Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ldr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 234.A OD1 no hydrogen 2.713 N/A ARG 2.A NH1 LEU 155.A O no hydrogen 3.011 N/A ARG 2.A NH1 ASP 234.A OD1 no hydrogen 3.329 N/A ARG 2.A NH1 ASP 234.A OD2 no hydrogen 3.067 N/A LYS 6.A NZ ASP 144.A OD1 no hydrogen 2.934 N/A LEU 7.A N VAL 145.A O no hydrogen 3.252 N/A ASN 8.A ND2 LEU 31.A O no hydrogen 3.277 N/A TRP 11.A N VAL 29.A O no hydrogen 3.093 N/A TRP 11.A NE1 LEU 7.A O no hydrogen 3.023 N/A ILE 12.A N GLN 55.A O no hydrogen 2.859 N/A PHE 13.A N GLU 27.A O no hydrogen 2.730 N/A ALA 14.A N THR 53.A O no hydrogen 2.877 N/A GLY 16.A N ALA 51.A O no hydrogen 2.922 N/A ALA 18.A N THR 53.A OG1 no hydrogen 3.207 N/A ALA 21.A N ASP 19.A OD1 no hydrogen 3.457 N/A THR 22.A OG1 ASP 19.A O no hydrogen 3.447 N/A LEU 24.A N GLN 55.A OE1 no hydrogen 3.037 N/A GLU 27.A N PHE 13.A O no hydrogen 2.651 N/A VAL 29.A N TRP 11.A O no hydrogen 2.937 N/A LEU 31.A N ASN 8.A O no hydrogen 2.674 N/A HIS 33.A N ILE 141.A O no hydrogen 2.887 N/A HIS 33.A ND1 TYR 54.A OH no hydrogen 2.693 N/A ALA 35.A N ALA 139.A O no hydrogen 3.230 N/A LEU 38.A N HIS 272.A O no hydrogen 2.882 N/A TYR 42.A N ASP 504.A O no hydrogen 2.745 N/A GLU 45.A N SER 47.A OG no hydrogen 3.191 N/A THR 46.A OG1 ASP 44.A OD1 no hydrogen 2.784 N/A TYR 48.A OH THR 137.A OG1 no hydrogen 3.149 N/A GLN 49.A N THR 46.A O no hydrogen 2.485 N/A GLN 49.A NE2 GLU 45.A O no hydrogen 3.609 N/A ARG 50.A NE SER 47.A O no hydrogen 3.075 N/A PHE 52.A N ILE 118.A O no hydrogen 3.005 N/A THR 53.A N ALA 14.A O no hydrogen 2.871 N/A THR 53.A OG1 GLY 16.A O no hydrogen 2.980 N/A TYR 54.A N VAL 116.A O no hydrogen 3.162 N/A TYR 54.A OH HIS 33.A ND1 no hydrogen 2.693 N/A GLN 55.A N ILE 12.A O no hydrogen 2.714 N/A GLN 55.A NE2 THR 115.A OG1 no hydrogen 2.963 N/A ARG 56.A N VAL 114.A O no hydrogen 3.036 N/A ARG 56.A NE VAL 57.A O no hydrogen 3.444 N/A ILE 58.A N ASN 112.A O no hydrogen 3.318 N/A TRP 60.A N GLY 110.A O no hydrogen 3.067 N/A TRP 64.A N ASP 61.A O no hydrogen 2.824 N/A ARG 67.A N TRP 64.A O no hydrogen 2.923 N/A ARG 67.A NH2 MET 1.A O no hydrogen 2.749 N/A ARG 68.A N LEU 150.A O no hydrogen 2.773 N/A ARG 68.A NH1 GLU 152.A OE2 no hydrogen 2.989 N/A ARG 68.A NH2 ASP 102.A OD2 no hydrogen 3.480 N/A ARG 68.A NH2 THR 104.A OG1 no hydrogen 3.012 N/A ARG 68.A NH2 ASP 105.A OD1 no hydrogen 3.160 N/A GLN 70.A N MET 148.A O no hydrogen 3.047 N/A LEU 71.A N ALA 101.A O no hydrogen 2.852 N/A ARG 72.A N TRP 146.A O no hydrogen 3.275 N/A PHE 73.A N PHE 99.A O no hydrogen 3.013 N/A ASP 74.A N ASP 144.A O no hydrogen 3.145 N/A MET 77.A N GLY 140.A O no hydrogen 2.973 N/A ASP 79.A N PRO 93.A O no hydrogen 3.042 N/A ASN 80.A ND2 ALA 76.A O no hydrogen 2.432 N/A TRP 83.A N THR 115.A O no hydrogen 2.738 N/A ASN 85.A N LEU 113.A O no hydrogen 2.859 N/A ASN 85.A ND2 HIS 106.A O no hydrogen 2.894 N/A ASN 85.A ND2 ASN 112.A OD1 no hydrogen 2.979 N/A VAL 87.A N VAL 84.A O no hydrogen 2.898 N/A VAL 89.A N VAL 82.A O no hydrogen 2.644 N/A HIS 92.A N ASN 80.A O no hydrogen 2.903 N/A HIS 92.A NE2 THR 97.A O no hydrogen 3.072 N/A HIS 92.A NE2 THR 97.A OG1 no hydrogen 3.048 N/A TYR 96.A OH TYR 275.A OH no hydrogen 3.297 N/A THR 97.A OG1 HIS 92.A NE2 no hydrogen 3.048 N/A THR 97.A OG1 ASP 94.A OD2 no hydrogen 3.298 N/A PHE 99.A N PHE 73.A O no hydrogen 3.344 N/A ALA 101.A N LEU 71.A O no hydrogen 3.122 N/A LEU 103.A N VAL 69.A O no hydrogen 2.676 N/A THR 104.A N ASP 102.A OD1 no hydrogen 3.236 N/A THR 104.A OG1 ASP 102.A OD1 no hydrogen 2.343 N/A HIS 106.A N LEU 103.A O no hydrogen 2.896 N/A LEU 107.A N LEU 103.A O no hydrogen 3.206 N/A LEU 107.A N THR 104.A O no hydrogen 3.162 N/A ARG 108.A N ASN 112.A OD1 no hydrogen 2.716 N/A ASN 112.A N ILE 58.A O no hydrogen 2.873 N/A ASN 112.A ND2 ILE 58.A O no hydrogen 3.090 N/A ASN 112.A ND2 ARG 108.A O no hydrogen 3.076 N/A LEU 113.A N ASN 85.A OD1 no hydrogen 3.200 N/A VAL 114.A N ARG 56.A O no hydrogen 3.185 N/A THR 115.A N TRP 83.A O no hydrogen 3.211 N/A THR 115.A OG1 PRO 20.A O no hydrogen 2.733 N/A VAL 116.A N TYR 54.A O no hydrogen 2.987 N/A ARG 117.A N VAL 81.A O no hydrogen 2.988 N/A ARG 117.A NH2 ALA 18.A O no hydrogen 2.785 N/A ILE 118.A N PHE 52.A O no hydrogen 2.979 N/A ASP 119.A N ALA 78.A O no hydrogen 3.083 N/A GLY 120.A N ARG 50.A O no hydrogen 2.693 N/A ASN 123.A N SER 121.A O no hydrogen 2.682 N/A ILE 126.A N ASN 123.A O no hydrogen 2.614 N/A PHE 129.A N ILE 126.A O no hydrogen 3.071 N/A TYR 135.A OH GLY 326.A O no hydrogen 3.234 N/A THR 137.A N TYR 48.A OH no hydrogen 3.331 N/A THR 137.A OG1 TYR 48.A OH no hydrogen 3.149 N/A GLY 140.A N MET 77.A O no hydrogen 3.054 N/A ILE 141.A N TYR 54.A OH no hydrogen 3.255 N/A TYR 142.A OH GLY 95.A O no hydrogen 2.761 N/A ARG 143.A NH2 GLN 268.A OE1 no hydrogen 2.921 N/A VAL 145.A N ASN 8.A OD1 no hydrogen 3.005 N/A TRP 146.A N ARG 72.A O no hydrogen 2.915 N/A TRP 146.A NE1 ASP 74.A OD2 no hydrogen 2.761 N/A LEU 147.A N GLN 5.A O no hydrogen 2.573 N/A MET 148.A N GLN 70.A O no hydrogen 3.190 N/A LEU 150.A N ARG 68.A O no hydrogen 3.202 N/A ARG 153.A NE ASP 231.A OD1 no hydrogen 2.575 N/A ARG 153.A NE ASP 231.A OD2 no hydrogen 3.162 N/A ARG 153.A NH1 ASP 231.A OD1 no hydrogen 2.828 N/A ARG 153.A NH2 ALA 180.A O no hydrogen 2.700 N/A HIS 154.A N THR 179.A OG1 no hydrogen 2.695 N/A HIS 154.A ND1 PRO 151.A O no hydrogen 2.522 N/A HIS 154.A ND1 GLU 152.A O no hydrogen 2.761 N/A LEU 155.A N ASP 234.A OD2 no hydrogen 3.218 N/A THR 156.A N GLU 177.A O no hydrogen 2.849 N/A ARG 159.A N ARG 175.A O no hydrogen 3.101 N/A ARG 159.A NE ILE 160.A O no hydrogen 2.904 N/A ARG 159.A NH1 ASP 384.A OD1 no hydrogen 3.103 N/A ARG 159.A NH2 THR 386.A OG1 no hydrogen 3.274 N/A LEU 161.A N VAL 173.A O no hydrogen 2.697 N/A SER 167.A N ASP 164.A O no hydrogen 3.406 N/A LYS 170.A N LEU 209.A O no hydrogen 3.220 N/A LYS 170.A NZ ALA 165.A O no hydrogen 2.149 N/A LYS 170.A NZ SER 167.A O no hydrogen 3.206 N/A VAL 172.A N LEU 206.A O no hydrogen 2.734 N/A VAL 173.A N LEU 161.A O no hydrogen 3.049 N/A ILE 174.A N LEU 204.A O no hydrogen 2.707 N/A ARG 175.A N ARG 159.A O no hydrogen 2.801 N/A THR 179.A OG1 GLU 152.A O no hydrogen 2.868 N/A THR 179.A OG1 HIS 154.A O no hydrogen 3.378 N/A GLY 182.A N GLU 201.A OE1 no hydrogen 3.002 N/A ARG 185.A N THR 228.A O no hydrogen 3.006 N/A ALA 186.A N THR 198.A O no hydrogen 3.373 N/A ARG 187.A N GLU 226.A O no hydrogen 3.063 N/A LEU 188.A N ALA 196.A O no hydrogen 3.302 N/A LEU 189.A N THR 224.A O no hydrogen 2.822 N/A ASP 190.A N ARG 193.A O no hydrogen 2.981 N/A ARG 193.A N ASP 190.A O no hydrogen 3.264 N/A ILE 195.A N LEU 188.A O no hydrogen 3.154 N/A THR 198.A N ALA 186.A O no hydrogen 3.202 N/A GLY 200.A N VAL 184.A O no hydrogen 2.729 N/A LEU 204.A N ILE 174.A O no hydrogen 2.832 N/A LEU 206.A N VAL 172.A O no hydrogen 2.683 N/A LEU 209.A N LYS 170.A O no hydrogen 2.965 N/A SER 213.A N TYR 223.A OH no hydrogen 2.735 N/A TRP 215.A NE1 ASP 314.A O no hydrogen 2.927 N/A ASN 219.A N SER 216.A OG no hydrogen 3.268 N/A GLN 221.A N ASN 219.A O no hydrogen 2.754 N/A TYR 223.A N PHE 240.A O no hydrogen 3.060 N/A TYR 223.A OH SER 213.A O no hydrogen 3.385 N/A THR 224.A N LEU 189.A O no hydrogen 3.253 N/A VAL 225.A N HIS 238.A O no hydrogen 3.064 N/A GLU 226.A N ARG 187.A O no hydrogen 3.062 N/A LEU 227.A N THR 236.A O no hydrogen 2.497 N/A THR 228.A N ARG 185.A O no hydrogen 3.014 N/A THR 228.A OG1 GLU 226.A OE2 no hydrogen 3.464 N/A LEU 229.A N ASP 234.A O no hydrogen 2.948 N/A SER 232.A N LEU 229.A O no hydrogen 3.054 N/A SER 232.A OG ARG 153.A O no hydrogen 2.846 N/A THR 236.A N LEU 227.A O no hydrogen 2.955 N/A THR 236.A OG1 HIS 238.A NE2 no hydrogen 3.391 N/A HIS 238.A N VAL 225.A O no hydrogen 3.147 N/A PHE 240.A N TYR 223.A O no hydrogen 2.948 N/A ARG 243.A NE PRO 354.A O no hydrogen 2.638 N/A ARG 243.A NH2 ILE 356.A O no hydrogen 3.414 N/A THR 244.A N ASN 255.A OD1 no hydrogen 2.667 N/A GLU 246.A N LEU 253.A O no hydrogen 2.862 N/A THR 248.A OG1 GLY 251.A O no hydrogen 3.293 N/A GLY 251.A N THR 248.A O no hydrogen 2.577 N/A LEU 253.A N GLU 246.A O no hydrogen 2.951 N/A ASN 255.A N THR 244.A O no hydrogen 2.572 N/A ASN 255.A ND2 TRP 215.A O no hydrogen 3.084 N/A MET 259.A N PHE 252.A O no hydrogen 2.913 N/A LYS 260.A NZ ASP 480.A O no hydrogen 3.271 N/A LYS 260.A NZ ILE 483.A O no hydrogen 3.260 N/A LEU 261.A N SER 484.A O no hydrogen 3.092 N/A ARG 262.A N ASN 296.A OD1 no hydrogen 2.942 N/A ARG 262.A NE CYS 294.A O no hydrogen 3.360 N/A ASN 265.A ND2 THR 445.A O no hydrogen 3.095 N/A ASN 265.A ND2 ILE 487.A O no hydrogen 3.139 N/A ASN 265.A ND2 GLY 488.A O no hydrogen 3.076 N/A ARG 266.A N ARG 299.A O no hydrogen 3.048 N/A ARG 266.A NE ASP 285.A OD2 no hydrogen 2.824 N/A ARG 266.A NH1 GLN 282.A OE1 no hydrogen 3.383 N/A ARG 266.A NH1 GLN 305.A OE1 no hydrogen 3.283 N/A ARG 266.A NH2 ASP 285.A OD2 no hydrogen 2.617 N/A HIS 267.A ND1 TYR 303.A OH no hydrogen 2.781 N/A GLN 268.A N TYR 303.A OH no hydrogen 3.465 N/A GLN 268.A NE2 TYR 142.A OH no hydrogen 3.542 N/A TRP 270.A N GLY 274.A O no hydrogen 2.684 N/A HIS 272.A ND1 LEU 38.A O no hydrogen 2.754 N/A GLN 273.A N ALA 271.A O no hydrogen 2.685 N/A GLY 274.A N TRP 270.A O no hydrogen 3.015 N/A TYR 275.A OH TYR 96.A OH no hydrogen 3.297 N/A TYR 275.A OH TYR 303.A OH no hydrogen 3.377 N/A ALA 276.A N GLN 273.A O no hydrogen 3.228 N/A ALA 277.A N TYR 275.A O no hydrogen 2.787 N/A GLY 278.A N ASP 654.A OD2 no hydrogen 3.192 N/A ARG 279.A N ASP 652.A OD1 no hydrogen 3.226 N/A ARG 279.A NE GLU 283.A OE2 no hydrogen 2.950 N/A GLN 282.A N GLY 278.A O no hydrogen 3.165 N/A GLN 282.A NE2 ALA 277.A O no hydrogen 3.056 N/A GLU 283.A N ARG 279.A O no hydrogen 2.787 N/A ARG 284.A N HIS 280.A O no hydrogen 2.904 N/A ARG 284.A NE ASP 643.A OD2 no hydrogen 3.204 N/A ARG 284.A NH1 GLU 287.A OE1 no hydrogen 3.213 N/A ARG 284.A NH2 ASP 643.A OD2 no hydrogen 3.214 N/A ASP 285.A N ALA 281.A O no hydrogen 3.424 N/A ALA 286.A N GLN 282.A O no hydrogen 3.469 N/A GLU 287.A N GLU 283.A O no hydrogen 3.282 N/A ILE 288.A N ARG 284.A O no hydrogen 2.950 N/A VAL 289.A N ASP 285.A O no hydrogen 2.900 N/A ARG 290.A N ALA 286.A O no hydrogen 3.014 N/A ARG 290.A NE ILE 316.A O no hydrogen 3.267 N/A ARG 290.A NH1 ARG 290.A O no hydrogen 2.912 N/A HIS 291.A N GLU 287.A O no hydrogen 2.850 N/A LEU 293.A N ILE 288.A O no hydrogen 3.163 N/A CYS 294.A N HIS 291.A O no hydrogen 2.873 N/A CYS 294.A SG ARG 290.A O no hydrogen 3.749 N/A CYS 294.A SG GLU 533.A OE1 no hydrogen 3.574 N/A CYS 295.A N VAL 289.A O no hydrogen 3.414 N/A CYS 295.A SG LEU 293.A O no hydrogen 3.564 N/A ASN 296.A ND2 LYS 260.A O no hydrogen 3.027 N/A MET 297.A N ARG 262.A O no hydrogen 3.185 N/A VAL 298.A N LEU 319.A O no hydrogen 2.936 N/A ARG 299.A N LEU 264.A O no hydrogen 3.427 N/A ARG 299.A NH1 ASN 265.A OD1 no hydrogen 3.322 N/A ARG 299.A NH1 GLU 446.A OE1 no hydrogen 2.539 N/A ARG 299.A NH2 GLU 323.A OE1 no hydrogen 2.723 N/A ARG 299.A NH2 ASN 364.A OD1 no hydrogen 2.504 N/A THR 300.A N PHE 321.A O no hydrogen 3.102 N/A THR 300.A OG1 TYR 303.A O no hydrogen 2.939 N/A THR 300.A OG1 PHE 321.A O no hydrogen 3.440 N/A SER 301.A N ARG 299.A O no hydrogen 3.226 N/A SER 301.A OG ASN 265.A OD1 no hydrogen 2.929 N/A TYR 303.A N THR 300.A O no hydrogen 3.098 N/A TYR 303.A OH TYR 275.A OH no hydrogen 3.377 N/A GLN 305.A NE2 ARG 266.A O no hydrogen 3.056 N/A TRP 308.A NE1 ASP 144.A OD1 no hydrogen 3.000 N/A TRP 308.A NE1 ASP 144.A OD2 no hydrogen 3.007 N/A LEU 310.A N SER 306.A O no hydrogen 3.058 N/A ASP 311.A N THR 307.A O no hydrogen 2.616 N/A ARG 312.A N TRP 308.A O no hydrogen 2.995 N/A CYS 313.A N PHE 309.A O no hydrogen 3.049 N/A CYS 313.A SG PHE 309.A O no hydrogen 3.309 N/A ASP 314.A N LEU 310.A O no hydrogen 3.154 N/A GLU 315.A N ASP 311.A O no hydrogen 3.147 N/A GLY 317.A N CYS 313.A O no hydrogen 3.084 N/A LEU 318.A N CYS 313.A O no hydrogen 3.041 N/A LEU 319.A N ASN 296.A O no hydrogen 2.994 N/A ILE 324.A N GLY 360.A O no hydrogen 3.134 N/A TRP 335.A N ASP 332.A OD1 no hydrogen 3.301 N/A GLN 336.A N ASP 332.A O no hydrogen 2.959 N/A GLN 336.A NE2 ASP 332.A O no hydrogen 3.063 N/A ASP 337.A N GLN 333.A O no hydrogen 2.808 N/A ARG 338.A N ALA 334.A O no hydrogen 2.972 N/A SER 339.A N TRP 335.A O no hydrogen 2.605 N/A VAL 340.A N GLN 336.A O no hydrogen 3.018 N/A ASP 341.A N ASP 337.A O no hydrogen 3.115 N/A ASP 341.A N ARG 338.A O no hydrogen 3.067 N/A ASN 342.A N ARG 338.A O no hydrogen 3.432 N/A ASN 342.A N SER 339.A O no hydrogen 3.231 N/A ASN 342.A ND2 ASP 94.A OD1 no hydrogen 3.014 N/A ALA 345.A N ASP 341.A O no hydrogen 2.900 N/A MET 346.A N ASN 342.A O no hydrogen 2.487 N/A ILE 347.A N VAL 343.A O no hydrogen 2.907 N/A THR 348.A N ARG 344.A O no hydrogen 3.076 N/A THR 348.A OG1 ARG 344.A O no hydrogen 2.749 N/A THR 348.A OG1 ALA 345.A O no hydrogen 3.238 N/A ARG 349.A NE ASP 350.A OD1 no hydrogen 2.678 N/A ARG 349.A NH1 GLN 305.A O no hydrogen 3.312 N/A ARG 349.A NH2 GLN 305.A O no hydrogen 3.284 N/A ARG 349.A NH2 ASP 350.A OD1 no hydrogen 3.205 N/A ASP 350.A N MET 346.A O no hydrogen 3.190 N/A ASP 350.A N ILE 347.A O no hydrogen 3.151 N/A ASN 352.A ND2 ALA 158.A O no hydrogen 3.314 N/A HIS 353.A ND1 ASP 314.A OD2 no hydrogen 2.751 N/A SER 355.A OG ASP 314.A OD1 no hydrogen 2.765 N/A ILE 356.A N HIS 353.A O no hydrogen 3.298 N/A VAL 357.A N VAL 320.A O no hydrogen 3.434 N/A TRP 359.A N ALA 388.A O no hydrogen 3.130 N/A TRP 359.A NE1 ASP 384.A OD2 no hydrogen 3.171 N/A GLY 360.A N GLU 322.A O no hydrogen 2.758 N/A VAL 361.A N GLY 390.A O no hydrogen 2.885 N/A ARG 362.A NH1 ASP 368.A OD1 no hydrogen 3.507 N/A ARG 362.A NH1 SER 398.A OG no hydrogen 3.195 N/A ARG 362.A NH2 SER 366.A O no hydrogen 3.355 N/A ARG 362.A NH2 ASP 368.A OD1 no hydrogen 3.006 N/A ILE 363.A N TYR 373.A OH no hydrogen 2.957 N/A SER 366.A N ILE 363.A O no hydrogen 3.428 N/A SER 366.A OG ILE 363.A O no hydrogen 3.193 N/A SER 366.A OG PRO 367.A O no hydrogen 2.944 N/A SER 366.A OG TYR 373.A OH no hydrogen 2.507 N/A ASN 369.A ND2 GLN 336.A OE1 no hydrogen 3.478 N/A HIS 370.A ND1 GLU 399.A OE2 no hydrogen 2.539 N/A PHE 372.A N ASN 369.A OD1 no hydrogen 2.834 N/A TYR 373.A N ASN 369.A O no hydrogen 2.917 N/A TYR 373.A OH SER 366.A OG no hydrogen 2.507 N/A VAL 374.A N HIS 370.A O no hydrogen 2.608 N/A ARG 375.A NH1 ASP 337.A OD1 no hydrogen 3.470 N/A THR 376.A N PHE 372.A O no hydrogen 3.214 N/A THR 376.A OG1 VAL 361.A O no hydrogen 3.201 N/A THR 376.A OG1 TYR 373.A O no hydrogen 2.779 N/A ASN 377.A N TYR 373.A O no hydrogen 2.911 N/A ALA 378.A N VAL 374.A O no hydrogen 2.880 N/A LEU 379.A N ARG 375.A O no hydrogen 2.727 N/A ALA 380.A N THR 376.A O no hydrogen 2.942 N/A ARG 381.A N ASN 377.A O no hydrogen 3.170 N/A ARG 381.A NH2 ASP 403.A OD1 no hydrogen 2.452 N/A GLU 382.A N ALA 378.A O no hydrogen 3.385 N/A LEU 383.A N LEU 379.A O no hydrogen 3.046 N/A ASP 384.A N ALA 380.A O no hydrogen 2.574 N/A THR 386.A N ASP 384.A OD1 no hydrogen 2.884 N/A THR 386.A OG1 ASP 384.A OD1 no hydrogen 2.491 N/A THR 386.A OG1 ASP 384.A OD2 no hydrogen 3.234 N/A ARG 387.A NE ILE 356.A O no hydrogen 2.830 N/A ARG 387.A NH1 TRP 351.A O no hydrogen 2.723 N/A ARG 387.A NH1 ASP 384.A OD2 no hydrogen 3.351 N/A ARG 387.A NH2 HIS 353.A O no hydrogen 2.673 N/A ILE 389.A N ASP 403.A OD2 no hydrogen 2.916 N/A GLY 390.A N TRP 359.A O no hydrogen 2.822 N/A GLY 391.A N THR 406.A OG1 no hydrogen 3.404 N/A ASP 397.A N VAL 433.A O no hydrogen 2.659 N/A SER 398.A OG ASP 368.A OD1 no hydrogen 2.382 N/A SER 398.A OG ASP 368.A OD2 no hydrogen 3.140 N/A GLU 399.A N ASP 368.A OD2 no hydrogen 2.958 N/A MET 400.A N SER 398.A O no hydrogen 2.880 N/A ASP 403.A N ILE 389.A O no hydrogen 2.930 N/A TYR 405.A N PRO 441.A O no hydrogen 2.761 N/A TYR 405.A OH ILE 395.A O no hydrogen 3.355 N/A THR 406.A OG1 GLY 391.A O no hydrogen 2.606 N/A THR 406.A OG1 VAL 404.A O no hydrogen 2.449 N/A MET 407.A N LEU 443.A O no hydrogen 3.211 N/A ASN 408.A N ARG 393.A O no hydrogen 2.704 N/A ASP 409.A N GLU 446.A O no hydrogen 3.109 N/A SER 415.A N ASP 413.A OD1 no hydrogen 2.728 N/A LEU 417.A N GLU 414.A O no hydrogen 3.221 N/A ARG 424.A NH1 GLU 465.A OE2 no hydrogen 3.314 N/A ARG 424.A NH2 GLU 465.A OE2 no hydrogen 2.746 N/A ARG 424.A NH2 GLU 472.A OE1 no hydrogen 2.674 N/A THR 425.A OG1 PRO 423.A O no hydrogen 2.559 N/A ARG 428.A N ASP 409.A OD2 no hydrogen 2.978 N/A ARG 428.A NE ASP 409.A OD1 no hydrogen 3.121 N/A ARG 428.A NH1 ASP 409.A OD1 no hydrogen 2.802 N/A GLU 431.A N GLU 431.A OE1 no hydrogen 2.548 N/A GLU 432.A N PRO 429.A O no hydrogen 3.309 N/A VAL 433.A N THR 430.A O no hydrogen 3.248 N/A THR 434.A N THR 430.A O no hydrogen 2.761 N/A THR 434.A OG1 THR 430.A O no hydrogen 2.420 N/A GLY 435.A N GLU 431.A O no hydrogen 3.205 N/A LEU 443.A N TYR 405.A O no hydrogen 3.394 N/A THR 445.A N MET 407.A O no hydrogen 2.811 N/A THR 445.A OG1 MET 407.A O no hydrogen 2.767 N/A MET 451.A N ASN 448.A O no hydrogen 2.897 N/A PHE 452.A N GLY 449.A O no hydrogen 2.787 N/A THR 454.A N HIS 508.A O no hydrogen 2.977 N/A THR 454.A OG1 PRO 453.A O no hydrogen 3.166 N/A LYS 455.A N ASP 458.A OD2 no hydrogen 2.641 N/A ASP 458.A N LYS 455.A O no hydrogen 2.912 N/A ARG 462.A N PRO 459.A O no hydrogen 2.966 N/A ARG 462.A NE PRO 453.A O no hydrogen 3.071 N/A ARG 462.A NH2 PRO 453.A O no hydrogen 2.807 N/A GLN 463.A N PRO 459.A O no hydrogen 3.217 N/A GLN 463.A NE2 ALA 456.A O no hydrogen 2.957 N/A GLN 463.A NE2 ASP 458.A O no hydrogen 3.131 N/A HIS 466.A N ARG 462.A O no hydrogen 2.863 N/A VAL 467.A N GLN 463.A O no hydrogen 3.268 N/A ILE 468.A N MET 464.A O no hydrogen 2.955 N/A ARG 469.A N GLU 465.A O no hydrogen 2.918 N/A ARG 469.A NE GLU 465.A OE2 no hydrogen 3.295 N/A ARG 469.A NH2 GLU 416.A OE2 no hydrogen 2.863 N/A HIS 470.A N HIS 466.A O no hydrogen 3.220 N/A HIS 470.A ND1 TYR 525.A OH no hydrogen 3.167 N/A LEU 471.A N VAL 467.A O no hydrogen 2.990 N/A GLU 472.A N ILE 468.A O no hydrogen 2.725 N/A VAL 473.A N ARG 469.A O no hydrogen 3.422 N/A LEU 474.A N HIS 470.A O no hydrogen 2.968 N/A ASN 475.A N LEU 471.A O no hydrogen 2.778 N/A ALA 476.A N GLU 472.A O no hydrogen 2.801 N/A ALA 477.A N VAL 473.A O no hydrogen 2.992 N/A HIS 478.A N LEU 474.A O no hydrogen 3.178 N/A GLY 479.A N ASN 475.A O no hydrogen 3.340 N/A GLY 479.A N ALA 476.A O no hydrogen 3.239 N/A ASP 480.A N ALA 476.A O no hydrogen 3.162 N/A ALA 482.A N ASP 480.A OD1 no hydrogen 3.218 N/A ILE 483.A N ASP 480.A O no hydrogen 3.276 N/A SER 484.A N TYR 442.A O no hydrogen 2.781 N/A CYS 486.A N LEU 261.A O no hydrogen 2.675 N/A CYS 486.A SG TYR 447.A OH no hydrogen 3.742 N/A GLY 488.A N GLY 263.A O no hydrogen 3.086 N/A TRP 489.A N TYR 447.A O no hydrogen 2.938 N/A TRP 489.A NE1 TYR 494.A OH no hydrogen 3.063 N/A CYS 490.A N HIS 509.A O no hydrogen 2.898 N/A CYS 490.A SG PHE 492.A O no hydrogen 2.869 N/A MET 491.A N ASN 265.A O no hydrogen 2.877 N/A TYR 494.A OH ASP 134.A OD1 no hydrogen 2.227 N/A TYR 494.A OH HIS 509.A ND1 no hydrogen 3.391 N/A ASN 495.A ND2 LEU 40.A O no hydrogen 3.243 N/A ASN 495.A ND2 ARG 505.A O no hydrogen 2.729 N/A THR 496.A N ARG 505.A O no hydrogen 3.100 N/A THR 496.A OG1 HIS 497.A O no hydrogen 3.355 N/A HIS 497.A NE2 GLU 122.A OE2 no hydrogen 2.506 N/A LYS 498.A N GLU 45.A OE2 no hydrogen 3.049 N/A LYS 498.A NZ ASP 499.A OD1 no hydrogen 2.892 N/A PHE 500.A N HIS 497.A O no hydrogen 2.929 N/A ALA 502.A N ILE 506.A O no hydrogen 3.070 N/A ASP 504.A N ASP 504.A OD1 no hydrogen 2.443 N/A ARG 505.A NE GLU 45.A OE1 no hydrogen 3.197 N/A ILE 506.A N ASP 504.A OD1 no hydrogen 3.021 N/A CYS 507.A SG ASP 134.A OD1 no hydrogen 3.774 N/A CYS 507.A SG ASP 134.A OD2 no hydrogen 3.211 N/A CYS 507.A SG TYR 494.A OH no hydrogen 3.407 N/A HIS 508.A NE2 ASP 504.A OD2 no hydrogen 2.757 N/A GLY 510.A N ASP 493.A OD1 no hydrogen 2.429 N/A VAL 511.A N MET 491.A O no hydrogen 3.376 N/A MET 512.A N MET 491.A O no hydrogen 3.320 N/A ASP 513.A N GLU 517.A O no hydrogen 3.055 N/A ARG 516.A N ASP 513.A O no hydrogen 2.890 N/A ARG 516.A NE ASP 285.A OD1 no hydrogen 2.845 N/A ARG 516.A NH1 SER 269.A O no hydrogen 3.366 N/A ARG 516.A NH1 ILE 514.A O no hydrogen 3.043 N/A ARG 516.A NH2 SER 269.A O no hydrogen 3.250 N/A ARG 516.A NH2 ASP 285.A OD1 no hydrogen 3.481 N/A ARG 516.A NH2 ASP 285.A OD2 no hydrogen 3.056 N/A GLU 517.A N ASP 513.A OD2 no hydrogen 2.543 N/A LYS 519.A N VAL 511.A O no hydrogen 2.701 N/A LYS 519.A NZ THR 454.A O no hydrogen 3.006 N/A LYS 519.A NZ ASP 493.A OD1 no hydrogen 2.875 N/A LYS 519.A NZ ASP 493.A OD2 no hydrogen 2.618 N/A LYS 519.A NZ GLY 510.A O no hydrogen 3.416 N/A ALA 522.A N LYS 519.A O no hydrogen 2.935 N/A HIS 523.A N PHE 520.A O no hydrogen 3.371 N/A ALA 524.A N ALA 521.A O no hydrogen 2.726 N/A TYR 525.A OH TYR 447.A OH no hydrogen 2.521 N/A TYR 525.A OH HIS 470.A ND1 no hydrogen 3.167 N/A GLY 526.A N ALA 522.A O no hydrogen 2.847 N/A SER 527.A N ALA 524.A O no hydrogen 3.310 N/A GLN 528.A N TYR 525.A O no hydrogen 3.046 N/A GLN 528.A NE2 ALA 524.A O no hydrogen 3.425 N/A GLN 528.A NE2 ARG 588.A O no hydrogen 3.002 N/A GLU 533.A N PRO 530.A O no hydrogen 2.838 N/A GLY 534.A N PRO 531.A O no hydrogen 2.436 N/A GLU 538.A N LEU 559.A O no hydrogen 3.113 N/A THR 541.A OG1 GLU 460.A OE1 no hydrogen 2.660 N/A THR 541.A OG1 GLU 460.A OE2 no hydrogen 2.418 N/A PHE 542.A N GLU 460.A OE1 no hydrogen 2.606 N/A TRP 543.A N THR 541.A OG1 no hydrogen 2.881 N/A ARG 548.A NH1 GLU 460.A OE2 no hydrogen 2.124 N/A GLY 552.A N ARG 545.A O no hydrogen 2.724 N/A LEU 556.A N ILE 593.A O no hydrogen 3.106 N/A VAL 558.A N VAL 591.A O no hydrogen 2.865 N/A LEU 559.A N GLU 538.A O no hydrogen 2.817 N/A THR 560.A OG1 VAL 536.A O no hydrogen 2.503 N/A ASN 561.A N VAL 536.A O no hydrogen 3.128 N/A CYS 562.A N THR 560.A OG1 no hydrogen 3.297 N/A CYS 562.A SG THR 560.A OG1 no hydrogen 3.098 N/A VAL 565.A N VAL 576.A O no hydrogen 3.238 N/A GLU 566.A N THR 616.A O no hydrogen 2.780 N/A PHE 567.A N ARG 574.A O no hydrogen 2.900 N/A CYS 569.A N VAL 572.A O no hydrogen 3.146 N/A CYS 569.A SG HIS 611.A O no hydrogen 3.320 N/A CYS 569.A SG PRO 612.A O no hydrogen 3.339 N/A VAL 572.A N CYS 569.A O no hydrogen 2.858 N/A THR 573.A OG1 VAL 572.A O no hydrogen 2.916 N/A ARG 574.A N PHE 567.A O no hydrogen 2.989 N/A ARG 574.A NE THR 573.A O no hydrogen 2.740 N/A ARG 574.A NH1 HIS 597.A O no hydrogen 3.383 N/A ARG 574.A NH1 GLU 602.A OE2 no hydrogen 2.913 N/A ARG 574.A NH2 GLU 602.A OE1 no hydrogen 3.351 N/A VAL 576.A N VAL 565.A O no hydrogen 3.021 N/A ASP 579.A N PRO 590.A O no hydrogen 2.998 N/A ARG 580.A N PRO 578.A O no hydrogen 3.081 N/A ARG 582.A N ASP 579.A O no hydrogen 2.893 N/A PHE 583.A N ASP 579.A O no hydrogen 2.610 N/A ARG 588.A N GLN 528.A OE1 no hydrogen 3.128 N/A VAL 591.A N VAL 558.A O no hydrogen 2.575 N/A ILE 593.A N LEU 556.A O no hydrogen 3.040 N/A ARG 596.A NH2 ASP 579.A OD1 no hydrogen 3.208 N/A ILE 598.A N HIS 595.A O no hydrogen 2.829 N/A GLU 602.A N SER 599.A O no hydrogen 3.016 N/A GLY 604.A N ALA 600.A O no hydrogen 2.899 N/A GLY 607.A N GLY 604.A O no hydrogen 2.584 N/A SER 609.A OG HIS 611.A NE2 no hydrogen 2.954 N/A GLY 613.A N TYR 629.A O no hydrogen 2.699 N/A ARG 614.A NE GLU 568.A OE1 no hydrogen 3.366 N/A ILE 615.A N ARG 627.A O no hydrogen 2.859 N/A THR 616.A N GLU 566.A O no hydrogen 3.425 N/A THR 616.A OG1 GLU 566.A OE1 no hydrogen 3.161 N/A GLY 617.A N ALA 625.A O no hydrogen 2.765 N/A LEU 619.A N GLU 622.A O no hydrogen 3.463 N/A GLU 622.A N LEU 619.A O no hydrogen 3.229 N/A VAL 624.A N GLY 617.A O no hydrogen 2.960 N/A ARG 627.A N ILE 615.A O no hydrogen 2.877 N/A TYR 629.A N GLY 613.A O no hydrogen 2.986 N/A LEU 634.A N GLN 664.A OE1 no hydrogen 2.425 N/A THR 636.A N LEU 662.A O no hydrogen 2.900 N/A THR 636.A OG1 LEU 634.A O no hydrogen 3.507 N/A THR 636.A OG1 LEU 662.A O no hydrogen 2.668 N/A THR 637.A N LEU 662.A O no hydrogen 3.175 N/A GLN 639.A N ARG 660.A O no hydrogen 2.680 N/A ALA 641.A N MET 658.A O no hydrogen 2.796 N/A ASP 643.A N ARG 656.A O no hydrogen 3.335 N/A LEU 647.A N THR 729.A O no hydrogen 2.969 N/A ASP 650.A N PRO 648.A O no hydrogen 2.653 N/A ASP 652.A N ASP 650.A OD1 no hydrogen 3.328 N/A LEU 655.A N LEU 703.A O no hydrogen 3.225 N/A ARG 656.A NH1 TRP 515.A O no hydrogen 3.219 N/A ARG 656.A NH1 ARG 516.A O no hydrogen 2.764 N/A ARG 656.A NH2 ASP 643.A OD1 no hydrogen 3.324 N/A VAL 657.A N MET 701.A O no hydrogen 2.817 N/A MET 658.A N ALA 641.A O no hydrogen 3.147 N/A LEU 659.A N THR 699.A O no hydrogen 2.630 N/A ARG 660.A NE GLN 639.A OE1 no hydrogen 3.160 N/A ARG 660.A NH1 GLU 517.A OE2 no hydrogen 2.988 N/A ARG 660.A NH2 GLN 639.A OE1 no hydrogen 3.187 N/A ALA 661.A N GLY 697.A O no hydrogen 3.156 N/A LEU 662.A N THR 637.A O no hydrogen 2.747 N/A ASP 663.A N ASN 667.A O no hydrogen 2.932 N/A GLN 664.A N GLN 664.A OE1 no hydrogen 2.916 N/A GLN 664.A NE2 ASP 632.A O no hydrogen 3.223 N/A GLY 666.A N ASP 663.A O no hydrogen 3.206 N/A GLY 666.A N ASP 663.A OD1 no hydrogen 2.884 N/A ASN 667.A ND2 GLU 628.A O no hydrogen 2.825 N/A ARG 668.A NH1 GLY 696.A O no hydrogen 3.405 N/A LEU 669.A N ALA 661.A O no hydrogen 2.942 N/A ILE 676.A N ARG 692.A O no hydrogen 2.703 N/A ALA 677.A N ARG 717.A O no hydrogen 3.123 N/A VAL 678.A N ASP 690.A O no hydrogen 3.342 N/A THR 679.A N THR 715.A O no hydrogen 3.327 N/A THR 679.A OG1 THR 715.A OG1 no hydrogen 2.787 N/A ASP 681.A N ARG 713.A O no hydrogen 2.737 N/A ARG 685.A N ARG 704.A O no hydrogen 3.379 N/A ILE 687.A N LEU 702.A O no hydrogen 2.972 N/A ARG 692.A N ILE 676.A O no hydrogen 2.961 N/A ARG 692.A NE PRO 689.A O no hydrogen 2.637 N/A LEU 694.A N ALA 674.A O no hydrogen 3.005 N/A GLN 695.A N THR 698.A O no hydrogen 2.932 N/A GLY 696.A N GLN 457.A OE1 no hydrogen 3.291 N/A THR 699.A N LEU 659.A O no hydrogen 3.078 N/A THR 699.A OG1 GLY 700.A O no hydrogen 3.193 N/A LEU 703.A N LEU 655.A O no hydrogen 3.227 N/A ARG 704.A NH2 THR 30.A O no hydrogen 3.523 N/A LEU 705.A N ILE 653.A O no hydrogen 3.115 N/A THR 706.A N PRO 683.A O no hydrogen 2.695 N/A THR 706.A OG1 PRO 683.A O no hydrogen 3.001 N/A THR 706.A OG1 ASP 708.A OD1 no hydrogen 2.049 N/A GLY 710.A N VAL 730.A O no hydrogen 2.844 N/A ILE 712.A N VAL 728.A O no hydrogen 2.944 N/A ARG 713.A N ASP 681.A O no hydrogen 3.198 N/A ARG 713.A NH2 ASP 681.A OD2 no hydrogen 3.457 N/A ILE 714.A N ALA 726.A O no hydrogen 2.808 N/A THR 715.A N THR 679.A O no hydrogen 2.897 N/A THR 715.A N THR 679.A OG1 no hydrogen 3.353 N/A THR 715.A OG1 THR 679.A OG1 no hydrogen 2.787 N/A ALA 716.A N ALA 724.A O no hydrogen 2.913 N/A ARG 717.A N ALA 677.A O no hydrogen 2.862 N/A GLN 720.A N HIS 718.A ND1 no hydrogen 3.465 N/A PHE 721.A N HIS 718.A O no hydrogen 2.802 N/A ALA 724.A N ALA 716.A O no hydrogen 3.230 N/A ALA 726.A N ILE 714.A O no hydrogen 3.160 N/A VAL 728.A N ILE 712.A O no hydrogen 3.052 N/A THR 729.A N ASP 645.A O no hydrogen 2.787 N/A VAL 730.A N GLY 710.A O no hydrogen 2.601 N/A GLY 731.A N LEU 647.A O no hydrogen 3.074 N/A