Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7hkq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ASN 1.A O no hydrogen 3.258 N/A ILE 4.A N ASP 3.A OD1 no hydrogen 2.838 N/A GLY 6.A N LEU 2.A O no hydrogen 3.124 N/A LYS 7.A NZ GLU 160.A OE1 no hydrogen 3.506 N/A ARG 8.A NH1 CYS 162.A O no hydrogen 3.396 N/A ARG 8.A NH1 LEU 268.A O no hydrogen 2.750 N/A ARG 8.A NH1 ASN 272.A O no hydrogen 3.436 N/A ARG 8.A NH2 ILE 4.A O no hydrogen 3.019 N/A ARG 8.A NH2 LEU 268.A O no hydrogen 2.977 N/A ILE 9.A N ILE 5.A O no hydrogen 3.164 N/A GLU 10.A N GLY 6.A O no hydrogen 2.829 N/A LYS 11.A N LYS 7.A O no hydrogen 3.109 N/A ILE 12.A N ILE 9.A O no hydrogen 3.177 N/A LYS 13.A N ILE 9.A O no hydrogen 2.743 N/A GLN 14.A N GLU 10.A O no hydrogen 3.095 N/A GLU 15.A N LYS 11.A O no hydrogen 3.228 N/A HIS 16.A N ILE 12.A O no hydrogen 3.222 N/A GLU 17.A N GLN 14.A O no hydrogen 3.120 N/A SER 19.A N HIS 16.A O no hydrogen 3.119 N/A HIS 21.A N SER 36.A O no hydrogen 3.274 N/A HIS 21.A ND1 SER 19.A O no hydrogen 3.009 N/A ASP 23.A N TYR 33.A OH no hydrogen 3.468 N/A GLN 24.A N ASP 23.A OD1 no hydrogen 2.739 N/A ASP 25.A N ASP 23.A OD1 no hydrogen 3.458 N/A TYR 28.A OH ASP 285.A OD2 no hydrogen 2.765 N/A THR 30.A OG1 ASP 75.A OD1 no hydrogen 2.445 N/A TRP 31.A NE1 VAL 74.A O no hydrogen 3.034 N/A ALA 32.A N SER 288.A O no hydrogen 2.943 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.401 N/A HIS 34.A N ILE 286.A O no hydrogen 2.993 N/A HIS 34.A NE2 SER 288.A OG no hydrogen 2.970 N/A SER 36.A N HIS 21.A O no hydrogen 3.283 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.401 N/A SER 36.A OG ASP 285.A OD1 no hydrogen 3.100 N/A TYR 37.A N MET 284.A O no hydrogen 3.413 N/A SER 45.A OG ALA 68.A O no hydrogen 3.191 N/A ASN 48.A N ARG 433.A O no hydrogen 2.971 N/A ASN 48.A ND2 THR 445.A O no hydrogen 3.409 N/A VAL 51.A N ASN 48.A OD1 no hydrogen 3.245 N/A ARG 52.A N ASN 48.A O no hydrogen 3.085 N/A LEU 53.A N GLY 49.A O no hydrogen 2.963 N/A LEU 54.A N VAL 50.A O no hydrogen 3.382 N/A LEU 54.A N VAL 51.A O no hydrogen 3.278 N/A THR 55.A N ARG 52.A O no hydrogen 3.081 N/A THR 55.A OG1 VAL 51.A O no hydrogen 2.719 N/A THR 55.A OG1 ARG 52.A O no hydrogen 3.496 N/A ASP 59.A N LYS 56.A O no hydrogen 3.017 N/A ILE 61.A N TRP 58.A O no hydrogen 3.346 N/A VAL 64.A N ILE 61.A O no hydrogen 3.001 N/A THR 65.A N ILE 61.A O no hydrogen 3.080 N/A THR 65.A OG1 ILE 61.A O no hydrogen 3.526 N/A THR 65.A OG1 PRO 62.A O no hydrogen 3.357 N/A GLN 66.A N PRO 62.A O no hydrogen 2.901 N/A ALA 68.A N THR 65.A O no hydrogen 3.255 N/A MET 69.A N GLN 66.A O no hydrogen 3.067 N/A THR 76.A OG1 LYS 73.A O no hydrogen 2.624 N/A LYS 82.A N ASP 377.A OD2 no hydrogen 2.945 N/A THR 85.A OG1 ASP 377.A OD2 no hydrogen 2.558 N/A LYS 86.A N LYS 82.A O no hydrogen 3.173 N/A LYS 86.A NZ GLU 80.A OE1 no hydrogen 2.986 N/A LYS 86.A NZ GLU 83.A OE2 no hydrogen 2.906 N/A LYS 87.A N GLU 83.A O no hydrogen 2.871 N/A LEU 88.A N GLY 84.A O no hydrogen 3.083 N/A MET 89.A N THR 85.A O no hydrogen 2.794 N/A LYS 90.A N LYS 86.A O no hydrogen 2.944 N/A LYS 90.A NZ GLU 242.A OE2 no hydrogen 3.440 N/A LYS 90.A NZ ASN 246.A OD1 no hydrogen 3.407 N/A ILE 91.A N LYS 87.A O no hydrogen 2.837 N/A THR 92.A N LEU 88.A O no hydrogen 3.050 N/A THR 92.A OG1 LEU 88.A O no hydrogen 2.680 N/A ALA 93.A N MET 89.A O no hydrogen 2.940 N/A GLU 94.A N LYS 90.A O no hydrogen 3.257 N/A TRP 95.A N ILE 91.A O no hydrogen 3.303 N/A LEU 96.A N THR 92.A O no hydrogen 2.956 N/A TRP 97.A N ALA 93.A O no hydrogen 2.909 N/A TRP 97.A NE1 ASN 246.A O no hydrogen 3.074 N/A LYS 98.A N GLU 94.A O no hydrogen 3.228 N/A LYS 98.A NZ GLU 94.A OE2 no hydrogen 3.275 N/A GLU 99.A N TRP 95.A O no hydrogen 2.997 N/A LEU 100.A N LEU 96.A O no hydrogen 2.787 N/A GLY 101.A N TRP 97.A O no hydrogen 2.872 N/A LYS 102.A N GLU 99.A O no hydrogen 3.404 N/A LYS 102.A NZ GLU 99.A OE1 no hydrogen 3.343 N/A LYS 102.A NZ GLU 99.A OE2 no hydrogen 2.871 N/A LYS 104.A N GLY 101.A O no hydrogen 3.385 N/A LYS 104.A NZ ASP 192.A O no hydrogen 3.110 N/A ARG 107.A NE ASP 192.A OD2 no hydrogen 2.957 N/A ARG 107.A NH1 MET 108.A O no hydrogen 3.201 N/A ARG 107.A NH1 GLU 113.A OE1 no hydrogen 2.941 N/A ARG 107.A NH1 GLU 113.A OE2 no hydrogen 3.165 N/A ARG 107.A NH2 GLU 113.A OE2 no hydrogen 2.995 N/A ARG 107.A NH2 ASP 192.A OD1 no hydrogen 3.217 N/A CYS 109.A N GLU 184.A O no hydrogen 2.907 N/A THR 110.A N GLU 113.A OE1 no hydrogen 2.903 N/A ARG 111.A NH2 ASP 148.A OD1 no hydrogen 2.690 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.092 N/A PHE 114.A N THR 110.A O no hydrogen 3.075 N/A THR 115.A N ARG 111.A O no hydrogen 2.734 N/A THR 115.A OG1 ARG 111.A O no hydrogen 2.904 N/A ARG 116.A N GLU 112.A O no hydrogen 3.271 N/A LYS 117.A N GLU 113.A O no hydrogen 3.256 N/A LYS 117.A NZ GLU 191.A OE2 no hydrogen 2.921 N/A VAL 118.A N PHE 114.A O no hydrogen 3.370 N/A ARG 119.A N THR 115.A O no hydrogen 3.374 N/A SER 120.A N ARG 116.A O no hydrogen 3.167 N/A ASN 121.A N VAL 118.A O no hydrogen 3.349 N/A ALA 122.A N LYS 117.A O no hydrogen 3.224 N/A LYS 132.A N GLU 136.A OE1 no hydrogen 3.120 N/A ARG 135.A NH1 ASN 121.A OD1 no hydrogen 2.486 N/A PHE 143.A N ASP 140.A OD1 no hydrogen 2.546 N/A TRP 144.A NE1 VAL 138.A O no hydrogen 3.132 N/A LEU 146.A N GLY 142.A O no hydrogen 3.470 N/A VAL 147.A N PHE 143.A O no hydrogen 2.938 N/A ASP 148.A N TRP 144.A O no hydrogen 2.751 N/A LYS 149.A N GLU 145.A O no hydrogen 2.684 N/A LYS 149.A NZ GLU 160.A OE2 no hydrogen 3.378 N/A GLU 150.A N LEU 146.A O no hydrogen 3.360 N/A ARG 151.A N VAL 147.A O no hydrogen 2.887 N/A ARG 151.A NH2 GLU 257.A OE1 no hydrogen 2.869 N/A ASN 152.A N ASP 148.A O no hydrogen 3.211 N/A LEU 153.A N LYS 149.A O no hydrogen 3.126 N/A HIS 154.A N GLU 150.A O no hydrogen 2.808 N/A LEU 155.A N ARG 151.A O no hydrogen 3.135 N/A GLU 156.A N ASN 152.A O no hydrogen 2.963 N/A GLY 157.A N HIS 154.A O no hydrogen 3.060 N/A LYS 158.A N LEU 153.A O no hydrogen 3.035 N/A CYS 159.A SG GLU 150.A OE1 no hydrogen 3.699 N/A CYS 159.A SG HIS 154.A NE2 no hydrogen 3.496 N/A GLU 160.A N GLU 150.A OE2 no hydrogen 2.806 N/A THR 161.A N GLU 150.A OE2 no hydrogen 3.338 N/A CYS 162.A SG GLU 150.A OE1 no hydrogen 3.090 N/A CYS 162.A SG HIS 154.A NE2 no hydrogen 3.822 N/A TYR 164.A N VAL 274.A O no hydrogen 2.927 N/A ASN 165.A N TYR 173.A O no hydrogen 2.952 N/A MET 166.A N ARG 276.A O no hydrogen 3.056 N/A TYR 173.A N ASN 165.A O no hydrogen 2.972 N/A TRP 175.A NE1 THR 161.A OG1 no hydrogen 3.213 N/A ALA 178.A N TRP 175.A O no hydrogen 2.745 N/A ARG 179.A N TRP 175.A O no hydrogen 3.309 N/A PHE 180.A N LEU 176.A O no hydrogen 2.741 N/A LEU 181.A N GLY 177.A O no hydrogen 3.274 N/A GLU 182.A N ALA 178.A O no hydrogen 3.179 N/A PHE 183.A N ARG 179.A O no hydrogen 3.045 N/A GLU 184.A N PHE 180.A O no hydrogen 2.626 N/A ALA 185.A N LEU 181.A O no hydrogen 3.320 N/A ALA 185.A N GLU 182.A O no hydrogen 3.222 N/A LEU 186.A N GLU 182.A O no hydrogen 2.978 N/A GLY 187.A N PHE 183.A O no hydrogen 2.823 N/A LEU 189.A N LEU 186.A O no hydrogen 3.099 N/A ASN 190.A ND2 GLU 205.A OE2 no hydrogen 3.226 N/A GLU 191.A N GLY 187.A O no hydrogen 2.872 N/A ASP 192.A N PHE 188.A O no hydrogen 2.999 N/A HIS 193.A N ASN 190.A O no hydrogen 2.803 N/A HIS 193.A ND1 GLU 205.A OE1 no hydrogen 2.863 N/A TRP 194.A N LEU 189.A O no hydrogen 2.976 N/A SER 196.A N HIS 193.A O no hydrogen 3.186 N/A SER 196.A OG HIS 193.A O no hydrogen 3.409 N/A ARG 197.A N GLU 207.A OE2 no hydrogen 3.265 N/A ARG 197.A NH1 SER 202.A O no hydrogen 2.913 N/A ARG 197.A NH1 GLY 203.A O no hydrogen 3.156 N/A ARG 197.A NH1 MET 352.A O no hydrogen 3.187 N/A ARG 197.A NH2 MET 352.A O no hydrogen 2.818 N/A ASN 199.A N SER 196.A OG no hydrogen 3.108 N/A ASN 199.A ND2 LEU 100.A O no hydrogen 3.022 N/A ASN 199.A ND2 TRP 194.A O no hydrogen 2.861 N/A SER 200.A N SER 196.A O no hydrogen 2.976 N/A SER 200.A OG SER 196.A O no hydrogen 2.807 N/A LEU 201.A N ARG 197.A O no hydrogen 2.903 N/A SER 202.A N SER 200.A O no hydrogen 2.761 N/A SER 202.A OG LEU 349.A O no hydrogen 2.539 N/A GLY 203.A N SER 200.A OG no hydrogen 3.044 N/A GLU 205.A N PHE 195.A O no hydrogen 3.060 N/A GLU 207.A N VAL 204.A O no hydrogen 3.196 N/A LYS 211.A N GLY 208.A O no hydrogen 2.722 N/A LEU 212.A N GLY 208.A O no hydrogen 3.313 N/A TYR 214.A OH VAL 417.A O no hydrogen 3.055 N/A ILE 215.A N LYS 211.A O no hydrogen 3.011 N/A LEU 216.A N LEU 212.A O no hydrogen 2.874 N/A ARG 217.A N GLY 213.A O no hydrogen 3.049 N/A ARG 217.A NH1 GLU 409.A OE1 no hydrogen 3.358 N/A ASP 218.A N TYR 214.A O no hydrogen 2.998 N/A VAL 219.A N ILE 215.A O no hydrogen 3.128 N/A SER 220.A N LEU 216.A O no hydrogen 3.010 N/A SER 220.A OG ARG 217.A O no hydrogen 2.630 N/A LYS 221.A N ARG 217.A O no hydrogen 3.278 N/A LYS 221.A NZ ASP 218.A OD1 no hydrogen 3.374 N/A LYS 222.A N VAL 219.A O no hydrogen 3.132 N/A LYS 222.A NZ SER 350.A OG no hydrogen 2.818 N/A GLY 225.A N PRO 363.A O no hydrogen 3.220 N/A ALA 226.A N ASP 366.A OD1 no hydrogen 2.871 N/A MET 227.A N TRP 394.A O no hydrogen 2.954 N/A TYR 228.A N VAL 361.A O no hydrogen 2.630 N/A TYR 228.A OH ASP 366.A OD1 no hydrogen 2.571 N/A ALA 233.A N VAL 381.A O no hydrogen 2.865 N/A TRP 235.A NE1 ASN 304.A OD1 no hydrogen 3.047 N/A THR 237.A N GLY 234.A O no hydrogen 2.827 N/A THR 237.A OG1 GLY 234.A O no hydrogen 2.548 N/A ARG 238.A N TRP 235.A O no hydrogen 3.171 N/A ARG 238.A NE ALA 233.A O no hydrogen 2.774 N/A THR 240.A N ASP 243.A OD2 no hydrogen 2.955 N/A ASP 243.A N THR 240.A OG1 no hydrogen 3.267 N/A LEU 244.A N THR 240.A O no hydrogen 3.245 N/A LYS 245.A N LEU 241.A O no hydrogen 2.919 N/A ASN 246.A N GLU 242.A O no hydrogen 2.935 N/A GLU 247.A N ASP 243.A O no hydrogen 2.840 N/A GLU 248.A N.A LEU 244.A O no hydrogen 2.961 N/A GLU 248.A N.B LEU 244.A O no hydrogen 2.967 N/A VAL 250.A N GLU 247.A O no hydrogen 3.308 N/A THR 251.A N GLU 248.A O.A no hydrogen 2.965 N/A THR 251.A N GLU 248.A O.B no hydrogen 2.830 N/A THR 251.A OG1 GLU 248.A O.A no hydrogen 2.693 N/A THR 251.A OG1 GLU 248.A O.B no hydrogen 2.756 N/A THR 251.A OG1 GLU 248.A OE2.B no hydrogen 2.760 N/A ASN 252.A N MET 249.A O no hydrogen 3.350 N/A HIS 253.A N VAL 250.A O no hydrogen 2.877 N/A MET 254.A N THR 251.A O no hydrogen 2.950 N/A HIS 258.A NE2 ALA 185.A O no hydrogen 2.870 N/A LYS 259.A N GLU 255.A O no hydrogen 3.327 N/A LYS 259.A NZ THR 251.A O no hydrogen 3.489 N/A LYS 260.A N GLY 256.A O no hydrogen 3.472 N/A LEU 261.A N GLU 257.A O no hydrogen 3.060 N/A ALA 262.A N HIS 258.A O no hydrogen 2.873 N/A GLU 263.A N LYS 259.A O no hydrogen 3.047 N/A ALA 264.A N LYS 260.A O no hydrogen 2.875 N/A ILE 265.A N LEU 261.A O no hydrogen 3.006 N/A PHE 266.A N ALA 262.A O no hydrogen 3.073 N/A LYS 267.A N GLU 263.A O no hydrogen 2.919 N/A LYS 267.A NZ GLU 248.A OE2.A no hydrogen 2.699 N/A LEU 268.A N ALA 264.A O no hydrogen 2.776 N/A THR 269.A N ILE 265.A O no hydrogen 2.812 N/A THR 269.A OG1 ILE 265.A O no hydrogen 2.532 N/A TYR 270.A N ILE 265.A O no hydrogen 3.148 N/A TYR 270.A OH GLU 182.A OE1 no hydrogen 2.840 N/A GLN 271.A N PHE 266.A O no hydrogen 2.839 N/A GLN 271.A NE2 GLU 248.A OE1.A no hydrogen 3.057 N/A ASN 272.A ND2 LYS 267.A O no hydrogen 2.896 N/A LYS 273.A N ARG 289.A O no hydrogen 3.001 N/A LYS 273.A NZ TYR 270.A O no hydrogen 2.744 N/A LYS 273.A NZ ASP 291.A O no hydrogen 2.581 N/A VAL 275.A N ILE 287.A O no hydrogen 3.024 N/A ARG 276.A N TYR 164.A O no hydrogen 2.730 N/A VAL 277.A N ASP 285.A O no hydrogen 2.997 N/A ARG 279.A N VAL 283.A O no hydrogen 3.349 N/A ARG 279.A NE ASP 285.A OD1 no hydrogen 3.406 N/A ARG 279.A NE ASP 285.A OD2 no hydrogen 3.059 N/A ARG 279.A NH1 ASP 25.A O no hydrogen 2.790 N/A ARG 279.A NH2 ASP 285.A OD1 no hydrogen 3.256 N/A THR 281.A OG1 ARG 279.A O no hydrogen 3.307 N/A VAL 283.A N ARG 279.A O no hydrogen 3.338 N/A ASP 285.A N VAL 277.A O no hydrogen 2.878 N/A ILE 286.A N GLY 35.A O no hydrogen 2.945 N/A ILE 287.A N VAL 275.A O no hydrogen 3.120 N/A SER 288.A N ALA 32.A O no hydrogen 2.746 N/A SER 288.A OG HIS 34.A NE2 no hydrogen 2.970 N/A ARG 289.A NE ASP 291.A OD1 no hydrogen 2.770 N/A ARG 289.A NH2 THR 76.A O no hydrogen 3.369 N/A ARG 289.A NH2 ASP 291.A OD1 no hydrogen 2.816 N/A ARG 290.A NE GLN 271.A O no hydrogen 3.455 N/A GLN 292.A N ILE 239.A O no hydrogen 2.798 N/A GLN 292.A NE2 VAL 74.A O no hydrogen 2.906 N/A ARG 293.A N ASP 236.A O no hydrogen 2.962 N/A ARG 293.A NE ASN 304.A OD1 no hydrogen 3.152 N/A ARG 293.A NH1 GLU 247.A OE1 no hydrogen 2.626 N/A ARG 293.A NH1 GLU 247.A OE2 no hydrogen 3.516 N/A ARG 293.A NH2 GLU 247.A OE1 no hydrogen 3.360 N/A ARG 293.A NH2 GLU 247.A OE2 no hydrogen 2.742 N/A ARG 293.A NH2 ASN 304.A OD1 no hydrogen 3.107 N/A GLY 296.A N GLU 182.A OE1 no hydrogen 2.736 N/A THR 300.A N GLY 296.A O no hydrogen 2.950 N/A THR 300.A OG1 GLY 296.A O no hydrogen 2.695 N/A TYR 301.A N GLN 297.A O no hydrogen 3.282 N/A TYR 301.A OH SER 355.A OG no hydrogen 2.852 N/A GLY 302.A N VAL 298.A O no hydrogen 3.473 N/A LEU 303.A N VAL 299.A O no hydrogen 2.877 N/A ASN 304.A N THR 300.A O no hydrogen 2.739 N/A ASN 304.A ND2 ASP 236.A OD1 no hydrogen 3.256 N/A THR 305.A N TYR 301.A O no hydrogen 2.885 N/A THR 305.A OG1 TYR 301.A O no hydrogen 2.647 N/A PHE 306.A N GLY 302.A O no hydrogen 3.059 N/A THR 307.A N LEU 303.A O no hydrogen 2.951 N/A THR 307.A OG1 GLU 247.A OE2 no hydrogen 2.534 N/A THR 307.A OG1 LEU 303.A O no hydrogen 3.392 N/A ASN 308.A N ASN 304.A O no hydrogen 2.857 N/A ASN 308.A ND2 GLY 356.A O no hydrogen 2.862 N/A MET 309.A N THR 305.A O no hydrogen 2.841 N/A GLU 310.A N PHE 306.A O no hydrogen 3.060 N/A ALA 311.A N THR 307.A O no hydrogen 2.911 N/A GLN 312.A N ASN 308.A O no hydrogen 3.073 N/A GLN 312.A NE2 ASN 308.A OD1 no hydrogen 3.441 N/A LEU 313.A N MET 309.A O no hydrogen 3.064 N/A ILE 314.A N GLU 310.A O no hydrogen 3.151 N/A ARG 315.A N ALA 311.A O no hydrogen 2.837 N/A ARG 315.A NE PHE 368.A O no hydrogen 3.331 N/A ARG 315.A NE ALA 371.A O no hydrogen 3.234 N/A ARG 315.A NH1 ASP 230.A OD2 no hydrogen 2.892 N/A ARG 315.A NH2 PHE 368.A O no hydrogen 3.078 N/A ARG 315.A NH2 SER 391.A OG no hydrogen 2.756 N/A GLN 316.A N GLN 312.A O no hydrogen 2.854 N/A GLN 316.A NE2 ARG 348.A O no hydrogen 3.288 N/A MET 317.A N LEU 313.A O no hydrogen 2.937 N/A GLU 318.A N ILE 314.A O no hydrogen 2.966 N/A GLY 319.A N ARG 315.A O no hydrogen 3.146 N/A GLU 320.A N GLN 316.A O no hydrogen 3.018 N/A GLU 320.A N MET 317.A O no hydrogen 3.224 N/A GLY 321.A N GLU 318.A O no hydrogen 3.131 N/A VAL 322.A N MET 317.A O no hydrogen 2.923 N/A LYS 324.A N GLU 333.A OE1 no hydrogen 2.747 N/A SER 325.A OG HIS 328.A O no hydrogen 3.403 N/A THR 330.A N GLU 333.A OE2 no hydrogen 3.379 N/A THR 330.A OG1 THR 332.A OG1 no hydrogen 3.216 N/A THR 332.A OG1 THR 330.A OG1 no hydrogen 3.216 N/A GLU 333.A N THR 330.A OG1 no hydrogen 2.762 N/A GLU 334.A N THR 330.A O no hydrogen 3.351 N/A ALA 336.A N THR 332.A O no hydrogen 2.978 N/A VAL 337.A N GLU 333.A O no hydrogen 3.041 N/A LYS 338.A N GLU 334.A O no hydrogen 2.896 N/A ASN 339.A N ILE 335.A O no hydrogen 2.818 N/A TRP 340.A N ALA 336.A O no hydrogen 2.941 N/A TRP 340.A NE1 GLU 320.A OE1 no hydrogen 3.082 N/A LEU 341.A N VAL 337.A O no hydrogen 2.959 N/A VAL 342.A N LYS 338.A O no hydrogen 3.145 N/A ARG 343.A N ASN 339.A O no hydrogen 2.962 N/A ARG 343.A N TRP 340.A O no hydrogen 2.960 N/A VAL 344.A N TRP 340.A O no hydrogen 2.778 N/A GLY 345.A N LEU 341.A O no hydrogen 3.087 N/A ARG 346.A NH1 GLU 99.A OE1 no hydrogen 2.943 N/A ARG 348.A N VAL 344.A O no hydrogen 2.888 N/A ARG 348.A NE GLU 320.A OE1 no hydrogen 3.019 N/A ARG 348.A NE GLU 320.A OE2 no hydrogen 2.924 N/A ARG 348.A NH1 GLU 347.A OE1 no hydrogen 2.711 N/A ARG 348.A NH2 GLU 320.A OE1 no hydrogen 3.032 N/A LEU 349.A N GLY 345.A O no hydrogen 3.160 N/A SER 350.A N ARG 346.A O no hydrogen 3.257 N/A SER 350.A OG GLU 347.A O no hydrogen 2.521 N/A ARG 351.A N ARG 348.A O no hydrogen 3.118 N/A ARG 351.A NE GLU 347.A OE1 no hydrogen 2.896 N/A ARG 351.A NE GLU 347.A OE2 no hydrogen 3.235 N/A ARG 351.A NH1 GLU 223.A O no hydrogen 3.361 N/A ARG 351.A NH1 LYS 362.A O no hydrogen 2.766 N/A ARG 351.A NH2 GLU 223.A O no hydrogen 2.773 N/A ARG 351.A NH2 GLU 347.A OE2 no hydrogen 3.370 N/A MET 352.A N LEU 349.A O no hydrogen 3.138 N/A ALA 353.A N VAL 360.A O no hydrogen 2.990 N/A ILE 354.A N SER 202.A O no hydrogen 2.832 N/A SER 355.A N ASP 358.A O no hydrogen 2.862 N/A SER 355.A OG TYR 301.A OH no hydrogen 2.852 N/A GLY 356.A N THR 305.A OG1 no hydrogen 2.857 N/A ASP 358.A N SER 355.A O no hydrogen 3.110 N/A CYS 359.A SG ASP 230.A O no hydrogen 4.039 N/A VAL 360.A N ALA 353.A O no hydrogen 3.052 N/A VAL 361.A N TYR 228.A O no hydrogen 2.734 N/A LYS 362.A N ARG 351.A O no hydrogen 3.017 N/A LYS 362.A NZ SER 220.A O no hydrogen 2.565 N/A LYS 362.A NZ LYS 222.A O no hydrogen 2.745 N/A ARG 367.A N ASP 365.A OD1 no hydrogen 3.290 N/A ARG 367.A NE ASP 365.A OD1 no hydrogen 2.770 N/A ARG 367.A NH2 ASP 365.A OD1 no hydrogen 3.509 N/A ARG 367.A NH2 ASP 365.A OD2 no hydrogen 2.768 N/A ALA 369.A N ASP 366.A O no hydrogen 3.012 N/A SER 370.A N ARG 367.A O no hydrogen 3.074 N/A SER 370.A OG ARG 367.A O no hydrogen 3.433 N/A ALA 371.A N PHE 368.A O no hydrogen 3.173 N/A THR 373.A N GLU 318.A OE1 no hydrogen 3.025 N/A THR 373.A OG1 GLU 318.A OE1 no hydrogen 2.992 N/A THR 373.A OG1 GLU 318.A OE2 no hydrogen 3.423 N/A ALA 374.A N GLU 318.A OE2 no hydrogen 2.913 N/A ASN 376.A N LEU 372.A O no hydrogen 3.090 N/A ASN 376.A ND2 GLN 387.A O no hydrogen 2.951 N/A ASP 377.A N THR 373.A O no hydrogen 3.026 N/A MET 378.A N ALA 374.A O no hydrogen 2.847 N/A GLY 379.A N ASN 376.A O no hydrogen 3.123 N/A LYS 380.A N LEU 375.A O no hydrogen 3.054 N/A LYS 380.A NZ ASP 243.A OD2 no hydrogen 2.769 N/A LYS 380.A NZ MET 378.A O no hydrogen 3.080 N/A ARG 382.A NH1 GLU 389.A O no hydrogen 2.884 N/A ARG 382.A NH1 SER 391.A OG no hydrogen 3.010 N/A ARG 382.A NH2 GLN 387.A O no hydrogen 3.101 N/A ARG 382.A NH2 GLU 389.A O no hydrogen 2.905 N/A LYS 383.A N ASP 231.A O no hydrogen 2.916 N/A GLU 389.A N GLN 386.A O no hydrogen 3.119 N/A SER 391.A N ALA 369.A O no hydrogen 2.966 N/A SER 391.A OG ASP 230.A OD2 no hydrogen 2.494 N/A TRP 394.A N MET 227.A O no hydrogen 3.023 N/A THR 398.A OG1 ASP 396.A OD1 no hydrogen 2.743 N/A GLN 399.A N ASP 396.A O no hydrogen 2.898 N/A PHE 402.A N HIS 405.A O no hydrogen 2.984 N/A CYS 403.A N ASP 358.A OD2 no hydrogen 3.018 N/A HIS 405.A N PHE 402.A O no hydrogen 3.129 N/A HIS 405.A ND1 CYS 403.A O no hydrogen 2.769 N/A HIS 405.A NE2 TYR 460.A OH no hydrogen 2.642 N/A HIS 406.A N CYS 422.A O no hydrogen 3.025 N/A HIS 406.A NE2 HIS 408.A NE2 no hydrogen 3.088 N/A HIS 408.A N VAL 420.A O no hydrogen 3.123 N/A HIS 408.A NE2 HIS 406.A NE2 no hydrogen 3.088 N/A LEU 410.A N LEU 418.A O no hydrogen 3.021 N/A MET 412.A N ARG 416.A O no hydrogen 2.840 N/A LYS 413.A NZ.A GLU 524.A O no hydrogen 2.864 N/A GLY 415.A N MET 412.A O no hydrogen 2.753 N/A ARG 416.A N ASP 414.A OD1 no hydrogen 3.234 N/A ARG 416.A NE ASP 414.A OD1 no hydrogen 3.141 N/A ARG 416.A NH1 ASP 516.A O no hydrogen 2.911 N/A ARG 416.A NH1 THR 518.A O no hydrogen 2.733 N/A ARG 416.A NH2 ASP 414.A OD2 no hydrogen 3.325 N/A ARG 416.A NH2 THR 518.A O no hydrogen 3.050 N/A LEU 418.A N LEU 410.A O no hydrogen 3.017 N/A VAL 419.A N TYR 214.A OH no hydrogen 3.381 N/A VAL 420.A N HIS 408.A O no hydrogen 3.102 N/A CYS 422.A SG HIS 406.A NE2 no hydrogen 3.404 N/A CYS 422.A SG HIS 408.A NE2 no hydrogen 3.586 N/A ARG 423.A NE GLU 427.A OE2 no hydrogen 2.816 N/A ARG 423.A NH2 GLU 427.A OE2 no hydrogen 3.288 N/A GLN 425.A N CYS 537.A O no hydrogen 3.029 N/A GLN 425.A NE2 ASP 465.A OD2 no hydrogen 2.797 N/A GLU 427.A N ASN 424.A O no hydrogen 2.772 N/A GLU 427.A N ASN 424.A OD1 no hydrogen 3.166 N/A ILE 429.A N GLN 425.A O no hydrogen 3.049 N/A GLY 430.A N ASP 426.A O no hydrogen 2.990 N/A ARG 431.A N GLU 427.A O no hydrogen 3.056 N/A ALA 432.A N LEU 428.A O no hydrogen 3.234 N/A ARG 433.A N ILE 429.A O no hydrogen 3.207 N/A ARG 433.A NH1 THR 55.A OG1 no hydrogen 3.120 N/A ARG 433.A NH1 ASP 59.A OD1 no hydrogen 3.060 N/A ARG 433.A NH2 ASP 59.A OD1 no hydrogen 2.642 N/A ILE 434.A N ARG 431.A O no hydrogen 3.066 N/A SER 435.A N.A MET 46.A O no hydrogen 2.785 N/A SER 435.A N.B MET 46.A O no hydrogen 2.797 N/A SER 435.A OG.B MET 46.A O no hydrogen 3.462 N/A GLU 444.A N SER 441.A OG no hydrogen 2.947 N/A THR 445.A N SER 441.A O no hydrogen 2.980 N/A THR 445.A OG1 SER 441.A O no hydrogen 2.985 N/A ALA 446.A N LEU 442.A O no hydrogen 3.065 N/A CYS 447.A N ARG 443.A O no hydrogen 3.124 N/A CYS 447.A N GLU 444.A O no hydrogen 3.113 N/A CYS 447.A SG ARG 443.A O no hydrogen 2.886 N/A CYS 447.A SG VAL 482.A O no hydrogen 3.186 N/A LEU 448.A N GLU 444.A O no hydrogen 2.993 N/A GLY 449.A N THR 445.A O no hydrogen 3.128 N/A LYS 450.A N ALA 446.A O no hydrogen 3.231 N/A LYS 450.A NZ SER 479.A O.A no hydrogen 2.896 N/A LYS 450.A NZ SER 479.A O.B no hydrogen 2.929 N/A LYS 450.A NZ TRP 481.A O no hydrogen 2.992 N/A SER 451.A N CYS 447.A O no hydrogen 3.201 N/A SER 451.A OG CYS 447.A O no hydrogen 3.097 N/A SER 451.A OG THR 484.A O no hydrogen 2.406 N/A TYR 452.A N LEU 448.A O no hydrogen 3.162 N/A ALA 453.A N GLY 449.A O no hydrogen 2.933 N/A GLN 454.A N LYS 450.A O no hydrogen 2.944 N/A GLN 454.A NE2 TRP 493.A O no hydrogen 2.856 N/A GLN 454.A NE2 THR 495.A O no hydrogen 2.925 N/A MET 455.A N SER 451.A O no hydrogen 3.010 N/A TRP 456.A N TYR 452.A O no hydrogen 2.808 N/A SER 457.A N.A ALA 453.A O no hydrogen 3.057 N/A SER 457.A N.B ALA 453.A O no hydrogen 3.061 N/A SER 457.A OG.A ALA 453.A O no hydrogen 3.107 N/A SER 457.A OG.B ALA 453.A O no hydrogen 3.099 N/A SER 457.A OG.B GLN 454.A O no hydrogen 2.474 N/A LEU 458.A N GLN 454.A O no hydrogen 3.117 N/A LEU 458.A N MET 455.A O no hydrogen 2.947 N/A MET 459.A N MET 455.A O no hydrogen 2.713 N/A TYR 460.A N TRP 456.A O no hydrogen 2.738 N/A TYR 460.A OH HIS 405.A NE2 no hydrogen 2.642 N/A HIS 462.A NE2 PRO 421.A O no hydrogen 2.878 N/A ARG 463.A N TYR 460.A O no hydrogen 3.311 N/A ARG 463.A NE ASP 534.A OD1 no hydrogen 2.777 N/A ARG 463.A NH1 ASP 534.A O no hydrogen 3.147 N/A ARG 463.A NH1 ASP 534.A OD1 no hydrogen 3.164 N/A ARG 463.A NH1 CYS 537.A O no hydrogen 2.910 N/A ARG 463.A NH2 ARG 423.A O no hydrogen 3.310 N/A ARG 463.A NH2 CYS 537.A O no hydrogen 3.507 N/A ARG 464.A N ASP 534.A OD2 no hydrogen 2.902 N/A ARG 464.A NH1 LEU 529.A O no hydrogen 2.857 N/A ARG 464.A NH1 ASP 534.A OD2 no hydrogen 2.833 N/A ARG 464.A NH2 LEU 529.A O no hydrogen 2.948 N/A LEU 466.A N ARG 463.A O no hydrogen 3.289 N/A ARG 467.A N ARG 463.A O no hydrogen 3.127 N/A ARG 467.A NE PHE 461.A O no hydrogen 2.790 N/A ARG 467.A NH1 ILE 526.A O no hydrogen 3.266 N/A ARG 467.A NH2 PHE 461.A O no hydrogen 2.995 N/A ARG 467.A NH2 ILE 526.A O no hydrogen 2.876 N/A LEU 468.A N ARG 464.A O no hydrogen 3.193 N/A ALA 469.A N ASP 465.A O no hydrogen 3.014 N/A ALA 470.A N LEU 466.A O no hydrogen 2.983 N/A ASN 471.A N ARG 467.A O no hydrogen 3.060 N/A ALA 472.A N LEU 468.A O no hydrogen 2.870 N/A ILE 473.A N ALA 469.A O no hydrogen 3.044 N/A CYS 474.A N ALA 470.A O no hydrogen 2.931 N/A CYS 474.A SG ALA 470.A O no hydrogen 3.361 N/A SER 475.A N ASN 471.A O no hydrogen 2.964 N/A SER 475.A OG ASN 471.A O no hydrogen 2.890 N/A ALA 476.A N ILE 473.A O no hydrogen 2.985 N/A SER 479.A N.A GLU 568.A O no hydrogen 3.185 N/A SER 479.A N.B GLU 568.A O no hydrogen 3.176 N/A SER 479.A OG.A GLU 568.A O no hydrogen 3.528 N/A SER 479.A OG.B GLU 568.A O no hydrogen 3.278 N/A SER 479.A OG.B THR 570.A OG1 no hydrogen 2.611 N/A TRP 481.A N PRO 478.A O no hydrogen 2.890 N/A THR 484.A N CYS 447.A O no hydrogen 3.382 N/A THR 487.A OG1 THR 487.A O no hydrogen 2.575 N/A THR 490.A OG1 GLU 492.A OE1 no hydrogen 3.417 N/A GLU 492.A N GLU 492.A OE2 no hydrogen 2.800 N/A MET 494.A N HIS 491.A O.A no hydrogen 3.249 N/A MET 494.A N HIS 491.A O.B no hydrogen 3.282 N/A GLU 497.A N THR 495.A OG1 no hydrogen 2.923 N/A THR 501.A N ASP 498.A O no hydrogen 3.038 N/A VAL 502.A N ASP 498.A O no hydrogen 3.230 N/A TRP 503.A N MET 499.A O no hydrogen 2.849 N/A ASN 504.A N LEU 500.A O no hydrogen 3.151 N/A ASN 504.A ND2 LEU 500.A O no hydrogen 3.019 N/A ASN 504.A ND2 VAL 520.A O no hydrogen 2.793 N/A ARG 505.A N THR 501.A O no hydrogen 3.085 N/A ARG 505.A NH1 GLU 497.A OE2 no hydrogen 3.138 N/A ARG 505.A NH2 GLU 497.A OE1 no hydrogen 3.095 N/A ARG 505.A NH2 GLU 497.A OE2 no hydrogen 3.064 N/A VAL 506.A N VAL 502.A O no hydrogen 2.864 N/A TRP 507.A N TRP 503.A O no hydrogen 2.815 N/A TRP 507.A NE1 LEU 458.A O no hydrogen 2.837 N/A ILE 508.A N ASN 504.A O no hydrogen 2.975 N/A GLN 509.A N ASN 504.A O no hydrogen 2.776 N/A GLU 510.A N ARG 505.A O no hydrogen 2.565 N/A ASN 511.A ND2 TYR 214.A OH no hydrogen 3.198 N/A ASN 511.A ND2 TRP 507.A O no hydrogen 2.862 N/A TRP 513.A N ASN 511.A OD1 no hydrogen 2.894 N/A TRP 513.A NE1 ASP 218.A OD2 no hydrogen 2.765 N/A MET 514.A N ASN 511.A O no hydrogen 3.336 N/A LYS 517.A NZ GLN 509.A O no hydrogen 2.945 N/A LYS 517.A NZ ASN 511.A O no hydrogen 3.089 N/A LYS 517.A NZ MET 514.A O no hydrogen 3.336 N/A THR 518.A N ASP 516.A OD1 no hydrogen 2.960 N/A THR 518.A OG1 ASP 516.A OD1 no hydrogen 2.823 N/A VAL 520.A N ASN 504.A OD1 no hydrogen 2.491 N/A GLU 521.A N GLU 525.A OE2 no hydrogen 2.593 N/A GLU 524.A N SER 522.A OG no hydrogen 3.367 N/A GLU 525.A N SER 522.A O no hydrogen 3.217 N/A ILE 526.A N TRP 523.A O no hydrogen 3.337 N/A LEU 529.A N HIS 462.A O no hydrogen 3.011 N/A GLY 530.A N GLU 533.A OE1 no hydrogen 3.216 N/A ASP 534.A N GLY 530.A O no hydrogen 2.851 N/A GLN 535.A N LYS 531.A O no hydrogen 3.169 N/A GLN 535.A NE2 ILE 541.A O no hydrogen 2.768 N/A TRP 536.A N ARG 532.A O no hydrogen 2.760 N/A CYS 537.A N GLU 533.A O no hydrogen 3.111 N/A CYS 537.A SG HIS 406.A NE2 no hydrogen 3.339 N/A CYS 537.A SG HIS 408.A NE2 no hydrogen 3.767 N/A CYS 537.A SG GLU 533.A O no hydrogen 3.784 N/A GLY 538.A N GLN 535.A O no hydrogen 2.949 N/A SER 539.A N ASP 534.A O no hydrogen 2.897 N/A SER 539.A OG ASP 465.A OD2 no hydrogen 3.303 N/A LEU 540.A N ASP 465.A OD2 no hydrogen 2.918 N/A ILE 541.A N SER 539.A OG no hydrogen 3.050 N/A LEU 543.A N LEU 540.A O no hydrogen 3.003 N/A ARG 546.A NE ASP 465.A OD1 no hydrogen 2.713 N/A ARG 546.A NH2 ASP 465.A OD1 no hydrogen 3.195 N/A ALA 547.A N LEU 543.A O no hydrogen 3.210 N/A THR 548.A N THR 544.A O no hydrogen 3.034 N/A THR 548.A OG1 THR 544.A O no hydrogen 3.520 N/A TRP 549.A N SER 545.A O no hydrogen 3.150 N/A TRP 549.A NE1 LEU 54.A O no hydrogen 3.076 N/A ALA 550.A N ARG 546.A O no hydrogen 2.898 N/A LYS 551.A N ALA 547.A O no hydrogen 3.031 N/A ASN 552.A N THR 548.A O no hydrogen 2.902 N/A ASN 552.A ND2 THR 548.A O no hydrogen 3.107 N/A ILE 553.A N ALA 550.A O no hydrogen 3.355 N/A GLN 554.A NE2.A ASP 571.A OD1 no hydrogen 2.997 N/A GLN 554.A NE2.B ASN 558.A OD1 no hydrogen 3.322 N/A THR 555.A N ASN 552.A O no hydrogen 3.374 N/A ALA 556.A N ILE 553.A O no hydrogen 3.088 N/A ILE 557.A N ILE 553.A O no hydrogen 2.987 N/A ASN 558.A N GLN 554.A O.A no hydrogen 3.205 N/A ASN 558.A N GLN 554.A O.B no hydrogen 3.183 N/A GLN 559.A N THR 555.A O no hydrogen 3.223 N/A VAL 560.A N ALA 556.A O no hydrogen 3.353 N/A ARG 561.A N ILE 557.A O no hydrogen 3.056 N/A ARG 561.A NE SER 475.A O no hydrogen 2.956 N/A ARG 561.A NH2 SER 475.A O no hydrogen 2.772 N/A SER 562.A N ASN 558.A O no hydrogen 2.952 N/A SER 562.A OG ASN 558.A O no hydrogen 2.935 N/A LEU 563.A N GLN 559.A O no hydrogen 3.192 N/A ILE 564.A N VAL 560.A O no hydrogen 3.034 N/A GLY 565.A N ARG 561.A O no hydrogen 3.035 N/A TYR 569.A OH GLY 565.A O no hydrogen 2.710 N/A THR 570.A OG1 SER 479.A OG.B no hydrogen 2.611 N/A TYR 572.A N SER 475.A OG no hydrogen 2.710 N/A SER 575.A N TYR 572.A O no hydrogen 3.037 N/A SER 575.A OG TYR 572.A O no hydrogen 2.583 N/A MET 576.A N MET 573.A O no hydrogen 3.067 N/A ARG 580.A N MET 576.A O no hydrogen 3.075 N/A ARG 580.A NE GLU 524.A OE2 no hydrogen 2.641 N/A ARG 580.A NH2 GLU 524.A OE1 no hydrogen 3.068 N/A