Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4py2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N GLY 39.A O no hydrogen 3.538 N/A LYS 3.A NZ ASP 41.A OD2 no hydrogen 3.296 N/A TYR 4.A N ASP 41.A O no hydrogen 2.810 N/A TYR 5.A N ASN 255.A OD1 no hydrogen 2.887 N/A TYR 5.A OH TYR 235.A O no hydrogen 2.624 N/A ILE 6.A N TYR 43.A O no hydrogen 3.036 N/A THR 7.A N ALA 256.A O no hydrogen 3.161 N/A THR 7.A OG1 HIS 257.A ND1 no hydrogen 2.763 N/A THR 8.A N LEU 45.A O no hydrogen 3.024 N/A THR 8.A OG1 ALA 9.A O no hydrogen 2.674 N/A THR 8.A OG1 THR 46.A OG1 no hydrogen 2.663 N/A ALA 9.A N ILE 258.A O no hydrogen 3.142 N/A ALA 11.A N GLY 47.A O no hydrogen 2.934 N/A TYR 12.A OH HIS 51.A O no hydrogen 2.735 N/A HIS 18.A N.A HIS 21.A ND1 no hydrogen 3.124 N/A HIS 18.A N.B HIS 21.A ND1 no hydrogen 3.121 N/A ALA 22.A N HIS 18.A O.A no hydrogen 3.306 N/A ALA 22.A N HIS 18.A O.B no hydrogen 3.308 N/A TYR 23.A N ILE 19.A O no hydrogen 2.864 N/A GLU 24.A N GLY 20.A O no hydrogen 3.119 N/A LEU 25.A N HIS 21.A O no hydrogen 3.113 N/A ILE 26.A N ALA 22.A O no hydrogen 2.821 N/A ALA 27.A N TYR 23.A O no hydrogen 3.035 N/A THR 28.A N GLU 24.A O no hydrogen 3.042 N/A THR 28.A OG1 GLU 24.A O no hydrogen 2.713 N/A ASP 29.A N LEU 25.A O no hydrogen 2.756 N/A ALA 30.A N ILE 26.A O no hydrogen 2.905 N/A MET 31.A N ALA 27.A O no hydrogen 3.148 N/A ALA 32.A N THR 28.A O no hydrogen 2.960 N/A ARG 33.A N ASP 29.A O no hydrogen 2.901 N/A ARG 33.A NE ASP 29.A OD1 no hydrogen 3.371 N/A ARG 33.A NE ASP 29.A OD2 no hydrogen 2.800 N/A ARG 33.A NH2 ASN 85.A O no hydrogen 2.851 N/A PHE 34.A N ALA 30.A O no hydrogen 2.961 N/A GLN 35.A N MET 31.A O no hydrogen 3.202 N/A ARG 36.A N ALA 32.A O no hydrogen 3.092 N/A ARG 36.A NH1 SER 87.A OG no hydrogen 2.863 N/A ARG 36.A NH2 SER 87.A O no hydrogen 2.980 N/A ARG 36.A NH2 ASP 89.A OD2 no hydrogen 2.995 N/A LEU 37.A N ARG 33.A O no hydrogen 3.019 N/A ASN 38.A N GLN 35.A O no hydrogen 3.115 N/A ASN 38.A ND2 GLN 35.A OE1 no hydrogen 3.415 N/A GLY 39.A N ARG 36.A O no hydrogen 3.067 N/A MET 40.A N GLN 35.A O no hydrogen 2.957 N/A ASP 41.A N GLU 2.A O no hydrogen 2.758 N/A TYR 43.A N TYR 4.A O no hydrogen 2.850 N/A PHE 44.A N ASP 89.A OD2 no hydrogen 2.877 N/A LEU 45.A N ILE 6.A O no hydrogen 3.023 N/A THR 46.A OG1 THR 8.A OG1 no hydrogen 2.663 N/A THR 48.A N ILE 92.A O no hydrogen 2.833 N/A THR 48.A OG1 GLU 50.A OE2 no hydrogen 3.034 N/A THR 48.A OG1 THR 74.A OG1 no hydrogen 3.254 N/A ASP 49.A N ALA 11.A O no hydrogen 2.788 N/A GLU 50.A N THR 94.A OG1 no hydrogen 2.810 N/A HIS 51.A ND1 ASP 230.A OD2 no hydrogen 2.627 N/A GLY 52.A N TRP 213.A O no hydrogen 3.134 N/A MET 55.A N TYR 12.A OH no hydrogen 3.353 N/A LEU 56.A N GLY 52.A O no hydrogen 3.146 N/A GLN 57.A N ILE 53.A O no hydrogen 2.823 N/A SER 58.A N LYS 54.A O no hydrogen 3.022 N/A SER 58.A OG LYS 54.A O no hydrogen 3.262 N/A ALA 59.A N MET 55.A O no hydrogen 2.979 N/A ARG 60.A N LEU 56.A O no hydrogen 3.085 N/A LYS 61.A N GLN 57.A O no hydrogen 3.051 N/A GLU 62.A N SER 58.A O no hydrogen 3.145 N/A GLY 63.A N ARG 60.A O no hydrogen 2.985 N/A ILE 64.A N ALA 59.A O no hydrogen 3.089 N/A ARG 67.A NH1 ASP 71.A OD2 no hydrogen 2.827 N/A ASP 68.A N THR 65.A OG1 no hydrogen 3.121 N/A LEU 69.A N THR 65.A O no hydrogen 2.917 N/A ALA 70.A N PRO 66.A O no hydrogen 2.815 N/A ASP 71.A N ARG 67.A O no hydrogen 2.901 N/A ARG 72.A N ASP 68.A O no hydrogen 2.988 N/A ASN 73.A N LEU 69.A O no hydrogen 2.870 N/A ASN 73.A ND2 PRO 13.A O no hydrogen 2.852 N/A THR 74.A N ALA 70.A O no hydrogen 2.879 N/A THR 74.A OG1 THR 48.A OG1 no hydrogen 3.254 N/A THR 74.A OG1 GLU 50.A OE2 no hydrogen 2.521 N/A THR 74.A OG1 ALA 70.A O no hydrogen 3.224 N/A SER 75.A N ASP 71.A O no hydrogen 3.396 N/A SER 75.A OG ARG 72.A O no hydrogen 2.735 N/A ALA 76.A N ASN 73.A O no hydrogen 3.142 N/A ARG 78.A N THR 74.A O no hydrogen 2.915 N/A ARG 79.A N SER 75.A O no hydrogen 2.947 N/A MET 80.A N ALA 76.A O no hydrogen 2.838 N/A ALA 81.A N PHE 77.A O no hydrogen 3.034 N/A GLU 82.A N ARG 78.A O no hydrogen 3.093 N/A VAL 83.A N ARG 79.A O no hydrogen 2.875 N/A LEU 84.A N MET 80.A O no hydrogen 2.961 N/A ASN 85.A N GLU 82.A O no hydrogen 2.995 N/A SER 86.A N ALA 81.A O no hydrogen 3.056 N/A SER 86.A OG ASN 88.A OD1 no hydrogen 2.797 N/A SER 87.A N ASP 29.A OD1 no hydrogen 2.829 N/A SER 87.A OG ASP 29.A OD1 no hydrogen 2.579 N/A ASN 88.A ND2 ASP 90.A O no hydrogen 2.931 N/A ASP 89.A N PHE 44.A O no hydrogen 2.751 N/A TYR 91.A N ASP 90.A OD1 no hydrogen 2.603 N/A ILE 92.A N THR 46.A O no hydrogen 3.020 N/A ARG 93.A N GLU 96.A OE1 no hydrogen 3.471 N/A ARG 93.A NE GLU 50.A OE2 no hydrogen 2.719 N/A ARG 93.A NH1 ASP 71.A OD1 no hydrogen 3.104 N/A ARG 93.A NH2 GLU 50.A OE1 no hydrogen 3.365 N/A ARG 93.A NH2 GLU 50.A OE2 no hydrogen 2.990 N/A ARG 93.A NH2 ASP 71.A OD1 no hydrogen 2.749 N/A THR 94.A N THR 48.A O no hydrogen 3.071 N/A SER 95.A N GLU 50.A OE1 no hydrogen 3.366 N/A SER 95.A OG GLU 50.A OE1 no hydrogen 2.411 N/A GLU 96.A N ARG 93.A O no hydrogen 2.956 N/A ARG 98.A NE GLU 96.A OE1 no hydrogen 2.966 N/A ARG 98.A NH1 ASP 90.A OD2 no hydrogen 2.859 N/A ARG 98.A NH2 ASP 90.A OD1 no hydrogen 3.378 N/A ARG 98.A NH2 GLU 96.A OE1 no hydrogen 2.856 N/A HIS 99.A N GLU 96.A O no hydrogen 2.966 N/A HIS 99.A ND1 THR 237.A OG1 no hydrogen 2.845 N/A HIS 99.A NE2 ASP 230.A OD1 no hydrogen 2.842 N/A TYR 100.A N GLU 96.A O no hydrogen 3.163 N/A LYS 101.A N GLU 97.A O no hydrogen 2.945 N/A LYS 101.A NZ GLU 97.A OE2 no hydrogen 3.034 N/A ALA 102.A N ARG 98.A O no hydrogen 3.054 N/A SER 103.A N HIS 99.A O no hydrogen 2.884 N/A SER 103.A OG HIS 99.A O no hydrogen 2.984 N/A GLN 104.A N TYR 100.A O no hydrogen 3.055 N/A GLN 104.A NE2 PRO 216.A O no hydrogen 2.894 N/A ALA 105.A N LYS 101.A O no hydrogen 2.944 N/A ILE 106.A N ALA 102.A O no hydrogen 2.901 N/A TRP 107.A N SER 103.A O no hydrogen 2.959 N/A GLN 108.A N GLN 104.A O no hydrogen 3.044 N/A ALA 109.A N ALA 105.A O no hydrogen 2.923 N/A MET 110.A N ILE 106.A O no hydrogen 2.977 N/A VAL 111.A N TRP 107.A O no hydrogen 2.926 N/A ALA 112.A N GLN 108.A O no hydrogen 2.892 N/A ASN 113.A N ALA 109.A O no hydrogen 3.047 N/A ASN 113.A ND2 ASP 115.A OD2 no hydrogen 2.910 N/A GLY 114.A N VAL 111.A O no hydrogen 2.901 N/A ASP 115.A N MET 110.A O no hydrogen 2.983 N/A TYR 117.A N PHE 163.A O no hydrogen 3.073 N/A TYR 117.A OH ASP 203.A OD2 no hydrogen 2.620 N/A LYS 118.A NZ GLU 160.A OE2 no hydrogen 3.372 N/A LYS 118.A NZ ASP 220.A OD2 no hydrogen 2.717 N/A GLY 119.A N SER 161.A O no hydrogen 2.899 N/A TYR 121.A N GLU 159.A O no hydrogen 2.893 N/A GLY 123.A N VAL 157.A O no hydrogen 3.008 N/A TRP 124.A NE1 GLU 135.A OE1 no hydrogen 2.833 N/A TYR 125.A N GLU 155.A O no hydrogen 2.853 N/A SER 126.A N ALA 131.A O no hydrogen 2.937 N/A SER 126.A OG THR 152.A OG1 no hydrogen 2.728 N/A SER 126.A OG PRO 153.A O no hydrogen 3.381 N/A ASP 129.A N SER 126.A OG no hydrogen 2.889 N/A GLU 130.A N SER 126.A O no hydrogen 2.695 N/A ALA 131.A N SER 126.A O no hydrogen 3.404 N/A TYR 133.A N TRP 124.A O no hydrogen 2.829 N/A TYR 133.A OH ASP 129.A OD2 no hydrogen 2.463 N/A GLY 134.A N GLU 137.A OE1 no hydrogen 3.168 N/A GLU 137.A N GLY 134.A O no hydrogen 2.938 N/A THR 138.A N GLU 135.A O no hydrogen 2.968 N/A THR 138.A OG1 GLU 135.A O no hydrogen 2.739 N/A GLU 139.A N TYR 147.A O no hydrogen 2.961 N/A ARG 141.A N VAL 145.A O no hydrogen 2.923 N/A ARG 141.A NH1 GLU 139.A OE2 no hydrogen 3.193 N/A GLY 144.A N ARG 141.A O no hydrogen 2.843 N/A VAL 145.A N ASP 143.A OD1 no hydrogen 3.068 N/A ARG 146.A NH1 THR 138.A OG1 no hydrogen 2.836 N/A TYR 147.A N GLU 139.A O no hydrogen 2.862 N/A TYR 147.A OH ASP 143.A OD2 no hydrogen 2.615 N/A GLY 148.A N THR 152.A O no hydrogen 2.952 N/A GLY 151.A N GLY 148.A O no hydrogen 3.028 N/A THR 152.A OG1 SER 126.A OG no hydrogen 2.728 N/A THR 152.A OG1 ASP 129.A OD1 no hydrogen 2.707 N/A VAL 154.A N ARG 146.A O no hydrogen 2.932 N/A GLU 155.A N TYR 125.A O no hydrogen 2.891 N/A TRP 156.A NE1 GLU 158.A OE1 no hydrogen 3.082 N/A VAL 157.A N GLY 123.A O no hydrogen 3.043 N/A GLU 159.A N TYR 121.A O no hydrogen 2.975 N/A SER 161.A N GLY 119.A O no hydrogen 3.037 N/A SER 161.A OG TYR 162.A O no hydrogen 2.903 N/A SER 161.A OG SER 205.A OG no hydrogen 2.677 N/A SER 161.A OG SER 207.A O no hydrogen 3.347 N/A TYR 162.A N SER 207.A OG no hydrogen 2.856 N/A TYR 162.A OH ASP 220.A OD2 no hydrogen 2.610 N/A PHE 163.A N TYR 117.A O no hydrogen 2.835 N/A PHE 164.A N LEU 204.A O no hydrogen 2.880 N/A ARG 165.A N ASP 115.A O no hydrogen 2.800 N/A ARG 165.A NE GLY 114.A O no hydrogen 2.954 N/A LEU 166.A N PHE 164.A O no hydrogen 2.747 N/A SER 167.A N ASP 203.A OD1 no hydrogen 3.140 N/A SER 167.A OG ASP 203.A OD1 no hydrogen 2.585 N/A ALA 168.A N ARG 165.A O no hydrogen 2.992 N/A TYR 169.A N LEU 166.A O no hydrogen 2.847 N/A TYR 169.A OH ASP 115.A OD2 no hydrogen 2.586 N/A GLN 170.A NE2 VAL 197.A O no hydrogen 3.026 N/A LEU 173.A N TYR 169.A O no hydrogen 2.927 N/A LEU 174.A N GLN 170.A O no hydrogen 3.039 N/A ASP 175.A N ASP 171.A O no hydrogen 2.899 N/A LEU 176.A N LYS 172.A O no hydrogen 2.941 N/A TYR 177.A N LEU 173.A O no hydrogen 2.981 N/A TYR 177.A OH ALA 268.A O no hydrogen 2.633 N/A GLU 178.A N LEU 174.A O no hydrogen 2.999 N/A ASN 179.A N ASP 175.A O no hydrogen 2.883 N/A ASN 180.A N LEU 176.A O no hydrogen 2.854 N/A ASN 180.A ND2 LYS 284.A O no hydrogen 3.071 N/A GLY 182.A N ASN 180.A OD1 no hydrogen 3.184 N/A PHE 183.A N ASN 180.A O no hydrogen 3.024 N/A MET 185.A N VAL 286.A O no hydrogen 2.917 N/A ARG 189.A N PRO 186.A O no hydrogen 2.898 N/A ARG 189.A NE GLU 192.A OE1 no hydrogen 2.954 N/A ARG 189.A NH2 GLU 192.A OE1 no hydrogen 3.345 N/A ARG 189.A NH2 GLU 192.A OE2 no hydrogen 2.921 N/A ARG 190.A N PRO 186.A O no hydrogen 3.316 N/A ARG 190.A NH2 TYR 177.A O no hydrogen 2.704 N/A ASN 191.A N ALA 187.A O no hydrogen 3.065 N/A GLU 192.A N GLU 188.A O no hydrogen 3.168 N/A ILE 193.A N ARG 189.A O no hydrogen 2.917 N/A VAL 194.A N ARG 190.A O no hydrogen 2.820 N/A SER 195.A N ASN 191.A O no hydrogen 3.078 N/A SER 195.A OG ASN 191.A O no hydrogen 2.852 N/A PHE 196.A N GLU 192.A O no hydrogen 3.037 N/A VAL 197.A N ILE 193.A O no hydrogen 2.952 N/A LYS 198.A N VAL 194.A O no hydrogen 2.849 N/A SER 199.A N SER 195.A O no hydrogen 3.040 N/A SER 199.A N PHE 196.A O no hydrogen 3.200 N/A SER 199.A OG SER 195.A O no hydrogen 2.929 N/A GLY 200.A N VAL 197.A O no hydrogen 2.995 N/A LEU 204.A N PHE 164.A O no hydrogen 2.978 N/A SER 205.A OG SER 161.A OG no hydrogen 2.677 N/A ILE 206.A N TYR 162.A O no hydrogen 2.935 N/A SER 207.A OG HIS 223.A ND1 no hydrogen 2.849 N/A ARG 208.A N VAL 224.A O no hydrogen 2.825 N/A ARG 208.A NH1 SER 205.A OG no hydrogen 2.860 N/A ARG 208.A NH1 SER 207.A O no hydrogen 2.796 N/A TRP 213.A NE1 GLU 50.A O no hydrogen 2.856 N/A VAL 217.A N HIS 223.A O no hydrogen 2.922 N/A ASP 220.A N VAL 217.A O no hydrogen 3.086 N/A HIS 223.A N ASP 220.A O no hydrogen 2.968 N/A HIS 223.A ND1 SER 207.A OG no hydrogen 2.849 N/A HIS 223.A NE2 GLU 160.A OE2 no hydrogen 2.735 N/A VAL 224.A N ARG 208.A O no hydrogen 2.826 N/A MET 225.A N ILE 215.A O no hydrogen 2.860 N/A TYR 226.A N ILE 206.A O no hydrogen 2.960 N/A ALA 231.A N VAL 227.A O no hydrogen 2.874 N/A LEU 232.A N TRP 228.A O no hydrogen 3.323 N/A THR 233.A N VAL 229.A O no hydrogen 3.207 N/A THR 233.A OG1 VAL 229.A O no hydrogen 2.600 N/A ASN 234.A N ALA 231.A O no hydrogen 3.213 N/A ASN 234.A ND2 ALA 231.A O no hydrogen 2.863 N/A TYR 235.A N LEU 232.A O no hydrogen 3.488 N/A TYR 235.A OH HIS 267.A NE2 no hydrogen 2.728 N/A ILE 236.A N THR 233.A O no hydrogen 2.939 N/A THR 237.A N THR 233.A O no hydrogen 3.016 N/A THR 237.A OG1 HIS 99.A ND1 no hydrogen 2.845 N/A THR 237.A OG1 THR 233.A O no hydrogen 3.244 N/A ALA 238.A N ASN 234.A O no hydrogen 3.141 N/A LEU 239.A N ILE 236.A O no hydrogen 3.009 N/A GLY 240.A N THR 237.A O no hydrogen 2.992 N/A TYR 241.A N ILE 236.A O no hydrogen 3.277 N/A ASP 243.A N GLY 240.A O no hydrogen 2.852 N/A THR 245.A N ASP 243.A OD1 no hydrogen 2.989 N/A THR 245.A OG1 ASP 243.A OD1 no hydrogen 2.705 N/A THR 245.A OG1 ASP 243.A OD2 no hydrogen 3.516 N/A ASP 246.A N ASP 243.A O no hydrogen 3.098 N/A ARG 248.A N ASP 246.A OD1 no hydrogen 2.788 N/A ARG 248.A NE ASP 246.A OD1 no hydrogen 3.034 N/A ARG 248.A NH2 ASP 246.A OD2 no hydrogen 2.766 N/A TRP 249.A N ASP 246.A O no hydrogen 2.931 N/A TYR 251.A N ARG 248.A O no hydrogen 2.976 N/A TYR 251.A OH ASP 41.A OD1 no hydrogen 2.561 N/A TYR 251.A OH ASP 41.A OD2 no hydrogen 3.407 N/A TRP 252.A N TRP 249.A O no hydrogen 3.024 N/A TRP 252.A NE1 PRO 281.A O no hydrogen 2.829 N/A ASN 255.A N TYR 5.A O no hydrogen 2.790 N/A ALA 256.A N TYR 5.A O no hydrogen 3.271 N/A HIS 257.A N ARG 285.A O no hydrogen 2.869 N/A HIS 257.A ND1 THR 7.A OG1 no hydrogen 2.763 N/A ILE 258.A N THR 7.A O no hydrogen 2.948 N/A ILE 259.A N PHE 287.A O no hydrogen 2.940 N/A LYS 261.A N HIS 289.A O no hydrogen 3.138 N/A LYS 261.A NZ ASP 323.A OD1 no hydrogen 2.779 N/A LYS 261.A NZ ASP 323.A OD2 no hydrogen 2.971 N/A ILE 263.A N GLY 260.A O no hydrogen 3.105 N/A SER 264.A N LYS 261.A O no hydrogen 3.305 N/A SER 264.A OG LYS 261.A O no hydrogen 3.209 N/A PHE 266.A N ILE 263.A O no hydrogen 3.172 N/A HIS 267.A N ILE 263.A O no hydrogen 3.357 N/A HIS 267.A ND1 ILE 263.A O no hydrogen 3.176 N/A HIS 267.A NE2 TYR 235.A OH no hydrogen 2.728 N/A ALA 268.A N SER 264.A O no hydrogen 2.920 N/A VAL 269.A N ARG 265.A O no hydrogen 2.949 N/A TYR 270.A N ARG 265.A O no hydrogen 3.463 N/A TRP 271.A N PHE 266.A O no hydrogen 2.939 N/A TRP 271.A NE1 HIS 257.A NE2 no hydrogen 3.134 N/A ALA 273.A N VAL 269.A O no hydrogen 3.324 N/A PHE 274.A N TYR 270.A O no hydrogen 2.943 N/A LEU 275.A N TRP 271.A O no hydrogen 2.955 N/A MET 276.A N PRO 272.A O no hydrogen 2.961 N/A SER 277.A N ALA 273.A O no hydrogen 2.997 N/A SER 277.A OG ASP 115.A OD2 no hydrogen 2.483 N/A ALA 278.A N PHE 274.A O no hydrogen 2.949 N/A GLN 279.A N MET 276.A O no hydrogen 3.123 N/A GLN 279.A NE2 SER 277.A O no hydrogen 3.114 N/A LEU 280.A N LEU 275.A O no hydrogen 2.882 N/A LYS 284.A N ALA 254.A O no hydrogen 2.869 N/A ARG 285.A NE GLY 182.A O no hydrogen 2.832 N/A ARG 285.A NH1 ASP 391.A O no hydrogen 2.782 N/A ARG 285.A NH1 GLN 393.A OE1 no hydrogen 2.985 N/A VAL 286.A N PHE 183.A O no hydrogen 2.822 N/A PHE 287.A N HIS 257.A O no hydrogen 2.888 N/A ALA 288.A N MET 185.A O no hydrogen 2.942 N/A HIS 289.A N ILE 259.A O no hydrogen 2.849 N/A HIS 289.A ND1 GLY 290.A O no hydrogen 2.736 N/A HIS 289.A NE2 GLU 24.A OE1 no hydrogen 2.678 N/A PHE 291.A N ASP 323.A OD1 no hydrogen 2.841 N/A PHE 293.A N GLY 324.A O no hydrogen 3.000 N/A ARG 295.A N TYR 326.A O no hydrogen 3.085 N/A PHE 299.A N ASP 297.A OD1 no hydrogen 3.002 N/A LEU 301.A N ASP 297.A O no hydrogen 3.032 N/A VAL 302.A N PRO 298.A O no hydrogen 2.973 N/A GLU 303.A N PHE 299.A O no hydrogen 3.061 N/A ARG 304.A N GLU 300.A O no hydrogen 2.909 N/A TYR 305.A N LEU 301.A O no hydrogen 2.930 N/A TYR 305.A OH HIS 328.A ND1 no hydrogen 2.676 N/A GLY 306.A N VAL 302.A O no hydrogen 2.790 N/A GLN 309.A N GLN 309.A OE1 no hydrogen 2.774 N/A LEU 310.A N GLY 306.A O no hydrogen 3.150 N/A ARG 311.A N LEU 307.A O no hydrogen 2.848 N/A ARG 311.A NE PHE 450.A O no hydrogen 2.918 N/A ARG 311.A NH1 ASP 29.A OD2 no hydrogen 2.913 N/A ARG 311.A NH1 LEU 84.A O no hydrogen 2.951 N/A ARG 311.A NH2 ASP 29.A OD2 no hydrogen 2.910 N/A ARG 311.A NH2 PRO 449.A O no hydrogen 2.922 N/A TYR 312.A N ASP 308.A O no hydrogen 2.867 N/A TYR 312.A OH ASP 338.A OD2 no hydrogen 2.478 N/A PHE 313.A N GLN 309.A O no hydrogen 2.896 N/A LEU 314.A N LEU 310.A O no hydrogen 2.915 N/A MET 315.A N ARG 311.A O no hydrogen 3.182 N/A ARG 316.A N TYR 312.A O no hydrogen 2.896 N/A GLU 317.A N PHE 313.A O no hydrogen 2.998 N/A PHE 320.A N HIS 396.A ND1 no hydrogen 3.329 N/A GLN 322.A N PRO 319.A O no hydrogen 2.974 N/A GLY 324.A N PHE 291.A O no hydrogen 3.028 N/A TYR 326.A N PHE 293.A O no hydrogen 3.233 N/A HIS 328.A ND1 TYR 305.A OH no hydrogen 2.676 N/A ALA 330.A N SER 327.A OG no hydrogen 3.024 N/A ILE 331.A N SER 327.A O no hydrogen 2.993 N/A VAL 332.A N HIS 328.A O no hydrogen 2.985 N/A ASN 333.A N GLU 329.A O no hydrogen 2.972 N/A ARG 334.A N ALA 330.A O no hydrogen 2.940 N/A THR 335.A N ILE 331.A O no hydrogen 2.973 N/A THR 335.A OG1 ILE 331.A O no hydrogen 2.659 N/A THR 335.A OG1 VAL 332.A O no hydrogen 3.388 N/A ASN 336.A N VAL 332.A O no hydrogen 2.858 N/A ALA 337.A N ASN 333.A O no hydrogen 2.958 N/A ASP 338.A N ARG 334.A O no hydrogen 3.014 N/A LEU 339.A N THR 335.A O no hydrogen 2.978 N/A ALA 340.A N THR 335.A O no hydrogen 3.138 N/A ASN 341.A N ASN 336.A O no hydrogen 2.887 N/A ASN 341.A ND2 ASP 342.A OD1 no hydrogen 3.171 N/A ASP 342.A N ALA 337.A O no hydrogen 2.974 N/A LEU 343.A N ASP 338.A O no hydrogen 3.112 N/A GLY 344.A N LEU 339.A O no hydrogen 2.696 N/A ASN 345.A N ASN 341.A O no hydrogen 2.958 N/A ALA 347.A N LEU 343.A O no hydrogen 3.131 N/A GLN 348.A N GLY 344.A O no hydrogen 2.996 N/A ARG 349.A N ASN 345.A O no hydrogen 2.936 N/A SER 350.A N LEU 346.A O no hydrogen 3.080 N/A SER 350.A OG LEU 346.A O no hydrogen 2.750 N/A SER 350.A OG ALA 347.A O no hydrogen 3.347 N/A LEU 351.A N ALA 347.A O no hydrogen 2.859 N/A SER 352.A N GLN 348.A O no hydrogen 3.002 N/A SER 352.A OG GLN 348.A O no hydrogen 2.783 N/A SER 352.A OG ARG 349.A O no hydrogen 3.094 N/A MET 353.A N ARG 349.A O no hydrogen 3.194 N/A ILE 354.A N SER 350.A O no hydrogen 3.062 N/A ALA 355.A N LEU 351.A O no hydrogen 2.996 N/A LYS 356.A N SER 352.A O no hydrogen 2.760 N/A ASN 357.A N MET 353.A O no hydrogen 2.820 N/A CYS 358.A N ILE 354.A O no hydrogen 2.945 N/A GLY 360.A N ILE 354.A O no hydrogen 3.099 N/A LYS 361.A N CYS 358.A O no hydrogen 3.094 N/A LYS 361.A NZ ASP 484.A OD1 no hydrogen 2.944 N/A VAL 362.A N THR 483.A O no hydrogen 2.823 N/A GLY 366.A N THR 431.A OG1 no hydrogen 2.856 N/A SER 369.A N ASP 372.A OD2 no hydrogen 2.801 N/A ASP 372.A N SER 369.A OG no hydrogen 3.028 N/A LYS 373.A N SER 369.A O no hydrogen 3.028 N/A LYS 373.A NZ GLU 370.A OE1 no hydrogen 3.360 N/A ALA 374.A N GLU 370.A O no hydrogen 3.018 N/A ILE 375.A N ALA 371.A O no hydrogen 3.266 N/A LEU 376.A N ASP 372.A O no hydrogen 3.156 N/A ASP 377.A N LYS 373.A O no hydrogen 2.861 N/A GLN 378.A N ALA 374.A O no hydrogen 2.856 N/A ALA 379.A N ILE 375.A O no hydrogen 3.029 N/A ASP 380.A N LEU 376.A O no hydrogen 3.167 N/A ALA 381.A N ASP 377.A O no hydrogen 2.973 N/A ALA 382.A N GLN 378.A O no hydrogen 3.041 N/A LEU 383.A N ASP 380.A O no hydrogen 3.158 N/A THR 385.A N ALA 381.A O no hydrogen 3.046 N/A THR 385.A OG1 ALA 381.A O no hydrogen 3.206 N/A ALA 386.A N ALA 382.A O no hydrogen 2.751 N/A ARG 387.A N LEU 383.A O no hydrogen 2.972 N/A ARG 387.A NE ASN 38.A OD1 no hydrogen 2.808 N/A ARG 387.A NH1 GLU 384.A OE2 no hydrogen 2.643 N/A ARG 387.A NH2 ASN 38.A OD1 no hydrogen 3.125 N/A LYS 388.A N GLU 384.A O no hydrogen 3.141 N/A ALA 389.A N THR 385.A O no hydrogen 2.938 N/A MET 390.A N ALA 386.A O no hydrogen 2.882 N/A ASP 391.A N ARG 387.A O no hydrogen 3.080 N/A ASP 392.A N ALA 389.A O no hydrogen 3.007 N/A GLN 393.A N MET 390.A O no hydrogen 3.103 N/A GLN 393.A NE2 ASP 391.A O no hydrogen 3.660 N/A ALA 394.A N ALA 389.A O no hydrogen 2.930 N/A LEU 397.A N ALA 394.A O no hydrogen 2.983 N/A ALA 398.A N ALA 394.A O no hydrogen 3.125 N/A LEU 399.A N LEU 395.A O no hydrogen 2.920 N/A GLY 400.A N HIS 396.A O no hydrogen 2.800 N/A ALA 401.A N LEU 397.A O no hydrogen 3.008 N/A ILE 402.A N ALA 398.A O no hydrogen 3.137 N/A PHE 403.A N LEU 399.A O no hydrogen 2.815 N/A ALA 404.A N GLY 400.A O no hydrogen 2.907 N/A VAL 405.A N ALA 401.A O no hydrogen 3.393 N/A VAL 405.A N ILE 402.A O no hydrogen 3.081 N/A VAL 406.A N ILE 402.A O no hydrogen 3.314 N/A ALA 407.A N PHE 403.A O no hydrogen 2.901 N/A GLU 408.A N ALA 404.A O no hydrogen 3.004 N/A ALA 409.A N VAL 405.A O no hydrogen 2.741 N/A ASN 410.A N VAL 406.A O no hydrogen 3.000 N/A ASN 410.A ND2 ASP 342.A O no hydrogen 2.931 N/A ASN 410.A ND2 VAL 406.A O no hydrogen 3.074 N/A ARG 411.A N ALA 407.A O no hydrogen 3.212 N/A ARG 411.A NH1 GLU 408.A OE1 no hydrogen 2.553 N/A TYR 412.A N GLU 408.A O no hydrogen 2.813 N/A TYR 412.A OH ASP 372.A OD1 no hydrogen 2.627 N/A PHE 413.A N ALA 409.A O no hydrogen 2.826 N/A ALA 414.A N ASN 410.A O no hydrogen 2.967 N/A GLY 415.A N ARG 411.A O no hydrogen 2.869 N/A GLN 416.A N TYR 412.A O no hydrogen 2.978 N/A GLU 417.A N PHE 413.A O no hydrogen 3.216 N/A ALA 420.A N GLU 417.A O no hydrogen 2.968 N/A LEU 421.A N PRO 418.A O no hydrogen 3.023 N/A ARG 422.A N.A PRO 418.A O no hydrogen 3.201 N/A ARG 422.A N.A TRP 419.A O no hydrogen 3.302 N/A ARG 422.A N.B PRO 418.A O no hydrogen 3.202 N/A ARG 422.A N.B TRP 419.A O no hydrogen 3.305 N/A ARG 422.A NH1.B ASN 357.A OD1 no hydrogen 3.050 N/A THR 424.A OG1 ALA 420.A O no hydrogen 3.395 N/A ASP 425.A N LEU 421.A O no hydrogen 2.704 N/A ARG 428.A N ASP 425.A OD1 no hydrogen 3.260 N/A ARG 428.A NH1 ASP 372.A OD2 no hydrogen 2.697 N/A ARG 428.A NH2 ASP 372.A OD1 no hydrogen 2.947 N/A ARG 428.A NH2 ASP 372.A OD2 no hydrogen 3.305 N/A ARG 428.A NH2 GLN 416.A OE1 no hydrogen 2.949 N/A MET 429.A N ASP 425.A O no hydrogen 3.008 N/A GLY 430.A N PRO 426.A O no hydrogen 2.892 N/A THR 431.A N ALA 427.A O no hydrogen 3.033 N/A THR 431.A OG1 ALA 427.A O no hydrogen 3.211 N/A VAL 432.A N ARG 428.A O no hydrogen 3.040 N/A LEU 433.A N MET 429.A O no hydrogen 2.950 N/A TYR 434.A N GLY 430.A O no hydrogen 2.843 N/A TYR 434.A OH LEU 479.A O no hydrogen 2.578 N/A VAL 435.A N THR 431.A O no hydrogen 2.940 N/A THR 436.A N VAL 432.A O no hydrogen 2.938 N/A THR 436.A OG1 VAL 432.A O no hydrogen 2.805 N/A ALA 437.A N LEU 433.A O no hydrogen 2.962 N/A GLU 438.A N TYR 434.A O no hydrogen 2.843 N/A VAL 439.A N VAL 435.A O no hydrogen 2.856 N/A LEU 440.A N THR 436.A O no hydrogen 3.005 N/A ARG 441.A N ALA 437.A O no hydrogen 2.861 N/A ARG 441.A NE GLU 438.A OE1 no hydrogen 2.933 N/A ARG 441.A NH1 GLU 438.A OE2 no hydrogen 2.690 N/A ARG 441.A NH1 VAL 474.A O no hydrogen 2.950 N/A ARG 441.A NH2 ASP 473.A O no hydrogen 2.804 N/A ARG 442.A N GLU 438.A O no hydrogen 3.067 N/A ARG 442.A NE GLU 438.A OE2 no hydrogen 2.827 N/A ARG 442.A NH2 GLU 438.A OE2 no hydrogen 3.012 N/A VAL 443.A N VAL 439.A O no hydrogen 2.863 N/A GLY 444.A N LEU 440.A O no hydrogen 2.769 N/A ILE 445.A N ARG 441.A O no hydrogen 2.997 N/A MET 446.A N ARG 442.A O no hydrogen 3.113 N/A VAL 447.A N VAL 443.A O no hydrogen 2.909 N/A GLN 448.A N ILE 445.A O no hydrogen 3.423 N/A GLN 448.A NE2 ILE 445.A O no hydrogen 2.966 N/A GLN 448.A NE2 ARG 469.A O no hydrogen 2.903 N/A PHE 450.A N VAL 447.A O no hydrogen 2.991 N/A ILE 451.A N VAL 447.A O no hydrogen 3.032 N/A SER 454.A N ASP 308.A OD2 no hydrogen 2.876 N/A SER 454.A OG ASP 308.A OD2 no hydrogen 2.570 N/A ALA 455.A N ILE 451.A O no hydrogen 2.936 N/A GLU 456.A N PRO 452.A O no hydrogen 2.936 N/A LYS 457.A N GLN 453.A O no hydrogen 3.095 N/A LEU 458.A N SER 454.A O no hydrogen 2.967 N/A LEU 459.A N ALA 455.A O no hydrogen 2.891 N/A ASP 460.A N GLU 456.A O no hydrogen 2.849 N/A ILE 461.A N LYS 457.A O no hydrogen 2.990 N/A LEU 462.A N LEU 458.A O no hydrogen 3.219 N/A LEU 462.A N LEU 459.A O no hydrogen 3.151 N/A ALA 463.A N ASP 460.A O no hydrogen 2.932 N/A VAL 464.A N LEU 459.A O no hydrogen 3.057 N/A LYS 468.A N PRO 465.A O no hydrogen 3.024 N/A ARG 469.A NE VAL 464.A O no hydrogen 3.331 N/A ARG 469.A NH1 GLU 456.A O no hydrogen 3.369 N/A ARG 469.A NH1 ASP 460.A OD1 no hydrogen 3.305 N/A ARG 469.A NH2 ASP 460.A OD1 no hydrogen 2.768 N/A ARG 469.A NH2 VAL 464.A O no hydrogen 2.824 N/A GLN 470.A N ASP 473.A OD2 no hydrogen 2.991 N/A GLN 470.A NE2 ARG 36.A O no hydrogen 3.116 N/A PHE 471.A N LEU 37.A O no hydrogen 2.921 N/A ASP 473.A N GLN 470.A O no hydrogen 2.942 N/A VAL 474.A N PHE 471.A O no hydrogen 3.050 N/A ALA 476.A N ALA 472.A O no hydrogen 3.208 N/A SER 477.A N ASP 473.A O no hydrogen 2.991 N/A SER 477.A OG ASP 473.A OD1 no hydrogen 2.568 N/A LEU 479.A N GLU 438.A OE1 no hydrogen 2.988 N/A GLY 482.A N VAL 362.A O no hydrogen 2.796 N/A THR 483.A N ALA 480.A O no hydrogen 3.285 N/A THR 483.A OG1 ALA 480.A O no hydrogen 2.723 N/A LEU 485.A N GLY 360.A O no hydrogen 2.823 N/A TYR 495.A N ASN 336.A OD1 no hydrogen 2.931 N/A