O no hydrogen 2.932 N/A LYS 700.A N GLU 689.A O no hydrogen 3.003 N/A LYS 700.A NZ ARG 645.A O no hydrogen 1.876 N/A GLY 705.A N GLY 702.A O no hydrogen 2.697 N/A ASN 706.A N GLY 702.A O no hydrogen 3.119 N/A LEU 707.A N VAL 703.A O no hydrogen 2.936 N/A LEU 707.A N LEU 704.A O no hydrogen 3.257 N/A GLU 708.A N LEU 704.A O no hydrogen 3.152 N/A GLU 709.A N ASN 706.A O no hydrogen 3.241 N/A MET 710.A N ASN 706.A O no hydrogen 3.174 N/A ARG 711.A N LEU 707.A O no hydrogen 2.759 N/A ASP 712.A N GLU 708.A O no hydrogen 3.248 N/A ASP 712.A N GLU 709.A O no hydrogen 2.708 N/A GLU 713.A N GLU 136.A O no hydrogen 2.580 N/A GLU 713.A N GLU 709.A O no hydrogen 2.922 N/A ARG 714.A N MET 710.A O no hydrogen 3.203 N/A LEU 715.A N ARG 711.A O no hydrogen 3.114 N/A SER 716.A N ASP 712.A O no hydrogen 2.672 N/A SER 716.A N GLU 713.A O no hydrogen 2.830 N/A SER 716.A OG ASP 712.A O no hydrogen 3.395 N/A SER 716.A OG GLU 713.A O no hydrogen 2.325 N/A LYS 717.A N GLU 713.A O no hydrogen 2.967 N/A ILE 718.A N ARG 714.A O no hydrogen 2.930 N/A ILE 719.A N LEU 715.A O no hydrogen 3.371 N/A SER 720.A N SER 716.A O no hydrogen 2.946 N/A SER 720.A OG LYS 717.A O no hydrogen 2.208 N/A MET 721.A N LYS 717.A O no hydrogen 2.748 N/A PHE 722.A N ILE 718.A O no hydrogen 3.050 N/A GLN 723.A N SER 720.A O no hydrogen 2.697 N/A ALA 724.A N SER 720.A O no hydrogen 2.590 N/A HIS 725.A N MET 721.A O no hydrogen 3.005 N/A ILE 726.A N PHE 722.A O no hydrogen 3.182 N/A ARG 727.A N GLN 723.A O no hydrogen 2.825 N/A ARG 727.A NE GLN 723.A OE1 no hydrogen 2.340 N/A GLY 728.A N ALA 724.A O no hydrogen 2.739 N/A TYR 729.A N HIS 725.A O no hydrogen 3.085 N/A LEU 730.A N ILE 726.A O no hydrogen 3.255 N/A ILE 731.A N ARG 727.A O no hydrogen 3.167 N/A ARG 732.A N GLY 728.A O no hydrogen 3.180 N/A LYS 733.A N TYR 729.A O no hydrogen 2.907 N/A ALA 734.A N LEU 730.A O no hydrogen 3.332 N/A ALA 734.A N ILE 731.A O no hydrogen 2.783 N/A GLN 741.A N LYS 737.A O no hydrogen 2.986 N/A ARG 742.A NE GLN 739.A OE1 no hydrogen 3.087 N/A ARG 742.A NH2 GLN 739.A OE1 no hydrogen 2.812 N/A ILE 743.A N GLN 739.A O no hydrogen 3.217 N/A ILE 743.A N ASP 740.A O no hydrogen 3.251 N/A GLY 744.A N ASP 740.A O no hydrogen 2.766 N/A SER 746.A OG ILE 743.A O no hydrogen 2.555 N/A VAL 747.A N ILE 743.A O no hydrogen 2.935 N/A GLN 749.A N LEU 745.A O no hydrogen 2.750 N/A ARG 750.A N SER 746.A O no hydrogen 2.944 N/A ARG 750.A NE SER 746.A O no hydrogen 2.613 N/A ASN 751.A N VAL 747.A O no hydrogen 2.670 N/A VAL 757.A N ARG 753.A O no hydrogen 3.103 N/A LEU 758.A N LYS 754.A O no hydrogen 2.824 N/A ASN 760.A N VAL 757.A O no hydrogen 3.251 N/A LYS 765.A N TRP 761.A O no hydrogen 3.034 N/A LEU 766.A N GLN 762.A O no hydrogen 2.775 N/A TYR 767.A N TRP 763.A O no hydrogen 2.698 N/A SER 768.A N TRP 764.A O no hydrogen 2.641 N/A SER 768.A OG TRP 764.A O no hydrogen 3.294 N/A SER 768.A OG LYS 765.A O no hydrogen 2.355 N/A LYS 769.A N LYS 765.A O no hydrogen 2.915 N/A VAL 770.A N LEU 766.A O no hydrogen 3.041 N/A LYS 771.A N TYR 767.A O no hydrogen 3.044 N/A