Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zxk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N TYR 298.A O no hydrogen 2.939 N/A ASN 6.A N THR 296.A O no hydrogen 2.851 N/A ASN 6.A ND2 VAL 273.A O no hydrogen 2.966 N/A ASN 6.A ND2 GLY 295.A O no hydrogen 3.013 N/A VAL 8.A N PRO 271.A O no hydrogen 3.091 N/A HIS 13.A N ARG 269.A O no hydrogen 2.903 N/A HIS 13.A ND1 SER 29.A OG no hydrogen 2.796 N/A GLU 17.A N SER 28.A O no hydrogen 2.956 N/A PHE 19.A N TYR 26.A O no hydrogen 3.064 N/A ARG 20.A NE ASP 250.A O no hydrogen 2.817 N/A ARG 20.A NH1 GLY 22.A O no hydrogen 2.804 N/A ARG 20.A NH2 ASP 250.A OD2 no hydrogen 2.615 N/A VAL 21.A N VAL 24.A O no hydrogen 2.817 N/A SER 23.A N ASN 117.A O no hydrogen 2.896 N/A VAL 24.A N VAL 21.A O no hydrogen 2.983 N/A PHE 25.A N SER 43.A O no hydrogen 2.813 N/A TYR 26.A N PHE 19.A O no hydrogen 2.900 N/A TYR 26.A OH GLY 118.A O no hydrogen 2.643 N/A TYR 27.A N LEU 41.A O no hydrogen 2.948 N/A TYR 27.A OH HIS 13.A O no hydrogen 2.854 N/A SER 28.A N GLU 17.A O no hydrogen 2.899 N/A SER 29.A N PRO 39.A O no hydrogen 3.205 N/A SER 29.A OG HIS 13.A ND1 no hydrogen 2.796 N/A SER 30.A N PRO 14.A O no hydrogen 3.024 N/A SER 30.A OG.A TRP 80.A O no hydrogen 2.788 N/A SER 30.A OG.B ILE 79.A O no hydrogen 2.685 N/A PHE 32.A N ILE 79.A O no hydrogen 2.856 N/A TYR 34.A N THR 31.A O no hydrogen 2.952 N/A TYR 34.A OH TYR 500.A OH no hydrogen 2.728 N/A SER 35.A N TRP 331.A O no hydrogen 2.867 N/A SER 35.A OG ASN 334.A OD1 no hydrogen 2.624 N/A GLY 37.A N VAL 56.A O no hydrogen 2.849 N/A ALA 38.A N THR 31.A OG1 no hydrogen 2.883 N/A VAL 40.A N THR 53.A O no hydrogen 2.810 N/A LEU 41.A N TYR 27.A O no hydrogen 2.762 N/A LYS 42.A N THR 50.A O no hydrogen 2.770 N/A LYS 42.A NZ TYR 44.A OH no hydrogen 3.083 N/A LYS 42.A NZ GLU 119.A OE1 no hydrogen 2.684 N/A LYS 42.A NZ GLU 310.A OE2 no hydrogen 2.952 N/A SER 43.A N PHE 25.A O no hydrogen 2.958 N/A SER 43.A OG.A HIS 48.A O no hydrogen 2.888 N/A TYR 44.A OH GLU 119.A OE1 no hydrogen 3.181 N/A TYR 44.A OH GLU 119.A OE2 no hydrogen 2.527 N/A ASP 45.A N SER 43.A OG.A no hydrogen 3.058 N/A LEU 46.A N SER 43.A OG.B no hydrogen 3.070 N/A VAL 47.A N ASP 45.A OD1 no hydrogen 2.902 N/A HIS 48.A N ASP 45.A OD1 no hydrogen 2.898 N/A HIS 48.A ND1 ASP 45.A OD2 no hydrogen 2.860 N/A TRP 49.A NE1 LEU 46.A O no hydrogen 2.934 N/A THR 50.A N LYS 42.A O no hydrogen 2.920 N/A VAL 52.A N VAL 40.A O no hydrogen 2.827 N/A THR 53.A N VAL 40.A O no hydrogen 3.473 N/A HIS 54.A ND1 GLU 327.A OE1 no hydrogen 2.846 N/A HIS 54.A NE2 GLU 330.A OE2 no hydrogen 2.742 N/A SER 55.A N ALA 38.A O no hydrogen 2.851 N/A VAL 56.A N GLY 37.A O no hydrogen 3.058 N/A ARG 58.A NH1 PRO 335.A O no hydrogen 2.887 N/A ARG 58.A NH2 PRO 335.A O no hydrogen 3.273 N/A LEU 59.A N ASN 334.A OD1 no hydrogen 2.945 N/A TYR 65.A N GLY 62.A O no hydrogen 3.134 N/A TYR 65.A OH GLU 100.A OE2 no hydrogen 2.571 N/A ASP 66.A N SER 63.A O no hydrogen 3.134 N/A LEU 67.A N ASN 64.A O no hydrogen 3.083 N/A THR 71.A OG1 THR 432.A OG1 no hydrogen 3.128 N/A GLY 73.A N GLY 70.A O no hydrogen 3.047 N/A ALA 74.A N HIS 333.A NE2 no hydrogen 2.842 N/A TYR 75.A N PRO 72.A O no hydrogen 2.998 N/A TYR 75.A OH PHE 362.A O no hydrogen 2.625 N/A LYS 77.A N ALA 74.A O no hydrogen 2.979 N/A GLY 78.A N TYR 65.A OH no hydrogen 2.842 N/A ILE 79.A N PHE 32.A O no hydrogen 3.025 N/A TRP 80.A NE1 VAL 76.A O no hydrogen 3.004 N/A SER 82.A OG TRP 80.A O no hydrogen 2.807 N/A THR 83.A N TYR 96.A O no hydrogen 2.935 N/A THR 83.A OG1 GLU 17.A OE1 no hydrogen 2.633 N/A ARG 85.A N TYR 94.A O no hydrogen 3.100 N/A ARG 85.A NE GLU 17.A OE2 no hydrogen 2.976 N/A ARG 85.A NH1 MET 192.A O no hydrogen 3.054 N/A ARG 85.A NH2 GLU 17.A OE2 no hydrogen 2.705 N/A ARG 85.A NH2 MET 192.A O no hydrogen 2.943 N/A TYR 86.A OH ASP 91.A OD1 no hydrogen 2.623 N/A ARG 87.A N ARG 92.A O no hydrogen 2.781 N/A ARG 87.A NE ASP 148.A OD1 no hydrogen 2.918 N/A ARG 87.A NH1 TYR 94.A OH no hydrogen 3.053 N/A ARG 87.A NH1 PRO 166.A O no hydrogen 2.855 N/A ARG 87.A NH2 ASP 148.A O no hydrogen 2.962 N/A ARG 87.A NH2 ASP 148.A OD1 no hydrogen 3.517 N/A ARG 87.A NH2 PRO 166.A O no hydrogen 2.808 N/A ARG 88.A NH1 TYR 86.A O no hydrogen 3.056 N/A ARG 88.A NH2 ARG 20.A O no hydrogen 3.017 N/A SER 89.A OG ASP 148.A OD1 no hydrogen 3.487 N/A SER 89.A OG ASP 148.A OD2 no hydrogen 2.586 N/A ASN 90.A ND2 TYR 94.A OH no hydrogen 2.947 N/A ASP 91.A N ARG 88.A O no hydrogen 3.243 N/A ARG 92.A N ARG 87.A O no hydrogen 3.210 N/A ARG 92.A NH1.B THR 107.A OG1 no hydrogen 3.147 N/A ARG 92.A NH2.A THR 107.A OG1 no hydrogen 2.963 N/A PHE 93.A N SER 108.A O no hydrogen 2.782 N/A TYR 94.A N ARG 85.A O no hydrogen 2.927 N/A TRP 95.A N TRP 106.A O no hydrogen 2.865 N/A TYR 96.A N THR 83.A O no hydrogen 2.875 N/A TYR 96.A OH GLY 168.A O no hydrogen 2.684 N/A GLY 97.A N TYR 104.A O no hydrogen 3.031 N/A CYS 98.A SG ARG 102.A O no hydrogen 3.555 N/A VAL 99.A N ARG 102.A O no hydrogen 2.858 N/A ARG 102.A N VAL 99.A O no hydrogen 3.279 N/A ARG 102.A NE ASP 134.A OD1 no hydrogen 2.858 N/A ARG 102.A NH2 ASP 134.A OD1 no hydrogen 2.789 N/A THR 103.A N ILE 133.A O no hydrogen 2.966 N/A THR 103.A OG1 ASN 135.A O no hydrogen 2.703 N/A TYR 104.A N GLY 97.A O no hydrogen 2.907 N/A LEU 105.A N ALA 131.A O no hydrogen 2.874 N/A TRP 106.A N TRP 95.A O no hydrogen 2.946 N/A TRP 106.A NE1 ASN 60.A OD1 no hydrogen 3.000 N/A THR 107.A N GLN 128.A O no hydrogen 2.968 N/A THR 107.A OG1 THR 130.A OG1 no hydrogen 2.726 N/A SER 108.A N PHE 93.A O no hydrogen 3.132 N/A SER 108.A OG PRO 109.A O no hydrogen 2.889 N/A GLY 110.A N ASP 91.A O no hydrogen 2.836 N/A ASN 112.A N ASP 91.A OD2 no hydrogen 2.636 N/A ALA 113.A N ASP 91.A OD1 no hydrogen 3.338 N/A LEU 114.A N TYR 86.A OH no hydrogen 3.046 N/A ALA 115.A N ASN 112.A O no hydrogen 3.105 N/A ASN 116.A N ALA 113.A O no hydrogen 2.945 N/A ASN 116.A ND2 ASN 112.A O no hydrogen 2.826 N/A GLY 118.A N ALA 113.A O no hydrogen 2.920 N/A GLU 119.A N ASN 116.A O no hydrogen 3.135 N/A ALA 124.A N PRO 121.A O no hydrogen 2.896 N/A ASN 126.A N SER 108.A OG no hydrogen 2.896 N/A TRP 127.A NE1 THR 53.A OG1 no hydrogen 2.944 N/A GLN 128.A N THR 107.A O no hydrogen 2.948 N/A GLN 128.A NE2 ASN 126.A OD1 no hydrogen 2.914 N/A HIS 129.A NE2 THR 132.A OG1 no hydrogen 2.961 N/A THR 130.A N LEU 105.A O no hydrogen 2.793 N/A THR 130.A OG1 THR 107.A OG1 no hydrogen 2.726 N/A THR 130.A OG1 GLN 128.A O no hydrogen 3.156 N/A ALA 131.A N LEU 105.A O no hydrogen 3.373 N/A THR 132.A OG1 HIS 129.A NE2 no hydrogen 2.961 N/A ILE 133.A N THR 103.A O no hydrogen 2.759 N/A ASN 135.A ND2 TYR 154.A OH no hydrogen 3.344 N/A ASN 135.A ND2 GLN 171.A OE1 no hydrogen 2.922 N/A TYR 137.A N THR 103.A OG1 no hydrogen 3.053 N/A TYR 137.A OH GLN 171.A OE1 no hydrogen 2.669 N/A TYR 138.A OH GLU 188.A OE1 no hydrogen 2.733 N/A GLY 141.A N ALA 153.A O no hydrogen 2.727 N/A LEU 142.A N THR 83.A OG1 no hydrogen 2.940 N/A LEU 143.A N TYR 151.A O no hydrogen 2.858 N/A ASP 145.A N THR 149.A O no hydrogen 2.839 N/A ASP 146.A N ASP 145.A OD1 no hydrogen 2.711 N/A ASP 148.A N ASP 145.A O no hydrogen 2.891 N/A THR 149.A N ASP 147.A OD1 no hydrogen 3.146 N/A THR 149.A OG1 ASP 147.A OD1 no hydrogen 3.405 N/A TYR 151.A N LEU 143.A O no hydrogen 2.951 N/A ILE 152.A N ALA 162.A O no hydrogen 2.840 N/A ALA 153.A N GLY 141.A O no hydrogen 2.901 N/A TYR 154.A N ASN 160.A O no hydrogen 2.986 N/A GLY 155.A N TYR 138.A O no hydrogen 2.862 N/A ASN 156.A ND2 GLU 188.A OE1 no hydrogen 2.788 N/A ILE 159.A N TYR 179.A O no hydrogen 2.947 N/A ASN 160.A N TYR 154.A O no hydrogen 2.831 N/A VAL 161.A N GLN 175.A O no hydrogen 2.982 N/A ALA 162.A N ILE 152.A O no hydrogen 2.818 N/A GLN 163.A N ARG 173.A O no hydrogen 2.773 N/A LEU 164.A N MET 150.A O no hydrogen 2.848 N/A SER 165.A N ARG 170.A O no hydrogen 2.838 N/A SER 165.A OG ASP 167.A OD1 no hydrogen 2.891 N/A SER 165.A OG ARG 170.A O no hydrogen 3.495 N/A GLY 168.A N SER 165.A O no hydrogen 2.822 N/A THR 169.A N ASP 167.A OD1 no hydrogen 2.957 N/A THR 169.A OG1 ASP 167.A OD1 no hydrogen 2.684 N/A THR 169.A OG1 ASP 167.A OD2 no hydrogen 3.325 N/A ARG 170.A N SER 165.A OG no hydrogen 3.137 N/A VAL 172.A N GLN 163.A O no hydrogen 2.794 N/A ARG 173.A N GLN 163.A O no hydrogen 3.383 N/A ARG 173.A NH2 GLN 175.A OE1 no hydrogen 3.543 N/A GLN 175.A N VAL 161.A O no hydrogen 2.805 N/A ARG 177.A N ASN 160.A OD1 no hydrogen 2.873 N/A VAL 178.A N ILE 159.A O no hydrogen 2.794 N/A GLN 183.A N HIS 181.A ND1 no hydrogen 2.988 N/A GLY 184.A N HIS 181.A O no hydrogen 3.010 N/A VAL 187.A N PRO 157.A O no hydrogen 3.229 N/A GLU 188.A N THR 204.A O no hydrogen 2.937 N/A GLY 189.A N ASP 139.A OD2 no hydrogen 2.877 N/A ARG 191.A N LEU 202.A O no hydrogen 2.994 N/A ARG 191.A NE LEU 16.A O no hydrogen 3.019 N/A ARG 191.A NH1 SER 82.A O no hydrogen 3.054 N/A ARG 191.A NH1 ALA 140.A O no hydrogen 2.878 N/A ARG 191.A NH1 ALA 190.A O no hydrogen 3.030 N/A ARG 191.A NH2 ALA 15.A O no hydrogen 3.002 N/A ARG 191.A NH2 LEU 16.A O no hydrogen 3.275 N/A ARG 191.A NH2 SER 82.A O no hydrogen 2.751 N/A TYR 193.A N TYR 200.A O no hydrogen 2.778 N/A LYS 194.A NZ ASP 145.A OD1 no hydrogen 2.816 N/A LYS 194.A NZ ASP 146.A OD2 no hydrogen 3.087 N/A LYS 194.A NZ TYR 199.A OH no hydrogen 3.469 N/A ILE 195.A N ASN 198.A O no hydrogen 2.908 N/A ASN 198.A N ILE 195.A O no hydrogen 3.037 N/A TYR 199.A OH ASP 145.A OD2 no hydrogen 2.458 N/A TYR 200.A N TYR 193.A O no hydrogen 2.912 N/A TYR 200.A OH GLY 282.A O no hydrogen 2.671 N/A ILE 201.A N LEU 213.A O no hydrogen 2.866 N/A LEU 202.A N ARG 191.A O no hydrogen 2.852 N/A VAL 203.A N TYR 211.A O no hydrogen 3.039 N/A THR 204.A N GLU 188.A O no hydrogen 2.841 N/A THR 204.A OG1 ALA 209.A O no hydrogen 2.831 N/A ARG 205.A N ALA 209.A O no hydrogen 2.887 N/A ARG 205.A NE ASP 208.A OD1 no hydrogen 3.013 N/A ARG 205.A NH2 ASP 208.A OD1 no hydrogen 3.144 N/A ARG 205.A NH2 ASP 208.A OD2 no hydrogen 3.159 N/A ASP 208.A N ARG 205.A O no hydrogen 2.946 N/A ALA 209.A N ARG 205.A O no hydrogen 3.278 N/A GLU 210.A N VAL 230.A O no hydrogen 2.864 N/A TYR 211.A N VAL 203.A O no hydrogen 2.751 N/A TYR 211.A OH GLN 185.A OE1 no hydrogen 2.803 N/A VAL 212.A N ARG 227.A O no hydrogen 2.869 N/A LEU 213.A N ILE 201.A O no hydrogen 2.714 N/A ARG 214.A N GLU 225.A O no hydrogen 2.854 N/A ARG 214.A NH1 ASP 281.A O no hydrogen 2.831 N/A ARG 214.A NH1 GLY 282.A O no hydrogen 3.103 N/A SER 215.A N TYR 199.A O no hydrogen 2.970 N/A SER 215.A OG SER 219.A O no hydrogen 2.692 N/A THR 216.A N PRO 223.A O no hydrogen 2.880 N/A THR 216.A OG1 PRO 223.A O no hydrogen 3.128 N/A THR 217.A N SER 215.A OG no hydrogen 3.372 N/A THR 217.A OG1 SER 215.A OG no hydrogen 3.173 N/A THR 217.A OG1 GLY 222.A O no hydrogen 2.706 N/A SER 219.A N THR 217.A OG1 no hydrogen 3.065 N/A PHE 221.A N SER 219.A OG no hydrogen 3.036 N/A GLY 222.A N SER 219.A O no hydrogen 2.947 N/A TYR 224.A N VAL 178.A O no hydrogen 2.919 N/A TYR 224.A OH PRO 220.A O no hydrogen 2.716 N/A GLU 225.A N ARG 214.A O no hydrogen 2.975 N/A ARG 227.A N VAL 212.A O no hydrogen 2.923 N/A ARG 227.A NH1 ASP 281.A OD1 no hydrogen 3.473 N/A ARG 227.A NH2 ASP 281.A OD1 no hydrogen 3.554 N/A ARG 227.A NH2 ASP 281.A OD2 no hydrogen 2.822 N/A LEU 229.A N GLU 210.A O no hydrogen 2.844 N/A VAL 230.A N GLU 210.A O no hydrogen 3.147 N/A ARG 232.A N ASP 208.A O no hydrogen 2.796 N/A ARG 232.A NH1 ASP 208.A OD2 no hydrogen 2.880 N/A HIS 244.A N PHE 261.A O no hydrogen 3.068 N/A HIS 244.A ND1 PHE 242.A O no hydrogen 2.690 N/A GLN 245.A N GLU 210.A OE1 no hydrogen 2.805 N/A GLY 247.A N VAL 259.A O no hydrogen 2.920 N/A ILE 248.A N TYR 193.A OH no hydrogen 2.878 N/A VAL 249.A N HIS 257.A O no hydrogen 3.032 N/A ALA 251.A N THR 255.A O no hydrogen 2.789 N/A GLY 254.A N ALA 251.A O no hydrogen 2.899 N/A THR 255.A N ASP 253.A OD1 no hydrogen 3.040 N/A THR 255.A OG1 ASP 253.A OD1 no hydrogen 2.529 N/A THR 255.A OG1 ASP 253.A OD2 no hydrogen 3.454 N/A THR 255.A OG1 HIS 257.A NE2 no hydrogen 3.222 N/A HIS 257.A N VAL 249.A O no hydrogen 2.869 N/A HIS 257.A NE2 THR 255.A OG1 no hydrogen 3.222 N/A TYR 258.A N ALA 274.A O no hydrogen 2.829 N/A TYR 258.A OH GLN 245.A O no hydrogen 2.626 N/A VAL 259.A N GLY 247.A O no hydrogen 2.823 N/A ALA 260.A N VAL 272.A O no hydrogen 2.907 N/A PHE 261.A N HIS 244.A O no hydrogen 3.087 N/A MET 262.A N ILE 270.A O no hydrogen 2.929 N/A TYR 265.A OH PHE 501.A O no hydrogen 2.718 N/A GLY 267.A N ALA 264.A O no hydrogen 2.989 N/A GLY 268.A N ALA 264.A O no hydrogen 3.305 N/A ARG 269.A N ASP 12.A OD1 no hydrogen 2.850 N/A ILE 270.A N MET 262.A O no hydrogen 3.206 N/A VAL 272.A N ALA 260.A O no hydrogen 2.950 N/A VAL 273.A N ASN 6.A OD1 no hydrogen 2.808 N/A ALA 274.A N TYR 258.A O no hydrogen 3.008 N/A LEU 276.A N TRP 256.A O no hydrogen 2.940 N/A ARG 277.A N GLU 285.A O no hydrogen 2.852 N/A ARG 277.A NE GLU 285.A OE1 no hydrogen 3.046 N/A ARG 277.A NH2 GLU 285.A OE1 no hydrogen 3.286 N/A THR 279.A N TRP 283.A O no hydrogen 2.740 N/A THR 279.A OG1 ASP 281.A OD1 no hydrogen 2.495 N/A THR 279.A OG1 TRP 283.A O no hydrogen 3.401 N/A GLY 282.A N THR 279.A O no hydrogen 3.121 N/A TRP 283.A N THR 279.A OG1 no hydrogen 2.948 N/A GLU 285.A N ARG 277.A O no hydrogen 2.796 N/A VAL 287.A N PRO 275.A O no hydrogen 2.874 N/A THR 288.A OG1 ASP 289.A O no hydrogen 2.980 N/A ASP 289.A N ARG 293.A O no hydrogen 2.869 N/A GLN 291.A N ASP 289.A OD1 no hydrogen 2.902 N/A GLY 292.A N ASP 289.A O no hydrogen 2.988 N/A ARG 293.A N ASP 289.A OD1 no hydrogen 2.807 N/A TRP 294.A N GLN 234.A O no hydrogen 2.839 N/A TRP 294.A NE1 VAL 273.A O no hydrogen 3.191 N/A GLY 295.A N TYR 298.A OH no hydrogen 2.887 N/A TYR 298.A N PHE 4.A O no hydrogen 3.109 N/A TYR 298.A OH VAL 287.A O no hydrogen 2.664 N/A ILE 300.A N SER 2.A O no hydrogen 2.950 N/A ARG 303.A NH2 ASP 253.A OD2 no hydrogen 2.876 N/A LYS 306.A NZ TYR 44.A OH no hydrogen 3.121 N/A THR 309.A OG1 ASN 307.A O no hydrogen 3.324 N/A ALA 313.A N ASP 316.A OD2 no hydrogen 2.809 N/A SER 314.A OG GLU 11.A OE2 no hydrogen 2.631 N/A ASP 316.A N ALA 313.A O no hydrogen 2.993 N/A ASP 318.A N PHE 525.A O no hydrogen 2.916 N/A PHE 320.A N ASP 318.A OD1 no hydrogen 2.839 N/A ARG 321.A NH2 GLU 319.A OE1 no hydrogen 2.928 N/A HIS 328.A N SER 326.A OG no hydrogen 3.205 N/A HIS 328.A NE2 LEU 312.A O no hydrogen 2.847 N/A TRP 329.A N SER 326.A O no hydrogen 3.443 N/A TRP 329.A NE1 ASP 318.A OD2 no hydrogen 2.911 N/A GLU 330.A N THR 369.A O no hydrogen 2.872 N/A TRP 331.A N SER 35.A O no hydrogen 2.676 N/A ASN 332.A N THR 367.A O no hydrogen 2.866 N/A ASN 332.A ND2 TYR 75.A OH no hydrogen 2.918 N/A HIS 333.A N ALA 33.A O no hydrogen 2.921 N/A HIS 333.A ND1 ASN 332.A OD1 no hydrogen 2.923 N/A ASN 334.A N TYR 65.A O no hydrogen 2.860 N/A ASN 334.A ND2 LEU 59.A O no hydrogen 2.914 N/A ASN 334.A ND2 ASP 66.A OD1 no hydrogen 2.846 N/A ASP 336.A N ASN 366.A OD1 no hydrogen 2.742 N/A SER 338.A N ASP 336.A OD1 no hydrogen 2.960 N/A SER 338.A OG ASP 336.A OD1 no hydrogen 2.738 N/A LYS 339.A N ASP 336.A O no hydrogen 3.061 N/A LYS 339.A NZ SER 338.A OG no hydrogen 3.402 N/A THR 341.A N ILE 351.A O no hydrogen 3.036 N/A LEU 343.A N GLY 349.A O no hydrogen 2.913 N/A GLY 348.A N GLY 344.A O no hydrogen 3.089 N/A GLY 349.A N GLU 319.A O no hydrogen 3.227 N/A GLY 349.A N PHE 320.A O no hydrogen 2.932 N/A LEU 350.A N VAL 522.A O no hydrogen 2.968 N/A ILE 351.A N THR 341.A O no hydrogen 2.779 N/A LEU 352.A N VAL 520.A O no hydrogen 2.934 N/A ARG 353.A N LYS 339.A O no hydrogen 2.759 N/A ARG 353.A NE GLU 519.A OE1 no hydrogen 3.011 N/A THR 354.A N GLY 518.A O no hydrogen 2.981 N/A THR 354.A OG1 SER 512.A OG.B no hydrogen 3.016 N/A THR 354.A OG1 GLY 518.A O no hydrogen 3.500 N/A THR 358.A N SER 512.A O no hydrogen 2.783 N/A THR 358.A OG1 ASP 360.A O no hydrogen 3.452 N/A ASP 360.A N THR 358.A OG1 no hydrogen 2.969 N/A PHE 362.A N ASP 360.A OD1 no hydrogen 2.977 N/A ALA 363.A N ASP 360.A O no hydrogen 2.876 N/A ALA 364.A N LEU 361.A O no hydrogen 3.062 N/A ARG 365.A N THR 356.A OG1 no hydrogen 2.930 N/A ARG 365.A NE ASP 66.A O no hydrogen 2.788 N/A ARG 365.A NE LEU 67.A O no hydrogen 3.173 N/A ARG 365.A NH2 ASP 66.A O no hydrogen 2.906 N/A ASN 366.A ND2 ASP 336.A O no hydrogen 3.125 N/A LEU 368.A N VAL 508.A O no hydrogen 2.941 N/A THR 369.A N GLU 330.A O no hydrogen 2.770 N/A THR 369.A OG1 GLU 330.A O no hydrogen 2.766 N/A ARG 370.A N PHE 506.A O no hydrogen 2.854 N/A ARG 371.A NE ASP 12.A O no hydrogen 2.826 N/A ARG 371.A NH1 GLU 330.A OE2 no hydrogen 3.136 N/A ARG 371.A NH2 GLU 330.A OE2 no hydrogen 2.923 N/A GLY 374.A N TRP 10.A O no hydrogen 2.973 N/A ALA 377.A N ALA 459.A O no hydrogen 3.156 N/A SER 378.A N ASN 528.A O no hydrogen 2.748 N/A SER 378.A OG ASP 458.A OD1 no hydrogen 2.725 N/A GLY 379.A N ILE 457.A O no hydrogen 2.825 N/A ILE 380.A N LYS 526.A O no hydrogen 2.841 N/A PHE 381.A N LEU 455.A O no hydrogen 2.834 N/A ARG 382.A N GLY 524.A O no hydrogen 2.940 N/A ARG 382.A NE ASP 452.A OD1 no hydrogen 2.681 N/A ARG 382.A NH2 ASP 452.A OD1 no hydrogen 3.346 N/A LEU 383.A N ILE 453.A O no hydrogen 2.833 N/A ASP 384.A N LYS 521.A O no hydrogen 2.804 N/A VAL 385.A N GLN 450.A O no hydrogen 2.777 N/A ARG 386.A N ASP 384.A OD1 no hydrogen 3.117 N/A ARG 386.A NE ASP 384.A OD1 no hydrogen 2.993 N/A ARG 386.A NE ASP 384.A OD2 no hydrogen 3.368 N/A ARG 386.A NH2 ASP 384.A OD2 no hydrogen 2.828 N/A MET 388.A N VAL 385.A O no hydrogen 3.103 N/A ARG 389.A N ASP 392.A OD2 no hydrogen 2.724 N/A GLY 391.A N LYS 410.A O no hydrogen 2.791 N/A ASP 392.A N ARG 389.A O no hydrogen 2.923 N/A ARG 393.A N PHE 511.A O no hydrogen 2.866 N/A ALA 394.A N VAL 408.A O no hydrogen 3.038 N/A GLY 395.A N PHE 509.A O no hydrogen 3.071 N/A ALA 396.A N ILE 406.A O no hydrogen 2.887 N/A VAL 397.A N GLY 507.A O no hydrogen 2.829 N/A LEU 398.A N ALA 404.A O no hydrogen 2.872 N/A PHE 399.A N ARG 505.A O no hydrogen 2.801 N/A ARG 400.A NE THR 502.A O no hydrogen 2.740 N/A ARG 400.A NH1 ASP 401.A OD1 no hydrogen 2.853 N/A ARG 400.A NH1 SER 497.A O no hydrogen 3.091 N/A ARG 400.A NH2 SER 497.A O no hydrogen 2.898 N/A ARG 400.A NH2 THR 502.A O no hydrogen 3.117 N/A ARG 402.A NH1 GLU 470.A OE1 no hydrogen 2.968 N/A ARG 402.A NH1 GLU 470.A OE2 no hydrogen 3.498 N/A ARG 402.A NH1 ALA 493.A O no hydrogen 2.828 N/A ARG 402.A NH2 GLU 470.A OE2 no hydrogen 3.057 N/A ALA 403.A N LEU 423.A O no hydrogen 2.813 N/A ALA 404.A N LEU 398.A O no hydrogen 3.403 N/A TYR 405.A N VAL 420.A O no hydrogen 2.881 N/A ILE 406.A N ALA 396.A O no hydrogen 3.055 N/A GLY 407.A N VAL 418.A O no hydrogen 2.870 N/A VAL 408.A N ALA 394.A O no hydrogen 2.767 N/A TRP 409.A N ARG 416.A O no hydrogen 2.911 N/A TRP 409.A NE1 TYR 405.A OH no hydrogen 2.874 N/A LYS 410.A N ASP 392.A O no hydrogen 3.036 N/A LYS 410.A NZ MET 388.A O no hydrogen 2.999 N/A GLN 411.A N GLU 414.A O no hydrogen 2.861 N/A GLY 412.A N ASP 390.A OD1 no hydrogen 2.779 N/A GLU 414.A N GLN 411.A O no hydrogen 2.910 N/A ARG 416.A N TRP 409.A O no hydrogen 3.012 N/A ARG 416.A NE ASN 441.A OD1 no hydrogen 2.719 N/A ARG 416.A NH1 GLN 411.A OE1 no hydrogen 2.998 N/A ARG 416.A NH2 ASN 441.A OD1 no hydrogen 2.877 N/A ILE 417.A N PRO 443.A O no hydrogen 3.024 N/A VAL 418.A N GLY 407.A O no hydrogen 2.860 N/A MET 419.A N ALA 440.A O no hydrogen 2.928 N/A VAL 420.A N TYR 405.A O no hydrogen 2.904 N/A ASP 421.A N ARG 437.A O no hydrogen 3.045 N/A LEU 423.A N ALA 403.A O no hydrogen 3.434 N/A ARG 424.A N SER 434.A O no hydrogen 2.984 N/A ARG 424.A NE ASP 422.A OD1 no hydrogen 2.902 N/A LEU 425.A N ASP 401.A O no hydrogen 2.888 N/A ASN 426.A N ARG 431.A O no hydrogen 2.818 N/A ASP 428.A N ASN 426.A OD1 no hydrogen 3.017 N/A TRP 430.A N ASN 426.A O no hydrogen 2.784 N/A THR 432.A N THR 71.A OG1 no hydrogen 3.094 N/A THR 432.A OG1 THR 71.A OG1 no hydrogen 3.128 N/A THR 432.A OG1 ASP 360.A OD1 no hydrogen 3.426 N/A THR 432.A OG1 ASP 360.A OD2 no hydrogen 2.471 N/A ALA 433.A N ARG 424.A O no hydrogen 2.763 N/A SER 434.A N ARG 424.A O no hydrogen 3.079 N/A SER 434.A OG ASP 422.A O no hydrogen 2.734 N/A SER 434.A OG ASP 422.A OD2 no hydrogen 2.962 N/A GLY 436.A N SER 434.A OG no hydrogen 3.336 N/A ARG 437.A N ASP 421.A O no hydrogen 3.026 N/A ALA 439.A N MET 419.A O no hydrogen 2.811 N/A ALA 440.A N MET 419.A O no hydrogen 3.297 N/A GLY 442.A N ILE 417.A O no hydrogen 2.693 N/A ILE 445.A N ALA 415.A O no hydrogen 2.918 N/A ALA 449.A N ASP 446.A OD1 no hydrogen 2.962 N/A GLN 450.A N ASP 446.A O no hydrogen 2.876 N/A GLN 450.A NE2 ILE 445.A O no hydrogen 2.915 N/A GLN 451.A N THR 447.A O no hydrogen 3.044 N/A ASP 452.A N ALA 449.A O no hydrogen 3.091 N/A ILE 453.A N LEU 383.A O no hydrogen 2.923 N/A TRP 454.A N SER 478.A O no hydrogen 2.972 N/A TRP 454.A NE1 ASP 452.A OD2 no hydrogen 2.836 N/A LEU 455.A N PHE 381.A O no hydrogen 2.787 N/A ARG 456.A N TYR 476.A O no hydrogen 2.884 N/A ARG 456.A NE ASP 458.A OD1 no hydrogen 2.868 N/A ARG 456.A NH2 ASP 458.A OD2 no hydrogen 2.848 N/A ILE 457.A N GLY 379.A O no hydrogen 2.870 N/A ASP 458.A N THR 474.A O no hydrogen 2.851 N/A ALA 459.A N ALA 377.A O no hydrogen 2.920 N/A ILE 461.A N PRO 375.A O no hydrogen 2.796 N/A THR 462.A N ASP 460.A OD1 no hydrogen 2.956 N/A THR 462.A OG1 ASP 460.A OD1 no hydrogen 2.636 N/A ALA 464.A N TYR 265.A O no hydrogen 2.836 N/A PHE 465.A N ASN 239.A O no hydrogen 2.908 N/A THR 467.A N ALA 464.A O no hydrogen 3.118 N/A THR 467.A OG1 ALA 464.A O no hydrogen 2.784 N/A THR 469.A N THR 467.A OG1 no hydrogen 3.068 N/A ARG 471.A NE THR 462.A O no hydrogen 2.818 N/A ARG 471.A NH2 PRO 463.A O no hydrogen 2.894 N/A THR 473.A N PHE 492.A O no hydrogen 2.902 N/A THR 474.A N ASP 458.A O no hydrogen 3.040 N/A THR 474.A OG1 TYR 476.A OH no hydrogen 2.710 N/A TYR 476.A N ARG 456.A O no hydrogen 2.888 N/A TYR 476.A OH THR 474.A OG1 no hydrogen 2.710 N/A TYR 477.A N THR 486.A O no hydrogen 2.933 N/A SER 478.A N TRP 454.A O no hydrogen 2.844 N/A SER 478.A OG ASP 480.A OD1 no hydrogen 2.768 N/A SER 478.A OG THR 484.A O no hydrogen 2.829 N/A ASP 480.A N SER 478.A OG no hydrogen 3.203 N/A GLY 482.A N SER 478.A OG no hydrogen 2.950 N/A ARG 483.A N ASP 480.A O no hydrogen 3.378 N/A ARG 483.A NH1 ARG 483.A O no hydrogen 2.387 N/A THR 484.A N ASP 480.A OD1 no hydrogen 2.866 N/A THR 484.A OG1 ASP 480.A OD2 no hydrogen 3.187 N/A THR 486.A N TYR 477.A O no hydrogen 2.802 N/A ARG 487.A NE GLY 489.A O no hydrogen 3.202 N/A ARG 487.A NH2 GLY 489.A O no hydrogen 3.152 N/A LEU 488.A N PHE 475.A O no hydrogen 2.946 N/A PHE 492.A N THR 473.A O no hydrogen 2.770 N/A MET 494.A N ARG 471.A O no hydrogen 2.824 N/A THR 495.A N TYR 504.A OH no hydrogen 3.004 N/A ASN 496.A ND2 THR 469.A O no hydrogen 2.817 N/A SER 497.A N THR 495.A OG1 no hydrogen 3.120 N/A SER 497.A OG GLU 427.A OE2 no hydrogen 2.566 N/A ARG 499.A N SER 497.A OG no hydrogen 3.212 N/A TYR 500.A OH TYR 34.A OH no hydrogen 2.728 N/A PHE 501.A N TRP 498.A O no hydrogen 2.815 N/A THR 502.A N TYR 500.A O no hydrogen 2.789 N/A GLY 503.A N ASP 12.A OD2 no hydrogen 2.854 N/A TYR 504.A N PRO 266.A O no hydrogen 3.346 N/A TYR 504.A OH ARG 402.A O no hydrogen 2.725 N/A ARG 505.A N PHE 399.A O no hydrogen 3.049 N/A ARG 505.A NH1 GLU 330.A OE1 no hydrogen 2.895 N/A ARG 505.A NH1 THR 369.A OG1 no hydrogen 3.000 N/A ARG 505.A NH2 GLU 330.A OE1 no hydrogen 2.942 N/A PHE 506.A N ARG 370.A O no hydrogen 2.977 N/A GLY 507.A N VAL 397.A O no hydrogen 2.834 N/A VAL 508.A N LEU 368.A O no hydrogen 2.893 N/A PHE 509.A N GLY 395.A O no hydrogen 3.053 N/A ASN 510.A ND2 LEU 352.A O no hydrogen 2.893 N/A PHE 511.A N ARG 393.A O no hydrogen 2.993 N/A SER 512.A N THR 356.A O no hydrogen 3.134 N/A SER 512.A OG.A ASP 392.A OD1 no hydrogen 2.850 N/A SER 512.A OG.A SER 515.A O no hydrogen 3.130 N/A SER 512.A OG.B ASP 392.A OD1 no hydrogen 3.070 N/A SER 512.A OG.B SER 515.A O no hydrogen 2.957 N/A THR 513.A N GLY 391.A O no hydrogen 2.966 N/A THR 513.A OG1 GLY 391.A O no hydrogen 2.926 N/A LYS 514.A N SER 512.A OG.A no hydrogen 3.082 N/A SER 515.A N SER 512.A OG.A no hydrogen 3.318 N/A SER 515.A OG LEU 516.A O no hydrogen 3.338 N/A GLU 519.A N GLY 387.A O no hydrogen 3.030 N/A VAL 520.A N LEU 352.A O no hydrogen 2.985 N/A LYS 521.A N ASP 384.A O no hydrogen 2.948 N/A VAL 522.A N LEU 350.A O no hydrogen 2.704 N/A LYS 523.A N ARG 382.A O no hydrogen 2.695 N/A LYS 523.A NZ GLN 451.A O no hydrogen 2.758 N/A LYS 523.A NZ ASP 452.A OD1 no hydrogen 2.767 N/A GLY 524.A N ARG 382.A O no hydrogen 3.337 N/A PHE 525.A N ASP 318.A O no hydrogen 2.863 N/A LYS 526.A N ILE 380.A O no hydrogen 2.938 N/A LYS 526.A NZ THR 315.A O no hydrogen 2.773 N/A LYS 526.A NZ MET 527.A O no hydrogen 2.927 N/A LYS 526.A NZ ASN 528.A OD1 no hydrogen 2.779 N/A ASN 528.A N SER 378.A O no hydrogen 2.882 N/A ILE 530.A N LYS 376.A O no hydrogen 3.129 N/A