Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ir1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ PHE 2.A O no hydrogen 3.095 N/A TYR 9.A N GLU 41.A OE2 no hydrogen 2.879 N/A TYR 9.A OH GLU 49.A OE2 no hydrogen 2.682 N/A LYS 10.A N GLU 41.A OE1 no hydrogen 3.046 N/A LEU 11.A N ASP 8.A O no hydrogen 3.386 N/A THR 12.A N TYR 9.A O no hydrogen 3.123 N/A TYR 13.A N TYR 9.A O no hydrogen 2.842 N/A TYR 13.A OH THR 52.A OG1 no hydrogen 2.911 N/A TYR 14.A N LYS 10.A O no hydrogen 3.377 N/A THR 15.A N CYS 73.A O no hydrogen 2.877 N/A GLU 17.A N GLU 17.A OE2 no hydrogen 2.572 N/A TYR 18.A N THR 15.A O no hydrogen 3.101 N/A TYR 18.A OH ASP 24.A OD2 no hydrogen 2.577 N/A LEU 21.A N ASP 24.A OD2 no hydrogen 2.935 N/A ASP 24.A N LEU 21.A O no hydrogen 3.171 N/A ILE 25.A N TYR 92.A O no hydrogen 2.804 N/A LEU 26.A N ARG 128.A O no hydrogen 3.137 N/A ALA 27.A N VAL 90.A O no hydrogen 2.821 N/A ALA 28.A N ASP 126.A O no hydrogen 3.138 N/A PHE 29.A N CYS 88.A O no hydrogen 2.991 N/A ARG 30.A N ARG 123.A O no hydrogen 2.713 N/A ARG 30.A NE GLU 125.A OE2 no hydrogen 2.807 N/A ARG 30.A NH1 GLN 85.A OE1 no hydrogen 2.896 N/A ARG 30.A NH2 GLU 125.A OE2 no hydrogen 2.988 N/A VAL 31.A N TYR 86.A O no hydrogen 2.678 N/A SER 32.A N ALA 121.A O no hydrogen 3.104 N/A GLN 34.A N ALA 118.A O no hydrogen 3.073 N/A GLN 34.A NE2 LYS 117.A O no hydrogen 3.312 N/A GLN 34.A NE2 LEU 119.A O no hydrogen 3.557 N/A VAL 37.A N GLN 34.A O no hydrogen 3.183 N/A ALA 42.A N PRO 38.A O no hydrogen 3.003 N/A GLY 43.A N PRO 39.A O no hydrogen 2.819 N/A ALA 44.A N GLU 40.A O no hydrogen 2.991 N/A ALA 45.A N GLU 41.A O no hydrogen 2.856 N/A VAL 46.A N ALA 42.A O no hydrogen 3.172 N/A ALA 47.A N GLY 43.A O no hydrogen 3.106 N/A ALA 48.A N ALA 44.A O no hydrogen 2.891 N/A GLU 49.A N ALA 45.A O no hydrogen 2.999 N/A SER 50.A OG VAL 46.A O no hydrogen 2.591 N/A SER 50.A OG ALA 47.A O no hydrogen 3.256 N/A SER 50.A OG TYR 92.A OH no hydrogen 2.696 N/A SER 51.A N ALA 48.A O no hydrogen 3.144 N/A SER 51.A OG ALA 47.A O no hydrogen 2.631 N/A SER 51.A OG ALA 48.A O no hydrogen 3.341 N/A THR 52.A N SER 51.A OG no hydrogen 2.720 N/A THR 52.A OG1 TYR 13.A OH no hydrogen 2.911 N/A GLY 53.A N ALA 48.A O no hydrogen 2.951 N/A TRP 55.A N THR 54.A OG1 no hydrogen 2.704 N/A THR 57.A N GLY 5.A O no hydrogen 3.106 N/A THR 57.A OG1 GLY 5.A O no hydrogen 2.969 N/A ASP 61.A N VAL 58.A O no hydrogen 3.455 N/A GLY 62.A N TRP 59.A O no hydrogen 3.126 N/A LEU 63.A N THR 60.A O no hydrogen 3.038 N/A THR 64.A N ASP 61.A O no hydrogen 3.253 N/A ASP 67.A N ASN 65.A OD1 no hydrogen 3.222 N/A ARG 68.A N ASN 65.A O no hydrogen 3.152 N/A TYR 69.A N LEU 66.A O no hydrogen 3.225 N/A LYS 70.A N LEU 66.A O no hydrogen 2.838 N/A LYS 70.A NZ THR 12.A O no hydrogen 2.813 N/A LYS 70.A NZ ASP 67.A OD1 no hydrogen 3.435 N/A GLY 71.A N SER 51.A OG no hydrogen 3.005 N/A ARG 72.A N ALA 91.A O no hydrogen 2.959 N/A ARG 72.A NH1 ASP 67.A O no hydrogen 3.292 N/A ARG 72.A NH2 ASP 67.A O no hydrogen 2.746 N/A CYS 73.A N TYR 13.A O no hydrogen 2.957 N/A CYS 73.A SG HIS 75.A O no hydrogen 3.975 N/A CYS 73.A SG TYR 89.A O no hydrogen 3.768 N/A TYR 74.A N TYR 89.A O no hydrogen 2.957 N/A GLU 77.A N ILE 87.A O no hydrogen 3.097 N/A VAL 79.A N GLN 85.A O no hydrogen 3.082 N/A GLU 82.A N VAL 79.A O no hydrogen 3.426 N/A TYR 86.A N VAL 31.A O no hydrogen 2.901 N/A ILE 87.A N GLU 77.A O no hydrogen 2.789 N/A CYS 88.A N PHE 29.A O no hydrogen 2.794 N/A TYR 89.A N HIS 75.A O no hydrogen 2.842 N/A TYR 89.A OH GLU 77.A OE2 no hydrogen 3.050 N/A VAL 90.A N ALA 27.A O no hydrogen 2.924 N/A ALA 91.A N ARG 72.A O no hydrogen 2.856 N/A TYR 92.A N ILE 25.A O no hydrogen 2.783 N/A TYR 92.A OH SER 50.A OG no hydrogen 2.696 N/A LEU 96.A N PRO 93.A O no hydrogen 3.196 N/A PHE 97.A N LEU 94.A O no hydrogen 3.262 N/A GLU 98.A N ASN 104.A OD1 no hydrogen 2.853 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.628 N/A GLY 100.A N THR 136.A OG1 no hydrogen 2.948 N/A SER 101.A N GLU 98.A O no hydrogen 3.279 N/A THR 103.A OG1 THR 263.A OG1 no hydrogen 3.240 N/A ASN 104.A N SER 101.A OG no hydrogen 3.054 N/A MET 105.A N SER 101.A O no hydrogen 3.183 N/A PHE 106.A N VAL 102.A O no hydrogen 3.016 N/A THR 107.A N THR 103.A O no hydrogen 3.075 N/A THR 107.A OG1 THR 103.A O no hydrogen 2.740 N/A SER 108.A N ASN 104.A O no hydrogen 3.339 N/A ILE 109.A N MET 105.A O no hydrogen 3.317 N/A VAL 110.A N PHE 106.A O no hydrogen 2.855 N/A GLY 115.A N ASN 112.A O no hydrogen 3.247 N/A PHE 116.A N VAL 113.A O no hydrogen 3.517 N/A LEU 119.A N PHE 116.A O no hydrogen 3.137 N/A ARG 120.A N SER 32.A O no hydrogen 2.746 N/A ARG 120.A NE PRO 33.A O no hydrogen 2.591 N/A ARG 120.A NH2 PRO 33.A O no hydrogen 3.188 N/A ALA 121.A N SER 32.A O no hydrogen 3.346 N/A LEU 122.A N HIS 295.A ND1 no hydrogen 3.263 N/A ARG 123.A N ARG 30.A O no hydrogen 3.088 N/A ARG 123.A NH1 GLU 125.A OE2 no hydrogen 3.047 N/A ARG 123.A NH1 ASP 461.A OD1 no hydrogen 3.226 N/A ARG 123.A NH2 ASP 290.A O no hydrogen 3.150 N/A ARG 123.A NH2 ASP 461.A OD1 no hydrogen 2.733 N/A LEU 124.A N GLY 296.A O no hydrogen 2.959 N/A GLU 125.A N ALA 28.A O no hydrogen 2.845 N/A LEU 127.A N ASP 126.A OD1 no hydrogen 2.639 N/A ARG 128.A N LEU 26.A O no hydrogen 2.706 N/A ARG 128.A NE ASP 24.A O no hydrogen 3.273 N/A ARG 128.A NE ARG 128.A O no hydrogen 3.299 N/A ARG 128.A NH2 LEU 21.A O no hydrogen 2.987 N/A ARG 128.A NH2 ASP 24.A O no hydrogen 2.882 N/A ILE 129.A N GLN 354.A OE1 no hydrogen 3.027 N/A TYR 133.A N PRO 130.A O no hydrogen 2.975 N/A TYR 133.A OH GLU 98.A O no hydrogen 2.901 N/A TYR 133.A OH SER 101.A O no hydrogen 3.368 N/A VAL 134.A N PRO 130.A O no hydrogen 3.003 N/A LYS 135.A N VAL 131.A O no hydrogen 3.138 N/A THR 136.A N TYR 133.A O no hydrogen 3.008 N/A THR 136.A OG1 TYR 133.A O no hydrogen 2.680 N/A PHE 137.A N VAL 134.A O no hydrogen 3.131 N/A GLN 138.A NE2 GLY 139.A O no hydrogen 3.209 N/A GLN 138.A NE2 SER 269.A O no hydrogen 3.349 N/A GLY 139.A N LEU 308.A O no hydrogen 3.241 N/A HIS 142.A N ASP 312.A OD1 no hydrogen 2.795 N/A HIS 142.A ND1 ASP 312.A OD2 no hydrogen 3.344 N/A GLY 143.A N ASP 312.A OD1 no hydrogen 2.852 N/A ILE 144.A N GLY 361.A O no hydrogen 3.257 N/A GLU 147.A N GLY 143.A O no hydrogen 2.932 N/A ARG 148.A N ILE 144.A O no hydrogen 3.070 N/A ARG 148.A NE ASP 385.A OD1 no hydrogen 3.033 N/A ARG 148.A NH1 LYS 153.A O no hydrogen 2.777 N/A ARG 148.A NH2 ARG 156.A O no hydrogen 2.995 N/A ARG 148.A NH2 ASP 385.A OD1 no hydrogen 3.222 N/A ASP 149.A N GLN 145.A O no hydrogen 3.076 N/A LYS 150.A N VAL 146.A O no hydrogen 2.879 N/A LEU 151.A N GLU 147.A O no hydrogen 3.025 N/A LYS 153.A N ARG 148.A O no hydrogen 3.155 N/A LYS 153.A NZ ASP 187.A OD1 no hydrogen 2.869 N/A LYS 153.A NZ ILE 223.A O no hydrogen 2.901 N/A TYR 154.A OH ASP 149.A OD1 no hydrogen 2.647 N/A ARG 156.A NH1 PRO 157.A O no hydrogen 3.079 N/A ARG 156.A NH1 ASP 187.A OD2 no hydrogen 2.897 N/A ARG 156.A NH2 ASP 187.A OD1 no hydrogen 2.815 N/A ARG 156.A NH2 ASP 187.A OD2 no hydrogen 3.380 N/A LEU 158.A N SER 386.A O no hydrogen 2.888 N/A LEU 159.A N ASP 187.A OD2 no hydrogen 2.853 N/A GLY 160.A N LEU 388.A O no hydrogen 2.883 N/A CYS 161.A SG THR 162.A O no hydrogen 3.747 N/A CYS 161.A SG PHE 390.A O no hydrogen 3.310 N/A LYS 164.A NZ ASP 191.A OD2 no hydrogen 2.863 N/A LYS 166.A NZ ASP 191.A OD1 no hydrogen 3.204 N/A LYS 166.A NZ ASP 191.A OD2 no hydrogen 3.515 N/A LYS 166.A NZ GLU 192.A OE2 no hydrogen 2.656 N/A ASN 173.A N SER 170.A OG no hydrogen 3.267 N/A TYR 174.A N SER 170.A O no hydrogen 2.977 N/A GLY 175.A N ALA 171.A O no hydrogen 3.216 N/A ARG 176.A N LYS 172.A O no hydrogen 2.959 N/A ARG 176.A NH1 ASN 173.A OD1 no hydrogen 2.923 N/A ALA 177.A N ASN 173.A O no hydrogen 2.965 N/A VAL 178.A N TYR 174.A O no hydrogen 2.955 N/A TYR 179.A N GLY 175.A O no hydrogen 2.963 N/A TYR 179.A OH GLU 219.A OE1 no hydrogen 2.527 N/A GLU 180.A N ARG 176.A O no hydrogen 3.289 N/A CYS 181.A N ALA 177.A O no hydrogen 3.083 N/A CYS 181.A SG ALA 177.A O no hydrogen 3.292 N/A LEU 182.A N VAL 178.A O no hydrogen 2.978 N/A ARG 183.A N TYR 179.A O no hydrogen 3.020 N/A ARG 183.A NE GLU 180.A OE1 no hydrogen 2.996 N/A ARG 183.A NH1 GLU 219.A OE2 no hydrogen 2.941 N/A GLY 184.A N CYS 181.A O no hydrogen 3.228 N/A GLY 185.A N LEU 182.A O no hydrogen 3.329 N/A ASP 187.A N LEU 159.A O no hydrogen 2.950 N/A PHE 188.A N LEU 159.A O no hydrogen 2.969 N/A THR 189.A N GLY 225.A O no hydrogen 3.265 N/A THR 189.A OG1 HIS 226.A ND1 no hydrogen 2.718 N/A ASP 190.A N TYR 227.A O no hydrogen 3.287 N/A ASP 191.A N TYR 174.A OH no hydrogen 3.372 N/A GLU 192.A N ASP 191.A OD1 no hydrogen 3.206 N/A VAL 194.A N ASP 191.A O no hydrogen 3.069 N/A ASN 195.A N GLN 197.A OE1 no hydrogen 3.158 N/A ASN 195.A ND2 GLU 192.A O no hydrogen 3.564 N/A GLN 197.A N MET 200.A O no hydrogen 3.061 N/A GLN 197.A NE2 ASN 193.A O no hydrogen 3.011 N/A MET 200.A N GLN 197.A O no hydrogen 2.932 N/A TRP 202.A N SER 196.A OG no hydrogen 3.223 N/A ARG 205.A N ARG 201.A O no hydrogen 3.214 N/A ARG 205.A NE ASP 190.A OD2 no hydrogen 2.914 N/A ARG 205.A NH1 ASN 195.A O no hydrogen 3.012 N/A ARG 205.A NH2 ASP 190.A OD2 no hydrogen 3.209 N/A ARG 205.A NH2 ASN 195.A O no hydrogen 2.883 N/A PHE 206.A N TRP 202.A O no hydrogen 2.924 N/A LEU 207.A N ARG 203.A O no hydrogen 3.021 N/A PHE 208.A N ASP 204.A O no hydrogen 3.006 N/A CYS 209.A N ARG 205.A O no hydrogen 2.843 N/A CYS 209.A SG ARG 205.A O no hydrogen 3.387 N/A ALA 210.A N PHE 206.A O no hydrogen 3.048 N/A GLU 211.A N LEU 207.A O no hydrogen 3.252 N/A ALA 212.A N PHE 208.A O no hydrogen 3.054 N/A LEU 213.A N CYS 209.A O no hydrogen 2.871 N/A TYR 214.A N ALA 210.A O no hydrogen 3.020 N/A TYR 214.A OH LEU 248.A O no hydrogen 2.695 N/A LYS 215.A N GLU 211.A O no hydrogen 3.114 N/A ALA 216.A N ALA 212.A O no hydrogen 3.036 N/A GLN 217.A N LEU 213.A O no hydrogen 2.987 N/A ALA 218.A N TYR 214.A O no hydrogen 3.083 N/A GLU 219.A N LYS 215.A O no hydrogen 3.005 N/A THR 220.A N ALA 216.A O no hydrogen 3.015 N/A THR 220.A OG1 ALA 216.A O no hydrogen 3.028 N/A GLY 221.A N GLN 217.A O no hydrogen 2.840 N/A GLU 222.A N THR 220.A OG1 no hydrogen 3.225 N/A LYS 224.A N GLN 217.A OE1 no hydrogen 3.192 N/A LYS 224.A NZ LEU 182.A O no hydrogen 2.833 N/A LYS 224.A NZ LEU 186.A O no hydrogen 2.822 N/A GLY 225.A N ASP 187.A O no hydrogen 3.106 N/A HIS 226.A ND1 THR 189.A OG1 no hydrogen 2.718 N/A HIS 226.A NE2 ASP 190.A OD1 no hydrogen 2.771 N/A TYR 227.A N THR 189.A O no hydrogen 3.035 N/A ASN 229.A N ASP 190.A OD2 no hydrogen 2.767 N/A ASN 229.A ND2 ASP 191.A O no hydrogen 3.394 N/A ASN 229.A ND2 GLU 192.A O no hydrogen 3.204 N/A ASN 229.A ND2 VAL 194.A O no hydrogen 3.313 N/A ALA 230.A N MET 254.A O no hydrogen 2.968 N/A THR 231.A N ASN 229.A OD1 no hydrogen 3.043 N/A THR 231.A OG1 ASN 229.A OD1 no hydrogen 2.699 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.681 N/A ASP 237.A N THR 234.A OG1 no hydrogen 3.136 N/A MET 238.A N THR 234.A O no hydrogen 3.055 N/A MET 239.A N CYS 235.A O no hydrogen 2.938 N/A LYS 240.A N GLU 236.A O no hydrogen 3.015 N/A ARG 241.A N ASP 237.A O no hydrogen 3.239 N/A ALA 242.A N MET 238.A O no hydrogen 3.221 N/A VAL 243.A N MET 239.A O no hydrogen 2.870 N/A PHE 244.A N LYS 240.A O no hydrogen 3.264 N/A ALA 245.A N ARG 241.A O no hydrogen 3.181 N/A ARG 246.A N ALA 242.A O no hydrogen 3.049 N/A ARG 246.A NE ASN 275.A OD1 no hydrogen 3.223 N/A GLU 247.A N VAL 243.A O no hydrogen 3.022 N/A LEU 248.A N PHE 244.A O no hydrogen 2.986 N/A GLY 249.A N ARG 246.A O no hydrogen 3.109 N/A VAL 253.A N LEU 278.A O no hydrogen 3.032 N/A MET 254.A N LEU 228.A O no hydrogen 2.878 N/A HIS 255.A N HIS 280.A O no hydrogen 3.003 N/A HIS 255.A ND1 ASN 265.A OD1 no hydrogen 2.913 N/A ASP 256.A N THR 231.A OG1 no hydrogen 2.918 N/A TYR 257.A OH LEU 302.A O no hydrogen 2.994 N/A GLY 260.A N ASP 256.A O no hydrogen 2.920 N/A GLY 261.A N TYR 257.A O no hydrogen 2.922 N/A THR 263.A OG1 THR 103.A OG1 no hydrogen 3.240 N/A ASN 265.A N GLY 261.A O no hydrogen 2.948 N/A ASN 265.A ND2 SER 309.A OG no hydrogen 3.008 N/A ASN 265.A ND2 GLY 310.A O no hydrogen 3.194 N/A THR 266.A N PHE 262.A O no hydrogen 2.933 N/A THR 266.A OG1 PHE 262.A O no hydrogen 2.745 N/A THR 266.A OG1 SER 309.A OG no hydrogen 2.962 N/A THR 267.A N THR 263.A O no hydrogen 3.294 N/A THR 267.A OG1 THR 263.A O no hydrogen 3.505 N/A LEU 268.A N ALA 264.A O no hydrogen 3.055 N/A SER 269.A N ASN 265.A O no hydrogen 2.825 N/A SER 269.A OG SER 309.A O no hydrogen 3.050 N/A HIS 270.A N THR 266.A O no hydrogen 3.042 N/A TYR 271.A N THR 267.A O no hydrogen 3.113 N/A CYS 272.A N LEU 268.A O no hydrogen 2.866 N/A CYS 272.A SG LEU 268.A O no hydrogen 3.358 N/A ARG 273.A N SER 269.A O no hydrogen 3.164 N/A ARG 273.A NE PRO 141.A O no hydrogen 2.723 N/A ARG 273.A NH2 PRO 140.A O no hydrogen 3.079 N/A ASP 274.A N HIS 270.A O no hydrogen 3.056 N/A ASN 275.A N CYS 272.A O no hydrogen 3.353 N/A ASN 275.A ND2 TYR 271.A O no hydrogen 3.091 N/A LEU 277.A N CYS 272.A O no hydrogen 3.048 N/A LEU 278.A N PRO 251.A O no hydrogen 2.946 N/A LEU 279.A N ASP 312.A OD2 no hydrogen 2.832 N/A HIS 280.A N VAL 253.A O no hydrogen 2.911 N/A HIS 280.A ND1 HIS 313.A ND1 no hydrogen 3.034 N/A HIS 280.A NE2 HIS 315.A NE2 no hydrogen 2.831 N/A ILE 281.A N HIS 313.A O no hydrogen 2.983 N/A HIS 282.A N HIS 255.A O no hydrogen 3.015 N/A ALA 284.A N HIS 282.A ND1 no hydrogen 2.932 N/A HIS 286.A N ARG 283.A O no hydrogen 2.987 N/A HIS 286.A ND1 ASP 290.A OD2 no hydrogen 2.743 N/A VAL 288.A N MET 285.A O no hydrogen 3.208 N/A ILE 289.A N HIS 286.A O no hydrogen 2.968 N/A ASP 290.A N HIS 286.A O no hydrogen 2.872 N/A ARG 291.A NE GLU 324.A OE1 no hydrogen 3.005 N/A ARG 291.A NH2 GLU 324.A OE1 no hydrogen 2.931 N/A LYS 293.A NZ VAL 463.A OXT no hydrogen 3.226 N/A GLY 296.A N LEU 122.A O no hydrogen 2.975 N/A MET 297.A N ILE 289.A O no hydrogen 3.164 N/A HIS 298.A N LEU 124.A O no hydrogen 2.992 N/A HIS 298.A NE2 ASP 461.A OD2 no hydrogen 3.034 N/A ARG 300.A N HIS 298.A ND1 no hydrogen 3.043 N/A ARG 300.A NH1 GLU 125.A O no hydrogen 2.744 N/A ARG 300.A NH1 GLU 125.A OE1 no hydrogen 3.001 N/A VAL 301.A N HIS 298.A O no hydrogen 3.052 N/A ALA 303.A N PHE 299.A O no hydrogen 2.716 N/A LYS 304.A N ARG 300.A O no hydrogen 3.039 N/A LYS 304.A NZ ASP 126.A OD1 no hydrogen 3.033 N/A LYS 304.A NZ LEU 127.A O no hydrogen 2.677 N/A LYS 304.A NZ GLN 354.A OE1 no hydrogen 3.158 N/A ALA 305.A N VAL 301.A O no hydrogen 3.035 N/A LEU 306.A N LEU 302.A O no hydrogen 3.186 N/A ARG 307.A N ALA 303.A O no hydrogen 3.155 N/A ARG 307.A NE PRO 360.A O no hydrogen 2.991 N/A ARG 307.A NH1 LEU 336.A O no hydrogen 2.807 N/A ARG 307.A NH1 ASP 339.A O no hydrogen 2.814 N/A ARG 307.A NH2 ASP 339.A O no hydrogen 2.976 N/A ARG 307.A NH2 THR 359.A O no hydrogen 2.918 N/A ARG 307.A NH2 PRO 360.A O no hydrogen 3.330 N/A LEU 308.A N LYS 304.A O no hydrogen 3.178 N/A SER 309.A N ALA 305.A O no hydrogen 2.965 N/A SER 309.A OG THR 266.A OG1 no hydrogen 2.962 N/A GLY 310.A N LEU 306.A O no hydrogen 2.628 N/A ASP 312.A N LEU 279.A O no hydrogen 2.757 N/A HIS 313.A N LEU 279.A O no hydrogen 3.258 N/A HIS 313.A ND1 HIS 280.A ND1 no hydrogen 3.034 N/A HIS 313.A NE2 GLU 147.A OE1 no hydrogen 2.965 N/A HIS 313.A NE2 GLU 147.A OE2 no hydrogen 2.466 N/A ILE 314.A N LEU 363.A O no hydrogen 3.135 N/A HIS 315.A NE2 HIS 280.A NE2 no hydrogen 2.831 N/A SER 316.A N VAL 365.A O no hydrogen 2.965 N/A SER 316.A OG GLY 317.A O no hydrogen 3.509 N/A GLY 321.A N THR 318.A OG1 no hydrogen 2.646 N/A LYS 322.A N GLY 368.A O no hydrogen 3.059 N/A ARG 327.A NH2 GLU 380.A OE2 no hydrogen 3.284 N/A THR 330.A N GLU 326.A O no hydrogen 2.915 N/A THR 330.A OG1 GLU 326.A O no hydrogen 2.659 N/A LEU 331.A N ARG 327.A O no hydrogen 2.900 N/A GLY 332.A N ASP 328.A O no hydrogen 3.078 N/A PHE 333.A N ILE 329.A O no hydrogen 3.191 N/A VAL 334.A N THR 330.A O no hydrogen 2.985 N/A ASP 335.A N LEU 331.A O no hydrogen 3.297 N/A LEU 336.A N GLY 332.A O no hydrogen 3.314 N/A LEU 337.A N PHE 333.A O no hydrogen 3.010 N/A LEU 337.A N VAL 334.A O no hydrogen 3.123 N/A ARG 338.A N VAL 334.A O no hydrogen 3.034 N/A ARG 338.A NH1 PHE 382.A O no hydrogen 2.815 N/A ARG 338.A NH1 ASP 385.A O no hydrogen 2.813 N/A ASP 339.A N ASP 335.A O no hydrogen 2.993 N/A THR 342.A N GLN 354.A O no hydrogen 2.993 N/A THR 342.A OG1 ASP 335.A O no hydrogen 3.542 N/A LYS 344.A N THR 353.A OG1 no hydrogen 3.059 N/A ASP 345.A N ILE 350.A O no hydrogen 2.812 N/A ARG 346.A NH1 GLU 77.A OE2 no hydrogen 2.864 N/A ARG 346.A NH2 GLU 77.A OE2 no hydrogen 3.254 N/A SER 347.A N ASP 345.A OD1 no hydrogen 3.177 N/A SER 347.A OG ASP 345.A OD1 no hydrogen 2.665 N/A ARG 348.A N ASP 345.A O no hydrogen 2.985 N/A ARG 348.A NE ASP 345.A OD2 no hydrogen 3.010 N/A ARG 348.A NH1 ASP 335.A OD2 no hydrogen 2.872 N/A ARG 348.A NH2 ASP 335.A OD2 no hydrogen 3.324 N/A GLY 349.A N ARG 346.A O no hydrogen 3.354 N/A ILE 350.A N ASP 345.A O no hydrogen 3.028 N/A TYR 351.A N ASP 126.A OD2 no hydrogen 3.125 N/A GLN 354.A N THR 342.A O no hydrogen 2.855 N/A GLN 354.A NE2 ILE 129.A O no hydrogen 2.864 N/A GLN 354.A NE2 SER 355.A O no hydrogen 2.974 N/A TRP 356.A N ASP 340.A O no hydrogen 2.877 N/A SER 358.A N ASP 340.A OD1 no hydrogen 2.634 N/A THR 359.A N TRP 356.A O no hydrogen 3.003 N/A THR 359.A OG1 TRP 356.A O no hydrogen 2.757 N/A VAL 362.A N LEU 337.A O no hydrogen 2.851 N/A LEU 363.A N ASP 312.A O no hydrogen 2.951 N/A VAL 365.A N ILE 314.A O no hydrogen 2.926 N/A ALA 366.A N VAL 387.A O no hydrogen 2.838 N/A SER 367.A OG GLN 389.A OE1 no hydrogen 3.553 N/A HIS 371.A N HIS 374.A ND1 no hydrogen 3.088 N/A HIS 371.A NE2 ILE 453.A O no hydrogen 3.055 N/A TRP 373.A N HIS 371.A ND1 no hydrogen 3.296 N/A TRP 373.A NE1 CYS 447.A O no hydrogen 2.943 N/A HIS 374.A N HIS 371.A O no hydrogen 2.798 N/A MET 375.A N VAL 372.A O no hydrogen 3.051 N/A LEU 378.A N HIS 374.A O no hydrogen 2.977 N/A THR 379.A N MET 375.A O no hydrogen 2.956 N/A THR 379.A OG1 MET 375.A O no hydrogen 2.891 N/A GLU 380.A N PRO 376.A O no hydrogen 2.933 N/A ILE 381.A N ALA 377.A O no hydrogen 2.859 N/A PHE 382.A N LEU 378.A O no hydrogen 2.960 N/A GLY 383.A N THR 379.A O no hydrogen 2.952 N/A SER 386.A N ASP 384.A O no hydrogen 2.960 N/A SER 386.A OG GLY 383.A O no hydrogen 3.190 N/A VAL 387.A N PRO 364.A O no hydrogen 2.976 N/A LEU 388.A N LEU 158.A O no hydrogen 2.875 N/A GLN 389.A N ALA 366.A O no hydrogen 2.908 N/A PHE 390.A N GLY 160.A O no hydrogen 2.972 N/A THR 394.A N GLY 391.A O no hydrogen 2.919 N/A THR 394.A OG1 PHE 390.A O no hydrogen 2.762 N/A LEU 395.A N GLY 391.A O no hydrogen 2.982 N/A HIS 397.A N THR 394.A O no hydrogen 3.296 N/A HIS 397.A NE2 GLU 442.A O no hydrogen 2.855 N/A TRP 399.A N HIS 397.A ND1 no hydrogen 3.007 N/A GLY 400.A N HIS 397.A O no hydrogen 3.202 N/A ASN 401.A ND2 ALA 177.A O no hydrogen 3.174 N/A GLY 404.A N GLY 400.A O no hydrogen 2.977 N/A ALA 405.A N ASN 401.A O no hydrogen 2.787 N/A VAL 406.A N ALA 402.A O no hydrogen 2.973 N/A ALA 407.A N PRO 403.A O no hydrogen 3.037 N/A ASN 408.A N GLY 404.A O no hydrogen 3.359 N/A ASN 408.A ND2 GLY 393.A O no hydrogen 3.386 N/A ARG 409.A N ALA 405.A O no hydrogen 2.917 N/A ARG 409.A NE GLU 413.A OE2 no hydrogen 2.997 N/A ARG 409.A NH1 GLY 185.A O no hydrogen 2.878 N/A ARG 409.A NH1 GLU 222.A OE1 no hydrogen 2.984 N/A ARG 409.A NH2 GLU 222.A OE2 no hydrogen 3.086 N/A ARG 409.A NH2 GLU 413.A OE2 no hydrogen 3.233 N/A VAL 410.A N VAL 406.A O no hydrogen 2.757 N/A ALA 411.A N ALA 407.A O no hydrogen 2.971 N/A LEU 412.A N ASN 408.A O no hydrogen 2.988 N/A GLU 413.A N ARG 409.A O no hydrogen 3.028 N/A ALA 414.A N VAL 410.A O no hydrogen 2.936 N/A CYS 415.A N ALA 411.A O no hydrogen 3.200 N/A CYS 415.A SG ALA 411.A O no hydrogen 3.377 N/A VAL 416.A N LEU 412.A O no hydrogen 2.942 N/A GLN 417.A N GLU 413.A O no hydrogen 2.909 N/A ALA 418.A N ALA 414.A O no hydrogen 3.011 N/A ARG 419.A N CYS 415.A O no hydrogen 2.888 N/A ARG 419.A NE ASN 420.A OD1 no hydrogen 3.005 N/A ARG 419.A NH1 ASP 384.A OD1 no hydrogen 2.919 N/A ARG 419.A NH2 ASP 384.A OD1 no hydrogen 3.008 N/A ARG 419.A NH2 ASP 384.A OD2 no hydrogen 3.343 N/A ARG 419.A NH2 ASN 420.A OD1 no hydrogen 3.151 N/A ASN 420.A N VAL 416.A O no hydrogen 2.930 N/A GLU 421.A N GLN 417.A O no hydrogen 3.012 N/A GLU 421.A N ALA 418.A O no hydrogen 3.183 N/A GLY 422.A N ARG 419.A O no hydrogen 2.882 N/A ARG 423.A N ALA 418.A O no hydrogen 3.071 N/A ARG 423.A NE GLU 428.A OE1 no hydrogen 2.980 N/A ARG 423.A NH1 GLU 435.A OE1 no hydrogen 2.983 N/A ARG 423.A NH2 GLU 428.A OE1 no hydrogen 3.359 N/A ARG 423.A NH2 GLU 435.A OE1 no hydrogen 3.517 N/A ARG 423.A NH2 GLU 435.A OE2 no hydrogen 2.949 N/A ASP 424.A N GLU 428.A OE2 no hydrogen 3.176 N/A ALA 426.A N ASP 424.A OD1 no hydrogen 3.371 N/A GLU 428.A N ASP 424.A O no hydrogen 2.747 N/A ILE 432.A N GLU 428.A O no hydrogen 2.948 N/A ILE 433.A N GLY 429.A O no hydrogen 3.214 N/A ARG 434.A N ASN 430.A O no hydrogen 3.045 N/A GLU 435.A N THR 431.A O no hydrogen 2.871 N/A ALA 436.A N ILE 432.A O no hydrogen 3.316 N/A THR 437.A N ILE 433.A O no hydrogen 3.184 N/A THR 437.A N ARG 434.A O no hydrogen 3.218 N/A THR 437.A OG1 ARG 434.A O no hydrogen 2.507 N/A LYS 438.A N GLU 435.A O no hydrogen 3.252 N/A LYS 438.A NZ ARG 434.A O no hydrogen 3.282 N/A TRP 439.A N ALA 436.A O no hydrogen 3.309 N/A SER 440.A N ALA 436.A O no hydrogen 3.094 N/A LEU 443.A N SER 440.A OG no hydrogen 3.304 N/A ALA 444.A N SER 440.A O no hydrogen 2.964 N/A ALA 445.A N PRO 441.A O no hydrogen 3.030 N/A ALA 446.A N GLU 442.A O no hydrogen 3.345 N/A CYS 447.A N LEU 443.A O no hydrogen 2.906 N/A CYS 447.A SG LEU 443.A O no hydrogen 3.389 N/A GLU 448.A N ALA 444.A O no hydrogen 3.211 N/A VAL 449.A N ALA 446.A O no hydrogen 3.250 N/A TRP 450.A N ALA 446.A O no hydrogen 3.353 N/A ILE 453.A N TRP 450.A O no hydrogen 3.214 N/A MET 460.A N GLU 324.A OE1 no hydrogen 2.827 N/A MET 460.A N GLU 324.A OE2 no hydrogen 3.297 N/A ASP 461.A N GLU 324.A OE2 no hydrogen 2.889 N/A