Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7au6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NE ASP 14.A OD2 no hydrogen 2.615 N/A ARG 5.A NH2 ASP 14.A OD1 no hydrogen 2.950 N/A TRP 6.A N PHE 2.A O no hydrogen 3.241 N/A PHE 7.A N PHE 3.A O no hydrogen 2.911 N/A ASN 11.A N SER 9.A OG no hydrogen 3.222 N/A HIS 12.A ND1 ASN 97.A O no hydrogen 3.056 N/A LYS 13.A NZ ASN 11.A OD1 no hydrogen 3.078 N/A LYS 13.A NZ PRO 523.A O no hydrogen 2.998 N/A LYS 13.A NZ GLU 524.A O no hydrogen 2.905 N/A ILE 15.A N ASN 11.A O no hydrogen 3.264 N/A GLY 16.A N HIS 12.A O no hydrogen 2.956 N/A ILE 17.A N LYS 13.A O no hydrogen 3.128 N/A LEU 18.A N ASP 14.A O no hydrogen 2.950 N/A TYR 19.A N ILE 15.A O no hydrogen 3.183 N/A TYR 19.A OH SER 118.A OG no hydrogen 2.742 N/A LEU 20.A N GLY 16.A O no hydrogen 2.998 N/A PHE 21.A N ILE 17.A O no hydrogen 3.256 N/A THR 22.A N LEU 18.A O no hydrogen 3.223 N/A THR 22.A OG1 LEU 18.A O no hydrogen 2.891 N/A THR 22.A OG1 TYR 119.A OH no hydrogen 2.771 N/A ALA 23.A N TYR 19.A O no hydrogen 2.949 N/A GLY 24.A N LEU 20.A O no hydrogen 2.997 N/A ILE 25.A N PHE 21.A O no hydrogen 2.972 N/A VAL 26.A N THR 22.A O no hydrogen 2.899 N/A GLY 27.A N ALA 23.A O no hydrogen 2.698 N/A LEU 28.A N GLY 24.A O no hydrogen 3.043 N/A LEU 28.A N ILE 25.A O no hydrogen 3.244 N/A ILE 29.A N ILE 25.A O no hydrogen 3.322 N/A SER 30.A N VAL 26.A O no hydrogen 3.145 N/A SER 30.A OG HIS 78.A ND1 no hydrogen 3.069 N/A SER 30.A OG HIS 78.A O no hydrogen 2.981 N/A VAL 31.A N GLY 27.A O no hydrogen 2.921 N/A CYS 32.A N LEU 28.A O no hydrogen 2.992 N/A CYS 32.A SG LEU 28.A O no hydrogen 3.514 N/A PHE 33.A N ILE 29.A O no hydrogen 3.093 N/A THR 34.A N SER 30.A O no hydrogen 3.112 N/A THR 34.A OG1 VAL 31.A O no hydrogen 2.423 N/A VAL 35.A N VAL 31.A O no hydrogen 3.062 N/A TYR 36.A N CYS 32.A O no hydrogen 3.202 N/A TYR 36.A OH ARG 55.A O no hydrogen 2.885 N/A MET 37.A N PHE 33.A O no hydrogen 2.903 N/A ARG 38.A N THR 34.A O no hydrogen 2.756 N/A ARG 38.A NE SER 474.A OG no hydrogen 3.125 N/A ARG 38.A NH2 ASN 470.A O no hydrogen 3.112 N/A ARG 38.A NH2 ASN 470.A OD1 no hydrogen 3.344 N/A ARG 38.A NH2 SER 474.A OG no hydrogen 3.175 N/A MET 39.A N VAL 35.A O no hydrogen 2.778 N/A GLU 40.A N TYR 36.A O no hydrogen 2.967 N/A LEU 41.A N MET 37.A O no hydrogen 2.914 N/A GLN 42.A NE2 ASN 471.A OD1 no hydrogen 3.142 N/A GLY 45.A N ASP 461.A OD1 no hydrogen 2.908 N/A GLN 47.A N GLU 40.A OE1 no hydrogen 2.893 N/A GLN 47.A NE2 PRO 44.A O no hydrogen 3.032 N/A TYR 48.A N GLU 40.A OE2 no hydrogen 2.799 N/A MET 49.A N GLU 40.A OE2 no hydrogen 2.779 N/A CYS 50.A N TYR 48.A O no hydrogen 2.933 N/A CYS 50.A SG TYR 48.A O no hydrogen 3.527 N/A LEU 51.A N THR 65.A O no hydrogen 2.730 N/A GLU 52.A N GLU 52.A OE2 no hydrogen 2.826 N/A GLY 53.A N CYS 50.A O no hydrogen 2.872 N/A ARG 55.A N TYR 48.A O no hydrogen 2.873 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.868 N/A ALA 62.A N ASP 59.A O no hydrogen 2.516 N/A CYS 64.A SG VAL 46.A O no hydrogen 3.159 N/A THR 65.A N GLU 52.A OE1 no hydrogen 3.309 N/A THR 65.A N GLU 52.A OE2 no hydrogen 2.833 N/A THR 65.A OG1 GLU 52.A OE1 no hydrogen 3.021 N/A THR 65.A OG1 GLU 63.A OE1 no hydrogen 3.064 N/A ASN 67.A N MET 49.A O no hydrogen 3.006 N/A ASN 67.A ND2 GLN 141.A OE1 no hydrogen 2.860 N/A HIS 69.A NE2 MET 142.A O no hydrogen 2.960 N/A ASN 72.A N GLY 68.A O no hydrogen 3.054 N/A VAL 73.A N HIS 69.A O no hydrogen 2.936 N/A MET 74.A N LEU 70.A O no hydrogen 2.877 N/A ILE 75.A N TRP 71.A O no hydrogen 3.177 N/A THR 76.A N ASN 72.A O no hydrogen 2.949 N/A THR 76.A OG1 ASN 72.A O no hydrogen 2.597 N/A TYR 77.A N VAL 73.A O no hydrogen 2.828 N/A TYR 77.A OH SER 132.A OG no hydrogen 2.566 N/A HIS 78.A N MET 74.A O no hydrogen 2.979 N/A HIS 78.A ND1 SER 30.A OG no hydrogen 3.069 N/A GLY 79.A N ILE 75.A O no hydrogen 3.064 N/A VAL 80.A N THR 76.A O no hydrogen 2.997 N/A LEU 81.A N TYR 77.A O no hydrogen 2.980 N/A MET 82.A N HIS 78.A O no hydrogen 3.211 N/A MET 83.A N GLY 79.A O no hydrogen 2.795 N/A PHE 84.A N VAL 80.A O no hydrogen 2.821 N/A PHE 85.A N LEU 81.A O no hydrogen 2.676 N/A ALA 90.A N VAL 86.A O no hydrogen 3.015 N/A LEU 91.A N VAL 87.A O no hydrogen 2.784 N/A PHE 92.A N ILE 88.A O no hydrogen 2.704 N/A GLY 93.A N ILE 88.A O no hydrogen 3.283 N/A GLY 94.A N PRO 89.A O no hydrogen 2.554 N/A PHE 95.A N ALA 90.A O no hydrogen 3.013 N/A GLY 96.A N LEU 91.A O no hydrogen 2.951 N/A ASN 97.A ND2 GLY 93.A O no hydrogen 2.898 N/A TYR 98.A N GLY 94.A O no hydrogen 3.213 N/A PHE 99.A N PHE 95.A O no hydrogen 2.826 N/A MET 100.A N GLY 96.A O no hydrogen 3.066 N/A HIS 103.A N PHE 99.A O no hydrogen 2.832 N/A HIS 103.A NE2 GLU 515.A OE2 no hydrogen 3.054 N/A ILE 104.A N MET 100.A O no hydrogen 3.205 N/A GLY 105.A N LEU 102.A O no hydrogen 3.163 N/A ALA 106.A N PRO 101.A O no hydrogen 3.110 N/A ALA 110.A N THR 187.A OG1 no hydrogen 2.690 N/A PHE 111.A N ASN 183.A OD1 no hydrogen 3.053 N/A ASN 115.A N PHE 111.A O no hydrogen 2.834 N/A ASN 115.A ND2 ASN 97.A OD1 no hydrogen 3.442 N/A ASN 116.A N PRO 112.A O no hydrogen 3.227 N/A ASN 116.A ND2 PHE 7.A O no hydrogen 3.519 N/A LEU 117.A N ARG 113.A O no hydrogen 2.941 N/A SER 118.A N LEU 114.A O no hydrogen 3.089 N/A SER 118.A OG TYR 19.A OH no hydrogen 2.742 N/A SER 118.A OG ASN 115.A O no hydrogen 2.991 N/A TYR 119.A N ASN 115.A O no hydrogen 3.319 N/A TYR 119.A OH THR 22.A OG1 no hydrogen 2.771 N/A TRP 120.A N ASN 116.A O no hydrogen 3.117 N/A MET 121.A N LEU 117.A O no hydrogen 2.718 N/A TYR 122.A N SER 118.A O no hydrogen 2.772 N/A TYR 122.A OH PHE 85.A O no hydrogen 2.672 N/A VAL 123.A N TYR 119.A O no hydrogen 3.162 N/A CYS 124.A N TRP 120.A O no hydrogen 3.057 N/A GLY 125.A N MET 121.A O no hydrogen 3.062 N/A VAL 126.A N TYR 122.A O no hydrogen 3.071 N/A ALA 127.A N VAL 123.A O no hydrogen 2.905 N/A LEU 128.A N CYS 124.A O no hydrogen 2.887 N/A GLY 129.A N GLY 125.A O no hydrogen 2.823 N/A VAL 130.A N VAL 126.A O no hydrogen 2.872 N/A ALA 131.A N ALA 127.A O no hydrogen 2.850 N/A SER 132.A N LEU 128.A O no hydrogen 2.858 N/A SER 132.A OG TYR 77.A OH no hydrogen 2.566 N/A SER 132.A OG SER 162.A O no hydrogen 2.862 N/A SER 132.A OG SER 162.A OG no hydrogen 2.969 N/A LEU 133.A N GLY 129.A O no hydrogen 2.964 N/A LEU 134.A N VAL 130.A O no hydrogen 3.148 N/A LEU 134.A N ALA 131.A O no hydrogen 3.267 N/A ALA 135.A N SER 132.A O no hydrogen 3.292 N/A GLY 137.A N GLN 141.A O no hydrogen 2.749 N/A ASN 139.A ND2 HIS 69.A ND1 no hydrogen 2.978 N/A GLN 141.A N GLY 138.A O no hydrogen 3.186 N/A GLN 141.A NE2 ASN 67.A OD1 no hydrogen 3.019 N/A GLN 141.A NE2 ASN 139.A O no hydrogen 3.650 N/A GLY 143.A N ALA 135.A O no hydrogen 2.898 N/A SER 144.A N TYR 77.A OH no hydrogen 3.127 N/A SER 144.A OG SER 162.A OG no hydrogen 2.702 N/A GLY 147.A N THR 76.A OG1 no hydrogen 2.826 N/A LEU 150.A N GLY 147.A O no hydrogen 3.105 N/A SER 155.A N TYR 151.A O no hydrogen 3.084 N/A SER 155.A OG LEU 150.A O no hydrogen 2.919 N/A THR 156.A OG1 PRO 153.A O no hydrogen 2.975 N/A THR 157.A N LEU 154.A O no hydrogen 3.303 N/A THR 157.A OG1 PRO 153.A O no hydrogen 3.003 N/A THR 157.A OG1 LEU 154.A O no hydrogen 3.317 N/A TYR 161.A N PRO 136.A O no hydrogen 3.024 N/A SER 162.A N PRO 136.A O no hydrogen 3.436 N/A SER 162.A OG SER 132.A O no hydrogen 2.797 N/A SER 162.A OG SER 132.A OG no hydrogen 2.969 N/A SER 162.A OG SER 144.A OG no hydrogen 2.702 N/A LEU 165.A N TYR 161.A O no hydrogen 3.109 N/A ALA 166.A N SER 162.A O no hydrogen 2.954 N/A ILE 167.A N MET 163.A O no hydrogen 2.965 N/A PHE 168.A N ASP 164.A O no hydrogen 3.008 N/A ALA 169.A N LEU 165.A O no hydrogen 2.818 N/A VAL 170.A N ALA 166.A O no hydrogen 2.905 N/A HIS 171.A N ILE 167.A O no hydrogen 2.951 N/A VAL 172.A N PHE 168.A O no hydrogen 3.116 N/A SER 173.A N ALA 169.A O no hydrogen 2.952 N/A SER 173.A OG PHE 84.A O no hydrogen 3.199 N/A GLY 174.A N VAL 170.A O no hydrogen 2.898 N/A ALA 175.A N HIS 171.A O no hydrogen 2.753 N/A SER 176.A N VAL 172.A O no hydrogen 2.934 N/A SER 176.A OG SER 118.A O no hydrogen 2.825 N/A SER 177.A N SER 173.A O no hydrogen 2.936 N/A SER 177.A OG SER 173.A O no hydrogen 3.336 N/A ILE 178.A N GLY 174.A O no hydrogen 2.878 N/A LEU 179.A N ALA 175.A O no hydrogen 2.908 N/A GLY 180.A N SER 176.A O no hydrogen 3.086 N/A ALA 181.A N SER 177.A O no hydrogen 2.958 N/A ILE 182.A N ILE 178.A O no hydrogen 2.995 N/A ASN 183.A N LEU 179.A O no hydrogen 3.106 N/A ASN 183.A ND2 PHE 111.A O no hydrogen 2.625 N/A ILE 184.A N GLY 180.A O no hydrogen 2.837 N/A ILE 185.A N ALA 181.A O no hydrogen 2.724 N/A THR 186.A N ILE 182.A O no hydrogen 2.988 N/A THR 186.A OG1 ILE 182.A O no hydrogen 2.819 N/A THR 187.A N ASN 183.A O no hydrogen 2.907 N/A THR 187.A OG1 ASN 183.A O no hydrogen 2.789 N/A THR 187.A OG1 ASN 183.A OD1 no hydrogen 3.232 N/A PHE 188.A N ILE 184.A O no hydrogen 2.987 N/A LEU 189.A N ILE 185.A O no hydrogen 2.940 N/A ASN 190.A N THR 186.A O no hydrogen 2.912 N/A MET 191.A N THR 187.A O no hydrogen 2.977 N/A ARG 192.A NE PHE 188.A O no hydrogen 2.836 N/A ARG 192.A NH1 MET 196.A O no hydrogen 2.851 N/A ARG 192.A NH2 LEU 189.A O no hydrogen 3.068 N/A ALA 193.A N ILE 104.A O no hydrogen 2.804 N/A MET 196.A N ALA 193.A O no hydrogen 2.890 N/A THR 197.A N GLY 195.A O no hydrogen 2.873 N/A LYS 200.A N THR 197.A O no hydrogen 2.844 N/A VAL 201.A N LEU 198.A O no hydrogen 3.413 N/A PHE 204.A N HIS 276.A NE2 no hydrogen 3.159 N/A TRP 206.A N PRO 202.A O no hydrogen 3.286 N/A TRP 206.A NE1 LEU 198.A O no hydrogen 2.892 N/A SER 207.A N LEU 203.A O no hydrogen 2.947 N/A SER 207.A OG PHE 204.A O no hydrogen 2.772 N/A VAL 208.A N PHE 204.A O no hydrogen 3.072 N/A PHE 209.A N ALA 205.A O no hydrogen 2.921 N/A ILE 210.A N TRP 206.A O no hydrogen 2.963 N/A THR 211.A N SER 207.A O no hydrogen 3.032 N/A THR 211.A OG1 SER 207.A O no hydrogen 2.740 N/A ALA 212.A N VAL 208.A O no hydrogen 2.922 N/A TRP 213.A N PHE 209.A O no hydrogen 3.272 N/A LEU 214.A N ILE 210.A O no hydrogen 3.130 N/A ILE 215.A N THR 211.A O no hydrogen 2.993 N/A LEU 216.A N ALA 212.A O no hydrogen 2.863 N/A LEU 217.A N TRP 213.A O no hydrogen 2.988 N/A SER 218.A N LEU 214.A O no hydrogen 3.067 N/A SER 218.A N ILE 215.A O no hydrogen 3.403 N/A SER 218.A OG LEU 214.A O no hydrogen 2.865 N/A LEU 219.A N ILE 215.A O no hydrogen 3.012 N/A LEU 222.A N SER 218.A O no hydrogen 3.298 N/A ALA 223.A N LEU 219.A O no hydrogen 3.062 N/A GLY 224.A N PRO 220.A O no hydrogen 3.190 N/A ALA 225.A N VAL 221.A O no hydrogen 3.250 N/A ILE 226.A N LEU 222.A O no hydrogen 2.981 N/A THR 227.A N ALA 223.A O no hydrogen 3.051 N/A THR 227.A OG1 ALA 223.A O no hydrogen 2.587 N/A MET 228.A N GLY 224.A O no hydrogen 2.959 N/A LEU 229.A N ALA 225.A O no hydrogen 3.002 N/A LEU 230.A N ILE 226.A O no hydrogen 2.833 N/A MET 231.A N THR 227.A O no hydrogen 2.791 N/A ASP 232.A N MET 228.A O no hydrogen 3.056 N/A ARG 233.A N LEU 229.A O no hydrogen 3.147 N/A ARG 233.A NE ASP 164.A OD1 no hydrogen 2.881 N/A ARG 233.A NH1 SER 155.A O no hydrogen 2.916 N/A ARG 233.A NH1 GLU 158.A O no hydrogen 2.857 N/A ARG 233.A NH2 GLU 158.A O no hydrogen 3.433 N/A ARG 233.A NH2 ASP 164.A OD2 no hydrogen 3.179 N/A ASN 234.A N LEU 230.A O no hydrogen 2.979 N/A ASN 234.A ND2 ASP 164.A OD1 no hydrogen 2.876 N/A ASN 234.A ND2 LEU 230.A O no hydrogen 3.258 N/A PHE 235.A N MET 231.A O no hydrogen 2.908 N/A THR 237.A OG1 ASP 232.A OD1 no hydrogen 2.529 N/A PHE 239.A N ASP 232.A OD1 no hydrogen 3.066 N/A PHE 240.A N ASP 232.A OD2 no hydrogen 3.037 N/A GLY 244.A N ASP 241.A O no hydrogen 3.272 N/A GLY 245.A N PRO 242.A O no hydrogen 3.033 N/A GLY 246.A N ASP 241.A O no hydrogen 2.593 N/A ASP 247.A N PHE 239.A O no hydrogen 3.353 N/A VAL 249.A N ASP 247.A OD1 no hydrogen 3.420 N/A LEU 250.A N ASP 247.A O no hydrogen 3.003 N/A TYR 251.A OH VAL 149.A O no hydrogen 2.652 N/A GLN 252.A N PRO 248.A O no hydrogen 3.197 N/A HIS 253.A N VAL 249.A O no hydrogen 3.029 N/A ILE 254.A N LEU 250.A O no hydrogen 3.087 N/A LEU 255.A N TYR 251.A O no hydrogen 2.898 N/A TRP 256.A N GLN 252.A O no hydrogen 2.965 N/A TRP 256.A NE1 TYR 151.A OH no hydrogen 2.905 N/A PHE 257.A N HIS 253.A O no hydrogen 2.982 N/A PHE 257.A N ILE 254.A O no hydrogen 3.134 N/A GLY 259.A N LEU 255.A O no hydrogen 2.744 N/A HIS 260.A N TRP 256.A O no hydrogen 3.254 N/A GLU 262.A N PHE 258.A O no hydrogen 3.106 N/A VAL 263.A N HIS 260.A O no hydrogen 2.744 N/A ILE 265.A N PRO 261.A O no hydrogen 2.819 N/A ILE 266.A N GLU 262.A O no hydrogen 2.939 N/A ILE 266.A N VAL 263.A O no hydrogen 3.006 N/A ILE 267.A N VAL 263.A O no hydrogen 3.016 N/A LEU 268.A N TYR 264.A O no hydrogen 2.955 N/A PHE 271.A N ILE 267.A O no hydrogen 3.008 N/A GLY 272.A N LEU 268.A O no hydrogen 3.064 N/A ILE 273.A N PRO 269.A O no hydrogen 3.014 N/A ILE 274.A N GLY 270.A O no hydrogen 2.916 N/A SER 275.A N PHE 271.A O no hydrogen 3.210 N/A HIS 276.A N GLY 272.A O no hydrogen 3.361 N/A VAL 277.A N ILE 273.A O no hydrogen 3.017 N/A ILE 278.A N ILE 274.A O no hydrogen 2.860 N/A SER 279.A N SER 275.A O no hydrogen 3.126 N/A SER 279.A OG LYS 284.A O no hydrogen 2.701 N/A THR 280.A N HIS 276.A O no hydrogen 3.109 N/A THR 280.A OG1 HIS 276.A O no hydrogen 3.094 N/A THR 280.A OG1 TYR 414.A OH no hydrogen 2.900 N/A THR 280.A OG1 HIS 510.A O no hydrogen 3.331 N/A PHE 281.A N VAL 277.A O no hydrogen 2.991 N/A ALA 282.A N ILE 278.A O no hydrogen 2.955 N/A LYS 283.A N THR 280.A O no hydrogen 3.242 N/A LYS 284.A N SER 279.A O no hydrogen 3.245 N/A LYS 284.A NZ THR 345.A O no hydrogen 2.814 N/A LYS 284.A NZ TRP 347.A O no hydrogen 2.886 N/A PHE 287.A N THR 345.A OG1 no hydrogen 2.889 N/A TYR 289.A OH VAL 201.A O no hydrogen 2.652 N/A MET 292.A N GLY 288.A O no hydrogen 2.945 N/A VAL 293.A N TYR 289.A O no hydrogen 2.976 N/A LEU 294.A N LEU 290.A O no hydrogen 2.974 N/A ALA 295.A N PRO 291.A O no hydrogen 2.784 N/A MET 296.A N MET 292.A O no hydrogen 3.219 N/A ALA 297.A N VAL 293.A O no hydrogen 3.120 N/A ALA 298.A N LEU 294.A O no hydrogen 2.806 N/A ILE 299.A N ALA 295.A O no hydrogen 2.904 N/A GLY 300.A N MET 296.A O no hydrogen 2.988 N/A ILE 301.A N ALA 297.A O no hydrogen 2.894 N/A LEU 302.A N ALA 298.A O no hydrogen 2.684 N/A GLY 303.A N ILE 299.A O no hydrogen 2.948 N/A PHE 304.A N ILE 301.A O no hydrogen 3.032 N/A VAL 305.A N LEU 302.A O no hydrogen 3.134 N/A TRP 307.A NE1 HIS 253.A ND1 no hydrogen 3.224 N/A HIS 309.A N VAL 306.A O no hydrogen 3.418 N/A HIS 309.A ND1 THR 328.A OG1 no hydrogen 2.868 N/A HIS 310.A N TRP 307.A O no hydrogen 2.938 N/A MET 311.A N ALA 308.A O no hydrogen 2.969 N/A TYR 312.A OH SER 378.A O no hydrogen 2.709 N/A ALA 314.A N MET 311.A O no hydrogen 3.148 N/A GLN 320.A N SER 317.A OG no hydrogen 2.995 N/A GLN 321.A N SER 317.A O no hydrogen 3.047 N/A GLN 321.A NE2 MET 316.A O no hydrogen 3.421 N/A ALA 322.A N LEU 318.A O no hydrogen 2.953 N/A TYR 323.A N THR 319.A O no hydrogen 3.031 N/A TYR 323.A OH VAL 305.A O no hydrogen 2.941 N/A PHE 324.A N GLN 320.A O no hydrogen 2.997 N/A MET 325.A N GLN 321.A O no hydrogen 2.968 N/A LEU 326.A N ALA 322.A O no hydrogen 3.077 N/A ALA 327.A N TYR 323.A O no hydrogen 2.948 N/A THR 328.A N PHE 324.A O no hydrogen 2.843 N/A THR 328.A OG1 VAL 306.A O no hydrogen 3.499 N/A THR 328.A OG1 HIS 309.A ND1 no hydrogen 2.868 N/A THR 328.A OG1 PHE 324.A O no hydrogen 2.706 N/A MET 329.A N MET 325.A O no hydrogen 3.090 N/A THR 330.A N ALA 327.A O no hydrogen 3.114 N/A THR 330.A OG1 ALA 327.A O no hydrogen 2.655 N/A VAL 333.A N THR 330.A O no hydrogen 3.031 N/A THR 335.A N ILE 331.A O no hydrogen 3.326 N/A THR 335.A OG1 ILE 331.A O no hydrogen 2.878 N/A GLY 336.A N ALA 332.A O no hydrogen 2.928 N/A ILE 337.A N VAL 333.A O no hydrogen 3.156 N/A LYS 338.A N PRO 334.A O no hydrogen 3.089 N/A LYS 338.A NZ MET 292.A O no hydrogen 3.384 N/A VAL 339.A N THR 335.A O no hydrogen 2.800 N/A PHE 340.A N GLY 336.A O no hydrogen 2.787 N/A SER 341.A N ILE 337.A O no hydrogen 2.956 N/A SER 341.A OG ILE 337.A O no hydrogen 2.830 N/A TRP 342.A N LYS 338.A O no hydrogen 2.987 N/A TRP 342.A NE1 SER 275.A OG no hydrogen 2.742 N/A ILE 343.A N VAL 339.A O no hydrogen 3.219 N/A ALA 344.A N PHE 340.A O no hydrogen 2.939 N/A THR 345.A N SER 341.A O no hydrogen 2.981 N/A THR 345.A OG1 SER 341.A O no hydrogen 2.913 N/A MET 346.A N TRP 342.A O no hydrogen 3.284 N/A TRP 347.A N ILE 343.A O no hydrogen 2.969 N/A GLY 349.A N MET 346.A O no hydrogen 3.036 N/A SER 350.A N ALA 282.A O no hydrogen 3.047 N/A GLU 352.A N PHE 281.A O no hydrogen 3.066 N/A LYS 354.A N GLU 352.A O no hydrogen 2.904 N/A LYS 354.A NZ GLU 352.A OE2 no hydrogen 3.121 N/A THR 355.A N GLU 426.A OE2 no hydrogen 2.812 N/A THR 355.A OG1 GLU 426.A OE2 no hydrogen 2.954 N/A LEU 358.A N LYS 354.A O no hydrogen 3.025 N/A TRP 359.A N THR 355.A O no hydrogen 2.996 N/A ALA 360.A N PRO 356.A O no hydrogen 2.961 N/A PHE 361.A N MET 357.A O no hydrogen 2.914 N/A GLY 362.A N LEU 358.A O no hydrogen 2.983 N/A PHE 363.A N TRP 359.A O no hydrogen 2.933 N/A LEU 364.A N ALA 360.A O no hydrogen 2.934 N/A PHE 365.A N PHE 361.A O no hydrogen 3.173 N/A LEU 366.A N GLY 362.A O no hydrogen 2.961 N/A PHE 367.A N PHE 363.A O no hydrogen 2.893 N/A THR 368.A OG1 LEU 364.A O no hydrogen 3.029 N/A VAL 369.A N PHE 365.A O no hydrogen 3.237 N/A GLY 370.A N LEU 366.A O no hydrogen 3.056 N/A GLY 371.A N PHE 367.A O no hydrogen 2.868 N/A VAL 372.A N THR 368.A O no hydrogen 3.033 N/A THR 373.A N VAL 369.A O no hydrogen 3.261 N/A THR 373.A OG1 VAL 369.A O no hydrogen 3.337 N/A THR 373.A OG1 GLY 370.A O no hydrogen 2.604 N/A THR 373.A OG1 HIS 395.A ND1 no hydrogen 3.280 N/A GLY 374.A N GLY 370.A O no hydrogen 3.043 N/A VAL 375.A N GLY 371.A O no hydrogen 2.951 N/A VAL 376.A N VAL 372.A O no hydrogen 3.045 N/A LEU 377.A N THR 373.A O no hydrogen 2.925 N/A SER 378.A N GLY 374.A O no hydrogen 2.873 N/A SER 378.A N VAL 375.A O no hydrogen 2.971 N/A SER 378.A OG VAL 375.A O no hydrogen 2.566 N/A GLN 379.A N VAL 376.A O no hydrogen 3.168 N/A GLN 379.A NE2 SER 378.A OG no hydrogen 2.592 N/A ASP 383.A N GLN 379.A O no hydrogen 3.025 N/A ARG 384.A N ALA 380.A O no hydrogen 2.947 N/A ARG 384.A NH1 TYR 312.A O no hydrogen 3.077 N/A ARG 384.A NH1 GLN 321.A OE1 no hydrogen 3.290 N/A ARG 384.A NH2 GLN 321.A OE1 no hydrogen 2.858 N/A VAL 385.A N LEU 382.A O no hydrogen 3.117 N/A TYR 386.A N LEU 382.A O no hydrogen 3.116 N/A HIS 387.A N ASP 383.A O no hydrogen 2.678 N/A THR 389.A N TYR 386.A O no hydrogen 3.211 N/A THR 389.A OG1 TYR 386.A O no hydrogen 2.576 N/A TYR 390.A N MET 455.A O no hydrogen 3.183 N/A TYR 391.A N THR 389.A OG1 no hydrogen 3.371 N/A ALA 394.A N TYR 390.A O no hydrogen 2.967 N/A HIS 395.A N TYR 391.A O no hydrogen 3.013 N/A HIS 395.A ND1 GLY 370.A O no hydrogen 2.952 N/A PHE 396.A N VAL 392.A O no hydrogen 2.889 N/A PHE 396.A N VAL 393.A O no hydrogen 3.049 N/A HIS 397.A N VAL 393.A O no hydrogen 2.962 N/A TYR 398.A N ALA 394.A O no hydrogen 2.953 N/A TYR 398.A OH ASN 441.A OD1 no hydrogen 2.998 N/A VAL 399.A N HIS 395.A O no hydrogen 3.217 N/A MET 400.A N PHE 396.A O no hydrogen 2.827 N/A LEU 402.A N HIS 397.A O no hydrogen 2.960 N/A GLY 403.A N MET 400.A O no hydrogen 3.226 N/A ALA 404.A N VAL 399.A O no hydrogen 3.237 N/A VAL 405.A N MET 400.A O no hydrogen 2.760 N/A GLY 407.A N GLY 403.A O no hydrogen 2.929 N/A ILE 408.A N ALA 404.A O no hydrogen 2.872 N/A PHE 409.A N VAL 405.A O no hydrogen 2.914 N/A ALA 410.A N PHE 406.A O no hydrogen 2.822 N/A GLY 411.A N GLY 407.A O no hydrogen 2.855 N/A VAL 412.A N ILE 408.A O no hydrogen 2.896 N/A TYR 413.A N PHE 409.A O no hydrogen 2.948 N/A TYR 413.A OH HIS 432.A ND1 no hydrogen 2.876 N/A TYR 414.A N ALA 410.A O no hydrogen 2.880 N/A TYR 414.A OH THR 280.A OG1 no hydrogen 2.900 N/A TRP 415.A N GLY 411.A O no hydrogen 2.910 N/A TRP 415.A N VAL 412.A O no hydrogen 3.322 N/A TRP 415.A NE1 GLU 515.A OE2 no hydrogen 2.760 N/A ILE 416.A N VAL 412.A O no hydrogen 2.891 N/A LYS 418.A NZ PRO 504.A O no hydrogen 2.797 N/A LYS 418.A NZ GLU 515.A O no hydrogen 3.014 N/A LYS 418.A NZ SER 520.A OG no hydrogen 2.809 N/A MET 419.A N TRP 415.A O no hydrogen 2.904 N/A SER 420.A N ILE 416.A O no hydrogen 2.858 N/A SER 420.A OG ILE 416.A O no hydrogen 2.936 N/A GLY 421.A N GLY 417.A O no hydrogen 2.743 N/A ARG 422.A N SER 420.A OG no hydrogen 3.034 N/A GLN 423.A N LYS 499.A O no hydrogen 2.924 N/A TYR 424.A N GLN 423.A OE1 no hydrogen 3.330 N/A TYR 424.A OH GLU 426.A OE1 no hydrogen 3.104 N/A GLY 429.A N PRO 425.A O no hydrogen 3.251 N/A GLN 430.A N GLU 426.A O no hydrogen 2.925 N/A GLN 430.A NE2 PHE 353.A O no hydrogen 3.263 N/A GLN 430.A NE2 GLU 426.A OE2 no hydrogen 2.809 N/A LEU 431.A N TRP 427.A O no hydrogen 2.942 N/A HIS 432.A N ALA 428.A O no hydrogen 2.911 N/A HIS 432.A ND1 TYR 413.A OH no hydrogen 2.876 N/A PHE 433.A N GLY 429.A O no hydrogen 2.924 N/A TRP 434.A N GLN 430.A O no hydrogen 2.984 N/A MET 435.A N LEU 431.A O no hydrogen 2.918 N/A MET 436.A N HIS 432.A O no hydrogen 2.941 N/A PHE 437.A N PHE 433.A O no hydrogen 2.888 N/A ILE 438.A N TRP 434.A O no hydrogen 2.962 N/A GLY 439.A N MET 435.A O no hydrogen 2.935 N/A SER 440.A N MET 436.A O no hydrogen 2.859 N/A SER 440.A OG MET 436.A O no hydrogen 3.258 N/A SER 440.A OG SER 480.A OG no hydrogen 3.054 N/A ASN 441.A N PHE 437.A O no hydrogen 3.043 N/A ASN 441.A ND2 PHE 437.A O no hydrogen 2.748 N/A LEU 442.A N ILE 438.A O no hydrogen 2.960 N/A ILE 443.A N GLY 439.A O no hydrogen 2.900 N/A PHE 444.A N SER 440.A O no hydrogen 3.001 N/A PHE 445.A N ASN 441.A O no hydrogen 2.931 N/A GLN 447.A N PHE 444.A O no hydrogen 3.242 N/A HIS 448.A N PHE 445.A O no hydrogen 3.090 N/A HIS 448.A ND1 PHE 445.A O no hydrogen 3.145 N/A LEU 450.A N PRO 446.A O no hydrogen 2.998 N/A GLY 451.A N GLN 447.A O no hydrogen 2.835 N/A ARG 452.A N HIS 448.A O no hydrogen 2.971 N/A ARG 452.A NH2 TYR 386.A OH no hydrogen 3.062 N/A GLN 453.A N PHE 449.A O no hydrogen 2.990 N/A GLY 454.A N GLY 451.A O no hydrogen 3.212 N/A MET 455.A N LEU 450.A O no hydrogen 2.976 N/A ARG 457.A N ASP 388.A O no hydrogen 3.008 N/A TYR 462.A N ASP 461.A OD1 no hydrogen 2.858 N/A TYR 462.A OH LEU 41.A O no hydrogen 2.950 N/A GLU 465.A N GLU 465.A OE1 no hydrogen 3.192 N/A PHE 466.A N PRO 463.A O no hydrogen 3.007 N/A ALA 467.A N VAL 464.A O no hydrogen 2.940 N/A ASN 470.A ND2 PHE 466.A O no hydrogen 3.052 N/A ASN 471.A N ALA 467.A O no hydrogen 2.930 N/A ASN 471.A N TYR 468.A O no hydrogen 2.995 N/A ILE 472.A N TYR 468.A O no hydrogen 3.393 N/A SER 473.A N TRP 469.A O no hydrogen 2.953 N/A SER 473.A OG ILE 443.A O no hydrogen 2.759 N/A SER 474.A N ASN 470.A O no hydrogen 3.179 N/A SER 474.A OG ARG 38.A O no hydrogen 2.599 N/A SER 474.A OG ASN 470.A O no hydrogen 3.471 N/A ILE 475.A N ASN 471.A O no hydrogen 3.011 N/A GLY 476.A N ILE 472.A O no hydrogen 2.950 N/A ALA 477.A N SER 473.A O no hydrogen 3.110 N/A TYR 478.A N SER 474.A O no hydrogen 3.252 N/A TYR 478.A OH GLN 42.A OE1 no hydrogen 2.974 N/A ILE 479.A N ILE 475.A O no hydrogen 3.306 N/A SER 480.A N GLY 476.A O no hydrogen 2.888 N/A SER 480.A OG SER 440.A OG no hydrogen 3.054 N/A PHE 481.A N ALA 477.A O no hydrogen 2.710 N/A ALA 482.A N TYR 478.A O no hydrogen 2.804 N/A SER 483.A N ILE 479.A O no hydrogen 2.863 N/A SER 483.A OG SER 480.A O no hydrogen 2.314 N/A PHE 484.A N SER 480.A O no hydrogen 2.983 N/A LEU 485.A N PHE 481.A O no hydrogen 3.038 N/A PHE 486.A N ALA 482.A O no hydrogen 3.052 N/A PHE 487.A N SER 483.A O no hydrogen 2.781 N/A ILE 488.A N PHE 484.A O no hydrogen 2.932 N/A GLY 489.A N LEU 485.A O no hydrogen 3.058 N/A ILE 490.A N PHE 486.A O no hydrogen 2.840 N/A VAL 491.A N PHE 487.A O no hydrogen 2.894 N/A PHE 492.A N ILE 488.A O no hydrogen 3.002 N/A TYR 493.A N GLY 489.A O no hydrogen 2.653 N/A THR 494.A N ILE 490.A O no hydrogen 2.823 N/A THR 494.A OG1 ILE 490.A O no hydrogen 2.946 N/A LEU 495.A N VAL 491.A O no hydrogen 2.948 N/A ALA 497.A N TYR 493.A O no hydrogen 2.692 N/A GLY 498.A N THR 494.A O no hydrogen 2.953 N/A ARG 500.A NH1 GLY 421.A O no hydrogen 2.894 N/A ARG 500.A NH2 SER 520.A O no hydrogen 2.637 N/A VAL 501.A N GLY 421.A O no hydrogen 3.087 N/A ASN 505.A ND2 ASN 508.A O no hydrogen 2.773 N/A TYR 506.A OH TYR 414.A O no hydrogen 3.324 N/A TRP 507.A N ASN 505.A OD1 no hydrogen 2.993 N/A TRP 507.A NE1 TYR 414.A O no hydrogen 3.080 N/A ASN 508.A N ASN 505.A OD1 no hydrogen 3.257 N/A ASN 508.A ND2 THR 280.A O no hydrogen 3.417 N/A HIS 510.A N ASN 508.A OD1 no hydrogen 2.966 N/A ALA 511.A N ASN 508.A O no hydrogen 3.125 N/A THR 513.A OG1 GLU 515.A OE1 no hydrogen 2.613 N/A GLU 515.A N GLU 515.A OE1 no hydrogen 2.943 N/A TRP 516.A N THR 513.A O no hydrogen 3.075 N/A THR 517.A N LEU 514.A O no hydrogen 2.612 N/A THR 517.A OG1 LEU 514.A O no hydrogen 2.470 N/A LEU 518.A N GLU 515.A O no hydrogen 3.204 N/A SER 520.A OG VAL 503.A O no hydrogen 2.989 N/A LYS 532.A N ASP 535.A OD2 no hydrogen 3.357 N/A ASP 535.A N LYS 532.A O no hydrogen 2.815 N/A TRP 536.A N ARG 533.A O no hydrogen 3.385 N/A ASP 537.A N ARG 533.A O no hydrogen 2.595 N/A