Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xr0_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 31.A O no hydrogen 3.204 N/A ARG 4.A NH1 GLN 50.A O no hydrogen 2.931 N/A ARG 4.A NH2 GLN 50.A O no hydrogen 2.772 N/A TRP 5.A N LEU 33.A O no hydrogen 2.777 N/A CYS 6.A N ALA 54.A O no hydrogen 3.042 N/A CYS 6.A SG VAL 35.A O no hydrogen 3.710 N/A ALA 7.A N VAL 35.A O no hydrogen 2.868 N/A THR 8.A N GLU 12.A OE1 no hydrogen 3.380 N/A THR 8.A OG1 GLU 12.A OE2 no hydrogen 3.243 N/A GLU 12.A N SER 9.A OG no hydrogen 3.264 N/A GLN 13.A N SER 9.A O no hydrogen 2.984 N/A HIS 14.A N ASP 10.A O no hydrogen 2.952 N/A LYS 15.A N PRO 11.A O no hydrogen 3.039 N/A LYS 15.A NZ MET 289.A O no hydrogen 2.735 N/A LYS 15.A NZ SER 291.A O no hydrogen 2.738 N/A LYS 15.A NZ LEU 300.A O no hydrogen 3.155 N/A CYS 16.A N GLU 12.A O no hydrogen 3.147 N/A GLY 17.A N GLN 13.A O no hydrogen 2.770 N/A ASN 18.A N HIS 14.A O no hydrogen 2.942 N/A ASN 18.A ND2 HIS 14.A O no hydrogen 2.733 N/A MET 19.A N LYS 15.A O no hydrogen 2.892 N/A SER 20.A N CYS 16.A O no hydrogen 2.820 N/A SER 20.A OG GLY 17.A O no hydrogen 3.015 N/A GLU 21.A N GLY 17.A O no hydrogen 3.391 N/A ALA 22.A N ASN 18.A O no hydrogen 3.129 N/A PHE 23.A N MET 19.A O no hydrogen 2.839 N/A ARG 24.A N SER 20.A O no hydrogen 3.030 N/A GLU 25.A N GLU 21.A O no hydrogen 3.154 N/A GLY 27.A N ARG 24.A O no hydrogen 2.836 N/A ILE 28.A N PHE 23.A O no hydrogen 3.098 N/A GLN 29.A NE2 GLY 27.A O no hydrogen 3.171 N/A LEU 33.A N VAL 3.A O no hydrogen 3.079 N/A VAL 35.A N TRP 5.A O no hydrogen 2.874 N/A ARG 36.A NE GLY 37.A O no hydrogen 2.814 N/A ARG 36.A NH1 ASP 10.A OD1 no hydrogen 2.778 N/A ARG 36.A NH2 GLY 37.A O no hydrogen 3.494 N/A GLY 37.A N ALA 7.A O no hydrogen 2.739 N/A THR 38.A N HIS 42.A ND1 no hydrogen 2.903 N/A THR 38.A OG1 HIS 42.A ND1 no hydrogen 3.244 N/A HIS 42.A N SER 39.A OG no hydrogen 2.840 N/A CYS 43.A N SER 39.A O no hydrogen 3.198 N/A CYS 43.A SG ALA 7.A O no hydrogen 3.697 N/A CYS 43.A SG SER 39.A O no hydrogen 3.491 N/A VAL 44.A N ALA 40.A O no hydrogen 3.263 N/A LEU 46.A N HIS 42.A O no hydrogen 2.998 N/A ILE 47.A N CYS 43.A O no hydrogen 2.854 N/A ALA 48.A N VAL 44.A O no hydrogen 2.909 N/A ALA 49.A N GLN 45.A O no hydrogen 2.751 N/A GLN 50.A N ILE 47.A O no hydrogen 2.919 N/A GLN 50.A NE2 ASP 266.A OD2 no hydrogen 3.463 N/A GLU 51.A N LEU 46.A O no hydrogen 2.899 N/A ALA 52.A N LEU 46.A O no hydrogen 3.320 N/A ASP 53.A N ARG 4.A O no hydrogen 2.855 N/A ALA 54.A N ARG 4.A O no hydrogen 3.494 N/A THR 56.A OG1 LEU 301.A O no hydrogen 3.154 N/A LEU 57.A N ALA 260.A O no hydrogen 2.831 N/A GLY 60.A N ASP 58.A OD2 no hydrogen 3.154 N/A GLY 60.A N THR 117.A OG1 no hydrogen 3.087 N/A ILE 62.A N ASP 58.A O no hydrogen 2.722 N/A TYR 63.A N GLY 59.A O no hydrogen 2.871 N/A GLU 64.A N GLY 60.A O no hydrogen 3.293 N/A ALA 65.A N ALA 61.A O no hydrogen 2.897 N/A GLY 66.A N ILE 62.A O no hydrogen 2.868 N/A LYS 67.A N TYR 63.A O no hydrogen 2.961 N/A LYS 67.A NZ TYR 63.A OH no hydrogen 3.454 N/A GLU 68.A N GLU 64.A O no hydrogen 3.047 N/A LEU 71.A N ALA 65.A O no hydrogen 3.147 N/A LYS 72.A N VAL 263.A O no hydrogen 2.824 N/A LYS 72.A NZ ALA 265.A O no hydrogen 2.903 N/A LYS 72.A NZ THR 267.A O no hydrogen 3.379 N/A VAL 74.A N VAL 261.A O no hydrogen 2.754 N/A GLY 76.A N VAL 310.A O no hydrogen 3.110 N/A GLU 77.A N HIS 259.A O no hydrogen 3.190 N/A VAL 78.A N GLU 308.A O no hydrogen 2.807 N/A TYR 79.A N GLY 84.A O no hydrogen 3.300 N/A TYR 79.A OH GLU 77.A OE1 no hydrogen 2.811 N/A GLY 84.A N ASP 80.A O no hydrogen 2.828 N/A THR 85.A OG1 THR 85.A O no hydrogen 2.533 N/A SER 86.A OG VAL 83.A O no hydrogen 3.120 N/A TYR 87.A N VAL 256.A O no hydrogen 2.962 N/A TYR 87.A OH TYR 190.A OH no hydrogen 3.309 N/A TYR 88.A N HIS 209.A ND1 no hydrogen 3.215 N/A ALA 89.A N ALA 254.A O no hydrogen 2.905 N/A VAL 90.A N VAL 207.A O no hydrogen 2.912 N/A VAL 92.A N ALA 205.A O no hydrogen 2.858 N/A VAL 93.A N GLU 234.A O no hydrogen 2.875 N/A ARG 94.A NH1 LEU 197.A O no hydrogen 2.744 N/A ARG 94.A NH1 GLY 202.A O no hydrogen 2.987 N/A ARG 94.A NH2 ASP 203.A OD1 no hydrogen 3.412 N/A ARG 95.A N ASP 232.A O no hydrogen 3.389 N/A ARG 95.A NH1 ASP 244.A OD2 no hydrogen 3.174 N/A ARG 95.A NH2 GLN 231.A O no hydrogen 2.850 N/A THR 100.A N THR 103.A OG1 no hydrogen 3.227 N/A THR 100.A OG1 GLY 240.A O no hydrogen 3.465 N/A THR 103.A N THR 100.A O no hydrogen 3.249 N/A THR 103.A OG1 THR 100.A O no hydrogen 3.451 N/A GLY 106.A N TYR 147.A O no hydrogen 2.787 N/A VAL 107.A N LEU 104.A O no hydrogen 3.278 N/A LYS 108.A NZ ALA 201.A O no hydrogen 3.546 N/A SER 109.A N GLY 150.A O no hydrogen 2.833 N/A SER 109.A OG HIS 111.A NE2 no hydrogen 2.466 N/A SER 109.A OG SER 151.A OG no hydrogen 3.318 N/A CYS 110.A N VAL 204.A O no hydrogen 2.813 N/A CYS 110.A SG VAL 204.A O no hydrogen 3.578 N/A HIS 111.A N CYS 152.A O no hydrogen 2.947 N/A HIS 111.A ND1 GLY 119.A O no hydrogen 2.584 N/A ILE 114.A N PRO 154.A O no hydrogen 3.017 N/A ASN 115.A ND2 GLU 64.A OE1 no hydrogen 2.726 N/A THR 117.A N ASP 58.A OD2 no hydrogen 2.792 N/A THR 117.A OG1 ASP 58.A OD2 no hydrogen 3.311 N/A THR 117.A OG1 TYR 325.A OH no hydrogen 2.784 N/A ASN 121.A N ARG 116.A O no hydrogen 2.847 N/A ASN 121.A ND2 TYR 325.A OH no hydrogen 2.885 N/A VAL 122.A N THR 117.A O no hydrogen 2.942 N/A VAL 124.A N TRP 120.A O no hydrogen 2.950 N/A GLY 125.A N ASN 121.A O no hydrogen 2.791 N/A TYR 126.A N VAL 122.A O no hydrogen 3.003 N/A TYR 126.A OH SER 130.A OG no hydrogen 3.263 N/A LEU 127.A N PRO 123.A O no hydrogen 3.137 N/A VAL 128.A N VAL 124.A O no hydrogen 3.288 N/A SER 130.A N TYR 126.A O no hydrogen 2.964 N/A SER 130.A OG TYR 126.A OH no hydrogen 3.263 N/A SER 130.A OG SER 130.A O no hydrogen 2.706 N/A SER 134.A OG ASP 620.A OD2 no hydrogen 2.703 N/A VAL 140.A N CYS 138.A O no hydrogen 3.157 N/A LYS 142.A N ASP 139.A OD1 no hydrogen 3.029 N/A LYS 142.A NZ ASP 146.A OD2 no hydrogen 3.368 N/A ALA 143.A N ASP 139.A O no hydrogen 3.453 N/A VAL 144.A N VAL 140.A O no hydrogen 3.144 N/A SER 145.A N LEU 141.A O no hydrogen 3.206 N/A ASP 146.A N LYS 142.A O no hydrogen 3.165 N/A TYR 147.A N ALA 143.A O no hydrogen 3.053 N/A PHE 148.A N VAL 144.A O no hydrogen 3.289 N/A GLY 149.A N VAL 107.A O no hydrogen 3.127 N/A SER 151.A N SER 164.A O no hydrogen 3.087 N/A SER 151.A OG SER 109.A OG no hydrogen 3.318 N/A CYS 152.A N SER 109.A O no hydrogen 3.036 N/A VAL 153.A N LEU 165.A O no hydrogen 2.735 N/A GLY 155.A N CYS 179.A O no hydrogen 3.221 N/A ALA 156.A N VAL 153.A O no hydrogen 3.348 N/A THR 159.A OG1 ALA 156.A O no hydrogen 2.981 N/A SER 162.A OG ALA 156.A O no hydrogen 3.082 N/A SER 162.A OG GLY 157.A O no hydrogen 2.651 N/A SER 164.A OG SER 145.A O no hydrogen 3.276 N/A LEU 165.A N TYR 161.A O no hydrogen 3.204 N/A CYS 166.A N SER 162.A O no hydrogen 2.858 N/A CYS 166.A SG ALA 156.A O no hydrogen 3.622 N/A ARG 167.A N SER 164.A O no hydrogen 3.478 N/A ARG 167.A NH2 GLU 163.A OE1 no hydrogen 2.622 N/A ARG 167.A NH2 GLU 163.A OE2 no hydrogen 3.480 N/A LEU 168.A N SER 151.A O no hydrogen 3.218 N/A ARG 170.A N GLU 185.A OE2 no hydrogen 3.256 N/A SER 173.A OG ASP 172.A OD1 no hydrogen 3.114 N/A SER 174.A OG ASP 172.A OD2 no hydrogen 3.083 N/A GLY 175.A N ASP 172.A O no hydrogen 3.211 N/A CYS 179.A N GLU 185.A OE1 no hydrogen 2.778 N/A CYS 179.A SG VAL 153.A O no hydrogen 3.199 N/A LYS 181.A NZ ASP 180.A OD1 no hydrogen 3.399 N/A SER 182.A OG THR 38.A O no hydrogen 2.539 N/A SER 182.A OG ASP 180.A OD2 no hydrogen 2.855 N/A GLU 185.A N SER 182.A O no hydrogen 3.102 N/A ARG 186.A NH2 ASP 172.A O no hydrogen 3.211 N/A TYR 187.A N GLU 185.A OE2 no hydrogen 3.084 N/A TYR 187.A OH GLU 199.A OE2 no hydrogen 2.608 N/A TYR 188.A N GLU 185.A O no hydrogen 3.105 N/A ASP 189.A N THR 112.A O no hydrogen 3.185 N/A TYR 190.A OH HIS 259.A NE2 no hydrogen 3.185 N/A GLY 192.A N TYR 188.A O no hydrogen 3.126 N/A ALA 193.A N ASP 189.A O no hydrogen 2.904 N/A PHE 194.A N TYR 190.A O no hydrogen 2.990 N/A ARG 195.A N SER 191.A O no hydrogen 3.048 N/A ARG 195.A NE GLU 199.A OE1 no hydrogen 2.745 N/A ARG 195.A NH1 GLU 199.A OE1 no hydrogen 3.272 N/A CYS 196.A N GLY 192.A O no hydrogen 2.844 N/A LEU 197.A N ALA 193.A O no hydrogen 3.380 N/A ALA 198.A N PHE 194.A O no hydrogen 3.147 N/A GLU 199.A N ARG 195.A O no hydrogen 2.824 N/A GLY 200.A N LEU 197.A O no hydrogen 3.197 N/A GLY 202.A N CYS 196.A O no hydrogen 3.209 N/A ASP 203.A N LYS 108.A O no hydrogen 2.818 N/A VAL 204.A N LYS 108.A O no hydrogen 3.123 N/A ALA 205.A N VAL 92.A O no hydrogen 2.950 N/A PHE 206.A N CYS 110.A O no hydrogen 3.272 N/A VAL 207.A N VAL 90.A O no hydrogen 3.038 N/A LYS 208.A NZ SER 305.A OG no hydrogen 3.256 N/A HIS 209.A N TYR 88.A O no hydrogen 2.992 N/A HIS 209.A ND1 TYR 88.A O no hydrogen 3.232 N/A SER 210.A OG GLU 214.A OE1 no hydrogen 3.225 N/A THR 211.A OG1 LYS 208.A O no hydrogen 3.273 N/A GLU 214.A N SER 210.A O no hydrogen 3.231 N/A ASN 215.A N VAL 212.A O no hydrogen 3.434 N/A ASN 215.A ND2 THR 211.A O no hydrogen 3.449 N/A THR 216.A OG1 VAL 212.A O no hydrogen 2.339 N/A THR 216.A OG1 SER 230.A OG no hydrogen 2.791 N/A ASP 217.A N LEU 228.A O no hydrogen 3.270 N/A LYS 219.A N THR 216.A O no hydrogen 2.965 N/A THR 220.A OG1 ASN 215.A O no hydrogen 2.637 N/A TRP 224.A N LEU 221.A O no hydrogen 3.213 N/A SER 230.A OG THR 216.A OG1 no hydrogen 2.791 N/A SER 230.A OG ASP 217.A OD1 no hydrogen 2.699 N/A ASP 232.A N LEU 229.A O no hydrogen 3.198 N/A GLU 234.A N VAL 93.A O no hydrogen 2.786 N/A LEU 236.A N ALA 91.A O no hydrogen 3.054 N/A CYS 237.A N SER 241.A O no hydrogen 2.896 N/A CYS 237.A SG SER 241.A O no hydrogen 3.498 N/A GLY 240.A N CYS 237.A O no hydrogen 3.101 N/A SER 241.A N ASP 239.A OD1 no hydrogen 2.758 N/A ARG 242.A NH1 ARG 94.A O no hydrogen 3.314 N/A ARG 242.A NH2 ARG 95.A O no hydrogen 3.155 N/A GLU 247.A N ASP 244.A O no hydrogen 3.130 N/A ARG 249.A NH1 GLU 82.A OE1 no hydrogen 2.885 N/A CYS 251.A N GLU 247.A O no hydrogen 3.032 N/A LEU 253.A N ALA 89.A O no hydrogen 2.864 N/A ARG 255.A NE TYR 88.A OH no hydrogen 2.842 N/A VAL 256.A N TYR 87.A O no hydrogen 2.772 N/A ALA 258.A N THR 85.A O no hydrogen 3.358 N/A HIS 259.A N TYR 79.A OH no hydrogen 3.036 N/A ALA 260.A N LEU 57.A O no hydrogen 3.076 N/A VAL 261.A N VAL 75.A O no hydrogen 2.616 N/A VAL 262.A N ILE 55.A O no hydrogen 2.763 N/A VAL 263.A N LYS 72.A O no hydrogen 3.078 N/A ARG 264.A NE ILE 47.A O no hydrogen 2.782 N/A ARG 264.A NH2 ALA 52.A O no hydrogen 3.223 N/A THR 267.A N ARG 264.A O no hydrogen 3.109 N/A LEU 271.A N ASP 268.A OD1 no hydrogen 3.098 N/A ILE 272.A N GLY 269.A O no hydrogen 3.180 N/A PHE 273.A N GLY 269.A O no hydrogen 3.412 N/A ARG 274.A N GLY 270.A O no hydrogen 3.036 N/A ARG 274.A NH1 GLN 29.A O no hydrogen 2.591 N/A ARG 274.A NH2 GLN 29.A O no hydrogen 3.026 N/A LEU 275.A N LEU 271.A O no hydrogen 3.231 N/A LEU 276.A N ILE 272.A O no hydrogen 3.165 N/A ASN 277.A N PHE 273.A O no hydrogen 2.763 N/A GLU 278.A N ARG 274.A O no hydrogen 2.926 N/A GLY 279.A N LEU 275.A O no hydrogen 3.419 N/A GLN 280.A N LEU 276.A O no hydrogen 2.814 N/A GLN 280.A NE2 LEU 309.A O no hydrogen 3.478 N/A ARG 281.A N ASN 277.A O no hydrogen 2.711 N/A LEU 282.A N GLU 278.A O no hydrogen 3.320 N/A SER 292.A OG GLN 297.A O no hydrogen 3.515 N/A SER 292.A OG ASP 304.A OD1 no hydrogen 2.949 N/A SER 292.A OG ASP 304.A OD2 no hydrogen 3.408 N/A TYR 295.A N SER 292.A O no hydrogen 3.390 N/A GLY 296.A N GLU 293.A O no hydrogen 3.201 N/A GLN 297.A NE2 GLY 296.A O no hydrogen 3.052 N/A LYS 298.A NZ GLU 214.A O no hydrogen 2.678 N/A LYS 298.A NZ LYS 219.A O no hydrogen 2.754 N/A ASP 299.A N ASP 304.A OD1 no hydrogen 2.914 N/A PHE 302.A N LEU 300.A O no hydrogen 2.729 N/A LYS 303.A N GLU 77.A OE2 no hydrogen 3.455 N/A LYS 303.A NZ ASP 189.A OD2 no hydrogen 3.400 N/A ASP 304.A N ASP 299.A OD1 no hydrogen 2.830 N/A SER 305.A OG GLU 214.A OE1 no hydrogen 2.682 N/A THR 306.A N LYS 303.A O no hydrogen 2.954 N/A THR 306.A OG1 LYS 303.A O no hydrogen 2.598 N/A SER 307.A N VAL 78.A O no hydrogen 2.757 N/A SER 307.A OG TYR 79.A O no hydrogen 2.365 N/A GLU 308.A N VAL 78.A O no hydrogen 3.294 N/A LEU 309.A N GLN 280.A OE1 no hydrogen 2.778 N/A VAL 310.A N GLY 76.A O no hydrogen 2.968 N/A GLN 315.A NE2 ILE 312.A O no hydrogen 3.298 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.675 N/A TRP 320.A N THR 316.A O no hydrogen 2.994 N/A TRP 320.A NE1 ALA 258.A O no hydrogen 3.125 N/A LEU 321.A N TYR 317.A O no hydrogen 3.162 N/A TYR 325.A OH THR 117.A OG1 no hydrogen 2.784 N/A LEU 326.A N GLY 322.A O no hydrogen 3.181 N/A HIS 327.A N HIS 323.A O no hydrogen 3.011 N/A ALA 328.A N GLU 324.A O no hydrogen 3.004 N/A MET 329.A N TYR 325.A O no hydrogen 3.065 N/A LYS 330.A N LEU 326.A O no hydrogen 2.933 N/A LYS 330.A N HIS 327.A O no hydrogen 2.983 N/A GLY 331.A N HIS 327.A O no hydrogen 3.319 N/A LEU 332.A N ALA 328.A O no hydrogen 3.258 N/A LEU 333.A N MET 329.A O no hydrogen 3.015 N/A ARG 338.A N ASP 335.A O no hydrogen 3.194 N/A LEU 343.A N GLU 371.A O no hydrogen 2.785 N/A ARG 344.A N ASP 393.A OD2 no hydrogen 3.067 N/A ARG 344.A NE ASP 393.A OD2 no hydrogen 3.139 N/A ARG 344.A NH1 GLU 390.A O no hydrogen 3.000 N/A ARG 344.A NH1 ASP 393.A OD1 no hydrogen 2.823 N/A ARG 344.A NH2 GLU 390.A O no hydrogen 3.463 N/A TRP 345.A N GLN 373.A O no hydrogen 2.718 N/A CYS 346.A N ALA 394.A O no hydrogen 2.951 N/A VAL 347.A N VAL 375.A O no hydrogen 2.986 N/A LEU 348.A N GLU 352.A OE1 no hydrogen 2.850 N/A GLU 352.A N SER 349.A OG no hydrogen 3.151 N/A ILE 353.A N SER 349.A O no hydrogen 2.887 N/A GLN 354.A N THR 350.A O no hydrogen 2.929 N/A LYS 355.A N PRO 351.A O no hydrogen 2.953 N/A LYS 355.A NZ MET 637.A O no hydrogen 2.688 N/A LYS 355.A NZ ASP 639.A O no hydrogen 3.150 N/A LYS 355.A NZ LEU 648.A O no hydrogen 2.709 N/A CYS 356.A N GLU 352.A O no hydrogen 2.973 N/A GLY 357.A N ILE 353.A O no hydrogen 2.897 N/A ASP 358.A N GLN 354.A O no hydrogen 2.890 N/A MET 359.A N LYS 355.A O no hydrogen 2.843 N/A ALA 360.A N CYS 356.A O no hydrogen 2.921 N/A VAL 361.A N GLY 357.A O no hydrogen 3.257 N/A ALA 362.A N ASP 358.A O no hydrogen 2.963 N/A PHE 363.A N MET 359.A O no hydrogen 2.970 N/A ARG 364.A N ALA 360.A O no hydrogen 3.018 N/A ARG 364.A NH1 GLU 371.A OE1 no hydrogen 3.190 N/A ARG 365.A N VAL 361.A O no hydrogen 2.905 N/A ARG 365.A NH2 ASN 633.A O no hydrogen 2.686 N/A ARG 365.A NH2 GLY 634.A O no hydrogen 3.039 N/A GLN 366.A N PHE 363.A O no hydrogen 2.944 N/A ARG 367.A N ARG 364.A O no hydrogen 2.905 N/A LYS 369.A NZ GLU 371.A OE2 no hydrogen 3.236 N/A GLU 371.A N PRO 341.A O no hydrogen 3.151 N/A GLN 373.A N LEU 343.A O no hydrogen 3.077 N/A VAL 375.A N TRP 345.A O no hydrogen 2.883 N/A ALA 377.A N VAL 347.A O no hydrogen 3.045 N/A LYS 378.A N HIS 382.A ND1.A no hydrogen 2.987 N/A GLN 381.A N SER 379.A OG no hydrogen 3.075 N/A GLN 381.A NE2 TYR 409.A OH no hydrogen 3.526 N/A HIS 382.A N.A SER 379.A OG no hydrogen 3.342 N/A HIS 382.A N.B SER 379.A OG no hydrogen 3.344 N/A CYS 383.A N SER 379.A O no hydrogen 2.952 N/A CYS 383.A SG SER 379.A O no hydrogen 3.980 N/A MET 384.A N PRO 380.A O no hydrogen 3.440 N/A GLU 385.A N GLN 381.A O no hydrogen 3.338 N/A ARG 386.A N HIS 382.A O.A no hydrogen 3.210 N/A ARG 386.A N HIS 382.A O.B no hydrogen 3.174 N/A ARG 386.A NE GLN 391.A OE1 no hydrogen 3.177 N/A ILE 387.A N CYS 383.A O no hydrogen 2.729 N/A GLN 388.A N MET 384.A O no hydrogen 3.088 N/A ALA 389.A N GLU 385.A O no hydrogen 3.124 N/A GLU 390.A N ILE 387.A O no hydrogen 2.959 N/A GLN 391.A N ARG 386.A O no hydrogen 3.078 N/A VAL 392.A N ARG 386.A O no hydrogen 3.284 N/A ASP 393.A N ARG 344.A O no hydrogen 2.892 N/A ALA 394.A N ARG 344.A O no hydrogen 3.192 N/A THR 396.A OG1 LEU 649.A O no hydrogen 2.768 N/A LEU 397.A N ALA 603.A O no hydrogen 3.011 N/A ILE 402.A N SER 398.A O no hydrogen 2.857 N/A ILE 402.A N GLY 399.A O no hydrogen 3.154 N/A TYR 403.A N GLY 399.A O no hydrogen 3.332 N/A TYR 403.A OH GLU 679.A OE2 no hydrogen 3.017 N/A THR 404.A N GLU 400.A O no hydrogen 3.451 N/A THR 404.A OG1 GLU 400.A O no hydrogen 3.245 N/A ALA 405.A N ASP 401.A O no hydrogen 3.198 N/A ALA 405.A N ILE 402.A O no hydrogen 3.050 N/A GLY 406.A N ILE 402.A O no hydrogen 3.046 N/A LYS 407.A N TYR 403.A O no hydrogen 2.989 N/A THR 408.A N THR 404.A O no hydrogen 3.275 N/A TYR 409.A N ALA 405.A O no hydrogen 2.950 N/A LEU 411.A N ALA 405.A O no hydrogen 3.130 N/A VAL 412.A N VAL 606.A O no hydrogen 2.840 N/A ALA 414.A N VAL 604.A O no hydrogen 2.714 N/A GLY 416.A N VAL 658.A O no hydrogen 2.812 N/A GLU 417.A N HIS 602.A O no hydrogen 3.006 N/A HIS 418.A N ARG 656.A O no hydrogen 2.810 N/A TYR 419.A OH GLU 417.A OE1 no hydrogen 2.801 N/A ASP 423.A N ALA 420.A O no hydrogen 2.924 N/A SER 425.A N ASP 423.A OD1 no hydrogen 3.175 N/A SER 425.A OG ASP 423.A OD1 no hydrogen 2.693 N/A TYR 429.A N HIS 552.A ND1 no hydrogen 3.170 N/A VAL 430.A N ALA 597.A O no hydrogen 2.832 N/A VAL 431.A N VAL 550.A O no hydrogen 2.912 N/A VAL 433.A N ALA 548.A O no hydrogen 2.848 N/A VAL 434.A N GLU 577.A O no hydrogen 2.905 N/A ARG 435.A NE LEU 540.A O no hydrogen 3.341 N/A ARG 435.A NH2 GLY 545.A O no hydrogen 2.862 N/A ARG 435.A NH2 ASP 546.A OD1 no hydrogen 3.071 N/A ARG 436.A N ASP 575.A O no hydrogen 2.935 N/A ARG 436.A NH1 GLU 574.A O no hydrogen 2.837 N/A ARG 436.A NH1 GLU 587.A OE2 no hydrogen 3.047 N/A ARG 436.A NH2 GLU 587.A OE1 no hydrogen 2.743 N/A ARG 436.A NH2 GLU 587.A OE2 no hydrogen 3.074 N/A SER 439.A OG ASP 437.A OD1 no hydrogen 3.311 N/A SER 439.A OG HIS 440.A ND1 no hydrogen 2.931 N/A HIS 440.A ND1 SER 439.A OG no hydrogen 2.931 N/A ALA 441.A N SER 438.A O no hydrogen 3.167 N/A THR 443.A N GLU 446.A OE1 no hydrogen 2.898 N/A THR 443.A OG1 GLU 446.A OE1 no hydrogen 3.511 N/A GLU 446.A N THR 443.A O no hydrogen 2.972 N/A GLY 449.A N PHE 490.A O no hydrogen 2.861 N/A LYS 450.A N LEU 447.A O no hydrogen 3.397 N/A ARG 451.A N ASP 546.A OD2 no hydrogen 3.075 N/A ARG 451.A NE ASP 546.A OD2 no hydrogen 2.883 N/A ARG 451.A NH2 ASP 546.A OD1 no hydrogen 2.914 N/A ARG 451.A NH2 ASP 546.A OD2 no hydrogen 3.376 N/A SER 452.A N ALA 493.A O no hydrogen 3.010 N/A SER 452.A OG HIS 454.A NE2 no hydrogen 2.873 N/A SER 452.A OG SER 494.A OG no hydrogen 3.252 N/A CYS 453.A N VAL 547.A O no hydrogen 2.817 N/A HIS 454.A N CYS 495.A O no hydrogen 3.099 N/A HIS 454.A ND1 GLY 462.A O no hydrogen 2.675 N/A HIS 454.A NE2 SER 452.A OG no hydrogen 2.873 N/A PHE 457.A N PRO 497.A O no hydrogen 2.870 N/A SER 459.A N GLY 456.A O no hydrogen 3.047 N/A ALA 461.A N TYR 533.A OH no hydrogen 3.343 N/A GLY 462.A N SER 459.A OG no hydrogen 3.317 N/A TRP 463.A N SER 459.A O no hydrogen 2.813 N/A ASP 464.A N SER 459.A O no hydrogen 2.889 N/A VAL 465.A N PRO 460.A O no hydrogen 2.894 N/A VAL 467.A N TRP 463.A O no hydrogen 2.974 N/A GLY 468.A N ASP 464.A O no hydrogen 3.042 N/A ALA 469.A N VAL 465.A O no hydrogen 2.877 N/A LEU 470.A N PRO 466.A O no hydrogen 2.966 N/A ILE 471.A N VAL 467.A O no hydrogen 3.088 N/A GLN 472.A N GLY 468.A O no hydrogen 3.199 N/A ARG 473.A N ALA 469.A O no hydrogen 2.874 N/A ARG 473.A NH1 PRO 581.A O no hydrogen 3.392 N/A ARG 473.A NH2 PRO 581.A O no hydrogen 3.344 N/A GLY 474.A N ILE 471.A O no hydrogen 3.028 N/A PHE 475.A N LEU 470.A O no hydrogen 2.906 N/A ILE 476.A N LEU 470.A O no hydrogen 3.145 N/A ARG 477.A NE GLY 474.A O no hydrogen 2.959 N/A ARG 477.A NH2 GLY 474.A O no hydrogen 3.068 N/A CYS 481.A SG ASP 480.A O no hydrogen 3.012 N/A ASP 482.A N LYS 479.A O no hydrogen 3.072 N/A THR 485.A OG1 GLU 489.A OE2 no hydrogen 3.352 N/A VAL 487.A N VAL 483.A O no hydrogen 3.085 N/A SER 488.A N LEU 484.A O no hydrogen 3.105 N/A SER 488.A OG LEU 484.A O no hydrogen 3.267 N/A SER 488.A OG THR 485.A O no hydrogen 3.007 N/A GLU 489.A N THR 485.A O no hydrogen 3.052 N/A PHE 490.A N VAL 487.A O no hydrogen 3.298 N/A PHE 491.A N VAL 487.A O no hydrogen 3.167 N/A ASN 492.A N LYS 450.A O no hydrogen 3.050 N/A SER 494.A N SER 507.A O no hydrogen 2.929 N/A SER 494.A OG SER 452.A OG no hydrogen 3.252 N/A CYS 495.A N SER 452.A O no hydrogen 3.042 N/A VAL 496.A N LEU 508.A O no hydrogen 2.743 N/A VAL 498.A N CYS 522.A O no hydrogen 3.134 N/A ASN 499.A ND2 GLY 524.A O no hydrogen 2.888 N/A TYR 504.A OH VAL 496.A O no hydrogen 2.695 N/A SER 507.A OG SER 488.A O no hydrogen 3.256 N/A LEU 508.A N PRO 505.A O no hydrogen 3.232 N/A CYS 509.A N SER 506.A O no hydrogen 3.004 N/A ALA 510.A N SER 507.A O no hydrogen 3.301 N/A LEU 511.A N SER 494.A O no hydrogen 3.118 N/A CYS 512.A N CYS 509.A O no hydrogen 3.296 N/A CYS 512.A SG CYS 509.A O no hydrogen 3.990 N/A VAL 513.A N GLU 528.A OE2 no hydrogen 2.924 N/A GLY 514.A N GLU 528.A OE2 no hydrogen 3.107 N/A ASP 515.A N ARG 519.A O no hydrogen 2.637 N/A GLY 518.A N ASP 515.A O no hydrogen 2.900 N/A LYS 521.A NZ.B GLY 518.A O no hydrogen 2.974 N/A CYS 522.A N GLU 528.A OE1 no hydrogen 2.641 N/A CYS 522.A SG VAL 496.A O no hydrogen 3.661 N/A VAL 523.A N ASN 520.A O no hydrogen 3.413 N/A ASN 525.A N VAL 523.A O no hydrogen 2.923 N/A GLN 527.A N ASN 525.A OD1 no hydrogen 3.116 N/A GLN 527.A NE2 ASN 520.A OD1 no hydrogen 2.952 N/A GLU 528.A N ASN 525.A O no hydrogen 3.075 N/A ARG 529.A N GLY 514.A O no hydrogen 3.184 N/A ARG 529.A NE GLY 514.A O no hydrogen 2.852 N/A TYR 530.A N GLU 528.A OE2 no hydrogen 3.101 N/A TYR 530.A OH GLU 542.A OE1 no hydrogen 2.860 N/A TYR 531.A N GLU 528.A O no hydrogen 3.102 N/A GLY 532.A N ALA 455.A O no hydrogen 2.949 N/A TYR 533.A OH SER 459.A OG no hydrogen 2.996 N/A ALA 536.A N GLY 532.A O no hydrogen 2.760 N/A PHE 537.A N TYR 533.A O no hydrogen 2.908 N/A ARG 538.A N ARG 534.A O no hydrogen 2.809 N/A CYS 539.A N GLY 535.A O no hydrogen 2.820 N/A LEU 540.A N ALA 536.A O no hydrogen 3.295 N/A VAL 541.A N PHE 537.A O no hydrogen 3.082 N/A GLU 542.A N ARG 538.A O no hydrogen 2.918 N/A ASN 543.A N LEU 540.A O no hydrogen 2.948 N/A ASN 543.A ND2 VAL 541.A O no hydrogen 3.597 N/A ALA 544.A N CYS 539.A O no hydrogen 3.069 N/A GLY 545.A N CYS 539.A O no hydrogen 3.231 N/A ASP 546.A N ARG 451.A O no hydrogen 2.746 N/A VAL 547.A N ARG 451.A O no hydrogen 3.307 N/A ALA 548.A N VAL 433.A O no hydrogen 2.996 N/A PHE 549.A N CYS 453.A O no hydrogen 3.329 N/A VAL 550.A N VAL 431.A O no hydrogen 2.990 N/A ARG 551.A N THR 554.A OG1 no hydrogen 3.260 N/A HIS 552.A N TYR 429.A O no hydrogen 2.974 N/A THR 553.A OG1 ASP 557.A OD2 no hydrogen 3.511 N/A THR 554.A N ARG 551.A O no hydrogen 2.936 N/A THR 554.A OG1 ARG 551.A O no hydrogen 3.075 N/A ASP 557.A N THR 553.A O no hydrogen 3.063 N/A ASN 558.A N VAL 555.A O no hydrogen 3.236 N/A ASN 558.A ND2 THR 554.A O no hydrogen 2.878 N/A THR 559.A OG1 VAL 555.A O no hydrogen 2.447 N/A ASN 560.A N LEU 571.A O no hydrogen 2.869 N/A ASN 560.A ND2 SER 573.A OG no hydrogen 3.140 N/A HIS 562.A N THR 559.A O no hydrogen 3.183 N/A HIS 562.A ND1 PHE 556.A O no hydrogen 2.789 N/A ASN 563.A ND2 ASN 558.A OD1 no hydrogen 2.987 N/A ASN 563.A ND2 GLU 565.A OE2 no hydrogen 2.852 N/A GLU 565.A N ASN 563.A OD1 no hydrogen 2.969 N/A ALA 568.A N GLU 565.A O no hydrogen 2.978 N/A LEU 571.A N ALA 568.A O no hydrogen 3.378 N/A SER 573.A N ASN 560.A OD1 no hydrogen 3.267 N/A SER 573.A OG GLU 574.A OE1 no hydrogen 3.500 N/A ASP 575.A N ARG 572.A O no hydrogen 3.346 N/A TYR 576.A N SER 573.A O no hydrogen 3.117 N/A GLU 577.A N VAL 434.A O no hydrogen 2.890 N/A LEU 578.A N ALA 586.A O no hydrogen 2.831 N/A LEU 579.A N ALA 432.A O no hydrogen 3.042 N/A CYS 580.A N ALA 584.A O no hydrogen 2.982 N/A CYS 580.A SG ALA 584.A O no hydrogen 3.141 N/A GLY 583.A N CYS 580.A O no hydrogen 3.018 N/A ALA 584.A N ASN 582.A OD1 no hydrogen 3.007 N/A ARG 585.A NE GLU 577.A OE1 no hydrogen 2.916 N/A ARG 585.A NH2 GLU 577.A OE1 no hydrogen 2.785 N/A ALA 586.A N LEU 578.A O no hydrogen 2.984 N/A GLN 590.A N GLU 587.A O no hydrogen 2.797 N/A ALA 593.A N GLN 590.A O no hydrogen 3.047 N/A CYS 594.A N PHE 591.A O no hydrogen 3.232 N/A ASN 595.A ND2 PHE 591.A O no hydrogen 2.907 N/A LEU 596.A N VAL 430.A O no hydrogen 2.741 N/A ILE 599.A N TYR 428.A O no hydrogen 2.764 N/A HIS 602.A N TYR 419.A OH no hydrogen 3.196 N/A ALA 603.A N LEU 397.A O no hydrogen 3.270 N/A VAL 604.A N ALA 415.A O no hydrogen 2.732 N/A MET 605.A N VAL 395.A O no hydrogen 2.913 N/A VAL 606.A N VAL 412.A O no hydrogen 2.888 N/A ARG 607.A NE ASP 609.A OD1 no hydrogen 3.330 N/A ARG 607.A NE ASP 609.A OD2 no hydrogen 3.548 N/A ARG 607.A NH1 ILE 387.A O no hydrogen 2.812 N/A ARG 607.A NH1 VAL 392.A O no hydrogen 2.753 N/A ARG 607.A NH1 ASP 393.A OD1 no hydrogen 3.209 N/A ARG 607.A NH2 ASP 393.A OD1 no hydrogen 3.234 N/A THR 610.A N ARG 607.A O no hydrogen 3.075 N/A THR 610.A OG1 ASP 609.A OD1 no hydrogen 3.368 N/A ASN 611.A ND2 GLY 331.A O no hydrogen 3.310 N/A PHE 613.A N ASN 611.A OD1 no hydrogen 3.170 N/A THR 614.A N ASN 611.A O no hydrogen 3.202 N/A THR 614.A OG1 ASN 611.A O no hydrogen 2.644 N/A TYR 616.A N ILE 612.A O no hydrogen 3.095 N/A GLY 617.A N PHE 613.A O no hydrogen 3.055 N/A LEU 618.A N THR 614.A O no hydrogen 2.948 N/A LEU 619.A N VAL 615.A O no hydrogen 3.076 N/A ASP 620.A N TYR 616.A O no hydrogen 2.723 N/A LYS 621.A N GLY 617.A O no hydrogen 3.003 N/A ALA 622.A N LEU 618.A O no hydrogen 2.861 N/A GLN 623.A N LEU 619.A O no hydrogen 2.849 N/A GLN 623.A NE2 ASP 620.A OD1 no hydrogen 2.934 N/A GLN 623.A NE2 ALA 657.A O no hydrogen 3.012 N/A ASP 624.A N ASP 620.A O no hydrogen 3.072 N/A LEU 625.A N ALA 622.A O no hydrogen 2.856 N/A PHE 626.A N ALA 622.A O no hydrogen 2.779 N/A GLY 627.A N GLN 623.A O no hydrogen 2.905 N/A ASN 631.A N ASP 628.A O no hydrogen 3.081 N/A ASN 631.A ND2 ASP 628.A O no hydrogen 2.820 N/A ASN 631.A ND2 PHE 635.A O no hydrogen 2.797 N/A ASN 633.A N ASN 631.A OD1 no hydrogen 2.901 N/A LYS 636.A NZ ASN 631.A O no hydrogen 2.961 N/A MET 637.A N PHE 626.A O no hydrogen 2.907 N/A SER 640.A OG ASP 652.A OD1 no hydrogen 2.701 N/A SER 640.A OG ASP 652.A OD2 no hydrogen 3.437 N/A SER 641.A N ASP 639.A OD2 no hydrogen 3.127 N/A SER 641.A OG ASP 639.A OD1 no hydrogen 3.178 N/A SER 641.A OG ASP 639.A OD2 no hydrogen 3.012 N/A TYR 643.A N SER 640.A O no hydrogen 3.418 N/A TYR 643.A OH ASP 358.A OD2 no hydrogen 2.800 N/A ASP 647.A N ASP 652.A OD2 no hydrogen 2.990 N/A LEU 648.A N SER 640.A OG no hydrogen 3.424 N/A LEU 649.A N GLU 352.A OE2 no hydrogen 3.203 N/A PHE 650.A N LEU 648.A O no hydrogen 2.735 N/A LYS 651.A N GLU 417.A OE2 no hydrogen 3.229 N/A LYS 651.A NZ ASP 647.A OD2 no hydrogen 3.521 N/A ASP 652.A N ASP 647.A OD1 no hydrogen 2.822 N/A THR 654.A N LYS 651.A O no hydrogen 2.980 N/A THR 654.A OG1 LYS 651.A O no hydrogen 2.891 N/A VAL 655.A N HIS 418.A O no hydrogen 2.826 N/A ARG 656.A N HIS 418.A O no hydrogen 3.276 N/A ARG 656.A NH1.A TYR 616.A OH no hydrogen 2.667 N/A ALA 657.A N GLN 623.A OE1 no hydrogen 2.841 N/A VAL 658.A N GLY 416.A O no hydrogen 2.713 N/A LYS 663.A N VAL 660.A O no hydrogen 2.996 N/A ARG 667.A NE TYR 666.A OH no hydrogen 3.187 N/A ARG 667.A NH1 GLU 679.A OE1 no hydrogen 3.270 N/A ARG 667.A NH1 GLU 679.A OE2 no hydrogen 2.714 N/A TRP 669.A N THR 665.A O no hydrogen 2.972 N/A TRP 669.A NE1 PRO 601.A O no hydrogen 3.012 N/A LEU 670.A N TYR 666.A O no hydrogen 3.094 N/A VAL 675.A N GLY 671.A O no hydrogen 3.216 N/A ALA 676.A N LEU 672.A O no hydrogen 2.962 N/A LEU 678.A N TYR 674.A O no hydrogen 3.207 N/A GLU 679.A N VAL 675.A O no hydrogen 2.820 N/A GLY 680.A N ALA 676.A O no hydrogen 2.822 N/A MET 681.A N ALA 677.A O no hydrogen 3.194 N/A MET 681.A N LEU 678.A O no hydrogen 3.292 N/A SER 682.A N LEU 678.A O no hydrogen 3.281 N/A SER 682.A N GLU 679.A O no hydrogen 3.225 N/A SER 682.A OG LEU 678.A O no hydrogen 3.056 N/A