Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1lrw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N TYR 21.A OH no hydrogen 3.343 N/A ASN 1.A ND2 GLN 3.A OE1 no hydrogen 3.681 N/A GLN 3.A NE2 GLY 116.A O no hydrogen 3.547 N/A VAL 5.A N ASN 1.A O no hydrogen 3.375 N/A GLU 6.A N ASP 2.A O no hydrogen 2.935 N/A LEU 7.A N GLN 3.A O no hydrogen 2.794 N/A ALA 8.A N LEU 4.A O no hydrogen 3.061 N/A ALA 8.A N VAL 5.A O no hydrogen 3.195 N/A LYS 9.A N GLU 6.A O no hydrogen 3.311 N/A LYS 9.A NZ GLU 6.A OE1 no hydrogen 2.756 N/A ASP 10.A N LEU 7.A O no hydrogen 3.366 N/A ALA 12.A N ASP 10.A OD2 no hydrogen 2.967 N/A ASN 13.A N ASP 10.A O no hydrogen 3.135 N/A TRP 14.A N VAL 60.A O no hydrogen 2.832 N/A TRP 14.A NE1 THR 17.A O no hydrogen 3.218 N/A ARG 19.A N MET 16.A O no hydrogen 2.974 N/A ARG 19.A NH1 ALA 8.A O no hydrogen 2.867 N/A ARG 19.A NH2 ALA 8.A O no hydrogen 2.808 N/A ASP 20.A N GLY 18.A O no hydrogen 2.745 N/A TYR 21.A OH VAL 164.A O no hydrogen 2.536 N/A ASN 22.A N ASP 20.A OD2 no hydrogen 2.978 N/A ALA 23.A N ASP 20.A O no hydrogen 2.951 N/A ASN 25.A N GLY 18.A O no hydrogen 3.490 N/A SER 27.A N ALA 481.A O no hydrogen 3.095 N/A ILE 32.A N GLN 529.A OE1 no hydrogen 2.782 N/A ASN 33.A ND2 THR 30.A O no hydrogen 3.117 N/A LYS 34.A N GLY 484.A O no hydrogen 3.233 N/A LYS 34.A NZ ASP 500.A OD1 no hydrogen 3.093 N/A LYS 34.A NZ ASP 500.A OD2 no hydrogen 3.096 N/A LYS 34.A NZ ASP 502.A OD2 no hydrogen 2.669 N/A ASN 36.A N ASN 33.A OD1 no hydrogen 3.326 N/A ASN 36.A ND2 ASN 33.A O no hydrogen 2.948 N/A GLN 39.A N ASN 36.A O no hydrogen 3.026 N/A LEU 40.A N VAL 37.A O no hydrogen 3.144 N/A ARG 41.A N SER 579.A O no hydrogen 2.754 N/A ARG 41.A NH2 LYS 38.A O no hydrogen 2.609 N/A ALA 43.A N VAL 577.A O no hydrogen 2.718 N/A PHE 46.A N VAL 575.A O no hydrogen 3.045 N/A SER 47.A OG GLY 573.A O no hydrogen 3.357 N/A THR 48.A N GLY 573.A O no hydrogen 3.360 N/A THR 48.A OG1 VAL 50.A O no hydrogen 3.411 N/A THR 48.A OG1 HIS 54.A NE2 no hydrogen 2.659 N/A HIS 52.A ND1 ASP 105.A OD1 no hydrogen 2.717 N/A GLY 53.A N ASP 105.A OD2 no hydrogen 2.995 N/A HIS 54.A N GLY 536.A O no hydrogen 2.985 N/A HIS 54.A ND1 HIS 52.A O no hydrogen 2.721 N/A HIS 54.A NE2 THR 48.A OG1 no hydrogen 2.659 N/A THR 57.A OG1 HIS 519.A O no hydrogen 2.969 N/A LEU 59.A N PHE 66.A O no hydrogen 3.105 N/A VAL 60.A N TRP 14.A O no hydrogen 3.138 N/A VAL 61.A N ARG 64.A O no hydrogen 2.863 N/A ARG 64.A N VAL 61.A O no hydrogen 3.383 N/A MET 65.A N LEU 78.A O no hydrogen 3.190 N/A PHE 66.A N LEU 59.A O no hydrogen 2.622 N/A ILE 67.A N PHE 76.A O no hydrogen 2.930 N/A HIS 68.A NE2 GLU 55.A O no hydrogen 2.699 N/A THR 69.A OG1 PRO 70.A O no hydrogen 3.420 N/A THR 69.A OG1 THR 74.A O no hydrogen 2.510 N/A PHE 71.A N VAL 106.A O no hydrogen 3.196 N/A ASN 73.A N PRO 70.A O no hydrogen 2.732 N/A ASN 73.A ND2 GLN 94.A OE1 no hydrogen 3.080 N/A THR 74.A OG1 ASN 90.A O no hydrogen 3.518 N/A THR 75.A N ASN 90.A O no hydrogen 3.079 N/A PHE 76.A N ILE 67.A O no hydrogen 2.837 N/A ALA 77.A N TRP 88.A O no hydrogen 2.915 N/A LEU 78.A N MET 65.A O no hydrogen 2.965 N/A LEU 80.A N ASP 63.A O no hydrogen 2.742 N/A ASN 81.A N ASP 79.A OD1 no hydrogen 2.757 N/A GLU 82.A N ASP 79.A O no hydrogen 3.003 N/A GLY 84.A N TYR 586.A OH no hydrogen 3.155 N/A LYS 85.A N GLU 82.A O no hydrogen 3.089 N/A LYS 85.A NZ GLU 82.A OE2 no hydrogen 3.002 N/A LYS 85.A NZ THR 600.A OXT no hydrogen 3.194 N/A LEU 87.A N ALA 77.A O no hydrogen 2.724 N/A TRP 88.A N ALA 77.A O no hydrogen 3.441 N/A TRP 88.A NE1 ALA 138.A O no hydrogen 3.066 N/A ASN 90.A N THR 75.A O no hydrogen 2.986 N/A ASN 95.A ND2 THR 97.A OG1 no hydrogen 3.092 N/A ALA 98.A N ASN 95.A O no hydrogen 2.758 N/A ARG 99.A N PRO 96.A O no hydrogen 3.180 N/A THR 100.A N THR 97.A O no hydrogen 2.859 N/A VAL 101.A N ALA 98.A O no hydrogen 3.294 N/A CYS 103.A SG GLU 177.A OE1 no hydrogen 3.920 N/A VAL 106.A N ASP 105.A OD1 no hydrogen 2.780 N/A ASN 108.A ND2 GLY 110.A O no hydrogen 3.575 N/A ARG 109.A N THR 159.A O no hydrogen 2.819 N/A ARG 109.A NH2 THR 159.A OG1 no hydrogen 2.755 N/A ALA 112.A N PHE 125.A O no hydrogen 3.247 N/A TRP 114.A N LEU 123.A O no hydrogen 2.983 N/A ASP 117.A N VAL 120.A O no hydrogen 2.940 N/A VAL 120.A N ASP 117.A OD1 no hydrogen 3.108 N/A LYS 121.A NZ GLU 139.A OE2 no hydrogen 3.001 N/A LEU 123.A N TRP 114.A O no hydrogen 3.024 N/A ILE 124.A N MET 136.A O no hydrogen 2.811 N/A PHE 125.A N ALA 112.A O no hydrogen 2.883 N/A ARG 126.A N VAL 134.A O no hydrogen 3.129 N/A ARG 126.A NE THR 75.A OG1 no hydrogen 3.101 N/A ARG 126.A NH1 THR 75.A OG1 no hydrogen 3.383 N/A THR 127.A OG1 ASN 108.A OD1 no hydrogen 3.182 N/A THR 127.A OG1 ILE 160.A O no hydrogen 2.734 N/A GLN 128.A N HIS 132.A O no hydrogen 2.789 N/A GLY 131.A N GLN 128.A O no hydrogen 3.079 N/A HIS 132.A N ASP 130.A OD2 no hydrogen 3.201 N/A HIS 132.A ND1 ASP 130.A OD2 no hydrogen 2.967 N/A ILE 133.A N MET 147.A O no hydrogen 3.095 N/A VAL 134.A N ARG 126.A O no hydrogen 2.930 N/A ALA 135.A N TRP 145.A O no hydrogen 2.989 N/A MET 136.A N ILE 124.A O no hydrogen 2.960 N/A ASP 137.A N GLU 142.A O no hydrogen 2.996 N/A ALA 138.A N PRO 122.A O no hydrogen 3.041 N/A THR 140.A N ASP 137.A OD2 no hydrogen 2.861 N/A THR 140.A OG1 ASP 137.A OD2 no hydrogen 2.941 N/A THR 140.A OG1 GLU 142.A OE2 no hydrogen 2.998 N/A GLY 141.A N ASP 137.A O no hydrogen 2.750 N/A GLU 142.A N THR 140.A OG1 no hydrogen 3.404 N/A THR 143.A OG1 ASN 90.A OD1 no hydrogen 3.022 N/A ARG 144.A N ALA 135.A O no hydrogen 2.719 N/A TRP 145.A NE1 VAL 189.A O no hydrogen 3.010 N/A MET 147.A N ILE 133.A O no hydrogen 3.110 N/A ASN 149.A N GLY 131.A O no hydrogen 2.964 N/A ASN 149.A ND2 SER 150.A OG no hydrogen 3.157 N/A ASN 149.A ND2 GLY 172.A O no hydrogen 3.538 N/A SER 150.A N GLY 131.A O no hydrogen 3.241 N/A LYS 153.A N ASP 151.A OD2 no hydrogen 2.644 N/A VAL 154.A N ASP 151.A O no hydrogen 3.240 N/A GLY 155.A N ILE 152.A O no hydrogen 3.010 N/A SER 156.A N ASP 151.A O no hydrogen 3.233 N/A LEU 158.A N LEU 129.A O no hydrogen 3.278 N/A THR 159.A OG1 SER 174.A OG no hydrogen 3.228 N/A TYR 163.A N LEU 170.A O no hydrogen 3.206 N/A ILE 165.A N LEU 168.A O no hydrogen 2.934 N/A LYS 166.A NZ ASP 253.A OD1 no hydrogen 3.152 N/A LEU 168.A N ILE 165.A O no hydrogen 2.804 N/A VAL 169.A N TYR 187.A O no hydrogen 2.860 N/A LEU 170.A N TYR 163.A O no hydrogen 2.684 N/A VAL 171.A N THR 185.A O no hydrogen 2.822 N/A SER 173.A N ASN 242.A O no hydrogen 2.853 N/A SER 173.A OG TYR 183.A O no hydrogen 2.991 N/A SER 173.A OG ASN 242.A OD1 no hydrogen 3.469 N/A SER 174.A N THR 157.A O no hydrogen 3.190 N/A SER 174.A OG THR 159.A OG1 no hydrogen 3.228 N/A LEU 178.A N GLY 175.A O no hydrogen 2.629 N/A GLY 179.A N ALA 176.A O no hydrogen 2.948 N/A VAL 180.A N GLY 175.A O no hydrogen 3.092 N/A ARG 181.A NE THR 201.A O no hydrogen 3.013 N/A ARG 181.A NH1 THR 201.A O no hydrogen 2.482 N/A ARG 181.A NH1 GLU 206.A OE1 no hydrogen 2.608 N/A ARG 181.A NH2 GLU 206.A OE1 no hydrogen 3.012 N/A GLY 182.A N GLY 239.A O no hydrogen 2.630 N/A TYR 183.A N SER 173.A OG no hydrogen 3.090 N/A TYR 183.A OH ASN 149.A O no hydrogen 2.512 N/A VAL 184.A N ALA 198.A O no hydrogen 3.063 N/A THR 185.A N VAL 171.A O no hydrogen 2.899 N/A THR 185.A OG1 ASN 149.A OD1 no hydrogen 3.258 N/A ALA 186.A N TRP 196.A O no hydrogen 2.948 N/A TYR 187.A N VAL 169.A O no hydrogen 2.981 N/A TYR 187.A OH ASN 149.A OD1 no hydrogen 2.620 N/A ASP 188.A N GLU 193.A O no hydrogen 2.960 N/A VAL 189.A N ASP 167.A O no hydrogen 3.236 N/A LYS 190.A N ASP 188.A OD2 no hydrogen 2.922 N/A LYS 190.A NZ ASP 117.A OD2 no hydrogen 2.757 N/A SER 191.A N ASP 188.A OD2 no hydrogen 3.095 N/A GLY 192.A N ASP 188.A O no hydrogen 2.760 N/A GLU 193.A N SER 191.A OG no hydrogen 3.153 N/A ARG 195.A N ALA 186.A O no hydrogen 2.806 N/A ARG 197.A NE THR 185.A OG1 no hydrogen 2.980 N/A ALA 198.A N VAL 184.A O no hydrogen 2.973 N/A PHE 199.A N GLU 206.A O no hydrogen 2.715 N/A ALA 200.A N GLY 182.A O no hydrogen 3.138 N/A THR 201.A OG1 TRP 235.A O no hydrogen 2.887 N/A GLY 202.A N GLY 226.A O no hydrogen 2.838 N/A GLU 206.A N PRO 203.A O no hydrogen 3.061 N/A LEU 207.A N PRO 203.A O no hydrogen 3.041 N/A ALA 210.A N ALA 290.A O no hydrogen 3.157 N/A PHE 213.A N ALA 210.A O no hydrogen 2.974 N/A ASN 214.A N LYS 291.A O no hydrogen 3.112 N/A ASN 214.A ND2 GLY 221.A O no hydrogen 2.732 N/A ASN 214.A ND2 ALA 293.A O no hydrogen 3.061 N/A ALA 215.A N ASP 212.A O no hydrogen 3.077 N/A ASN 217.A ND2 ASN 342.A O no hydrogen 3.639 N/A ASN 217.A ND2 ASP 344.A OD1 no hydrogen 2.917 N/A HIS 219.A ND1 THR 365.A O no hydrogen 3.192 N/A TYR 220.A N ASN 217.A O no hydrogen 2.811 N/A TYR 220.A OH GLY 343.A O no hydrogen 2.512 N/A GLY 221.A N PRO 218.A O no hydrogen 3.005 N/A ASN 224.A N ASP 204.A OD2 no hydrogen 2.648 N/A ASN 224.A ND2 GLU 228.A OE1 no hydrogen 2.633 N/A LEU 227.A N ASN 224.A O no hydrogen 3.435 N/A GLU 228.A N ASN 224.A O no hydrogen 3.094 N/A THR 229.A OG1 LEU 225.A O no hydrogen 2.606 N/A TRP 230.A N LEU 227.A O no hydrogen 3.029 N/A TRP 230.A NE1 LYS 275.A O no hydrogen 2.622 N/A LYS 236.A N ASP 233.A O no hydrogen 2.822 N/A ILE 237.A N ALA 234.A O no hydrogen 3.213 N/A GLY 238.A N TRP 235.A O no hydrogen 3.334 N/A GLY 240.A N ASN 261.A O no hydrogen 2.992 N/A TRP 245.A NE1 GLN 395.A O no hydrogen 2.710 N/A ALA 247.A N TYR 256.A O no hydrogen 3.254 N/A TYR 248.A N TYR 21.A O no hydrogen 3.066 N/A TYR 248.A OH ASP 253.A OD1 no hydrogen 2.612 N/A ASP 249.A N LEU 254.A O no hydrogen 2.871 N/A GLU 251.A N ASP 249.A OD2 no hydrogen 2.953 N/A VAL 252.A N ASP 249.A O no hydrogen 3.179 N/A LEU 254.A N ASP 249.A O no hydrogen 3.377 N/A PHE 255.A N ARG 283.A O no hydrogen 3.082 N/A TYR 256.A N ALA 247.A O no hydrogen 2.754 N/A TYR 256.A OH ARG 340.A O no hydrogen 2.598 N/A SER 259.A N ALA 279.A O no hydrogen 2.991 N/A SER 259.A OG TRP 276.A O no hydrogen 2.698 N/A SER 259.A OG ALA 279.A O no hydrogen 3.437 N/A GLY 260.A N THR 241.A O no hydrogen 2.668 N/A ASN 261.A ND2 GLU 177.A OE2 no hydrogen 3.380 N/A ASN 261.A ND2 PRO 262.A O no hydrogen 3.365 N/A TRP 265.A N VAL 432.A O no hydrogen 2.783 N/A TRP 265.A NE1 GLU 177.A OE2 no hydrogen 2.715 N/A ASN 266.A ND2 PHE 421.A O no hydrogen 2.982 N/A THR 268.A N ASN 266.A OD1 no hydrogen 2.887 N/A THR 268.A OG1 GLU 267.A OE2 no hydrogen 2.530 N/A MET 269.A N ASN 266.A O no hydrogen 3.229 N/A ARG 270.A N GLU 267.A O no hydrogen 3.362 N/A ARG 270.A NE PRO 264.A O no hydrogen 2.800 N/A ARG 270.A NH1 PRO 264.A O no hydrogen 3.228 N/A ARG 270.A NH1 ASP 300.A O no hydrogen 2.991 N/A ARG 270.A NH2 ASP 300.A O no hydrogen 3.014 N/A ASN 274.A N THR 229.A O no hydrogen 3.250 N/A ASN 274.A ND2 HIS 299.A ND1 no hydrogen 3.351 N/A LYS 275.A N THR 229.A OG1 no hydrogen 2.975 N/A LYS 275.A NZ GLN 295.A OE1 no hydrogen 2.651 N/A TRP 276.A N ALA 200.A O no hydrogen 2.667 N/A THR 277.A N ASN 274.A O no hydrogen 3.183 N/A THR 277.A OG1 ASN 274.A O no hydrogen 2.733 N/A MET 278.A N GLY 260.A O no hydrogen 2.885 N/A ALA 279.A N SER 259.A OG no hydrogen 2.893 N/A ILE 280.A N TYR 294.A O no hydrogen 2.880 N/A TRP 281.A N TYR 257.A O no hydrogen 2.878 N/A TRP 281.A NE1 SER 259.A OG no hydrogen 3.319 N/A GLY 282.A N PHE 292.A O no hydrogen 2.970 N/A ARG 283.A N PHE 255.A O no hydrogen 3.201 N/A ARG 283.A NE TYR 257.A OH no hydrogen 2.834 N/A ARG 283.A NH1 LEU 207.A O no hydrogen 2.899 N/A ARG 283.A NH2 LEU 207.A O no hydrogen 2.937 N/A ARG 283.A NH2 LEU 208.A O no hydrogen 2.918 N/A ARG 283.A NH2 GLY 288.A O no hydrogen 2.800 N/A GLU 284.A N GLU 289.A O no hydrogen 2.695 N/A ALA 285.A N ASP 253.A O no hydrogen 3.253 N/A THR 287.A OG1 GLU 284.A OE2 no hydrogen 3.496 N/A GLY 288.A N GLU 284.A O no hydrogen 2.681 N/A GLU 289.A N THR 287.A OG1 no hydrogen 2.949 N/A ALA 290.A N LEU 208.A O no hydrogen 2.848 N/A LYS 291.A N GLY 282.A O no hydrogen 2.634 N/A LYS 291.A NZ ASP 212.A OD1 no hydrogen 3.169 N/A LYS 291.A NZ ASP 212.A OD2 no hydrogen 2.740 N/A PHE 292.A N GLY 282.A O no hydrogen 3.378 N/A ALA 293.A N ASN 214.A OD1 no hydrogen 2.907 N/A TYR 294.A N ILE 280.A O no hydrogen 2.999 N/A TYR 294.A OH GLY 366.A O no hydrogen 2.710 N/A GLN 295.A NE2 ASP 273.A O no hydrogen 2.654 N/A GLN 295.A NE2 THR 277.A O no hydrogen 3.217 N/A LYS 296.A N MET 278.A O no hydrogen 2.775 N/A LYS 296.A NZ GLY 306.A O no hydrogen 3.193 N/A LYS 296.A NZ HIS 328.A NE2 no hydrogen 2.727 N/A LYS 296.A NZ ASP 330.A OD2 no hydrogen 2.635 N/A HIS 299.A N ASP 273.A O no hydrogen 3.235 N/A HIS 299.A NE2 GLU 267.A OE1 no hydrogen 2.587 N/A TRP 302.A N ASP 300.A OD1 no hydrogen 3.218 N/A TRP 302.A NE1 PHE 374.A O no hydrogen 2.896 N/A ASP 303.A N ASP 300.A OD2 no hydrogen 2.810 N/A TYR 304.A N ASP 300.A OD1 no hydrogen 3.187 N/A TYR 304.A OH PRO 387.A O no hydrogen 2.701 N/A ASN 308.A ND2 PRO 329.A O no hydrogen 2.688 N/A ASN 308.A ND2 HIS 393.A O no hydrogen 3.122 N/A MET 311.A N THR 327.A O no hydrogen 3.003 N/A LEU 312.A N ASN 22.A O no hydrogen 2.848 N/A SER 313.A N LEU 325.A O no hydrogen 3.279 N/A GLN 315.A N ARG 323.A O no hydrogen 3.312 N/A GLN 315.A NE2 SER 313.A OG no hydrogen 3.094 N/A ASP 317.A N GLN 321.A O no hydrogen 2.337 N/A LYS 318.A N ASP 317.A OD2 no hydrogen 3.024 N/A GLY 320.A N ASP 317.A O no hydrogen 3.120 N/A ARG 323.A N GLN 315.A O no hydrogen 2.820 N/A LEU 325.A N SER 313.A O no hydrogen 2.705 N/A THR 327.A N MET 311.A O no hydrogen 2.808 N/A THR 327.A OG1 THR 337.A OG1 no hydrogen 3.325 N/A HIS 328.A N TYR 336.A O no hydrogen 2.598 N/A HIS 328.A ND1 VAL 309.A O no hydrogen 2.732 N/A ASP 330.A N ILE 334.A O no hydrogen 2.864 N/A ARG 331.A NH2 ALA 389.A O no hydrogen 2.326 N/A ASN 332.A N ASP 330.A OD1 no hydrogen 2.784 N/A ASN 332.A ND2 THR 297.A OG1 no hydrogen 3.065 N/A ASN 332.A ND2 TYR 336.A OH no hydrogen 3.102 N/A GLY 333.A N ASP 330.A O no hydrogen 3.254 N/A ILE 334.A N ASN 332.A OD1 no hydrogen 2.909 N/A VAL 335.A N ASP 349.A O no hydrogen 2.691 N/A TYR 336.A N HIS 328.A O no hydrogen 2.843 N/A THR 337.A N SER 347.A O no hydrogen 2.908 N/A THR 337.A OG1 THR 327.A OG1 no hydrogen 3.325 N/A LEU 338.A N LEU 326.A O no hydrogen 2.909 N/A ASP 339.A N ASP 344.A O no hydrogen 2.927 N/A ARG 340.A N LYS 324.A O no hydrogen 2.995 N/A ARG 340.A NE ASP 249.A OD1 no hydrogen 2.718 N/A ARG 340.A NH1 ASP 249.A OD1 no hydrogen 3.019 N/A ARG 340.A NH2 SER 313.A O no hydrogen 3.115 N/A ARG 340.A NH2 GLU 314.A OE1 no hydrogen 3.554 N/A ARG 340.A NH2 LEU 325.A O no hydrogen 2.847 N/A THR 341.A N ASP 339.A OD2 no hydrogen 3.051 N/A THR 341.A OG1 ASP 339.A OD2 no hydrogen 2.756 N/A ASN 342.A N ASP 339.A O no hydrogen 2.889 N/A ASN 342.A ND2 ASP 339.A OD1 no hydrogen 3.144 N/A GLY 343.A N ASP 339.A O no hydrogen 2.826 N/A ILE 346.A N THR 337.A O no hydrogen 2.992 N/A SER 347.A N THR 337.A O no hydrogen 3.163 N/A SER 347.A OG ALA 460.A O no hydrogen 2.764 N/A ASP 349.A N VAL 335.A O no hydrogen 3.410 N/A LYS 350.A NZ VAL 355.A O no hydrogen 2.957 N/A LYS 350.A NZ VAL 358.A O no hydrogen 2.951 N/A LYS 350.A NZ LYS 359.A O no hydrogen 3.447 N/A MET 351.A N GLY 333.A O no hydrogen 2.802 N/A THR 354.A N ASP 352.A OD1 no hydrogen 3.117 N/A THR 354.A OG1 ASP 352.A OD1 no hydrogen 2.526 N/A THR 354.A OG1 TYR 392.A OH no hydrogen 2.686 N/A VAL 355.A N ASP 352.A O no hydrogen 3.180 N/A ASN 356.A N CYS 386.A O no hydrogen 2.969 N/A ASN 356.A ND2 ASP 384.A O no hydrogen 3.005 N/A TRP 357.A NE1 ASN 332.A O no hydrogen 2.567 N/A LYS 359.A N VAL 369.A O no hydrogen 2.989 N/A GLN 362.A N LEU 367.A O no hydrogen 3.188 N/A THR 365.A OG1 GLN 362.A OE1 no hydrogen 2.659 N/A GLY 366.A N GLN 362.A O no hydrogen 2.519 N/A LEU 367.A N THR 365.A OG1 no hydrogen 3.085 N/A VAL 369.A N GLU 360.A O no hydrogen 2.875 N/A ARG 370.A NE GLU 301.A OE2 no hydrogen 3.409 N/A ARG 370.A NH1 PRO 298.A O no hydrogen 3.233 N/A ARG 370.A NH1 HIS 299.A O no hydrogen 2.797 N/A ARG 370.A NH1 GLU 301.A OE2 no hydrogen 2.758 N/A ARG 370.A NH2 PRO 298.A O no hydrogen 2.920 N/A ASP 371.A N TRP 357.A O no hydrogen 3.097 N/A GLU 373.A N ASP 371.A OD2 no hydrogen 3.039 N/A PHE 374.A N ASP 371.A O no hydrogen 2.732 N/A GLY 375.A N PRO 372.A O no hydrogen 3.377 N/A THR 376.A N GLU 301.A OE1 no hydrogen 2.756 N/A THR 376.A OG1 GLU 301.A O no hydrogen 2.956 N/A MET 378.A N THR 268.A OG1 no hydrogen 3.001 N/A ALA 382.A N TRP 418.A O no hydrogen 2.902 N/A ASP 384.A N ASP 417.A OD2 no hydrogen 3.495 N/A ASP 384.A N TYR 439.A OH no hydrogen 3.231 N/A ILE 385.A N MET 416.A O no hydrogen 3.141 N/A CYS 386.A N ASN 356.A OD1 no hydrogen 3.057 N/A CYS 386.A SG ASP 384.A O no hydrogen 3.995 N/A SER 388.A N ILE 414.A O no hydrogen 2.948 N/A MET 390.A N SER 388.A OG no hydrogen 3.101 N/A GLY 391.A N SER 388.A O no hydrogen 2.806 N/A TYR 392.A N ARG 331.A O no hydrogen 3.392 N/A TYR 392.A OH THR 354.A OG1 no hydrogen 2.686 N/A HIS 393.A ND1 ASN 394.A O no hydrogen 2.726 N/A HIS 393.A NE2 ASP 398.A OD2 no hydrogen 2.488 N/A ASN 394.A ND2 MET 390.A O no hydrogen 3.255 N/A GLN 395.A N ASN 394.A OD1 no hydrogen 2.617 N/A HIS 397.A ND1 ASP 398.A O no hydrogen 2.964 N/A SER 399.A OG THR 479.A OG1 no hydrogen 2.780 N/A TYR 400.A N GLN 24.A O no hydrogen 2.901 N/A ASP 401.A N VAL 406.A O no hydrogen 2.914 N/A GLU 403.A N ASP 401.A OD1 no hydrogen 2.920 N/A ARG 404.A N ASP 401.A OD1 no hydrogen 3.189 N/A VAL 406.A N ASP 401.A O no hydrogen 3.408 N/A PHE 407.A N TYR 458.A O no hydrogen 2.692 N/A MET 408.A N SER 399.A O no hydrogen 2.961 N/A LEU 409.A N LYS 456.A O no hydrogen 2.833 N/A GLY 410.A N ASP 398.A OD2 no hydrogen 3.327 N/A ILE 411.A N GLN 454.A O no hydrogen 2.497 N/A ASN 412.A N TYR 392.A O no hydrogen 2.622 N/A ASN 412.A ND2 VAL 475.A O no hydrogen 3.498 N/A HIS 413.A N LEU 452.A O no hydrogen 2.723 N/A CYS 415.A N TYR 439.A O no hydrogen 2.874 N/A CYS 415.A SG TYR 392.A OH no hydrogen 3.681 N/A MET 416.A N ILE 385.A O no hydrogen 3.094 N/A ASP 417.A N THR 437.A O no hydrogen 2.898 N/A TRP 418.A N ALA 382.A O no hydrogen 2.824 N/A GLU 419.A N THR 435.A O no hydrogen 3.210 N/A PHE 421.A N GLY 433.A O no hydrogen 3.019 N/A GLN 429.A N ARG 426.A O no hydrogen 2.801 N/A PHE 431.A N GLU 177.A O no hydrogen 2.677 N/A THR 435.A N GLU 419.A O no hydrogen 2.871 N/A THR 437.A N ASP 417.A O no hydrogen 3.259 N/A TYR 439.A N CYS 415.A O no hydrogen 3.105 N/A TYR 439.A OH ASP 384.A OD1 no hydrogen 3.300 N/A TYR 439.A OH ASP 417.A OD2 no hydrogen 2.738 N/A GLY 441.A N HIS 413.A O no hydrogen 2.999 N/A LYS 443.A N HIS 413.A NE2 no hydrogen 2.987 N/A LYS 443.A NZ ASP 352.A OD1 no hydrogen 3.318 N/A LYS 443.A NZ ASP 352.A OD2 no hydrogen 3.065 N/A LYS 443.A NZ ASP 353.A OD2 no hydrogen 2.870 N/A GLY 444.A N GLY 441.A O no hydrogen 2.646 N/A ASP 445.A N SER 450.A O no hydrogen 3.031 N/A ASN 448.A N ASP 445.A O no hydrogen 2.968 N/A ASN 448.A N ASP 445.A OD2 no hydrogen 2.827 N/A ASN 448.A ND2 ASP 445.A OD1 no hydrogen 2.600 N/A SER 450.A N ASP 445.A O no hydrogen 3.321 N/A SER 450.A OG ASN 448.A O no hydrogen 3.534 N/A LEU 452.A N ARG 472.A O no hydrogen 2.902 N/A GLY 453.A N GLU 471.A O no hydrogen 3.299 N/A GLN 454.A N ILE 411.A O no hydrogen 2.897 N/A GLN 454.A NE2 ASP 352.A OD2 no hydrogen 3.113 N/A ILE 455.A N LYS 469.A O no hydrogen 3.093 N/A LYS 456.A N LEU 409.A O no hydrogen 3.082 N/A LYS 456.A NZ MET 351.A O no hydrogen 2.884 N/A LYS 456.A NZ ASP 352.A OD2 no hydrogen 2.970 N/A LYS 456.A NZ GLU 468.A OE2 no hydrogen 3.569 N/A ALA 457.A N TRP 467.A O no hydrogen 3.152 N/A TYR 458.A N PHE 407.A O no hydrogen 2.727 N/A TYR 458.A OH ASP 349.A OD2 no hydrogen 2.489 N/A ASP 459.A N GLU 464.A O no hydrogen 3.049 N/A ILE 461.A N ASP 459.A OD2 no hydrogen 3.150 N/A GLY 463.A N ASP 459.A O no hydrogen 2.647 N/A LYS 466.A N ALA 457.A O no hydrogen 2.951 N/A TRP 467.A NE1 SER 501.A O no hydrogen 2.632 N/A LYS 469.A N ILE 455.A O no hydrogen 3.014 N/A GLU 471.A N GLY 453.A O no hydrogen 2.808 N/A ARG 472.A N GLU 471.A OE2 no hydrogen 3.310 N/A SER 474.A OG LEU 452.A O no hydrogen 2.809 N/A VAL 475.A N ILE 411.A O no hydrogen 3.447 N/A THR 479.A N HIS 397.A O no hydrogen 3.096 N/A THR 479.A OG1 SER 399.A OG no hydrogen 2.780 N/A THR 479.A OG1 MET 408.A O no hydrogen 2.702 N/A MET 480.A N PHE 488.A O no hydrogen 2.839 N/A ALA 481.A N ASN 25.A O no hydrogen 3.179 N/A THR 482.A N LEU 486.A O no hydrogen 3.008 N/A ALA 483.A N SER 27.A O no hydrogen 2.894 N/A GLY 484.A N THR 482.A OG1 no hydrogen 3.359 N/A GLY 485.A N THR 482.A O no hydrogen 2.942 N/A THR 487.A N ARG 499.A O no hydrogen 2.941 N/A PHE 488.A N MET 480.A O no hydrogen 2.686 N/A TYR 489.A N LYS 497.A O no hydrogen 3.272 N/A TYR 489.A OH GLU 471.A OE1 no hydrogen 2.543 N/A THR 491.A N PHE 495.A O no hydrogen 2.856 N/A THR 491.A OG1 ASP 493.A OD1 no hydrogen 2.696 N/A THR 491.A OG1 PHE 495.A O no hydrogen 3.541 N/A GLY 494.A N THR 491.A O no hydrogen 3.203 N/A PHE 495.A N THR 491.A OG1 no hydrogen 3.139 N/A ILE 496.A N PHE 510.A O no hydrogen 3.294 N/A LYS 497.A N TYR 489.A O no hydrogen 2.877 N/A ALA 498.A N TRP 508.A O no hydrogen 3.093 N/A ARG 499.A N THR 487.A O no hydrogen 3.170 N/A ARG 499.A NE TYR 489.A OH no hydrogen 2.965 N/A ARG 499.A NH1 GLY 504.A O no hydrogen 2.963 N/A ARG 499.A NH2 TYR 489.A OH no hydrogen 3.395 N/A ASP 500.A N ASP 505.A O no hydrogen 2.787 N/A SER 501.A N GLY 485.A O no hydrogen 3.024 N/A ASP 502.A N ASP 500.A OD1 no hydrogen 2.805 N/A THR 503.A N ASP 500.A OD1 no hydrogen 2.957 N/A THR 503.A OG1 ASP 505.A OD2 no hydrogen 2.511 N/A GLY 504.A N ASP 500.A O no hydrogen 2.518 N/A ASP 505.A N THR 503.A OG1 no hydrogen 3.345 N/A LEU 507.A N ALA 498.A O no hydrogen 2.927 N/A PHE 510.A N ILE 496.A O no hydrogen 3.232 N/A LYS 511.A NZ LEU 512.A O no hydrogen 2.889 N/A LEU 512.A N GLY 494.A O no hydrogen 2.780 N/A SER 514.A OG THR 569.A OG1 no hydrogen 3.141 N/A SER 514.A OG GLN 570.A O no hydrogen 2.482 N/A GLY 515.A N THR 569.A OG1 no hydrogen 3.094 N/A VAL 516.A N THR 491.A O no hydrogen 2.811 N/A HIS 519.A NE2 THR 17.A O no hydrogen 3.094 N/A MET 521.A N ALA 532.A O no hydrogen 2.989 N/A THR 522.A OG1 TYR 530.A O no hydrogen 2.857 N/A TYR 523.A N TYR 530.A O no hydrogen 3.131 N/A LYS 524.A N PRO 11.A O no hydrogen 3.109 N/A LYS 524.A NZ ASP 31.A OD1 no hydrogen 3.146 N/A HIS 525.A N ARG 528.A O no hydrogen 2.875 N/A HIS 525.A NE2 ASP 63.A OD1 no hydrogen 2.977 N/A ARG 528.A N HIS 525.A O no hydrogen 2.899 N/A ARG 528.A NH2 TYR 530.A OH no hydrogen 3.477 N/A GLN 529.A NE2 THR 522.A OG1 no hydrogen 3.379 N/A TYR 530.A N TYR 523.A O no hydrogen 2.941 N/A VAL 531.A N PHE 578.A O no hydrogen 2.953 N/A ALA 532.A N MET 521.A O no hydrogen 2.946 N/A ILE 533.A N MET 576.A O no hydrogen 3.024 N/A TYR 535.A N GLY 574.A O no hydrogen 2.982 N/A GLY 536.A N GLY 515.A O no hydrogen 2.886 N/A VAL 537.A N SER 514.A OG no hydrogen 3.228 N/A GLY 539.A N ASP 105.A OD2 no hydrogen 3.005 N/A TRP 540.A NE1 GLY 555.A O no hydrogen 2.760 N/A GLY 542.A N GLY 538.A O no hydrogen 3.186 N/A GLY 542.A N GLY 539.A O no hydrogen 3.216 N/A VAL 543.A N TRP 540.A O no hydrogen 3.354 N/A VAL 546.A N GLY 542.A O no hydrogen 2.546 N/A PHE 547.A N VAL 543.A O no hydrogen 2.679 N/A LEU 549.A N GLY 544.A O no hydrogen 3.029 N/A THR 553.A N ASP 551.A OD2 no hydrogen 3.202 N/A THR 553.A OG1 ASP 551.A OD2 no hydrogen 2.334 N/A ALA 554.A N ASP 551.A O no hydrogen 2.877 N/A GLY 557.A N ALA 554.A O no hydrogen 3.114 N/A SER 558.A N GLY 555.A O no hydrogen 3.101 N/A SER 558.A OG TRP 540.A O no hydrogen 3.343 N/A SER 558.A OG GLY 555.A O no hydrogen 2.766 N/A VAL 559.A N ALA 554.A O no hydrogen 3.345 N/A GLY 560.A N PRO 552.A O no hydrogen 3.147 N/A PHE 562.A N SER 558.A O no hydrogen 3.138 N/A LYS 563.A N GLY 560.A O no hydrogen 3.173 N/A ARG 564.A NE ASN 448.A O no hydrogen 3.130 N/A ARG 564.A NH2 GLU 567.A OE2 no hydrogen 3.100 N/A LEU 565.A N PHE 562.A O no hydrogen 3.289 N/A GLU 567.A N ARG 564.A O no hydrogen 3.052 N/A PHE 568.A N LEU 565.A O no hydrogen 2.933 N/A THR 569.A N LEU 565.A O no hydrogen 3.252 N/A THR 569.A OG1 GLN 570.A O no hydrogen 2.860 N/A GLN 570.A NE2 GLN 566.A O no hydrogen 3.337 N/A GLY 574.A N TYR 535.A O no hydrogen 3.239 N/A VAL 575.A N PHE 46.A O no hydrogen 2.808 N/A MET 576.A N ILE 533.A O no hydrogen 2.877 N/A VAL 577.A N TRP 44.A O no hydrogen 3.008 N/A PHE 578.A N VAL 531.A O no hydrogen 2.690 N/A SER 579.A N ARG 41.A O no hydrogen 2.842 N/A SER 579.A OG GLU 583.A O no hydrogen 2.665 N/A ASP 581.A N GLN 39.A O no hydrogen 2.921 N/A GLY 582.A N SER 579.A O no hydrogen 3.254 N/A GLU 583.A N LEU 580.A O no hydrogen 3.469 N/A SER 584.A N SER 587.A OG no hydrogen 3.104 N/A SER 584.A OG ALA 43.A O no hydrogen 3.377 N/A TYR 586.A N SER 584.A OG no hydrogen 3.265 N/A SER 587.A N SER 584.A O no hydrogen 2.926 N/A SER 587.A OG GLU 583.A OE1 no hydrogen 3.108 N/A SER 587.A OG SER 584.A O no hydrogen 2.999 N/A VAL 591.A N ASP 588.A O no hydrogen 2.899 N/A GLU 593.A N ASN 590.A O no hydrogen 2.844 N/A