Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qf4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASN 314.A OD1 no hydrogen 3.235 N/A ARG 9.A NH2 ASP 94.A OD2 no hydrogen 3.016 N/A TYR 10.A OH ASP 94.A OD2 no hydrogen 3.171 N/A LYS 12.A N ALA 8.A O no hydrogen 3.409 N/A TYR 14.A N LEU 11.A O no hydrogen 2.724 N/A TYR 14.A OH ASP 90.A OD1 no hydrogen 3.308 N/A TYR 14.A OH ASP 90.A OD2 no hydrogen 2.684 N/A TRP 15.A N LYS 12.A O no hydrogen 2.989 N/A ALA 18.A N TYR 14.A O no hydrogen 3.087 N/A VAL 19.A N TRP 15.A O no hydrogen 2.797 N/A VAL 19.A N ILE 16.A O no hydrogen 3.260 N/A LEU 20.A N ILE 16.A O no hydrogen 3.159 N/A ALA 21.A N PHE 17.A O no hydrogen 3.143 N/A LEU 23.A N VAL 19.A O no hydrogen 3.321 N/A PHE 24.A N LEU 20.A O no hydrogen 2.885 N/A VAL 26.A N PRO 22.A O no hydrogen 3.088 N/A VAL 27.A N LEU 23.A O no hydrogen 3.405 N/A GLU 28.A N PHE 24.A O no hydrogen 3.347 N/A VAL 29.A N MET 25.A O no hydrogen 2.878 N/A ILE 30.A N VAL 26.A O no hydrogen 2.745 N/A CYS 31.A N VAL 27.A O no hydrogen 3.342 N/A CYS 31.A SG VAL 27.A O no hydrogen 3.216 N/A CYS 31.A SG VAL 65.A O no hydrogen 3.357 N/A ASP 32.A N VAL 29.A O no hydrogen 3.095 N/A LEU 33.A N VAL 29.A O no hydrogen 2.813 N/A SER 34.A N ILE 30.A O no hydrogen 2.721 N/A SER 34.A OG ILE 30.A O no hydrogen 2.914 N/A GLN 35.A NE2 MET 62.A O no hydrogen 2.922 N/A THR 37.A N SER 34.A O no hydrogen 3.072 N/A THR 37.A OG1 TYR 281.A OH no hydrogen 2.581 N/A LEU 38.A N SER 34.A O no hydrogen 3.178 N/A LEU 39.A N GLN 35.A O no hydrogen 3.152 N/A ALA 40.A N PRO 36.A O no hydrogen 3.358 N/A ARG 41.A N THR 37.A O no hydrogen 2.954 N/A ILE 42.A N LEU 38.A O no hydrogen 3.115 N/A VAL 43.A N LEU 39.A O no hydrogen 3.280 N/A ASP 44.A N ALA 40.A O no hydrogen 2.927 N/A ILE 47.A N ILE 42.A O no hydrogen 2.851 N/A ALA 48.A N VAL 43.A O no hydrogen 3.160 N/A GLY 50.A N ILE 47.A O no hydrogen 3.159 N/A ASP 51.A N GLY 46.A O no hydrogen 2.967 N/A LEU 56.A N PHE 52.A O no hydrogen 2.687 N/A LYS 57.A N SER 53.A O no hydrogen 2.604 N/A THR 58.A N LEU 54.A O no hydrogen 2.843 N/A THR 58.A OG1 LEU 54.A O no hydrogen 3.334 N/A THR 58.A OG1 VAL 55.A O no hydrogen 3.481 N/A GLY 59.A N VAL 55.A O no hydrogen 2.796 N/A ILE 60.A N LEU 56.A O no hydrogen 3.066 N/A LEU 61.A N LYS 57.A O no hydrogen 2.853 N/A MET 62.A N THR 58.A O no hydrogen 3.015 N/A MET 62.A N GLY 59.A O no hydrogen 3.007 N/A LEU 63.A N GLY 59.A O no hydrogen 3.153 N/A ILE 64.A N ILE 60.A O no hydrogen 3.237 N/A VAL 65.A N LEU 61.A O no hydrogen 3.308 N/A ALA 66.A N MET 62.A O no hydrogen 3.163 N/A ALA 66.A N LEU 63.A O no hydrogen 3.003 N/A LEU 67.A N LEU 63.A O no hydrogen 3.117 N/A ILE 68.A N ILE 64.A O no hydrogen 2.945 N/A GLY 69.A N VAL 65.A O no hydrogen 2.961 N/A ALA 70.A N ALA 66.A O no hydrogen 2.981 N/A VAL 71.A N LEU 67.A O no hydrogen 2.932 N/A GLY 72.A N ILE 68.A O no hydrogen 2.949 N/A GLY 73.A N GLY 69.A O no hydrogen 3.037 N/A ILE 74.A N ALA 70.A O no hydrogen 3.193 N/A GLY 75.A N VAL 71.A O no hydrogen 3.198 N/A CYS 76.A N GLY 72.A O no hydrogen 3.060 N/A CYS 76.A SG ALA 21.A O no hydrogen 2.928 N/A CYS 76.A SG LEU 134.A O no hydrogen 3.262 N/A THR 77.A N GLY 73.A O no hydrogen 3.240 N/A VAL 78.A N ILE 74.A O no hydrogen 2.756 N/A PHE 79.A N GLY 75.A O no hydrogen 3.058 N/A ALA 80.A N CYS 76.A O no hydrogen 2.849 N/A SER 81.A N THR 77.A O no hydrogen 2.885 N/A SER 81.A OG THR 77.A O no hydrogen 2.994 N/A TYR 82.A N VAL 78.A O no hydrogen 3.225 N/A ALA 83.A N PHE 79.A O no hydrogen 3.167 N/A SER 84.A N ALA 80.A O no hydrogen 2.886 N/A SER 84.A OG ALA 80.A O no hydrogen 2.836 N/A SER 84.A OG SER 81.A O no hydrogen 3.047 N/A GLN 85.A N SER 81.A O no hydrogen 2.928 N/A ASN 86.A N TYR 82.A O no hydrogen 3.040 N/A PHE 87.A N ALA 83.A O no hydrogen 2.955 N/A GLY 88.A N SER 84.A O no hydrogen 3.191 N/A ALA 89.A N GLN 85.A O no hydrogen 2.917 N/A ASP 90.A N ASN 86.A O no hydrogen 2.819 N/A LEU 91.A N PHE 87.A O no hydrogen 2.725 N/A ARG 92.A N GLY 88.A O no hydrogen 2.575 N/A ARG 92.A NH2 GLN 127.A OE1 no hydrogen 3.253 N/A ARG 93.A N ALA 89.A O no hydrogen 2.847 N/A ASP 94.A N ASP 90.A O no hydrogen 3.207 N/A LEU 95.A N LEU 91.A O no hydrogen 2.951 N/A PHE 96.A N ARG 92.A O no hydrogen 2.835 N/A ARG 97.A N ARG 93.A O no hydrogen 2.814 N/A LYS 98.A N ASP 94.A O no hydrogen 2.858 N/A LYS 98.A NZ GLU 315.A O no hydrogen 2.619 N/A VAL 99.A N LEU 95.A O no hydrogen 3.312 N/A LEU 100.A N PHE 96.A O no hydrogen 3.049 N/A SER 101.A N LYS 98.A O no hydrogen 2.912 N/A SER 101.A OG LYS 98.A O no hydrogen 2.662 N/A PHE 102.A N VAL 99.A O no hydrogen 3.050 N/A SER 103.A N ASN 106.A OD1 no hydrogen 2.927 N/A ASN 106.A N SER 103.A O no hydrogen 3.239 N/A ASN 106.A ND2 GLU 315.A OE2 no hydrogen 3.258 N/A ASN 106.A ND2 LYS 316.A O no hydrogen 2.993 N/A VAL 107.A N SER 103.A O no hydrogen 3.341 N/A ASN 108.A N ILE 104.A O no hydrogen 2.914 N/A ARG 109.A N ASN 106.A O no hydrogen 2.926 N/A LEU 115.A N HIS 111.A O no hydrogen 3.198 N/A ILE 116.A N THR 112.A O no hydrogen 3.350 N/A THR 117.A N SER 113.A O no hydrogen 3.347 N/A THR 117.A OG1 SER 113.A O no hydrogen 3.569 N/A THR 117.A OG1 SER 114.A O no hydrogen 2.707 N/A ARG 118.A N SER 114.A O no hydrogen 2.963 N/A ARG 118.A NE SER 114.A OG no hydrogen 2.797 N/A ARG 118.A NH1 ARG 308.A O no hydrogen 3.044 N/A ARG 118.A NH1 GLU 311.A OE1 no hydrogen 2.794 N/A ARG 118.A NH2 SER 114.A OG no hydrogen 3.041 N/A LEU 119.A N LEU 115.A O no hydrogen 3.112 N/A LEU 119.A N ILE 116.A O no hydrogen 3.086 N/A THR 120.A N THR 117.A O no hydrogen 3.187 N/A THR 120.A OG1 ILE 116.A O no hydrogen 2.633 N/A ASN 121.A N THR 117.A O no hydrogen 2.827 N/A ASP 122.A N THR 117.A O no hydrogen 3.179 N/A THR 124.A N ASN 121.A O no hydrogen 2.588 N/A THR 124.A OG1 ASN 121.A O no hydrogen 2.797 N/A GLN 125.A N ASN 121.A O no hydrogen 3.033 N/A LEU 126.A N ASP 122.A O no hydrogen 3.067 N/A GLN 127.A N VAL 123.A O no hydrogen 3.049 N/A ASN 128.A N THR 124.A O no hydrogen 2.690 N/A LEU 129.A N GLN 125.A O no hydrogen 2.672 N/A VAL 130.A N LEU 126.A O no hydrogen 2.944 N/A MET 131.A N GLN 127.A O no hydrogen 3.041 N/A MET 132.A N ASN 128.A O no hydrogen 2.580 N/A LEU 133.A N LEU 129.A O no hydrogen 2.750 N/A LEU 134.A N MET 131.A O no hydrogen 3.269 N/A ARG 135.A N MET 132.A O no hydrogen 3.164 N/A ARG 135.A NH2 THR 77.A OG1 no hydrogen 2.854 N/A VAL 137.A N MET 132.A O no hydrogen 3.144 N/A VAL 138.A N ARG 135.A O no hydrogen 3.032 N/A ARG 139.A N ARG 135.A O no hydrogen 2.756 N/A ARG 139.A NH1 ASP 32.A OD2 no hydrogen 3.528 N/A ARG 139.A NH2 ASP 32.A OD2 no hydrogen 3.158 N/A ALA 140.A N ILE 136.A O no hydrogen 2.905 N/A LEU 142.A N VAL 138.A O no hydrogen 3.260 N/A LEU 143.A N ARG 139.A O no hydrogen 2.899 N/A PHE 144.A N ALA 140.A O no hydrogen 2.801 N/A VAL 145.A N PRO 141.A O no hydrogen 2.804 N/A GLY 146.A N LEU 142.A O no hydrogen 2.829 N/A GLY 147.A N LEU 143.A O no hydrogen 2.792 N/A ILE 148.A N PHE 144.A O no hydrogen 3.120 N/A VAL 149.A N VAL 145.A O no hydrogen 2.936 N/A MET 150.A N GLY 146.A O no hydrogen 2.957 N/A ALA 151.A N GLY 147.A O no hydrogen 3.097 N/A VAL 152.A N ILE 148.A O no hydrogen 3.006 N/A SER 153.A N VAL 149.A O no hydrogen 2.972 N/A SER 153.A OG MET 150.A O no hydrogen 2.611 N/A ILE 154.A N MET 150.A O no hydrogen 2.874 N/A ASN 155.A N ALA 151.A O no hydrogen 2.905 N/A SER 159.A N ASN 155.A O no hydrogen 3.408 N/A SER 159.A OG ASN 155.A O no hydrogen 3.387 N/A SER 159.A OG TYR 278.A OH no hydrogen 2.867 N/A SER 160.A N LYS 157.A O no hydrogen 3.245 N/A SER 160.A OG LYS 157.A O no hydrogen 3.061 N/A VAL 161.A N LEU 158.A O no hydrogen 2.825 N/A LEU 162.A N SER 159.A O no hydrogen 2.903 N/A PHE 164.A N VAL 161.A O no hydrogen 3.267 N/A LEU 165.A N VAL 161.A O no hydrogen 3.141 N/A LEU 165.A N LEU 162.A O no hydrogen 2.845 N/A ILE 166.A N LEU 162.A O no hydrogen 2.914 N/A VAL 170.A N ILE 166.A O no hydrogen 2.903 N/A LEU 171.A N PRO 167.A O no hydrogen 2.770 N/A LEU 172.A N PRO 168.A O no hydrogen 2.834 N/A PHE 173.A N ILE 169.A O no hydrogen 3.019 N/A VAL 174.A N VAL 170.A O no hydrogen 3.052 N/A TRP 175.A N LEU 171.A O no hydrogen 2.984 N/A LEU 176.A N LEU 172.A O no hydrogen 2.973 N/A THR 177.A N PHE 173.A O no hydrogen 3.015 N/A THR 177.A OG1 PHE 173.A O no hydrogen 3.338 N/A THR 177.A OG1 ASN 297.A OD1 no hydrogen 3.541 N/A LYS 178.A N VAL 174.A O no hydrogen 3.015 N/A LYS 178.A N TRP 175.A O no hydrogen 3.229 N/A LYS 179.A N LEU 176.A O no hydrogen 3.172 N/A GLY 180.A N LEU 176.A O no hydrogen 2.621 N/A ASN 181.A N THR 177.A O no hydrogen 3.398 N/A PHE 184.A N GLY 180.A O no hydrogen 2.806 N/A ARG 185.A N ASN 181.A O no hydrogen 3.128 N/A LYS 186.A N PRO 182.A O no hydrogen 3.040 N/A ILE 187.A N LEU 183.A O no hydrogen 3.270 N/A GLN 188.A N PHE 184.A O no hydrogen 2.983 N/A GLU 189.A N ARG 185.A O no hydrogen 3.089 N/A SER 190.A N LYS 186.A O no hydrogen 3.230 N/A SER 190.A OG LYS 186.A O no hydrogen 3.313 N/A SER 190.A OG SER 227.A O no hydrogen 3.511 N/A SER 190.A OG SER 227.A OG no hydrogen 3.158 N/A THR 191.A N ILE 187.A O no hydrogen 2.875 N/A THR 191.A OG1 ILE 187.A O no hydrogen 3.256 N/A THR 191.A OG1 GLN 188.A O no hydrogen 2.934 N/A ASP 192.A N GLN 188.A O no hydrogen 3.333 N/A GLU 193.A N GLU 189.A O no hydrogen 3.163 N/A VAL 194.A N SER 190.A O no hydrogen 3.225 N/A ASN 195.A N THR 191.A O no hydrogen 3.258 N/A ARG 196.A N ASP 192.A O no hydrogen 2.976 N/A VAL 197.A N GLU 193.A O no hydrogen 3.261 N/A VAL 198.A N VAL 194.A O no hydrogen 3.137 N/A ARG 199.A N ASN 195.A O no hydrogen 2.590 N/A GLU 200.A N ARG 196.A O no hydrogen 3.158 N/A ASN 201.A N VAL 197.A O no hydrogen 3.220 N/A LEU 202.A N VAL 198.A O no hydrogen 3.303 N/A LEU 202.A N ARG 199.A O no hydrogen 3.044 N/A LEU 203.A N ARG 199.A O no hydrogen 2.770 N/A GLY 204.A N GLU 200.A O no hydrogen 2.927 N/A VAL 208.A N GLY 204.A O no hydrogen 2.826 N/A ARG 209.A N VAL 205.A O no hydrogen 2.750 N/A ALA 210.A N ARG 206.A O no hydrogen 2.845 N/A PHE 211.A N VAL 207.A O no hydrogen 2.962 N/A PHE 211.A N VAL 208.A O no hydrogen 3.153 N/A ARG 212.A N ARG 209.A O no hydrogen 2.732 N/A ARG 213.A N VAL 208.A O no hydrogen 3.234 N/A GLU 214.A N GLU 214.A OE2 no hydrogen 2.784 N/A GLU 217.A N ARG 213.A O no hydrogen 3.048 N/A GLU 217.A N GLU 214.A O no hydrogen 2.814 N/A ASN 218.A N GLU 214.A O no hydrogen 2.914 N/A GLU 219.A N GLU 215.A O no hydrogen 3.251 N/A ASN 220.A N TYR 216.A O no hydrogen 2.923 N/A PHE 221.A N GLU 217.A O no hydrogen 2.908 N/A PHE 221.A N ASN 218.A O no hydrogen 2.900 N/A ARG 222.A N ASN 218.A O no hydrogen 2.803 N/A ARG 222.A NE GLU 219.A OE1 no hydrogen 3.192 N/A ARG 222.A NH1 GLU 226.A OE2 no hydrogen 2.845 N/A ARG 222.A NH2 GLU 219.A OE1 no hydrogen 3.158 N/A ARG 222.A NH2 GLU 219.A OE2 no hydrogen 2.690 N/A ASN 225.A N PHE 221.A O no hydrogen 2.866 N/A GLU 226.A N ARG 222.A O no hydrogen 2.903 N/A SER 227.A N LYS 223.A O no hydrogen 3.340 N/A SER 227.A OG SER 190.A OG no hydrogen 3.158 N/A LEU 228.A N ALA 224.A O no hydrogen 3.166 N/A ARG 229.A N ASN 225.A O no hydrogen 3.234 N/A ARG 230.A N GLU 226.A O no hydrogen 2.746 N/A SER 231.A N SER 227.A O no hydrogen 2.789 N/A SER 231.A OG LEU 228.A O no hydrogen 3.361 N/A ILE 232.A N LEU 228.A O no hydrogen 3.057 N/A ILE 232.A N ARG 229.A O no hydrogen 3.266 N/A ILE 233.A N ARG 229.A O no hydrogen 3.080 N/A SER 234.A N ARG 230.A O no hydrogen 3.381 N/A SER 234.A OG ARG 230.A O no hydrogen 3.383 N/A ALA 235.A N SER 231.A O no hydrogen 3.481 N/A PHE 236.A N ILE 232.A O no hydrogen 2.785 N/A SER 237.A N ILE 233.A O no hydrogen 2.712 N/A SER 237.A OG ILE 233.A O no hydrogen 3.064 N/A SER 237.A OG SER 234.A O no hydrogen 2.791 N/A ILE 239.A N ALA 235.A O no hydrogen 3.489 N/A VAL 240.A N PHE 236.A O no hydrogen 2.916 N/A PHE 241.A N LEU 238.A O no hydrogen 3.044 N/A ALA 242.A N LEU 238.A O no hydrogen 2.904 N/A LEU 243.A N ILE 239.A O no hydrogen 3.368 N/A LEU 245.A N PHE 241.A O no hydrogen 3.336 N/A PHE 246.A N ALA 242.A O no hydrogen 2.790 N/A ILE 247.A N LEU 243.A O no hydrogen 3.045 N/A PHE 248.A N PRO 244.A O no hydrogen 3.022 N/A ILE 249.A N LEU 245.A O no hydrogen 3.242 N/A VAL 250.A N PHE 246.A O no hydrogen 3.223 N/A ASN 251.A N ILE 247.A O no hydrogen 3.038 N/A MET 252.A N PHE 248.A O no hydrogen 2.765 N/A GLY 253.A N ILE 249.A O no hydrogen 2.827 N/A MET 254.A N VAL 250.A O no hydrogen 3.174 N/A ILE 255.A N ASN 251.A O no hydrogen 3.121 N/A ALA 256.A N MET 252.A O no hydrogen 2.800 N/A VAL 257.A N GLY 253.A O no hydrogen 2.949 N/A VAL 257.A N MET 254.A O no hydrogen 2.805 N/A LEU 258.A N MET 254.A O no hydrogen 2.818 N/A TRP 259.A N ILE 255.A O no hydrogen 2.797 N/A PHE 260.A N ALA 256.A O no hydrogen 3.163 N/A GLY 261.A N VAL 257.A O no hydrogen 2.831 N/A VAL 263.A N TRP 259.A O no hydrogen 3.376 N/A VAL 265.A N GLY 261.A O no hydrogen 3.190 N/A ARG 266.A N GLY 262.A O no hydrogen 3.186 N/A ARG 266.A NE ASN 267.A OD1 no hydrogen 3.359 N/A ASN 267.A N VAL 263.A O no hydrogen 2.877 N/A ASN 268.A N VAL 265.A O no hydrogen 2.917 N/A GLN 269.A N LEU 264.A O no hydrogen 2.781 N/A MET 270.A N LEU 264.A O no hydrogen 3.161 N/A GLY 273.A N ASP 44.A OD1 no hydrogen 2.947 N/A SER 274.A N ASP 44.A OD2 no hydrogen 3.047 N/A ILE 275.A N ILE 272.A O no hydrogen 3.199 N/A MET 276.A N ILE 272.A O no hydrogen 3.413 N/A ALA 277.A N GLY 273.A O no hydrogen 2.951 N/A TYR 278.A N SER 274.A O no hydrogen 3.017 N/A TYR 278.A OH SER 159.A OG no hydrogen 2.867 N/A THR 279.A N ILE 275.A O no hydrogen 3.176 N/A THR 279.A OG1 ILE 275.A O no hydrogen 3.546 N/A THR 279.A OG1 MET 276.A O no hydrogen 2.565 N/A ASN 280.A N MET 276.A O no hydrogen 3.449 N/A TYR 281.A N ALA 277.A O no hydrogen 3.173 N/A TYR 281.A OH LEU 33.A O no hydrogen 2.750 N/A TYR 281.A OH THR 37.A OG1 no hydrogen 2.581 N/A LEU 282.A N TYR 278.A O no hydrogen 2.750 N/A MET 283.A N THR 279.A O no hydrogen 3.370 N/A GLN 284.A N ASN 280.A O no hydrogen 2.975 N/A GLN 284.A NE2 ASP 32.A O no hydrogen 3.495 N/A ILE 285.A N TYR 281.A O no hydrogen 2.990 N/A MET 286.A N LEU 282.A O no hydrogen 3.403 N/A PHE 287.A N MET 283.A O no hydrogen 2.906 N/A SER 288.A N GLN 284.A O no hydrogen 2.976 N/A SER 288.A OG GLN 284.A O no hydrogen 2.896 N/A LEU 289.A N ILE 285.A O no hydrogen 3.107 N/A MET 290.A N MET 286.A O no hydrogen 2.981 N/A MET 290.A N PHE 287.A O no hydrogen 2.859 N/A MET 291.A N PHE 287.A O no hydrogen 2.901 N/A ILE 292.A N SER 288.A O no hydrogen 2.782 N/A GLY 293.A N LEU 289.A O no hydrogen 3.330 N/A ASN 294.A N MET 290.A O no hydrogen 3.160 N/A ILE 295.A N MET 291.A O no hydrogen 2.970 N/A LEU 296.A N ILE 292.A O no hydrogen 3.353 N/A ASN 297.A N GLY 293.A O no hydrogen 3.364 N/A PHE 298.A N ASN 294.A O no hydrogen 3.225 N/A ILE 299.A N ILE 295.A O no hydrogen 2.934 N/A ALA 302.A N PHE 298.A O no hydrogen 2.896 N/A SER 303.A N ILE 299.A O no hydrogen 2.847 N/A ALA 304.A N ARG 301.A O no hydrogen 2.935 N/A SER 305.A N ALA 302.A O no hydrogen 3.052 N/A SER 305.A OG ASP 122.A OD1 no hydrogen 3.302 N/A ALA 306.A N ALA 302.A O no hydrogen 3.311 N/A LYS 307.A N SER 303.A O no hydrogen 3.233 N/A ARG 308.A N ALA 304.A O no hydrogen 3.256 N/A ARG 308.A NH1 ASP 122.A OD2 no hydrogen 2.701 N/A VAL 309.A N SER 305.A O no hydrogen 3.016 N/A LEU 310.A N ALA 306.A O no hydrogen 2.893 N/A GLU 311.A N LYS 307.A O no hydrogen 2.896 N/A VAL 312.A N ARG 308.A O no hydrogen 3.392 N/A LEU 313.A N VAL 309.A O no hydrogen 3.071 N/A ASN 314.A N GLU 311.A O no hydrogen 3.225 N/A GLU 315.A N VAL 312.A O no hydrogen 3.401 N/A LYS 316.A NZ ASN 314.A O no hydrogen 2.696 N/A ALA 318.A N ASN 106.A OD1 no hydrogen 3.007 N/A LEU 326.A N THR 402.A O no hydrogen 2.801 N/A LEU 328.A N ASP 407.A OD2 no hydrogen 2.865 N/A GLU 332.A N ASP 396.A OD2 no hydrogen 2.645 N/A GLY 333.A N ASP 396.A OD1 no hydrogen 3.057 N/A SER 334.A N ASP 396.A OD1 no hydrogen 3.049 N/A VAL 335.A N VAL 359.A O no hydrogen 3.054 N/A SER 336.A N GLU 394.A O no hydrogen 3.038 N/A PHE 337.A N PHE 357.A O no hydrogen 2.958 N/A GLU 338.A N ARG 392.A O no hydrogen 2.936 N/A ASN 339.A N ASN 356.A OD1 no hydrogen 2.948 N/A VAL 340.A N VAL 355.A O no hydrogen 3.117 N/A GLU 341.A N ARG 390.A O no hydrogen 2.736 N/A PHE 342.A N LEU 352.A O no hydrogen 2.903 N/A TYR 344.A OH THR 377.A OG1 no hydrogen 2.841 N/A THR 348.A OG1 PHE 345.A O no hydrogen 3.456 N/A THR 348.A OG1 ASP 349.A O no hydrogen 3.398 N/A VAL 351.A N PHE 342.A O no hydrogen 2.765 N/A LEU 352.A N PHE 342.A O no hydrogen 3.208 N/A SER 353.A N GLY 546.A O no hydrogen 3.332 N/A VAL 355.A N VAL 340.A O no hydrogen 3.211 N/A ASN 356.A ND2 GLY 354.A O no hydrogen 3.575 N/A PHE 357.A N PHE 337.A O no hydrogen 3.326 N/A GLY 362.A N THR 523.A OG1 no hydrogen 3.072 N/A SER 363.A N LYS 360.A O no hydrogen 3.088 N/A SER 363.A OG LYS 360.A O no hydrogen 2.386 N/A VAL 365.A N THR 524.A O no hydrogen 2.717 N/A ALA 366.A N LYS 539.A O no hydrogen 2.868 N/A VAL 367.A N ILE 526.A O no hydrogen 2.822 N/A LEU 368.A N LEU 541.A O no hydrogen 2.755 N/A SER 373.A OG GLU 370.A O no hydrogen 3.140 N/A SER 376.A OG ASP 497.A OD1 no hydrogen 3.429 N/A SER 376.A OG ASP 497.A OD2 no hydrogen 2.476 N/A THR 377.A OG1 TYR 344.A OH no hydrogen 2.841 N/A LEU 378.A N GLY 374.A O no hydrogen 2.769 N/A MET 379.A N LYS 375.A O no hydrogen 3.055 N/A ASN 380.A N SER 376.A O no hydrogen 2.876 N/A LEU 381.A N THR 377.A O no hydrogen 3.244 N/A LEU 381.A N LEU 378.A O no hydrogen 3.388 N/A ILE 382.A N MET 379.A O no hydrogen 3.104 N/A ARG 384.A NE ASP 387.A OD1 no hydrogen 3.019 N/A ARG 384.A NE ASP 387.A OD2 no hydrogen 3.112 N/A ARG 384.A NH1 GLU 320.A O no hydrogen 3.365 N/A ARG 384.A NH2 GLU 320.A O no hydrogen 3.245 N/A ARG 384.A NH2 ASP 387.A OD2 no hydrogen 3.128 N/A LEU 385.A N ASN 380.A O no hydrogen 3.329 N/A LEU 385.A N PRO 383.A O no hydrogen 2.411 N/A GLU 389.A N GLU 341.A O no hydrogen 2.869 N/A ARG 390.A N GLU 341.A O no hydrogen 3.252 N/A ARG 392.A N GLU 338.A O no hydrogen 3.155 N/A ARG 392.A NE GLU 394.A OE2 no hydrogen 2.962 N/A GLU 394.A N SER 336.A O no hydrogen 2.826 N/A VAL 395.A N LEU 398.A O no hydrogen 2.931 N/A ASP 396.A N SER 334.A O no hydrogen 2.912 N/A VAL 400.A N VAL 393.A O no hydrogen 3.178 N/A ARG 401.A N ASP 399.A OD1 no hydrogen 3.219 N/A ARG 401.A NH2 GLY 391.A O no hydrogen 3.555 N/A THR 402.A N ASP 399.A O no hydrogen 2.775 N/A THR 402.A OG1 ASP 399.A O no hydrogen 3.014 N/A VAL 403.A N VAL 400.A O no hydrogen 3.069 N/A LYS 404.A N LEU 326.A O no hydrogen 2.901 N/A LEU 405.A N GLU 321.A OE1 no hydrogen 2.840 N/A LEU 408.A N LYS 404.A O no hydrogen 3.140 N/A ARG 409.A N LEU 405.A O no hydrogen 2.896 N/A ARG 409.A NH2 ARG 384.A O no hydrogen 2.766 N/A GLY 410.A N LYS 406.A O no hydrogen 2.856 N/A HIS 411.A N ASP 407.A O no hydrogen 3.084 N/A HIS 411.A N LEU 408.A O no hydrogen 3.110 N/A HIS 411.A NE2 LEU 328.A O no hydrogen 2.824 N/A ILE 412.A N LEU 408.A O no hydrogen 3.133 N/A SER 413.A N VAL 493.A O no hydrogen 2.959 N/A SER 413.A OG ALA 486.A O no hydrogen 2.801 N/A VAL 415.A N ILE 495.A O no hydrogen 2.791 N/A PHE 422.A N ASN 429.A OD1 no hydrogen 2.888 N/A GLY 424.A N VAL 466.A O no hydrogen 3.409 N/A THR 425.A N GLU 428.A OE1 no hydrogen 2.792 N/A ILE 426.A N SER 464.A O no hydrogen 3.045 N/A LYS 427.A N TYR 462.A O no hydrogen 3.009 N/A LYS 427.A NZ ASP 439.A OD1 no hydrogen 3.006 N/A LYS 427.A NZ ASP 439.A OD2 no hydrogen 3.492 N/A GLU 428.A N THR 425.A OG1 no hydrogen 2.878 N/A ASN 429.A N THR 425.A O no hydrogen 3.168 N/A ASN 429.A ND2 PHE 422.A O no hydrogen 3.071 N/A ASN 429.A ND2 THR 425.A O no hydrogen 2.865 N/A LEU 430.A N ILE 426.A O no hydrogen 2.914 N/A LYS 431.A N LYS 427.A O no hydrogen 3.096 N/A LYS 431.A N GLU 428.A O no hydrogen 3.182 N/A TRP 432.A N ASN 429.A O no hydrogen 3.167 N/A ARG 434.A N LYS 431.A O no hydrogen 2.950 N/A THR 438.A N GLU 441.A OE1 no hydrogen 2.933 N/A GLU 441.A N THR 438.A OG1 no hydrogen 3.059 N/A ILE 442.A N THR 438.A O no hydrogen 3.218 N/A ILE 442.A N ASP 439.A O no hydrogen 2.977 N/A VAL 443.A N ASP 439.A O no hydrogen 2.970 N/A GLU 444.A N ASP 440.A O no hydrogen 2.867 N/A ALA 445.A N GLU 441.A O no hydrogen 3.276 N/A ALA 446.A N ILE 442.A O no hydrogen 2.825 N/A LYS 447.A N VAL 443.A O no hydrogen 2.794 N/A ILE 448.A N GLU 444.A O no hydrogen 3.013 N/A ALA 449.A N ALA 445.A O no hydrogen 2.741 N/A GLN 450.A N LYS 447.A O no hydrogen 2.863 N/A GLN 450.A NE2 LYS 447.A O no hydrogen 2.943 N/A ILE 451.A N ALA 446.A O no hydrogen 2.839 N/A HIS 452.A N ALA 446.A O no hydrogen 3.166 N/A ILE 455.A N ILE 451.A O no hydrogen 3.061 N/A ILE 456.A N HIS 452.A O no hydrogen 2.989 N/A SER 457.A N PHE 454.A O no hydrogen 3.260 N/A SER 457.A OG PHE 454.A O no hydrogen 2.665 N/A LEU 458.A N ILE 455.A O no hydrogen 2.905 N/A SER 464.A N GLY 461.A O no hydrogen 3.138 N/A VAL 466.A N GLY 424.A O no hydrogen 2.562 N/A GLU 467.A N ASN 472.A OD1 no hydrogen 3.369 N/A GLY 470.A N GLU 467.A O no hydrogen 3.098 N/A ARG 471.A NH2 GLU 467.A OE1 no hydrogen 3.442 N/A ASN 472.A ND2 ARG 465.A O no hydrogen 2.931 N/A PHE 473.A N ASN 472.A OD1 no hydrogen 3.073 N/A SER 474.A OG GLN 477.A OE1 no hydrogen 2.513 N/A GLY 476.A N SER 474.A OG no hydrogen 3.234 N/A GLN 479.A N GLY 475.A O no hydrogen 2.784 N/A ARG 480.A N GLY 476.A O no hydrogen 2.802 N/A LEU 481.A N GLN 477.A O no hydrogen 2.655 N/A SER 482.A N LYS 478.A O no hydrogen 3.148 N/A SER 482.A N GLN 479.A O no hydrogen 3.181 N/A SER 482.A OG GLN 479.A O no hydrogen 2.847 N/A ILE 483.A N GLN 479.A O no hydrogen 3.279 N/A ALA 484.A N ARG 480.A O no hydrogen 3.020 N/A ARG 485.A N LEU 481.A O no hydrogen 2.983 N/A ARG 485.A NH2 VAL 420.A O no hydrogen 2.628 N/A ALA 486.A N SER 482.A O no hydrogen 2.527 N/A LEU 487.A N ILE 483.A O no hydrogen 2.900 N/A VAL 488.A N ALA 484.A O no hydrogen 2.968 N/A LYS 489.A NZ ARG 409.A O no hydrogen 3.566 N/A LYS 489.A NZ ILE 412.A O no hydrogen 2.770 N/A LYS 490.A N LEU 487.A O no hydrogen 2.917 N/A LYS 490.A NZ TYR 518.A OH no hydrogen 3.180 N/A LYS 492.A N HIS 411.A O no hydrogen 3.019 N/A VAL 493.A N HIS 411.A O no hydrogen 3.421 N/A LEU 494.A N THR 523.A O no hydrogen 2.855 N/A ILE 495.A N SER 413.A O no hydrogen 2.953 N/A LEU 496.A N PHE 525.A O no hydrogen 3.005 N/A ASP 497.A N VAL 415.A O no hydrogen 3.217 N/A ASP 498.A N ILE 527.A O no hydrogen 3.115 N/A SER 501.A OG ASP 498.A O no hydrogen 3.507 N/A SER 502.A N GLN 479.A OE1 no hydrogen 2.870 N/A VAL 503.A N THR 500.A O no hydrogen 2.991 N/A GLU 508.A N ASP 504.A O no hydrogen 2.965 N/A LYS 509.A N PRO 505.A O no hydrogen 3.329 N/A ILE 511.A N THR 507.A O no hydrogen 3.249 N/A LEU 512.A N GLU 508.A O no hydrogen 3.199 N/A ASP 513.A N LYS 509.A O no hydrogen 3.099 N/A GLY 514.A N ARG 510.A O no hydrogen 2.869 N/A LEU 515.A N ILE 511.A O no hydrogen 2.862 N/A LYS 516.A N LEU 512.A O no hydrogen 3.156 N/A TYR 518.A N LEU 515.A O no hydrogen 2.685 N/A THR 519.A N LEU 515.A O no hydrogen 2.454 N/A THR 519.A OG1 LEU 515.A O no hydrogen 2.711 N/A CYS 522.A SG PRO 491.A O no hydrogen 3.618 N/A CYS 522.A SG THR 523.A O no hydrogen 3.528 N/A CYS 522.A SG THR 524.A OG1 no hydrogen 3.736 N/A THR 523.A N LYS 492.A O no hydrogen 3.304 N/A THR 523.A OG1 GLY 333.A O no hydrogen 2.762 N/A THR 524.A N SER 363.A O no hydrogen 2.788 N/A THR 524.A OG1 CYS 522.A O no hydrogen 3.450 N/A PHE 525.A N LEU 494.A O no hydrogen 2.936 N/A ILE 526.A N VAL 365.A O no hydrogen 2.752 N/A ILE 527.A N LEU 496.A O no hydrogen 2.995 N/A THR 528.A N VAL 367.A O no hydrogen 2.976 N/A THR 528.A OG1 ILE 527.A O no hydrogen 3.120 N/A GLN 529.A NE2 THR 371.A OG1 no hydrogen 3.298 N/A ILE 531.A N GLN 571.A OE1 no hydrogen 3.460 N/A THR 533.A OG1 GLU 508.A OE2 no hydrogen 2.920 N/A ALA 534.A N LYS 530.A O no hydrogen 3.236 N/A LEU 535.A N ILE 531.A O no hydrogen 2.947 N/A LEU 536.A N THR 533.A O no hydrogen 3.374 N/A ALA 537.A N ALA 534.A O no hydrogen 3.075 N/A ILE 540.A N GLY 552.A O no hydrogen 2.679 N/A LEU 541.A N ALA 366.A O no hydrogen 2.742 N/A VAL 542.A N GLY 550.A O no hydrogen 2.879 N/A LEU 543.A N LEU 368.A O no hydrogen 2.855 N/A HIS 544.A N LYS 547.A O no hydrogen 2.876 N/A LYS 547.A N HIS 544.A O no hydrogen 3.151 N/A ALA 549.A N VAL 542.A O no hydrogen 2.674 N/A GLY 552.A N ILE 540.A O no hydrogen 3.067 N/A HIS 554.A ND1 TYR 564.A OH no hydrogen 3.068 N/A LEU 557.A N THR 553.A O no hydrogen 2.629 N/A LEU 558.A N HIS 554.A O no hydrogen 2.805 N/A GLU 559.A N LYS 555.A O no hydrogen 3.369 N/A HIS 560.A N GLU 556.A O no hydrogen 2.904 N/A CYS 561.A N LEU 557.A O no hydrogen 2.751 N/A TYR 564.A OH HIS 554.A ND1 no hydrogen 3.068 N/A ARG 565.A N CYS 561.A O no hydrogen 2.992 N/A GLU 566.A N LYS 562.A O no hydrogen 2.716 N/A ILE 567.A N PRO 563.A O no hydrogen 2.877 N/A TYR 568.A N TYR 564.A O no hydrogen 2.681 N/A GLU 569.A N ARG 565.A O no hydrogen 2.696 N/A SER 570.A N GLU 566.A O no hydrogen 3.243 N/A SER 570.A OG ILE 567.A O no hydrogen 2.530 N/A GLN 571.A N ILE 567.A O no hydrogen 3.283 N/A GLN 571.A N TYR 568.A O no hydrogen 3.200 N/A GLN 571.A NE2 GLN 529.A O no hydrogen 2.838 N/A PHE 572.A N TYR 568.A O no hydrogen 2.996 N/A