Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ukm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 491.A OE1 no hydrogen 3.407 N/A ILE 9.A N GLU 6.A O no hydrogen 2.994 N/A ARG 10.A N PRO 7.A O no hydrogen 3.244 N/A ARG 10.A NE GLN 14.A OE1 no hydrogen 2.822 N/A ARG 10.A NH1 ILE 136.A O no hydrogen 3.156 N/A ARG 10.A NH1 THR 142.A OG1 no hydrogen 2.925 N/A ARG 10.A NH2 GLN 14.A OE1 no hydrogen 3.233 N/A ARG 10.A NH2 ILE 136.A O no hydrogen 2.542 N/A VAL 12.A N ILE 9.A O no hydrogen 3.257 N/A MET 13.A N ILE 9.A O no hydrogen 3.020 N/A GLN 14.A N ARG 10.A O no hydrogen 2.788 N/A GLN 14.A NE2 GLU 18.A OE2 no hydrogen 3.318 N/A TYR 16.A N VAL 12.A O no hydrogen 2.988 N/A LEU 17.A N MET 13.A O no hydrogen 2.746 N/A GLU 18.A N GLN 14.A O no hydrogen 2.983 N/A ASP 19.A N LYS 15.A O no hydrogen 2.998 N/A ARG 20.A N LEU 17.A O no hydrogen 2.741 N/A ARG 20.A NH1 TYR 16.A O no hydrogen 3.189 N/A GLY 21.A N GLU 18.A O no hydrogen 3.142 N/A GLU 22.A N LEU 17.A O no hydrogen 3.273 N/A LYS 27.A N THR 24.A OG1 no hydrogen 3.239 N/A ILE 28.A N THR 24.A O no hydrogen 3.368 N/A PHE 29.A N PHE 25.A O no hydrogen 2.758 N/A SER 30.A N GLU 26.A O no hydrogen 3.213 N/A SER 30.A OG GLU 26.A O no hydrogen 2.838 N/A GLN 31.A N ILE 28.A O no hydrogen 3.113 N/A LEU 33.A N GLN 477.A OE1 no hydrogen 2.914 N/A TYR 35.A N GLN 31.A O no hydrogen 2.839 N/A TYR 35.A OH GLU 57.A OE1 no hydrogen 2.690 N/A LEU 36.A N LYS 32.A O no hydrogen 3.056 N/A LEU 37.A N LEU 33.A O no hydrogen 3.153 N/A PHE 38.A N GLY 34.A O no hydrogen 2.958 N/A ARG 39.A N TYR 35.A O no hydrogen 2.830 N/A ARG 39.A NE GLU 57.A OE1 no hydrogen 3.070 N/A ARG 39.A NE GLU 57.A OE2 no hydrogen 3.310 N/A ASP 40.A N LEU 36.A O no hydrogen 3.068 N/A PHE 41.A N LEU 37.A O no hydrogen 3.031 N/A CYS 42.A N PHE 38.A O no hydrogen 3.011 N/A CYS 42.A SG PHE 38.A O no hydrogen 3.450 N/A LEU 43.A N ARG 39.A O no hydrogen 2.797 N/A LYS 44.A N ASP 40.A O no hydrogen 2.939 N/A HIS 45.A N PHE 41.A O no hydrogen 2.917 N/A ALA 49.A N LEU 46.A O no hydrogen 2.945 N/A LEU 52.A N ALA 49.A O no hydrogen 3.062 N/A VAL 53.A N ALA 49.A O no hydrogen 3.279 N/A GLU 54.A N LYS 50.A O no hydrogen 2.887 N/A PHE 55.A N PRO 51.A O no hydrogen 3.274 N/A TYR 56.A N LEU 52.A O no hydrogen 2.963 N/A GLU 57.A N VAL 53.A O no hydrogen 2.821 N/A GLU 58.A N GLU 54.A O no hydrogen 3.047 N/A ILE 59.A N PHE 55.A O no hydrogen 2.989 N/A LYS 60.A N TYR 56.A O no hydrogen 3.038 N/A LYS 60.A NZ GLU 63.A OE1 no hydrogen 2.948 N/A LYS 60.A NZ GLU 63.A OE2 no hydrogen 3.554 N/A LYS 61.A N GLU 57.A O no hydrogen 3.184 N/A TYR 62.A N GLU 58.A O no hydrogen 3.118 N/A TYR 62.A OH PRO 112.A O no hydrogen 2.893 N/A GLU 63.A N ILE 59.A O no hydrogen 2.915 N/A LYS 64.A N LYS 61.A O no hydrogen 3.046 N/A LEU 65.A N TYR 62.A O no hydrogen 3.229 N/A THR 67.A N GLU 70.A OE1 no hydrogen 2.976 N/A THR 67.A OG1 GLU 70.A OE1 no hydrogen 2.966 N/A GLU 70.A N THR 67.A O no hydrogen 3.090 N/A GLU 70.A N THR 67.A OG1 no hydrogen 3.147 N/A ARG 71.A N THR 67.A O no hydrogen 3.330 N/A ARG 71.A NE VAL 111.A O no hydrogen 2.906 N/A ARG 71.A NH2 VAL 111.A O no hydrogen 3.419 N/A LEU 72.A N GLU 68.A O no hydrogen 3.164 N/A VAL 73.A N GLU 69.A O no hydrogen 3.402 N/A CYS 74.A N GLU 70.A O no hydrogen 2.875 N/A SER 75.A N ARG 71.A O no hydrogen 2.690 N/A SER 75.A OG ARG 71.A O no hydrogen 2.912 N/A SER 75.A OG LEU 72.A O no hydrogen 3.122 N/A ARG 76.A N LEU 72.A O no hydrogen 3.488 N/A GLU 77.A N VAL 73.A O no hydrogen 3.201 N/A ILE 78.A N CYS 74.A O no hydrogen 2.945 N/A PHE 79.A N SER 75.A O no hydrogen 2.903 N/A ASP 80.A N ARG 76.A O no hydrogen 2.945 N/A THR 81.A OG1 GLU 77.A O no hydrogen 3.157 N/A TYR 82.A N ILE 78.A O no hydrogen 3.142 N/A ILE 83.A N PHE 79.A O no hydrogen 3.067 N/A MET 84.A N PHE 79.A O no hydrogen 3.178 N/A LYS 85.A NZ THR 81.A O no hydrogen 3.384 N/A LEU 87.A N ILE 83.A O no hydrogen 2.874 N/A LEU 88.A N MET 84.A O no hydrogen 2.903 N/A ALA 89.A N LYS 85.A O no hydrogen 2.818 N/A CYS 90.A N LEU 87.A O no hydrogen 3.230 N/A CYS 90.A SG LEU 88.A O no hydrogen 3.893 N/A SER 91.A N GLU 86.A O no hydrogen 2.934 N/A HIS 92.A ND1 GLU 86.A OE1 no hydrogen 3.375 N/A PHE 94.A N HIS 92.A O no hydrogen 3.004 N/A SER 95.A N GLU 122.A OE1 no hydrogen 2.899 N/A SER 95.A OG SER 97.A OG no hydrogen 3.162 N/A SER 95.A OG GLU 122.A OE1 no hydrogen 3.015 N/A SER 95.A OG GLU 122.A OE2 no hydrogen 2.600 N/A SER 97.A OG SER 95.A OG no hydrogen 3.162 N/A ALA 98.A N SER 95.A OG no hydrogen 3.121 N/A ILE 99.A N SER 95.A O no hydrogen 3.299 N/A GLU 100.A N LYS 96.A O no hydrogen 2.862 N/A HIS 101.A N SER 97.A O no hydrogen 2.993 N/A GLN 103.A N ILE 99.A O no hydrogen 3.020 N/A GLY 104.A N GLU 100.A O no hydrogen 3.060 N/A HIS 105.A N HIS 101.A O no hydrogen 3.152 N/A HIS 105.A ND1 HIS 101.A O no hydrogen 2.664 N/A LEU 106.A N VAL 102.A O no hydrogen 2.708 N/A VAL 107.A N GLN 103.A O no hydrogen 3.274 N/A LYS 109.A N LEU 106.A O no hydrogen 2.569 N/A GLN 110.A N HIS 105.A O no hydrogen 2.917 N/A LEU 115.A N PRO 112.A O no hydrogen 3.067 N/A GLN 117.A N ASP 114.A O no hydrogen 2.966 N/A TYR 119.A N PHE 116.A O no hydrogen 2.999 N/A ILE 120.A N PHE 116.A O no hydrogen 3.325 N/A GLU 121.A N GLN 117.A O no hydrogen 3.291 N/A GLU 122.A N PRO 118.A O no hydrogen 3.117 N/A ILE 123.A N TYR 119.A O no hydrogen 2.783 N/A CYS 124.A N ILE 120.A O no hydrogen 2.983 N/A CYS 124.A SG ILE 120.A O no hydrogen 3.236 N/A GLN 125.A N GLU 121.A O no hydrogen 2.877 N/A ASN 126.A N GLU 122.A O no hydrogen 3.265 N/A ASN 126.A ND2 PRO 93.A O no hydrogen 2.986 N/A LEU 127.A N CYS 124.A O no hydrogen 2.944 N/A ARG 128.A N CYS 124.A O no hydrogen 3.033 N/A PHE 132.A N LEU 127.A O no hydrogen 2.952 N/A GLN 133.A N GLY 129.A O no hydrogen 2.848 N/A LYS 134.A N ASP 130.A O no hydrogen 3.134 N/A LYS 134.A NZ GLU 48.A OE2 no hydrogen 3.136 N/A LYS 134.A NZ ASP 130.A OD2 no hydrogen 3.508 N/A PHE 135.A N VAL 131.A O no hydrogen 2.933 N/A ILE 136.A N PHE 132.A O no hydrogen 2.817 N/A GLU 137.A N GLN 133.A O no hydrogen 2.903 N/A SER 138.A N PHE 135.A O no hydrogen 3.209 N/A SER 138.A OG PHE 135.A O no hydrogen 2.681 N/A LYS 140.A N SER 138.A OG no hydrogen 3.087 N/A LYS 140.A NZ ASP 40.A OD1 no hydrogen 3.021 N/A THR 142.A N SER 138.A O no hydrogen 3.464 N/A THR 142.A OG1 SER 138.A O no hydrogen 3.171 N/A ARG 143.A N ASP 139.A O no hydrogen 2.778 N/A ARG 143.A NE GLN 146.A OE1 no hydrogen 3.002 N/A ARG 143.A NH1 ASN 489.A O no hydrogen 3.264 N/A ARG 143.A NH1 ASN 489.A OD1 no hydrogen 3.204 N/A ARG 143.A NH1 ASP 493.A OD1 no hydrogen 2.757 N/A ARG 143.A NH2 ASP 493.A OD1 no hydrogen 2.568 N/A ARG 143.A NH2 GLU 496.A OE1 no hydrogen 3.126 N/A PHE 144.A N LYS 140.A O no hydrogen 2.689 N/A CYS 145.A N PHE 141.A O no hydrogen 3.012 N/A CYS 145.A SG PHE 141.A O no hydrogen 3.156 N/A GLN 146.A N THR 142.A O no hydrogen 2.996 N/A GLN 146.A NE2 PRO 5.A O no hydrogen 3.046 N/A GLN 146.A NE2 GLU 496.A OE2 no hydrogen 2.820 N/A TRP 147.A N ARG 143.A O no hydrogen 2.891 N/A TRP 147.A NE1 ASN 489.A OD1 no hydrogen 2.872 N/A LYS 148.A N PHE 144.A O no hydrogen 2.681 N/A ASN 149.A N CYS 145.A O no hydrogen 2.823 N/A ASN 149.A ND2 SER 588.A OG no hydrogen 3.195 N/A GLU 151.A N TRP 147.A O no hydrogen 3.202 N/A LEU 152.A N LYS 148.A O no hydrogen 3.138 N/A ASN 153.A ND2 ASP 589.A OD1 no hydrogen 2.926 N/A HIS 155.A NE2 ASP 589.A OD1 no hydrogen 2.903 N/A THR 157.A N ASP 160.A OD2 no hydrogen 2.754 N/A THR 157.A OG1 ASP 160.A OD2 no hydrogen 2.632 N/A PHE 161.A N MET 158.A O no hydrogen 2.705 N/A SER 162.A N ARG 179.A O no hydrogen 2.904 N/A HIS 164.A N GLY 177.A O no hydrogen 2.649 N/A ILE 167.A N VAL 175.A O no hydrogen 2.876 N/A GLY 168.A N VAL 175.A O no hydrogen 3.357 N/A ARG 169.A N ALA 450.A O no hydrogen 3.366 N/A GLY 170.A N GLY 173.A O no hydrogen 3.049 N/A VAL 175.A N GLY 168.A O no hydrogen 3.009 N/A TYR 176.A N MET 189.A O no hydrogen 2.985 N/A GLY 177.A N ARG 165.A O no hydrogen 3.444 N/A CYS 178.A N TYR 187.A O no hydrogen 2.926 N/A CYS 178.A SG TYR 187.A O no hydrogen 3.251 N/A ARG 179.A N SER 162.A O no hydrogen 2.896 N/A LYS 180.A N LYS 185.A O no hydrogen 3.034 N/A LYS 180.A NZ ASP 182.A OD1 no hydrogen 3.411 N/A LYS 180.A NZ ASP 182.A OD2 no hydrogen 2.812 N/A ALA 181.A N ASP 160.A O no hydrogen 3.004 N/A THR 183.A OG1 LYS 180.A O no hydrogen 3.449 N/A THR 183.A OG1 ASP 182.A OD1 no hydrogen 3.430 N/A THR 183.A OG1 GLU 479.A OE2 no hydrogen 2.857 N/A GLY 184.A N LYS 180.A O no hydrogen 2.749 N/A LYS 185.A NZ GLU 482.A OE1 no hydrogen 2.412 N/A TYR 187.A N CYS 178.A O no hydrogen 3.201 N/A TYR 187.A OH GLU 479.A OE1 no hydrogen 2.298 N/A ALA 188.A N LEU 241.A O no hydrogen 3.146 N/A MET 189.A N TYR 176.A O no hydrogen 2.793 N/A LYS 190.A N PHE 239.A O no hydrogen 2.972 N/A LYS 190.A NZ GLU 209.A OE2 no hydrogen 2.786 N/A LYS 190.A NZ ASP 305.A OD1 no hydrogen 2.936 N/A CYS 191.A N GLU 174.A O no hydrogen 3.284 N/A CYS 191.A SG SER 238.A OG no hydrogen 3.528 N/A LEU 192.A N LEU 237.A O no hydrogen 2.795 N/A ASP 193.A N PHE 172.A O no hydrogen 3.388 N/A LYS 194.A N ASP 235.A O no hydrogen 3.304 N/A LYS 194.A NZ THR 233.A O no hydrogen 3.258 N/A LYS 195.A N ASP 193.A OD1 no hydrogen 3.206 N/A ARG 196.A N ASP 193.A OD2 no hydrogen 3.286 N/A ARG 196.A NH1 PHE 172.A O no hydrogen 3.562 N/A ARG 196.A NH1 GLU 174.A OE1 no hydrogen 3.064 N/A ARG 196.A NH1 GLU 174.A OE2 no hydrogen 3.563 N/A ILE 197.A N ASP 193.A O no hydrogen 3.368 N/A LYS 198.A N LYS 194.A O no hydrogen 3.095 N/A LYS 198.A NZ LYS 456.A O no hydrogen 2.748 N/A LYS 198.A NZ ASP 461.A OD2 no hydrogen 3.064 N/A MET 199.A N LYS 195.A O no hydrogen 3.261 N/A LYS 200.A N ARG 196.A O no hydrogen 2.838 N/A GLN 201.A N LYS 198.A O no hydrogen 3.346 N/A GLY 202.A N ILE 197.A O no hydrogen 3.108 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 2.974 N/A ALA 206.A N GLY 202.A O no hydrogen 3.014 N/A LEU 207.A N GLU 203.A O no hydrogen 2.850 N/A ASN 208.A N THR 204.A O no hydrogen 3.037 N/A GLU 209.A N LEU 205.A O no hydrogen 3.046 N/A ARG 210.A N ALA 206.A O no hydrogen 3.488 N/A ILE 211.A N LEU 207.A O no hydrogen 3.448 N/A MET 212.A N ASN 208.A O no hydrogen 2.991 N/A LEU 213.A N GLU 209.A O no hydrogen 2.645 N/A SER 214.A N ARG 210.A O no hydrogen 3.083 N/A LEU 215.A N ILE 211.A O no hydrogen 3.062 N/A VAL 216.A N MET 212.A O no hydrogen 3.191 N/A VAL 216.A N LEU 213.A O no hydrogen 2.932 N/A SER 217.A N LEU 213.A O no hydrogen 2.774 N/A SER 217.A OG LEU 213.A O no hydrogen 2.515 N/A GLY 219.A N GLU 474.A OE1 no hydrogen 3.068 N/A VAL 225.A N ILE 303.A O no hydrogen 2.957 N/A CYS 226.A N ASP 242.A OD2 no hydrogen 3.273 N/A CYS 226.A SG VAL 216.A O no hydrogen 3.917 N/A CYS 226.A SG ILE 224.A O no hydrogen 3.698 N/A MET 227.A N SER 217.A OG no hydrogen 3.003 N/A SER 228.A N ILE 240.A O no hydrogen 2.950 N/A TYR 229.A OH GLU 479.A OE1 no hydrogen 3.020 N/A TYR 229.A OH GLU 479.A OE2 no hydrogen 3.417 N/A ALA 230.A N LEU 470.A O no hydrogen 3.098 N/A PHE 231.A N SER 238.A O no hydrogen 3.035 N/A THR 233.A N LYS 236.A O no hydrogen 3.003 N/A LYS 236.A NZ ASP 193.A OD1 no hydrogen 3.455 N/A LEU 237.A N LEU 192.A O no hydrogen 2.978 N/A SER 238.A N PHE 231.A O no hydrogen 2.985 N/A ILE 240.A N TYR 229.A O no hydrogen 2.725 N/A LEU 241.A N ALA 188.A O no hydrogen 2.845 N/A ASP 242.A N CYS 226.A O no hydrogen 3.072 N/A LEU 249.A N ILE 293.A O no hydrogen 3.054 N/A HIS 250.A N ASP 248.A OD1 no hydrogen 2.940 N/A TYR 251.A N ASP 248.A OD1 no hydrogen 3.243 N/A HIS 252.A N ASP 248.A O no hydrogen 3.021 N/A HIS 252.A NE2 GLY 246.A O no hydrogen 2.747 N/A LEU 253.A N LEU 249.A O no hydrogen 2.744 N/A SER 254.A N HIS 250.A O no hydrogen 3.147 N/A SER 254.A OG TYR 251.A O no hydrogen 2.835 N/A GLN 255.A N TYR 251.A O no hydrogen 3.178 N/A HIS 256.A N HIS 252.A O no hydrogen 2.910 N/A HIS 256.A ND1 GLY 257.A O no hydrogen 2.923 N/A PHE 259.A N LEU 354.A O no hydrogen 2.915 N/A SER 260.A OG ASP 263.A OD2 no hydrogen 2.857 N/A ASP 263.A N SER 260.A OG no hydrogen 3.337 N/A MET 264.A N SER 260.A O no hydrogen 2.819 N/A ARG 265.A N GLU 261.A O no hydrogen 3.058 N/A ARG 265.A NH1 PHE 422.A O no hydrogen 2.589 N/A PHE 266.A N ASP 263.A O no hydrogen 3.233 N/A ALA 268.A N MET 264.A O no hydrogen 2.663 N/A ALA 269.A N ARG 265.A O no hydrogen 3.031 N/A GLU 270.A N PHE 266.A O no hydrogen 3.245 N/A ILE 271.A N TYR 267.A O no hydrogen 2.982 N/A ILE 272.A N ALA 268.A O no hydrogen 2.760 N/A LEU 273.A N ALA 269.A O no hydrogen 3.088 N/A GLY 274.A N GLU 270.A O no hydrogen 3.339 N/A LEU 275.A N ILE 271.A O no hydrogen 3.033 N/A GLU 276.A N ILE 272.A O no hydrogen 2.917 N/A HIS 277.A N LEU 273.A O no hydrogen 3.204 N/A HIS 277.A N GLY 274.A O no hydrogen 3.060 N/A MET 278.A N GLY 274.A O no hydrogen 3.435 N/A HIS 279.A N LEU 275.A O no hydrogen 2.991 N/A HIS 279.A NE2 ASP 343.A OD2 no hydrogen 3.069 N/A ASN 280.A N GLU 276.A O no hydrogen 3.251 N/A ARG 281.A NE LEU 215.A O no hydrogen 3.156 N/A PHE 282.A N HIS 279.A O no hydrogen 3.234 N/A VAL 283.A N MET 278.A O no hydrogen 2.649 N/A VAL 284.A N CYS 310.A O no hydrogen 3.294 N/A TYR 285.A N ASP 343.A OD2 no hydrogen 2.857 N/A TYR 285.A OH SER 304.A O no hydrogen 2.187 N/A TYR 285.A OH ASP 305.A O no hydrogen 3.309 N/A ARG 286.A N ASP 343.A OD1 no hydrogen 2.659 N/A ARG 286.A NE LEU 308.A O no hydrogen 2.611 N/A ARG 286.A NH1 TYR 338.A OH no hydrogen 3.047 N/A ARG 286.A NH2 LEU 308.A O no hydrogen 2.974 N/A ASP 287.A N TYR 285.A O no hydrogen 2.978 N/A LEU 288.A N ARG 286.A O no hydrogen 2.600 N/A LYS 289.A NZ THR 323.A OG1 no hydrogen 2.927 N/A ASN 292.A N LYS 289.A O no hydrogen 2.988 N/A ASN 292.A ND2 ASP 287.A O no hydrogen 2.704 N/A ASN 292.A ND2 ASP 287.A OD2 no hydrogen 3.017 N/A ILE 293.A N PRO 290.A O no hydrogen 3.089 N/A LEU 294.A N ARG 302.A O no hydrogen 2.900 N/A ASP 296.A N HIS 300.A O no hydrogen 3.156 N/A GLY 299.A N ASP 296.A O no hydrogen 3.181 N/A HIS 300.A N ASP 296.A OD1 no hydrogen 2.590 N/A HIS 300.A ND1 GLU 270.A OE2 no hydrogen 2.765 N/A VAL 301.A N GLU 270.A OE1 no hydrogen 2.900 N/A ARG 302.A N LEU 294.A O no hydrogen 2.992 N/A ARG 302.A NE ILE 224.A O no hydrogen 3.263 N/A ARG 302.A NH2 CYS 221.A O no hydrogen 3.443 N/A ILE 303.A N PHE 223.A O no hydrogen 2.827 N/A SER 304.A N ASN 292.A O no hydrogen 3.025 N/A SER 304.A OG ASP 305.A OD1 no hydrogen 3.318 N/A ALA 309.A N LEU 306.A O no hydrogen 3.214 N/A CYS 310.A N VAL 284.A O no hydrogen 3.167 N/A CYS 310.A SG ASP 311.A O no hydrogen 3.633 N/A PHE 312.A N PHE 282.A O no hydrogen 2.679 N/A SER 313.A N ASP 311.A OD1 no hydrogen 2.945 N/A SER 313.A OG ASP 311.A OD1 no hydrogen 3.194 N/A LYS 316.A NZ ASP 339.A OD2 no hydrogen 3.473 N/A SER 320.A OG VAL 331.A O no hydrogen 3.218 N/A THR 323.A OG1 ASP 287.A OD1 no hydrogen 2.578 N/A HIS 324.A ND1 ASP 373.A OD1 no hydrogen 3.140 N/A TYR 326.A N THR 323.A O no hydrogen 3.404 N/A GLU 330.A N GLU 330.A OE1 no hydrogen 2.671 N/A LEU 332.A N ALA 328.A O no hydrogen 3.246 N/A GLN 333.A N PRO 329.A O no hydrogen 3.033 N/A TYR 338.A N PRO 317.A O no hydrogen 3.249 N/A TYR 338.A OH ALA 319.A O no hydrogen 2.702 N/A SER 341.A N ASP 339.A OD1 no hydrogen 3.237 N/A SER 341.A OG GLU 330.A OE2 no hydrogen 2.582 N/A ALA 342.A N ASP 339.A O no hydrogen 3.340 N/A ASP 343.A N SER 340.A O no hydrogen 3.234 N/A SER 346.A N ALA 342.A O no hydrogen 3.154 N/A SER 346.A OG TYR 326.A O no hydrogen 2.592 N/A SER 346.A OG ALA 342.A O no hydrogen 3.081 N/A LEU 347.A N ASP 343.A O no hydrogen 2.651 N/A GLY 348.A N TRP 344.A O no hydrogen 3.409 N/A CYS 349.A N PHE 345.A O no hydrogen 2.974 N/A CYS 349.A SG GLY 325.A O no hydrogen 3.804 N/A CYS 349.A SG PHE 345.A O no hydrogen 3.392 N/A MET 350.A N SER 346.A O no hydrogen 2.751 N/A LEU 351.A N LEU 347.A O no hydrogen 2.726 N/A PHE 352.A N GLY 348.A O no hydrogen 3.184 N/A LYS 353.A N CYS 349.A O no hydrogen 3.146 N/A LEU 354.A N MET 350.A O no hydrogen 3.061 N/A LEU 355.A N LEU 351.A O no hydrogen 3.416 N/A ARG 356.A N PHE 352.A O no hydrogen 2.669 N/A GLY 357.A N LYS 353.A O no hydrogen 2.732 N/A HIS 358.A ND1 SER 359.A O no hydrogen 3.127 N/A GLU 371.A N ASP 368.A O no hydrogen 3.397 N/A ILE 372.A N ASP 368.A O no hydrogen 3.483 N/A ASP 373.A N LYS 369.A O no hydrogen 3.004 N/A ARG 374.A NH1 GLU 371.A OE2 no hydrogen 2.700 N/A MET 375.A N GLU 371.A O no hydrogen 3.040 N/A THR 376.A N ILE 372.A O no hydrogen 3.250 N/A THR 376.A OG1 ILE 372.A O no hydrogen 2.710 N/A LEU 377.A N ASP 373.A O no hydrogen 3.356 N/A THR 378.A N ARG 374.A O no hydrogen 2.992 N/A THR 378.A OG1 ARG 374.A O no hydrogen 2.492 N/A SER 388.A N GLU 261.A OE2 no hydrogen 2.925 N/A SER 388.A OG GLU 261.A OE1 no hydrogen 3.142 N/A LEU 391.A N SER 388.A OG no hydrogen 3.039 N/A ARG 392.A N SER 388.A O no hydrogen 2.990 N/A SER 393.A N PRO 389.A O no hydrogen 3.303 N/A LEU 395.A N LEU 391.A O no hydrogen 3.056 N/A GLU 396.A N ARG 392.A O no hydrogen 2.629 N/A GLY 397.A N SER 393.A O no hydrogen 3.136 N/A LEU 398.A N LEU 394.A O no hydrogen 2.823 N/A LEU 399.A N LEU 395.A O no hydrogen 3.127 N/A LEU 399.A N GLU 396.A O no hydrogen 3.166 N/A ARG 405.A N ASP 402.A O no hydrogen 3.249 N/A ARG 406.A N VAL 403.A O no hydrogen 3.444 N/A ARG 406.A NE GLN 400.A O no hydrogen 3.187 N/A ARG 406.A NH1 GLU 330.A OE2 no hydrogen 3.171 N/A ARG 406.A NH1 SER 341.A O no hydrogen 2.690 N/A ARG 406.A NH2 GLU 330.A OE1 no hydrogen 2.839 N/A ARG 406.A NH2 GLN 400.A O no hydrogen 3.561 N/A LEU 407.A N GLY 397.A O no hydrogen 2.990 N/A GLY 408.A N GLU 416.A OE1 no hydrogen 3.102 N/A CYS 409.A N ARG 406.A O no hydrogen 3.223 N/A CYS 409.A SG LEU 407.A O no hydrogen 3.811 N/A LEU 410.A N GLU 416.A OE1 no hydrogen 3.211 N/A ARG 412.A N GLU 416.A OE2 no hydrogen 2.711 N/A ARG 412.A NH2 GLU 419.A OE2 no hydrogen 2.986 N/A GLU 416.A N GLY 413.A O no hydrogen 2.911 N/A LYS 418.A N ALA 414.A O no hydrogen 2.777 N/A LYS 418.A NZ GLU 276.A OE1 no hydrogen 3.333 N/A LYS 418.A NZ GLU 276.A OE2 no hydrogen 3.435 N/A GLU 419.A N GLN 415.A O no hydrogen 3.118 N/A SER 420.A N VAL 417.A O no hydrogen 3.023 N/A PHE 423.A N SER 420.A O no hydrogen 3.339 N/A ARG 424.A N PRO 421.A O no hydrogen 3.061 N/A LEU 426.A N PHE 423.A O no hydrogen 2.989 N/A ASP 427.A N TYR 436.A OH no hydrogen 2.908 N/A MET 430.A N ASP 427.A O no hydrogen 2.919 N/A VAL 431.A N ASP 427.A O no hydrogen 3.238 N/A PHE 432.A N TRP 428.A O no hydrogen 2.975 N/A LEU 433.A N GLN 429.A O no hydrogen 2.950 N/A GLN 434.A N VAL 431.A O no hydrogen 2.971 N/A LYS 435.A N MET 430.A O no hydrogen 2.742 N/A LYS 435.A NZ GLU 66.A OE2 no hydrogen 3.380 N/A ASN 448.A ND2 ASP 451.A OD2 no hydrogen 2.742 N/A LEU 458.A N ASP 461.A OD2 no hydrogen 2.900 N/A ASP 461.A N LEU 458.A O no hydrogen 3.192 N/A GLN 462.A NE2 PRO 234.A O no hydrogen 2.948 N/A GLU 463.A N ASP 459.A O no hydrogen 3.033 N/A LEU 464.A N ASP 461.A O no hydrogen 3.034 N/A LEU 470.A N ALA 230.A O no hydrogen 2.915 N/A ILE 472.A N SER 228.A O no hydrogen 3.130 N/A SER 473.A OG GLU 151.A OE2 no hydrogen 2.425 N/A ARG 475.A NE SER 217.A O no hydrogen 3.428 N/A ARG 475.A NH1 ASP 220.A OD1 no hydrogen 3.261 N/A TRP 476.A N ILE 472.A O no hydrogen 3.088 N/A GLN 477.A N SER 473.A O no hydrogen 2.945 N/A GLN 477.A NE2 GLN 31.A OE1 no hydrogen 3.323 N/A GLN 477.A NE2 GLU 151.A OE1 no hydrogen 3.288 N/A GLN 478.A N GLU 474.A O no hydrogen 3.164 N/A GLU 479.A N ARG 475.A O no hydrogen 2.968 N/A VAL 480.A N TRP 476.A O no hydrogen 3.144 N/A ALA 481.A N GLN 477.A O no hydrogen 3.156 N/A GLU 482.A N GLN 478.A O no hydrogen 3.000 N/A THR 483.A N VAL 480.A O no hydrogen 3.076 N/A THR 483.A OG1 GLU 479.A O no hydrogen 2.929 N/A THR 483.A OG1 VAL 480.A O no hydrogen 3.380 N/A VAL 484.A N VAL 480.A O no hydrogen 3.229 N/A PHE 485.A N VAL 480.A O no hydrogen 3.240 N/A THR 487.A OG1 VAL 484.A O no hydrogen 3.048 N/A ILE 488.A N VAL 484.A O no hydrogen 2.909 N/A ASN 489.A N PHE 485.A O no hydrogen 2.975 N/A ALA 490.A N ASP 486.A O no hydrogen 3.071 N/A GLU 491.A N THR 487.A O no hydrogen 2.785 N/A THR 492.A N ILE 488.A O no hydrogen 2.736 N/A THR 492.A OG1 ILE 488.A O no hydrogen 3.248 N/A ASP 493.A N ASN 489.A O no hydrogen 3.232 N/A ARG 494.A N ALA 490.A O no hydrogen 3.231 N/A LEU 495.A N GLU 491.A O no hydrogen 3.042 N/A GLU 496.A N THR 492.A O no hydrogen 3.001 N/A ALA 497.A N ASP 493.A O no hydrogen 3.148 N/A ARG 498.A N ARG 494.A O no hydrogen 3.067 N/A LYS 499.A N LEU 495.A O no hydrogen 3.304 N/A THR 501.A N ALA 497.A O no hydrogen 3.230 N/A THR 501.A OG1 ALA 497.A O no hydrogen 3.148 N/A LYS 502.A N ARG 498.A O no hydrogen 2.980 N/A ASN 503.A N LYS 499.A O no hydrogen 2.842 N/A LYS 504.A N LYS 500.A O no hydrogen 2.946 N/A GLN 505.A N THR 501.A O no hydrogen 3.386 N/A LEU 506.A N LYS 502.A O no hydrogen 3.091 N/A GLY 507.A N LYS 504.A O no hydrogen 3.406 N/A GLU 510.A N GLU 510.A OE1 no hydrogen 2.598 N/A TYR 512.A OH GLU 541.A OE1 no hydrogen 2.488 N/A TYR 512.A OH GLU 541.A OE2 no hydrogen 3.348 N/A LEU 514.A N ASP 511.A O no hydrogen 3.430 N/A LYS 516.A NZ TYR 512.A O no hydrogen 2.689 N/A CYS 518.A SG MET 520.A O no hydrogen 3.583 N/A CYS 518.A SG LEU 535.A O no hydrogen 3.676 N/A ILE 519.A N LEU 535.A O no hydrogen 2.724 N/A MET 520.A N LEU 535.A O no hydrogen 3.408 N/A HIS 521.A ND1 TYR 532.A OH no hydrogen 2.778 N/A GLY 522.A N PHE 533.A O no hydrogen 3.228 N/A MET 524.A N ARG 531.A O no hydrogen 3.228 N/A SER 525.A N GLN 585.A O no hydrogen 3.111 N/A LYS 526.A N GLN 529.A O no hydrogen 3.010 N/A LYS 526.A NZ GLN 529.A OE1 no hydrogen 2.721 N/A GLN 529.A N LYS 526.A O no hydrogen 3.007 N/A ARG 530.A NE ASP 587.A OD2 no hydrogen 3.160 N/A ARG 530.A NH2 ASP 587.A OD2 no hydrogen 3.325 N/A ARG 531.A N MET 524.A O no hydrogen 2.986 N/A TYR 532.A N ARG 543.A O no hydrogen 3.028 N/A TYR 532.A OH HIS 521.A ND1 no hydrogen 2.778 N/A PHE 533.A N GLY 522.A O no hydrogen 2.863 N/A TYR 534.A N GLU 541.A O no hydrogen 3.331 N/A LEU 535.A N MET 520.A O no hydrogen 2.820 N/A PHE 536.A N ARG 539.A O no hydrogen 2.870 N/A ARG 539.A N PHE 536.A O no hydrogen 3.434 N/A ARG 539.A NE GLU 541.A OE2 no hydrogen 2.827 N/A ARG 539.A NH1 ASN 538.A OD1 no hydrogen 2.987 N/A ARG 539.A NH2 GLU 541.A OE2 no hydrogen 3.128 N/A LEU 540.A N LEU 553.A O no hydrogen 2.666 N/A TRP 542.A N SER 551.A O no hydrogen 3.286 N/A ARG 543.A N TYR 532.A O no hydrogen 2.866 N/A ARG 543.A NE TYR 534.A OH no hydrogen 2.915 N/A ARG 543.A NH1 GLY 544.A O no hydrogen 3.535 N/A ARG 543.A NH2 TYR 534.A OH no hydrogen 2.912 N/A LEU 553.A N LEU 540.A O no hydrogen 2.936 N/A THR 554.A N GLU 557.A OE1 no hydrogen 2.734 N/A THR 554.A OG1 GLU 557.A OE1 no hydrogen 3.040 N/A MET 555.A N ASN 538.A O no hydrogen 3.313 N/A GLU 557.A N THR 554.A OG1 no hydrogen 3.137 N/A GLN 559.A N LYS 575.A O no hydrogen 2.662 N/A SER 560.A N LYS 575.A O no hydrogen 3.442 N/A GLU 562.A N LEU 573.A O no hydrogen 2.927 N/A THR 564.A N CYS 571.A O no hydrogen 2.909 N/A ILE 566.A N ARG 569.A O no hydrogen 2.844 N/A ARG 569.A N ILE 566.A O no hydrogen 3.241 N/A CYS 571.A N THR 564.A O no hydrogen 2.744 N/A LEU 572.A N LEU 584.A O no hydrogen 3.125 N/A LEU 573.A N GLU 562.A O no hydrogen 2.637 N/A LEU 574.A N PHE 582.A O no hydrogen 2.831 N/A LYS 575.A N SER 560.A O no hydrogen 2.972 N/A ILE 576.A N LYS 580.A O no hydrogen 2.696 N/A ARG 577.A N GLU 557.A O no hydrogen 2.721 N/A PHE 582.A N LEU 574.A O no hydrogen 2.796 N/A LEU 584.A N LEU 572.A O no hydrogen 3.275 N/A GLN 585.A N SER 525.A O no hydrogen 2.816 N/A SER 588.A OG GLU 591.A OE1 no hydrogen 2.547 N/A LEU 592.A N SER 588.A O no hydrogen 3.038 N/A VAL 593.A N ASP 589.A O no hydrogen 3.251 N/A GLN 594.A N PRO 590.A O no hydrogen 3.094 N/A GLN 594.A NE2 ASP 19.A OD2 no hydrogen 2.851 N/A GLN 594.A NE2 GLU 598.A OE2 no hydrogen 3.143 N/A TRP 595.A N GLU 591.A O no hydrogen 2.906 N/A LYS 596.A N LEU 592.A O no hydrogen 3.159 N/A LYS 597.A N VAL 593.A O no hydrogen 2.974 N/A LYS 597.A NZ ASP 19.A OD2 no hydrogen 3.107 N/A LYS 597.A NZ GLU 598.A OE2 no hydrogen 3.381 N/A GLU 598.A N GLN 594.A O no hydrogen 2.763 N/A LEU 599.A N TRP 595.A O no hydrogen 2.825 N/A ARG 600.A N LYS 596.A O no hydrogen 3.383 N/A ASP 601.A N LYS 597.A O no hydrogen 2.888 N/A ALA 602.A N GLU 598.A O no hydrogen 3.047 N/A TYR 603.A N LEU 599.A O no hydrogen 2.962 N/A ARG 604.A N ARG 600.A O no hydrogen 3.278 N/A GLU 605.A N ASP 601.A O no hydrogen 3.163 N/A ALA 606.A N ALA 602.A O no hydrogen 2.928 N/A GLN 607.A N TYR 603.A O no hydrogen 2.996 N/A GLN 607.A NE2 MET 555.A O no hydrogen 3.578 N/A GLN 607.A NE2 GLU 556.A O no hydrogen 3.443 N/A GLN 607.A NE2 ILE 558.A O no hydrogen 2.916 N/A GLN 608.A N ARG 604.A O no hydrogen 3.076 N/A LEU 609.A N GLU 605.A O no hydrogen 3.151 N/A VAL 610.A N ALA 606.A O no hydrogen 2.833 N/A GLN 611.A N GLN 607.A O no hydrogen 3.111 N/A VAL 613.A N VAL 610.A O no hydrogen 2.830 N/A MET 616.A N VAL 613.A O no hydrogen 3.087 N/A LYS 617.A N VAL 613.A O no hydrogen 3.044 N/A LYS 617.A NZ GLN 611.A O no hydrogen 3.014 N/A