Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG THR 1.A O no hydrogen 2.797 N/A GLU 12.A N ASP 9.A O no hydrogen 3.412 N/A THR 13.A N ASP 9.A O no hydrogen 3.378 N/A THR 13.A OG1 ASP 9.A O no hydrogen 3.137 N/A TRP 14.A N PHE 10.A O no hydrogen 2.869 N/A LYS 16.A N GLU 12.A O no hydrogen 2.930 N/A LEU 17.A N THR 13.A O no hydrogen 2.873 N/A LEU 18.A N TRP 14.A O no hydrogen 2.832 N/A THR 19.A OG1 LYS 16.A O no hydrogen 3.129 N/A THR 20.A N LEU 17.A O no hydrogen 3.134 N/A ILE 21.A N LEU 17.A O no hydrogen 2.929 N/A LYS 22.A N LEU 18.A O no hydrogen 2.811 N/A LEU 27.A N VAL 24.A O no hydrogen 3.454 N/A GLU 28.A N ALA 23.A O no hydrogen 2.869 N/A GLU 31.A N GLU 31.A OE1 no hydrogen 2.544 N/A TRP 35.A N GLU 31.A O no hydrogen 3.078 N/A ASN 36.A N ARG 32.A O no hydrogen 2.901 N/A ASP 37.A N ALA 33.A O no hydrogen 2.915 N/A ARG 38.A N THR 34.A O no hydrogen 2.938 N/A ARG 38.A NE LYS 16.A O no hydrogen 2.865 N/A ARG 38.A NH2 LYS 16.A O no hydrogen 2.856 N/A PHE 39.A N ASN 36.A O no hydrogen 3.174 N/A ASP 41.A N ASP 37.A O no hydrogen 2.959 N/A ILE 42.A N ARG 38.A O no hydrogen 2.879 N/A TYR 43.A N PHE 39.A O no hydrogen 2.947 N/A TYR 43.A OH LEU 3.A O no hydrogen 3.113 N/A ALA 44.A N SER 40.A O no hydrogen 2.867 N/A LEU 45.A N ASP 41.A O no hydrogen 2.934 N/A CYS 46.A N ILE 42.A O no hydrogen 2.927 N/A CYS 46.A SG ILE 42.A O no hydrogen 3.479 N/A VAL 47.A N TYR 43.A O no hydrogen 3.054 N/A TYR 49.A N ARG 6.A O no hydrogen 2.540 N/A LEU 53.A N LEU 45.A O no hydrogen 3.042 N/A LEU 57.A N LEU 53.A O no hydrogen 2.888 N/A TYR 58.A N GLY 54.A O no hydrogen 2.901 N/A TYR 58.A OH MET 119.A O no hydrogen 3.048 N/A THR 59.A N GLU 55.A O no hydrogen 2.894 N/A THR 59.A OG1 GLU 55.A O no hydrogen 3.165 N/A THR 59.A OG1 GLU 55.A OE2 no hydrogen 2.765 N/A GLU 60.A N ARG 56.A O no hydrogen 2.916 N/A THR 61.A N LEU 57.A O no hydrogen 2.893 N/A THR 61.A OG1 LEU 57.A O no hydrogen 2.868 N/A THR 61.A OG1 TYR 105.A OH no hydrogen 2.693 N/A LYS 62.A N TYR 58.A O no hydrogen 2.913 N/A ILE 63.A N THR 59.A O no hydrogen 2.915 N/A PHE 64.A N GLU 60.A O no hydrogen 2.876 N/A LEU 65.A N THR 61.A O no hydrogen 2.891 N/A GLU 66.A N LYS 62.A O no hydrogen 2.914 N/A ASN 67.A N ILE 63.A O no hydrogen 2.929 N/A ASN 67.A N PHE 64.A O no hydrogen 3.157 N/A HIS 68.A N LEU 65.A O no hydrogen 2.999 N/A VAL 69.A N LEU 65.A O no hydrogen 2.993 N/A ARG 70.A NE GLU 66.A O no hydrogen 3.398 N/A LEU 72.A N HIS 68.A O no hydrogen 2.790 N/A HIS 73.A N VAL 69.A O no hydrogen 2.861 N/A LYS 74.A N ARG 70.A O no hydrogen 2.921 N/A ARG 75.A N HIS 71.A O no hydrogen 2.907 N/A VAL 76.A N HIS 73.A O no hydrogen 2.804 N/A LEU 77.A N HIS 73.A O no hydrogen 3.104 N/A SER 79.A N VAL 76.A O no hydrogen 3.024 N/A MET 86.A N GLN 82.A O no hydrogen 3.045 N/A TYR 87.A N VAL 83.A O no hydrogen 2.887 N/A TYR 87.A OH SER 169.A OG no hydrogen 2.648 N/A HIS 88.A N LEU 84.A O no hydrogen 2.899 N/A ARG 89.A N VAL 85.A O no hydrogen 2.902 N/A TYR 90.A N MET 86.A O no hydrogen 2.941 N/A TRP 91.A N TYR 87.A O no hydrogen 2.828 N/A GLU 92.A N HIS 88.A O no hydrogen 2.864 N/A GLU 93.A N ARG 89.A O no hydrogen 2.992 N/A TYR 94.A N TYR 90.A O no hydrogen 2.840 N/A TYR 94.A OH ALA 125.A O no hydrogen 2.676 N/A SER 95.A N TRP 91.A O no hydrogen 2.855 N/A GLY 97.A N GLU 93.A O no hydrogen 2.921 N/A ALA 98.A N TYR 94.A O no hydrogen 2.822 N/A ASP 99.A N SER 95.A O no hydrogen 2.963 N/A TYR 100.A N LYS 96.A O no hydrogen 2.902 N/A MET 101.A N GLY 97.A O no hydrogen 2.880 N/A ASP 102.A N ALA 98.A O no hydrogen 2.865 N/A CYS 103.A N ASP 99.A O no hydrogen 2.956 N/A CYS 103.A SG ASP 99.A O no hydrogen 3.325 N/A LEU 104.A N TYR 100.A O no hydrogen 2.898 N/A TYR 105.A N MET 101.A O no hydrogen 2.895 N/A TYR 105.A OH THR 61.A OG1 no hydrogen 2.693 N/A ASN 109.A N TYR 105.A O no hydrogen 2.883 N/A THR 110.A N ARG 106.A O no hydrogen 2.915 N/A THR 110.A OG1 ARG 106.A O no hydrogen 3.017 N/A GLN 111.A N TYR 107.A O no hydrogen 2.893 N/A PHE 112.A N LEU 108.A O no hydrogen 3.282 N/A ILE 113.A N LEU 108.A O no hydrogen 2.998 N/A LYS 114.A N ASN 109.A O no hydrogen 3.106 N/A ASN 116.A N PHE 112.A O no hydrogen 3.077 N/A MET 119.A N TYR 58.A OH no hydrogen 3.268 N/A ILE 121.A N ASN 109.A OD1 no hydrogen 2.958 N/A LEU 124.A N GLU 120.A O no hydrogen 2.360 N/A ALA 125.A N ILE 121.A O no hydrogen 2.882 N/A ASP 127.A N GLU 123.A O no hydrogen 2.894 N/A MET 128.A N LEU 124.A O no hydrogen 2.650 N/A TRP 129.A N ALA 125.A O no hydrogen 2.948 N/A TRP 129.A NE1 TYR 87.A OH no hydrogen 3.168 N/A ARG 130.A N LEU 126.A O no hydrogen 2.828 N/A LYS 131.A N ASP 127.A O no hydrogen 3.207 N/A LYS 131.A NZ ASP 127.A OD2 no hydrogen 2.705 N/A MET 133.A N TRP 129.A O no hydrogen 2.900 N/A VAL 134.A N TRP 129.A O no hydrogen 3.130 N/A GLU 135.A N ARG 130.A O no hydrogen 2.860 N/A GLN 138.A N GLU 135.A O no hydrogen 3.377 N/A ILE 140.A N LEU 137.A O no hydrogen 3.133 N/A LEU 141.A N LEU 137.A O no hydrogen 2.717 N/A MET 144.A N ILE 140.A O no hydrogen 2.941 N/A LEU 145.A N LEU 141.A O no hydrogen 2.876 N/A LEU 146.A N ILE 142.A O no hydrogen 2.906 N/A ARG 147.A N ARG 143.A O no hydrogen 2.940 N/A GLU 148.A N MET 144.A O no hydrogen 2.872 N/A ILE 149.A N LEU 145.A O no hydrogen 2.923 N/A LYS 150.A N LEU 146.A O no hydrogen 2.882 N/A ASN 151.A N ARG 147.A O no hydrogen 2.896 N/A ASP 152.A N GLU 148.A O no hydrogen 2.875 N/A ARG 153.A N ILE 149.A O no hydrogen 2.917 N/A ARG 153.A NE GLU 228.A OE1 no hydrogen 2.912 N/A ARG 153.A NH2 GLU 228.A OE1 no hydrogen 3.019 N/A ARG 153.A NH2 GLU 228.A OE2 no hydrogen 2.944 N/A GLY 154.A N ASN 151.A O no hydrogen 3.065 N/A GLY 155.A N ASP 152.A O no hydrogen 3.224 N/A GLU 156.A N ASN 151.A O no hydrogen 3.193 N/A GLN 160.A NE2 LYS 234.A O no hydrogen 2.758 N/A ILE 163.A N ASN 159.A O no hydrogen 3.043 N/A HIS 164.A N GLN 160.A O no hydrogen 2.901 N/A GLY 165.A N LYS 161.A O no hydrogen 2.898 N/A VAL 166.A N VAL 162.A O no hydrogen 2.918 N/A ILE 167.A N ILE 163.A O no hydrogen 2.931 N/A ASN 168.A N HIS 164.A O no hydrogen 2.892 N/A SER 169.A N GLY 165.A O no hydrogen 2.895 N/A SER 169.A N VAL 166.A O no hydrogen 3.206 N/A SER 169.A OG TYR 87.A OH no hydrogen 2.648 N/A SER 169.A OG VAL 166.A O no hydrogen 2.565 N/A PHE 170.A N ILE 167.A O no hydrogen 3.316 N/A VAL 171.A N ASN 168.A O no hydrogen 3.326 N/A HIS 172.A N ASN 168.A O no hydrogen 2.876 N/A GLU 174.A N VAL 171.A O no hydrogen 3.267 N/A LYS 177.A N GLU 174.A O no hydrogen 3.267 N/A LYS 183.A N PHE 180.A O no hydrogen 3.342 N/A TYR 185.A OH SER 240.A OG no hydrogen 3.165 N/A GLN 186.A N LEU 182.A O no hydrogen 2.858 N/A GLU 187.A N LYS 183.A O no hydrogen 3.266 N/A GLU 187.A N PHE 184.A O no hydrogen 3.175 N/A ILE 188.A N PHE 184.A O no hydrogen 2.961 N/A PHE 189.A N TYR 185.A O no hydrogen 3.458 N/A GLU 190.A N TYR 185.A O no hydrogen 2.935 N/A SER 191.A N GLN 186.A O no hydrogen 2.779 N/A SER 191.A OG GLN 186.A O no hydrogen 3.018 N/A PHE 193.A N PHE 189.A O no hydrogen 2.784 N/A LEU 194.A N GLU 190.A O no hydrogen 2.869 N/A THR 195.A N SER 191.A O no hydrogen 2.984 N/A THR 195.A OG1 SER 191.A O no hydrogen 2.913 N/A GLU 196.A N PRO 192.A O no hydrogen 2.876 N/A THR 197.A N PHE 193.A O no hydrogen 2.853 N/A GLY 198.A N LEU 194.A O no hydrogen 2.858 N/A GLU 199.A N THR 195.A O no hydrogen 3.021 N/A TYR 200.A N GLU 196.A O no hydrogen 2.866 N/A TYR 201.A N THR 197.A O no hydrogen 2.862 N/A TYR 201.A OH GLU 228.A OE1 no hydrogen 2.461 N/A LYS 202.A N GLY 198.A O no hydrogen 2.908 N/A LYS 202.A NZ GLU 199.A OE1 no hydrogen 3.500 N/A GLN 203.A N GLU 199.A O no hydrogen 2.972 N/A GLU 204.A N TYR 200.A O no hydrogen 2.843 N/A ALA 205.A N TYR 201.A O no hydrogen 2.839 N/A SER 206.A N LYS 202.A O no hydrogen 2.958 N/A SER 206.A OG LYS 202.A O no hydrogen 3.194 N/A ASN 207.A N GLN 203.A O no hydrogen 2.885 N/A LEU 208.A N ALA 205.A O no hydrogen 3.107 N/A LEU 209.A N ALA 205.A O no hydrogen 3.319 N/A SER 212.A OG LEU 208.A O no hydrogen 2.805 N/A SER 215.A OG ASP 275.A OD1 no hydrogen 2.688 N/A GLN 216.A N ASN 213.A OD1 no hydrogen 2.808 N/A TYR 217.A N ASN 213.A O no hydrogen 3.164 N/A TYR 217.A OH MET 252.A O no hydrogen 2.211 N/A MET 218.A N CYS 214.A O no hydrogen 2.893 N/A GLU 219.A N SER 215.A O no hydrogen 2.964 N/A LYS 220.A N GLN 216.A O no hydrogen 2.905 N/A VAL 221.A N TYR 217.A O no hydrogen 2.843 N/A LEU 222.A N MET 218.A O no hydrogen 2.921 N/A GLY 223.A N GLU 219.A O no hydrogen 2.961 N/A ARG 224.A N LYS 220.A O no hydrogen 2.844 N/A ARG 224.A NH1 ARG 153.A O no hydrogen 3.390 N/A ARG 224.A NH2 ARG 153.A O no hydrogen 2.691 N/A LEU 225.A N VAL 221.A O no hydrogen 2.847 N/A LYS 226.A N LEU 222.A O no hydrogen 2.935 N/A LYS 226.A NZ ASP 227.A OD1 no hydrogen 3.391 N/A ASP 227.A N GLY 223.A O no hydrogen 2.911 N/A GLU 228.A N ARG 224.A O no hydrogen 2.857 N/A GLU 229.A N LEU 225.A O no hydrogen 2.911 N/A ILE 230.A N LYS 226.A O no hydrogen 2.929 N/A ARG 231.A N ASP 227.A O no hydrogen 2.884 N/A CYS 232.A N GLU 228.A O no hydrogen 2.804 N/A CYS 232.A SG GLU 228.A O no hydrogen 3.128 N/A CYS 232.A SG GLU 229.A O no hydrogen 3.267 N/A ARG 233.A N ILE 230.A O no hydrogen 3.235 N/A ARG 233.A NH2 GLU 229.A OE2 no hydrogen 2.382 N/A SER 240.A OG TYR 185.A OH no hydrogen 3.165 N/A SER 240.A OG GLU 190.A OE1 no hydrogen 2.468 N/A TYR 241.A N PRO 238.A O no hydrogen 2.933 N/A TYR 241.A OH ARG 233.A O no hydrogen 2.622 N/A THR 242.A N SER 239.A O no hydrogen 2.990 N/A THR 242.A OG1 SER 239.A O no hydrogen 3.047 N/A HIS 246.A N THR 242.A O no hydrogen 2.989 N/A GLU 247.A N LYS 243.A O no hydrogen 2.861 N/A CYS 248.A N VAL 244.A O no hydrogen 2.663 N/A GLN 249.A N HIS 246.A O no hydrogen 2.944 N/A GLN 250.A N HIS 246.A O no hydrogen 2.809 N/A MET 252.A N GLN 249.A O no hydrogen 2.909 N/A VAL 253.A N GLN 249.A O no hydrogen 2.774 N/A ALA 254.A N GLN 249.A O no hydrogen 3.025 N/A HIS 256.A ND1 TYR 217.A OH no hydrogen 3.224 N/A LEU 257.A N ALA 254.A O no hydrogen 2.924 N/A PHE 259.A N HIS 256.A O no hydrogen 2.927 N/A LEU 260.A N HIS 256.A O no hydrogen 3.086 N/A HIS 261.A N LEU 257.A O no hydrogen 2.761 N/A HIS 261.A NE2 GLY 289.A O no hydrogen 2.393 N/A ALA 262.A N GLN 258.A O no hydrogen 3.467 N/A GLU 263.A N LEU 260.A O no hydrogen 2.939 N/A CYS 264.A N HIS 261.A O no hydrogen 2.936 N/A HIS 265.A ND1 GLU 296.A OE1 no hydrogen 2.635 N/A ASN 266.A ND2 GLU 263.A OE2 no hydrogen 3.150 N/A ILE 267.A N GLU 263.A O no hydrogen 2.879 N/A ILE 268.A N CYS 264.A O no hydrogen 3.040 N/A ARG 269.A N HIS 265.A O no hydrogen 3.405 N/A ARG 269.A NH1 GLU 296.A OE1 no hydrogen 2.456 N/A GLU 271.A N ILE 268.A O no hydrogen 3.072 N/A LYS 272.A N ILE 267.A O no hydrogen 3.439 N/A LYS 273.A NZ GLU 271.A O no hydrogen 3.559 N/A ASN 274.A ND2 GLU 219.A OE2 no hydrogen 3.461 N/A MET 276.A N LYS 272.A O no hydrogen 2.723 N/A ALA 277.A N LYS 273.A O no hydrogen 2.928 N/A MET 279.A N ASP 275.A O no hydrogen 2.896 N/A TYR 280.A N MET 276.A O no hydrogen 2.915 N/A TYR 280.A OH ASP 343.A OD2 no hydrogen 2.817 N/A VAL 281.A N ALA 277.A O no hydrogen 2.935 N/A LEU 282.A N ASN 278.A O no hydrogen 2.906 N/A LEU 283.A N MET 279.A O no hydrogen 2.897 N/A ARG 284.A N TYR 280.A O no hydrogen 2.943 N/A ILE 294.A N LEU 290.A O no hydrogen 2.943 N/A GLN 295.A N PRO 291.A O no hydrogen 2.899 N/A GLU 296.A N HIS 292.A O no hydrogen 2.900 N/A LEU 297.A N MET 293.A O no hydrogen 2.903 N/A GLN 298.A N ILE 294.A O no hydrogen 2.931 N/A ASN 299.A N GLN 295.A O no hydrogen 2.911 N/A HIS 300.A N GLU 296.A O no hydrogen 2.894 N/A HIS 300.A NE2 GLU 271.A OE2 no hydrogen 2.934 N/A ILE 301.A N LEU 297.A O no hydrogen 2.899 N/A HIS 302.A N GLN 298.A O no hydrogen 2.906 N/A ASP 303.A N ASN 299.A O no hydrogen 2.914 N/A GLU 304.A N HIS 300.A O no hydrogen 2.877 N/A GLY 305.A N ILE 301.A O no hydrogen 2.862 N/A LEU 306.A N HIS 302.A O no hydrogen 2.967 N/A ARG 307.A N ASP 303.A O no hydrogen 2.919 N/A ALA 308.A N GLU 304.A O no hydrogen 2.896 N/A THR 309.A N GLY 305.A O no hydrogen 2.902 N/A THR 309.A OG1 GLY 305.A O no hydrogen 3.173 N/A SER 310.A N LEU 306.A O no hydrogen 2.889 N/A THR 313.A OG1 ASN 311.A O no hydrogen 3.427 N/A THR 319.A OG1 ASN 316.A OD1 no hydrogen 3.326 N/A LEU 320.A N ASN 316.A O no hydrogen 2.999 N/A PHE 321.A N MET 317.A O no hydrogen 2.906 N/A GLU 323.A N THR 319.A O no hydrogen 2.899 N/A SER 324.A N LEU 320.A O no hydrogen 2.857 N/A SER 324.A OG LEU 320.A O no hydrogen 3.310 N/A VAL 325.A N PHE 321.A O no hydrogen 2.978 N/A LEU 326.A N VAL 322.A O no hydrogen 2.899 N/A GLU 327.A N GLU 323.A O no hydrogen 2.854 N/A VAL 328.A N SER 324.A O no hydrogen 2.935 N/A HIS 329.A N VAL 325.A O no hydrogen 2.879 N/A GLY 330.A N LEU 326.A O no hydrogen 2.835 N/A LYS 331.A N GLU 327.A O no hydrogen 2.910 N/A LYS 331.A NZ GLU 304.A OE2 no hydrogen 3.080 N/A PHE 332.A N VAL 328.A O no hydrogen 2.944 N/A VAL 333.A N HIS 329.A O no hydrogen 2.867 N/A LEU 335.A N LYS 331.A O no hydrogen 2.922 N/A ILE 336.A N PHE 332.A O no hydrogen 2.869 N/A ASN 337.A N VAL 333.A O no hydrogen 2.898 N/A THR 338.A N GLN 334.A O no hydrogen 3.279 N/A THR 338.A OG1 GLN 334.A O no hydrogen 2.614 N/A VAL 339.A N LEU 335.A O no hydrogen 3.156 N/A GLY 342.A N ILE 336.A O no hydrogen 2.866 N/A ASP 343.A N LEU 340.A O no hydrogen 2.905 N/A GLN 344.A N GLN 344.A OE1 no hydrogen 2.648 N/A MET 347.A N ASP 343.A O no hydrogen 3.081 N/A SER 348.A N GLN 344.A O no hydrogen 2.891 N/A ALA 349.A N HIS 345.A O no hydrogen 2.927 N/A LEU 350.A N PHE 346.A O no hydrogen 2.865 N/A ASP 351.A N MET 347.A O no hydrogen 2.894 N/A LYS 352.A N SER 348.A O no hydrogen 2.894 N/A LYS 352.A NZ SER 348.A OG no hydrogen 3.289 N/A ALA 353.A N ALA 349.A O no hydrogen 2.932 N/A LEU 354.A N LEU 350.A O no hydrogen 2.869 N/A THR 355.A N ASP 351.A O no hydrogen 2.888 N/A THR 355.A OG1 ASP 351.A O no hydrogen 2.650 N/A SER 356.A N LYS 352.A O no hydrogen 2.940 N/A SER 356.A OG LYS 352.A O no hydrogen 2.950 N/A VAL 357.A N ALA 353.A O no hydrogen 2.922 N/A VAL 358.A N LEU 354.A O no hydrogen 2.906 N/A ASN 359.A N THR 355.A O no hydrogen 3.188 N/A ASN 359.A ND2 TYR 406.A O no hydrogen 3.591 N/A ASN 359.A ND2 ILE 407.A O no hydrogen 2.252 N/A TYR 360.A N VAL 357.A O no hydrogen 3.206 N/A VAL 366.A N SER 365.A OG no hydrogen 2.534 N/A LEU 372.A N LYS 368.A O no hydrogen 2.991 N/A LEU 373.A N ALA 369.A O no hydrogen 2.937 N/A ALA 374.A N PRO 370.A O no hydrogen 2.913 N/A LYS 375.A N GLU 371.A O no hydrogen 2.888 N/A LYS 375.A NZ ASP 378.A OD2 no hydrogen 2.967 N/A LYS 375.A NZ ASN 379.A OD1 no hydrogen 2.689 N/A TYR 376.A N LEU 372.A O no hydrogen 2.891 N/A CYS 377.A N LEU 373.A O no hydrogen 2.958 N/A CYS 377.A SG LEU 373.A O no hydrogen 3.382 N/A ASP 378.A N ALA 374.A O no hydrogen 2.911 N/A ASN 379.A N LYS 375.A O no hydrogen 2.831 N/A LEU 380.A N TYR 376.A O no hydrogen 2.990 N/A LEU 381.A N CYS 377.A O no hydrogen 2.902 N/A LYS 382.A N ASP 378.A O no hydrogen 3.122 N/A LYS 382.A NZ ASP 378.A OD1 no hydrogen 2.389 N/A LYS 382.A NZ ASP 378.A OD2 no hydrogen 3.422 N/A LYS 383.A N LEU 429.A O no hydrogen 2.817 N/A LYS 386.A NZ ASN 379.A O no hydrogen 3.205 N/A THR 389.A OG1 ASN 391.A OD1 no hydrogen 2.541 N/A GLU 392.A N THR 389.A O no hydrogen 3.501 N/A VAL 393.A N GLU 390.A O no hydrogen 3.295 N/A GLU 394.A N GLU 394.A OE1 no hydrogen 2.917 N/A ASP 395.A N GLU 392.A O no hydrogen 3.292 N/A ARG 396.A N GLU 392.A O no hydrogen 2.921 N/A LEU 397.A N VAL 393.A O no hydrogen 2.921 N/A THR 398.A OG1 ASP 395.A O no hydrogen 2.494 N/A SER 399.A N ASP 395.A O no hydrogen 2.947 N/A SER 399.A OG ARG 396.A O no hydrogen 2.616 N/A PHE 400.A N ARG 396.A O no hydrogen 2.877 N/A ILE 401.A N LEU 397.A O no hydrogen 2.934 N/A THR 402.A N SER 399.A O no hydrogen 3.322 N/A THR 402.A OG1 SER 399.A O no hydrogen 2.732 N/A PHE 404.A N PHE 400.A O no hydrogen 2.924 N/A LYS 405.A N ILE 401.A O no hydrogen 2.913 N/A TYR 406.A N VAL 403.A O no hydrogen 3.321 N/A TYR 406.A OH ASP 351.A OD1 no hydrogen 3.081 N/A ILE 407.A N PHE 404.A O no hydrogen 3.263 N/A ASP 411.A N ARG 692.A O no hydrogen 3.149 N/A GLN 414.A N LYS 410.A O no hydrogen 2.847 N/A LYS 415.A N ASP 411.A O no hydrogen 2.968 N/A LYS 415.A NZ LYS 415.A O no hydrogen 3.459 N/A PHE 416.A N VAL 412.A O no hydrogen 2.918 N/A TYR 417.A N PHE 413.A O no hydrogen 2.835 N/A ALA 418.A N GLN 414.A O no hydrogen 2.871 N/A ARG 419.A N LYS 415.A O no hydrogen 2.939 N/A MET 420.A N PHE 416.A O no hydrogen 2.939 N/A LEU 421.A N TYR 417.A O no hydrogen 2.801 N/A ALA 422.A N ALA 418.A O no hydrogen 2.907 N/A LYS 423.A N ARG 419.A O no hydrogen 2.974 N/A LYS 423.A NZ GLU 646.A OE1 no hydrogen 2.614 N/A ARG 424.A N MET 420.A O no hydrogen 2.866 N/A ARG 424.A NE GLU 436.A OE2 no hydrogen 2.457 N/A ARG 424.A NH2 GLU 436.A OE1 no hydrogen 2.597 N/A LEU 425.A N LEU 421.A O no hydrogen 2.869 N/A ILE 426.A N ALA 422.A O no hydrogen 2.963 N/A HIS 427.A ND1 LYS 423.A O no hydrogen 2.494 N/A GLY 428.A N LEU 425.A O no hydrogen 3.378 N/A LEU 429.A N ARG 424.A O no hydrogen 2.907 N/A SER 430.A OG GLU 436.A OE2 no hydrogen 2.284 N/A MET 431.A N LEU 381.A O no hydrogen 3.085 N/A SER 432.A OG MET 431.A O no hydrogen 2.621 N/A GLU 436.A N SER 432.A O no hydrogen 3.205 N/A GLU 437.A N MET 433.A O no hydrogen 2.938 N/A ALA 438.A N ASP 434.A O no hydrogen 2.879 N/A MET 439.A N SER 435.A O no hydrogen 2.911 N/A ILE 440.A N GLU 436.A O no hydrogen 2.940 N/A ASN 441.A N GLU 437.A O no hydrogen 2.904 N/A LYS 442.A N ALA 438.A O no hydrogen 2.894 N/A LYS 442.A NZ ALA 438.A O no hydrogen 3.284 N/A LEU 443.A N MET 439.A O no hydrogen 2.960 N/A LYS 444.A N ILE 440.A O no hydrogen 2.870 N/A GLN 445.A N ASN 441.A O no hydrogen 2.897 N/A GLN 445.A NE2 ASN 441.A O no hydrogen 3.152 N/A ALA 446.A N LYS 442.A O no hydrogen 2.921 N/A CYS 447.A N LEU 443.A O no hydrogen 2.924 N/A THR 452.A OG1 TYR 449.A O no hydrogen 3.550 N/A HIS 456.A ND1 HIS 456.A O no hydrogen 3.064 N/A ARG 457.A N SER 453.A O no hydrogen 2.924 N/A ARG 457.A NE GLN 495.A OE1 no hydrogen 2.814 N/A MET 458.A N LYS 454.A O no hydrogen 2.894 N/A TYR 459.A N LEU 455.A O no hydrogen 2.953 N/A THR 460.A N HIS 456.A O no hydrogen 2.887 N/A THR 460.A OG1 HIS 456.A O no hydrogen 2.975 N/A THR 460.A OG1 ARG 457.A O no hydrogen 2.807 N/A ASP 461.A N ARG 457.A O no hydrogen 2.880 N/A MET 462.A N MET 458.A O no hydrogen 2.981 N/A SER 463.A N TYR 459.A O no hydrogen 2.900 N/A SER 463.A N THR 460.A O no hydrogen 3.295 N/A VAL 464.A N THR 460.A O no hydrogen 2.879 N/A SER 465.A N ASP 461.A O no hydrogen 2.914 N/A LEU 468.A N VAL 464.A O no hydrogen 2.919 N/A ASN 469.A N SER 465.A O no hydrogen 2.859 N/A ASN 469.A ND2 ILE 491.A O no hydrogen 2.818 N/A ASN 470.A N ALA 466.A O no hydrogen 2.968 N/A LYS 471.A N ASP 467.A O no hydrogen 2.876 N/A PHE 472.A N LEU 468.A O no hydrogen 2.893 N/A ASN 473.A N ASN 469.A O no hydrogen 2.892 N/A ASN 474.A N ASN 470.A O no hydrogen 2.963 N/A PHE 475.A N LYS 471.A O no hydrogen 2.883 N/A ILE 476.A N PHE 472.A O no hydrogen 2.915 N/A LYS 477.A N ASN 473.A O no hydrogen 2.954 N/A GLN 495.A N ASP 461.A OD2 no hydrogen 2.488 N/A GLN 495.A NE2 ASP 461.A OD1 no hydrogen 2.946 N/A TRP 499.A N GLN 495.A O no hydrogen 3.377 N/A TRP 499.A NE1 ASP 461.A OD2 no hydrogen 2.964 N/A SER 506.A OG THR 508.A OG1 no hydrogen 3.410 N/A SER 507.A OG SER 506.A O no hydrogen 2.766 N/A SER 507.A OG SER 507.A O no hydrogen 2.461 N/A THR 508.A OG1 SER 506.A OG no hydrogen 3.410 N/A PHE 509.A N SER 507.A O no hydrogen 2.682 N/A GLN 513.A N GLN 513.A OE1 no hydrogen 2.888 N/A GLU 514.A N GLU 514.A OE1 no hydrogen 2.882 N/A LEU 515.A N PRO 512.A O no hydrogen 2.860 N/A GLU 516.A N PRO 512.A O no hydrogen 3.136 N/A VAL 519.A N LEU 515.A O no hydrogen 2.963 N/A GLN 520.A N GLU 516.A O no hydrogen 2.933 N/A MET 521.A N LYS 517.A O no hydrogen 2.899 N/A PHE 522.A N SER 518.A O no hydrogen 2.927 N/A GLU 523.A N VAL 519.A O no hydrogen 2.949 N/A LEU 524.A N GLN 520.A O no hydrogen 2.906 N/A PHE 525.A N MET 521.A O no hydrogen 2.866 N/A TYR 526.A N PHE 522.A O no hydrogen 2.993 N/A SER 527.A N GLU 523.A O no hydrogen 2.873 N/A SER 527.A OG GLU 523.A O no hydrogen 2.489 N/A GLN 528.A N PHE 525.A O no hydrogen 3.243 N/A HIS 529.A N PHE 525.A O no hydrogen 2.625 N/A CYS 542.A SG LEU 538.A O no hydrogen 3.484 N/A CYS 542.A SG THR 561.A OG1 no hydrogen 2.673 N/A THR 543.A OG1 GLY 544.A O no hydrogen 3.569 N/A THR 543.A OG1 VAL 559.A O no hydrogen 2.554 N/A GLY 544.A N THR 543.A OG1 no hydrogen 2.606 N/A GLY 544.A N VAL 559.A O no hydrogen 2.882 N/A ASN 549.A N LYS 547.A O no hydrogen 2.941 N/A TYR 550.A OH ASN 571.A O no hydrogen 3.285 N/A VAL 556.A N THR 631.A O no hydrogen 3.109 N/A MET 558.A N PHE 633.A O no hydrogen 2.884 N/A VAL 559.A N GLY 544.A O no hydrogen 2.878 N/A THR 560.A OG1 CYS 542.A O no hydrogen 3.543 N/A THR 561.A OG1 CYS 542.A O no hydrogen 2.656 N/A GLN 563.A NE2 THR 560.A O no hydrogen 3.664 N/A MET 564.A N THR 561.A O no hydrogen 2.920 N/A VAL 566.A N GLN 563.A O no hydrogen 2.926 N/A LEU 567.A N GLN 563.A O no hydrogen 3.354 N/A PHE 570.A N VAL 566.A O no hydrogen 3.166 N/A ASN 571.A N LEU 567.A O no hydrogen 2.951 N/A ASN 571.A N LEU 568.A O no hydrogen 2.923 N/A ASN 572.A N LEU 568.A O no hydrogen 3.226 N/A ASN 572.A N ALA 569.A O no hydrogen 2.914 N/A SER 573.A N ALA 569.A O no hydrogen 2.948 N/A SER 573.A OG THR 575.A O no hydrogen 3.159 N/A VAL 576.A N PHE 620.A O no hydrogen 3.141 N/A SER 577.A OG GLU 617.A OE2 no hydrogen 2.325 N/A TYR 578.A N GLU 617.A O no hydrogen 3.360 N/A LEU 581.A N TYR 578.A O no hydrogen 3.226 N/A GLN 582.A N TYR 578.A O no hydrogen 2.771 N/A GLN 582.A NE2 MET 587.A O no hydrogen 3.223 N/A SER 584.A N LEU 581.A O no hydrogen 3.310 N/A SER 584.A OG LEU 581.A O no hydrogen 3.087 N/A THR 585.A OG1 LEU 581.A O no hydrogen 2.888 N/A LEU 592.A N ASN 588.A O no hydrogen 3.509 N/A THR 593.A N GLU 589.A O no hydrogen 2.890 N/A THR 593.A OG1 GLU 589.A O no hydrogen 2.719 N/A LYS 594.A N LYS 590.A O no hydrogen 2.915 N/A THR 595.A N GLU 591.A O no hydrogen 2.940 N/A THR 595.A OG1 GLU 591.A O no hydrogen 2.804 N/A THR 595.A OG1 LEU 592.A O no hydrogen 2.724 N/A ILE 596.A N LEU 592.A O no hydrogen 2.911 N/A LYS 597.A N THR 593.A O no hydrogen 2.898 N/A SER 598.A N LYS 594.A O no hydrogen 2.907 N/A SER 598.A OG LYS 594.A O no hydrogen 3.493 N/A SER 598.A OG THR 595.A O no hydrogen 2.389 N/A LEU 599.A N ILE 596.A O no hydrogen 2.946 N/A LEU 600.A N ILE 596.A O no hydrogen 2.901 N/A VAL 602.A N ASP 601.A OD1 no hydrogen 2.789 N/A LYS 603.A N LEU 600.A O no hydrogen 3.172 N/A ASN 606.A N SER 621.A O no hydrogen 2.917 N/A HIS 607.A NE2 SER 618.A OG no hydrogen 2.858 N/A ASP 608.A N SER 619.A O no hydrogen 3.047 N/A SER 609.A OG HIS 607.A ND1 no hydrogen 3.058 N/A SER 609.A OG LYS 611.A O no hydrogen 3.563 N/A LYS 611.A NZ SER 609.A OG no hydrogen 3.387 N/A ILE 614.A N ASP 613.A OD1 no hydrogen 2.989 N/A SER 618.A N ASP 615.A OD2 no hydrogen 2.590 N/A SER 618.A OG HIS 607.A NE2 no hydrogen 2.858 N/A SER 619.A OG ASP 608.A OD2 no hydrogen 3.447 N/A PHE 620.A N VAL 576.A O no hydrogen 2.734 N/A SER 621.A N ASN 606.A O no hydrogen 2.895 N/A SER 621.A OG ASN 606.A O no hydrogen 3.209 N/A LEU 622.A N GLU 574.A OE2 no hydrogen 2.516 N/A ASN 623.A N MET 604.A O no hydrogen 3.244 N/A ASN 623.A ND2 LYS 603.A O no hydrogen 2.625 N/A SER 627.A OG SER 628.A O no hydrogen 3.499 N/A SER 628.A OG ARG 630.A O no hydrogen 2.911 N/A LYS 629.A NZ LYS 629.A O no hydrogen 2.917 N/A PHE 633.A N VAL 556.A O no hydrogen 2.898 N/A LYS 634.A NZ THR 636.A O no hydrogen 2.866 N/A MET 639.A N THR 636.A O no hydrogen 2.674 N/A GLN 640.A NE2 THR 637.A O no hydrogen 2.644 N/A LYS 641.A NZ ASP 642.A O no hydrogen 2.762 N/A THR 650.A N GLU 646.A O no hydrogen 2.924 N/A THR 650.A OG1 GLU 646.A O no hydrogen 3.027 N/A THR 650.A OG1 MET 647.A O no hydrogen 2.747 N/A ARG 651.A N MET 647.A O no hydrogen 2.867 N/A SER 652.A N GLU 648.A O no hydrogen 2.921 N/A SER 652.A OG GLN 649.A O no hydrogen 2.828 N/A ALA 653.A N GLN 649.A O no hydrogen 2.895 N/A VAL 654.A N THR 650.A O no hydrogen 2.894 N/A ASP 655.A N ARG 651.A O no hydrogen 2.915 N/A GLU 656.A N SER 652.A O no hydrogen 2.910 N/A ASP 657.A N ALA 653.A O no hydrogen 2.900 N/A ARG 658.A N VAL 654.A O no hydrogen 2.900 N/A ARG 658.A NH2 ASP 409.A OD1 no hydrogen 2.703 N/A LYS 659.A N ASP 655.A O no hydrogen 2.896 N/A MET 660.A N GLU 656.A O no hydrogen 2.923 N/A TYR 661.A N ASP 657.A O no hydrogen 2.916 N/A LEU 662.A N ARG 658.A O no hydrogen 2.883 N/A GLN 663.A N LYS 659.A O no hydrogen 2.895 N/A GLN 663.A NE2 CYS 703.A O no hydrogen 2.753 N/A ALA 664.A N MET 660.A O no hydrogen 2.929 N/A ALA 665.A N TYR 661.A O no hydrogen 2.923 N/A ILE 666.A N LEU 662.A O no hydrogen 2.896 N/A VAL 667.A N GLN 663.A O no hydrogen 2.928 N/A ARG 668.A N ALA 664.A O no hydrogen 2.935 N/A ILE 669.A N ALA 665.A O no hydrogen 2.904 N/A MET 670.A N ILE 666.A O no hydrogen 2.882 N/A LYS 671.A N VAL 667.A O no hydrogen 2.903 N/A LYS 671.A NZ TYR 725.A OH no hydrogen 3.299 N/A ALA 672.A N ARG 668.A O no hydrogen 2.933 N/A ARG 673.A N ILE 669.A O no hydrogen 2.886 N/A LYS 674.A N MET 670.A O no hydrogen 3.095 N/A LYS 674.A NZ LYS 671.A O no hydrogen 2.429 N/A HIS 678.A N ASP 721.A OD1 no hydrogen 2.675 N/A ALA 680.A N ARG 677.A O no hydrogen 3.133 N/A LEU 681.A N ARG 677.A O no hydrogen 2.713 N/A GLU 684.A N ALA 680.A O no hydrogen 2.905 N/A VAL 685.A N LEU 681.A O no hydrogen 2.907 N/A ILE 686.A N ILE 682.A O no hydrogen 2.920 N/A SER 687.A N GLN 683.A O no hydrogen 2.921 N/A SER 687.A OG GLU 684.A O no hydrogen 2.251 N/A GLN 688.A N VAL 685.A O no hydrogen 3.213 N/A SER 689.A N VAL 685.A O no hydrogen 2.939 N/A SER 689.A OG VAL 685.A O no hydrogen 2.826 N/A ARG 690.A N ILE 686.A O no hydrogen 2.895 N/A ARG 692.A NE ALA 691.A O no hydrogen 3.146 N/A PHE 693.A N SER 689.A O no hydrogen 3.479 N/A ILE 700.A N SER 696.A O no hydrogen 2.991 N/A LYS 701.A N ILE 697.A O no hydrogen 2.913 N/A LYS 701.A NZ HIS 678.A NE2 no hydrogen 3.548 N/A LYS 702.A N SER 698.A O no hydrogen 2.894 N/A CYS 703.A N MET 699.A O no hydrogen 2.907 N/A CYS 703.A SG MET 699.A O no hydrogen 3.256 N/A ILE 704.A N ILE 700.A O no hydrogen 2.915 N/A GLU 705.A N LYS 701.A O no hydrogen 2.983 N/A GLU 705.A N GLU 705.A OE1 no hydrogen 3.208 N/A VAL 706.A N LYS 702.A O no hydrogen 2.897 N/A LEU 707.A N CYS 703.A O no hydrogen 2.923 N/A ILE 708.A N ILE 704.A O no hydrogen 2.871 N/A ASP 709.A N GLU 705.A O no hydrogen 2.924 N/A LYS 710.A N LEU 707.A O no hydrogen 3.209 N/A GLN 711.A N ILE 708.A O no hydrogen 3.097 N/A TYR 712.A N LEU 707.A O no hydrogen 3.265 N/A GLU 714.A N SER 724.A O no hydrogen 3.410 N/A ARG 715.A NH1 TYR 723.A OH no hydrogen 3.423 N/A ARG 715.A NH2 TYR 723.A OH no hydrogen 3.346 N/A SER 716.A N GLU 722.A O no hydrogen 2.929 N/A SER 716.A OG GLU 722.A O no hydrogen 3.079 N/A SER 724.A N GLU 714.A O no hydrogen 2.932 N/A SER 724.A OG GLU 714.A O no hydrogen 3.445 N/A SER 724.A OG GLU 714.A OE2 no hydrogen 2.930 N/A