Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3icr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 29.A OD1 no hydrogen 2.741 N/A ARG 4.A NH2 ILE 307.A O no hydrogen 2.961 N/A LYS 5.A N ASP 107.A OD2 no hydrogen 2.766 N/A LYS 5.A NZ GLU 104.A OE2 no hydrogen 2.723 N/A LYS 5.A NZ ALA 105.A O no hydrogen 2.723 N/A ILE 6.A N GLU 30.A O no hydrogen 2.778 N/A VAL 7.A N VAL 108.A O no hydrogen 2.970 N/A VAL 8.A N ILE 32.A O no hydrogen 2.735 N/A VAL 9.A N ILE 110.A O no hydrogen 2.688 N/A GLY 10.A N VAL 33.A O no hydrogen 2.758 N/A GLY 11.A N GLU 34.A OE1 no hydrogen 2.971 N/A ALA 16.A N VAL 12.A O no hydrogen 2.904 N/A SER 17.A OG ALA 13.A O no hydrogen 2.963 N/A SER 17.A OG GLY 14.A O no hydrogen 3.116 N/A SER 17.A OG ASN 298.A O no hydrogen 3.464 N/A VAL 18.A N GLY 14.A O no hydrogen 3.057 N/A ALA 19.A N GLY 15.A O no hydrogen 3.020 N/A ALA 20.A N ALA 16.A O no hydrogen 3.113 N/A ARG 21.A N SER 17.A O no hydrogen 3.431 N/A ARG 21.A NE ASP 305.A OD1 no hydrogen 2.885 N/A ARG 21.A NH2 ASP 305.A OD1 no hydrogen 2.920 N/A LEU 22.A N VAL 18.A O no hydrogen 2.895 N/A ARG 23.A N ALA 19.A O no hydrogen 3.108 N/A ARG 23.A NE PHE 71.A O no hydrogen 2.751 N/A ARG 23.A NH1 SER 26.A O no hydrogen 2.713 N/A ARG 23.A NH1 ASP 29.A O no hydrogen 2.939 N/A ARG 23.A NH2 ASP 29.A O no hydrogen 3.000 N/A ARG 23.A NH2 ASN 72.A O no hydrogen 2.881 N/A ARG 24.A N ALA 20.A O no hydrogen 3.185 N/A LEU 25.A N ARG 21.A O no hydrogen 2.994 N/A LEU 25.A N LEU 22.A O no hydrogen 3.294 N/A SER 26.A N ARG 23.A O no hydrogen 3.161 N/A GLU 28.A N SER 26.A OG no hydrogen 3.129 N/A ASP 29.A N SER 26.A OG no hydrogen 3.209 N/A GLU 30.A N ARG 4.A O no hydrogen 3.045 N/A ILE 32.A N ILE 6.A O no hydrogen 2.982 N/A GLU 34.A N ARG 76.A O no hydrogen 2.921 N/A ARG 35.A NH1 GLU 242.A OE2 no hydrogen 2.953 N/A GLY 36.A N GLU 34.A OE2 no hydrogen 2.668 N/A SER 40.A N GLY 11.A O no hydrogen 2.873 N/A ALA 42.A N LEU 60.A O no hydrogen 2.727 N/A ASN 43.A N PHE 41.A O no hydrogen 3.055 N/A GLY 45.A N ALA 42.A O no hydrogen 2.826 N/A LEU 46.A N ASN 43.A O no hydrogen 3.342 N/A TYR 49.A N GLY 45.A O no hydrogen 3.071 N/A ILE 50.A N LEU 46.A O no hydrogen 3.128 N/A GLY 51.A N PRO 47.A O no hydrogen 3.016 N/A GLY 52.A N TYR 49.A O no hydrogen 3.125 N/A VAL 53.A N TYR 48.A O no hydrogen 2.855 N/A ILE 54.A N TYR 48.A O no hydrogen 2.920 N/A ARG 57.A NE ASP 141.A OD1 no hydrogen 2.818 N/A ARG 57.A NE ASP 141.A OD2 no hydrogen 3.365 N/A ARG 57.A NH1 TYR 38.A OH no hydrogen 3.329 N/A ARG 57.A NH2 TYR 38.A OH no hydrogen 3.191 N/A ARG 57.A NH2 ASP 141.A OD2 no hydrogen 2.674 N/A LYS 59.A N GLU 56.A O no hydrogen 2.900 N/A LEU 60.A N ARG 57.A O no hydrogen 2.959 N/A LEU 61.A N GLN 58.A O no hydrogen 2.987 N/A VAL 62.A N SER 40.A O no hydrogen 2.975 N/A GLN 63.A NE2 VAL 62.A O no hydrogen 2.964 N/A ARG 67.A N THR 64.A OG1 no hydrogen 3.179 N/A SER 68.A OG VAL 65.A O no hydrogen 2.804 N/A SER 68.A OG GLU 66.A O no hydrogen 3.314 N/A LYS 69.A N GLU 66.A O no hydrogen 3.210 N/A ARG 70.A N ARG 67.A O no hydrogen 2.817 N/A LEU 73.A N SER 68.A O no hydrogen 2.978 N/A ASP 74.A N ILE 31.A O no hydrogen 2.853 N/A ARG 76.A NE ASP 74.A OD1 no hydrogen 2.855 N/A ARG 76.A NH1 TYR 102.A OH no hydrogen 3.122 N/A ARG 76.A NH1 GLU 104.A OE1 no hydrogen 2.722 N/A ARG 76.A NH2 ASP 74.A OD2 no hydrogen 2.721 N/A LEU 78.A N GLY 36.A O no hydrogen 2.736 N/A SER 79.A N GLU 34.A O no hydrogen 2.874 N/A SER 79.A OG ARG 76.A O no hydrogen 3.496 N/A SER 79.A OG VAL 77.A O no hydrogen 3.067 N/A GLU 80.A N LYS 94.A O no hydrogen 2.827 N/A VAL 82.A N THR 92.A O no hydrogen 2.709 N/A ASN 85.A N THR 90.A O no hydrogen 2.814 N/A ASN 85.A ND2 THR 90.A O no hydrogen 3.380 N/A ASN 85.A ND2 THR 90.A OG1 no hydrogen 3.182 N/A ASN 85.A ND2 THR 92.A OG1 no hydrogen 3.131 N/A LYS 86.A NZ GLU 87.A OE1 no hydrogen 3.370 N/A LYS 86.A NZ ALA 249.A O no hydrogen 2.777 N/A LYS 89.A N LYS 86.A O no hydrogen 3.344 N/A LYS 89.A NZ TYR 106.A O no hydrogen 3.442 N/A LYS 89.A NZ ASP 107.A O no hydrogen 2.971 N/A THR 90.A N ASN 85.A O no hydrogen 3.119 N/A THR 90.A OG1 GLU 88.A OE2 no hydrogen 2.691 N/A ILE 91.A N GLU 104.A O no hydrogen 2.923 N/A THR 92.A N LYS 83.A O no hydrogen 2.800 N/A THR 92.A OG1 ASN 103.A OD1 no hydrogen 2.757 N/A ILE 93.A N TYR 102.A O no hydrogen 2.844 N/A LYS 94.A N GLU 80.A O no hydrogen 2.757 N/A ASN 95.A N GLU 100.A O no hydrogen 2.836 N/A VAL 96.A N LEU 78.A O no hydrogen 2.835 N/A THR 97.A N ASN 95.A OD1 no hydrogen 3.039 N/A THR 98.A N ASN 95.A OD1 no hydrogen 3.266 N/A THR 98.A OG1 GLU 100.A OE2 no hydrogen 2.577 N/A ASN 99.A N ASN 95.A O no hydrogen 2.809 N/A GLU 100.A N THR 98.A OG1 no hydrogen 3.197 N/A TYR 102.A N ILE 93.A O no hydrogen 3.006 N/A GLU 104.A N ILE 91.A O no hydrogen 2.808 N/A TYR 106.A N LYS 89.A O no hydrogen 2.961 N/A ASP 107.A N LYS 5.A O no hydrogen 2.900 N/A VAL 108.A N LYS 5.A O no hydrogen 3.223 N/A LEU 109.A N HIS 271.A O no hydrogen 2.869 N/A ILE 110.A N VAL 7.A O no hydrogen 2.742 N/A LEU 111.A N TYR 273.A O no hydrogen 2.805 N/A SER 112.A N VAL 9.A O no hydrogen 2.770 N/A LYS 116.A N GLN 240.A O no hydrogen 2.859 N/A ILE 118.A N GLY 238.A O no hydrogen 2.929 N/A ILE 125.A N ILE 122.A O no hydrogen 3.088 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 3.050 N/A GLU 127.A N GLY 124.A O no hydrogen 3.052 N/A ALA 128.A N ILE 125.A O no hydrogen 3.356 N/A LYS 129.A N ASN 217.A O no hydrogen 3.333 N/A PHE 132.A N LEU 233.A O no hydrogen 2.756 N/A ARG 135.A N ASP 139.A OD2 no hydrogen 2.892 N/A ARG 135.A NH1 GLU 242.A OE2 no hydrogen 2.574 N/A ARG 135.A NH2 PRO 113.A O no hydrogen 2.897 N/A ASN 136.A N ASP 139.A OD2 no hydrogen 3.104 N/A ASP 139.A N ASN 136.A OD1 no hydrogen 2.832 N/A THR 140.A N ASN 136.A O no hydrogen 3.129 N/A THR 140.A OG1 ASN 136.A O no hydrogen 2.630 N/A ASP 141.A N VAL 137.A O no hydrogen 2.855 N/A ARG 142.A N PRO 138.A O no hydrogen 3.084 N/A ARG 142.A NH1 ASP 139.A OD1 no hydrogen 3.206 N/A ILE 143.A N ASP 139.A O no hydrogen 3.088 N/A LYS 144.A N THR 140.A O no hydrogen 2.963 N/A LYS 144.A NZ ASP 148.A OD2 no hydrogen 3.321 N/A ALA 145.A N ASP 141.A O no hydrogen 2.782 N/A TYR 146.A N ARG 142.A O no hydrogen 3.019 N/A TYR 146.A OH ASP 232.A O no hydrogen 2.644 N/A ILE 147.A N ILE 143.A O no hydrogen 3.111 N/A ASP 148.A N LYS 144.A O no hydrogen 2.913 N/A GLU 149.A N ALA 145.A O no hydrogen 2.802 N/A LYS 150.A N TYR 146.A O no hydrogen 2.764 N/A LYS 151.A N ILE 147.A O no hydrogen 3.103 N/A LYS 151.A NZ ASP 148.A O no hydrogen 2.746 N/A ARG 153.A N ASP 232.A OD2 no hydrogen 2.738 N/A HIS 154.A N ASP 232.A OD2 no hydrogen 3.056 N/A HIS 154.A ND1 THR 231.A OG1 no hydrogen 2.689 N/A HIS 154.A NE2 THR 178.A OG1 no hydrogen 2.704 N/A ALA 155.A N GLU 176.A O no hydrogen 2.796 N/A THR 156.A OG1 THR 231.A OG1 no hydrogen 2.878 N/A VAL 157.A N THR 178.A O no hydrogen 2.812 N/A ILE 158.A N ILE 234.A O no hydrogen 2.889 N/A GLY 159.A N VAL 180.A O no hydrogen 2.871 N/A GLY 160.A N GLU 181.A OE1 no hydrogen 2.690 N/A VAL 165.A N GLY 161.A O no hydrogen 2.892 N/A GLU 166.A N PHE 162.A O no hydrogen 3.147 N/A GLU 168.A N VAL 165.A O no hydrogen 2.989 N/A ASN 169.A N GLU 166.A O no hydrogen 2.979 N/A ASN 169.A ND2 GLU 166.A O no hydrogen 2.755 N/A ARG 171.A N VAL 167.A O no hydrogen 3.162 N/A ARG 171.A NE HIS 201.A O no hydrogen 3.123 N/A ARG 171.A NH1 ILE 175.A O no hydrogen 2.807 N/A ARG 171.A NH2 HIS 201.A O no hydrogen 3.555 N/A GLU 172.A N GLU 168.A O no hydrogen 2.913 N/A ARG 173.A N ASN 169.A O no hydrogen 3.276 N/A ARG 173.A N LEU 170.A O no hydrogen 2.978 N/A ARG 173.A NH1 ILE 50.A O no hydrogen 3.058 N/A ARG 173.A NH1 ASP 148.A OD1 no hydrogen 3.539 N/A ARG 173.A NH2 ASP 148.A OD1 no hydrogen 2.902 N/A GLY 174.A N ARG 171.A O no hydrogen 2.786 N/A ILE 175.A N LEU 170.A O no hydrogen 3.151 N/A GLU 176.A N ARG 153.A O no hydrogen 2.922 N/A THR 178.A N ALA 155.A O no hydrogen 2.981 N/A THR 178.A OG1 HIS 154.A NE2 no hydrogen 2.704 N/A THR 178.A OG1 GLU 204.A OE1 no hydrogen 2.717 N/A LEU 179.A N GLU 204.A O no hydrogen 2.829 N/A VAL 180.A N VAL 157.A O no hydrogen 2.729 N/A GLU 181.A N VAL 206.A O no hydrogen 2.904 N/A GLN 184.A NE2 VAL 185.A O no hydrogen 2.941 N/A GLN 184.A NE2 ILE 188.A O no hydrogen 2.750 N/A VAL 185.A N HIS 196.A NE2 no hydrogen 3.028 N/A ASP 189.A N GLN 385.A OE1 no hydrogen 2.818 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.716 N/A ALA 193.A N TYR 190.A O no hydrogen 3.107 N/A HIS 196.A N ALA 192.A O no hydrogen 2.793 N/A GLU 197.A N ALA 193.A O no hydrogen 3.198 N/A HIS 198.A N TYR 194.A O no hydrogen 3.144 N/A HIS 198.A ND1 ASP 328.A OD1 no hydrogen 2.744 N/A ASN 200.A N GLU 197.A O no hydrogen 2.920 N/A HIS 201.A ND1 HIS 198.A O no hydrogen 2.815 N/A ASP 202.A N LYS 199.A O no hydrogen 3.004 N/A GLU 204.A N VAL 177.A O no hydrogen 3.008 N/A VAL 206.A N LEU 179.A O no hydrogen 2.849 N/A GLU 208.A N ALA 182.A O no hydrogen 2.924 N/A ASP 209.A N GLU 181.A O no hydrogen 3.270 N/A GLY 210.A N ASP 209.A OD1 no hydrogen 3.121 N/A ASP 212.A N ARG 222.A O no hydrogen 2.690 N/A ALA 213.A N ARG 222.A O no hydrogen 3.103 N/A LEU 214.A N PRO 123.A O no hydrogen 2.818 N/A GLU 215.A N VAL 220.A O no hydrogen 2.679 N/A GLY 218.A N GLU 215.A O no hydrogen 2.936 N/A ALA 219.A N GLU 216.A O no hydrogen 3.200 N/A VAL 220.A N GLU 215.A O no hydrogen 2.986 N/A VAL 221.A N ILE 229.A O no hydrogen 2.855 N/A ARG 222.A N ALA 213.A O no hydrogen 2.854 N/A ARG 222.A NH1 GLY 226.A O no hydrogen 2.823 N/A LEU 223.A N SER 227.A O no hydrogen 2.703 N/A LYS 224.A N GLY 210.A O no hydrogen 2.684 N/A SER 225.A N ASP 209.A OD1 no hydrogen 2.970 N/A SER 225.A OG ASP 209.A OD1 no hydrogen 3.087 N/A SER 225.A OG ASP 209.A OD2 no hydrogen 2.522 N/A GLY 226.A N LEU 223.A O no hydrogen 2.800 N/A ILE 229.A N VAL 221.A O no hydrogen 2.887 N/A THR 231.A N ALA 219.A O no hydrogen 2.996 N/A THR 231.A OG1 HIS 154.A ND1 no hydrogen 2.689 N/A THR 231.A OG1 HIS 154.A O no hydrogen 3.286 N/A THR 231.A OG1 THR 156.A OG1 no hydrogen 2.878 N/A ASP 232.A N HIS 154.A O no hydrogen 2.936 N/A LEU 233.A N ALA 130.A O no hydrogen 2.700 N/A ILE 234.A N THR 156.A O no hydrogen 2.902 N/A LEU 235.A N PHE 132.A O no hydrogen 2.813 N/A ALA 236.A N ILE 158.A O no hydrogen 2.773 N/A GLN 240.A N LYS 116.A O no hydrogen 2.884 N/A GLU 242.A N GLY 114.A O no hydrogen 2.890 N/A SER 243.A OG GLY 257.A O no hydrogen 2.535 N/A LYS 247.A N SER 243.A O no hydrogen 2.864 N/A GLY 248.A N SER 244.A O no hydrogen 2.900 N/A ALA 249.A N LEU 245.A O no hydrogen 2.998 N/A ALA 249.A N ALA 246.A O no hydrogen 2.898 N/A GLY 250.A N LYS 247.A O no hydrogen 3.047 N/A LEU 251.A N ALA 246.A O no hydrogen 2.963 N/A ALA 252.A N SER 268.A OG no hydrogen 2.961 N/A GLY 254.A N THR 258.A O no hydrogen 2.688 N/A VAL 255.A N GLU 280.A OE1 no hydrogen 2.876 N/A GLY 257.A N GLY 254.A O no hydrogen 3.309 N/A THR 258.A N VAL 255.A O no hydrogen 3.175 N/A THR 258.A OG1 VAL 255.A O no hydrogen 2.858 N/A ILE 259.A N ALA 278.A O no hydrogen 2.781 N/A LYS 260.A N ALA 252.A O no hydrogen 3.025 N/A LYS 260.A NZ GLU 280.A OE2 no hydrogen 2.728 N/A ASN 262.A N GLN 266.A O no hydrogen 2.963 N/A LYS 264.A N ASN 262.A OD1 no hydrogen 2.766 N/A PHE 265.A N ASN 262.A O no hydrogen 3.041 N/A GLN 266.A N ASN 262.A OD1 no hydrogen 3.099 N/A THR 267.A N ILE 272.A O no hydrogen 2.877 N/A THR 267.A OG1 ASP 269.A O no hydrogen 3.097 N/A THR 267.A OG1 ILE 272.A O no hydrogen 2.735 N/A ASP 269.A N THR 267.A OG1 no hydrogen 3.110 N/A HIS 271.A N ASP 269.A OD2 no hydrogen 2.942 N/A ILE 272.A N ASP 269.A O no hydrogen 3.004 N/A TYR 273.A N LEU 109.A O no hydrogen 2.738 N/A ALA 274.A N PHE 265.A O no hydrogen 2.947 N/A ILE 275.A N LEU 111.A O no hydrogen 3.040 N/A GLY 276.A N GLN 300.A OE1 no hydrogen 2.696 N/A ILE 279.A N GLY 276.A O no hydrogen 3.157 N/A GLU 280.A N ILE 259.A O no hydrogen 3.115 N/A VAL 281.A N THR 290.A O no hydrogen 3.029 N/A LYS 282.A NZ GLU 287.A O no hydrogen 3.423 N/A ASP 283.A N THR 288.A O no hydrogen 2.935 N/A PHE 284.A N THR 318.A O no hydrogen 3.000 N/A THR 286.A N ASP 283.A OD1 no hydrogen 3.010 N/A THR 286.A N ASP 283.A OD2 no hydrogen 3.306 N/A THR 286.A OG1 ASP 283.A OD2 no hydrogen 2.447 N/A THR 286.A OG1 THR 288.A OG1 no hydrogen 2.637 N/A GLU 287.A N ASP 283.A O no hydrogen 2.793 N/A THR 288.A N ASP 283.A OD2 no hydrogen 2.929 N/A THR 288.A OG1 THR 286.A OG1 no hydrogen 2.637 N/A GLU 289.A N GLU 289.A OE1 no hydrogen 2.681 N/A THR 290.A N VAL 281.A O no hydrogen 2.818 N/A ALA 297.A N LEU 293.A O no hydrogen 3.214 N/A ASN 298.A N ALA 294.A O no hydrogen 2.916 N/A ASN 298.A ND2 ALA 294.A O no hydrogen 3.005 N/A ARG 299.A N TRP 295.A O no hydrogen 2.774 N/A GLN 300.A N PRO 296.A O no hydrogen 2.728 N/A GLN 300.A NE2 TYR 315.A OH no hydrogen 3.319 N/A GLY 301.A N ALA 297.A O no hydrogen 3.017 N/A ARG 302.A N ASN 298.A O no hydrogen 3.084 N/A ARG 302.A NH1 ARG 302.A O no hydrogen 2.986 N/A ARG 302.A NH1 ASP 305.A OD2 no hydrogen 2.654 N/A ALA 304.A N GLY 301.A O no hydrogen 3.320 N/A ILE 307.A N LEU 303.A O no hydrogen 2.775 N/A HIS 308.A N ALA 304.A O no hydrogen 3.355 N/A GLY 309.A N ILE 306.A O no hydrogen 2.902 N/A HIS 310.A N ASP 305.A O no hydrogen 2.847 N/A TYR 315.A OH THR 318.A OG1 no hydrogen 2.667 N/A LYS 316.A NZ LEU 314.A O no hydrogen 3.531 N/A THR 318.A N LYS 282.A O no hydrogen 2.854 N/A THR 318.A OG1 TYR 315.A OH no hydrogen 2.667 N/A THR 321.A OG1 THR 334.A OG1 no hydrogen 2.836 N/A SER 322.A N THR 333.A O no hydrogen 2.744 N/A ALA 324.A N VAL 331.A O no hydrogen 2.765 N/A LYS 325.A NZ GLU 168.A OE1 no hydrogen 2.962 N/A LYS 325.A NZ PHE 327.A O no hydrogen 2.922 N/A VAL 326.A N LEU 329.A O no hydrogen 2.780 N/A PHE 327.A N GLU 168.A OE1 no hydrogen 2.618 N/A LEU 329.A N VAL 326.A O no hydrogen 2.892 N/A THR 330.A N GLY 388.A O no hydrogen 2.838 N/A VAL 331.A N ALA 324.A O no hydrogen 2.811 N/A ALA 332.A N THR 386.A O no hydrogen 2.824 N/A THR 333.A N SER 322.A O no hydrogen 2.904 N/A THR 333.A OG1 PRO 187.A O no hydrogen 3.567 N/A THR 334.A N ALA 384.A O no hydrogen 3.053 N/A THR 334.A OG1 THR 321.A OG1 no hydrogen 2.836 N/A GLY 335.A N LEU 319.A O no hydrogen 3.025 N/A LEU 336.A N TYR 382.A O no hydrogen 2.744 N/A ASN 337.A ND2 PRO 187.A O no hydrogen 2.998 N/A GLU 338.A N ASP 189.A OD2 no hydrogen 2.873 N/A LYS 339.A NZ GLN 184.A OE1 no hydrogen 2.953 N/A LYS 339.A NZ PRO 186.A O no hydrogen 2.769 N/A LYS 339.A NZ ILE 188.A O no hydrogen 2.797 N/A ILE 340.A N ASN 337.A OD1 no hydrogen 2.795 N/A LEU 341.A N ASN 337.A O no hydrogen 3.150 N/A LYS 342.A N GLU 338.A O no hydrogen 2.912 N/A ARG 343.A N LYS 339.A O no hydrogen 3.193 N/A LEU 344.A N ILE 340.A O no hydrogen 2.996 N/A ASN 345.A N LYS 342.A O no hydrogen 3.055 N/A ILE 346.A N LEU 341.A O no hydrogen 3.006 N/A TYR 348.A OH GLU 338.A OE1 no hydrogen 2.679 N/A GLU 349.A N PHE 374.A O no hydrogen 2.833 N/A VAL 351.A N LEU 372.A O no hydrogen 3.007 N/A HIS 352.A N ASP 523.A OD1 no hydrogen 2.719 N/A HIS 352.A ND1 ASP 523.A OD2 no hydrogen 2.686 N/A HIS 352.A NE2 GLU 191.A OE2 no hydrogen 2.644 N/A VAL 353.A N ILE 370.A O no hydrogen 2.852 N/A ALA 355.A N VAL 368.A O no hydrogen 2.908 N/A SER 357.A N THR 366.A O no hydrogen 2.722 N/A SER 357.A OG THR 366.A O no hydrogen 3.293 N/A HIS 358.A NE2 TYR 362.A O no hydrogen 3.164 N/A HIS 358.A NE2 PRO 363.A O no hydrogen 2.787 N/A ALA 359.A N SER 423.A O no hydrogen 2.892 N/A TYR 361.A OH TYR 418.A OH no hydrogen 2.533 N/A TYR 362.A N ALA 359.A O no hydrogen 3.069 N/A THR 366.A N SER 357.A OG no hydrogen 3.013 N/A VAL 368.A N ALA 355.A O no hydrogen 2.769 N/A LEU 369.A N LEU 387.A O no hydrogen 2.879 N/A ILE 370.A N VAL 353.A O no hydrogen 2.794 N/A LYS 371.A N GLN 385.A O no hydrogen 2.715 N/A LYS 371.A NZ ASP 189.A OD2 no hydrogen 2.675 N/A LYS 371.A NZ GLU 191.A OE2 no hydrogen 2.802 N/A LYS 371.A NZ GLU 338.A OE2 no hydrogen 2.680 N/A LEU 372.A N VAL 351.A O no hydrogen 2.999 N/A ILE 373.A N GLY 383.A O no hydrogen 2.916 N/A PHE 374.A N GLU 349.A O no hydrogen 2.995 N/A ASN 375.A N LYS 380.A O no hydrogen 2.802 N/A ASN 375.A ND2 TYR 382.A OH no hydrogen 2.856 N/A ASP 377.A N ASN 375.A OD1 no hydrogen 2.835 N/A SER 378.A N ASN 375.A OD1 no hydrogen 2.919 N/A GLY 379.A N ASN 375.A O no hydrogen 2.824 N/A LYS 380.A N SER 378.A OG no hydrogen 3.137 N/A LYS 380.A NZ VAL 285.A O no hydrogen 2.793 N/A TYR 382.A N ILE 373.A O no hydrogen 2.874 N/A GLY 383.A N ILE 373.A O no hydrogen 3.350 N/A ALA 384.A N THR 334.A O no hydrogen 3.089 N/A GLN 385.A N LYS 371.A O no hydrogen 2.875 N/A GLN 385.A NE2 ASP 189.A OD2 no hydrogen 3.017 N/A THR 386.A N ALA 332.A O no hydrogen 2.944 N/A LEU 387.A N LEU 369.A O no hydrogen 3.118 N/A GLY 388.A N THR 330.A O no hydrogen 3.275 N/A ARG 389.A NE ASP 328.A OD2 no hydrogen 2.721 N/A ARG 389.A NH2 ASP 328.A OD2 no hydrogen 3.244 N/A LYS 394.A NZ TYR 422.A O no hydrogen 2.680 N/A ARG 395.A NE ASP 427.A OD1 no hydrogen 3.138 N/A ARG 395.A NE ASP 427.A OD2 no hydrogen 3.011 N/A ARG 395.A NH1 SER 357.A O no hydrogen 3.507 N/A ARG 395.A NH1 GLY 391.A O no hydrogen 2.936 N/A ARG 395.A NH2 SER 357.A O no hydrogen 2.806 N/A ARG 395.A NH2 ASP 427.A OD1 no hydrogen 2.983 N/A VAL 397.A N LYS 394.A O no hydrogen 3.061 N/A ILE 398.A N ARG 395.A O no hydrogen 3.069 N/A THR 400.A N ASP 396.A O no hydrogen 2.893 N/A THR 400.A OG1 ASP 396.A O no hydrogen 2.705 N/A ALA 401.A N VAL 397.A O no hydrogen 2.902 N/A ILE 402.A N ILE 398.A O no hydrogen 2.942 N/A LYS 403.A N ALA 399.A O no hydrogen 3.135 N/A ALA 404.A N THR 400.A O no hydrogen 2.844 N/A ASN 405.A N ILE 402.A O no hydrogen 2.855 N/A LEU 406.A N ALA 401.A O no hydrogen 2.879 N/A THR 407.A N ASP 410.A OD2 no hydrogen 2.932 N/A THR 407.A OG1 ASP 410.A OD2 no hydrogen 3.482 N/A VAL 408.A N GLY 379.A O no hydrogen 2.876 N/A LEU 409.A N THR 407.A OG1 no hydrogen 3.296 N/A ASP 410.A N THR 407.A O no hydrogen 2.933 N/A LEU 411.A N VAL 408.A O no hydrogen 3.310 N/A ASP 413.A N ASP 410.A O no hydrogen 2.820 N/A LEU 414.A N LEU 411.A O no hydrogen 3.298 N/A TYR 418.A OH TYR 361.A OH no hydrogen 2.533 N/A TYR 422.A N ALA 419.A O no hydrogen 2.918 N/A SER 423.A N ALA 419.A O no hydrogen 3.359 N/A SER 423.A OG SER 424.A O no hydrogen 3.393 N/A SER 423.A OG ASP 427.A OD1 no hydrogen 2.500 N/A ASP 427.A N ASN 430.A OD1 no hydrogen 2.945 N/A VAL 429.A N ASP 427.A OD2 no hydrogen 2.927 N/A ASN 430.A ND2 LEU 411.A O no hydrogen 2.851 N/A ASN 430.A ND2 LEU 414.A O no hydrogen 3.085 N/A GLY 432.A N VAL 429.A O no hydrogen 3.020 N/A TYR 433.A N ASN 430.A O no hydrogen 2.748 N/A ALA 435.A N VAL 431.A O no hydrogen 2.998 N/A SER 436.A N GLY 432.A O no hydrogen 2.899 N/A SER 436.A OG GLY 432.A O no hydrogen 2.811 N/A ASN 437.A N TYR 433.A O no hydrogen 2.988 N/A ILE 438.A N ALA 435.A O no hydrogen 3.187 N/A VAL 439.A N ALA 435.A O no hydrogen 3.011 N/A ASP 440.A N SER 436.A O no hydrogen 2.726 N/A GLY 441.A N ILE 438.A O no hydrogen 3.032 N/A PHE 442.A N ASN 437.A O no hydrogen 2.750 N/A VAL 443.A N ASN 437.A O no hydrogen 3.250 N/A THR 445.A N ASP 444.A OD1 no hydrogen 3.215 N/A VAL 446.A N ASN 521.A O no hydrogen 2.953 N/A GLN 447.A N GLU 450.A OE1 no hydrogen 2.784 N/A GLN 447.A NE2 ASP 523.A OD2 no hydrogen 2.801 N/A GLU 450.A N GLN 447.A O no hydrogen 3.004 N/A ILE 451.A N GLN 447.A O no hydrogen 3.297 N/A ARG 453.A NH2 HIS 449.A O no hydrogen 3.341 N/A ILE 454.A N GLU 450.A O no hydrogen 3.145 N/A VAL 455.A N ILE 451.A O no hydrogen 2.937 N/A GLU 456.A N ASP 452.A O no hydrogen 2.911 N/A ASN 457.A N ARG 453.A O no hydrogen 2.935 N/A GLY 458.A N VAL 455.A O no hydrogen 3.169 N/A GLY 459.A N ILE 454.A O no hydrogen 2.834 N/A TYR 460.A N ASP 497.A O no hydrogen 3.081 N/A ILE 462.A N TYR 499.A O no hydrogen 2.719 N/A ASP 463.A N ILE 478.A O no hydrogen 2.695 N/A VAL 464.A N THR 501.A O no hydrogen 2.821 N/A ARG 465.A N ASP 463.A OD2 no hydrogen 3.100 N/A ARG 465.A NE ASP 463.A OD1 no hydrogen 3.202 N/A ARG 465.A NE ASP 463.A OD2 no hydrogen 2.925 N/A ARG 465.A NH1 GLY 473.A O no hydrogen 3.316 N/A ARG 465.A NH1 GLN 503.A OE1 no hydrogen 2.904 N/A ARG 465.A NH2 ASP 463.A OD1 no hydrogen 2.639 N/A ARG 465.A NH2 GLY 473.A O no hydrogen 2.837 N/A GLU 466.A N GLU 469.A OE2 no hydrogen 2.881 N/A GLU 469.A N GLU 466.A O no hydrogen 2.917 N/A LEU 470.A N PRO 467.A O no hydrogen 3.345 N/A LYS 471.A N ASN 468.A O no hydrogen 3.386 N/A GLN 472.A N GLU 469.A O no hydrogen 3.199 N/A GLY 473.A N LEU 470.A O no hydrogen 2.910 N/A SER 477.A N ILE 474.A O no hydrogen 3.271 N/A SER 477.A OG ILE 474.A O no hydrogen 2.750 N/A ILE 478.A N LEU 461.A O no hydrogen 2.846 N/A ASN 479.A ND2 ASP 463.A O no hydrogen 2.693 N/A ASN 479.A ND2 ARG 465.A O no hydrogen 2.910 N/A ILE 480.A N ASP 463.A O no hydrogen 3.112 N/A LEU 482.A N VAL 464.A O no hydrogen 2.846 N/A GLU 484.A N PRO 481.A O no hydrogen 2.878 N/A LEU 485.A N PRO 481.A O no hydrogen 3.139 N/A LEU 485.A N LEU 482.A O no hydrogen 3.222 N/A ASP 487.A N GLU 484.A O no hydrogen 2.808 N/A ARG 488.A N LEU 485.A O no hydrogen 2.984 N/A ARG 488.A NE GLU 491.A OE2 no hydrogen 2.830 N/A ARG 488.A NH1 GLU 484.A OE1 no hydrogen 2.741 N/A ARG 488.A NH2 GLU 491.A OE1 no hydrogen 2.755 N/A ARG 488.A NH2 GLU 491.A OE2 no hydrogen 3.402 N/A GLU 491.A N ARG 488.A O no hydrogen 2.921 N/A VAL 492.A N LEU 489.A O no hydrogen 3.000 N/A ILE 498.A N LYS 518.A O no hydrogen 3.204 N/A TYR 499.A N TYR 460.A O no hydrogen 2.820 N/A ILE 500.A N LYS 520.A O no hydrogen 2.807 N/A THR 501.A N ILE 462.A O no hydrogen 2.976 N/A THR 501.A OG1 CYS 502.A O no hydrogen 3.132 N/A ARG 506.A NH1 GLU 469.A OE2 no hydrogen 2.804 N/A ARG 506.A NH2 GLU 469.A OE1 no hydrogen 3.006 N/A ARG 506.A NH2 GLU 469.A OE2 no hydrogen 3.569 N/A TYR 508.A N GLY 505.A O no hydrogen 2.824 N/A ALA 510.A N ARG 506.A O no hydrogen 3.019 N/A ALA 511.A N GLY 507.A O no hydrogen 2.816 N/A ARG 512.A N TYR 508.A O no hydrogen 2.921 N/A ARG 512.A NH1 PHE 442.A O no hydrogen 2.769 N/A ARG 512.A NH2 GLU 514.A OE2 no hydrogen 2.769 N/A TYR 517.A N LEU 513.A O no hydrogen 2.864 N/A LYS 518.A NZ ASP 497.A OD2 no hydrogen 2.736 N/A LYS 520.A N ILE 498.A O no hydrogen 3.010 N/A ASN 521.A N ASP 444.A O no hydrogen 2.967 N/A ASN 521.A ND2 GLY 505.A O no hydrogen 3.002 N/A VAL 522.A N ILE 500.A O no hydrogen 2.656 N/A ASP 523.A N VAL 446.A O no hydrogen 2.918 N/A GLY 525.A N VAL 522.A O no hydrogen 2.897 N/A PHE 526.A N CYS 502.A O no hydrogen 2.762 N/A LYS 527.A N GLN 503.A O no hydrogen 2.880 N/A LYS 527.A NZ GLN 354.A OE1 no hydrogen 3.328 N/A LEU 528.A N GLY 524.A O no hydrogen 3.341 N/A TYR 529.A N GLY 525.A O no hydrogen 3.234 N/A TYR 529.A OH ASP 452.A OD1 no hydrogen 3.070 N/A TYR 529.A OH ASP 452.A OD2 no hydrogen 2.611 N/A GLY 530.A N PHE 526.A O no hydrogen 2.770 N/A THR 531.A N LYS 527.A O no hydrogen 3.289 N/A THR 531.A N LEU 528.A O no hydrogen 3.113 N/A THR 531.A OG1 LYS 527.A O no hydrogen 2.721 N/A VAL 532.A N LEU 528.A O no hydrogen 3.234 N/A LEU 533.A N TYR 529.A O no hydrogen 2.836 N/A GLU 535.A N GLU 535.A OE1 no hydrogen 2.695 N/A ARG 536.A N LEU 533.A O no hydrogen 2.987 N/A ARG 536.A NH1 ASP 452.A OD2 no hydrogen 3.033 N/A ILE 537.A N PRO 534.A O no hydrogen 3.176 N/A