Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5he2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 161.A OD1 no hydrogen 2.858 N/A ILE 10.A N GLU 7.A O no hydrogen 3.254 N/A ARG 11.A N PRO 8.A O no hydrogen 2.931 N/A ARG 11.A NE GLN 15.A OE1 no hydrogen 3.346 N/A ARG 11.A NH1 ILE 137.A O no hydrogen 3.298 N/A ARG 11.A NH1 SER 139.A O no hydrogen 3.187 N/A ARG 11.A NH1 THR 143.A OG1 no hydrogen 2.973 N/A ARG 11.A NH2 GLN 15.A OE1 no hydrogen 3.360 N/A ARG 11.A NH2 ILE 137.A O no hydrogen 2.548 N/A SER 12.A N SER 9.A O no hydrogen 3.038 N/A MET 14.A N ILE 10.A O no hydrogen 3.046 N/A GLN 15.A N ARG 11.A O no hydrogen 2.997 N/A GLN 15.A NE2 GLU 19.A OE2 no hydrogen 3.060 N/A TYR 17.A N VAL 13.A O no hydrogen 2.968 N/A LEU 18.A N MET 14.A O no hydrogen 2.952 N/A GLU 19.A N GLN 15.A O no hydrogen 3.083 N/A ASP 20.A N LYS 16.A O no hydrogen 2.947 N/A ARG 21.A N LEU 18.A O no hydrogen 2.809 N/A ARG 21.A NH1 TYR 17.A O no hydrogen 2.755 N/A GLY 22.A N GLU 19.A O no hydrogen 3.020 N/A GLU 23.A N LEU 18.A O no hydrogen 3.046 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.087 N/A LYS 28.A NZ GLY 22.A O no hydrogen 3.483 N/A ILE 29.A N THR 25.A O no hydrogen 3.156 N/A PHE 30.A N PHE 26.A O no hydrogen 2.831 N/A SER 31.A N GLU 27.A O no hydrogen 3.241 N/A SER 31.A OG GLU 27.A O no hydrogen 3.035 N/A SER 31.A OG LYS 28.A O no hydrogen 3.516 N/A GLN 32.A N ILE 29.A O no hydrogen 3.187 N/A GLN 32.A NE2 LYS 28.A O no hydrogen 2.995 N/A LEU 34.A N GLN 478.A OE1 no hydrogen 2.845 N/A TYR 36.A N GLN 32.A O no hydrogen 2.677 N/A TYR 36.A OH GLU 58.A OE2 no hydrogen 2.749 N/A LEU 37.A N LYS 33.A O no hydrogen 2.921 N/A LEU 38.A N LEU 34.A O no hydrogen 2.949 N/A LEU 38.A N GLY 35.A O no hydrogen 3.127 N/A PHE 39.A N GLY 35.A O no hydrogen 3.048 N/A ARG 40.A N TYR 36.A O no hydrogen 3.113 N/A ARG 40.A NE GLU 58.A OE2 no hydrogen 3.114 N/A ASP 41.A N LEU 37.A O no hydrogen 3.383 N/A PHE 42.A N LEU 38.A O no hydrogen 3.035 N/A CYS 43.A N PHE 39.A O no hydrogen 3.056 N/A CYS 43.A SG PHE 39.A O no hydrogen 3.118 N/A LEU 44.A N ARG 40.A O no hydrogen 2.927 N/A LYS 45.A N ASP 41.A O no hydrogen 3.227 N/A HIS 46.A N PHE 42.A O no hydrogen 2.796 N/A LYS 51.A N LEU 47.A O no hydrogen 3.440 N/A VAL 54.A N ALA 50.A O no hydrogen 3.199 N/A GLU 55.A N LYS 51.A O no hydrogen 2.852 N/A PHE 56.A N PRO 52.A O no hydrogen 2.856 N/A TYR 57.A N LEU 53.A O no hydrogen 2.618 N/A GLU 58.A N VAL 54.A O no hydrogen 2.903 N/A GLU 59.A N GLU 55.A O no hydrogen 3.059 N/A ILE 60.A N PHE 56.A O no hydrogen 3.154 N/A LYS 61.A N TYR 57.A O no hydrogen 2.891 N/A LYS 61.A NZ GLU 64.A OE1 no hydrogen 3.210 N/A LYS 61.A NZ GLU 64.A OE2 no hydrogen 3.059 N/A LYS 62.A N GLU 58.A O no hydrogen 2.866 N/A LYS 62.A NZ GLU 59.A OE1 no hydrogen 3.328 N/A LYS 62.A NZ GLU 59.A OE2 no hydrogen 3.049 N/A TYR 63.A N GLU 59.A O no hydrogen 2.979 N/A TYR 63.A OH PRO 113.A O no hydrogen 3.111 N/A GLU 64.A N ILE 60.A O no hydrogen 3.087 N/A LYS 65.A N LYS 62.A O no hydrogen 3.255 N/A LEU 66.A N TYR 63.A O no hydrogen 3.252 N/A THR 68.A N GLU 71.A OE1 no hydrogen 3.150 N/A THR 68.A OG1 GLU 71.A OE1 no hydrogen 2.526 N/A GLU 71.A N THR 68.A OG1 no hydrogen 3.122 N/A ARG 72.A N GLU 69.A O no hydrogen 3.086 N/A ARG 72.A NE VAL 112.A O no hydrogen 2.899 N/A ARG 72.A NH1 LEU 66.A O no hydrogen 3.040 N/A ARG 72.A NH1 GLU 67.A O no hydrogen 3.304 N/A LEU 73.A N GLU 69.A O no hydrogen 3.279 N/A CYS 75.A N GLU 71.A O no hydrogen 3.246 N/A SER 76.A N ARG 72.A O no hydrogen 2.862 N/A SER 76.A OG ARG 72.A O no hydrogen 2.483 N/A SER 76.A OG LEU 73.A O no hydrogen 3.139 N/A ARG 77.A N LEU 73.A O no hydrogen 3.226 N/A GLU 78.A N VAL 74.A O no hydrogen 3.225 N/A ILE 79.A N CYS 75.A O no hydrogen 2.854 N/A PHE 80.A N SER 76.A O no hydrogen 3.042 N/A ASP 81.A N ARG 77.A O no hydrogen 3.050 N/A THR 82.A N GLU 78.A O no hydrogen 2.982 N/A THR 82.A OG1 GLU 78.A O no hydrogen 2.863 N/A TYR 83.A N ILE 79.A O no hydrogen 2.730 N/A ILE 84.A N PHE 80.A O no hydrogen 3.252 N/A MET 85.A N PHE 80.A O no hydrogen 2.825 N/A LYS 86.A N ASP 81.A O no hydrogen 3.376 N/A LEU 88.A N ILE 84.A O no hydrogen 3.018 N/A LEU 89.A N MET 85.A O no hydrogen 2.970 N/A ALA 90.A N LYS 86.A O no hydrogen 3.270 N/A CYS 91.A N LEU 88.A O no hydrogen 2.921 N/A SER 92.A N GLU 87.A O no hydrogen 2.874 N/A SER 96.A N GLU 123.A OE1 no hydrogen 2.772 N/A SER 96.A OG GLU 123.A OE1 no hydrogen 2.646 N/A SER 96.A OG GLU 123.A OE2 no hydrogen 2.875 N/A GLU 101.A N LYS 97.A O no hydrogen 2.907 N/A HIS 102.A N SER 98.A O no hydrogen 3.040 N/A VAL 103.A N ALA 99.A O no hydrogen 3.373 N/A GLN 104.A N ILE 100.A O no hydrogen 2.782 N/A GLY 105.A N GLU 101.A O no hydrogen 3.449 N/A HIS 106.A N HIS 102.A O no hydrogen 3.368 N/A HIS 106.A ND1 HIS 102.A O no hydrogen 2.791 N/A LEU 107.A N VAL 103.A O no hydrogen 2.954 N/A VAL 108.A N GLN 104.A O no hydrogen 3.264 N/A LYS 110.A N LEU 107.A O no hydrogen 2.764 N/A GLN 111.A N HIS 106.A O no hydrogen 2.739 N/A LEU 116.A N PRO 113.A O no hydrogen 2.946 N/A GLN 118.A N ASP 115.A O no hydrogen 3.399 N/A TYR 120.A N PHE 117.A O no hydrogen 3.072 N/A ILE 121.A N PHE 117.A O no hydrogen 3.346 N/A ILE 124.A N TYR 120.A O no hydrogen 2.609 N/A CYS 125.A N ILE 121.A O no hydrogen 3.139 N/A CYS 125.A SG ILE 121.A O no hydrogen 3.387 N/A GLN 126.A N GLU 122.A O no hydrogen 3.043 N/A ASN 127.A N GLU 123.A O no hydrogen 3.038 N/A ASN 127.A ND2 PRO 94.A O no hydrogen 3.589 N/A ASN 127.A ND2 GLU 123.A O no hydrogen 3.198 N/A LEU 128.A N ILE 124.A O no hydrogen 3.049 N/A LEU 128.A N CYS 125.A O no hydrogen 2.790 N/A ARG 129.A N CYS 125.A O no hydrogen 2.852 N/A PHE 133.A N LEU 128.A O no hydrogen 3.080 N/A GLN 134.A N GLY 130.A O no hydrogen 3.163 N/A LYS 135.A N ASP 131.A O no hydrogen 2.919 N/A PHE 136.A N VAL 132.A O no hydrogen 2.809 N/A ILE 137.A N PHE 133.A O no hydrogen 3.142 N/A GLU 138.A N GLN 134.A O no hydrogen 3.198 N/A SER 139.A N PHE 136.A O no hydrogen 2.731 N/A ARG 144.A N ASP 140.A O no hydrogen 2.915 N/A ARG 144.A NE GLN 147.A OE1 no hydrogen 2.768 N/A ARG 144.A NH1 ASN 490.A O no hydrogen 3.341 N/A ARG 144.A NH1 ASN 490.A OD1 no hydrogen 2.763 N/A ARG 144.A NH1 ASP 494.A OD1 no hydrogen 3.333 N/A ARG 144.A NH2 ASP 494.A OD1 no hydrogen 3.079 N/A ARG 144.A NH2 GLU 497.A OE1 no hydrogen 3.324 N/A PHE 145.A N LYS 141.A O no hydrogen 2.936 N/A CYS 146.A N PHE 142.A O no hydrogen 2.936 N/A CYS 146.A SG PHE 142.A O no hydrogen 3.471 N/A GLN 147.A N THR 143.A O no hydrogen 2.877 N/A GLN 147.A NE2 PRO 6.A O no hydrogen 2.768 N/A GLN 147.A NE2 GLU 497.A OE2 no hydrogen 2.956 N/A TRP 148.A N ARG 144.A O no hydrogen 3.044 N/A TRP 148.A NE1 ASN 490.A OD1 no hydrogen 3.082 N/A LYS 149.A N PHE 145.A O no hydrogen 2.896 N/A LYS 149.A NZ GLN 32.A OE1 no hydrogen 3.049 N/A LYS 149.A NZ GLU 152.A OE1 no hydrogen 3.076 N/A ASN 150.A N CYS 146.A O no hydrogen 2.855 N/A ASN 150.A ND2 SER 596.A OG no hydrogen 2.866 N/A VAL 151.A N GLN 147.A O no hydrogen 3.466 N/A GLU 152.A N TRP 148.A O no hydrogen 3.032 N/A LEU 153.A N LYS 149.A O no hydrogen 2.820 N/A ASN 154.A N VAL 151.A O no hydrogen 2.828 N/A ILE 155.A N GLU 152.A O no hydrogen 3.344 N/A THR 158.A N ASP 161.A OD2 no hydrogen 3.324 N/A ASP 161.A N THR 158.A O no hydrogen 2.756 N/A PHE 162.A N MET 159.A O no hydrogen 3.199 N/A SER 163.A N ARG 180.A O no hydrogen 2.933 N/A HIS 165.A N GLY 178.A O no hydrogen 2.849 N/A ILE 168.A N VAL 176.A O no hydrogen 2.797 N/A GLY 171.A N GLY 174.A O no hydrogen 2.928 N/A GLY 174.A N GLY 171.A O no hydrogen 3.360 N/A GLU 175.A N CYS 192.A O no hydrogen 3.183 N/A VAL 176.A N GLY 169.A O no hydrogen 2.793 N/A TYR 177.A N MET 190.A O no hydrogen 2.894 N/A GLY 178.A N ARG 166.A O no hydrogen 3.235 N/A CYS 179.A N TYR 188.A O no hydrogen 2.729 N/A CYS 179.A SG TYR 188.A O no hydrogen 3.430 N/A ARG 180.A N SER 163.A O no hydrogen 3.417 N/A LYS 181.A N LYS 186.A O no hydrogen 3.090 N/A LYS 181.A NZ ASP 183.A OD2 no hydrogen 2.772 N/A LYS 181.A NZ TYR 230.A OH no hydrogen 3.419 N/A LYS 181.A NZ GLU 480.A OE2 no hydrogen 2.578 N/A ALA 182.A N ASP 161.A O no hydrogen 2.991 N/A THR 184.A N LYS 181.A O no hydrogen 3.302 N/A THR 184.A OG1 GLU 480.A OE2 no hydrogen 2.777 N/A GLY 185.A N LYS 181.A O no hydrogen 2.979 N/A LYS 186.A NZ GLU 483.A OE2 no hydrogen 3.090 N/A TYR 188.A N CYS 179.A O no hydrogen 2.856 N/A TYR 188.A OH GLU 480.A OE1 no hydrogen 2.359 N/A ALA 189.A N LEU 242.A O no hydrogen 3.049 N/A MET 190.A N TYR 177.A O no hydrogen 2.708 N/A LYS 191.A N PHE 240.A O no hydrogen 3.040 N/A LYS 191.A NZ GLU 210.A OE1 no hydrogen 3.024 N/A LYS 191.A NZ GLU 210.A OE2 no hydrogen 2.671 N/A LYS 191.A NZ ASP 306.A OD2 no hydrogen 3.374 N/A CYS 192.A N GLU 175.A O no hydrogen 2.758 N/A CYS 192.A SG.A LYS 191.A O no hydrogen 3.433 N/A CYS 192.A SG.A SER 239.A OG no hydrogen 3.520 N/A CYS 192.A SG.B LEU 238.A O no hydrogen 4.046 N/A LEU 193.A N LEU 238.A O no hydrogen 3.112 N/A ASP 194.A N PHE 173.A O no hydrogen 2.889 N/A LYS 195.A N ASP 236.A O no hydrogen 3.059 N/A LYS 195.A NZ HIS 233.A ND1 no hydrogen 3.123 N/A LYS 195.A NZ THR 234.A O no hydrogen 2.790 N/A LYS 195.A NZ GLN 463.A OE1 no hydrogen 3.193 N/A LYS 196.A N ASP 194.A OD1 no hydrogen 3.087 N/A ARG 197.A NE GLY 172.A O no hydrogen 3.023 N/A ARG 197.A NH2 GLY 172.A O no hydrogen 2.809 N/A ILE 198.A N ASP 194.A O no hydrogen 2.946 N/A LYS 199.A N LYS 195.A O no hydrogen 2.964 N/A LYS 199.A NZ LYS 457.A O no hydrogen 2.548 N/A LYS 199.A NZ ASP 462.A OD2 no hydrogen 3.318 N/A MET 200.A N LYS 196.A O no hydrogen 3.054 N/A GLN 202.A N ILE 198.A O no hydrogen 2.658 N/A LEU 208.A N GLU 204.A O no hydrogen 2.819 N/A ASN 209.A N THR 205.A O no hydrogen 2.588 N/A ASN 209.A ND2 GLY 308.A O no hydrogen 2.872 N/A ASN 209.A ND2 ALA 310.A O no hydrogen 3.052 N/A GLU 210.A N LEU 206.A O no hydrogen 3.292 N/A ARG 211.A N ALA 207.A O no hydrogen 3.432 N/A ARG 211.A NE PHE 469.A O no hydrogen 3.017 N/A ARG 211.A NH1 ARG 211.A O no hydrogen 3.174 N/A ARG 211.A NH2 ASN 468.A O no hydrogen 2.844 N/A ILE 212.A N LEU 208.A O no hydrogen 3.246 N/A MET 213.A N ASN 209.A O no hydrogen 2.755 N/A LEU 214.A N GLU 210.A O no hydrogen 2.802 N/A SER 215.A N ARG 211.A O no hydrogen 3.063 N/A LEU 216.A N MET 213.A O no hydrogen 2.856 N/A VAL 217.A N MET 213.A O no hydrogen 3.256 N/A VAL 217.A N LEU 214.A O no hydrogen 3.068 N/A SER 218.A OG LEU 214.A O no hydrogen 2.867 N/A SER 218.A OG MET 228.A O no hydrogen 3.429 N/A GLY 220.A N GLU 475.A OE2 no hydrogen 3.220 N/A VAL 226.A N ILE 304.A O no hydrogen 2.777 N/A CYS 227.A N ASP 243.A OD2 no hydrogen 2.654 N/A CYS 227.A SG ILE 225.A O no hydrogen 3.453 N/A MET 228.A N SER 218.A OG no hydrogen 2.690 N/A SER 229.A N ILE 241.A O no hydrogen 2.921 N/A TYR 230.A OH GLU 480.A OE1 no hydrogen 2.860 N/A TYR 230.A OH GLU 480.A OE2 no hydrogen 3.149 N/A ALA 231.A N LEU 471.A O no hydrogen 3.008 N/A PHE 232.A N SER 239.A O no hydrogen 3.060 N/A THR 234.A N LYS 237.A O no hydrogen 2.902 N/A LYS 237.A N THR 234.A OG1 no hydrogen 3.104 N/A LEU 238.A N LEU 193.A O no hydrogen 2.935 N/A SER 239.A N PHE 232.A O no hydrogen 2.811 N/A PHE 240.A N LYS 191.A O no hydrogen 3.198 N/A ILE 241.A N TYR 230.A O no hydrogen 2.960 N/A LEU 242.A N ALA 189.A O no hydrogen 3.191 N/A ASP 243.A N CYS 227.A O no hydrogen 3.009 N/A LEU 250.A N PRO 291.A O no hydrogen 3.235 N/A LEU 250.A N ILE 294.A O no hydrogen 3.071 N/A TYR 252.A N ASP 249.A OD2 no hydrogen 3.031 N/A HIS 253.A N ASP 249.A O no hydrogen 3.324 N/A HIS 253.A NE2 GLY 247.A O no hydrogen 2.690 N/A LEU 254.A N LEU 250.A O no hydrogen 2.705 N/A SER 255.A N HIS 251.A O no hydrogen 3.163 N/A SER 255.A OG TYR 252.A O no hydrogen 2.896 N/A GLN 256.A N TYR 252.A O no hydrogen 2.863 N/A HIS 257.A N HIS 253.A O no hydrogen 2.867 N/A HIS 257.A ND1 GLY 258.A O no hydrogen 2.917 N/A GLY 258.A N LEU 254.A O no hydrogen 2.728 N/A PHE 260.A N LEU 355.A O no hydrogen 2.521 N/A ASP 264.A N SER 261.A OG no hydrogen 3.352 N/A MET 265.A N SER 261.A O no hydrogen 2.991 N/A ARG 266.A NE PHE 423.A O no hydrogen 2.863 N/A ARG 266.A NH2 PHE 423.A O no hydrogen 3.347 N/A ALA 269.A N MET 265.A O no hydrogen 3.118 N/A ALA 270.A N ARG 266.A O no hydrogen 3.145 N/A GLU 271.A N PHE 267.A O no hydrogen 3.515 N/A ILE 272.A N TYR 268.A O no hydrogen 3.191 N/A ILE 273.A N ALA 269.A O no hydrogen 3.016 N/A ILE 273.A N ALA 270.A O no hydrogen 2.785 N/A LEU 274.A N ALA 270.A O no hydrogen 3.105 N/A GLY 275.A N GLU 271.A O no hydrogen 3.354 N/A LEU 276.A N ILE 272.A O no hydrogen 3.046 N/A GLU 277.A N ILE 273.A O no hydrogen 2.713 N/A HIS 278.A N LEU 274.A O no hydrogen 3.191 N/A HIS 278.A NE2 VAL 217.A O no hydrogen 3.043 N/A MET 279.A N GLY 275.A O no hydrogen 3.006 N/A HIS 280.A N LEU 276.A O no hydrogen 2.735 N/A HIS 280.A NE2 ASP 344.A OD2 no hydrogen 2.724 N/A ASN 281.A N GLU 277.A O no hydrogen 2.699 N/A ARG 282.A N HIS 278.A O no hydrogen 3.106 N/A ARG 282.A NH1 HIS 278.A O no hydrogen 3.467 N/A PHE 283.A N HIS 280.A O no hydrogen 2.872 N/A VAL 284.A N MET 279.A O no hydrogen 2.958 N/A VAL 285.A N CYS 311.A O no hydrogen 2.997 N/A TYR 286.A N ASP 344.A OD2 no hydrogen 3.176 N/A TYR 286.A OH SER 305.A O no hydrogen 2.460 N/A TYR 286.A OH ASP 306.A O no hydrogen 3.119 N/A ARG 287.A N ASP 344.A OD1 no hydrogen 2.944 N/A ARG 287.A NE LEU 309.A O no hydrogen 2.842 N/A ARG 287.A NH1 TYR 339.A OH no hydrogen 3.504 N/A ARG 287.A NH2 LEU 309.A O no hydrogen 2.821 N/A LYS 290.A NZ THR 324.A OG1 no hydrogen 2.462 N/A ASN 293.A N LYS 290.A O no hydrogen 3.054 N/A ASN 293.A ND2 ASP 288.A O no hydrogen 3.015 N/A ASN 293.A ND2 ASP 288.A OD2 no hydrogen 3.368 N/A ILE 294.A N PRO 291.A O no hydrogen 3.049 N/A LEU 295.A N ARG 303.A O no hydrogen 3.078 N/A LEU 296.A N GLY 248.A O no hydrogen 2.763 N/A ASP 297.A N HIS 301.A O no hydrogen 2.889 N/A HIS 299.A N ASP 297.A OD1 no hydrogen 2.997 N/A GLY 300.A N ASP 297.A OD1 no hydrogen 2.930 N/A HIS 301.A N ASP 297.A OD1 no hydrogen 3.108 N/A HIS 301.A ND1 GLU 271.A OE2 no hydrogen 2.560 N/A VAL 302.A N GLU 271.A OE1 no hydrogen 3.108 N/A ARG 303.A N LEU 295.A O no hydrogen 3.104 N/A ARG 303.A NH1 ILE 225.A O no hydrogen 3.367 N/A ILE 304.A N PHE 224.A O no hydrogen 2.843 N/A SER 305.A N ASN 293.A O no hydrogen 2.966 N/A SER 305.A OG ASP 306.A OD1 no hydrogen 2.887 N/A ALA 310.A N LEU 307.A O no hydrogen 3.146 N/A CYS 311.A N VAL 285.A O no hydrogen 2.886 N/A CYS 311.A SG ASP 312.A O no hydrogen 3.414 N/A PHE 313.A N PHE 283.A O no hydrogen 3.375 N/A SER 314.A N ASP 312.A OD1 no hydrogen 2.753 N/A THR 324.A OG1 ASP 288.A OD1 no hydrogen 2.990 N/A GLU 331.A N GLU 331.A OE1 no hydrogen 2.513 N/A LEU 333.A N ALA 329.A O no hydrogen 3.306 N/A GLN 334.A N PRO 330.A O no hydrogen 3.135 N/A TYR 339.A N PRO 318.A O no hydrogen 2.679 N/A TYR 339.A OH ALA 320.A O no hydrogen 2.300 N/A SER 342.A OG ASP 340.A OD1 no hydrogen 2.772 N/A ALA 343.A N ASP 340.A O no hydrogen 3.099 N/A PHE 346.A N SER 342.A O no hydrogen 3.246 N/A SER 347.A N ALA 343.A O no hydrogen 2.712 N/A SER 347.A OG TYR 327.A O no hydrogen 2.442 N/A SER 347.A OG ALA 343.A O no hydrogen 3.097 N/A LEU 348.A N ASP 344.A O no hydrogen 2.636 N/A GLY 349.A N TRP 345.A O no hydrogen 3.208 N/A CYS 350.A N PHE 346.A O no hydrogen 3.126 N/A CYS 350.A SG PHE 346.A O no hydrogen 3.110 N/A CYS 350.A SG SER 347.A O no hydrogen 3.670 N/A MET 351.A N SER 347.A O no hydrogen 2.573 N/A LEU 352.A N LEU 348.A O no hydrogen 2.706 N/A PHE 353.A N GLY 349.A O no hydrogen 2.807 N/A LYS 354.A N CYS 350.A O no hydrogen 2.819 N/A LYS 354.A NZ HIS 251.A NE2 no hydrogen 3.126 N/A LYS 354.A NZ TYR 327.A OH no hydrogen 3.273 N/A LEU 355.A N MET 351.A O no hydrogen 3.096 N/A LEU 355.A N LEU 352.A O no hydrogen 3.257 N/A LEU 356.A N PHE 353.A O no hydrogen 2.916 N/A ARG 357.A N PHE 353.A O no hydrogen 3.030 N/A GLY 358.A N LYS 354.A O no hydrogen 3.082 N/A HIS 359.A ND1 SER 360.A O no hydrogen 2.784 N/A SER 360.A OG GLY 326.A O no hydrogen 2.791 N/A PHE 362.A N SER 360.A OG no hydrogen 3.417 N/A ARG 363.A N SER 360.A O no hydrogen 2.857 N/A THR 367.A N GLN 364.A O no hydrogen 3.076 N/A GLU 372.A N ASP 369.A O no hydrogen 2.978 N/A ILE 373.A N ASP 369.A O no hydrogen 3.065 N/A ASP 374.A N LYS 370.A O no hydrogen 2.810 N/A ARG 375.A N HIS 371.A O no hydrogen 3.209 N/A MET 376.A N GLU 372.A O no hydrogen 3.110 N/A THR 377.A N ILE 373.A O no hydrogen 3.307 N/A THR 377.A OG1 ILE 373.A O no hydrogen 2.687 N/A LEU 378.A N ASP 374.A O no hydrogen 3.170 N/A THR 379.A OG1 THR 379.A O no hydrogen 2.652 N/A GLU 383.A N GLU 383.A OE1 no hydrogen 2.950 N/A PHE 388.A N PRO 385.A O no hydrogen 3.005 N/A SER 389.A N GLU 262.A OE2 no hydrogen 3.347 N/A SER 389.A OG GLU 262.A OE1 no hydrogen 2.855 N/A SER 389.A OG GLU 391.A OE2 no hydrogen 2.831 N/A ARG 393.A N SER 389.A O no hydrogen 2.861 N/A ARG 393.A NH1 PHE 388.A O no hydrogen 2.599 N/A SER 394.A N PRO 390.A O no hydrogen 2.577 N/A LEU 395.A N GLU 391.A O no hydrogen 2.802 N/A LEU 396.A N LEU 392.A O no hydrogen 2.753 N/A GLU 397.A N ARG 393.A O no hydrogen 3.048 N/A GLY 398.A N SER 394.A O no hydrogen 2.831 N/A LEU 399.A N LEU 395.A O no hydrogen 2.799 N/A LEU 400.A N LEU 396.A O no hydrogen 2.727 N/A GLN 401.A N GLU 397.A O no hydrogen 2.990 N/A ARG 406.A N ASP 403.A O no hydrogen 3.048 N/A ARG 407.A NE GLN 401.A O no hydrogen 2.997 N/A ARG 407.A NH1 GLU 331.A OE1 no hydrogen 3.547 N/A ARG 407.A NH1 GLU 331.A OE2 no hydrogen 2.781 N/A ARG 407.A NH1 SER 342.A O no hydrogen 3.380 N/A ARG 407.A NH2 GLN 401.A O no hydrogen 3.502 N/A LEU 408.A N GLY 398.A O no hydrogen 2.823 N/A GLY 409.A N GLU 417.A OE1 no hydrogen 2.549 N/A CYS 410.A SG VAL 404.A O no hydrogen 3.839 N/A CYS 410.A SG ARG 407.A O no hydrogen 3.268 N/A CYS 410.A SG LEU 408.A O no hydrogen 3.932 N/A LEU 411.A N GLU 417.A OE1 no hydrogen 3.092 N/A ARG 413.A N GLU 417.A OE2 no hydrogen 2.818 N/A ARG 413.A NH2 GLU 420.A OE2 no hydrogen 2.935 N/A GLU 417.A N GLY 414.A O no hydrogen 2.891 N/A LYS 419.A N ALA 415.A O no hydrogen 2.909 N/A LYS 419.A NZ GLU 277.A OE1 no hydrogen 3.112 N/A LYS 419.A NZ GLU 277.A OE2 no hydrogen 3.158 N/A GLU 420.A N GLN 416.A O no hydrogen 3.163 N/A GLU 420.A N GLU 417.A O no hydrogen 3.209 N/A SER 421.A N VAL 418.A O no hydrogen 3.253 N/A PHE 424.A N SER 421.A O no hydrogen 3.088 N/A ARG 425.A N PRO 422.A O no hydrogen 3.075 N/A ASP 428.A N TYR 437.A OH no hydrogen 3.128 N/A GLN 430.A N ASP 428.A OD1 no hydrogen 3.197 N/A VAL 432.A N ASP 428.A O no hydrogen 3.316 N/A PHE 433.A N TRP 429.A O no hydrogen 3.243 N/A LEU 434.A N GLN 430.A O no hydrogen 2.956 N/A GLN 435.A N VAL 432.A O no hydrogen 2.801 N/A LYS 436.A N MET 431.A O no hydrogen 2.923 N/A ARG 445.A NH2 GLU 298.A OE2 no hydrogen 3.223 N/A ASP 449.A N ASP 449.A OD1 no hydrogen 2.627 N/A LEU 459.A N ASP 462.A OD2 no hydrogen 2.687 N/A ASP 462.A N LEU 459.A O no hydrogen 3.191 N/A GLN 463.A N LEU 459.A O no hydrogen 3.342 N/A GLN 463.A NE2 PRO 235.A O no hydrogen 2.578 N/A LEU 465.A N ASP 462.A O no hydrogen 3.012 N/A ARG 467.A N GLU 464.A O no hydrogen 3.199 N/A ARG 467.A NH1 GLU 464.A OE2 no hydrogen 3.179 N/A LEU 471.A N ALA 231.A O no hydrogen 2.861 N/A ILE 473.A N SER 229.A O no hydrogen 3.109 N/A SER 474.A OG GLU 152.A OE1 no hydrogen 3.455 N/A SER 474.A OG GLU 152.A OE2 no hydrogen 2.755 N/A ARG 476.A NE SER 218.A O no hydrogen 3.058 N/A ARG 476.A NH2 SER 218.A O no hydrogen 2.702 N/A TRP 477.A N ILE 473.A O no hydrogen 3.204 N/A GLN 478.A N SER 474.A O no hydrogen 2.896 N/A GLN 478.A NE2 GLN 32.A OE1 no hydrogen 3.026 N/A GLN 478.A NE2 GLU 152.A OE1 no hydrogen 3.315 N/A GLN 479.A N GLU 475.A O no hydrogen 2.889 N/A GLN 479.A NE2 GLU 483.A OE1 no hydrogen 2.849 N/A GLU 480.A N ARG 476.A O no hydrogen 2.698 N/A VAL 481.A N TRP 477.A O no hydrogen 2.846 N/A ALA 482.A N GLN 478.A O no hydrogen 2.705 N/A GLU 483.A N GLN 479.A O no hydrogen 3.313 N/A THR 484.A N VAL 481.A O no hydrogen 2.957 N/A THR 484.A OG1 GLU 480.A O no hydrogen 2.631 N/A THR 484.A OG1 VAL 481.A O no hydrogen 3.477 N/A PHE 486.A N VAL 481.A O no hydrogen 3.164 N/A THR 488.A OG1 VAL 485.A O no hydrogen 3.529 N/A ILE 489.A N VAL 485.A O no hydrogen 2.830 N/A ASN 490.A N PHE 486.A O no hydrogen 3.041 N/A ALA 491.A N ASP 487.A O no hydrogen 2.980 N/A GLU 492.A N THR 488.A O no hydrogen 3.032 N/A THR 493.A N ILE 489.A O no hydrogen 2.916 N/A THR 493.A OG1 ILE 489.A O no hydrogen 3.213 N/A ASP 494.A N ASN 490.A O no hydrogen 2.941 N/A ARG 495.A N ALA 491.A O no hydrogen 2.966 N/A LEU 496.A N GLU 492.A O no hydrogen 2.941 N/A GLU 497.A N THR 493.A O no hydrogen 3.070 N/A ALA 498.A N ASP 494.A O no hydrogen 2.906 N/A ARG 499.A N ARG 495.A O no hydrogen 3.021 N/A LYS 500.A NZ GLU 7.A OE1 no hydrogen 2.612 N/A LYS 501.A N GLU 497.A O no hydrogen 3.066 N/A THR 502.A OG1 ALA 498.A O no hydrogen 3.197 N/A LYS 503.A N ARG 499.A O no hydrogen 3.062 N/A ASN 504.A N LYS 501.A O no hydrogen 3.344 N/A LYS 505.A N LYS 501.A O no hydrogen 3.344 N/A LEU 507.A N LYS 503.A O no hydrogen 3.090 N/A TYR 513.A OH GLU 549.A OE1 no hydrogen 2.509 N/A ALA 514.A N ASP 512.A OD1 no hydrogen 3.277 N/A LEU 515.A N ASP 512.A O no hydrogen 3.299 N/A LYS 517.A NZ TYR 513.A O no hydrogen 2.985 N/A CYS 519.A SG LEU 543.A O no hydrogen 3.732 N/A ILE 520.A N LEU 543.A O no hydrogen 2.815 N/A HIS 522.A N SER 12.A OG no hydrogen 3.235 N/A HIS 522.A ND1 TYR 540.A OH no hydrogen 2.685 N/A GLY 523.A N PHE 541.A O no hydrogen 3.133 N/A TYR 524.A OH GLU 553.A OE1 no hydrogen 3.069 N/A MET 525.A N ARG 539.A O no hydrogen 3.099 N/A SER 526.A N GLN 593.A O no hydrogen 3.020 N/A LYS 527.A N GLN 537.A O no hydrogen 2.980 N/A LYS 527.A NZ GLN 537.A OE1 no hydrogen 2.876 N/A LEU 533.A N ASN 530.A O no hydrogen 3.422 N/A THR 534.A N ASN 530.A O no hydrogen 2.909 N/A THR 534.A OG1 LEU 533.A O no hydrogen 2.441 N/A THR 534.A OG1 THR 534.A O no hydrogen 2.501 N/A GLN 537.A N LYS 527.A O no hydrogen 2.803 N/A ARG 538.A NH2 ASP 595.A OD2 no hydrogen 3.199 N/A ARG 539.A N MET 525.A O no hydrogen 2.884 N/A TYR 540.A N ARG 551.A O no hydrogen 3.061 N/A TYR 540.A OH HIS 522.A ND1 no hydrogen 2.685 N/A PHE 541.A N GLY 523.A O no hydrogen 2.729 N/A TYR 542.A N GLU 549.A O no hydrogen 2.760 N/A LEU 543.A N MET 521.A O no hydrogen 2.900 N/A PHE 544.A N ARG 547.A O no hydrogen 2.817 N/A ARG 547.A NE GLU 549.A OE2 no hydrogen 2.705 N/A ARG 547.A NH1 ASN 546.A OD1 no hydrogen 2.864 N/A ARG 547.A NH2 GLU 549.A OE2 no hydrogen 3.395 N/A LEU 548.A N LEU 561.A O no hydrogen 2.636 N/A GLU 549.A N TYR 542.A O no hydrogen 2.940 N/A ARG 551.A N TYR 540.A O no hydrogen 3.126 N/A ARG 551.A NE TYR 542.A OH no hydrogen 3.434 N/A ARG 551.A NH1 GLY 554.A O no hydrogen 3.564 N/A ARG 551.A NH1 GLU 555.A O no hydrogen 3.430 N/A GLU 555.A N GLU 553.A O no hydrogen 3.255 N/A LEU 561.A N LEU 548.A O no hydrogen 2.887 N/A THR 562.A N GLU 565.A OE1 no hydrogen 2.759 N/A THR 562.A OG1 GLU 565.A OE1 no hydrogen 3.400 N/A MET 563.A N ASN 546.A O no hydrogen 3.111 N/A GLU 565.A N THR 562.A OG1 no hydrogen 3.055 N/A ILE 566.A N MET 563.A O no hydrogen 3.183 N/A GLN 567.A N LYS 583.A O no hydrogen 2.887 N/A GLU 570.A N LEU 581.A O no hydrogen 3.268 N/A THR 572.A N CYS 579.A O no hydrogen 2.898 N/A ILE 574.A N ARG 577.A O no hydrogen 2.822 N/A ARG 577.A NH1 LYS 578.A O no hydrogen 3.452 N/A CYS 579.A N THR 572.A O no hydrogen 2.748 N/A CYS 579.A SG ARG 577.A O no hydrogen 3.366 N/A LEU 580.A N LEU 592.A O no hydrogen 2.725 N/A LEU 581.A N GLU 570.A O no hydrogen 2.696 N/A LEU 582.A N PHE 590.A O no hydrogen 2.847 N/A LYS 583.A N SER 568.A O no hydrogen 3.232 N/A LYS 583.A NZ GLU 570.A OE2 no hydrogen 3.188 N/A ILE 584.A N LYS 588.A O no hydrogen 3.069 N/A ARG 585.A N GLU 565.A O no hydrogen 3.062 N/A GLY 587.A N ILE 584.A O no hydrogen 2.915 N/A PHE 590.A N LEU 582.A O no hydrogen 2.835 N/A LEU 592.A N LEU 580.A O no hydrogen 2.988 N/A GLN 593.A N SER 526.A O no hydrogen 3.093 N/A SER 596.A OG GLU 599.A OE1 no hydrogen 2.316 N/A ASP 597.A N ASN 154.A OD1 no hydrogen 3.265 N/A LEU 600.A N SER 596.A O no hydrogen 3.040 N/A VAL 601.A N ASP 597.A O no hydrogen 2.882 N/A GLN 602.A N PRO 598.A O no hydrogen 2.917 N/A GLN 602.A N GLU 599.A O no hydrogen 3.169 N/A GLN 602.A NE2 ASP 20.A OD2 no hydrogen 2.830 N/A GLN 602.A NE2 GLU 606.A OE2 no hydrogen 3.159 N/A TRP 603.A N GLU 599.A O no hydrogen 2.897 N/A LYS 604.A N LEU 600.A O no hydrogen 3.112 N/A LYS 604.A NZ GLU 571.A OE1 no hydrogen 3.090 N/A LYS 605.A N VAL 601.A O no hydrogen 3.206 N/A LYS 605.A NZ ASP 20.A OD2 no hydrogen 3.002 N/A GLU 606.A N GLN 602.A O no hydrogen 2.748 N/A LEU 607.A N TRP 603.A O no hydrogen 3.017 N/A ARG 608.A N LYS 604.A O no hydrogen 3.190 N/A ARG 608.A NE VAL 569.A O no hydrogen 2.759 N/A ARG 608.A NH2 VAL 569.A O no hydrogen 3.256 N/A ASP 609.A N LYS 605.A O no hydrogen 3.047 N/A ALA 610.A N GLU 606.A O no hydrogen 2.790 N/A TYR 611.A N LEU 607.A O no hydrogen 3.150 N/A ARG 612.A N ARG 608.A O no hydrogen 3.270 N/A ARG 612.A NE TYR 611.A OH no hydrogen 3.337 N/A ARG 612.A NH2 TYR 611.A OH no hydrogen 3.444 N/A GLU 613.A N ASP 609.A O no hydrogen 3.217 N/A ALA 614.A N ALA 610.A O no hydrogen 2.851 N/A GLN 615.A N TYR 611.A O no hydrogen 2.976 N/A GLN 615.A NE2 MET 563.A O no hydrogen 2.867 N/A GLN 615.A NE2 GLU 564.A O no hydrogen 3.470 N/A GLN 615.A NE2 ILE 566.A O no hydrogen 2.839 N/A GLN 616.A N ARG 612.A O no hydrogen 3.123 N/A LEU 617.A N GLU 613.A O no hydrogen 2.957 N/A VAL 618.A N ALA 614.A O no hydrogen 2.915 N/A ARG 620.A N LEU 617.A O no hydrogen 3.264 N/A VAL 621.A N VAL 618.A O no hydrogen 3.346 N/A MET 624.A N VAL 621.A O no hydrogen 2.914 N/A LYS 625.A N VAL 621.A O no hydrogen 3.009 N/A LYS 627.A NZ PRO 622.A O no hydrogen 3.380 N/A