Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u9r_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N HIS 1.A O no hydrogen 3.076 N/A LEU 5.A N SER 315.A O no hydrogen 2.860 N/A THR 7.A N TYR 285.A OH no hydrogen 3.078 N/A THR 7.A OG1 GLU 306.A OE1 no hydrogen 3.414 N/A THR 7.A OG1 GLU 306.A OE2 no hydrogen 2.557 N/A GLN 8.A N GLU 306.A OE1 no hydrogen 2.898 N/A ILE 9.A N THR 7.A OG1 no hydrogen 3.020 N/A SER 13.A N ASN 10.A O no hydrogen 2.893 N/A SER 13.A OG ASN 10.A O no hydrogen 3.072 N/A PHE 16.A N SER 13.A OG no hydrogen 2.979 N/A ALA 17.A N SER 13.A O no hydrogen 3.075 N/A ALA 18.A N ALA 14.A O no hydrogen 2.988 N/A ASN 19.A N GLU 15.A O no hydrogen 2.946 N/A ASN 19.A ND2 GLU 15.A OE1 no hydrogen 3.182 N/A ASN 19.A ND2 GLY 292.A O no hydrogen 2.971 N/A ALA 20.A N PHE 16.A O no hydrogen 2.837 N/A ALA 21.A N ALA 17.A O no hydrogen 2.903 N/A THR 22.A N ALA 18.A O no hydrogen 3.165 N/A THR 22.A OG1 ALA 18.A O no hydrogen 3.364 N/A MET 23.A N ASN 19.A O no hydrogen 2.961 N/A LEU 24.A N ALA 20.A O no hydrogen 2.756 N/A GLU 25.A N ALA 21.A O no hydrogen 3.057 N/A VAL 27.A N MET 23.A O no hydrogen 2.898 N/A ASN 28.A N LEU 24.A O no hydrogen 2.745 N/A ALA 29.A N GLU 25.A O no hydrogen 3.181 N/A LEU 30.A N GLN 26.A O no hydrogen 2.950 N/A ARG 31.A N VAL 27.A O no hydrogen 2.985 N/A ARG 31.A NH2 ASP 506.A OD1 no hydrogen 3.088 N/A THR 32.A N ASN 28.A O no hydrogen 3.093 N/A THR 32.A OG1 ASN 28.A O no hydrogen 3.142 N/A LEU 33.A N ALA 29.A O no hydrogen 2.969 N/A LEU 34.A N LEU 30.A O no hydrogen 2.857 N/A GLY 35.A N ARG 31.A O no hydrogen 2.956 N/A ARG 36.A N THR 32.A O no hydrogen 3.082 N/A ILE 37.A N LEU 33.A O no hydrogen 2.894 N/A HIS 38.A N LEU 34.A O no hydrogen 2.961 N/A GLU 39.A N ARG 36.A O no hydrogen 3.026 N/A GLY 40.A N ILE 37.A O no hydrogen 2.961 N/A GLY 41.A N THR 112.A OG1 no hydrogen 2.986 N/A GLY 42.A N GLU 39.A O no hydrogen 2.885 N/A GLN 46.A N GLY 42.A O no hydrogen 2.885 N/A GLN 46.A NE2 GLU 39.A OE2 no hydrogen 2.821 N/A ALA 47.A N SER 43.A O no hydrogen 2.944 N/A ARG 48.A N ALA 44.A O no hydrogen 3.011 N/A HIS 49.A N ALA 45.A O no hydrogen 3.071 N/A HIS 49.A NE2 LEU 55.A O no hydrogen 2.807 N/A SER 50.A N GLN 46.A O no hydrogen 3.031 N/A SER 50.A OG GLN 46.A O no hydrogen 3.184 N/A ALA 51.A N ALA 47.A O no hydrogen 2.949 N/A ARG 52.A N HIS 49.A O no hydrogen 3.019 N/A GLY 53.A N SER 50.A O no hydrogen 2.920 N/A LYS 54.A N HIS 49.A O no hydrogen 3.439 N/A LYS 54.A NZ ASP 145.A OD1 no hydrogen 2.906 N/A LYS 54.A NZ ASP 145.A OD2 no hydrogen 3.421 N/A LEU 55.A N ASP 253.A OD2 no hydrogen 2.765 N/A ARG 58.A NH1 GLU 73.A OE1 no hydrogen 3.444 N/A ARG 58.A NH1 GLU 73.A OE2 no hydrogen 2.899 N/A ARG 58.A NH2 GLU 73.A OE1 no hydrogen 2.838 N/A ARG 60.A N LEU 56.A O no hydrogen 2.909 N/A ARG 60.A NE ASP 253.A OD2 no hydrogen 2.987 N/A ARG 60.A NH1 ASP 145.A OD2 no hydrogen 2.823 N/A ARG 60.A NH2 ASP 145.A OD2 no hydrogen 3.463 N/A ARG 60.A NH2 ASP 253.A OD2 no hydrogen 2.882 N/A ILE 61.A N VAL 57.A O no hydrogen 2.970 N/A ASN 62.A N ARG 58.A O no hydrogen 2.993 N/A ARG 63.A N GLU 59.A O no hydrogen 3.006 N/A ARG 63.A NE GLU 59.A OE2 no hydrogen 2.710 N/A ARG 63.A NH1 GLU 59.A OE2 no hydrogen 3.503 N/A ARG 63.A NH2 ASP 254.A OD2 no hydrogen 3.284 N/A LEU 64.A N ARG 60.A O no hydrogen 2.936 N/A LEU 65.A N ILE 61.A O no hydrogen 3.024 N/A ASP 66.A N ARG 98.A O no hydrogen 2.843 N/A SER 69.A N ASP 66.A O no hydrogen 2.885 N/A SER 69.A OG PRO 70.A O no hydrogen 2.746 N/A LEU 72.A N ILE 96.A O no hydrogen 2.935 N/A LEU 74.A N ALA 94.A O no hydrogen 2.819 N/A SER 75.A N ASP 502.A O no hydrogen 2.908 N/A ALA 78.A N SER 75.A O no hydrogen 3.030 N/A ALA 79.A N ALA 497.A O no hydrogen 2.896 N/A HIS 80.A N LEU 77.A O no hydrogen 2.983 N/A VAL 82.A N ALA 79.A O no hydrogen 3.196 N/A ALA 90.A N VAL 87.A O no hydrogen 2.888 N/A GLY 91.A N ALA 88.A O no hydrogen 2.869 N/A ILE 92.A N ALA 89.A O no hydrogen 3.260 N/A VAL 93.A N GLY 108.A O no hydrogen 2.877 N/A GLY 95.A N ILE 106.A O no hydrogen 2.991 N/A ILE 96.A N LEU 72.A O no hydrogen 2.990 N/A GLY 97.A N CYS 104.A O no hydrogen 3.195 N/A ARG 98.A N SER 69.A OG no hydrogen 2.950 N/A ARG 98.A NH1 GLY 101.A O no hydrogen 3.076 N/A VAL 99.A N VAL 102.A O no hydrogen 2.896 N/A GLU 100.A N ASP 66.A OD1 no hydrogen 2.747 N/A GLY 101.A N ASP 66.A OD2 no hydrogen 2.906 N/A VAL 102.A N VAL 99.A O no hydrogen 2.932 N/A CYS 104.A N GLY 97.A O no hydrogen 2.969 N/A CYS 104.A SG VAL 102.A O no hydrogen 3.636 N/A MET 105.A N PRO 139.A O no hydrogen 2.860 N/A ILE 106.A N GLY 95.A O no hydrogen 2.854 N/A VAL 107.A N ILE 141.A O no hydrogen 2.959 N/A GLY 108.A N VAL 93.A O no hydrogen 2.851 N/A ASN 109.A N LEU 143.A O no hydrogen 3.022 N/A ASN 109.A ND2 TYR 118.A OH no hydrogen 3.058 N/A ASP 110.A N GLY 91.A O no hydrogen 2.785 N/A THR 112.A N ASP 110.A OD1 no hydrogen 3.004 N/A THR 112.A OG1 ASP 110.A OD1 no hydrogen 2.705 N/A THR 112.A OG1 ASP 110.A OD2 no hydrogen 3.451 N/A VAL 113.A N ASP 110.A O no hydrogen 3.026 N/A GLY 116.A N VAL 113.A O no hydrogen 2.820 N/A THR 117.A N LYS 114.A O no hydrogen 3.039 N/A THR 117.A OG1 LYS 114.A O no hydrogen 2.888 N/A TYR 118.A N GLY 148.A O no hydrogen 2.788 N/A TYR 118.A OH HIS 126.A ND1 no hydrogen 2.736 N/A TYR 119.A N THR 122.A OG1 no hydrogen 2.915 N/A TYR 119.A OH GLU 85.A OE2 no hydrogen 3.244 N/A LEU 121.A N TYR 83.A OH no hydrogen 3.012 N/A THR 122.A OG1 ALA 90.A O no hydrogen 2.671 N/A THR 122.A OG1 TYR 119.A O no hydrogen 3.396 N/A VAL 123.A N TYR 119.A O no hydrogen 3.169 N/A LYS 124.A N PRO 120.A O no hydrogen 3.113 N/A LYS 124.A NZ ARG 498.A O no hydrogen 2.858 N/A LYS 125.A N LEU 121.A O no hydrogen 2.890 N/A LYS 125.A NZ LEU 74.A O no hydrogen 3.416 N/A LYS 125.A NZ SER 75.A O no hydrogen 2.860 N/A LYS 125.A NZ ALA 89.A O no hydrogen 2.975 N/A LYS 125.A NZ ILE 92.A O no hydrogen 2.742 N/A HIS 126.A N THR 122.A O no hydrogen 2.949 N/A HIS 126.A ND1 TYR 118.A OH no hydrogen 2.736 N/A LEU 127.A N VAL 123.A O no hydrogen 2.879 N/A ARG 128.A N LYS 124.A O no hydrogen 2.861 N/A ARG 128.A NE ASP 502.A OD1 no hydrogen 2.893 N/A ARG 128.A NH2 ARG 433.A O no hydrogen 2.872 N/A ARG 128.A NH2 ASP 502.A OD1 no hydrogen 3.531 N/A ARG 128.A NH2 ASP 502.A OD2 no hydrogen 2.921 N/A ALA 129.A N LYS 125.A O no hydrogen 3.026 N/A GLN 130.A N HIS 126.A O no hydrogen 3.117 N/A ALA 131.A N LEU 127.A O no hydrogen 2.887 N/A ILE 132.A N ARG 128.A O no hydrogen 2.992 N/A ALA 133.A N ALA 129.A O no hydrogen 2.980 N/A LEU 134.A N GLN 130.A O no hydrogen 2.879 N/A GLU 135.A N ALA 131.A O no hydrogen 2.861 N/A ASN 136.A N ILE 132.A O no hydrogen 2.989 N/A ASN 136.A ND2 ILE 132.A O no hydrogen 2.847 N/A ARG 137.A N LEU 134.A O no hydrogen 3.463 N/A ARG 137.A NH1 ARG 270.A O no hydrogen 2.905 N/A ARG 137.A NH1 ASN 523.A O no hydrogen 3.042 N/A LEU 138.A N ALA 133.A O no hydrogen 2.904 N/A CYS 140.A N PRO 180.A O no hydrogen 2.889 N/A CYS 140.A SG LEU 138.A O no hydrogen 3.602 N/A CYS 140.A SG TYR 142.A OH no hydrogen 3.542 N/A ILE 141.A N MET 105.A O no hydrogen 2.893 N/A TYR 142.A N ILE 182.A O no hydrogen 2.831 N/A TYR 142.A OH GLN 181.A OE1 no hydrogen 2.611 N/A LEU 143.A N VAL 107.A O no hydrogen 2.809 N/A VAL 144.A N VAL 184.A O no hydrogen 2.908 N/A ASP 145.A N ASN 109.A OD1 no hydrogen 3.034 N/A SER 146.A N SER 188.A O no hydrogen 3.051 N/A SER 146.A OG GLY 116.A O no hydrogen 2.741 N/A GLY 147.A N GLY 115.A O no hydrogen 2.874 N/A ASN 150.A N TYR 118.A O no hydrogen 2.897 N/A ARG 153.A N ASN 150.A O no hydrogen 3.004 N/A ARG 153.A NH1 ASN 150.A OD1 no hydrogen 2.877 N/A GLN 154.A N LEU 151.A O no hydrogen 2.918 N/A GLU 156.A N ARG 153.A O no hydrogen 2.802 N/A VAL 157.A N GLN 154.A O no hydrogen 3.079 N/A PHE 158.A N GLN 154.A O no hydrogen 2.945 N/A ASP 160.A N HIS 163.A ND1 no hydrogen 2.897 N/A HIS 163.A N ASP 160.A O no hydrogen 3.089 N/A PHE 164.A N VAL 157.A O no hydrogen 2.811 N/A ARG 166.A N HIS 163.A O no hydrogen 2.944 N/A ILE 167.A N PHE 164.A O no hydrogen 3.046 N/A PHE 168.A N GLY 165.A O no hydrogen 3.217 N/A PHE 169.A N GLY 165.A O no hydrogen 3.386 N/A ASN 170.A N ARG 166.A O no hydrogen 2.853 N/A GLN 171.A N ILE 167.A O no hydrogen 2.965 N/A GLN 171.A NE2 TYR 195.A O no hydrogen 3.655 N/A GLN 171.A NE2 VAL 196.A O no hydrogen 3.047 N/A ALA 172.A N PHE 168.A O no hydrogen 2.975 N/A ASN 173.A N PHE 169.A O no hydrogen 3.011 N/A MET 174.A N ASN 170.A O no hydrogen 2.912 N/A SER 175.A N GLN 171.A O no hydrogen 2.909 N/A SER 175.A OG ASP 201.A OD1 no hydrogen 2.692 N/A ALA 176.A N ALA 172.A O no hydrogen 2.975 N/A ARG 177.A N ASN 173.A O no hydrogen 3.136 N/A ARG 177.A N MET 174.A O no hydrogen 2.983 N/A GLY 178.A N SER 175.A O no hydrogen 2.965 N/A ILE 179.A N MET 174.A O no hydrogen 2.911 N/A GLN 181.A N ASP 201.A OD2 no hydrogen 3.021 N/A GLN 181.A NE2 ILE 179.A O no hydrogen 3.046 N/A ILE 182.A N CYS 140.A O no hydrogen 2.845 N/A ALA 183.A N GLU 202.A O no hydrogen 2.882 N/A VAL 184.A N TYR 142.A O no hydrogen 2.777 N/A VAL 185.A N VAL 204.A O no hydrogen 2.756 N/A MET 186.A N VAL 144.A O no hydrogen 2.798 N/A CYS 189.A SG GLY 193.A O no hydrogen 3.031 N/A ALA 191.A N PHE 213.A O no hydrogen 2.870 N/A GLY 193.A N THR 190.A O no hydrogen 2.910 N/A ALA 194.A N ALA 191.A O no hydrogen 2.845 N/A TYR 195.A N GLY 192.A O no hydrogen 2.943 N/A VAL 196.A N GLY 193.A O no hydrogen 2.998 N/A ALA 198.A N ALA 194.A O no hydrogen 3.065 N/A MET 199.A N TYR 195.A O no hydrogen 2.856 N/A SER 200.A N PRO 197.A O no hydrogen 3.149 N/A SER 200.A OG VAL 196.A O no hydrogen 2.775 N/A ASP 201.A N GLN 181.A O no hydrogen 2.771 N/A GLU 202.A N GLN 181.A O no hydrogen 3.365 N/A THR 203.A N ASP 247.A OD2 no hydrogen 2.776 N/A THR 203.A OG1 PRO 197.A O no hydrogen 2.822 N/A VAL 204.A N ALA 183.A O no hydrogen 2.820 N/A MET 205.A N HIS 248.A O no hydrogen 2.893 N/A VAL 206.A N VAL 185.A O no hydrogen 3.147 N/A ARG 207.A N ALA 250.A O no hydrogen 2.871 N/A ARG 207.A NH1 GLU 251.A OE1 no hydrogen 2.918 N/A ALA 210.A N VAL 206.A O no hydrogen 2.909 N/A THR 211.A N GLY 187.A O no hydrogen 3.106 N/A ILE 212.A N GLY 234.A O no hydrogen 2.835 N/A PHE 213.A N CYS 189.A O no hydrogen 3.185 N/A VAL 220.A N GLY 216.A O no hydrogen 2.995 N/A LYS 221.A N PRO 217.A O no hydrogen 2.939 N/A ALA 222.A N PRO 218.A O no hydrogen 2.925 N/A ALA 223.A N LEU 219.A O no hydrogen 2.925 N/A THR 224.A N VAL 220.A O no hydrogen 2.925 N/A THR 224.A OG1 VAL 220.A O no hydrogen 2.827 N/A GLY 225.A N LYS 221.A O no hydrogen 2.652 N/A GLU 226.A N THR 224.A OG1 no hydrogen 3.044 N/A SER 229.A N GLU 232.A OE1 no hydrogen 3.114 N/A GLU 232.A N SER 229.A OG no hydrogen 3.098 N/A LEU 233.A N SER 229.A O no hydrogen 2.950 N/A GLY 234.A N ALA 230.A O no hydrogen 2.922 N/A GLY 235.A N GLU 231.A O no hydrogen 2.997 N/A HIS 239.A N GLY 235.A O no hydrogen 3.117 N/A HIS 239.A ND1 SER 243.A OG no hydrogen 2.701 N/A HIS 239.A NE2 ILE 212.A O no hydrogen 2.780 N/A CYS 240.A N ALA 236.A O no hydrogen 2.828 N/A LYS 241.A N ASP 237.A O no hydrogen 3.033 N/A LYS 241.A NZ ASP 237.A OD2 no hydrogen 2.929 N/A VAL 242.A N VAL 238.A O no hydrogen 2.994 N/A SER 243.A N VAL 238.A O no hydrogen 2.961 N/A SER 243.A OG HIS 239.A ND1 no hydrogen 2.701 N/A SER 243.A OG HIS 239.A O no hydrogen 3.498 N/A VAL 245.A N SER 243.A OG no hydrogen 3.020 N/A ALA 246.A N HIS 239.A O no hydrogen 3.285 N/A ASP 247.A N THR 203.A O no hydrogen 2.808 N/A HIS 248.A N THR 203.A O no hydrogen 3.042 N/A HIS 248.A NE2 GLU 202.A OE2 no hydrogen 2.833 N/A TYR 249.A OH ASP 237.A OD2 no hydrogen 2.754 N/A ALA 250.A N MET 205.A O no hydrogen 2.905 N/A GLU 251.A N HIS 255.A ND1 no hydrogen 2.916 N/A HIS 255.A N ASP 252.A OD2 no hydrogen 2.888 N/A ALA 256.A N ASP 252.A O no hydrogen 2.928 N/A LEU 257.A N ASP 253.A O no hydrogen 2.978 N/A ALA 258.A N ASP 254.A O no hydrogen 3.071 N/A ILE 259.A N HIS 255.A O no hydrogen 2.880 N/A ALA 260.A N ALA 256.A O no hydrogen 2.917 N/A ARG 261.A N LEU 257.A O no hydrogen 3.024 N/A ARG 261.A NH1 ASP 66.A OD1 no hydrogen 3.008 N/A ARG 261.A NH2 LEU 64.A O no hydrogen 2.845 N/A ARG 261.A NH2 ASP 66.A OD1 no hydrogen 2.840 N/A ARG 262.A N ALA 258.A O no hydrogen 3.146 N/A CYS 263.A N ILE 259.A O no hydrogen 2.865 N/A CYS 263.A SG GLU 202.A OE2 no hydrogen 3.517 N/A CYS 263.A SG HIS 248.A NE2 no hydrogen 3.860 N/A CYS 263.A SG ILE 259.A O no hydrogen 3.434 N/A VAL 264.A N ALA 260.A O no hydrogen 3.021 N/A ALA 265.A N ARG 261.A O no hydrogen 2.918 N/A ASN 266.A N CYS 263.A O no hydrogen 3.226 N/A ASN 266.A ND2 ARG 262.A O no hydrogen 3.032 N/A LEU 267.A N VAL 264.A O no hydrogen 3.146 N/A TRP 269.A NE1 ASN 523.A OD1 no hydrogen 3.007 N/A LYS 271.A NZ GLU 103.A OE2 no hydrogen 2.820 N/A LYS 271.A NZ SER 519.A O no hydrogen 2.837 N/A GLN 272.A N ASN 523.A O no hydrogen 3.028 N/A GLY 273.A N LEU 522.A O no hydrogen 2.786 N/A CYS 277.A SG LEU 275.A O no hydrogen 3.764 N/A ARG 278.A N GLY 337.A O no hydrogen 2.904 N/A ARG 281.A N ASP 313.A OD1 no hydrogen 3.258 N/A ARG 281.A NH1 GLU 316.A OE1 no hydrogen 2.878 N/A ARG 281.A NH2 GLU 316.A OE2 no hydrogen 2.812 N/A LEU 284.A N SER 315.A OG no hydrogen 2.845 N/A TYR 285.A OH LEU 5.A O no hydrogen 2.681 N/A GLU 289.A N PRO 286.A O no hydrogen 3.017 N/A LEU 290.A N ALA 287.A O no hydrogen 2.971 N/A TYR 291.A N GLU 288.A O no hydrogen 3.044 N/A TYR 291.A OH ASP 506.A OD1 no hydrogen 3.160 N/A TYR 291.A OH ASP 506.A OD2 no hydrogen 2.669 N/A GLY 292.A N GLU 289.A O no hydrogen 2.979 N/A VAL 293.A N LEU 290.A O no hydrogen 3.240 N/A ALA 296.A N ASN 19.A OD1 no hydrogen 2.978 N/A LYS 299.A N ASP 297.A OD1 no hydrogen 2.942 N/A GLN 300.A N ASP 297.A O no hydrogen 2.994 N/A ARG 305.A N ASP 303.A OD1 no hydrogen 2.965 N/A ARG 305.A NE GLU 319.A OE2 no hydrogen 2.921 N/A ARG 305.A NH1 ASP 303.A OD1 no hydrogen 2.835 N/A ARG 305.A NH2 GLU 319.A OE1 no hydrogen 2.918 N/A ARG 305.A NH2 GLU 319.A OE2 no hydrogen 3.523 N/A GLU 306.A N ASP 303.A O no hydrogen 2.902 N/A VAL 307.A N VAL 304.A O no hydrogen 2.878 N/A ILE 308.A N VAL 304.A O no hydrogen 3.170 N/A ALA 309.A N ARG 305.A O no hydrogen 2.829 N/A ARG 310.A N VAL 307.A O no hydrogen 2.981 N/A ARG 310.A NE GLU 289.A OE2 no hydrogen 2.881 N/A ARG 310.A NH1 GLU 306.A O no hydrogen 2.872 N/A ARG 310.A NH1 GLU 306.A OE2 no hydrogen 2.848 N/A ARG 310.A NH2 THR 7.A OG1 no hydrogen 2.939 N/A ARG 310.A NH2 GLU 289.A OE2 no hydrogen 2.888 N/A LEU 311.A N ILE 308.A O no hydrogen 2.972 N/A VAL 312.A N ILE 308.A O no hydrogen 3.116 N/A ASP 313.A N HIS 334.A O no hydrogen 2.873 N/A GLY 314.A N ALA 282.A O no hydrogen 2.851 N/A SER 315.A N VAL 312.A O no hydrogen 2.963 N/A SER 315.A OG ALA 309.A O no hydrogen 2.732 N/A GLU 316.A N ASP 313.A O no hydrogen 3.100 N/A PHE 317.A N ALA 3.A O no hydrogen 2.814 N/A ASP 318.A N PHE 332.A O no hydrogen 2.913 N/A PHE 320.A N CYS 330.A O no hydrogen 2.836 N/A PHE 324.A N LYS 321.A O no hydrogen 3.176 N/A THR 327.A OG1 ILE 348.A O no hydrogen 2.614 N/A LEU 328.A N GLY 325.A O no hydrogen 3.080 N/A VAL 329.A N ALA 344.A O no hydrogen 2.858 N/A GLY 331.A N ILE 342.A O no hydrogen 3.007 N/A PHE 332.A N ASP 318.A O no hydrogen 2.982 N/A ALA 333.A N ILE 340.A O no hydrogen 2.987 N/A LEU 335.A N TYR 338.A O no hydrogen 2.798 N/A HIS 336.A N ASP 313.A OD2 no hydrogen 2.759 N/A GLY 337.A N ASP 313.A OD1 no hydrogen 2.862 N/A TYR 338.A N LEU 335.A O no hydrogen 3.004 N/A ILE 340.A N ALA 333.A O no hydrogen 2.895 N/A ALA 341.A N PRO 370.A O no hydrogen 2.867 N/A ILE 342.A N GLY 331.A O no hydrogen 2.850 N/A LEU 343.A N LEU 372.A O no hydrogen 2.871 N/A ALA 344.A N VAL 329.A O no hydrogen 2.775 N/A ASN 345.A N LEU 374.A O no hydrogen 3.179 N/A ASN 346.A N THR 327.A O no hydrogen 2.834 N/A ASN 346.A ND2 TYR 302.A O no hydrogen 3.004 N/A LEU 349.A N GLY 379.A O no hydrogen 2.932 N/A ALA 354.A N PHE 350.A O no hydrogen 3.133 N/A GLN 355.A N ALA 351.A O no hydrogen 2.926 N/A LYS 356.A N GLU 352.A O no hydrogen 2.987 N/A LYS 356.A NZ LYS 321.A O no hydrogen 2.955 N/A LYS 356.A NZ PHE 324.A O no hydrogen 2.892 N/A LYS 356.A NZ GLY 325.A O no hydrogen 3.105 N/A LYS 356.A NZ LEU 328.A O no hydrogen 2.756 N/A GLY 357.A N ALA 353.A O no hydrogen 2.907 N/A ALA 358.A N ALA 354.A O no hydrogen 2.972 N/A HIS 359.A N GLN 355.A O no hydrogen 3.035 N/A PHE 360.A N LYS 356.A O no hydrogen 2.844 N/A ILE 361.A N GLY 357.A O no hydrogen 2.943 N/A GLU 362.A N ALA 358.A O no hydrogen 2.993 N/A LEU 363.A N HIS 359.A O no hydrogen 3.074 N/A ALA 364.A N PHE 360.A O no hydrogen 3.062 N/A CYS 365.A N ILE 361.A O no hydrogen 2.864 N/A CYS 365.A SG ILE 361.A O no hydrogen 3.459 N/A CYS 365.A SG THR 529.A OG1 no hydrogen 3.451 N/A GLN 366.A N GLU 362.A O no hydrogen 2.943 N/A ARG 367.A N LEU 363.A O no hydrogen 3.101 N/A GLY 368.A N CYS 365.A O no hydrogen 3.427 N/A ILE 369.A N ALA 364.A O no hydrogen 2.947 N/A LEU 371.A N PRO 408.A O no hydrogen 2.919 N/A LEU 372.A N ALA 341.A O no hydrogen 2.845 N/A PHE 373.A N PHE 410.A O no hydrogen 2.817 N/A LEU 374.A N LEU 343.A O no hydrogen 2.890 N/A GLN 375.A N VAL 412.A O no hydrogen 2.926 N/A ASN 376.A N ASN 345.A OD1 no hydrogen 2.928 N/A ILE 377.A N GLY 416.A O no hydrogen 2.791 N/A MET 381.A N LEU 349.A O no hydrogen 2.964 N/A TYR 386.A N GLY 383.A O no hydrogen 3.082 N/A GLU 387.A N GLY 383.A O no hydrogen 3.090 N/A ALA 388.A N GLN 384.A O no hydrogen 2.929 N/A GLY 389.A N LYS 385.A O no hydrogen 2.964 N/A GLY 390.A N GLU 387.A O no hydrogen 2.917 N/A ILE 391.A N TYR 386.A O no hydrogen 3.118 N/A LYS 393.A NZ MET 536.A O no hydrogen 3.336 N/A LYS 393.A NZ MET 536.A OXT no hydrogen 2.867 N/A HIS 394.A N GLY 390.A O no hydrogen 3.017 N/A GLY 395.A N ILE 391.A O no hydrogen 2.829 N/A ALA 396.A N ALA 392.A O no hydrogen 3.026 N/A LYS 397.A N LYS 393.A O no hydrogen 3.170 N/A LYS 397.A NZ HIS 394.A ND1 no hydrogen 2.994 N/A LYS 397.A NZ ARG 535.A O no hydrogen 2.794 N/A LYS 397.A NZ MET 536.A O no hydrogen 2.899 N/A LEU 398.A N HIS 394.A O no hydrogen 3.422 N/A VAL 399.A N GLY 395.A O no hydrogen 2.991 N/A THR 400.A N ALA 396.A O no hydrogen 2.853 N/A THR 400.A OG1 ALA 396.A O no hydrogen 3.064 N/A ALA 401.A N LYS 397.A O no hydrogen 3.007 N/A VAL 402.A N LEU 398.A O no hydrogen 2.913 N/A ALA 403.A N VAL 399.A O no hydrogen 2.852 N/A CYS 404.A N THR 400.A O no hydrogen 3.029 N/A CYS 404.A SG THR 400.A O no hydrogen 3.373 N/A ALA 405.A N ALA 401.A O no hydrogen 2.981 N/A ARG 406.A N THR 529.A OG1 no hydrogen 2.893 N/A LYS 409.A NZ VAL 402.A O no hydrogen 2.731 N/A LYS 409.A NZ ALA 405.A O no hydrogen 3.507 N/A LYS 409.A NZ TYR 430.A O no hydrogen 3.022 N/A PHE 410.A N LEU 371.A O no hydrogen 2.864 N/A THR 411.A N PHE 434.A O no hydrogen 3.118 N/A THR 411.A OG1 CYS 426.A O no hydrogen 2.775 N/A VAL 412.A N PHE 373.A O no hydrogen 2.887 N/A LEU 413.A N TRP 436.A O no hydrogen 2.823 N/A ILE 414.A N GLN 375.A O no hydrogen 2.939 N/A SER 417.A N ARG 442.A O no hydrogen 2.851 N/A PHE 418.A N ILE 377.A O no hydrogen 3.011 N/A GLY 419.A N GLY 444.A O no hydrogen 3.094 N/A ASN 422.A N GLY 419.A O no hydrogen 2.953 N/A ASN 422.A ND2 SER 417.A OG no hydrogen 2.841 N/A TYR 423.A N ALA 420.A O no hydrogen 3.082 N/A GLY 424.A N ALA 420.A O no hydrogen 3.478 N/A MET 425.A N GLY 421.A O no hydrogen 3.223 N/A CYS 426.A N TYR 423.A O no hydrogen 3.141 N/A GLY 427.A N ASN 422.A O no hydrogen 2.913 N/A ARG 428.A NE LEU 499.A O no hydrogen 3.347 N/A ARG 428.A NH1 ASP 502.A OD1 no hydrogen 3.379 N/A ARG 428.A NH1 ASP 502.A OD2 no hydrogen 2.974 N/A ARG 428.A NH2 LEU 499.A O no hydrogen 2.942 N/A ARG 428.A NH2 ASP 502.A OD1 no hydrogen 2.958 N/A TYR 430.A N GLY 427.A O no hydrogen 2.922 N/A ARG 433.A N LYS 409.A O no hydrogen 2.663 N/A ARG 433.A NH1 ASN 136.A OD1 no hydrogen 2.906 N/A LEU 435.A N ASP 502.A OD2 no hydrogen 2.990 N/A TRP 436.A N THR 411.A O no hydrogen 2.909 N/A MET 437.A N GLY 503.A O no hydrogen 3.023 N/A TRP 438.A N LEU 413.A O no hydrogen 2.884 N/A TRP 438.A NE1 THR 510.A OG1 no hydrogen 2.860 N/A ALA 441.A N TRP 438.A O no hydrogen 3.132 N/A ARG 442.A N GLY 415.A O no hydrogen 3.130 N/A ARG 442.A NE GLU 487.A OE1 no hydrogen 2.954 N/A ARG 442.A NE GLU 487.A OE2 no hydrogen 3.383 N/A ARG 442.A NH1 GLU 487.A OE2 no hydrogen 2.743 N/A ARG 442.A NH2 ALA 441.A O no hydrogen 2.928 N/A ILE 443.A N GLY 490.A O no hydrogen 3.220 N/A GLY 444.A N SER 417.A O no hydrogen 3.031 N/A ALA 451.A N GLY 447.A O no hydrogen 3.112 N/A ALA 452.A N GLY 448.A O no hydrogen 2.883 N/A GLY 453.A N GLU 449.A O no hydrogen 2.991 N/A VAL 454.A N GLN 450.A O no hydrogen 3.284 N/A ALA 456.A N ALA 452.A O no hydrogen 3.011 N/A GLN 457.A N GLY 453.A O no hydrogen 2.493 N/A VAL 458.A N VAL 454.A O no hydrogen 3.077 N/A LYS 459.A N LEU 455.A O no hydrogen 2.917 N/A ARG 460.A N ALA 456.A O no hydrogen 2.907 N/A GLN 462.A N VAL 458.A O no hydrogen 3.152 N/A ALA 463.A N LYS 459.A O no hydrogen 3.119 N/A ALA 463.A N ARG 460.A O no hydrogen 3.018 N/A GLU 464.A N ARG 460.A O no hydrogen 2.715 N/A ARG 465.A N GLU 461.A O no hydrogen 2.763 N/A ALA 466.A N ALA 463.A O no hydrogen 2.981 N/A GLY 467.A N GLU 464.A O no hydrogen 2.711 N/A GLN 468.A N ALA 463.A O no hydrogen 2.823 N/A GLY 471.A N GLU 474.A OE1 no hydrogen 2.744 N/A GLU 475.A N GLY 471.A O no hydrogen 2.978 N/A ALA 476.A N VAL 472.A O no hydrogen 3.020 N/A LYS 477.A N GLU 473.A O no hydrogen 2.914 N/A ILE 478.A N GLU 474.A O no hydrogen 3.064 N/A LYS 479.A N GLU 475.A O no hydrogen 3.014 N/A ALA 480.A N ALA 476.A O no hydrogen 3.021 N/A LEU 483.A N LYS 479.A O no hydrogen 3.024 N/A GLU 484.A N ALA 480.A O no hydrogen 2.980 N/A GLN 485.A N PRO 481.A O no hydrogen 2.864 N/A GLN 485.A NE2 GLN 489.A OE1 no hydrogen 2.997 N/A TYR 486.A N ILE 482.A O no hydrogen 3.039 N/A GLU 487.A N LEU 483.A O no hydrogen 3.076 N/A HIS 488.A N GLU 484.A O no hydrogen 2.877 N/A GLN 489.A N GLN 485.A O no hydrogen 2.818 N/A GLY 490.A N TYR 486.A O no hydrogen 2.864 N/A TYR 494.A N HIS 491.A O no hydrogen 2.911 N/A SER 495.A N HIS 491.A O no hydrogen 3.084 N/A SER 495.A OG ASP 501.A OD1 no hydrogen 2.628 N/A SER 496.A N PRO 492.A O no hydrogen 2.837 N/A SER 496.A OG ASP 501.A OD2 no hydrogen 2.704 N/A ALA 497.A N TYR 493.A O no hydrogen 2.938 N/A ARG 498.A N SER 495.A O no hydrogen 3.079 N/A ARG 498.A NH1 TYR 494.A O no hydrogen 3.063 N/A LEU 499.A N SER 496.A O no hydrogen 3.175 N/A TRP 500.A N SER 495.A O no hydrogen 3.086 N/A ASP 502.A N LEU 435.A O no hydrogen 2.754 N/A GLY 503.A N ASP 501.A OD2 no hydrogen 2.739 N/A ILE 505.A N MET 437.A O no hydrogen 3.004 N/A ALA 508.A N ASP 506.A OD2 no hydrogen 3.006 N/A GLN 509.A N ASP 506.A O no hydrogen 2.833 N/A THR 510.A N PRO 507.A O no hydrogen 3.111 N/A THR 510.A OG1 PRO 507.A O no hydrogen 2.761 N/A ARG 511.A NH1 LEU 311.A O no hydrogen 2.864 N/A ARG 511.A NH1 ASP 313.A OD2 no hydrogen 2.778 N/A ARG 511.A NH2 ARG 281.A O no hydrogen 3.043 N/A ARG 511.A NH2 ASP 313.A OD2 no hydrogen 2.997 N/A VAL 513.A N GLN 509.A O no hydrogen 2.990 N/A LEU 514.A N THR 510.A O no hydrogen 2.948 N/A ALA 515.A N ARG 511.A O no hydrogen 2.921 N/A LEU 516.A N GLU 512.A O no hydrogen 3.051 N/A ALA 517.A N VAL 513.A O no hydrogen 2.919 N/A LEU 518.A N LEU 514.A O no hydrogen 2.837 N/A SER 519.A N ALA 515.A O no hydrogen 3.123 N/A SER 519.A OG GLU 103.A OE1 no hydrogen 2.617 N/A ALA 520.A N LEU 516.A O no hydrogen 2.960 N/A ALA 521.A N ALA 517.A O no hydrogen 2.886 N/A LEU 522.A N LEU 518.A O no hydrogen 3.234 N/A LEU 522.A N SER 519.A O no hydrogen 3.132 N/A ASN 523.A N ALA 520.A O no hydrogen 3.040 N/A ASN 523.A ND2 GLU 103.A OE2 no hydrogen 2.942 N/A ASN 523.A ND2 ALA 520.A O no hydrogen 2.929 N/A ALA 524.A N ALA 521.A O no hydrogen 3.225 N/A