Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2grx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ILE 2.A O no hydrogen 2.380 N/A GLN 11.A NE2 GLN 11.A O no hydrogen 3.609 N/A TRP 15.A N SER 13.A OG no hydrogen 3.057 N/A GLY 16.A N SER 13.A OG no hydrogen 3.198 N/A ALA 22.A N THR 20.A OG1 no hydrogen 3.351 N/A ARG 24.A N GLU 12.A OE1 no hydrogen 2.684 N/A ARG 24.A NH1 ARG 520.A O no hydrogen 3.554 N/A ARG 24.A NH2 PRO 517.A O no hydrogen 2.685 N/A GLN 25.A N GLU 12.A OE1 no hydrogen 2.531 N/A SER 26.A N THR 34.A O no hydrogen 3.092 N/A SER 26.A OG GLU 123.A OE1 no hydrogen 3.526 N/A SER 26.A OG GLU 123.A OE2 no hydrogen 2.939 N/A THR 28.A N SER 26.A OG no hydrogen 3.021 N/A THR 28.A OG1 GLU 123.A OE2 no hydrogen 2.517 N/A THR 30.A OG1 THR 32.A O no hydrogen 3.437 N/A THR 30.A OG1 THR 32.A OG1 no hydrogen 2.762 N/A LYS 31.A NZ ASP 351.A OD1 no hydrogen 2.604 N/A THR 32.A OG1 THR 30.A O no hydrogen 3.013 N/A THR 32.A OG1 THR 30.A OG1 no hydrogen 2.762 N/A THR 32.A OG1 GLN 427.A OE1 no hydrogen 2.879 N/A THR 34.A N SER 26.A O no hydrogen 3.043 N/A THR 34.A OG1 THR 32.A O no hydrogen 3.201 N/A ILE 36.A N ARG 24.A O no hydrogen 2.939 N/A GLN 37.A N GLN 37.A OE1 no hydrogen 2.498 N/A LYS 38.A N PRO 35.A O no hydrogen 2.917 N/A VAL 39.A N ILE 36.A O no hydrogen 2.925 N/A GLN 41.A NE2 ARG 126.A O no hydrogen 3.026 N/A GLN 41.A NE2 PRO 128.A O no hydrogen 3.104 N/A SER 44.A OG ILE 43.A O no hydrogen 2.923 N/A SER 44.A OG GLU 561.A OE1 no hydrogen 3.535 N/A SER 44.A OG GLU 561.A OE2 no hydrogen 3.264 N/A VAL 46.A N ALA 122.A O no hydrogen 2.827 N/A THR 47.A OG1 ILE 21.A O no hydrogen 3.102 N/A MET 51.A N THR 47.A O no hydrogen 2.741 N/A ALA 52.A N ALA 48.A O no hydrogen 2.784 N/A LEU 53.A N MET 51.A O no hydrogen 2.374 N/A HIS 54.A N MET 51.A O no hydrogen 2.834 N/A GLN 55.A N MET 51.A O no hydrogen 3.173 N/A LYS 57.A N GLU 61.A OE1 no hydrogen 2.928 N/A LYS 57.A NZ GLN 693.A OE1 no hydrogen 2.559 N/A SER 58.A OG ASN 78.A OD1 no hydrogen 3.056 N/A LYS 60.A NZ SER 77.A O no hydrogen 2.807 N/A LYS 60.A NZ TYR 80.A O no hydrogen 3.181 N/A ALA 62.A N VAL 59.A O no hydrogen 3.182 N/A LEU 63.A N LYS 60.A O no hydrogen 2.838 N/A THR 66.A N LEU 63.A O no hydrogen 3.183 N/A GLY 68.A N THR 577.A OG1 no hydrogen 3.239 N/A SER 70.A N ILE 84.A O no hydrogen 3.351 N/A GLY 72.A N SER 70.A OG no hydrogen 3.396 N/A THR 73.A OG1 HIS 82.A ND1 no hydrogen 3.393 N/A THR 73.A OG1 HIS 82.A O no hydrogen 2.902 N/A GLY 75.A N GLY 72.A O no hydrogen 2.810 N/A SER 77.A N ARG 74.A O no hydrogen 3.402 N/A SER 77.A OG TYR 236.A O no hydrogen 2.972 N/A THR 79.A N SER 77.A OG no hydrogen 3.341 N/A THR 79.A OG1 SER 77.A OG no hydrogen 3.312 N/A THR 79.A OG1 TYR 236.A O no hydrogen 3.335 N/A TYR 80.A OH TYR 109.A O no hydrogen 2.704 N/A TYR 80.A OH TYR 268.A OH no hydrogen 2.660 N/A ILE 85.A N PHE 88.A O no hydrogen 2.836 N/A ARG 86.A N GLY 68.A O no hydrogen 3.086 N/A ARG 86.A NE GLU 559.A OE1 no hydrogen 3.099 N/A ARG 86.A NH1 GLU 510.A OE1 no hydrogen 3.009 N/A ARG 86.A NH2 GLU 559.A OE2 no hydrogen 2.740 N/A PHE 88.A N ILE 85.A O no hydrogen 3.354 N/A GLN 95.A NE2 ALA 112.A O no hydrogen 3.326 N/A ASN 96.A ND2 GLY 140.A O no hydrogen 3.031 N/A ASN 97.A ND2 ASP 81.A O no hydrogen 3.318 N/A TYR 98.A N LEU 142.A O no hydrogen 2.441 N/A LEU 99.A N LEU 102.A O no hydrogen 2.753 N/A ASN 100.A N MET 144.A O no hydrogen 2.728 N/A LEU 102.A N LEU 99.A O no hydrogen 3.166 N/A LYS 103.A NZ ASN 96.A OD1 no hydrogen 2.714 N/A LEU 104.A N ASN 97.A O no hydrogen 2.803 N/A GLN 105.A NE2 GLY 106.A O no hydrogen 3.274 N/A ASN 107.A N ASN 110.A O no hydrogen 2.959 N/A ASN 107.A ND2 ASN 415.A OD1 no hydrogen 3.467 N/A ASN 110.A N ASN 107.A O no hydrogen 2.587 N/A ASN 110.A ND2 ASN 298.A O no hydrogen 3.052 N/A ASN 110.A ND2 ASN 378.A OD1 no hydrogen 3.107 N/A VAL 113.A N GLU 272.A OE2 no hydrogen 2.601 N/A ASP 115.A N TYR 227.A OH no hydrogen 3.059 N/A TYR 117.A N ASP 115.A OD1 no hydrogen 2.616 N/A MET 118.A N ASP 115.A O no hydrogen 3.276 N/A LEU 119.A N PRO 116.A O no hydrogen 2.576 N/A GLU 120.A N VAL 145.A O no hydrogen 3.077 N/A ARG 121.A NH1 SER 13.A O no hydrogen 2.907 N/A ALA 122.A N VAL 46.A O no hydrogen 2.881 N/A GLU 123.A N ASN 143.A O no hydrogen 2.727 N/A ILE 124.A N SER 44.A O no hydrogen 3.093 N/A MET 125.A N LEU 141.A O no hydrogen 3.052 N/A ARG 126.A NE GLU 559.A OE2 no hydrogen 2.214 N/A ARG 126.A NH1 SER 44.A OG no hydrogen 2.736 N/A ARG 126.A NH2 GLU 559.A OE2 no hydrogen 2.461 N/A SER 130.A OG GLY 134.A O no hydrogen 2.950 N/A LEU 132.A N VAL 129.A O no hydrogen 2.613 N/A TYR 133.A N VAL 129.A O no hydrogen 2.958 N/A SER 136.A N PHE 488.A O no hydrogen 2.993 N/A SER 136.A OG SER 137.A O no hydrogen 3.375 N/A SER 137.A OG ALA 89.A O no hydrogen 3.286 N/A SER 137.A OG PRO 138.A O no hydrogen 3.302 N/A GLY 140.A N GLY 127.A O no hydrogen 3.302 N/A LEU 142.A N ASN 96.A O no hydrogen 3.172 N/A ASN 143.A N GLU 123.A O no hydrogen 2.906 N/A MET 144.A N TYR 98.A O no hydrogen 3.045 N/A VAL 145.A N ARG 121.A O no hydrogen 2.984 N/A SER 146.A OG ASN 100.A OD1 no hydrogen 2.704 N/A LYS 147.A N MET 118.A O no hydrogen 3.017 N/A LYS 147.A NZ TYR 117.A O no hydrogen 2.689 N/A LYS 147.A NZ ASP 172.A OD2 no hydrogen 3.323 N/A ARG 148.A NH2 SER 278.A OG no hydrogen 3.333 N/A THR 150.A N SER 174.A OG no hydrogen 3.031 N/A THR 150.A OG1 GLU 152.A O no hydrogen 2.986 N/A THR 150.A OG1 SER 174.A OG no hydrogen 3.405 N/A GLU 156.A N ASP 172.A O no hydrogen 3.183 N/A VAL 157.A N PHE 700.A O no hydrogen 3.025 N/A GLN 158.A N GLY 170.A O no hydrogen 2.598 N/A PHE 159.A N ALA 698.A O no hydrogen 2.857 N/A LYS 160.A N GLN 168.A O no hydrogen 2.949 N/A ALA 161.A N ALA 696.A O no hydrogen 2.871 N/A GLY 162.A N LEU 166.A O no hydrogen 3.101 N/A THR 163.A N VAL 694.A O no hydrogen 2.822 N/A LEU 166.A N GLY 162.A O no hydrogen 3.302 N/A PHE 167.A N SER 193.A O no hydrogen 2.778 N/A GLN 168.A N LYS 160.A O no hydrogen 2.621 N/A THR 169.A N ALA 191.A O no hydrogen 3.028 N/A GLY 170.A N GLN 158.A O no hydrogen 2.846 N/A PHE 171.A N GLY 189.A O no hydrogen 2.743 N/A ASP 172.A N GLU 156.A O no hydrogen 2.786 N/A PHE 173.A N LEU 187.A O no hydrogen 3.003 N/A SER 174.A N LEU 154.A O no hydrogen 2.887 N/A SER 174.A OG THR 150.A OG1 no hydrogen 3.405 N/A SER 174.A OG TYR 185.A O no hydrogen 2.727 N/A ASP 175.A N TYR 185.A O no hydrogen 3.163 N/A SER 176.A OG THR 151.A O no hydrogen 2.813 N/A LEU 177.A N TYR 183.A O no hydrogen 2.720 N/A GLY 181.A N ASP 178.A O no hydrogen 3.306 N/A VAL 182.A N ASP 178.A OD1 no hydrogen 2.457 N/A TYR 183.A N ASP 178.A OD1 no hydrogen 3.344 N/A SER 184.A N THR 213.A O no hydrogen 3.070 N/A SER 184.A OG THR 213.A O no hydrogen 3.327 N/A TYR 185.A N ASP 175.A O no hydrogen 2.963 N/A ARG 186.A N ALA 211.A O no hydrogen 2.877 N/A ARG 186.A NE ASP 172.A OD1 no hydrogen 2.987 N/A ARG 186.A NH1 ARG 148.A O no hydrogen 2.738 N/A ARG 186.A NH2 ASP 172.A OD2 no hydrogen 2.452 N/A LEU 187.A N PHE 173.A O no hydrogen 2.680 N/A THR 188.A N ALA 209.A O no hydrogen 3.106 N/A THR 188.A OG1 ASP 172.A OD1 no hydrogen 2.726 N/A GLY 189.A N PHE 171.A O no hydrogen 2.878 N/A LEU 190.A N ALA 207.A O no hydrogen 2.984 N/A ALA 191.A N THR 169.A O no hydrogen 2.787 N/A ARG 192.A N ARG 205.A O no hydrogen 2.664 N/A ARG 192.A NH1 ASP 115.A OD2 no hydrogen 3.079 N/A ARG 192.A NH1 GLN 168.A OE1 no hydrogen 3.354 N/A ARG 192.A NH2 ASP 115.A OD2 no hydrogen 3.179 N/A SER 193.A N PHE 167.A O no hydrogen 3.055 N/A ASN 195.A N ASP 164.A O no hydrogen 2.956 N/A ALA 196.A N SER 201.A O no hydrogen 2.490 N/A GLN 197.A NE2 GLY 689.A O no hydrogen 3.578 N/A GLN 198.A NE2 THR 257.A O no hydrogen 3.545 N/A GLN 198.A NE2 PHE 259.A O no hydrogen 3.122 N/A GLU 203.A N ALA 194.A O no hydrogen 2.564 N/A GLN 204.A N GLU 233.A O no hydrogen 3.179 N/A ARG 205.A N ARG 192.A O no hydrogen 2.764 N/A ARG 205.A NE GLU 231.A OE2 no hydrogen 3.358 N/A ARG 205.A NH1 ASP 115.A OD2 no hydrogen 2.776 N/A ARG 205.A NH2 GLU 231.A OE2 no hydrogen 3.334 N/A TYR 206.A N ASN 230.A O no hydrogen 2.969 N/A ALA 207.A N LEU 190.A O no hydrogen 2.988 N/A ILE 208.A N PHE 228.A O no hydrogen 3.095 N/A ALA 209.A N THR 188.A O no hydrogen 2.533 N/A ALA 211.A N ARG 186.A O no hydrogen 2.850 N/A PHE 212.A N PHE 224.A O no hydrogen 2.850 N/A THR 213.A N SER 184.A O no hydrogen 3.126 N/A THR 213.A OG1 THR 223.A OG1 no hydrogen 2.552 N/A TRP 214.A N PHE 222.A O no hydrogen 2.928 N/A LYS 219.A N ASP 217.A OD1 no hydrogen 2.499 N/A THR 220.A OG1 LYS 219.A O no hydrogen 2.608 N/A ASN 221.A N ASP 280.A O no hydrogen 3.032 N/A PHE 222.A N TRP 214.A O no hydrogen 3.001 N/A THR 223.A N SER 278.A O no hydrogen 3.031 N/A THR 223.A OG1 THR 213.A OG1 no hydrogen 2.552 N/A THR 223.A OG1 ASN 221.A OD1 no hydrogen 2.843 N/A PHE 224.A N PHE 212.A O no hydrogen 2.632 N/A LEU 225.A N GLY 276.A O no hydrogen 2.746 N/A SER 226.A N PRO 210.A O no hydrogen 3.170 N/A SER 226.A OG PRO 210.A O no hydrogen 2.559 N/A TYR 227.A N MET 274.A O no hydrogen 2.832 N/A TYR 227.A OH GLN 229.A OE1 no hydrogen 2.796 N/A PHE 228.A N ILE 208.A O no hydrogen 3.251 N/A GLN 229.A N GLU 272.A O no hydrogen 2.791 N/A GLN 229.A NE2 GLU 231.A OE1 no hydrogen 2.732 N/A ASN 230.A N TYR 206.A O no hydrogen 2.877 N/A GLU 231.A N ARG 270.A O no hydrogen 3.323 N/A THR 234.A N TYR 268.A O no hydrogen 2.938 N/A THR 234.A OG1 TYR 268.A O no hydrogen 3.380 N/A TRP 239.A N GLU 261.A OE2 no hydrogen 2.932 N/A LEU 240.A N CYS 686.A O no hydrogen 3.384 N/A LYS 242.A N THR 683.A O no hydrogen 3.147 N/A LYS 242.A NZ GLU 243.A OE2 no hydrogen 2.899 N/A GLY 244.A N LYS 242.A O no hydrogen 2.588 N/A GLY 244.A N GLU 247.A O no hydrogen 2.904 N/A THR 245.A N LYS 242.A O no hydrogen 3.053 N/A THR 245.A OG1 PRO 241.A O no hydrogen 3.052 N/A VAL 246.A N THR 245.A OG1 no hydrogen 2.548 N/A GLU 247.A N LYS 242.A O no hydrogen 3.031 N/A LEU 249.A N LYS 253.A O no hydrogen 3.166 N/A GLY 252.A N LEU 249.A O no hydrogen 2.540 N/A LEU 255.A N GLY 244.A O no hydrogen 2.745 N/A THR 257.A OG1 GLU 691.A OE1 no hydrogen 3.440 N/A PHE 259.A N PRO 256.A O no hydrogen 3.075 N/A ASN 260.A ND2 GLU 261.A OE1 no hydrogen 2.958 N/A ALA 263.A N ASN 266.A OD1 no hydrogen 2.586 N/A LYS 264.A N THR 396.A O no hydrogen 3.086 N/A ASN 265.A ND2 ALA 263.A O no hydrogen 3.688 N/A ASN 266.A N ALA 263.A O no hydrogen 2.715 N/A ASN 266.A ND2 VAL 305.A O no hydrogen 3.529 N/A THR 267.A N ASN 303.A O no hydrogen 3.121 N/A THR 267.A OG1 GLU 233.A OE1 no hydrogen 3.394 N/A TYR 268.A N GLU 233.A OE1 no hydrogen 3.334 N/A TYR 268.A OH TYR 80.A OH no hydrogen 2.660 N/A SER 269.A N SER 301.A O no hydrogen 2.868 N/A SER 269.A OG PRO 232.A O no hydrogen 3.164 N/A ARG 270.A N GLU 231.A O no hydrogen 3.327 N/A ARG 270.A NE GLU 231.A OE1 no hydrogen 2.613 N/A ARG 270.A NH1 THR 79.A O no hydrogen 3.385 N/A ARG 270.A NH2 THR 79.A O no hydrogen 2.834 N/A ARG 270.A NH2 GLU 231.A OE2 no hydrogen 3.447 N/A ASN 271.A N LYS 299.A O no hydrogen 2.724 N/A GLU 272.A N GLN 229.A O no hydrogen 3.037 N/A LYS 273.A N GLU 297.A O no hydrogen 3.031 N/A MET 274.A N TYR 227.A O no hydrogen 2.755 N/A VAL 275.A N PHE 295.A O no hydrogen 2.902 N/A GLY 276.A N LEU 225.A O no hydrogen 2.932 N/A TYR 277.A N LEU 293.A O no hydrogen 3.265 N/A SER 278.A N THR 223.A O no hydrogen 3.090 N/A PHE 279.A N GLN 291.A O no hydrogen 2.697 N/A ASP 280.A N ASN 221.A O no hydrogen 3.276 N/A HIS 281.A N VAL 289.A O no hydrogen 2.737 N/A GLU 282.A N LYS 219.A O no hydrogen 2.902 N/A PHE 283.A N PHE 287.A O no hydrogen 2.826 N/A ASN 284.A N PHE 287.A O no hydrogen 3.321 N/A ASN 284.A ND2 THR 286.A OG1 no hydrogen 2.708 N/A THR 288.A N GLN 355.A O no hydrogen 2.872 N/A VAL 289.A N HIS 281.A O no hydrogen 2.742 N/A ARG 290.A N GLN 353.A O no hydrogen 3.145 N/A ARG 290.A NE GLN 353.A OE1 no hydrogen 3.152 N/A ARG 290.A NH1 GLN 355.A OE1 no hydrogen 2.663 N/A ARG 290.A NH2 LYS 31.A O no hydrogen 3.082 N/A ARG 290.A NH2 GLN 355.A OE1 no hydrogen 2.808 N/A GLN 291.A N PHE 279.A O no hydrogen 2.939 N/A ASN 292.A N ASP 351.A O no hydrogen 3.076 N/A LEU 293.A N TYR 277.A O no hydrogen 2.951 N/A ARG 294.A NH2 LEU 99.A O no hydrogen 2.896 N/A ARG 294.A NH2 LEU 102.A O no hydrogen 3.281 N/A PHE 295.A N VAL 275.A O no hydrogen 2.857 N/A ALA 296.A N ASN 347.A O no hydrogen 2.919 N/A GLU 297.A N LYS 273.A O no hydrogen 2.961 N/A ASN 298.A N LEU 345.A O no hydrogen 2.800 N/A LYS 299.A N ASN 271.A O no hydrogen 2.561 N/A THR 300.A N GLU 343.A O no hydrogen 3.034 N/A SER 301.A N SER 269.A O no hydrogen 3.006 N/A GLN 302.A N ASP 341.A O no hydrogen 2.862 N/A ASN 303.A N THR 267.A O no hydrogen 2.979 N/A SER 304.A N VAL 339.A O no hydrogen 2.910 N/A CYS 311.A N TYR 333.A O no hydrogen 2.534 N/A SER 312.A N LYS 330.A O no hydrogen 3.280 N/A ASP 313.A N VAL 310.A O no hydrogen 3.043 N/A ALA 315.A N ASP 313.A OD1 no hydrogen 2.655 N/A ASN 316.A N ASP 313.A O no hydrogen 2.705 N/A ASN 316.A ND2 GLY 309.A O no hydrogen 3.155 N/A ASN 316.A ND2 VAL 310.A O no hydrogen 3.040 N/A ALA 317.A N PRO 314.A O no hydrogen 3.508 N/A SER 319.A N ASN 316.A O no hydrogen 2.780 N/A GLN 321.A N ASP 388.A OD2 no hydrogen 2.778 N/A CYS 322.A N SER 319.A OG no hydrogen 3.265 N/A ALA 323.A N SER 319.A O no hydrogen 2.930 N/A ALA 324.A N CYS 322.A O no hydrogen 2.748 N/A ASP 329.A N ALA 326.A O no hydrogen 2.548 N/A LYS 330.A N ALA 326.A O no hydrogen 3.401 N/A HIS 332.A N ASP 329.A O no hydrogen 2.785 N/A HIS 332.A ND1 HIS 332.A O no hydrogen 2.712 N/A LEU 334.A N LEU 393.A O no hydrogen 2.881 N/A ALA 335.A N GLY 309.A O no hydrogen 3.089 N/A LYS 337.A N TYR 306.A O no hydrogen 3.296 N/A TYR 338.A OH SER 408.A OG no hydrogen 3.117 N/A VAL 339.A N SER 304.A O no hydrogen 2.646 N/A VAL 340.A N TRP 383.A O no hydrogen 2.928 N/A ASP 341.A N GLN 302.A O no hydrogen 2.697 N/A ASP 342.A N ASN 381.A O no hydrogen 3.092 N/A GLU 343.A N THR 300.A O no hydrogen 3.133 N/A LYS 344.A N ASP 379.A O no hydrogen 3.287 N/A LEU 345.A N ASN 298.A O no hydrogen 2.827 N/A GLN 346.A N ARG 377.A O no hydrogen 3.000 N/A ASN 347.A N ALA 296.A O no hydrogen 2.802 N/A ASN 347.A ND2 ARG 375.A O no hydrogen 3.262 N/A PHE 348.A N ARG 375.A O no hydrogen 3.068 N/A SER 349.A N ARG 294.A O no hydrogen 2.837 N/A SER 349.A OG ARG 294.A O no hydrogen 3.566 N/A VAL 350.A N PHE 373.A O no hydrogen 3.155 N/A THR 352.A N VAL 371.A O no hydrogen 3.316 N/A THR 352.A OG1 GLN 291.A OE1 no hydrogen 2.944 N/A GLN 353.A N ARG 290.A O no hydrogen 3.140 N/A GLN 353.A NE2 ASP 351.A OD1 no hydrogen 3.334 N/A LEU 354.A N THR 369.A O no hydrogen 2.860 N/A GLN 355.A N THR 288.A O no hydrogen 2.800 N/A SER 356.A N LEU 367.A O no hydrogen 2.704 N/A LYS 357.A N THR 286.A O no hydrogen 2.988 N/A PHE 358.A N HIS 365.A O no hydrogen 3.139 N/A THR 360.A OG1 ILE 363.A O no hydrogen 2.742 N/A ASP 364.A N GLN 429.A O no hydrogen 2.955 N/A HIS 365.A N PHE 358.A O no hydrogen 2.768 N/A THR 366.A OG1 GLN 427.A O no hydrogen 3.378 N/A LEU 367.A N SER 356.A O no hydrogen 2.877 N/A LEU 368.A N GLN 425.A O no hydrogen 2.719 N/A THR 369.A N LEU 354.A O no hydrogen 3.276 N/A THR 369.A OG1 LEU 354.A O no hydrogen 3.247 N/A GLY 370.A N TYR 423.A O no hydrogen 3.001 N/A VAL 371.A N THR 352.A O no hydrogen 3.160 N/A ASP 372.A N GLY 421.A O no hydrogen 2.871 N/A PHE 373.A N VAL 350.A O no hydrogen 3.143 N/A MET 374.A N GLN 419.A O no hydrogen 2.910 N/A ARG 375.A N PHE 348.A O no hydrogen 3.193 N/A MET 376.A N GLN 417.A O no hydrogen 2.750 N/A ARG 377.A N GLN 346.A O no hydrogen 3.125 N/A ASN 378.A N ASN 415.A O no hydrogen 3.063 N/A ASN 378.A ND2 GLU 343.A OE1 no hydrogen 2.779 N/A ASP 379.A N LYS 344.A O no hydrogen 2.762 N/A ILE 380.A N ILE 413.A O no hydrogen 2.600 N/A ASN 381.A N ASP 342.A O no hydrogen 3.056 N/A ALA 382.A N TYR 411.A O no hydrogen 2.632 N/A TRP 383.A N VAL 340.A O no hydrogen 2.793 N/A PHE 384.A N GLY 409.A O no hydrogen 2.956 N/A GLY 385.A N TYR 338.A O no hydrogen 3.341 N/A TYR 386.A N ASN 407.A O no hydrogen 2.917 N/A PHE 398.A N ASN 265.A OD1 no hydrogen 3.361 N/A ASN 401.A N ASP 399.A OD2 no hydrogen 3.104 N/A ALA 406.A N ASP 404.A OD1 no hydrogen 3.010 N/A ASN 407.A N ASP 404.A O no hydrogen 2.811 N/A SER 408.A OG TYR 338.A OH no hydrogen 3.117 N/A SER 408.A OG ASN 407.A OD1 no hydrogen 3.229 N/A GLY 409.A N PHE 384.A O no hydrogen 2.956 N/A TYR 411.A N ALA 382.A O no hydrogen 2.819 N/A ILE 413.A N ILE 380.A O no hydrogen 3.187 N/A LEU 414.A N LEU 449.A O no hydrogen 3.040 N/A ASN 415.A N ASN 378.A O no hydrogen 3.023 N/A LYS 416.A N GLU 447.A O no hydrogen 2.844 N/A GLN 417.A N MET 376.A O no hydrogen 2.837 N/A LYS 418.A N ASP 445.A O no hydrogen 2.945 N/A GLN 419.A N MET 374.A O no hydrogen 2.631 N/A THR 420.A N TRP 443.A O no hydrogen 3.241 N/A GLY 421.A N ASP 372.A O no hydrogen 2.861 N/A VAL 422.A N TYR 441.A O no hydrogen 2.892 N/A TYR 423.A N GLY 370.A O no hydrogen 3.121 N/A TYR 423.A OH ASP 351.A OD2 no hydrogen 3.390 N/A VAL 424.A N GLY 439.A O no hydrogen 3.143 N/A GLN 425.A N LEU 368.A O no hydrogen 2.800 N/A GLN 425.A NE2 THR 30.A O no hydrogen 3.227 N/A ASP 426.A N LEU 437.A O no hydrogen 2.993 N/A GLN 427.A N THR 366.A O no hydrogen 2.943 N/A ALA 428.A N VAL 435.A O no hydrogen 2.847 N/A GLN 429.A N ASP 364.A O no hydrogen 3.164 N/A TRP 430.A N VAL 433.A O no hydrogen 2.648 N/A LYS 432.A N TRP 430.A O no hydrogen 2.358 N/A VAL 433.A N TRP 430.A O no hydrogen 3.117 N/A LEU 434.A N ASN 471.A O no hydrogen 2.970 N/A VAL 435.A N ALA 428.A O no hydrogen 2.600 N/A THR 436.A N GLY 469.A O no hydrogen 3.140 N/A LEU 437.A N ASP 426.A O no hydrogen 3.126 N/A GLY 438.A N ARG 467.A O no hydrogen 3.015 N/A GLY 439.A N VAL 424.A O no hydrogen 3.069 N/A ARG 440.A N THR 465.A O no hydrogen 2.818 N/A ARG 440.A NE ASP 442.A OD1 no hydrogen 2.514 N/A ARG 440.A NH1 LEU 132.A O no hydrogen 2.940 N/A TYR 441.A N VAL 422.A O no hydrogen 2.961 N/A ASP 442.A N GLN 463.A O no hydrogen 2.874 N/A TRP 443.A N THR 420.A O no hydrogen 2.807 N/A ALA 444.A N ASP 461.A O no hydrogen 2.956 N/A GLN 446.A N ARG 459.A O no hydrogen 2.789 N/A GLU 447.A N LYS 416.A O no hydrogen 3.065 N/A SER 448.A N ASP 457.A O no hydrogen 2.897 N/A LEU 449.A N LEU 414.A O no hydrogen 3.091 N/A ASN 450.A N THR 455.A O no hydrogen 2.580 N/A ARG 451.A NH2 ASP 379.A OD2 no hydrogen 3.256 N/A THR 455.A OG1 ALA 453.A O no hydrogen 3.334 N/A ARG 459.A N GLN 446.A O no hydrogen 2.858 N/A ARG 459.A NE ASP 461.A OD2 no hydrogen 3.047 N/A ARG 459.A NH1 ILE 500.A O no hydrogen 2.508 N/A ASP 461.A N ALA 444.A O no hydrogen 3.226 N/A GLN 463.A N ASP 442.A O no hydrogen 3.105 N/A THR 465.A N ARG 440.A O no hydrogen 3.006 N/A TRP 466.A N GLU 486.A OE2 no hydrogen 3.077 N/A ARG 467.A N GLY 438.A O no hydrogen 2.852 N/A ARG 467.A NH1 GLY 29.A O no hydrogen 3.330 N/A ARG 467.A NH1 GLN 41.A OE1 no hydrogen 2.610 N/A ARG 467.A NH2 GLY 29.A O no hydrogen 2.825 N/A ARG 467.A NH2 GLN 425.A OE1 no hydrogen 3.494 N/A GLY 468.A N TYR 484.A O no hydrogen 2.855 N/A GLY 469.A N THR 436.A O no hydrogen 2.997 N/A VAL 470.A N PHE 482.A O no hydrogen 3.008 N/A ASN 471.A N LEU 434.A O no hydrogen 2.949 N/A ASN 471.A ND2 LEU 434.A O no hydrogen 3.546 N/A TYR 472.A N PRO 480.A O no hydrogen 2.972 N/A LEU 473.A N LYS 432.A O no hydrogen 3.021 N/A PHE 474.A N TYR 472.A O no hydrogen 3.304 N/A GLY 477.A N PHE 474.A O no hydrogen 2.715 N/A THR 479.A N LYS 514.A O no hydrogen 2.638 N/A THR 479.A OG1 GLY 477.A O no hydrogen 2.754 N/A TYR 481.A N GLY 512.A O no hydrogen 2.735 N/A TYR 481.A OH GLU 510.A OE2 no hydrogen 3.147 N/A PHE 482.A N VAL 470.A O no hydrogen 3.270 N/A SER 483.A N GLU 510.A O no hydrogen 3.010 N/A SER 483.A OG PRO 40.A O no hydrogen 2.682 N/A TYR 484.A N GLY 468.A O no hydrogen 2.684 N/A TYR 484.A OH GLU 486.A OE1 no hydrogen 3.062 N/A SER 485.A N GLN 508.A O no hydrogen 2.989 N/A GLU 486.A N TRP 466.A O no hydrogen 3.165 N/A PHE 488.A N SER 130.A OG no hydrogen 3.008 N/A GLU 489.A N SER 504.A O no hydrogen 3.122 N/A GLN 493.A N SER 491.A OG no hydrogen 3.326 N/A GLY 495.A N ASN 499.A O no hydrogen 2.991 N/A GLY 498.A N GLY 495.A O no hydrogen 3.045 N/A ASN 499.A ND2 ASP 497.A OD2 no hydrogen 3.436 N/A PHE 501.A N GLN 493.A O no hydrogen 3.227 N/A ALA 502.A N GLU 549.A OE1 no hydrogen 3.471 N/A SER 504.A N GLU 489.A O no hydrogen 2.918 N/A LYS 505.A N THR 534.A O no hydrogen 2.885 N/A GLY 506.A N SER 487.A O no hydrogen 2.961 N/A LYS 507.A N THR 532.A O no hydrogen 2.978 N/A GLN 508.A N SER 485.A O no hydrogen 3.120 N/A TYR 509.A N ASN 530.A O no hydrogen 3.023 N/A GLU 510.A N SER 483.A O no hydrogen 3.055 N/A VAL 511.A N VAL 528.A O no hydrogen 2.788 N/A GLY 512.A N TYR 481.A O no hydrogen 2.952 N/A VAL 513.A N GLY 526.A O no hydrogen 3.281 N/A LYS 514.A N THR 479.A O no hydrogen 2.633 N/A LYS 514.A NZ ILE 36.A O no hydrogen 2.867 N/A LYS 514.A NZ VAL 39.A O no hydrogen 2.565 N/A LYS 514.A NZ GLN 41.A O no hydrogen 3.074 N/A TYR 515.A N VAL 524.A O no hydrogen 2.674 N/A VAL 523.A N LYS 563.A O no hydrogen 2.973 N/A VAL 524.A N TYR 515.A O no hydrogen 3.077 N/A THR 525.A N GLU 561.A O no hydrogen 2.724 N/A THR 525.A OG1 VAL 524.A O no hydrogen 3.160 N/A GLY 526.A N VAL 513.A O no hydrogen 3.096 N/A ALA 527.A N GLU 559.A O no hydrogen 2.830 N/A VAL 528.A N VAL 511.A O no hydrogen 2.754 N/A TYR 529.A N GLY 557.A O no hydrogen 2.599 N/A ASN 530.A N TYR 509.A O no hydrogen 2.961 N/A LEU 531.A N ALA 555.A O no hydrogen 2.428 N/A THR 532.A N LYS 507.A O no hydrogen 2.737 N/A LYS 533.A N ILE 553.A O no hydrogen 3.045 N/A LYS 533.A NZ GLU 91.A OE2 no hydrogen 3.548 N/A LYS 533.A NZ ASN 536.A OD1 no hydrogen 3.482 N/A THR 534.A N LYS 505.A O no hydrogen 2.589 N/A ASN 535.A N GLY 551.A O no hydrogen 2.570 N/A ASN 535.A ND2 ALA 502.A O no hydrogen 3.665 N/A ASN 536.A N GLY 551.A O no hydrogen 3.163 N/A MET 538.A N VAL 548.A O no hydrogen 2.614 N/A GLU 542.A N ASP 540.A OD1 no hydrogen 3.007 N/A PHE 546.A N SER 544.A OG no hydrogen 3.154 N/A VAL 548.A N MET 538.A O no hydrogen 2.403 N/A GLU 552.A N THR 585.A O no hydrogen 3.279 N/A ILE 553.A N LYS 533.A O no hydrogen 2.966 N/A ARG 554.A N GLU 582.A O no hydrogen 2.906 N/A ALA 555.A N LEU 531.A O no hydrogen 2.542 N/A ARG 556.A N ASP 580.A O no hydrogen 2.878 N/A GLY 557.A N TYR 529.A O no hydrogen 2.894 N/A VAL 558.A N TYR 578.A O no hydrogen 3.208 N/A GLU 559.A N ALA 527.A O no hydrogen 2.798 N/A ILE 560.A N TYR 576.A O no hydrogen 2.979 N/A GLU 561.A N THR 525.A O no hydrogen 2.693 N/A ALA 562.A N GLY 574.A O no hydrogen 2.837 N/A LYS 563.A N VAL 523.A O no hydrogen 3.259 N/A LYS 563.A NZ GLU 50.A OE1 no hydrogen 3.018 N/A ALA 564.A N VAL 572.A O no hydrogen 3.026 N/A ALA 565.A N PRO 521.A O no hydrogen 3.105 N/A SER 569.A N SER 567.A OG no hydrogen 2.723 N/A VAL 570.A N SER 567.A OG no hydrogen 2.714 N/A ASN 571.A N ASP 607.A O no hydrogen 3.242 N/A ASN 571.A ND2 ASP 607.A OD2 no hydrogen 3.471 N/A VAL 572.A N ALA 564.A O no hydrogen 3.105 N/A VAL 573.A N TRP 605.A O no hydrogen 2.716 N/A GLY 574.A N ALA 562.A O no hydrogen 2.884 N/A SER 575.A N SER 603.A O no hydrogen 2.754 N/A SER 575.A OG SER 603.A OG no hydrogen 2.624 N/A TYR 576.A N ILE 560.A O no hydrogen 2.812 N/A THR 577.A N MET 601.A O no hydrogen 2.511 N/A TYR 578.A N VAL 558.A O no hydrogen 2.802 N/A THR 579.A N LYS 599.A O no hydrogen 2.827 N/A ASP 580.A N ARG 556.A O no hydrogen 2.791 N/A GLU 582.A N ARG 554.A O no hydrogen 3.001 N/A TYR 583.A N ASN 592.A O no hydrogen 2.749 N/A THR 584.A N GLU 552.A O no hydrogen 2.939 N/A THR 585.A N GLU 552.A O no hydrogen 3.253 N/A THR 587.A OG1 ALA 539.A O no hydrogen 3.003 N/A THR 588.A N ASP 586.A OD1 no hydrogen 2.534 N/A TYR 589.A N ASP 586.A OD1 no hydrogen 2.840 N/A LYS 590.A NZ THR 584.A O no hydrogen 2.769 N/A GLY 591.A N TYR 583.A O no hydrogen 2.996 N/A ASN 592.A N TYR 589.A O no hydrogen 3.000 N/A GLN 596.A N TYR 631.A O no hydrogen 3.350 N/A GLN 596.A NE2 THR 73.A O no hydrogen 3.006 N/A MET 601.A N THR 577.A O no hydrogen 3.075 N/A ALA 602.A N TYR 626.A O no hydrogen 3.054 N/A SER 603.A N SER 575.A O no hydrogen 2.998 N/A SER 603.A OG SER 575.A OG no hydrogen 2.624 N/A LEU 604.A N GLY 624.A O no hydrogen 3.040 N/A TRP 605.A N VAL 573.A O no hydrogen 2.784 N/A ALA 606.A N THR 622.A O no hydrogen 3.134 N/A ASP 607.A N ASN 571.A O no hydrogen 3.086 N/A TYR 608.A N LEU 620.A O no hydrogen 2.835 N/A THR 609.A N SER 569.A O no hydrogen 2.762 N/A THR 609.A OG1 THR 619.A OG1 no hydrogen 3.384 N/A PHE 610.A N LEU 618.A O no hydrogen 2.907 N/A SER 616.A N GLY 613.A O no hydrogen 2.925 N/A SER 616.A OG PHE 611.A O no hydrogen 2.980 N/A GLY 617.A N PHE 610.A O no hydrogen 2.592 N/A LEU 618.A N LEU 615.A O no hydrogen 2.731 N/A THR 619.A OG1 THR 609.A OG1 no hydrogen 3.384 N/A LEU 620.A N TYR 608.A O no hydrogen 2.850 N/A GLY 621.A N LEU 649.A O no hydrogen 2.851 N/A THR 622.A N ALA 606.A O no hydrogen 3.164 N/A GLY 623.A N ASP 647.A O no hydrogen 2.960 N/A GLY 624.A N LEU 604.A O no hydrogen 2.774 N/A ARG 625.A N VAL 645.A O no hydrogen 2.871 N/A ARG 625.A NH1 ASP 647.A OD2 no hydrogen 2.400 N/A TYR 626.A N ALA 602.A O no hydrogen 2.784 N/A THR 627.A N TYR 643.A O no hydrogen 2.814 N/A GLY 628.A N HIS 600.A O no hydrogen 2.703 N/A SER 630.A N VAL 640.A O no hydrogen 2.971 N/A SER 630.A OG TYR 631.A O no hydrogen 3.402 N/A GLY 632.A N PHE 638.A O no hydrogen 3.099 N/A ASN 636.A N ASP 633.A O no hydrogen 2.651 N/A ASN 636.A ND2 THR 593.A O no hydrogen 3.482 N/A SER 637.A N ASP 633.A OD2 no hydrogen 2.759 N/A VAL 640.A N SER 630.A O no hydrogen 2.540 N/A TYR 643.A N THR 627.A O no hydrogen 3.007 N/A VAL 645.A N ARG 625.A O no hydrogen 3.095 N/A ASP 647.A N GLY 623.A O no hydrogen 2.872 N/A ALA 648.A N VAL 668.A O no hydrogen 2.823 N/A LEU 649.A N GLY 621.A O no hydrogen 2.610 N/A VAL 650.A N LEU 666.A O no hydrogen 3.036 N/A ARG 651.A N THR 619.A O no hydrogen 3.039 N/A ARG 651.A NH1 ALA 52.A O no hydrogen 3.252 N/A TYR 652.A N VAL 664.A O no hydrogen 3.005 N/A LEU 654.A N SER 662.A O no hydrogen 2.899 N/A ARG 656.A N ASP 653.A O no hydrogen 3.241 N/A VAL 657.A N LEU 654.A O no hydrogen 2.830 N/A GLY 658.A N ALA 655.A O no hydrogen 3.294 N/A MET 659.A N LEU 654.A O no hydrogen 3.165 N/A SER 662.A N ALA 660.A O no hydrogen 2.630 N/A SER 662.A OG THR 699.A O no hydrogen 3.402 N/A ASN 663.A N THR 699.A O no hydrogen 3.041 N/A ASN 663.A ND2 GLY 661.A O no hydrogen 3.247 N/A VAL 664.A N TYR 652.A O no hydrogen 3.169 N/A ALA 665.A N THR 697.A O no hydrogen 2.995 N/A LEU 666.A N VAL 650.A O no hydrogen 2.701 N/A HIS 667.A N VAL 695.A O no hydrogen 2.710 N/A HIS 667.A NE2 THR 697.A OG1 no hydrogen 3.014 N/A VAL 668.A N ALA 648.A O no hydrogen 2.937 N/A ASN 669.A N GLN 693.A O no hydrogen 3.108 N/A ASN 669.A ND2 HIS 54.A O no hydrogen 3.654 N/A ASN 670.A ND2 ARG 674.A O no hydrogen 3.684 N/A ASN 670.A ND2 ALA 690.A O no hydrogen 3.313 N/A LEU 671.A N VAL 646.A O no hydrogen 2.720 N/A ASP 673.A N ASN 670.A O no hydrogen 3.312 N/A ARG 674.A N ASN 670.A OD1 no hydrogen 2.752 N/A ARG 674.A NH1 THR 644.A O no hydrogen 3.224 N/A ALA 678.A N PHE 687.A O no hydrogen 2.987 N/A SER 679.A OG GLY 72.A O no hydrogen 3.001 N/A PHE 681.A N GLY 685.A O no hydrogen 3.006 N/A THR 683.A OG1 ASP 313.A OD2 no hydrogen 3.181 N/A THR 683.A OG1 ASN 682.A OD1 no hydrogen 3.049 N/A GLY 685.A N ASN 682.A O no hydrogen 2.650 N/A CYS 686.A N LEU 240.A O no hydrogen 2.771 N/A PHE 687.A N SER 679.A O no hydrogen 3.030 N/A GLY 689.A N TYR 676.A O no hydrogen 2.526 N/A ARG 692.A N ASP 673.A OD1 no hydrogen 2.672 N/A GLN 693.A N ASN 669.A O no hydrogen 3.026 N/A VAL 694.A N THR 163.A OG1 no hydrogen 3.204 N/A VAL 695.A N HIS 667.A O no hydrogen 2.932 N/A ALA 696.A N ALA 161.A O no hydrogen 2.692 N/A THR 697.A N ALA 665.A O no hydrogen 2.822 N/A THR 697.A OG1 HIS 667.A NE2 no hydrogen 3.014 N/A ALA 698.A N PHE 159.A O no hydrogen 2.846 N/A THR 699.A N ASN 663.A O no hydrogen 2.868 N/A PHE 700.A N VAL 157.A O no hydrogen 3.056 N/A ARG 701.A N SER 662.A OG no hydrogen 2.747 N/A