Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jaq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 8.A OH ASP 36.A OD2 no hydrogen 2.368 N/A THR 10.A N THR 6.A O no hydrogen 2.785 N/A THR 10.A OG1 THR 6.A O no hydrogen 2.913 N/A ALA 11.A N LEU 7.A O no hydrogen 2.889 N/A ILE 12.A N TYR 8.A O no hydrogen 2.891 N/A SER 13.A N ASN 9.A O no hydrogen 2.907 N/A SER 13.A OG ASN 9.A O no hydrogen 2.910 N/A ALA 14.A N THR 10.A O no hydrogen 2.902 N/A VAL 15.A N ALA 11.A O no hydrogen 2.668 N/A VAL 16.A N ILE 12.A O no hydrogen 2.906 N/A ASP 17.A N SER 13.A O no hydrogen 3.091 N/A ASN 18.A N ALA 14.A O no hydrogen 2.998 N/A ARG 21.A NE ASN 18.A OD1 no hydrogen 2.650 N/A SER 22.A N TYR 19.A O no hydrogen 3.015 N/A SER 22.A OG ASN 18.A O no hydrogen 2.966 N/A ARG 27.A N ARG 24.A O no hydrogen 3.307 N/A ARG 27.A NE GLU 53.A OE1 no hydrogen 3.023 N/A ARG 27.A NH2 GLU 53.A OE1 no hydrogen 2.982 N/A ARG 27.A NH2 GLU 53.A OE2 no hydrogen 2.809 N/A ARG 27.A NH2 GLU 56.A OE2 no hydrogen 3.313 N/A SER 28.A N ASP 25.A O no hydrogen 3.236 N/A SER 28.A OG ASP 25.A O no hydrogen 2.884 N/A SER 28.A OG ASP 25.A OD1 no hydrogen 3.021 N/A LEU 29.A N ILE 26.A O no hydrogen 2.854 N/A GLN 34.A N PRO 30.A O no hydrogen 2.944 N/A GLN 34.A NE2 LEU 29.A O no hydrogen 3.012 N/A VAL 37.A N ILE 33.A O no hydrogen 2.904 N/A TYR 38.A N GLN 34.A O no hydrogen 2.956 N/A TYR 39.A N PHE 35.A O no hydrogen 2.809 N/A LYS 40.A N ASP 36.A O no hydrogen 2.907 N/A LYS 40.A NZ GLN 44.A OE1 no hydrogen 3.205 N/A LEU 41.A N VAL 37.A O no hydrogen 2.919 N/A TYR 42.A N TYR 38.A O no hydrogen 2.946 N/A GLN 43.A N TYR 39.A O no hydrogen 2.843 N/A GLN 44.A N LYS 40.A O no hydrogen 2.925 N/A GLY 45.A N TYR 42.A O no hydrogen 3.174 N/A ARG 46.A NH1 VAL 16.A O no hydrogen 2.547 N/A CYS 48.A SG HIS 83.A NE2 no hydrogen 3.156 N/A LEU 50.A N ARG 46.A O no hydrogen 3.214 N/A LEU 50.A N LEU 47.A O no hydrogen 3.287 N/A GLY 51.A N LEU 47.A O no hydrogen 2.886 N/A SER 52.A OG CYS 48.A O no hydrogen 3.299 N/A GLU 53.A N LEU 50.A O no hydrogen 3.025 N/A PHE 54.A N LEU 50.A O no hydrogen 2.911 N/A CYS 55.A N GLY 51.A O no hydrogen 3.026 N/A CYS 55.A SG GLY 51.A O no hydrogen 3.104 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.799 N/A PHE 60.A N GLU 56.A O no hydrogen 2.793 N/A ALA 61.A N LEU 57.A O no hydrogen 2.849 N/A LYS 62.A N VAL 59.A O no hydrogen 3.178 N/A LYS 62.A NZ LEU 29.A O no hydrogen 3.500 N/A VAL 63.A N VAL 59.A O no hydrogen 3.206 N/A LEU 64.A N PHE 60.A O no hydrogen 3.175 N/A LYS 69.A NZ ASN 32.A OD1 no hydrogen 3.363 N/A ARG 70.A NH2 LEU 64.A O no hydrogen 3.416 N/A HIS 74.A N ARG 70.A O no hydrogen 2.915 N/A HIS 75.A N LEU 72.A O no hydrogen 2.935 N/A CYS 76.A N LEU 72.A O no hydrogen 2.753 N/A CYS 76.A N LEU 73.A O no hydrogen 2.953 N/A CYS 76.A SG LEU 72.A O no hydrogen 3.240 N/A PHE 77.A N LEU 73.A O no hydrogen 2.715 N/A GLN 78.A N HIS 74.A O no hydrogen 3.347 N/A LEU 80.A N CYS 76.A O no hydrogen 2.943 N/A LEU 80.A N PHE 77.A O no hydrogen 2.959 N/A MET 81.A N PHE 77.A O no hydrogen 2.952 N/A ASP 82.A N GLN 78.A O no hydrogen 2.799 N/A VAL 85.A N LEU 80.A O no hydrogen 3.087 N/A VAL 87.A N VAL 85.A O no hydrogen 2.721 N/A SER 89.A OG ASP 132.A OD1 no hydrogen 3.374 N/A VAL 90.A N LYS 86.A O no hydrogen 3.018 N/A LEU 91.A N VAL 87.A O no hydrogen 2.894 N/A ALA 92.A N ALA 88.A O no hydrogen 2.916 N/A TYR 93.A N SER 89.A O no hydrogen 2.907 N/A SER 94.A N VAL 90.A O no hydrogen 2.867 N/A SER 94.A OG VAL 90.A O no hydrogen 3.076 N/A PHE 95.A N LEU 91.A O no hydrogen 2.921 N/A SER 96.A N ALA 92.A O no hydrogen 2.898 N/A SER 96.A OG ALA 92.A O no hydrogen 3.070 N/A SER 96.A OG SER 139.A OG no hydrogen 3.120 N/A ARG 97.A N TYR 93.A O no hydrogen 2.926 N/A ARG 98.A N SER 94.A O no hydrogen 2.906 N/A CYS 99.A N PHE 95.A O no hydrogen 2.885 N/A CYS 99.A SG PHE 95.A O no hydrogen 3.516 N/A CYS 99.A SG SER 96.A O no hydrogen 3.036 N/A CYS 99.A SG SER 139.A O no hydrogen 4.032 N/A SER 100.A N SER 96.A O no hydrogen 2.945 N/A SER 100.A OG SER 96.A O no hydrogen 3.181 N/A SER 100.A OG ARG 97.A O no hydrogen 2.781 N/A TYR 101.A N ARG 97.A O no hydrogen 2.956 N/A ILE 102.A N ARG 98.A O no hydrogen 2.913 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.628 N/A SER 105.A N ILE 102.A O no hydrogen 3.406 N/A LYS 110.A N ASP 106.A O no hydrogen 2.844 N/A LYS 110.A NZ ALA 103.A O no hydrogen 2.937 N/A LYS 110.A NZ LEU 143.A O no hydrogen 3.267 N/A LYS 110.A NZ HIS 147.A ND1 no hydrogen 3.253 N/A GLU 111.A N ALA 107.A O no hydrogen 2.712 N/A LYS 112.A N ALA 108.A O no hydrogen 3.160 N/A ALA 113.A N VAL 109.A O no hydrogen 2.926 N/A ILE 114.A N GLU 111.A O no hydrogen 3.201 N/A GLN 115.A N GLU 111.A O no hydrogen 3.095 N/A VAL 116.A N LYS 112.A O no hydrogen 3.148 N/A GLY 117.A N ALA 113.A O no hydrogen 3.323 N/A PHE 118.A N ILE 114.A O no hydrogen 2.630 N/A VAL 119.A N GLN 115.A O no hydrogen 3.155 N/A LEU 120.A N VAL 116.A O no hydrogen 3.134 N/A GLY 121.A N GLY 117.A O no hydrogen 2.888 N/A GLY 122.A N PHE 118.A O no hydrogen 2.848 N/A PHE 123.A N VAL 119.A O no hydrogen 2.899 N/A LEU 124.A N LEU 120.A O no hydrogen 2.934 N/A SER 125.A N GLY 121.A O no hydrogen 2.888 N/A SER 125.A OG GLY 122.A O no hydrogen 3.035 N/A SER 125.A OG ASP 126.A OD1 no hydrogen 3.466 N/A ASP 126.A N GLY 122.A O no hydrogen 2.879 N/A ALA 127.A N PHE 123.A O no hydrogen 2.742 N/A GLY 128.A N SER 125.A O no hydrogen 3.321 N/A TRP 129.A N LEU 124.A O no hydrogen 2.836 N/A TYR 130.A OH HIS 322.A NE2 no hydrogen 3.094 N/A ALA 133.A N TRP 129.A O no hydrogen 2.869 N/A GLU 134.A N SER 131.A O no hydrogen 3.264 N/A LYS 135.A NZ TYR 93.A OH no hydrogen 3.555 N/A PHE 137.A N ALA 133.A O no hydrogen 3.089 N/A LEU 138.A N GLU 134.A O no hydrogen 2.887 N/A SER 139.A N LYS 135.A O no hydrogen 2.890 N/A SER 139.A OG SER 96.A OG no hydrogen 3.120 N/A SER 139.A OG LYS 135.A O no hydrogen 2.703 N/A CYS 140.A N VAL 136.A O no hydrogen 2.925 N/A LEU 141.A N PHE 137.A O no hydrogen 2.835 N/A GLN 142.A N LEU 138.A O no hydrogen 2.960 N/A LEU 143.A N SER 139.A O no hydrogen 3.343 N/A CYS 144.A N CYS 140.A O no hydrogen 2.969 N/A CYS 144.A SG CYS 140.A O no hydrogen 3.069 N/A CYS 144.A SG LEU 141.A O no hydrogen 3.350 N/A THR 145.A N LEU 141.A O no hydrogen 2.889 N/A THR 145.A N GLN 142.A O no hydrogen 3.284 N/A THR 145.A OG1 TYR 186.A OH no hydrogen 2.441 N/A LEU 146.A N GLN 142.A O no hydrogen 2.973 N/A GLU 149.A N GLU 149.A OE1 no hydrogen 2.693 N/A HIS 152.A N GLU 149.A O no hydrogen 3.323 N/A ARG 155.A NE GLU 111.A OE2 no hydrogen 2.457 N/A ARG 155.A NE GLN 115.A OE1 no hydrogen 3.049 N/A ALA 156.A N HIS 152.A O no hydrogen 2.893 N/A VAL 157.A N TRP 153.A O no hydrogen 2.962 N/A GLU 158.A N PHE 154.A O no hydrogen 2.895 N/A CYS 159.A N ARG 155.A O no hydrogen 2.882 N/A CYS 159.A SG PHE 137.A O no hydrogen 3.161 N/A CYS 160.A N ALA 156.A O no hydrogen 2.892 N/A CYS 160.A SG ALA 156.A O no hydrogen 3.108 N/A VAL 161.A N VAL 157.A O no hydrogen 2.930 N/A ARG 162.A N GLU 158.A O no hydrogen 2.938 N/A LEU 163.A N CYS 159.A O no hydrogen 2.859 N/A LEU 164.A N CYS 160.A O no hydrogen 2.973 N/A HIS 165.A N ARG 162.A O no hydrogen 3.262 N/A VAL 166.A N ARG 162.A O no hydrogen 3.456 N/A ARG 167.A N LEU 164.A O no hydrogen 3.354 N/A ARG 167.A NE GLU 134.A OE2 no hydrogen 2.770 N/A ASN 168.A N LEU 164.A O no hydrogen 3.153 N/A GLY 169.A N HIS 165.A O no hydrogen 3.180 N/A ASN 170.A ND2 GLU 134.A OE1 no hydrogen 3.468 N/A CYS 171.A N ASN 168.A O no hydrogen 3.162 N/A CYS 171.A SG TYR 173.A OH no hydrogen 3.147 N/A LYS 172.A N ARG 167.A O no hydrogen 2.843 N/A LYS 172.A NZ GLU 134.A OE1 no hydrogen 2.666 N/A LYS 172.A NZ GLU 134.A OE2 no hydrogen 3.178 N/A TYR 173.A OH ASN 168.A O no hydrogen 3.309 N/A LEU 175.A N LYS 172.A O no hydrogen 3.372 N/A GLY 176.A N TYR 173.A O no hydrogen 2.916 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.774 N/A THR 179.A N LEU 175.A O no hydrogen 2.930 N/A THR 179.A OG1 LEU 175.A O no hydrogen 2.746 N/A PHE 180.A N GLY 176.A O no hydrogen 2.896 N/A LYS 181.A N GLU 177.A O no hydrogen 2.866 N/A LEU 182.A N GLU 178.A O no hydrogen 2.954 N/A ALA 183.A N THR 179.A O no hydrogen 2.920 N/A GLN 184.A N PHE 180.A O no hydrogen 2.776 N/A THR 185.A N LYS 181.A O no hydrogen 2.924 N/A THR 185.A OG1 LYS 181.A O no hydrogen 3.553 N/A THR 185.A OG1 LEU 182.A O no hydrogen 2.489 N/A TYR 186.A N LEU 182.A O no hydrogen 3.008 N/A MET 187.A N ALA 183.A O no hydrogen 2.886 N/A ASP 188.A N GLN 184.A O no hydrogen 2.852 N/A LYS 189.A N THR 185.A O no hydrogen 2.956 N/A LYS 189.A NZ THR 185.A O no hydrogen 2.887 N/A LEU 190.A N TYR 186.A O no hydrogen 2.907 N/A SER 191.A N MET 187.A O no hydrogen 2.934 N/A HIS 193.A N LEU 190.A O no hydrogen 3.242 N/A HIS 193.A ND1 LYS 189.A O no hydrogen 2.880 N/A ASN 198.A ND2 GLU 229.A O no hydrogen 2.700 N/A ALA 200.A N ASN 198.A OD1 no hydrogen 3.240 N/A TYR 203.A N LYS 199.A O no hydrogen 2.851 N/A GLY 204.A N ALA 200.A O no hydrogen 2.907 N/A GLU 205.A N LEU 202.A O no hydrogen 3.149 N/A LEU 206.A N LEU 202.A O no hydrogen 3.435 N/A CYS 207.A N TYR 203.A O no hydrogen 2.944 N/A CYS 207.A SG TYR 203.A O no hydrogen 3.098 N/A ALA 208.A N GLU 205.A O no hydrogen 3.170 N/A LEU 209.A N GLU 205.A O no hydrogen 2.888 N/A LEU 210.A N LEU 206.A O no hydrogen 2.892 N/A ALA 212.A N ALA 208.A O no hydrogen 2.902 N/A LYS 213.A N LEU 209.A O no hydrogen 3.000 N/A SER 214.A N PHE 211.A O no hydrogen 3.011 N/A SER 214.A OG LYS 213.A O no hydrogen 2.466 N/A SER 214.A OG ASN 419.A OD1 no hydrogen 2.180 N/A HIS 215.A N LEU 210.A O no hydrogen 2.682 N/A ALA 219.A N HIS 215.A O no hydrogen 2.783 N/A TYR 220.A N TYR 216.A O no hydrogen 2.911 N/A LYS 221.A N ASP 217.A O no hydrogen 3.435 N/A TRP 222.A N GLU 218.A O no hydrogen 2.938 N/A CYS 223.A N ALA 219.A O no hydrogen 2.896 N/A CYS 223.A SG ALA 219.A O no hydrogen 3.661 N/A CYS 223.A SG TYR 220.A O no hydrogen 3.021 N/A ILE 224.A N TYR 220.A O no hydrogen 3.009 N/A ALA 226.A N TRP 222.A O no hydrogen 2.896 N/A MET 227.A N CYS 223.A O no hydrogen 2.907 N/A LYS 228.A N ILE 224.A O no hydrogen 2.918 N/A GLU 229.A N GLU 225.A O no hydrogen 2.924 N/A GLU 229.A N ALA 226.A O no hydrogen 3.202 N/A VAL 239.A N PRO 235.A O no hydrogen 3.121 N/A VAL 240.A N VAL 236.A O no hydrogen 2.869 N/A ASP 241.A N LYS 237.A O no hydrogen 2.967 N/A VAL 242.A N VAL 238.A O no hydrogen 2.884 N/A LEU 243.A N VAL 239.A O no hydrogen 2.912 N/A ARG 244.A N VAL 240.A O no hydrogen 2.885 N/A ARG 244.A NH1 ASP 287.A OD2 no hydrogen 2.285 N/A GLN 245.A N ASP 241.A O no hydrogen 2.946 N/A ALA 246.A N VAL 242.A O no hydrogen 2.867 N/A SER 247.A N LEU 243.A O no hydrogen 2.895 N/A SER 247.A OG LEU 243.A O no hydrogen 3.002 N/A SER 247.A OG ALA 259.A O no hydrogen 3.399 N/A LYS 248.A N ARG 244.A O no hydrogen 2.980 N/A LYS 248.A NZ ASP 287.A OD1 no hydrogen 2.578 N/A ALA 249.A N GLN 245.A O no hydrogen 2.905 N/A CYS 250.A N ALA 246.A O no hydrogen 2.866 N/A CYS 250.A SG ALA 246.A O no hydrogen 3.174 N/A VAL 251.A N SER 247.A O no hydrogen 2.955 N/A ARG 254.A N VAL 251.A O no hydrogen 2.872 N/A ARG 254.A NH1 VAL 252.A O no hydrogen 2.651 N/A GLU 255.A N CYS 250.A O no hydrogen 3.152 N/A LYS 258.A N GLU 255.A O no hydrogen 3.180 N/A LYS 258.A NZ GLU 255.A OE1 no hydrogen 2.659 N/A ALA 259.A N GLU 255.A O no hydrogen 3.239 N/A GLU 260.A N PHE 256.A O no hydrogen 3.301 N/A LEU 262.A N LYS 258.A O no hydrogen 2.948 N/A ILE 263.A N ALA 259.A O no hydrogen 2.899 N/A LYS 264.A N GLU 260.A O no hydrogen 2.895 N/A HIS 265.A NE2 THR 561.A OG1 no hydrogen 3.177 N/A ALA 266.A N LEU 262.A O no hydrogen 2.903 N/A VAL 267.A N ILE 263.A O no hydrogen 2.874 N/A TYR 268.A N LYS 264.A O no hydrogen 2.929 N/A LEU 269.A N HIS 265.A O no hydrogen 2.859 N/A ALA 270.A N ALA 266.A O no hydrogen 2.911 N/A ARG 271.A N VAL 267.A O no hydrogen 2.920 N/A ARG 271.A NH2 SER 555.A O no hydrogen 2.628 N/A ASP 272.A N TYR 268.A O no hydrogen 2.860 N/A HIS 273.A N LEU 269.A O no hydrogen 2.968 N/A PHE 274.A N ALA 270.A O no hydrogen 3.043 N/A GLY 275.A N ALA 270.A O no hydrogen 3.321 N/A LYS 277.A NZ ASP 310.A O no hydrogen 3.389 N/A LYS 280.A N HIS 278.A ND1 no hydrogen 3.083 N/A LYS 280.A NZ ASP 241.A OD1 no hydrogen 2.479 N/A SER 282.A N HIS 278.A O no hydrogen 2.890 N/A SER 282.A OG PRO 279.A O no hydrogen 2.301 N/A ASP 283.A N PRO 279.A O no hydrogen 2.911 N/A THR 284.A N LYS 280.A O no hydrogen 2.928 N/A THR 284.A OG1 LYS 280.A O no hydrogen 3.022 N/A LEU 285.A N TYR 281.A O no hydrogen 2.890 N/A LEU 286.A N SER 282.A O no hydrogen 2.859 N/A ASP 287.A N ASP 283.A O no hydrogen 3.014 N/A TYR 288.A N THR 284.A O no hydrogen 2.877 N/A GLY 289.A N LEU 285.A O no hydrogen 2.839 N/A PHE 290.A N LEU 286.A O no hydrogen 2.962 N/A TYR 291.A N ASP 287.A O no hydrogen 2.930 N/A TYR 291.A OH PHE 256.A O no hydrogen 3.149 N/A LEU 292.A N TYR 288.A O no hydrogen 2.903 N/A LEU 293.A N GLY 289.A O no hydrogen 2.860 N/A ASN 294.A N PHE 290.A O no hydrogen 2.990 N/A ASN 294.A N TYR 291.A O no hydrogen 2.926 N/A ASN 297.A ND2 GLN 300.A OE1 no hydrogen 2.372 N/A CYS 299.A SG HIS 337.A NE2 no hydrogen 3.300 N/A GLN 300.A NE2 SER 546.A O no hydrogen 3.168 N/A GLN 300.A NE2 THR 548.A O no hydrogen 2.326 N/A SER 301.A N ILE 298.A O no hydrogen 2.892 N/A SER 301.A OG GLY 289.A O no hydrogen 2.874 N/A SER 301.A OG SER 333.A OG no hydrogen 3.382 N/A VAL 302.A N ILE 298.A O no hydrogen 3.043 N/A ILE 304.A N SER 301.A O no hydrogen 3.177 N/A TYR 305.A N SER 301.A O no hydrogen 3.182 N/A GLN 306.A N VAL 302.A O no hydrogen 3.206 N/A GLN 306.A NE2 ASP 310.A OD2 no hydrogen 3.461 N/A ALA 308.A N ILE 304.A O no hydrogen 2.660 N/A LEU 309.A N TYR 305.A O no hydrogen 2.690 N/A ASP 310.A N GLN 306.A O no hydrogen 3.213 N/A ARG 312.A N ALA 308.A O no hydrogen 3.396 N/A ARG 312.A NE SER 282.A OG no hydrogen 3.396 N/A ARG 312.A NH1 HIS 322.A O no hydrogen 2.877 N/A ARG 312.A NH2 ASP 283.A OD1 no hydrogen 2.227 N/A GLN 313.A N LEU 309.A O no hydrogen 2.546 N/A SER 314.A OG ASP 310.A O no hydrogen 3.336 N/A SER 314.A OG ILE 311.A O no hydrogen 3.469 N/A VAL 315.A N ILE 311.A O no hydrogen 3.132 N/A PHE 316.A N ARG 312.A O no hydrogen 2.829 N/A LYS 319.A N ASP 82.A OD2 no hydrogen 3.514 N/A LYS 319.A NZ GLY 356.A O no hydrogen 3.038 N/A ASN 320.A ND2 ALA 127.A O no hydrogen 2.516 N/A HIS 322.A NE2 TYR 130.A OH no hydrogen 3.094 N/A ALA 324.A N ASN 320.A O no hydrogen 2.762 N/A THR 325.A N ILE 321.A O no hydrogen 2.706 N/A THR 325.A OG1 ILE 321.A O no hydrogen 3.228 N/A THR 325.A OG1 HIS 322.A O no hydrogen 3.004 N/A ALA 326.A N HIS 322.A O no hydrogen 3.163 N/A HIS 327.A N VAL 323.A O no hydrogen 2.934 N/A GLU 328.A N ALA 324.A O no hydrogen 2.908 N/A ASP 329.A N THR 325.A O no hydrogen 2.898 N/A LEU 330.A N ALA 326.A O no hydrogen 2.905 N/A ALA 331.A N HIS 327.A O no hydrogen 2.570 N/A TYR 332.A N ASP 329.A O no hydrogen 3.083 N/A SER 333.A N ASP 329.A O no hydrogen 3.039 N/A SER 333.A OG SER 301.A OG no hydrogen 3.382 N/A SER 334.A N LEU 330.A O no hydrogen 2.899 N/A TYR 335.A OH GLU 382.A OE2 no hydrogen 3.320 N/A VAL 336.A N TYR 332.A O no hydrogen 2.928 N/A HIS 337.A N SER 333.A O no hydrogen 2.656 N/A HIS 337.A ND1 GLN 338.A OE1 no hydrogen 2.321 N/A GLN 338.A N SER 334.A O no hydrogen 3.105 N/A TYR 339.A N VAL 336.A O no hydrogen 3.195 N/A GLY 342.A N GLN 338.A O no hydrogen 2.742 N/A PHE 349.A N ASP 345.A O no hydrogen 3.180 N/A HIS 350.A N ASN 346.A O no hydrogen 3.154 N/A ALA 351.A N LEU 348.A O no hydrogen 3.021 N/A GLU 352.A N LEU 348.A O no hydrogen 2.735 N/A ARG 353.A N PHE 349.A O no hydrogen 3.082 N/A ILE 355.A N ALA 351.A O no hydrogen 3.385 N/A GLY 356.A N GLU 352.A O no hydrogen 2.955 N/A ILE 357.A N ARG 353.A O no hydrogen 2.914 N/A ILE 357.A N ALA 354.A O no hydrogen 3.246 N/A ILE 358.A N ALA 354.A O no hydrogen 2.928 N/A THR 359.A N ILE 355.A O no hydrogen 2.896 N/A THR 359.A OG1 ILE 355.A O no hydrogen 2.505 N/A HIS 360.A N ILE 357.A O no hydrogen 3.201 N/A ILE 361.A N ILE 357.A O no hydrogen 3.067 N/A LEU 362.A N ILE 358.A O no hydrogen 2.823 N/A HIS 366.A NE2 ASN 170.A OD1 no hydrogen 3.211 N/A LEU 368.A N HIS 366.A ND1 no hydrogen 3.069 N/A LEU 369.A N HIS 366.A O no hydrogen 3.050 N/A ALA 370.A N LEU 367.A O no hydrogen 2.962 N/A SER 371.A OG GLU 328.A OE1 no hydrogen 3.377 N/A SER 371.A OG GLU 328.A OE2 no hydrogen 3.426 N/A SER 371.A OG LEU 368.A O no hydrogen 3.314 N/A SER 372.A OG LEU 368.A O no hydrogen 3.487 N/A SER 372.A OG LEU 369.A O no hydrogen 3.308 N/A LYS 373.A N LEU 369.A O no hydrogen 2.961 N/A ARG 374.A N ALA 370.A O no hydrogen 3.268 N/A VAL 375.A N SER 371.A O no hydrogen 3.333 N/A LYS 376.A N SER 372.A O no hydrogen 3.435 N/A LEU 378.A N ARG 374.A O no hydrogen 2.912 N/A ILE 379.A N VAL 375.A O no hydrogen 2.997 N/A LEU 380.A N LYS 376.A O no hydrogen 2.879 N/A GLU 381.A N ALA 377.A O no hydrogen 3.001 N/A GLU 381.A N LEU 378.A O no hydrogen 3.114 N/A GLU 382.A N LEU 378.A O no hydrogen 3.419 N/A ILE 383.A N ILE 379.A O no hydrogen 3.138 N/A ALA 384.A N LEU 380.A O no hydrogen 3.369 N/A ILE 385.A N GLU 381.A O no hydrogen 2.977 N/A ASP 386.A N GLU 382.A O no hydrogen 3.259 N/A CYS 387.A N ALA 384.A O no hydrogen 3.045 N/A CYS 387.A SG ASN 389.A O no hydrogen 3.660 N/A GLU 391.A N ASN 389.A OD1 no hydrogen 3.276 N/A GLN 394.A N LYS 390.A O no hydrogen 2.932 N/A ARG 395.A N GLU 391.A O no hydrogen 3.452 N/A LEU 396.A N THR 392.A O no hydrogen 2.947 N/A LEU 397.A N GLU 393.A O no hydrogen 2.846 N/A GLN 398.A N GLN 394.A O no hydrogen 2.951 N/A GLU 399.A N ARG 395.A O no hydrogen 2.910 N/A ALA 400.A N LEU 396.A O no hydrogen 2.912 N/A HIS 401.A N LEU 397.A O no hydrogen 2.863 N/A HIS 401.A NE2 TYR 433.A OH no hydrogen 2.320 N/A ASP 402.A N GLN 398.A O no hydrogen 2.953 N/A LEU 403.A N GLU 399.A O no hydrogen 2.917 N/A HIS 404.A N ALA 400.A O no hydrogen 2.889 N/A HIS 404.A ND1 ALA 400.A O no hydrogen 2.481 N/A LEU 405.A N HIS 401.A O no hydrogen 2.928 N/A SER 406.A N ASP 402.A O no hydrogen 2.939 N/A SER 406.A OG ASP 402.A O no hydrogen 3.024 N/A SER 407.A N LEU 403.A O no hydrogen 2.904 N/A SER 407.A OG HIS 404.A O no hydrogen 3.114 N/A LEU 408.A N HIS 404.A O no hydrogen 2.850 N/A GLN 409.A N LEU 405.A O no hydrogen 2.897 N/A LEU 410.A N SER 406.A O no hydrogen 2.956 N/A ALA 411.A N SER 407.A O no hydrogen 2.897 N/A LYS 412.A N LEU 408.A O no hydrogen 2.863 N/A LYS 413.A N GLN 409.A O no hydrogen 2.914 N/A ALA 414.A N LEU 410.A O no hydrogen 2.917 N/A PHE 415.A N ALA 411.A O no hydrogen 2.894 N/A ASN 419.A N THR 422.A OG1 no hydrogen 2.872 N/A VAL 420.A N ASN 419.A OD1 no hydrogen 2.787 N/A THR 422.A OG1 GLU 417.A O no hydrogen 3.513 N/A THR 422.A OG1 ASN 419.A O no hydrogen 2.498 N/A ALA 423.A N ASN 419.A O no hydrogen 2.756 N/A LYS 424.A N VAL 420.A O no hydrogen 2.879 N/A LYS 424.A NZ GLU 463.A OE1 no hydrogen 2.407 N/A HIS 425.A N GLN 421.A O no hydrogen 2.938 N/A HIS 425.A ND1 GLN 421.A O no hydrogen 2.356 N/A TYR 426.A N THR 422.A O no hydrogen 2.869 N/A GLY 427.A N ALA 423.A O no hydrogen 2.906 N/A ASN 428.A N LYS 424.A O no hydrogen 2.886 N/A LEU 429.A N HIS 425.A O no hydrogen 2.888 N/A GLY 430.A N TYR 426.A O no hydrogen 2.925 N/A ARG 431.A N GLY 427.A O no hydrogen 2.881 N/A ARG 431.A NH1 GLU 382.A OE2 no hydrogen 2.990 N/A ARG 431.A NH2 TYR 339.A OH no hydrogen 2.918 N/A ARG 431.A NH2 GLU 382.A OE2 no hydrogen 2.787 N/A LEU 432.A N ASN 428.A O no hydrogen 2.875 N/A TYR 433.A N LEU 429.A O no hydrogen 2.914 N/A TYR 433.A OH HIS 401.A NE2 no hydrogen 2.320 N/A GLN 434.A N GLY 430.A O no hydrogen 2.913 N/A SER 435.A N LEU 432.A O no hydrogen 3.036 N/A MET 436.A N LEU 432.A O no hydrogen 2.914 N/A MET 436.A N TYR 433.A O no hydrogen 3.065 N/A LYS 438.A N TYR 433.A O no hydrogen 3.294 N/A GLU 441.A N GLU 441.A OE1 no hydrogen 2.670 N/A ALA 442.A N LYS 438.A O no hydrogen 3.266 N/A GLU 443.A N PHE 439.A O no hydrogen 2.955 N/A MET 445.A N GLU 441.A O no hydrogen 2.917 N/A HIS 446.A N ALA 442.A O no hydrogen 2.925 N/A ILE 447.A N GLU 443.A O no hydrogen 2.912 N/A LYS 448.A N GLU 444.A O no hydrogen 2.896 N/A ALA 449.A N MET 445.A O no hydrogen 2.911 N/A ILE 450.A N HIS 446.A O no hydrogen 2.909 N/A GLN 451.A N ILE 447.A O no hydrogen 2.927 N/A ILE 452.A N LYS 448.A O no hydrogen 2.938 N/A LYS 453.A N ALA 449.A O no hydrogen 2.935 N/A LYS 453.A NZ GLU 463.A OE2 no hydrogen 2.955 N/A LYS 453.A NZ SER 467.A OG no hydrogen 2.316 N/A GLU 454.A N ILE 450.A O no hydrogen 2.862 N/A GLN 455.A N GLN 451.A O no hydrogen 2.917 N/A LEU 456.A N ILE 452.A O no hydrogen 3.366 N/A LEU 457.A N LYS 453.A O no hydrogen 2.617 N/A GLY 458.A N LYS 453.A O no hydrogen 3.113 N/A GLN 459.A N GLU 460.A OE1 no hydrogen 2.705 N/A GLN 459.A NE2 GLY 458.A O no hydrogen 2.682 N/A LEU 466.A N TYR 462.A O no hydrogen 2.945 N/A VAL 468.A N VAL 464.A O no hydrogen 2.892 N/A GLY 469.A N ALA 465.A O no hydrogen 2.871 N/A HIS 470.A N LEU 466.A O no hydrogen 2.885 N/A LEU 471.A N SER 467.A O no hydrogen 2.907 N/A ALA 472.A N VAL 468.A O no hydrogen 2.859 N/A SER 473.A N GLY 469.A O no hydrogen 2.891 N/A SER 473.A OG GLY 469.A O no hydrogen 3.247 N/A SER 473.A OG TYR 489.A OH no hydrogen 3.363 N/A LEU 474.A N HIS 470.A O no hydrogen 2.904 N/A TYR 475.A N LEU 471.A O no hydrogen 2.913 N/A ASN 476.A N ALA 472.A O no hydrogen 2.881 N/A ASN 476.A ND2 TYR 489.A OH no hydrogen 3.249 N/A ASN 476.A ND2 GLY 513.A O no hydrogen 2.292 N/A TYR 477.A N SER 473.A O no hydrogen 3.010 N/A TYR 477.A OH ARG 512.A O no hydrogen 3.095 N/A MET 479.A N LEU 474.A O no hydrogen 3.123 N/A GLU 483.A N GLU 483.A OE1 no hydrogen 2.796 N/A ASN 484.A ND2 GLN 481.A OE1 no hydrogen 2.683 N/A LYS 487.A NZ ASN 484.A O no hydrogen 2.797 N/A TYR 489.A N ALA 485.A O no hydrogen 2.919 N/A LEU 490.A N GLU 486.A O no hydrogen 2.915 N/A ARG 491.A N LYS 487.A O no hydrogen 2.878 N/A ARG 491.A NH1 GLN 459.A OE1 no hydrogen 2.948 N/A ARG 491.A NH2 GLN 459.A OE1 no hydrogen 2.451 N/A SER 492.A N LEU 488.A O no hydrogen 2.924 N/A SER 492.A OG LEU 488.A O no hydrogen 3.095 N/A ILE 493.A N TYR 489.A O no hydrogen 2.929 N/A ALA 494.A N LEU 490.A O no hydrogen 2.894 N/A ILE 495.A N ARG 491.A O no hydrogen 2.948 N/A GLY 496.A N SER 492.A O no hydrogen 2.890 N/A LYS 497.A N ILE 493.A O no hydrogen 2.920 N/A LYS 497.A NZ GLU 502.A OE1 no hydrogen 2.836 N/A LYS 497.A NZ TYR 511.A OH no hydrogen 3.007 N/A LYS 498.A N ALA 494.A O no hydrogen 2.930 N/A LYS 498.A NZ GLU 460.A O no hydrogen 2.780 N/A PHE 500.A N GLY 496.A O no hydrogen 3.164 N/A SER 505.A N ASP 296.A OD2 no hydrogen 2.531 N/A SER 505.A OG ASP 296.A OD1 no hydrogen 3.108 N/A SER 505.A OG ASP 296.A OD2 no hydrogen 2.584 N/A LEU 507.A N TYR 504.A O no hydrogen 3.090 N/A TYR 511.A N LEU 507.A O no hydrogen 2.867 N/A ARG 512.A N GLU 508.A O no hydrogen 2.929 N/A LEU 514.A N ASP 510.A O no hydrogen 2.879 N/A ILE 515.A N TYR 511.A O no hydrogen 2.917 N/A LYS 516.A NZ ASN 476.A O no hydrogen 3.398 N/A LEU 517.A N GLY 513.A O no hydrogen 2.888 N/A TYR 518.A N LEU 514.A O no hydrogen 2.899 N/A TYR 518.A OH GLU 486.A OE2 no hydrogen 2.473 N/A ASN 519.A N ILE 515.A O no hydrogen 2.882 N/A SER 520.A OG LYS 516.A O no hydrogen 3.344 N/A SER 520.A OG LEU 517.A O no hydrogen 2.928 N/A ILE 521.A N TYR 518.A O no hydrogen 3.105 N/A LYS 526.A N ASN 523.A OD1 no hydrogen 3.226 N/A PHE 528.A N TYR 524.A O no hydrogen 2.927 N/A GLU 529.A N GLU 525.A O no hydrogen 2.903 N/A TYR 530.A N LYS 526.A O no hydrogen 2.883 N/A HIS 531.A N VAL 527.A O no hydrogen 2.898 N/A ASN 532.A N PHE 528.A O no hydrogen 2.894 N/A VAL 533.A N GLU 529.A O no hydrogen 2.961 N/A LEU 534.A N TYR 530.A O no hydrogen 2.848 N/A TRP 537.A N VAL 533.A O no hydrogen 2.901 N/A TRP 537.A NE1 TYR 504.A O no hydrogen 2.964 N/A ASN 538.A N LEU 534.A O no hydrogen 2.885 N/A ARG 539.A N SER 535.A O no hydrogen 2.922 N/A LEU 540.A N ASN 536.A O no hydrogen 2.906 N/A ARG 541.A N TRP 537.A O no hydrogen 2.914 N/A ASP 542.A N ASN 538.A O no hydrogen 2.890 N/A ARG 543.A N ARG 539.A O no hydrogen 2.908 N/A GLN 544.A N LEU 540.A O no hydrogen 2.921 N/A SER 546.A OG ASN 297.A OD1 no hydrogen 3.384 N/A SER 546.A OG TYR 545.A O no hydrogen 2.519 N/A ALA 550.A N ASP 549.A OD1 no hydrogen 2.934 N/A GLU 552.A N GLU 552.A OE1 no hydrogen 2.758 N/A ASP 553.A N ASP 549.A O no hydrogen 3.188 N/A VAL 554.A N ALA 550.A O no hydrogen 2.926 N/A SER 555.A OG VAL 554.A O no hydrogen 2.559 N/A SER 557.A OG THR 556.A O no hydrogen 2.764 N/A SER 557.A OG SER 557.A O no hydrogen 2.389 N/A SER 560.A OG GLU 562.A OE1 no hydrogen 3.262 N/A THR 561.A N SER 560.A OG no hydrogen 2.607 N/A THR 561.A OG1 HIS 265.A NE2 no hydrogen 3.177 N/A GLU 562.A N GLU 562.A OE1 no hydrogen 2.859 N/A GLU 563.A N GLU 563.A OE1 no hydrogen 2.745 N/A VAL 565.A N THR 561.A O no hydrogen 2.986 N/A GLN 566.A N GLU 562.A O no hydrogen 2.946 N/A SER 567.A N GLU 563.A O no hydrogen 2.881 N/A SER 567.A OG GLU 563.A O no hydrogen 2.763 N/A PHE 568.A N VAL 564.A O no hydrogen 2.927 N/A LEU 569.A N VAL 565.A O no hydrogen 2.954 N/A ILE 570.A N GLN 566.A O no hydrogen 2.873 N/A SER 571.A N SER 567.A O no hydrogen 2.923 N/A SER 571.A OG SER 567.A O no hydrogen 3.082 N/A SER 571.A OG PHE 568.A O no hydrogen 2.514 N/A GLN 572.A N LEU 569.A O no hydrogen 3.018 N/A