Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xpi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 SER 2.A OG no hydrogen 3.156 N/A GLN 3.A NE2 GLU 124.A OE1 no hydrogen 2.840 N/A LEU 4.A N ASN 1.A O no hydrogen 3.309 N/A SER 5.A N ASP 118.A OD2 no hydrogen 2.832 N/A SER 5.A OG ASP 118.A OD1 no hydrogen 2.756 N/A SER 5.A OG ASP 118.A OD2 no hydrogen 3.026 N/A THR 8.A OG1 ASP 118.A OD2 no hydrogen 3.018 N/A ILE 9.A N THR 6.A O no hydrogen 2.684 N/A SER 10.A N LEU 7.A O no hydrogen 3.195 N/A MET 12.A N SER 10.A OG no hydrogen 3.271 N/A THR 13.A N SER 10.A O no hydrogen 3.077 N/A THR 13.A OG1 SER 10.A O no hydrogen 3.046 N/A TYR 14.A N PRO 11.A O no hydrogen 3.028 N/A LEU 15.A N MET 12.A O no hydrogen 3.306 N/A ALA 16.A N THR 13.A O no hydrogen 2.923 N/A SER 17.A OG GLU 19.A OE1 no hydrogen 3.161 N/A TYR 21.A N SER 17.A O no hydrogen 3.205 N/A LEU 22.A N ARG 18.A O no hydrogen 2.963 N/A ARG 23.A N GLU 19.A O no hydrogen 2.973 N/A ARG 23.A NE ASP 54.A OD1 no hydrogen 3.013 N/A ARG 23.A NE ASP 54.A OD2 no hydrogen 3.352 N/A ARG 23.A NH1 ASP 20.A OD1 no hydrogen 3.223 N/A ARG 23.A NH2 ASP 54.A OD2 no hydrogen 2.947 N/A LEU 24.A N ASP 20.A O no hydrogen 3.252 N/A TRP 25.A N TYR 21.A O no hydrogen 3.079 N/A ARG 26.A N LEU 22.A O no hydrogen 2.702 N/A ARG 26.A NH1 ASP 54.A OD1 no hydrogen 3.042 N/A HIS 27.A N ARG 23.A O no hydrogen 2.782 N/A ASP 28.A N LEU 24.A O no hydrogen 3.063 N/A ALA 29.A N TRP 25.A O no hydrogen 3.021 N/A LEU 30.A N ARG 26.A O no hydrogen 3.101 N/A MET 31.A N HIS 27.A O no hydrogen 3.070 N/A GLN 32.A N ASP 28.A O no hydrogen 2.844 N/A GLN 32.A N ALA 29.A O no hydrogen 2.969 N/A GLN 33.A N LEU 30.A O no hydrogen 2.730 N/A GLN 34.A N ALA 29.A O no hydrogen 2.958 N/A ALA 38.A N GLN 34.A O no hydrogen 3.195 N/A ALA 39.A N TYR 35.A O no hydrogen 3.040 N/A PHE 40.A N LYS 36.A O no hydrogen 3.023 N/A VAL 41.A N CYS 37.A O no hydrogen 2.911 N/A GLY 42.A N ALA 38.A O no hydrogen 2.827 N/A GLU 43.A N ALA 39.A O no hydrogen 2.947 N/A VAL 45.A N VAL 41.A O no hydrogen 3.136 N/A LEU 46.A N GLY 42.A O no hydrogen 3.248 N/A ASP 47.A N GLU 43.A O no hydrogen 3.062 N/A ILE 48.A N LYS 44.A O no hydrogen 3.114 N/A THR 49.A N VAL 45.A O no hydrogen 2.939 N/A THR 49.A OG1 VAL 45.A O no hydrogen 2.573 N/A THR 49.A OG1 ASP 54.A OD2 no hydrogen 2.787 N/A GLY 50.A N LEU 46.A O no hydrogen 2.904 N/A ASN 51.A N THR 49.A OG1 no hydrogen 3.308 N/A ASP 54.A N ASN 51.A O no hydrogen 2.822 N/A ALA 55.A N ASN 51.A O no hydrogen 3.044 N/A PHE 56.A N PRO 52.A O no hydrogen 2.774 N/A TRP 57.A N ASN 53.A O no hydrogen 3.166 N/A TRP 57.A NE1 ILE 9.A O no hydrogen 2.908 N/A LEU 58.A N ASP 54.A O no hydrogen 2.976 N/A ALA 59.A N ALA 55.A O no hydrogen 2.862 N/A GLN 60.A N PHE 56.A O no hydrogen 2.851 N/A VAL 61.A N TRP 57.A O no hydrogen 3.319 N/A TYR 62.A N LEU 58.A O no hydrogen 3.287 N/A TYR 62.A OH GLU 43.A OE2 no hydrogen 2.892 N/A CYS 63.A N ALA 59.A O no hydrogen 3.062 N/A CYS 63.A SG ALA 59.A O no hydrogen 3.783 N/A CYS 64.A N GLN 60.A O no hydrogen 3.043 N/A CYS 64.A SG GLN 60.A O no hydrogen 3.397 N/A THR 65.A N VAL 61.A O no hydrogen 3.212 N/A THR 65.A N TYR 62.A O no hydrogen 3.101 N/A THR 65.A OG1 VAL 61.A O no hydrogen 3.452 N/A GLY 66.A N CYS 63.A O no hydrogen 3.096 N/A ASP 67.A N TYR 62.A O no hydrogen 2.879 N/A TYR 68.A N GLY 66.A O no hydrogen 2.941 N/A ALA 71.A N ASP 67.A O no hydrogen 3.110 N/A LYS 72.A N TYR 68.A O no hydrogen 2.870 N/A LYS 72.A NZ ALA 69.A O no hydrogen 3.516 N/A CYS 73.A N ALA 69.A O no hydrogen 2.815 N/A LEU 74.A N ARG 70.A O no hydrogen 2.982 N/A LEU 75.A N ALA 71.A O no hydrogen 2.953 N/A THR 76.A N LYS 72.A O no hydrogen 2.944 N/A THR 76.A N CYS 73.A O no hydrogen 2.920 N/A THR 76.A OG1 LYS 72.A O no hydrogen 3.093 N/A LYS 77.A N CYS 73.A O no hydrogen 2.875 N/A ASP 79.A N THR 76.A O no hydrogen 2.925 N/A ASN 82.A N ASP 79.A O no hydrogen 2.993 N/A ARG 83.A N LEU 80.A O no hydrogen 2.613 N/A ARG 83.A NH1 GLU 78.A O no hydrogen 3.342 N/A CYS 87.A N SER 84.A OG no hydrogen 3.324 N/A CYS 87.A SG PRO 52.A O no hydrogen 3.568 N/A CYS 87.A SG SER 84.A OG no hydrogen 3.408 N/A ARG 88.A N SER 84.A O no hydrogen 3.119 N/A ARG 88.A NE LEU 107.A O no hydrogen 2.913 N/A ARG 88.A NH1 ASN 82.A OD1 no hydrogen 3.418 N/A ARG 88.A NH2 ASN 82.A OD1 no hydrogen 3.355 N/A TYR 89.A N SER 85.A O no hydrogen 2.805 N/A LEU 90.A N ALA 86.A O no hydrogen 2.889 N/A ALA 91.A N CYS 87.A O no hydrogen 2.927 N/A ALA 92.A N ARG 88.A O no hydrogen 2.977 N/A PHE 93.A N TYR 89.A O no hydrogen 2.834 N/A CYS 94.A N LEU 90.A O no hydrogen 2.969 N/A CYS 94.A SG TYR 68.A O no hydrogen 3.813 N/A CYS 94.A SG LEU 90.A O no hydrogen 3.335 N/A LEU 95.A N ALA 91.A O no hydrogen 2.992 N/A VAL 96.A N ALA 92.A O no hydrogen 2.895 N/A LYS 97.A N PHE 93.A O no hydrogen 3.075 N/A LEU 98.A N LEU 95.A O no hydrogen 2.926 N/A TYR 99.A N VAL 96.A O no hydrogen 2.979 N/A ASP 100.A N LEU 95.A O no hydrogen 2.977 N/A GLY 103.A N ASP 100.A OD1 no hydrogen 2.915 N/A ALA 104.A N ASP 100.A O no hydrogen 3.090 N/A LEU 105.A N TRP 101.A O no hydrogen 3.112 N/A ASN 106.A N GLN 102.A O no hydrogen 2.789 N/A LEU 107.A N GLY 103.A O no hydrogen 3.098 N/A LEU 108.A N ALA 104.A O no hydrogen 2.893 N/A GLY 109.A N LEU 105.A O no hydrogen 2.688 N/A ASN 112.A ND2 GLU 124.A OE2 no hydrogen 3.069 N/A ASN 112.A ND2 GLU 150.A OE1 no hydrogen 2.840 N/A PHE 114.A N ASN 112.A OD1 no hydrogen 3.023 N/A GLN 117.A NE2 SER 186.A O no hydrogen 3.560 N/A GLY 120.A N ASP 118.A OD1 no hydrogen 2.828 N/A LYS 122.A N ASP 155.A OD2 no hydrogen 3.118 N/A LYS 122.A NZ GLN 3.A OE1 no hydrogen 3.281 N/A LEU 123.A N LEU 4.A O no hydrogen 2.859 N/A GLU 124.A N SER 2.A O no hydrogen 2.785 N/A ALA 125.A N LYS 122.A O no hydrogen 2.697 N/A SER 126.A N LYS 122.A O no hydrogen 3.251 N/A MET 127.A N LEU 123.A O no hydrogen 3.007 N/A CYS 128.A N GLU 124.A O no hydrogen 3.383 N/A CYS 128.A SG GLU 124.A O no hydrogen 3.705 N/A CYS 128.A SG GLU 150.A OE2 no hydrogen 3.471 N/A TYR 129.A N ALA 125.A O no hydrogen 3.026 N/A LEU 130.A N SER 126.A O no hydrogen 3.025 N/A ARG 131.A N MET 127.A O no hydrogen 2.820 N/A ARG 131.A NH1 GLY 109.A O no hydrogen 3.275 N/A GLY 132.A N CYS 128.A O no hydrogen 2.804 N/A GLN 133.A N TYR 129.A O no hydrogen 2.917 N/A VAL 134.A N LEU 130.A O no hydrogen 3.086 N/A TYR 135.A N ARG 131.A O no hydrogen 3.131 N/A TYR 135.A OH GLU 110.A O no hydrogen 2.781 N/A TYR 135.A OH GLU 110.A OE2 no hydrogen 3.429 N/A THR 136.A N GLY 132.A O no hydrogen 3.024 N/A THR 136.A OG1 GLY 132.A O no hydrogen 2.975 N/A THR 136.A OG1 TYR 148.A OH no hydrogen 3.186 N/A ASN 137.A N GLN 133.A O no hydrogen 3.306 N/A ASN 137.A ND2 GLN 133.A O no hydrogen 2.758 N/A LEU 138.A N VAL 134.A O no hydrogen 2.956 N/A SER 139.A N THR 136.A O no hydrogen 3.021 N/A ASN 140.A N TYR 135.A O no hydrogen 2.828 N/A ARG 143.A N ASN 140.A O no hydrogen 3.063 N/A ARG 143.A NE TYR 135.A OH no hydrogen 3.172 N/A ARG 143.A NH2 TYR 135.A OH no hydrogen 2.853 N/A ALA 144.A N ASN 140.A O no hydrogen 3.001 N/A LYS 145.A N PHE 141.A O no hydrogen 3.106 N/A GLU 146.A N ASP 142.A O no hydrogen 3.281 N/A CYS 147.A N ARG 143.A O no hydrogen 2.712 N/A CYS 147.A SG ARG 143.A O no hydrogen 2.770 N/A TYR 148.A N ALA 144.A O no hydrogen 2.773 N/A TYR 148.A OH GLN 133.A OE1 no hydrogen 2.890 N/A TYR 148.A OH THR 136.A OG1 no hydrogen 3.186 N/A LYS 149.A N LYS 145.A O no hydrogen 2.797 N/A GLU 150.A N GLU 146.A O no hydrogen 2.908 N/A MET 153.A N LYS 149.A O no hydrogen 3.026 N/A VAL 154.A N GLU 150.A O no hydrogen 2.867 N/A ASP 155.A N ALA 151.A O no hydrogen 2.914 N/A ALA 156.A N THR 187.A OG1 no hydrogen 2.808 N/A LYS 157.A N ASP 155.A OD1 no hydrogen 2.700 N/A LYS 157.A NZ GLY 120.A O no hydrogen 3.075 N/A LYS 157.A NZ ASP 155.A OD1 no hydrogen 3.007 N/A LYS 157.A NZ ASP 155.A OD2 no hydrogen 2.926 N/A LYS 157.A NZ THR 187.A O no hydrogen 2.916 N/A CYS 158.A N ASP 155.A O no hydrogen 3.060 N/A TYR 159.A N LYS 157.A O no hydrogen 2.667 N/A ALA 161.A N CYS 158.A O no hydrogen 3.247 N/A PHE 162.A N CYS 158.A O no hydrogen 3.504 N/A ASP 163.A N TYR 159.A O no hydrogen 2.807 N/A GLN 164.A N GLU 160.A O no hydrogen 3.050 N/A LEU 165.A N ALA 161.A O no hydrogen 2.795 N/A VAL 166.A N PHE 162.A O no hydrogen 2.863 N/A SER 167.A N ASP 163.A O no hydrogen 2.847 N/A SER 167.A OG ASP 163.A OD2 no hydrogen 3.415 N/A ASN 168.A N GLN 164.A O no hydrogen 2.779 N/A HIS 169.A N VAL 166.A O no hydrogen 3.329 N/A LEU 170.A N LEU 165.A O no hydrogen 3.086 N/A THR 172.A N GLU 175.A OE1 no hydrogen 2.419 N/A GLU 175.A N THR 172.A OG1 no hydrogen 3.239 N/A GLU 176.A N THR 172.A O no hydrogen 3.015 N/A TRP 177.A N ALA 173.A O no hydrogen 3.346 N/A ASP 178.A N ASP 174.A O no hydrogen 2.949 N/A LEU 179.A N GLU 175.A O no hydrogen 2.908 N/A VAL 180.A N GLU 176.A O no hydrogen 3.141 N/A LEU 181.A N TRP 177.A O no hydrogen 2.960 N/A LYS 182.A N ASP 178.A O no hydrogen 3.233 N/A LYS 182.A N LEU 179.A O no hydrogen 3.076 N/A LEU 183.A N LEU 179.A O no hydrogen 3.128 N/A TYR 185.A OH VAL 180.A O no hydrogen 2.727 N/A SER 186.A N ASN 184.A OD1 no hydrogen 3.329 N/A THR 187.A N ASN 184.A O no hydrogen 3.141 N/A THR 187.A OG1 ASN 184.A O no hydrogen 3.048 N/A TYR 188.A N TYR 185.A O no hydrogen 2.810 N/A TYR 188.A OH ASP 192.A OD1 no hydrogen 2.780 N/A SER 189.A N TYR 185.A O no hydrogen 2.895 N/A ASP 192.A N SER 189.A O no hydrogen 3.123 N/A ASP 192.A N SER 189.A OG no hydrogen 3.022 N/A PHE 195.A N ASP 192.A O no hydrogen 3.207 N/A ARG 197.A N ALA 193.A O no hydrogen 3.111 N/A SER 198.A N ALA 194.A O no hydrogen 2.973 N/A SER 198.A OG ALA 194.A O no hydrogen 2.622 N/A LEU 199.A N PHE 195.A O no hydrogen 3.115 N/A TYR 200.A N LEU 196.A O no hydrogen 3.022 N/A TYR 200.A OH ALA 156.A O no hydrogen 2.757 N/A MET 201.A N ARG 197.A O no hydrogen 3.013 N/A LEU 202.A N SER 198.A O no hydrogen 3.204 N/A LEU 202.A N LEU 199.A O no hydrogen 3.246 N/A LYS 203.A N TYR 200.A O no hydrogen 2.795 N/A LYS 203.A NZ ASP 231.A OD1 no hydrogen 2.757 N/A LEU 204.A N MET 201.A O no hydrogen 3.094 N/A ASN 205.A ND2 GLY 364.A O no hydrogen 2.934 N/A LYS 206.A NZ LEU 204.A O no hydrogen 3.075 N/A THR 207.A N ASN 205.A OD1 no hydrogen 2.944 N/A THR 207.A OG1 ASN 205.A OD1 no hydrogen 3.042 N/A SER 208.A N ASN 205.A OD1 no hydrogen 3.056 N/A SER 208.A OG ASN 205.A OD1 no hydrogen 3.163 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 3.004 N/A LEU 213.A N HIS 209.A O no hydrogen 3.178 N/A ARG 214.A N ASP 211.A O no hydrogen 2.968 N/A ARG 215.A N ASP 211.A O no hydrogen 3.382 N/A ALA 216.A N GLU 212.A O no hydrogen 3.263 N/A GLU 217.A N LEU 213.A O no hydrogen 3.136 N/A ASP 218.A N ARG 214.A O no hydrogen 3.110 N/A TYR 219.A N ARG 215.A O no hydrogen 2.708 N/A LEU 220.A N ALA 216.A O no hydrogen 3.083 N/A SER 221.A N GLU 217.A O no hydrogen 3.225 N/A SER 221.A OG GLU 217.A O no hydrogen 3.307 N/A SER 221.A OG GLU 217.A OE2 no hydrogen 2.998 N/A SER 222.A N ASP 218.A O no hydrogen 3.021 N/A SER 222.A N TYR 219.A O no hydrogen 3.211 N/A SER 222.A OG TYR 219.A O no hydrogen 2.663 N/A ILE 223.A N LEU 220.A O no hydrogen 3.232 N/A GLY 225.A N GLU 227.A OE1 no hydrogen 2.952 N/A LEU 226.A N ILE 223.A O no hydrogen 3.318 N/A SER 229.A N LEU 226.A O no hydrogen 2.637 N/A LEU 233.A N SER 229.A O no hydrogen 3.022 N/A LEU 234.A N SER 230.A O no hydrogen 3.026 N/A CYS 235.A N ASP 231.A O no hydrogen 3.366 N/A LYS 236.A NZ GLU 217.A OE2 no hydrogen 2.442 N/A ALA 237.A N LEU 233.A O no hydrogen 2.880 N/A ASP 238.A N LEU 234.A O no hydrogen 3.152 N/A THR 239.A N CYS 235.A O no hydrogen 2.852 N/A THR 239.A OG1 CYS 235.A O no hydrogen 2.964 N/A LEU 240.A N LYS 236.A O no hydrogen 2.722 N/A PHE 241.A N ALA 237.A O no hydrogen 2.755 N/A VAL 242.A N ASP 238.A O no hydrogen 3.026 N/A ARG 243.A N THR 239.A O no hydrogen 3.298 N/A SER 244.A N PHE 241.A O no hydrogen 2.933 N/A ARG 245.A N LEU 240.A O no hydrogen 2.928 N/A ARG 245.A NH1 LYS 432.A O no hydrogen 3.144 N/A VAL 249.A N ARG 245.A O no hydrogen 3.096 N/A LEU 250.A N PHE 246.A O no hydrogen 3.165 N/A ALA 251.A N ILE 247.A O no hydrogen 2.914 N/A ILE 252.A N ASP 248.A O no hydrogen 3.178 N/A THR 253.A N VAL 249.A O no hydrogen 2.934 N/A THR 254.A N LEU 250.A O no hydrogen 2.831 N/A THR 254.A OG1 LEU 250.A O no hydrogen 2.819 N/A LYS 255.A N ALA 251.A O no hydrogen 3.283 N/A ILE 256.A N ILE 252.A O no hydrogen 3.054 N/A LEU 257.A N THR 253.A O no hydrogen 3.231 N/A GLU 258.A N THR 254.A O no hydrogen 3.160 N/A GLU 258.A N LYS 255.A O no hydrogen 3.311 N/A ILE 259.A N LYS 255.A O no hydrogen 3.200 N/A ASP 260.A N ILE 256.A O no hydrogen 2.882 N/A ASN 263.A N ASP 260.A O no hydrogen 2.853 N/A VAL 266.A N ASN 263.A OD1 no hydrogen 3.307 N/A TYR 267.A N LEU 264.A O no hydrogen 3.171 N/A HIS 270.A N VAL 266.A O no hydrogen 3.136 N/A LEU 271.A N TYR 267.A O no hydrogen 2.614 N/A ALA 272.A N PRO 268.A O no hydrogen 2.892 N/A SER 273.A N LEU 269.A O no hydrogen 3.065 N/A SER 273.A OG LEU 269.A O no hydrogen 2.950 N/A LEU 274.A N HIS 270.A O no hydrogen 2.948 N/A HIS 275.A N LEU 271.A O no hydrogen 2.914 N/A GLU 276.A N ALA 272.A O no hydrogen 3.160 N/A SER 277.A N SER 273.A O no hydrogen 3.311 N/A SER 277.A N LEU 274.A O no hydrogen 3.173 N/A SER 277.A OG SER 273.A O no hydrogen 3.250 N/A GLY 278.A N HIS 275.A O no hydrogen 3.082 N/A GLU 279.A N LEU 274.A O no hydrogen 3.120 N/A LYS 280.A N GLY 278.A O no hydrogen 3.117 N/A LEU 283.A N GLU 279.A O no hydrogen 2.977 N/A TYR 284.A N LYS 280.A O no hydrogen 2.674 N/A LEU 285.A N ASN 281.A O no hydrogen 3.035 N/A ILE 286.A N LYS 282.A O no hydrogen 3.179 N/A SER 287.A N LEU 283.A O no hydrogen 3.096 N/A SER 287.A OG LEU 283.A O no hydrogen 2.503 N/A SER 287.A OG TYR 284.A O no hydrogen 3.149 N/A ASN 288.A N TYR 284.A O no hydrogen 3.227 N/A ASP 289.A N LEU 285.A O no hydrogen 3.232 N/A LEU 290.A N ILE 286.A O no hydrogen 2.997 N/A VAL 291.A N SER 287.A O no hydrogen 3.000 N/A ASP 292.A N ASN 288.A O no hydrogen 3.148 N/A ARG 293.A N ASP 289.A O no hydrogen 3.005 N/A HIS 294.A N LEU 290.A O no hydrogen 2.596 N/A GLU 296.A N GLU 296.A OE1 no hydrogen 2.714 N/A LYS 297.A N HIS 294.A O no hydrogen 3.262 N/A THR 300.A N LYS 297.A O no hydrogen 3.039 N/A THR 300.A OG1 LEU 290.A O no hydrogen 3.343 N/A THR 300.A OG1 HIS 294.A O no hydrogen 2.439 N/A TRP 301.A N ALA 298.A O no hydrogen 3.110 N/A TRP 301.A NE1 PRO 295.A O no hydrogen 2.982 N/A LEU 302.A N ALA 298.A O no hydrogen 3.085 N/A ALA 303.A N VAL 299.A O no hydrogen 3.044 N/A VAL 304.A N THR 300.A O no hydrogen 3.237 N/A GLY 305.A N TRP 301.A O no hydrogen 3.071 N/A ILE 306.A N LEU 302.A O no hydrogen 2.941 N/A TYR 307.A N ALA 303.A O no hydrogen 3.104 N/A TYR 308.A N VAL 304.A O no hydrogen 3.215 N/A LEU 309.A N GLY 305.A O no hydrogen 3.050 N/A LEU 309.A N ILE 306.A O no hydrogen 2.971 N/A CYS 310.A N ILE 306.A O no hydrogen 3.121 N/A CYS 310.A SG GLY 278.A O no hydrogen 3.615 N/A CYS 310.A SG CYS 310.A O no hydrogen 2.191 N/A LYS 313.A N TYR 308.A O no hydrogen 2.798 N/A ALA 317.A N LYS 313.A O no hydrogen 3.129 N/A ARG 318.A N ILE 314.A O no hydrogen 2.816 N/A ARG 319.A N SER 315.A O no hydrogen 2.984 N/A ARG 319.A NH1 ARG 319.A O no hydrogen 2.999 N/A TYR 320.A N GLU 316.A O no hydrogen 3.217 N/A TYR 320.A N ALA 317.A O no hydrogen 2.970 N/A PHE 321.A N ALA 317.A O no hydrogen 3.064 N/A SER 322.A N ARG 318.A O no hydrogen 2.921 N/A LYS 323.A N ARG 319.A O no hydrogen 2.915 N/A SER 324.A N TYR 320.A O no hydrogen 3.032 N/A SER 324.A OG ALA 298.A O no hydrogen 2.832 N/A SER 325.A N PHE 321.A O no hydrogen 2.982 N/A SER 325.A OG PHE 321.A O no hydrogen 2.957 N/A SER 325.A OG SER 322.A O no hydrogen 3.219 N/A THR 326.A N SER 322.A O no hydrogen 3.059 N/A THR 326.A OG1 SER 322.A O no hydrogen 2.820 N/A MET 327.A N LYS 323.A O no hydrogen 2.926 N/A ASP 328.A N SER 324.A O no hydrogen 2.948 N/A GLN 330.A N ASP 328.A OD1 no hydrogen 3.053 N/A GLN 330.A NE2 ASN 168.A O no hydrogen 3.692 N/A PHE 331.A N ASP 328.A O no hydrogen 2.737 N/A ALA 334.A N PHE 331.A O no hydrogen 3.225 N/A TRP 335.A N GLY 332.A O no hydrogen 2.810 N/A TRP 335.A NE1 PRO 329.A O no hydrogen 3.113 N/A ILE 336.A N GLY 332.A O no hydrogen 3.144 N/A GLY 337.A N PRO 333.A O no hydrogen 3.123 N/A PHE 338.A N ALA 334.A O no hydrogen 2.935 N/A ALA 339.A N TRP 335.A O no hydrogen 2.822 N/A HIS 340.A N ILE 336.A O no hydrogen 2.910 N/A SER 341.A N GLY 337.A O no hydrogen 3.269 N/A SER 341.A OG GLY 337.A O no hydrogen 3.120 N/A PHE 342.A N PHE 338.A O no hydrogen 3.313 N/A ALA 343.A N ALA 339.A O no hydrogen 2.843 N/A ILE 344.A N HIS 340.A O no hydrogen 2.886 N/A GLU 345.A N SER 341.A O no hydrogen 3.186 N/A GLY 346.A N ALA 343.A O no hydrogen 2.908 N/A GLU 347.A N PHE 342.A O no hydrogen 2.860 N/A HIS 348.A N GLY 346.A O no hydrogen 3.052 N/A HIS 348.A ND1 GLN 375.A OE1 no hydrogen 2.904 N/A ALA 351.A N GLU 347.A O no hydrogen 2.973 N/A ILE 352.A N HIS 348.A O no hydrogen 2.889 N/A SER 353.A N ASP 349.A O no hydrogen 2.942 N/A SER 353.A OG ASP 349.A O no hydrogen 3.350 N/A ALA 354.A N GLN 350.A O no hydrogen 3.043 N/A TYR 355.A N ALA 351.A O no hydrogen 2.814 N/A THR 356.A N ILE 352.A O no hydrogen 2.946 N/A THR 356.A OG1 ILE 352.A O no hydrogen 3.108 N/A THR 356.A OG1 SER 353.A O no hydrogen 3.058 N/A THR 357.A N SER 353.A O no hydrogen 2.815 N/A ALA 358.A N ALA 354.A O no hydrogen 2.868 N/A ALA 359.A N TYR 355.A O no hydrogen 2.942 N/A ALA 359.A N THR 356.A O no hydrogen 3.124 N/A LEU 361.A N ALA 358.A O no hydrogen 3.028 N/A THR 365.A OG1 PHE 362.A O no hydrogen 3.362 N/A HIS 366.A NE2 ASP 399.A OD2 no hydrogen 2.881 N/A LEU 370.A N HIS 366.A O no hydrogen 3.187 N/A PHE 371.A N LEU 367.A O no hydrogen 2.934 N/A LEU 372.A N PRO 368.A O no hydrogen 2.949 N/A GLY 373.A N TYR 369.A O no hydrogen 2.880 N/A MET 374.A N LEU 370.A O no hydrogen 3.002 N/A GLN 375.A N PHE 371.A O no hydrogen 2.974 N/A HIS 376.A N LEU 372.A O no hydrogen 3.008 N/A MET 377.A N GLY 373.A O no hydrogen 2.919 N/A GLN 378.A N MET 374.A O no hydrogen 3.382 N/A GLN 378.A NE2 MET 374.A O no hydrogen 3.620 N/A LEU 379.A N GLN 375.A O no hydrogen 3.397 N/A GLY 380.A N MET 377.A O no hydrogen 2.869 N/A ASN 381.A N HIS 376.A O no hydrogen 2.923 N/A ASN 381.A ND2 HIS 376.A ND1 no hydrogen 3.263 N/A ALA 385.A N ASN 381.A O no hydrogen 2.744 N/A ASN 386.A N ILE 382.A O no hydrogen 2.908 N/A GLU 387.A N LEU 383.A O no hydrogen 2.951 N/A TYR 388.A N LEU 384.A O no hydrogen 3.058 N/A LEU 389.A N ALA 385.A O no hydrogen 3.027 N/A GLN 390.A N ASN 386.A O no hydrogen 2.903 N/A GLN 390.A NE2 ASN 386.A OD1 no hydrogen 3.471 N/A SER 391.A N GLU 387.A O no hydrogen 3.043 N/A SER 391.A OG GLU 387.A O no hydrogen 3.203 N/A SER 392.A N TYR 388.A O no hydrogen 2.962 N/A SER 392.A OG TYR 388.A O no hydrogen 3.195 N/A SER 392.A OG LEU 389.A O no hydrogen 3.511 N/A TYR 393.A N LEU 389.A O no hydrogen 3.001 N/A ALA 394.A N GLN 390.A O no hydrogen 2.962 N/A ALA 394.A N SER 391.A O no hydrogen 3.213 N/A LEU 395.A N SER 391.A O no hydrogen 3.415 N/A PHE 396.A N SER 392.A O no hydrogen 2.831 N/A LEU 401.A N ASP 399.A OD1 no hydrogen 2.910 N/A LEU 402.A N ASP 399.A O no hydrogen 2.995 N/A LEU 403.A N ASP 399.A O no hydrogen 3.362 N/A ASN 404.A N PRO 400.A O no hydrogen 3.032 N/A GLU 405.A N LEU 401.A O no hydrogen 3.091 N/A LEU 406.A N LEU 402.A O no hydrogen 2.871 N/A GLY 407.A N LEU 403.A O no hydrogen 3.018 N/A GLY 407.A N ASN 404.A O no hydrogen 2.986 N/A VAL 408.A N ASN 404.A O no hydrogen 2.953 N/A VAL 409.A N GLU 405.A O no hydrogen 3.296 N/A ALA 410.A N LEU 406.A O no hydrogen 3.076 N/A PHE 411.A N GLY 407.A O no hydrogen 3.004 N/A ASN 412.A N VAL 408.A O no hydrogen 3.120 N/A LYS 413.A N VAL 409.A O no hydrogen 2.927 N/A ASP 415.A N ALA 410.A O no hydrogen 2.881 N/A THR 418.A N ASP 415.A OD2 no hydrogen 3.292 N/A THR 418.A OG1 ASP 415.A OD1 no hydrogen 2.513 N/A ALA 419.A N ASP 415.A O no hydrogen 2.973 N/A ILE 420.A N MET 416.A O no hydrogen 2.801 N/A ASN 421.A N GLN 417.A O no hydrogen 3.047 N/A HIS 422.A N THR 418.A O no hydrogen 2.886 N/A PHE 423.A N ALA 419.A O no hydrogen 2.927 N/A GLN 424.A N ILE 420.A O no hydrogen 2.845 N/A ASN 425.A N ASN 421.A O no hydrogen 3.094 N/A ASN 425.A N HIS 422.A O no hydrogen 3.085 N/A ALA 426.A N HIS 422.A O no hydrogen 2.984 N/A LEU 427.A N PHE 423.A O no hydrogen 3.139 N/A LEU 428.A N GLN 424.A O no hydrogen 3.076 N/A LEU 429.A N ASN 425.A O no hydrogen 2.842 N/A VAL 430.A N ALA 426.A O no hydrogen 2.760 N/A LYS 431.A N LEU 427.A O no hydrogen 3.306 N/A LYS 431.A N LEU 428.A O no hydrogen 3.191 N/A LYS 432.A N LEU 429.A O no hydrogen 2.987 N/A THR 433.A N LEU 429.A O no hydrogen 3.352 N/A THR 433.A OG1 VAL 430.A O no hydrogen 3.170 N/A THR 433.A OG1 SER 435.A OG no hydrogen 2.508 N/A GLN 434.A N SER 244.A O no hydrogen 3.004 N/A SER 435.A N THR 433.A OG1 no hydrogen 3.285 N/A SER 435.A OG THR 433.A OG1 no hydrogen 2.508 N/A ASN 436.A N GLU 276.A OE1 no hydrogen 2.736 N/A TRP 440.A N GLU 437.A O no hydrogen 3.261 N/A ALA 441.A N LYS 438.A O no hydrogen 3.373 N/A ALA 442.A N PRO 439.A O no hydrogen 3.368 N/A TRP 444.A N TRP 440.A O no hydrogen 3.290 N/A ALA 445.A N ALA 441.A O no hydrogen 2.956 N/A ASN 446.A N ALA 442.A O no hydrogen 2.699 N/A LEU 447.A N THR 443.A O no hydrogen 2.753 N/A GLY 448.A N TRP 444.A O no hydrogen 2.883 N/A HIS 449.A N ALA 445.A O no hydrogen 2.850 N/A ALA 450.A N ASN 446.A O no hydrogen 2.999 N/A TYR 451.A N LEU 447.A O no hydrogen 3.105 N/A TYR 451.A OH GLN 424.A OE1 no hydrogen 3.000 N/A ARG 452.A N GLY 448.A O no hydrogen 3.161 N/A LYS 453.A N HIS 449.A O no hydrogen 3.329 N/A LEU 454.A N ALA 450.A O no hydrogen 3.188 N/A LYS 455.A N ARG 452.A O no hydrogen 2.908 N/A MET 456.A N TYR 451.A O no hydrogen 2.768 N/A ALA 460.A N MET 456.A O no hydrogen 3.109 N/A ILE 461.A N TYR 457.A O no hydrogen 2.898 N/A ASP 462.A N ASP 458.A O no hydrogen 3.084 N/A ALA 463.A N ALA 459.A O no hydrogen 3.131 N/A LEU 464.A N ALA 460.A O no hydrogen 2.785 N/A ASN 465.A N ILE 461.A O no hydrogen 2.893 N/A GLN 466.A N ASP 462.A O no hydrogen 3.215 N/A GLY 467.A N ALA 463.A O no hydrogen 2.945 N/A LEU 468.A N LEU 464.A O no hydrogen 2.916 N/A LEU 469.A N ASN 465.A O no hydrogen 2.937 N/A LEU 470.A N GLN 466.A O no hydrogen 3.448 N/A SER 471.A N LEU 468.A O no hydrogen 3.316 N/A SER 471.A OG SER 471.A O no hydrogen 2.451 N/A HIS 478.A ND1 HIS 497.A ND1 no hydrogen 3.015 N/A THR 479.A N ALA 475.A O no hydrogen 3.104 N/A THR 479.A OG1 ALA 475.A O no hydrogen 3.125 N/A THR 479.A OG1 SER 501.A OG no hydrogen 2.793 N/A ALA 480.A N ASN 476.A O no hydrogen 2.979 N/A ILE 481.A N VAL 477.A O no hydrogen 3.012 N/A ALA 482.A N HIS 478.A O no hydrogen 3.024 N/A LEU 483.A N THR 479.A O no hydrogen 2.857 N/A VAL 484.A N ALA 480.A O no hydrogen 3.028 N/A TYR 485.A N ILE 481.A O no hydrogen 2.876 N/A LEU 486.A N ALA 482.A O no hydrogen 2.946 N/A HIS 487.A N LEU 483.A O no hydrogen 3.271 N/A HIS 487.A N VAL 484.A O no hydrogen 2.853 N/A LYS 488.A N VAL 484.A O no hydrogen 2.876 N/A LYS 488.A NZ ASP 458.A OD2 no hydrogen 2.589 N/A ILE 490.A N TYR 485.A O no hydrogen 2.851 N/A LEU 493.A N ILE 490.A O no hydrogen 3.197 N/A ALA 494.A N ILE 490.A O no hydrogen 3.258 N/A ILE 495.A N PRO 491.A O no hydrogen 2.841 N/A THR 496.A OG1 LEU 493.A O no hydrogen 3.116 N/A HIS 497.A ND1 HIS 478.A ND1 no hydrogen 3.015 N/A LEU 498.A N ALA 494.A O no hydrogen 3.205 N/A HIS 499.A N ILE 495.A O no hydrogen 3.104 N/A GLU 500.A N THR 496.A O no hydrogen 3.285 N/A SER 501.A N HIS 497.A O no hydrogen 3.136 N/A SER 501.A OG ALA 475.A O no hydrogen 2.819 N/A SER 501.A OG THR 479.A OG1 no hydrogen 2.793 N/A SER 501.A OG HIS 497.A O no hydrogen 3.533 N/A LEU 502.A N LEU 498.A O no hydrogen 3.050 N/A ALA 503.A N GLU 500.A O no hydrogen 3.098 N/A ILE 504.A N GLU 500.A O no hydrogen 3.038 N/A SER 505.A N SER 501.A O no hydrogen 2.853 N/A SER 505.A OG SER 505.A O no hydrogen 2.529 N/A GLU 508.A N SER 505.A O no hydrogen 3.419 N/A SER 512.A OG GLU 508.A O no hydrogen 3.152 N/A ASP 513.A N ILE 509.A O no hydrogen 3.417 N/A LEU 514.A N MET 510.A O no hydrogen 2.966 N/A LEU 515.A N ALA 511.A O no hydrogen 3.154 N/A LYS 516.A N SER 512.A O no hydrogen 2.757 N/A ARG 517.A N ASP 513.A O no hydrogen 3.041 N/A ALA 518.A N LEU 515.A O no hydrogen 3.087 N/A