Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wpd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N PRO 3.A O no hydrogen 3.415 N/A CYS 8.A N PHE 5.A O no hydrogen 2.628 N/A GLU 9.A N ASN 17.A O no hydrogen 3.056 N/A GLN 11.A NE2 GLU 9.A OE2 no hydrogen 3.303 N/A LEU 15.A N GLN 11.A O no hydrogen 3.452 N/A VAL 16.A N SER 40.A O no hydrogen 2.750 N/A ASN 17.A N GLU 9.A O no hydrogen 2.685 N/A CYS 18.A N SER 42.A O no hydrogen 2.611 N/A ASN 19.A N ASN 17.A OD1 no hydrogen 2.826 N/A TRP 20.A N LEU 44.A O no hydrogen 2.867 N/A LEU 23.A N ASN 46.A OD1 no hydrogen 2.993 N/A SER 25.A OG VAL 26.A O no hydrogen 3.540 N/A ARG 35.A N ALA 33.A O no hydrogen 2.782 N/A ARG 35.A NE SER 30.A O no hydrogen 3.048 N/A ARG 35.A NH1 SER 30.A O no hydrogen 3.243 N/A ASN 37.A N PRO 34.A O no hydrogen 2.853 N/A VAL 38.A N ARG 35.A O no hydrogen 3.131 N/A THR 39.A N GLY 14.A O no hydrogen 2.975 N/A THR 39.A OG1 GLY 14.A O no hydrogen 3.282 N/A LEU 41.A N LYS 64.A O no hydrogen 2.783 N/A SER 42.A N VAL 16.A O no hydrogen 2.951 N/A SER 42.A OG ASN 19.A OD1 no hydrogen 2.479 N/A LEU 43.A N ASN 66.A O no hydrogen 2.754 N/A LEU 44.A N ASN 19.A OD1 no hydrogen 3.182 N/A SER 45.A N LYS 68.A O no hydrogen 2.874 N/A ASN 46.A ND2 CYS 18.A O no hydrogen 2.740 N/A ARG 47.A N LEU 23.A O no hydrogen 3.000 N/A ILE 48.A N ASN 70.A OD1 no hydrogen 2.948 N/A HIS 50.A ND1 THR 86.A OG1 no hydrogen 2.551 N/A LEU 51.A N THR 86.A O no hydrogen 2.854 N/A HIS 52.A N ASP 55.A OD2 no hydrogen 3.015 N/A ASP 53.A N GLU 88.A OE1 no hydrogen 3.059 N/A ASP 55.A N HIS 52.A O no hydrogen 3.130 N/A LEU 59.A N PHE 56.A O no hydrogen 3.308 N/A SER 60.A OG ASP 36.A OD1 no hydrogen 3.462 N/A ASN 61.A ND2 ASP 36.A O no hydrogen 2.590 N/A LEU 62.A N LEU 59.A O no hydrogen 3.088 N/A GLN 63.A N THR 39.A O no hydrogen 3.186 N/A LEU 65.A N GLU 100.A O no hydrogen 3.031 N/A ASN 66.A N LEU 41.A O no hydrogen 3.079 N/A LEU 67.A N ASN 102.A O no hydrogen 3.097 N/A TRP 69.A N SER 104.A O no hydrogen 3.023 N/A ASN 70.A ND2 LEU 43.A O no hydrogen 2.858 N/A ASN 70.A ND2 LEU 67.A O no hydrogen 2.872 N/A LEU 76.A N PRO 73.A O no hydrogen 2.871 N/A SER 77.A N PRO 73.A O no hydrogen 3.164 N/A SER 77.A N ALA 74.A O no hydrogen 3.154 N/A HIS 80.A N SER 77.A O no hydrogen 2.950 N/A HIS 80.A ND1 ALA 74.A O no hydrogen 3.087 N/A PHE 81.A N SER 77.A OG no hydrogen 3.219 N/A MET 85.A N GLY 107.A O no hydrogen 2.782 N/A THR 86.A N HIS 49.A O no hydrogen 3.329 N/A THR 86.A OG1 HIS 49.A O no hydrogen 3.513 N/A THR 86.A OG1 HIS 50.A ND1 no hydrogen 2.551 N/A GLU 88.A N LEU 51.A O no hydrogen 2.715 N/A ASN 90.A N ASP 53.A OD1 no hydrogen 3.077 N/A THR 91.A N GLU 88.A O no hydrogen 3.153 N/A THR 91.A OG1 LEU 51.A O no hydrogen 3.532 N/A THR 91.A OG1 GLU 88.A O no hydrogen 2.496 N/A ALA 94.A N ASN 90.A O no hydrogen 3.059 N/A VAL 95.A N PHE 92.A O no hydrogen 2.964 N/A THR 97.A OG1 SER 60.A O no hydrogen 3.249 N/A THR 97.A OG1 LEU 62.A O no hydrogen 2.881 N/A LEU 98.A N VAL 95.A O no hydrogen 3.103 N/A GLU 99.A N GLN 63.A O no hydrogen 2.992 N/A GLU 100.A N GLN 63.A O no hydrogen 2.893 N/A LEU 101.A N SER 120.A O no hydrogen 3.026 N/A ASN 102.A N LEU 65.A O no hydrogen 2.999 N/A LEU 103.A N ILE 122.A O no hydrogen 2.811 N/A SER 104.A N ASN 102.A OD1 no hydrogen 3.208 N/A SER 104.A OG ASN 102.A OD1 no hydrogen 2.610 N/A TYR 105.A N SER 124.A O no hydrogen 2.916 N/A ASN 106.A ND2 LEU 67.A O no hydrogen 2.724 N/A ASN 106.A ND2 LEU 103.A O no hydrogen 3.272 N/A ILE 108.A N ASN 106.A O no hydrogen 3.128 N/A THR 110.A OG1 VAL 111.A O no hydrogen 3.322 N/A SER 117.A OG PRO 96.A O no hydrogen 3.092 N/A SER 117.A OG LEU 98.A O no hydrogen 2.660 N/A LEU 118.A N PRO 115.A O no hydrogen 3.160 N/A VAL 119.A N GLU 99.A O no hydrogen 2.906 N/A SER 120.A N GLU 99.A O no hydrogen 3.024 N/A LEU 121.A N PHE 144.A O no hydrogen 2.834 N/A ILE 122.A N LEU 101.A O no hydrogen 2.887 N/A LEU 123.A N TYR 146.A O no hydrogen 2.809 N/A SER 124.A OG TYR 146.A O no hydrogen 3.550 N/A ARG 125.A N ASP 148.A O no hydrogen 2.792 N/A ARG 125.A NE TYR 152.A OH no hydrogen 3.269 N/A THR 126.A N ASN 150.A OD1 no hydrogen 3.099 N/A THR 126.A OG1 LEU 123.A O no hydrogen 2.743 N/A ASN 127.A N ILE 108.A O no hydrogen 2.951 N/A ASN 127.A ND2 ASN 155.A OD1 no hydrogen 3.254 N/A GLN 130.A NE2 GLU 162.A OE1 no hydrogen 2.961 N/A LEU 131.A N GLU 162.A O no hydrogen 2.847 N/A ASP 132.A N SER 135.A OG no hydrogen 2.793 N/A THR 134.A N ASP 132.A OD1 no hydrogen 2.760 N/A THR 134.A OG1 ASP 132.A OD1 no hydrogen 2.472 N/A SER 135.A N ASP 132.A O no hydrogen 3.058 N/A SER 135.A OG ASP 132.A O no hydrogen 2.567 N/A SER 135.A OG ASP 132.A OD1 no hydrogen 3.538 N/A THR 137.A OG1 PRO 133.A O no hydrogen 2.684 N/A LEU 139.A N LEU 136.A O no hydrogen 3.221 N/A LEU 142.A N LEU 139.A O no hydrogen 3.108 N/A ARG 143.A N VAL 119.A O no hydrogen 2.751 N/A PHE 144.A N VAL 119.A O no hydrogen 3.026 N/A LEU 145.A N HIS 176.A O no hydrogen 3.019 N/A TYR 146.A N LEU 121.A O no hydrogen 3.144 N/A MET 147.A N SER 178.A O no hydrogen 2.758 N/A ASP 148.A N SER 124.A OG no hydrogen 2.980 N/A GLY 149.A N LYS 180.A O no hydrogen 3.081 N/A ASN 150.A N ASN 182.A OD1 no hydrogen 2.763 N/A ASN 150.A ND2 THR 126.A OG1 no hydrogen 3.217 N/A ASN 150.A ND2 ILE 128.A O no hydrogen 3.042 N/A CYS 151.A N TYR 181.A O no hydrogen 3.314 N/A CYS 151.A SG ARG 159.A O no hydrogen 3.229 N/A TYR 152.A N ASN 155.A O no hydrogen 3.394 N/A ASN 155.A N TYR 152.A O no hydrogen 3.050 N/A ASN 155.A ND2 THR 126.A O no hydrogen 3.524 N/A ASN 155.A ND2 GLY 149.A O no hydrogen 3.192 N/A CYS 157.A SG ARG 159.A O no hydrogen 2.933 N/A ARG 159.A NE GLU 162.A OE2 no hydrogen 2.600 N/A ARG 159.A NH2 GLU 162.A OE2 no hydrogen 2.902 N/A LEU 161.A N ASN 182.A O no hydrogen 3.264 N/A GLU 162.A N LEU 129.A O no hydrogen 2.915 N/A ALA 164.A N LEU 131.A O no hydrogen 3.243 N/A GLY 166.A N ARG 189.A O no hydrogen 2.742 N/A ALA 167.A N ALA 164.A O no hydrogen 3.025 N/A LEU 171.A N LEU 168.A O no hydrogen 2.903 N/A GLY 172.A N GLY 170.A O no hydrogen 2.990 N/A ASN 173.A ND2 HIS 140.A O no hydrogen 3.178 N/A LEU 174.A N LEU 171.A O no hydrogen 2.964 N/A THR 175.A N ARG 143.A O no hydrogen 3.032 N/A THR 175.A OG1 ARG 143.A O no hydrogen 3.364 N/A THR 175.A OG1 HIS 176.A ND1 no hydrogen 2.689 N/A HIS 176.A N ARG 143.A O no hydrogen 2.916 N/A HIS 176.A ND1 THR 175.A OG1 no hydrogen 2.689 N/A LEU 177.A N TYR 197.A O no hydrogen 2.704 N/A SER 178.A N LEU 145.A O no hydrogen 2.988 N/A SER 178.A OG ASP 148.A OD1 no hydrogen 2.535 N/A SER 178.A OG ASP 148.A OD2 no hydrogen 2.864 N/A LEU 179.A N LEU 199.A O no hydrogen 3.026 N/A LYS 180.A N ASP 148.A OD1 no hydrogen 2.689 N/A TYR 181.A N TYR 202.A O no hydrogen 3.261 N/A ASN 182.A N ASN 203.A OD1 no hydrogen 2.987 N/A ASN 182.A ND2 MET 147.A O no hydrogen 2.752 N/A ASN 183.A ND2 ARG 159.A O no hydrogen 3.210 N/A LEU 184.A N ASN 203.A OD1 no hydrogen 3.369 N/A ARG 189.A NE VAL 187.A O no hydrogen 3.046 N/A ARG 189.A NH1 VAL 187.A O no hydrogen 2.844 N/A ARG 189.A NH1 ASP 212.A OD1 no hydrogen 2.546 N/A ARG 189.A NH2 ASP 212.A OD1 no hydrogen 3.328 N/A SER 194.A OG LEU 174.A O no hydrogen 2.741 N/A LEU 195.A N PRO 192.A O no hydrogen 2.998 N/A GLU 196.A N THR 175.A O no hydrogen 2.742 N/A TYR 197.A N THR 175.A O no hydrogen 2.838 N/A LEU 198.A N VAL 221.A O no hydrogen 3.233 N/A LEU 199.A N LEU 177.A O no hydrogen 2.837 N/A LEU 200.A N ASP 223.A O no hydrogen 2.779 N/A TYR 202.A N GLY 225.A O no hydrogen 2.853 N/A ASN 203.A N ASN 227.A OD1 no hydrogen 2.601 N/A ASN 203.A ND2 LEU 179.A O no hydrogen 3.104 N/A ASN 203.A ND2 LEU 200.A O no hydrogen 3.004 N/A HIS 204.A N LEU 184.A O no hydrogen 2.792 N/A ILE 205.A N ASN 227.A OD1 no hydrogen 3.385 N/A LEU 208.A N GLN 247.A O no hydrogen 3.069 N/A ALA 209.A N ASP 212.A OD2 no hydrogen 2.801 N/A GLU 211.A N GLU 211.A OE2 no hydrogen 2.627 N/A ASP 212.A N ALA 209.A O no hydrogen 2.659 N/A LEU 213.A N PRO 210.A O no hydrogen 2.913 N/A ALA 214.A N GLU 211.A O no hydrogen 3.208 N/A LEU 216.A N LEU 213.A O no hydrogen 3.161 N/A ARG 220.A N GLU 196.A O no hydrogen 2.679 N/A ARG 220.A NE GLU 196.A OE1 no hydrogen 3.096 N/A ARG 220.A NH1 GLU 260.A OE2 no hydrogen 2.690 N/A ARG 220.A NH2 GLU 196.A OE1 no hydrogen 2.946 N/A VAL 221.A N GLU 196.A O no hydrogen 2.924 N/A LEU 222.A N GLY 261.A O no hydrogen 3.159 N/A ASP 223.A N LEU 198.A O no hydrogen 3.221 N/A VAL 224.A N VAL 263.A O no hydrogen 3.227 N/A GLY 225.A N ASP 223.A OD1 no hydrogen 3.029 N/A GLY 226.A N LYS 265.A O no hydrogen 2.946 N/A GLY 226.A N ASP 266.A O no hydrogen 3.045 N/A ASN 227.A ND2 LEU 200.A O no hydrogen 3.148 N/A ASN 227.A ND2 VAL 224.A O no hydrogen 2.634 N/A ARG 230.A N ASP 266.A OD1 no hydrogen 3.184 N/A ARG 230.A NH2 TYR 318.A O no hydrogen 3.391 N/A CYS 231.A N GLU 240.A OE1 no hydrogen 2.667 N/A CYS 231.A SG GLU 240.A OE1 no hydrogen 3.654 N/A CYS 241.A N ARG 229.A O no hydrogen 2.878 N/A CYS 241.A SG PRO 242.A O no hydrogen 3.722 N/A CYS 241.A SG PHE 245.A O no hydrogen 3.267 N/A PHE 245.A N PRO 242.A O no hydrogen 3.265 N/A PHE 245.A N HIS 243.A O no hydrogen 2.723 N/A GLN 247.A N VAL 206.A O no hydrogen 2.873 N/A GLN 247.A NE2 LYS 244.A O no hydrogen 3.519 N/A HIS 249.A N LEU 208.A O no hydrogen 3.024 N/A THR 252.A N HIS 249.A O no hydrogen 2.995 N/A THR 252.A OG1 LEU 208.A O no hydrogen 3.075 N/A THR 252.A OG1 HIS 249.A O no hydrogen 2.622 N/A SER 254.A N ASP 251.A O no hydrogen 3.270 N/A SER 254.A OG ASP 251.A O no hydrogen 2.612 N/A HIS 255.A NE2 LEU 213.A O no hydrogen 3.145 N/A LEU 256.A N PHE 253.A O no hydrogen 3.266 N/A LEU 259.A N LEU 256.A O no hydrogen 3.034 N/A GLU 260.A N ARG 220.A O no hydrogen 2.575 N/A GLY 261.A N ARG 220.A O no hydrogen 2.856 N/A LEU 262.A N VAL 285.A O no hydrogen 2.835 N/A VAL 263.A N LEU 222.A O no hydrogen 3.024 N/A LEU 264.A N ASP 287.A O no hydrogen 2.848 N/A ASP 266.A N SER 289.A O no hydrogen 2.888 N/A SER 267.A N ASN 291.A OD1 no hydrogen 2.708 N/A SER 267.A OG LEU 264.A O no hydrogen 2.971 N/A SER 267.A OG LYS 265.A O no hydrogen 3.054 N/A SER 268.A OG CYS 228.A O no hydrogen 2.836 N/A LEU 269.A N ASN 291.A OD1 no hydrogen 3.462 N/A ARG 275.A N ASN 273.A OD1 no hydrogen 3.080 N/A TRP 276.A N ASN 273.A O no hydrogen 2.764 N/A TRP 276.A NE1 LEU 248.A O no hydrogen 2.998 N/A PHE 277.A N PRO 274.A O no hydrogen 3.223 N/A GLY 281.A N GLY 279.A O no hydrogen 3.097 N/A THR 284.A N GLU 260.A O no hydrogen 2.648 N/A THR 284.A OG1 GLU 260.A O no hydrogen 3.322 N/A VAL 285.A N GLU 260.A O no hydrogen 2.823 N/A LEU 286.A N ARG 311.A O no hydrogen 3.016 N/A ASP 287.A N LEU 262.A O no hydrogen 2.989 N/A LEU 288.A N ASN 313.A O no hydrogen 2.919 N/A SER 289.A N ASP 287.A OD1 no hydrogen 3.025 N/A SER 289.A OG ASP 287.A OD1 no hydrogen 2.566 N/A GLU 290.A N SER 315.A O no hydrogen 2.899 N/A ASN 291.A ND2 LEU 264.A O no hydrogen 3.074 N/A ASN 291.A ND2 LEU 288.A O no hydrogen 2.916 N/A PHE 292.A N LEU 269.A O no hydrogen 2.809 N/A LEU 293.A N ASN 317.A OD1 no hydrogen 2.958 N/A ILE 297.A N LEU 293.A O no hydrogen 3.115 N/A THR 298.A N ASP 295.A O no hydrogen 3.414 N/A THR 298.A OG1 ASP 295.A O no hydrogen 2.788 N/A LYS 299.A N CYS 296.A O no hydrogen 3.179 N/A THR 300.A N CYS 296.A O no hydrogen 2.779 N/A ALA 302.A N THR 300.A OG1 no hydrogen 3.119 N/A GLN 304.A N LYS 301.A O no hydrogen 3.149 N/A LEU 306.A N PHE 303.A O no hydrogen 3.374 N/A ARG 310.A N THR 284.A O no hydrogen 2.878 N/A ARG 311.A N THR 284.A O no hydrogen 3.004 N/A LEU 312.A N GLU 341.A O no hydrogen 3.155 N/A ASN 313.A N LEU 286.A O no hydrogen 3.100 N/A LEU 314.A N ASP 343.A O no hydrogen 2.712 N/A SER 315.A N ASN 313.A OD1 no hydrogen 2.700 N/A SER 315.A OG ASN 313.A OD1 no hydrogen 2.327 N/A PHE 316.A N HIS 345.A O no hydrogen 3.116 N/A ASN 317.A ND2 LEU 288.A O no hydrogen 3.190 N/A ASN 317.A ND2 LEU 314.A O no hydrogen 2.619 N/A VAL 322.A N HIS 319.A O no hydrogen 3.043 N/A ALA 325.A N PHE 348.A O no hydrogen 2.807 N/A LEU 329.A N THR 356.A O no hydrogen 3.060 N/A ALA 330.A N ILE 297.A O no hydrogen 2.805 N/A SER 332.A OG THR 300.A O no hydrogen 2.701 N/A GLY 334.A N PRO 331.A O no hydrogen 3.164 N/A SER 335.A N SER 332.A O no hydrogen 2.611 N/A LEU 336.A N PHE 333.A O no hydrogen 2.926 N/A SER 338.A N ALA 307.A O no hydrogen 3.145 N/A SER 338.A OG ALA 307.A O no hydrogen 2.436 N/A LEU 339.A N LEU 336.A O no hydrogen 2.927 N/A GLN 340.A N ARG 310.A O no hydrogen 2.706 N/A GLU 341.A N ARG 310.A O no hydrogen 2.880 N/A LEU 342.A N ARG 368.A O no hydrogen 2.972 N/A ASP 343.A N LEU 312.A O no hydrogen 3.045 N/A MET 344.A N TYR 370.A O no hydrogen 2.738 N/A HIS 345.A N ASP 343.A OD1 no hydrogen 3.063 N/A HIS 345.A ND1 ASP 343.A OD1 no hydrogen 2.530 N/A GLY 346.A N GLN 372.A O no hydrogen 3.050 N/A ILE 347.A N ASN 374.A OD1 no hydrogen 2.763 N/A PHE 348.A N ASN 374.A OD1 no hydrogen 2.704 N/A PHE 349.A N ASN 374.A O no hydrogen 2.869 N/A LEU 352.A N GLN 378.A O no hydrogen 2.665 N/A SER 353.A N THR 356.A OG1 no hydrogen 2.859 N/A SER 353.A OG THR 356.A OG1 no hydrogen 3.390 N/A THR 356.A N SER 353.A O no hydrogen 3.063 N/A THR 356.A OG1 SER 351.A O no hydrogen 3.376 N/A THR 356.A OG1 SER 353.A O no hydrogen 3.041 N/A THR 356.A OG1 SER 353.A OG no hydrogen 3.390 N/A GLN 358.A N LYS 355.A O no hydrogen 3.225 N/A LEU 360.A N LEU 357.A O no hydrogen 3.213 N/A ALA 361.A N GLN 358.A O no hydrogen 2.901 N/A LEU 363.A N LEU 360.A O no hydrogen 2.771 N/A GLN 367.A N GLN 340.A O no hydrogen 2.909 N/A ARG 368.A N GLN 340.A O no hydrogen 3.009 N/A ARG 368.A NE TYR 370.A OH no hydrogen 2.904 N/A ARG 368.A NH1 TYR 370.A OH no hydrogen 3.485 N/A TYR 370.A N LEU 342.A O no hydrogen 3.128 N/A TYR 370.A OH GLU 341.A OE1 no hydrogen 2.923 N/A LEU 371.A N ASP 394.A O no hydrogen 2.691 N/A GLN 372.A N GLN 372.A OE1 no hydrogen 2.400 N/A MET 373.A N SER 396.A O no hydrogen 3.098 N/A ASN 374.A N ASN 398.A OD1 no hydrogen 2.857 N/A ASN 374.A ND2 MET 344.A O no hydrogen 2.667 N/A ASN 374.A ND2 LEU 371.A O no hydrogen 2.901 N/A ILE 376.A N ASN 398.A OD1 no hydrogen 3.064 N/A ASN 377.A N ARG 350.A O no hydrogen 2.832 N/A GLN 378.A N ARG 350.A O no hydrogen 3.281 N/A GLN 378.A NE2 ASN 377.A O no hydrogen 3.366 N/A ILE 383.A N GLN 380.A O no hydrogen 3.129 N/A LYS 385.A N GLY 382.A O no hydrogen 3.175 N/A PHE 387.A N PHE 384.A O no hydrogen 3.101 N/A ARG 391.A N GLN 367.A O no hydrogen 3.011 N/A TYR 392.A N GLN 367.A O no hydrogen 3.094 N/A ILE 393.A N THR 418.A O no hydrogen 2.958 N/A ASP 394.A N LEU 369.A O no hydrogen 2.885 N/A LEU 395.A N ASP 420.A O no hydrogen 2.974 N/A SER 396.A N ASP 394.A OD1 no hydrogen 2.852 N/A SER 396.A OG ASP 394.A OD1 no hydrogen 2.412 N/A SER 396.A OG ASP 394.A OD2 no hydrogen 3.495 N/A ASP 397.A N SER 422.A O no hydrogen 3.034 N/A ASN 398.A ND2 LEU 371.A O no hydrogen 3.163 N/A ASN 398.A ND2 LEU 395.A O no hydrogen 3.302 N/A ARG 399.A N ILE 376.A O no hydrogen 2.681 N/A ARG 399.A NH1 ASN 398.A O no hydrogen 3.083 N/A ILE 400.A N ASN 424.A OD1 no hydrogen 3.013 N/A GLU 405.A N GLN 378.A OE1 no hydrogen 3.174 N/A PHE 408.A N GLU 406.A OE1 no hydrogen 3.517 N/A LEU 415.A N CYS 412.A O no hydrogen 3.243 N/A SER 416.A N GLN 441.A OE1 no hydrogen 2.805 N/A THR 418.A N ARG 391.A O no hydrogen 2.623 N/A LEU 419.A N CYS 442.A O no hydrogen 2.936 N/A ASP 420.A N ILE 393.A O no hydrogen 3.167 N/A LEU 421.A N ARG 444.A O no hydrogen 2.813 N/A SER 422.A N ASP 420.A OD1 no hydrogen 2.880 N/A SER 422.A OG ASP 420.A OD1 no hydrogen 2.672 N/A ARG 423.A N SER 446.A O no hydrogen 3.177 N/A ASN 424.A ND2 LEU 395.A O no hydrogen 3.009 N/A ASN 424.A ND2 LEU 421.A O no hydrogen 3.350 N/A ASN 424.A ND2 SER 422.A O no hydrogen 3.014 N/A ASN 425.A N ILE 400.A O no hydrogen 3.238 N/A LEU 426.A N ASN 448.A OD1 no hydrogen 3.504 N/A VAL 429.A N GLN 452.A OE1 no hydrogen 2.570 N/A PHE 434.A N PRO 431.A O no hydrogen 3.156 N/A ALA 435.A N GLU 432.A O no hydrogen 3.097 N/A ARG 439.A NH2 LEU 390.A O no hydrogen 3.034 N/A LEU 440.A N LEU 437.A O no hydrogen 2.945 N/A GLN 441.A N PHE 417.A O no hydrogen 2.925 N/A CYS 442.A N PHE 417.A O no hydrogen 3.258 N/A LEU 443.A N VAL 467.A O no hydrogen 2.808 N/A ARG 444.A N LEU 419.A O no hydrogen 2.837 N/A LEU 445.A N ASP 469.A O no hydrogen 2.735 N/A SER 446.A OG ASP 469.A OD2 no hydrogen 3.404 N/A HIS 447.A N SER 471.A O no hydrogen 2.939 N/A ASN 448.A ND2 LEU 421.A O no hydrogen 3.346 N/A ASN 448.A ND2 LEU 445.A O no hydrogen 3.072 N/A SER 449.A N LEU 426.A O no hydrogen 3.197 N/A ILE 450.A N ASN 473.A OD1 no hydrogen 2.903 N/A SER 451.A N VAL 427.A O no hydrogen 3.174 N/A GLN 452.A NE2 VAL 429.A O no hydrogen 3.335 N/A ASN 455.A N GLN 458.A OE1 no hydrogen 3.106 N/A GLY 456.A N GLN 458.A OE1 no hydrogen 3.200 N/A SER 457.A N ASN 455.A OD1 no hydrogen 2.965 N/A SER 457.A OG ASN 455.A OD1 no hydrogen 2.760 N/A GLN 458.A NE2 ASN 455.A OD1 no hydrogen 3.014 N/A PHE 459.A N GLU 485.A OE2 no hydrogen 3.137 N/A LEU 462.A N PHE 459.A O no hydrogen 3.410 N/A THR 463.A N PRO 461.A O no hydrogen 3.007 N/A SER 464.A OG SER 438.A O no hydrogen 3.059 N/A LEU 465.A N LEU 462.A O no hydrogen 3.394 N/A GLN 466.A N GLN 441.A O no hydrogen 2.919 N/A VAL 467.A N GLN 441.A O no hydrogen 2.873 N/A LEU 468.A N ALA 491.A O no hydrogen 3.220 N/A ASP 469.A N LEU 443.A O no hydrogen 3.057 N/A LEU 470.A N ASP 493.A O no hydrogen 2.932 N/A SER 471.A N ASP 469.A OD1 no hydrogen 2.752 N/A SER 471.A OG ASP 469.A OD1 no hydrogen 2.656 N/A HIS 472.A N SER 495.A O no hydrogen 3.192 N/A ASN 473.A ND2 LEU 445.A O no hydrogen 3.389 N/A ASN 473.A ND2 LEU 470.A O no hydrogen 2.865 N/A ASN 473.A ND2 SER 471.A O no hydrogen 2.829 N/A LYS 474.A N ILE 450.A O no hydrogen 3.041 N/A LEU 475.A N ASN 497.A OD1 no hydrogen 3.124 N/A ASP 476.A N GLN 452.A O no hydrogen 3.136 N/A HIS 479.A N SER 482.A OG no hydrogen 3.102 N/A HIS 479.A ND1 VAL 454.A O no hydrogen 2.715 N/A SER 482.A N HIS 479.A O no hydrogen 3.253 N/A SER 482.A OG VAL 454.A O no hydrogen 2.709 N/A SER 482.A OG HIS 479.A O no hydrogen 3.543 N/A THR 484.A N ARG 481.A O no hydrogen 3.297 N/A THR 484.A OG1 ARG 481.A O no hydrogen 2.236 N/A GLU 485.A N GLU 485.A OE1 no hydrogen 2.594 N/A LEU 486.A N PHE 483.A O no hydrogen 3.175 N/A ARG 488.A NH1 THR 463.A O no hydrogen 3.007 N/A LEU 489.A N LEU 486.A O no hydrogen 3.465 N/A GLU 490.A N GLN 466.A O no hydrogen 3.060 N/A ALA 491.A N GLN 466.A O no hydrogen 2.840 N/A LEU 492.A N TYR 521.A O no hydrogen 2.871 N/A ASP 493.A N LEU 468.A O no hydrogen 2.941 N/A LEU 494.A N SER 523.A O no hydrogen 2.920 N/A SER 495.A N ASP 493.A OD1 no hydrogen 2.871 N/A SER 495.A OG ASP 493.A OD1 no hydrogen 2.521 N/A TYR 496.A N ALA 525.A O no hydrogen 3.004 N/A ASN 497.A ND2 LEU 470.A O no hydrogen 3.271 N/A ASN 497.A ND2 LEU 494.A O no hydrogen 3.313 N/A ASN 497.A ND2 SER 495.A O no hydrogen 2.872 N/A SER 502.A OG GLN 499.A OE1 no hydrogen 3.077 N/A ASN 509.A N TYR 478.A O no hydrogen 2.590 N/A LEU 510.A N SER 534.A OG no hydrogen 3.033 N/A SER 511.A N ASN 509.A OD1 no hydrogen 3.187 N/A VAL 513.A N LEU 510.A O no hydrogen 3.147 N/A ALA 514.A N SER 511.A O no hydrogen 2.655 N/A GLN 515.A N PHE 512.A O no hydrogen 2.890 N/A THR 518.A OG1 PRO 487.A O no hydrogen 2.958 N/A THR 518.A OG1 LEU 489.A O no hydrogen 2.809 N/A LEU 519.A N LEU 516.A O no hydrogen 2.981 N/A ARG 520.A N GLU 490.A O no hydrogen 2.899 N/A ARG 520.A NH1 SER 541.A O no hydrogen 3.028 N/A TYR 521.A N GLU 490.A O no hydrogen 3.260 N/A LEU 522.A N ALA 544.A O no hydrogen 3.239 N/A SER 523.A N LEU 492.A O no hydrogen 3.117 N/A LEU 524.A N ASP 546.A O no hydrogen 2.938 N/A HIS 526.A N SER 548.A O no hydrogen 2.650 N/A ASN 527.A N ASN 550.A OD1 no hydrogen 2.713 N/A ASN 527.A ND2 LEU 494.A O no hydrogen 3.028 N/A ILE 529.A N ASN 550.A OD1 no hydrogen 3.295 N/A ARG 532.A N SER 531.A OG no hydrogen 2.439 N/A VAL 533.A N TYR 562.A OH no hydrogen 3.306 N/A LEU 537.A N PHE 565.A O no hydrogen 3.229 N/A CYS 538.A SG GLN 536.A O no hydrogen 3.675 N/A CYS 538.A SG GLN 536.A OE1 no hydrogen 3.165 N/A SER 539.A N GLY 568.A O no hydrogen 3.170 N/A SER 539.A OG SER 541.A OG no hydrogen 2.731 N/A SER 541.A N SER 539.A OG no hydrogen 3.090 N/A SER 541.A OG LEU 516.A O no hydrogen 3.558 N/A SER 541.A OG LEU 519.A O no hydrogen 3.075 N/A SER 541.A OG SER 539.A OG no hydrogen 2.731 N/A LEU 542.A N SER 539.A OG no hydrogen 2.765 N/A TRP 543.A N ARG 520.A O no hydrogen 2.934 N/A ALA 544.A N ARG 520.A O no hydrogen 3.173 N/A LEU 545.A N ARG 574.A O no hydrogen 3.005 N/A ASP 546.A N LEU 522.A O no hydrogen 3.036 N/A PHE 547.A N ASP 576.A O no hydrogen 2.742 N/A SER 548.A N ASP 546.A OD1 no hydrogen 3.048 N/A SER 548.A OG ASP 546.A OD1 no hydrogen 3.093 N/A GLY 549.A N SER 578.A O no hydrogen 3.011 N/A ASN 550.A ND2 LEU 524.A O no hydrogen 3.034 N/A ASN 550.A ND2 PHE 547.A O no hydrogen 2.971 N/A SER 551.A OG ASN 550.A O no hydrogen 2.974 N/A LEU 552.A N ASN 580.A OD1 no hydrogen 2.783 N/A MET 555.A N SER 551.A O no hydrogen 3.332 N/A TRP 556.A N LEU 552.A O no hydrogen 2.973 N/A TRP 556.A NE1 TYR 562.A O no hydrogen 2.654 N/A ALA 557.A N SER 553.A O no hydrogen 2.765 N/A GLU 558.A N GLN 554.A O no hydrogen 3.211 N/A GLU 558.A N MET 555.A O no hydrogen 3.303 N/A GLY 559.A N ALA 557.A O no hydrogen 3.103 N/A ARG 564.A NH1 GLN 567.A OE1 no hydrogen 3.246 N/A PHE 565.A N TYR 562.A O no hydrogen 3.305 N/A GLN 567.A N ARG 564.A O no hydrogen 2.851 N/A LEU 569.A N PHE 566.A O no hydrogen 3.346 N/A SER 571.A OG THR 540.A O no hydrogen 2.421 N/A LEU 572.A N LEU 569.A O no hydrogen 2.927 N/A ILE 573.A N TRP 543.A O no hydrogen 2.761 N/A ARG 574.A N TRP 543.A O no hydrogen 3.144 N/A ARG 574.A NE ASP 407.A O no hydrogen 2.779 N/A LEU 575.A N LEU 599.A O no hydrogen 3.101 N/A ASP 576.A N LEU 545.A O no hydrogen 2.940 N/A LEU 577.A N ARG 601.A O no hydrogen 2.823 N/A SER 578.A N ASP 576.A OD1 no hydrogen 3.162 N/A SER 578.A OG ASP 576.A OD1 no hydrogen 2.383 N/A GLN 579.A N ARG 603.A O no hydrogen 2.999 N/A ASN 580.A N ASN 605.A OD1 no hydrogen 2.736 N/A ASN 580.A ND2 PHE 547.A O no hydrogen 2.976 N/A ASN 580.A ND2 SER 578.A O no hydrogen 3.432 N/A ARG 581.A NE SER 551.A OG no hydrogen 3.116 N/A LEU 582.A N ASN 605.A OD1 no hydrogen 3.046 N/A LEU 585.A N THR 584.A OG1 no hydrogen 2.645 N/A THR 589.A N LEU 586.A O no hydrogen 3.087 N/A LYS 595.A NZ LEU 617.A O no hydrogen 3.311 N/A SER 596.A OG ARG 570.A O no hydrogen 3.351 N/A SER 596.A OG LEU 572.A O no hydrogen 2.872 N/A LEU 597.A N PRO 594.A O no hydrogen 3.104 N/A GLN 598.A N ILE 573.A O no hydrogen 2.877 N/A LEU 599.A N ILE 573.A O no hydrogen 2.902 N/A LEU 600.A N THR 623.A O no hydrogen 3.080 N/A ARG 601.A N LEU 575.A O no hydrogen 2.970 N/A LEU 602.A N ASP 625.A O no hydrogen 2.800 N/A ARG 603.A N SER 578.A OG no hydrogen 3.120 N/A ARG 603.A NH2 ASP 625.A OD1 no hydrogen 3.295 N/A ARG 603.A NH2 ASP 625.A OD2 no hydrogen 2.771 N/A ARG 603.A NH2 ASP 649.A OD2 no hydrogen 3.543 N/A ASN 604.A N ALA 627.A O no hydrogen 2.796 N/A ASN 605.A ND2 LEU 577.A O no hydrogen 2.868 N/A ASN 605.A ND2 LEU 602.A O no hydrogen 3.447 N/A TYR 606.A N LEU 582.A O no hydrogen 2.914 N/A LEU 607.A N ASN 629.A OD1 no hydrogen 3.119 N/A SER 613.A OG ASN 611.A OD1 no hydrogen 2.512 N/A SER 614.A N ASN 611.A O no hydrogen 3.336 N/A SER 614.A OG ASN 611.A O no hydrogen 2.630 N/A LEU 615.A N TRP 612.A O no hydrogen 3.137 N/A THR 616.A OG1 SER 613.A O no hydrogen 2.967 N/A LEU 618.A N LEU 615.A O no hydrogen 3.432 N/A ASN 620.A ND2 LYS 595.A O no hydrogen 3.004 N/A LEU 621.A N LEU 618.A O no hydrogen 2.813 N/A GLU 622.A N GLN 598.A O no hydrogen 2.850 N/A THR 623.A N GLN 598.A O no hydrogen 2.999 N/A LEU 624.A N ARG 647.A O no hydrogen 2.977 N/A ASP 625.A N LEU 600.A O no hydrogen 3.101 N/A LEU 626.A N ASP 649.A O no hydrogen 2.706 N/A ALA 627.A N ASP 625.A OD1 no hydrogen 3.165 N/A GLY 628.A N SER 651.A O no hydrogen 2.995 N/A ASN 629.A ND2 LEU 602.A O no hydrogen 3.032 N/A ASN 629.A ND2 LEU 626.A O no hydrogen 3.093 N/A GLN 630.A N LEU 607.A O no hydrogen 2.930 N/A LEU 631.A N ASN 653.A OD1 no hydrogen 3.002 N/A LYS 632.A NZ GLN 630.A O no hydrogen 2.995 N/A LEU 634.A N PHE 657.A O no hydrogen 3.266 N/A LEU 639.A N PHE 662.A O no hydrogen 3.105 N/A THR 643.A N PRO 640.A O no hydrogen 3.380 N/A LEU 645.A N THR 643.A OG1 no hydrogen 3.399 N/A GLN 646.A N GLU 622.A O no hydrogen 2.719 N/A ARG 647.A N GLU 622.A O no hydrogen 2.872 N/A ARG 647.A NE THR 623.A OG1 no hydrogen 2.652 N/A ARG 647.A NH2 THR 623.A OG1 no hydrogen 3.048 N/A LEU 648.A N GLU 671.A O no hydrogen 2.870 N/A ASP 649.A N LEU 624.A O no hydrogen 3.045 N/A VAL 650.A N ASN 673.A O no hydrogen 3.030 N/A SER 651.A N ASP 649.A OD1 no hydrogen 2.824 N/A SER 651.A OG ASP 649.A OD1 no hydrogen 2.874 N/A ARG 652.A N SER 675.A O no hydrogen 2.959 N/A ARG 652.A NH2 ASN 604.A OD1 no hydrogen 2.857 N/A ASN 653.A ND2 LEU 626.A O no hydrogen 3.091 N/A ASN 653.A ND2 VAL 650.A O no hydrogen 2.887 N/A SER 654.A N LEU 631.A O no hydrogen 2.954 N/A ILE 655.A N ASN 677.A OD1 no hydrogen 2.833 N/A ILE 656.A N LYS 632.A O no hydrogen 3.333 N/A VAL 659.A N LEU 634.A O no hydrogen 3.198 N/A GLY 661.A N SER 685.A O no hydrogen 2.640 N/A PHE 662.A N VAL 659.A O no hydrogen 3.363 N/A PHE 663.A N TRP 686.A O no hydrogen 3.116 N/A ALA 664.A N GLY 661.A O no hydrogen 2.670 N/A ALA 666.A N PHE 663.A O no hydrogen 3.138 N/A LEU 669.A N ALA 666.A O no hydrogen 2.897 N/A ARG 670.A N GLN 646.A O no hydrogen 2.787 N/A GLU 671.A N GLN 646.A O no hydrogen 2.698 N/A LEU 672.A N VAL 696.A O no hydrogen 2.894 N/A ASN 673.A N LEU 648.A O no hydrogen 2.996 N/A LEU 674.A N ASP 698.A O no hydrogen 2.870 N/A SER 675.A N ASN 673.A OD1 no hydrogen 2.941 N/A SER 675.A OG SER 700.A O no hydrogen 2.853 N/A SER 675.A OG SER 700.A OG no hydrogen 2.888 N/A ALA 676.A N SER 700.A O no hydrogen 3.058 N/A ASN 677.A N ALA 701.A O no hydrogen 3.089 N/A ASN 677.A ND2 VAL 650.A O no hydrogen 3.368 N/A ASN 677.A ND2 LEU 674.A O no hydrogen 3.298 N/A ALA 678.A N ILE 655.A O no hydrogen 3.105 N/A LEU 679.A N ASN 702.A OD1 no hydrogen 3.305 N/A ARG 680.A NH2 SER 734.A OG no hydrogen 3.201 N/A PHE 687.A N PRO 684.A O no hydrogen 2.852 N/A SER 693.A N ALA 691.A O no hydrogen 2.751 N/A GLU 695.A N ARG 670.A O no hydrogen 2.908 N/A VAL 696.A N ARG 670.A O no hydrogen 3.207 N/A LEU 697.A N ALA 722.A O no hydrogen 2.606 N/A ASP 698.A N LEU 672.A O no hydrogen 3.057 N/A SER 700.A N ASP 698.A OD1 no hydrogen 3.030 N/A SER 700.A OG SER 675.A OG no hydrogen 2.888 N/A SER 700.A OG ASP 698.A OD1 no hydrogen 2.705 N/A ASN 702.A ND2 LEU 674.A O no hydrogen 2.813 N/A ASN 702.A ND2 VAL 699.A O no hydrogen 3.607 N/A LEU 704.A N ASN 702.A O no hydrogen 2.597 N/A HIS 705.A N ARG 680.A O no hydrogen 2.721 N/A HIS 705.A ND1 SER 734.A OG no hydrogen 2.716 N/A CYS 706.A N SER 734.A O no hydrogen 2.844 N/A ALA 707.A N HIS 705.A O no hydrogen 2.750 N/A LEU 716.A N PHE 712.A O no hydrogen 3.090 N/A LEU 717.A N VAL 713.A O no hydrogen 3.010 N/A GLN 718.A N ASP 714.A O no hydrogen 3.082 N/A GLN 720.A N LEU 717.A O no hydrogen 3.235 N/A GLN 720.A NE2 THR 1.A O no hydrogen 2.800 N/A GLN 720.A NE2 LEU 717.A O no hydrogen 2.633 N/A ALA 722.A N VAL 719.A O no hydrogen 2.794 N/A VAL 723.A N GLN 720.A O no hydrogen 2.784 N/A LEU 726.A N VAL 723.A O no hydrogen 3.284 N/A SER 728.A N GLY 725.A O no hydrogen 3.174 N/A ARG 729.A N GLY 725.A O no hydrogen 2.949 N/A CYS 732.A N ARG 741.A O no hydrogen 3.074 N/A CYS 732.A SG ARG 741.A O no hydrogen 3.707 N/A GLY 733.A N LEU 704.A O no hydrogen 2.727 N/A SER 734.A N LEU 704.A O no hydrogen 3.315 N/A SER 734.A OG HIS 705.A ND1 no hydrogen 2.716 N/A LEU 738.A N PRO 735.A O no hydrogen 2.905 N/A GLN 739.A N PRO 735.A O no hydrogen 3.182 N/A GLN 739.A N GLY 736.A O no hydrogen 2.897 N/A GLY 740.A N CYS 732.A O no hydrogen 2.929 N/A ARG 741.A N LEU 738.A O no hydrogen 2.827 N/A SER 742.A OG PRO 727.A O no hydrogen 3.470 N/A ILE 743.A N VAL 730.A O no hydrogen 3.306 N/A PHE 744.A N SER 742.A OG no hydrogen 3.395 N/A ALA 745.A N SER 742.A O no hydrogen 3.008 N/A LEU 748.A N ALA 745.A O no hydrogen 2.323 N/A ARG 749.A N ALA 745.A O no hydrogen 2.911 N/A ARG 749.A NE PHE 744.A O no hydrogen 3.069 N/A CYS 751.A N LEU 748.A O no hydrogen 2.815 N/A CYS 751.A SG LEU 750.A O no hydrogen 3.377 N/A