Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nzt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N GLN 2.A O no hydrogen 3.098 N/A VAL 6.A N GLN 2.A O no hydrogen 3.118 N/A ASP 7.A N VAL 3.A O no hydrogen 3.219 N/A GLN 8.A N LYS 5.A O no hydrogen 3.197 N/A TYR 9.A N LYS 5.A O no hydrogen 2.873 N/A TYR 9.A OH GLU 293.A OE1 no hydrogen 3.111 N/A LEU 10.A N VAL 6.A O no hydrogen 2.682 N/A MET 13.A N LEU 10.A O no hydrogen 3.231 N/A ARG 14.A N TYR 11.A O no hydrogen 3.318 N/A SER 16.A OG THR 19.A OG1 no hydrogen 3.258 N/A THR 19.A N SER 16.A OG no hydrogen 3.234 N/A THR 19.A OG1 SER 16.A O no hydrogen 3.081 N/A THR 19.A OG1 SER 16.A OG no hydrogen 3.258 N/A LEU 20.A N SER 16.A O no hydrogen 2.893 N/A LEU 21.A N ASP 17.A O no hydrogen 2.805 N/A GLU 22.A N GLU 18.A O no hydrogen 3.223 N/A ILE 23.A N THR 19.A O no hydrogen 2.984 N/A SER 24.A N LEU 20.A O no hydrogen 3.121 N/A SER 24.A OG LEU 21.A O no hydrogen 3.245 N/A LYS 25.A N LEU 21.A O no hydrogen 3.181 N/A ARG 26.A N GLU 22.A O no hydrogen 3.083 N/A ARG 26.A NE GLU 22.A OE2 no hydrogen 3.564 N/A ARG 26.A NH1 SER 246.A O no hydrogen 2.745 N/A ARG 26.A NH1 ASP 249.A OD1 no hydrogen 3.091 N/A ARG 26.A NH2 ASP 249.A OD2 no hydrogen 3.022 N/A PHE 27.A N ILE 23.A O no hydrogen 3.021 N/A ARG 28.A N SER 24.A O no hydrogen 3.110 N/A ARG 28.A NE GLU 32.A OE2 no hydrogen 3.329 N/A ARG 28.A NH1 GLU 376.A OE2 no hydrogen 3.305 N/A ARG 28.A NH2 GLU 32.A OE2 no hydrogen 3.426 N/A ARG 28.A NH2 GLU 376.A OE1 no hydrogen 3.182 N/A LYS 29.A N LYS 25.A O no hydrogen 3.228 N/A GLU 30.A N ARG 26.A O no hydrogen 2.977 N/A MET 31.A N PHE 27.A O no hydrogen 2.754 N/A GLU 32.A N ARG 28.A O no hydrogen 3.203 N/A LYS 33.A N LYS 29.A O no hydrogen 3.153 N/A GLY 34.A N GLU 30.A O no hydrogen 3.009 N/A LEU 35.A N MET 31.A O no hydrogen 3.096 N/A LEU 35.A N GLU 32.A O no hydrogen 3.212 N/A GLY 36.A N GLU 32.A O no hydrogen 3.004 N/A ALA 37.A N ASP 223.A OD2 no hydrogen 2.874 N/A THR 39.A OG1 LYS 33.A O no hydrogen 2.600 N/A HIS 40.A N GLY 36.A O no hydrogen 2.994 N/A HIS 40.A ND1 GLY 34.A O no hydrogen 2.804 N/A THR 42.A N THR 39.A O no hydrogen 2.938 N/A THR 42.A OG1 THR 39.A O no hydrogen 2.657 N/A ALA 43.A N HIS 40.A O no hydrogen 3.005 N/A MET 47.A N MET 236.A O no hydrogen 3.285 N/A LEU 48.A N ASN 235.A O no hydrogen 2.771 N/A THR 50.A OG1 CYS 233.A O no hydrogen 2.425 N/A VAL 52.A N THR 50.A OG1 no hydrogen 3.280 N/A SER 54.A OG THR 55.A O no hydrogen 2.381 N/A THR 55.A OG1 HIS 199.A O no hydrogen 2.927 N/A ASP 57.A N GLU 60.A OE2 no hydrogen 3.039 N/A GLY 58.A N GLU 60.A OE1 no hydrogen 2.958 N/A THR 59.A OG1 ASP 57.A OD2 no hydrogen 3.252 N/A GLU 60.A N GLU 60.A OE1 no hydrogen 2.797 N/A GLY 62.A N VAL 81.A O no hydrogen 3.285 N/A PHE 64.A N VAL 79.A O no hydrogen 2.787 N/A LEU 65.A N PRO 126.A O no hydrogen 3.037 N/A ALA 66.A N LEU 77.A O no hydrogen 3.018 N/A LEU 67.A N GLY 128.A O no hydrogen 3.153 N/A ASP 68.A N ARG 75.A O no hydrogen 2.805 N/A LEU 69.A N THR 130.A O no hydrogen 2.903 N/A ARG 75.A N ASP 68.A O no hydrogen 3.157 N/A ARG 75.A NH1 ASN 86.A OD1 no hydrogen 3.175 N/A VAL 76.A N GLN 87.A O no hydrogen 3.168 N/A LEU 77.A N ALA 66.A O no hydrogen 3.023 N/A TRP 78.A N GLU 85.A O no hydrogen 2.820 N/A VAL 79.A N PHE 64.A O no hydrogen 2.885 N/A LYS 80.A N GLU 83.A O no hydrogen 2.819 N/A VAL 81.A N GLY 62.A O no hydrogen 3.056 N/A GLU 83.A N LYS 80.A O no hydrogen 3.014 N/A GLU 85.A N TRP 78.A O no hydrogen 2.827 N/A GLN 87.A N VAL 76.A O no hydrogen 3.016 N/A TYR 89.A N PHE 74.A O no hydrogen 2.820 N/A TYR 89.A OH ASN 113.A OD1 no hydrogen 2.847 N/A ILE 95.A N PRO 92.A O no hydrogen 2.722 N/A MET 96.A N PRO 92.A O no hydrogen 2.983 N/A ARG 97.A N GLU 93.A O no hydrogen 2.975 N/A GLY 98.A N ILE 95.A O no hydrogen 3.081 N/A GLY 100.A N SER 155.A O no hydrogen 3.052 N/A GLN 102.A N SER 99.A OG no hydrogen 2.976 N/A LEU 103.A N SER 99.A O no hydrogen 2.930 N/A PHE 104.A N GLY 100.A O no hydrogen 2.841 N/A ASP 105.A N THR 101.A O no hydrogen 2.844 N/A HIS 106.A N GLN 102.A O no hydrogen 2.953 N/A HIS 106.A NE2 ALA 90.A O no hydrogen 2.806 N/A ILE 107.A N LEU 103.A O no hydrogen 3.059 N/A ALA 108.A N PHE 104.A O no hydrogen 2.867 N/A GLU 109.A N ASP 105.A O no hydrogen 2.953 N/A CYS 110.A N HIS 106.A O no hydrogen 2.864 N/A CYS 110.A SG HIS 106.A NE2 no hydrogen 3.644 N/A CYS 110.A SG HIS 106.A O no hydrogen 3.326 N/A LEU 111.A N ILE 107.A O no hydrogen 2.823 N/A ALA 112.A N ALA 108.A O no hydrogen 2.934 N/A ASN 113.A N GLU 109.A O no hydrogen 2.815 N/A PHE 114.A N CYS 110.A O no hydrogen 2.971 N/A MET 115.A N LEU 111.A O no hydrogen 2.982 N/A ASP 116.A N ALA 112.A O no hydrogen 3.094 N/A LYS 117.A N ASN 113.A O no hydrogen 3.056 N/A LEU 118.A N PHE 114.A O no hydrogen 2.963 N/A GLN 119.A N ASP 116.A O no hydrogen 2.863 N/A ILE 120.A N MET 115.A O no hydrogen 2.822 N/A LYS 121.A NZ ASP 116.A OD1 no hydrogen 2.854 N/A LYS 121.A NZ ASP 116.A OD2 no hydrogen 3.236 N/A LYS 121.A NZ ASP 175.A OD2 no hydrogen 2.574 N/A LYS 123.A N ILE 120.A O no hydrogen 2.857 N/A LEU 127.A N ILE 180.A O no hydrogen 2.921 N/A GLY 128.A N LEU 65.A O no hydrogen 2.871 N/A PHE 129.A N ALA 182.A O no hydrogen 2.816 N/A THR 130.A N LEU 67.A O no hydrogen 2.852 N/A PHE 131.A N VAL 184.A O no hydrogen 2.888 N/A SER 132.A N LEU 69.A O no hydrogen 2.895 N/A SER 132.A OG LEU 69.A O no hydrogen 3.000 N/A PHE 133.A N PHE 131.A O no hydrogen 2.812 N/A CYS 135.A SG PHE 133.A O no hydrogen 3.578 N/A HIS 136.A N PHE 144.A O no hydrogen 2.783 N/A GLN 137.A NE2 LYS 139.A O no hydrogen 3.257 N/A GLN 137.A NE2 VAL 183.A O no hydrogen 3.109 N/A THR 138.A N GLU 142.A OE2 no hydrogen 2.714 N/A THR 138.A OG1 GLU 142.A OE2 no hydrogen 2.483 N/A SER 143.A N ASP 161.A OD1 no hydrogen 2.913 N/A SER 143.A OG GLU 142.A O no hydrogen 2.791 N/A PHE 144.A N HIS 136.A O no hydrogen 2.816 N/A LEU 145.A N ARG 160.A O no hydrogen 3.199 N/A VAL 146.A N PRO 134.A O no hydrogen 2.694 N/A SER 147.A OG TRP 148.A O no hydrogen 3.233 N/A TRP 148.A N GLU 158.A OE2 no hydrogen 3.238 N/A TRP 148.A NE1 SER 154.A O no hydrogen 3.083 N/A LYS 150.A NZ GLY 70.A O no hydrogen 3.038 N/A LYS 150.A NZ SER 132.A O no hydrogen 3.051 N/A PHE 152.A N THR 149.A O no hydrogen 3.427 N/A LYS 153.A N MET 96.A O no hydrogen 2.975 N/A SER 154.A OG GLY 98.A O no hydrogen 3.452 N/A GLY 159.A N LEU 145.A O no hydrogen 2.884 N/A ARG 160.A N VAL 157.A O no hydrogen 2.784 N/A VAL 162.A N SER 143.A O no hydrogen 2.921 N/A VAL 163.A N ASP 161.A OD1 no hydrogen 3.086 N/A ALA 164.A N ASP 161.A O no hydrogen 2.940 N/A LEU 165.A N ASP 161.A O no hydrogen 3.028 N/A ILE 166.A N VAL 162.A O no hydrogen 3.013 N/A ARG 167.A N VAL 163.A O no hydrogen 3.051 N/A ARG 167.A NH1 ILE 178.A O no hydrogen 3.486 N/A ARG 167.A NH1 ASP 179.A O no hydrogen 3.330 N/A ARG 167.A NH2 ASP 179.A O no hydrogen 2.939 N/A LYS 168.A N ALA 164.A O no hydrogen 2.829 N/A ALA 169.A N LEU 165.A O no hydrogen 2.962 N/A ILE 170.A N ILE 166.A O no hydrogen 2.942 N/A GLN 171.A N ARG 167.A O no hydrogen 2.898 N/A ARG 172.A N LYS 168.A O no hydrogen 3.044 N/A ARG 172.A N ALA 169.A O no hydrogen 3.190 N/A ARG 172.A NH1 THR 101.A O no hydrogen 3.519 N/A ARG 172.A NH1 ASP 105.A OD1 no hydrogen 2.974 N/A ARG 173.A N ILE 170.A O no hydrogen 2.971 N/A ARG 173.A NH2 ASP 175.A OD2 no hydrogen 2.530 N/A GLY 174.A N ILE 170.A O no hydrogen 3.160 N/A ILE 178.A N ASP 177.A OD1 no hydrogen 2.854 N/A ASP 179.A N LEU 125.A O no hydrogen 2.709 N/A ALA 182.A N LEU 127.A O no hydrogen 3.099 N/A VAL 183.A N LEU 140.A O no hydrogen 2.938 N/A VAL 184.A N PHE 129.A O no hydrogen 2.977 N/A ASN 185.A ND2 PHE 131.A O no hydrogen 3.308 N/A ASN 185.A ND2 PHE 133.A O no hydrogen 3.358 N/A THR 187.A N ASN 185.A OD1 no hydrogen 3.408 N/A THR 187.A OG1 ASN 185.A OD1 no hydrogen 2.970 N/A GLY 189.A N ASN 185.A O no hydrogen 2.865 N/A THR 190.A N ASP 186.A O no hydrogen 2.859 N/A THR 190.A OG1 ASP 186.A O no hydrogen 2.877 N/A THR 190.A OG1 SER 426.A OG no hydrogen 2.961 N/A MET 191.A N THR 187.A O no hydrogen 2.929 N/A MET 192.A N VAL 188.A O no hydrogen 2.944 N/A THR 193.A N GLY 189.A O no hydrogen 2.802 N/A THR 193.A OG1 GLY 189.A O no hydrogen 3.283 N/A THR 193.A OG1 GLY 425.A O no hydrogen 2.640 N/A CYS 194.A N THR 190.A O no hydrogen 3.140 N/A CYS 194.A SG THR 190.A O no hydrogen 3.430 N/A GLY 195.A N MET 191.A O no hydrogen 2.815 N/A TYR 196.A N MET 192.A O no hydrogen 3.140 N/A ASP 197.A N CYS 194.A O no hydrogen 2.944 N/A ASP 198.A N CYS 194.A O no hydrogen 2.983 N/A ASN 200.A N ASP 198.A OD1 no hydrogen 3.026 N/A ASN 200.A ND2 ASP 198.A OD1 no hydrogen 2.932 N/A CYS 201.A N ASP 198.A O no hydrogen 2.984 N/A CYS 201.A SG MET 191.A O no hydrogen 3.755 N/A CYS 201.A SG ILE 203.A O no hydrogen 3.626 N/A CYS 201.A SG THR 386.A O no hydrogen 3.701 N/A GLU 202.A N THR 386.A O no hydrogen 2.993 N/A ILE 203.A N THR 386.A O no hydrogen 3.374 N/A GLY 204.A N CYS 214.A O no hydrogen 3.058 N/A LEU 205.A N GLY 388.A O no hydrogen 2.766 N/A ILE 206.A N ASN 212.A O no hydrogen 3.060 N/A VAL 207.A N ASP 390.A O no hydrogen 3.233 N/A GLY 208.A N GLY 210.A O no hydrogen 2.874 N/A SER 211.A N GLU 271.A OE2 no hydrogen 2.952 N/A SER 211.A OG ILE 206.A O no hydrogen 3.037 N/A ASN 212.A N ILE 206.A O no hydrogen 3.297 N/A ASN 212.A ND2 ASN 235.A OD1 no hydrogen 2.845 N/A CYS 214.A N GLY 204.A O no hydrogen 2.945 N/A TYR 215.A N ILE 234.A O no hydrogen 3.051 N/A TYR 215.A OH GLU 217.A OE1 no hydrogen 2.597 N/A MET 216.A N GLU 202.A O no hydrogen 3.005 N/A GLU 217.A N MET 232.A O no hydrogen 2.936 N/A GLU 218.A N GLU 217.A OE2 no hydrogen 2.707 N/A MET 219.A N GLY 230.A O no hydrogen 2.776 N/A HIS 221.A N GLU 218.A O no hydrogen 2.924 N/A ILE 222.A N MET 219.A O no hydrogen 3.204 N/A ASP 223.A N LEU 35.A O no hydrogen 3.377 N/A VAL 225.A N ILE 222.A O no hydrogen 3.487 N/A ARG 231.A NH1 GLU 202.A OE2 no hydrogen 3.324 N/A MET 232.A N GLU 217.A O no hydrogen 2.781 N/A CYS 233.A N VAL 52.A O no hydrogen 2.747 N/A CYS 233.A SG TYR 215.A O no hydrogen 3.947 N/A ILE 234.A N TYR 215.A O no hydrogen 2.763 N/A ASN 235.A N LEU 48.A O no hydrogen 2.812 N/A ASN 235.A ND2 GLU 237.A OE2 no hydrogen 2.924 N/A MET 236.A N ALA 213.A O no hydrogen 3.113 N/A GLU 237.A N ASN 235.A OD1 no hydrogen 3.272 N/A TRP 238.A N ASN 212.A OD1 no hydrogen 3.152 N/A TRP 238.A NE1 SER 211.A OG no hydrogen 3.208 N/A ALA 240.A N GLU 237.A O no hydrogen 3.501 N/A PHE 241.A N TRP 238.A O no hydrogen 3.049 N/A ASP 243.A N ALA 240.A O no hydrogen 3.037 N/A GLY 245.A N GLY 242.A O no hydrogen 2.879 N/A SER 246.A OG ASP 244.A OD1 no hydrogen 3.253 N/A ASN 248.A N GLY 245.A O no hydrogen 3.268 N/A ILE 250.A N LEU 247.A O no hydrogen 2.894 N/A ARG 251.A N LEU 247.A O no hydrogen 2.819 N/A ARG 251.A NH1 ASN 248.A OD1 no hydrogen 3.272 N/A THR 252.A N ASP 255.A OD2 no hydrogen 3.348 N/A THR 252.A OG1 ASP 255.A OD2 no hydrogen 2.966 N/A ASP 255.A N THR 252.A O no hydrogen 3.262 N/A GLN 256.A N THR 252.A O no hydrogen 3.128 N/A GLU 257.A N GLU 253.A O no hydrogen 3.073 N/A ILE 258.A N PHE 254.A O no hydrogen 3.056 N/A ASP 259.A N ASP 255.A O no hydrogen 2.884 N/A MET 260.A N GLN 256.A O no hydrogen 3.023 N/A GLY 261.A N GLU 257.A O no hydrogen 3.004 N/A SER 262.A N ASP 259.A O no hydrogen 2.950 N/A SER 262.A OG ASP 259.A O no hydrogen 2.553 N/A SER 262.A OG ASP 259.A OD1 no hydrogen 3.481 N/A GLY 266.A N ASP 259.A OD1 no hydrogen 2.910 N/A GLY 266.A N ASP 259.A OD2 no hydrogen 3.376 N/A LYS 267.A N ASN 264.A O no hydrogen 3.305 N/A GLN 268.A N ASP 243.A OD2 no hydrogen 2.910 N/A GLN 268.A NE2 GLU 271.A OE1 no hydrogen 2.853 N/A LEU 269.A N ASP 243.A OD1 no hydrogen 2.833 N/A GLU 271.A N GLY 239.A O no hydrogen 3.160 N/A LYS 272.A N GLN 268.A O no hydrogen 2.989 N/A LYS 272.A NZ ASP 259.A OD1 no hydrogen 2.979 N/A LYS 272.A NZ ASN 264.A O no hydrogen 2.647 N/A LYS 272.A NZ ASN 264.A OD1 no hydrogen 3.047 N/A LYS 272.A NZ LYS 267.A O no hydrogen 2.753 N/A MET 273.A N PHE 270.A O no hydrogen 3.002 N/A ILE 274.A N GLU 271.A O no hydrogen 2.938 N/A SER 275.A N GLU 271.A O no hydrogen 2.917 N/A SER 275.A OG THR 209.A O no hydrogen 2.653 N/A SER 275.A OG GLU 271.A O no hydrogen 3.515 N/A GLY 276.A N GLY 208.A O no hydrogen 2.738 N/A MET 277.A N THR 209.A O no hydrogen 3.260 N/A TYR 278.A N SER 275.A O no hydrogen 3.154 N/A MET 279.A N SER 275.A O no hydrogen 3.174 N/A GLY 280.A N THR 313.A OG1 no hydrogen 2.938 N/A LEU 282.A N TYR 278.A O no hydrogen 2.995 N/A VAL 283.A N MET 279.A O no hydrogen 3.063 N/A ARG 284.A N GLY 280.A O no hydrogen 2.846 N/A ARG 284.A NE GLU 281.A OE1 no hydrogen 3.016 N/A ARG 284.A NH1 LEU 305.A O no hydrogen 2.947 N/A ARG 284.A NH2 GLU 281.A OE2 no hydrogen 3.397 N/A LEU 285.A N GLU 281.A O no hydrogen 2.845 N/A ILE 286.A N LEU 282.A O no hydrogen 3.115 N/A LEU 287.A N VAL 283.A O no hydrogen 3.036 N/A VAL 288.A N ARG 284.A O no hydrogen 2.819 N/A LYS 289.A N LEU 285.A O no hydrogen 3.217 N/A LYS 289.A NZ GLU 253.A OE1 no hydrogen 2.829 N/A MET 290.A N ILE 286.A O no hydrogen 3.144 N/A ALA 291.A N LEU 287.A O no hydrogen 3.023 N/A LYS 292.A N VAL 288.A O no hydrogen 3.032 N/A GLU 293.A N LYS 289.A O no hydrogen 3.105 N/A GLU 294.A N ALA 291.A O no hydrogen 3.231 N/A LEU 295.A N MET 290.A O no hydrogen 2.891 N/A PHE 297.A N ASP 344.A OD1 no hydrogen 3.130 N/A PHE 297.A N ASP 344.A OD2 no hydrogen 3.133 N/A GLY 299.A N LEU 296.A O no hydrogen 2.943 N/A LYS 300.A N PHE 297.A O no hydrogen 3.122 N/A SER 302.A OG LEU 336.A O no hydrogen 2.474 N/A LEU 305.A N SER 302.A OG no hydrogen 3.052 N/A ASN 307.A N GLU 304.A O no hydrogen 3.308 N/A THR 308.A OG1 GLU 281.A OE2 no hydrogen 2.483 N/A GLY 309.A N GLU 281.A OE1 no hydrogen 2.765 N/A ARG 310.A NE ASN 307.A OD1 no hydrogen 2.914 N/A GLU 312.A N ASP 315.A OD2 no hydrogen 2.981 N/A THR 313.A OG1 GLY 276.A O no hydrogen 2.810 N/A LYS 314.A NZ ASP 318.A OD2 no hydrogen 2.777 N/A ASP 315.A N GLU 312.A O no hydrogen 3.219 N/A SER 317.A N THR 313.A O no hydrogen 2.929 N/A SER 317.A OG THR 313.A O no hydrogen 3.419 N/A ASP 318.A N LYS 314.A O no hydrogen 2.898 N/A ILE 319.A N ASP 315.A O no hydrogen 2.938 N/A GLU 320.A N ILE 316.A O no hydrogen 3.117 N/A GLU 320.A N SER 317.A O no hydrogen 3.132 N/A GLY 321.A N ASP 318.A O no hydrogen 3.169 N/A GLU 322.A N ASP 318.A O no hydrogen 2.860 N/A LYS 328.A N ASP 324.A O no hydrogen 2.919 N/A LYS 328.A NZ GLU 331.A OE1 no hydrogen 3.346 N/A ALA 329.A N GLY 325.A O no hydrogen 2.956 N/A ARG 330.A N ILE 326.A O no hydrogen 3.132 N/A GLU 331.A N ARG 327.A O no hydrogen 2.936 N/A VAL 332.A N LYS 328.A O no hydrogen 3.170 N/A VAL 332.A N ALA 329.A O no hydrogen 3.207 N/A LEU 333.A N ALA 329.A O no hydrogen 3.134 N/A MET 334.A N ARG 330.A O no hydrogen 3.057 N/A ARG 335.A N GLU 331.A O no hydrogen 3.272 N/A ARG 335.A NH1 ASP 315.A OD1 no hydrogen 2.988 N/A ARG 335.A NH1 ASP 315.A OD2 no hydrogen 3.349 N/A ARG 335.A NH2 ASP 315.A OD2 no hydrogen 3.106 N/A LEU 336.A N VAL 332.A O no hydrogen 2.972 N/A GLY 337.A N MET 334.A O no hydrogen 3.014 N/A LEU 338.A N LEU 333.A O no hydrogen 3.024 N/A ASP 344.A N THR 341.A OG1 no hydrogen 3.101 N/A CYS 345.A N THR 341.A O no hydrogen 2.914 N/A CYS 345.A SG ILE 326.A O no hydrogen 3.984 N/A CYS 345.A SG THR 341.A O no hydrogen 3.972 N/A VAL 346.A N GLN 342.A O no hydrogen 3.158 N/A VAL 346.A N GLU 343.A O no hydrogen 2.943 N/A ALA 347.A N GLU 343.A O no hydrogen 3.118 N/A THR 348.A N ASP 344.A O no hydrogen 3.019 N/A THR 348.A OG1 ASP 344.A O no hydrogen 3.244 N/A HIS 349.A N CYS 345.A O no hydrogen 3.239 N/A ARG 350.A N VAL 346.A O no hydrogen 3.115 N/A ARG 350.A NE ASP 7.A OD1 no hydrogen 2.973 N/A ARG 350.A NH1 GLN 353.A OE1 no hydrogen 3.040 N/A ARG 350.A NH2 ASP 7.A OD1 no hydrogen 3.416 N/A ARG 350.A NH2 ASP 7.A OD2 no hydrogen 2.889 N/A ILE 351.A N ALA 347.A O no hydrogen 2.907 N/A CYS 352.A N THR 348.A O no hydrogen 3.230 N/A CYS 352.A SG THR 348.A O no hydrogen 3.344 N/A GLN 353.A N HIS 349.A O no hydrogen 3.167 N/A ILE 354.A N ARG 350.A O no hydrogen 3.041 N/A VAL 355.A N ILE 351.A O no hydrogen 2.753 N/A SER 356.A N CYS 352.A O no hydrogen 3.199 N/A SER 356.A OG GLU 320.A OE2 no hydrogen 2.813 N/A SER 356.A OG CYS 352.A O no hydrogen 3.007 N/A SER 356.A OG GLN 353.A O no hydrogen 3.408 N/A THR 357.A N GLN 353.A O no hydrogen 2.839 N/A THR 357.A OG1 GLN 353.A O no hydrogen 2.568 N/A ARG 358.A N ILE 354.A O no hydrogen 3.311 N/A ARG 358.A N VAL 355.A O no hydrogen 3.299 N/A ARG 358.A NH1 ASP 255.A OD2 no hydrogen 2.958 N/A ARG 358.A NH2 ASP 255.A OD1 no hydrogen 3.064 N/A ARG 358.A NH2 ASP 255.A OD2 no hydrogen 3.428 N/A SER 359.A N VAL 355.A O no hydrogen 3.234 N/A SER 359.A OG ILE 274.A O no hydrogen 2.529 N/A ALA 360.A N SER 356.A O no hydrogen 3.419 N/A SER 361.A N THR 357.A O no hydrogen 3.181 N/A SER 361.A OG THR 357.A O no hydrogen 2.903 N/A LEU 362.A N ARG 358.A O no hydrogen 2.800 N/A CYS 363.A N SER 359.A O no hydrogen 3.296 N/A CYS 363.A SG SER 359.A O no hydrogen 3.372 N/A ALA 364.A N ALA 360.A O no hydrogen 3.105 N/A ALA 365.A N SER 361.A O no hydrogen 2.996 N/A THR 366.A N LEU 362.A O no hydrogen 3.192 N/A THR 366.A OG1 LEU 362.A O no hydrogen 3.569 N/A THR 366.A OG1 CYS 363.A O no hydrogen 3.174 N/A LEU 367.A N CYS 363.A O no hydrogen 2.788 N/A ALA 368.A N ALA 364.A O no hydrogen 2.960 N/A ALA 369.A N THR 366.A O no hydrogen 3.070 N/A VAL 370.A N THR 366.A O no hydrogen 3.180 N/A LEU 371.A N LEU 367.A O no hydrogen 3.033 N/A GLN 372.A N ALA 368.A O no hydrogen 3.239 N/A GLN 372.A NE2 GLU 376.A OE2 no hydrogen 3.305 N/A ARG 373.A N ALA 369.A O no hydrogen 3.092 N/A ARG 373.A NE GLU 217.A OE1 no hydrogen 2.676 N/A ARG 373.A NH2 GLU 217.A OE1 no hydrogen 3.169 N/A ILE 374.A N VAL 370.A O no hydrogen 3.007 N/A LYS 375.A N LEU 371.A O no hydrogen 2.900 N/A LYS 375.A NZ GLN 372.A OE1 no hydrogen 3.020 N/A GLU 376.A N GLN 372.A O no hydrogen 3.019 N/A ASN 377.A N ARG 373.A O no hydrogen 2.949 N/A ASN 377.A ND2 GLU 217.A OE2 no hydrogen 2.744 N/A LYS 378.A N ILE 374.A O no hydrogen 3.190 N/A LYS 378.A NZ GLU 202.A OE1 no hydrogen 3.143 N/A LYS 378.A NZ GLU 202.A OE2 no hydrogen 2.791 N/A GLY 379.A N LYS 375.A O no hydrogen 3.147 N/A GLU 381.A N GLU 380.A OE1 no hydrogen 3.204 N/A LEU 383.A N GLY 414.A O no hydrogen 2.975 N/A SER 385.A N ASP 416.A O no hydrogen 3.166 N/A SER 385.A OG GLU 202.A OE1 no hydrogen 2.402 N/A THR 386.A OG1 ASP 198.A OD2 no hydrogen 3.232 N/A ILE 387.A N ARG 418.A O no hydrogen 3.017 N/A GLY 388.A N ILE 203.A O no hydrogen 2.868 N/A VAL 389.A N LEU 420.A O no hydrogen 2.926 N/A ASP 390.A N LEU 205.A O no hydrogen 3.062 N/A GLY 391.A N ASP 390.A OD1 no hydrogen 3.012 N/A VAL 393.A N VAL 207.A O no hydrogen 3.097 N/A TYR 394.A N VAL 207.A O no hydrogen 3.348 N/A TYR 394.A OH HIS 405.A NE2 no hydrogen 2.330 N/A LYS 395.A N GLY 391.A O no hydrogen 2.991 N/A LYS 395.A NZ SER 422.A O no hydrogen 3.017 N/A LYS 396.A N SER 392.A O no hydrogen 2.829 N/A HIS 397.A N VAL 393.A O no hydrogen 2.912 N/A HIS 397.A NE2 GLU 320.A OE2 no hydrogen 2.658 N/A HIS 399.A N HIS 397.A ND1 no hydrogen 3.144 N/A HIS 399.A NE2 GLU 320.A O no hydrogen 2.799 N/A PHE 400.A N HIS 397.A ND1 no hydrogen 3.211 N/A ARG 403.A N HIS 399.A O no hydrogen 3.014 N/A ARG 403.A NH1 GLU 320.A OE1 no hydrogen 3.028 N/A ARG 403.A NH2 GLU 320.A OE1 no hydrogen 3.019 N/A LEU 404.A N PHE 400.A O no hydrogen 2.802 N/A HIS 405.A N ALA 401.A O no hydrogen 2.736 N/A HIS 405.A NE2 TYR 394.A OH no hydrogen 2.330 N/A LYS 406.A N LYS 402.A O no hydrogen 2.981 N/A THR 407.A N ARG 403.A O no hydrogen 2.830 N/A THR 407.A OG1 ARG 403.A O no hydrogen 2.702 N/A VAL 408.A N LEU 404.A O no hydrogen 3.054 N/A ARG 409.A N HIS 405.A O no hydrogen 3.304 N/A ARG 409.A NH2 VAL 417.A O no hydrogen 3.046 N/A ARG 410.A N LYS 406.A O no hydrogen 3.262 N/A ARG 410.A N THR 407.A O no hydrogen 3.246 N/A ARG 410.A NH1 ASP 17.A OD1 no hydrogen 2.770 N/A ARG 410.A NH1 ASP 17.A OD2 no hydrogen 3.291 N/A LEU 411.A N THR 407.A O no hydrogen 2.962 N/A VAL 412.A N VAL 408.A O no hydrogen 2.896 N/A CYS 415.A N VAL 412.A O no hydrogen 3.087 N/A ASP 416.A N LEU 383.A O no hydrogen 2.565 N/A ARG 418.A N SER 385.A O no hydrogen 2.919 N/A LEU 420.A N ILE 387.A O no hydrogen 2.876 N/A ARG 421.A NE GLU 423.A OE2 no hydrogen 3.071 N/A ARG 421.A NH2 LYS 395.A O no hydrogen 3.424 N/A SER 422.A N VAL 389.A O no hydrogen 2.924 N/A GLY 425.A N SER 422.A OG no hydrogen 3.373 N/A SER 426.A OG ASP 186.A O no hydrogen 3.134 N/A SER 426.A OG THR 190.A OG1 no hydrogen 2.961 N/A LYS 428.A NZ ASP 424.A OD2 no hydrogen 3.097 N/A GLY 429.A N THR 193.A OG1 no hydrogen 2.894 N/A ALA 430.A N SER 426.A O no hydrogen 2.876 N/A ALA 431.A N GLY 427.A O no hydrogen 2.967 N/A MET 432.A N LYS 428.A O no hydrogen 3.036 N/A VAL 433.A N GLY 429.A O no hydrogen 3.127 N/A THR 434.A N ALA 430.A O no hydrogen 3.164 N/A THR 434.A OG1 ALA 430.A O no hydrogen 2.771 N/A ALA 435.A N ALA 431.A O no hydrogen 2.968 N/A ALA 437.A N VAL 433.A O no hydrogen 3.059 N/A TYR 438.A N THR 434.A O no hydrogen 2.882 N/A ARG 439.A N ALA 435.A O no hydrogen 3.087 N/A LEU 440.A N VAL 436.A O no hydrogen 2.742 N/A ALA 441.A N ALA 437.A O no hydrogen 2.849 N/A ASP 442.A N TYR 438.A O no hydrogen 2.848 N/A ASP 442.A N ARG 439.A O no hydrogen 2.906 N/A GLN 443.A N ARG 439.A O no hydrogen 2.875 N/A HIS 444.A N LEU 440.A O no hydrogen 3.014 N/A ARG 445.A N ALA 441.A O no hydrogen 3.215 N/A ALA 446.A N ASP 442.A O no hydrogen 2.944 N/A ARG 447.A N GLN 443.A O no hydrogen 2.862 N/A ARG 447.A NE LEU 724.A O no hydrogen 3.118 N/A ARG 447.A NH1 HIS 444.A ND1 no hydrogen 3.391 N/A GLN 448.A N HIS 444.A O no hydrogen 2.961 N/A LYS 449.A N ARG 445.A O no hydrogen 2.973 N/A THR 450.A N ALA 446.A O no hydrogen 3.416 N/A THR 450.A OG1 ALA 446.A O no hydrogen 3.386 N/A LEU 451.A N ARG 447.A O no hydrogen 3.087 N/A GLU 452.A N GLN 448.A O no hydrogen 2.944 N/A HIS 453.A N THR 450.A O no hydrogen 3.085 N/A LEU 454.A N LEU 451.A O no hydrogen 3.190 N/A GLN 455.A N GLU 452.A O no hydrogen 3.330 N/A SER 457.A N GLN 460.A OE1 no hydrogen 2.521 N/A SER 457.A OG GLN 460.A OE1 no hydrogen 3.223 N/A GLN 460.A N SER 457.A OG no hydrogen 3.343 N/A LEU 461.A N SER 457.A O no hydrogen 2.924 N/A LEU 462.A N HIS 458.A O no hydrogen 2.838 N/A GLU 463.A N ASP 459.A O no hydrogen 3.131 N/A VAL 464.A N GLN 460.A O no hydrogen 2.771 N/A LYS 465.A N LEU 461.A O no hydrogen 3.067 N/A LYS 465.A NZ ASP 801.A OD2 no hydrogen 2.470 N/A LYS 465.A NZ LEU 840.A O no hydrogen 2.801 N/A ARG 466.A N LEU 462.A O no hydrogen 2.974 N/A ARG 466.A NE GLU 463.A OE1 no hydrogen 2.924 N/A ARG 466.A NH2 GLU 463.A OE2 no hydrogen 2.948 N/A ARG 467.A N GLU 463.A O no hydrogen 2.873 N/A ARG 467.A NE GLU 463.A OE2 no hydrogen 2.733 N/A ARG 467.A NH1 CYS 675.A O no hydrogen 3.159 N/A ARG 467.A NH1 ASP 678.A OD1 no hydrogen 2.934 N/A ARG 467.A NH1 ASP 678.A OD2 no hydrogen 3.355 N/A ARG 467.A NH2 GLU 463.A OE2 no hydrogen 3.098 N/A ARG 467.A NH2 ASP 678.A OD2 no hydrogen 3.038 N/A MET 468.A N VAL 464.A O no hydrogen 3.021 N/A LYS 469.A N LYS 465.A O no hydrogen 3.151 N/A VAL 470.A N ARG 466.A O no hydrogen 3.040 N/A GLU 471.A N ARG 467.A O no hydrogen 3.028 N/A MET 472.A N MET 468.A O no hydrogen 2.933 N/A GLU 473.A N LYS 469.A O no hydrogen 3.275 N/A ARG 474.A N VAL 470.A O no hydrogen 3.054 N/A ARG 474.A NE GLU 471.A OE1 no hydrogen 2.753 N/A ARG 474.A NH2 GLU 471.A OE2 no hydrogen 3.083 N/A GLY 475.A N GLU 471.A O no hydrogen 3.296 N/A LEU 476.A N MET 472.A O no hydrogen 3.273 N/A SER 477.A N GLU 473.A O no hydrogen 2.991 N/A SER 477.A OG THR 480.A OG1 no hydrogen 3.178 N/A LYS 478.A N GLU 652.A OE1 no hydrogen 3.216 N/A THR 480.A N SER 477.A O no hydrogen 3.025 N/A THR 480.A N SER 477.A OG no hydrogen 3.305 N/A THR 480.A OG1 ARG 474.A O no hydrogen 2.634 N/A THR 480.A OG1 SER 477.A O no hydrogen 3.390 N/A THR 480.A OG1 SER 477.A OG no hydrogen 3.178 N/A HIS 481.A ND1 GLY 475.A O no hydrogen 2.860 N/A SER 483.A N THR 480.A O no hydrogen 3.196 N/A SER 483.A OG THR 480.A O no hydrogen 2.935 N/A ALA 484.A N HIS 481.A O no hydrogen 3.059 N/A LYS 487.A NZ HIS 481.A O no hydrogen 2.978 N/A LYS 487.A NZ ALA 482.A O no hydrogen 3.024 N/A LYS 487.A NZ ALA 484.A O no hydrogen 2.680 N/A MET 488.A N MET 665.A O no hydrogen 3.348 N/A LEU 489.A N ASN 664.A O no hydrogen 2.769 N/A THR 491.A N CYS 662.A O no hydrogen 3.276 N/A THR 491.A OG1 CYS 662.A O no hydrogen 2.387 N/A VAL 493.A N THR 491.A OG1 no hydrogen 3.137 N/A CYS 494.A SG ARG 660.A O no hydrogen 3.598 N/A PHE 497.A N VAL 512.A O no hydrogen 3.187 N/A LEU 498.A N PRO 558.A O no hydrogen 2.931 N/A ALA 499.A N LEU 510.A O no hydrogen 2.820 N/A LEU 500.A N GLY 560.A O no hydrogen 3.031 N/A ASP 501.A N ARG 508.A O no hydrogen 3.018 N/A LEU 502.A N THR 562.A O no hydrogen 2.673 N/A ARG 508.A N ASP 501.A O no hydrogen 3.135 N/A ARG 508.A NH1 ASN 521.A OD1 no hydrogen 3.286 N/A VAL 509.A N LYS 522.A O no hydrogen 3.187 N/A LEU 510.A N ALA 499.A O no hydrogen 2.721 N/A LEU 511.A N HIS 520.A O no hydrogen 2.970 N/A VAL 512.A N PHE 497.A O no hydrogen 2.718 N/A ARG 513.A N GLU 518.A O no hydrogen 2.814 N/A VAL 514.A N GLY 495.A O no hydrogen 2.788 N/A ARG 515.A N GLY 516.A O no hydrogen 3.154 N/A GLU 518.A N ARG 513.A O no hydrogen 2.787 N/A HIS 520.A N LEU 511.A O no hydrogen 2.968 N/A HIS 520.A NE2 GLU 518.A OE2 no hydrogen 2.992 N/A LYS 522.A N VAL 509.A O no hydrogen 3.184 N/A TYR 524.A N PHE 507.A O no hydrogen 2.863 N/A TYR 524.A OH ASP 548.A OD2 no hydrogen 2.742 N/A MET 531.A N PRO 527.A O no hydrogen 2.886 N/A HIS 532.A N GLN 528.A O no hydrogen 2.866 N/A HIS 532.A N GLU 529.A O no hydrogen 2.899 N/A GLY 533.A N VAL 530.A O no hydrogen 3.259 N/A THR 534.A N GLU 537.A OE1 no hydrogen 3.151 N/A GLY 535.A N SER 587.A O no hydrogen 2.596 N/A GLU 537.A N THR 534.A OG1 no hydrogen 3.267 N/A LEU 538.A N THR 534.A O no hydrogen 3.076 N/A PHE 539.A N GLY 535.A O no hydrogen 2.938 N/A ASP 540.A N ASP 536.A O no hydrogen 2.726 N/A HIS 541.A N GLU 537.A O no hydrogen 2.968 N/A HIS 541.A NE2 ALA 525.A O no hydrogen 2.946 N/A ILE 542.A N LEU 538.A O no hydrogen 2.812 N/A VAL 543.A N PHE 539.A O no hydrogen 2.954 N/A GLN 544.A N ASP 540.A O no hydrogen 2.905 N/A CYS 545.A N HIS 541.A O no hydrogen 2.899 N/A CYS 545.A SG HIS 541.A NE2 no hydrogen 3.857 N/A CYS 545.A SG HIS 541.A O no hydrogen 3.281 N/A ILE 546.A N ILE 542.A O no hydrogen 2.982 N/A ALA 547.A N VAL 543.A O no hydrogen 2.878 N/A ASP 548.A N GLN 544.A O no hydrogen 3.090 N/A PHE 549.A N CYS 545.A O no hydrogen 3.003 N/A PHE 549.A N ILE 546.A O no hydrogen 2.913 N/A LEU 550.A N ILE 546.A O no hydrogen 3.015 N/A GLU 551.A N ALA 547.A O no hydrogen 3.215 N/A TYR 552.A N ASP 548.A O no hydrogen 2.868 N/A MET 553.A N PHE 549.A O no hydrogen 2.630 N/A GLY 554.A N GLU 551.A O no hydrogen 2.846 N/A MET 555.A N LEU 550.A O no hydrogen 2.688 N/A SER 556.A OG ASP 606.A O no hydrogen 3.178 N/A LEU 559.A N ASP 608.A O no hydrogen 2.852 N/A GLY 560.A N LEU 498.A O no hydrogen 3.076 N/A PHE 561.A N ALA 611.A O no hydrogen 2.948 N/A THR 562.A N LEU 500.A O no hydrogen 2.646 N/A PHE 563.A N VAL 613.A O no hydrogen 2.930 N/A SER 564.A N LEU 502.A O no hydrogen 2.956 N/A SER 564.A OG LEU 502.A O no hydrogen 2.707 N/A CYS 567.A SG PHE 565.A O no hydrogen 3.790 N/A GLN 568.A N ILE 576.A O no hydrogen 2.592 N/A GLN 569.A NE2 SER 571.A O no hydrogen 3.079 N/A GLN 569.A NE2 LEU 572.A O no hydrogen 3.585 N/A ASN 570.A N GLU 574.A O no hydrogen 2.967 N/A ASN 570.A ND2 GLN 568.A OE1 no hydrogen 2.773 N/A SER 571.A OG ASP 573.A OD1 no hydrogen 2.755 N/A GLU 574.A N SER 571.A OG no hydrogen 3.286 N/A ILE 576.A N GLN 568.A O no hydrogen 2.530 N/A LEU 577.A N GLU 592.A O no hydrogen 2.920 N/A LEU 578.A N PRO 566.A O no hydrogen 2.949 N/A TRP 580.A N GLU 590.A OE2 no hydrogen 3.069 N/A TRP 580.A NE1 ALA 586.A O no hydrogen 2.858 N/A LYS 582.A NZ GLY 503.A O no hydrogen 2.518 N/A LYS 582.A NZ SER 564.A O no hydrogen 2.753 N/A PHE 584.A N THR 581.A O no hydrogen 3.325 N/A SER 587.A N GLY 533.A O no hydrogen 2.927 N/A CYS 589.A SG SER 587.A O no hydrogen 3.665 N/A GLY 591.A N LEU 577.A O no hydrogen 2.655 N/A GLU 592.A N CYS 589.A O no hydrogen 3.138 N/A VAL 594.A N SER 575.A O no hydrogen 2.825 N/A VAL 595.A N ASP 593.A OD1 no hydrogen 2.781 N/A THR 596.A N ASP 593.A O no hydrogen 3.130 N/A LEU 597.A N ASP 593.A O no hydrogen 3.251 N/A LEU 598.A N VAL 594.A O no hydrogen 2.865 N/A LYS 599.A N VAL 595.A O no hydrogen 2.753 N/A GLU 600.A N THR 596.A O no hydrogen 2.624 N/A ALA 601.A N LEU 597.A O no hydrogen 3.136 N/A ILE 602.A N LEU 598.A O no hydrogen 2.943 N/A HIS 603.A N LYS 599.A O no hydrogen 2.905 N/A ARG 604.A N GLU 600.A O no hydrogen 3.147 N/A ARG 604.A NE ASP 540.A OD1 no hydrogen 3.104 N/A ARG 604.A NH2 ASP 540.A OD1 no hydrogen 2.939 N/A ARG 605.A N ILE 602.A O no hydrogen 3.010 N/A ASP 608.A N LEU 557.A O no hydrogen 3.472 N/A VAL 610.A N LEU 559.A O no hydrogen 3.186 N/A ALA 611.A N LEU 559.A O no hydrogen 3.232 N/A VAL 612.A N LEU 572.A O no hydrogen 2.884 N/A VAL 613.A N PHE 561.A O no hydrogen 2.941 N/A THR 616.A N ASN 614.A OD1 no hydrogen 3.031 N/A THR 616.A OG1 ASN 614.A OD1 no hydrogen 2.692 N/A GLY 618.A N ASN 614.A O no hydrogen 3.038 N/A THR 619.A N ASP 615.A O no hydrogen 2.759 N/A THR 619.A OG1 SER 855.A OG no hydrogen 3.117 N/A MET 620.A N THR 616.A O no hydrogen 2.806 N/A MET 621.A N VAL 617.A O no hydrogen 3.093 N/A THR 622.A N GLY 618.A O no hydrogen 2.933 N/A THR 622.A OG1 GLY 618.A O no hydrogen 3.038 N/A THR 622.A OG1 GLY 854.A O no hydrogen 2.774 N/A CYS 623.A N THR 619.A O no hydrogen 3.094 N/A CYS 623.A SG THR 619.A O no hydrogen 3.460 N/A CYS 623.A SG LEU 849.A O no hydrogen 3.496 N/A GLY 624.A N MET 620.A O no hydrogen 2.850 N/A GLU 626.A N CYS 623.A O no hydrogen 3.131 N/A HIS 629.A N ASP 627.A OD1 no hydrogen 2.554 N/A CYS 630.A N ASP 627.A O no hydrogen 2.968 N/A CYS 630.A SG MET 620.A O no hydrogen 3.813 N/A CYS 630.A SG VAL 632.A O no hydrogen 3.705 N/A CYS 630.A SG THR 815.A O no hydrogen 4.045 N/A GLU 631.A N THR 815.A O no hydrogen 3.337 N/A GLY 633.A N CYS 643.A O no hydrogen 2.696 N/A LEU 634.A N GLY 817.A O no hydrogen 2.988 N/A ILE 635.A N ASN 641.A O no hydrogen 2.814 N/A VAL 636.A N ASP 819.A O no hydrogen 3.040 N/A GLY 637.A N GLY 639.A O no hydrogen 2.982 N/A SER 640.A N GLU 700.A OE1 no hydrogen 2.937 N/A SER 640.A OG ILE 635.A O no hydrogen 2.835 N/A ASN 641.A N ILE 635.A O no hydrogen 3.128 N/A ASN 641.A ND2 ASN 614.A OD1 no hydrogen 3.056 N/A ASN 641.A ND2 ASN 664.A OD1 no hydrogen 2.843 N/A CYS 643.A N GLY 633.A O no hydrogen 3.098 N/A CYS 643.A SG THR 616.A OG1 no hydrogen 3.321 N/A TYR 644.A N VAL 663.A O no hydrogen 3.098 N/A TYR 644.A OH GLU 646.A OE1 no hydrogen 2.818 N/A MET 645.A N GLU 631.A O no hydrogen 3.220 N/A GLU 646.A N MET 661.A O no hydrogen 2.861 N/A GLU 647.A N GLU 646.A OE2 no hydrogen 3.075 N/A MET 648.A N GLY 659.A O no hydrogen 3.207 N/A ASN 650.A N GLU 647.A O no hydrogen 3.060 N/A ASN 650.A ND2 GLU 646.A OE2 no hydrogen 2.506 N/A VAL 651.A N GLU 647.A O no hydrogen 3.046 N/A VAL 654.A N VAL 651.A O no hydrogen 3.286 N/A MET 661.A N GLU 646.A O no hydrogen 3.097 N/A CYS 662.A N VAL 493.A O no hydrogen 2.790 N/A CYS 662.A SG TYR 644.A O no hydrogen 3.917 N/A VAL 663.A N TYR 644.A O no hydrogen 2.773 N/A ASN 664.A N LEU 489.A O no hydrogen 2.920 N/A ASN 664.A ND2 GLU 666.A OE2 no hydrogen 3.079 N/A MET 665.A N ALA 642.A O no hydrogen 2.953 N/A GLU 666.A N ASN 664.A OD1 no hydrogen 3.371 N/A TRP 667.A N ASN 641.A OD1 no hydrogen 3.102 N/A TRP 667.A NE1 SER 640.A OG no hydrogen 3.275 N/A PHE 670.A N TRP 667.A O no hydrogen 2.792 N/A ASP 672.A N ALA 669.A O no hydrogen 2.799 N/A ASN 673.A ND2 GLU 471.A OE2 no hydrogen 3.171 N/A GLY 674.A N GLY 671.A O no hydrogen 3.246 N/A CYS 675.A N ASN 673.A OD1 no hydrogen 3.179 N/A CYS 675.A SG ASN 673.A OD1 no hydrogen 3.264 N/A ASP 677.A N GLY 674.A O no hydrogen 3.107 N/A ASP 678.A N ASP 678.A OD1 no hydrogen 2.529 N/A PHE 679.A N LEU 676.A O no hydrogen 2.848 N/A THR 681.A N ASP 684.A OD2 no hydrogen 2.923 N/A THR 681.A OG1 ASP 684.A OD2 no hydrogen 2.720 N/A PHE 683.A N THR 681.A OG1 no hydrogen 3.328 N/A ASP 684.A N THR 681.A OG1 no hydrogen 3.314 N/A VAL 685.A N THR 681.A O no hydrogen 3.003 N/A ALA 686.A N GLU 682.A O no hydrogen 3.154 N/A VAL 687.A N PHE 683.A O no hydrogen 3.077 N/A ASP 688.A N ASP 684.A O no hydrogen 3.027 N/A GLU 689.A N VAL 685.A O no hydrogen 2.783 N/A LEU 690.A N ALA 686.A O no hydrogen 3.173 N/A SER 691.A N ASP 688.A O no hydrogen 2.985 N/A SER 691.A OG ASP 688.A O no hydrogen 2.464 N/A GLY 695.A N ASP 688.A OD1 no hydrogen 2.961 N/A GLY 695.A N ASP 688.A OD2 no hydrogen 3.204 N/A LYS 696.A N ASN 693.A O no hydrogen 3.157 N/A GLN 697.A N ASP 672.A OD2 no hydrogen 3.144 N/A GLN 697.A NE2 GLU 700.A OE2 no hydrogen 2.801 N/A ARG 698.A N ASP 672.A OD1 no hydrogen 3.000 N/A ARG 698.A NE ASP 688.A OD2 no hydrogen 3.324 N/A ARG 698.A NH1 GLY 671.A O no hydrogen 3.349 N/A GLU 700.A N GLY 668.A O no hydrogen 3.082 N/A LYS 701.A N GLN 697.A O no hydrogen 2.932 N/A LYS 701.A NZ ASP 688.A OD1 no hydrogen 2.823 N/A LYS 701.A NZ ASN 693.A O no hydrogen 2.693 N/A LYS 701.A NZ ASN 693.A OD1 no hydrogen 3.136 N/A LYS 701.A NZ LYS 696.A O no hydrogen 2.495 N/A MET 702.A N PHE 699.A O no hydrogen 2.858 N/A ILE 703.A N GLU 700.A O no hydrogen 2.987 N/A SER 704.A N GLU 700.A O no hydrogen 2.920 N/A SER 704.A OG THR 638.A O no hydrogen 2.979 N/A SER 704.A OG GLU 700.A O no hydrogen 3.067 N/A GLY 705.A N GLY 637.A O no hydrogen 2.702 N/A MET 706.A N THR 638.A O no hydrogen 3.263 N/A TYR 707.A N SER 704.A O no hydrogen 2.996 N/A LEU 708.A N SER 704.A O no hydrogen 3.240 N/A GLU 710.A N TYR 707.A O no hydrogen 2.870 N/A ILE 711.A N TYR 707.A O no hydrogen 3.147 N/A VAL 712.A N LEU 708.A O no hydrogen 2.890 N/A ARG 713.A N GLY 709.A O no hydrogen 2.765 N/A ARG 713.A NE GLU 710.A OE1 no hydrogen 3.280 N/A ARG 713.A NE GLU 710.A OE2 no hydrogen 3.327 N/A ARG 713.A NH1 LEU 734.A O no hydrogen 2.769 N/A ARG 713.A NH2 GLU 710.A OE1 no hydrogen 3.048 N/A ASN 714.A N GLU 710.A O no hydrogen 2.987 N/A ASN 714.A ND2 GLU 710.A O no hydrogen 2.764 N/A ILE 715.A N ILE 711.A O no hydrogen 3.039 N/A LEU 716.A N VAL 712.A O no hydrogen 2.814 N/A ILE 717.A N ARG 713.A O no hydrogen 2.923 N/A ASP 718.A N ASN 714.A O no hydrogen 3.021 N/A PHE 719.A N ILE 715.A O no hydrogen 2.823 N/A THR 720.A N LEU 716.A O no hydrogen 2.941 N/A THR 720.A OG1 ILE 717.A O no hydrogen 3.172 N/A LYS 721.A N ILE 717.A O no hydrogen 3.060 N/A ARG 722.A N ASP 718.A O no hydrogen 3.051 N/A ARG 722.A N PHE 719.A O no hydrogen 2.857 N/A ARG 722.A NH2 THR 450.A OG1 no hydrogen 3.196 N/A GLY 723.A N THR 720.A O no hydrogen 2.841 N/A LEU 724.A N PHE 719.A O no hydrogen 2.972 N/A PHE 726.A N ASP 773.A OD1 no hydrogen 3.049 N/A GLY 728.A N LEU 725.A O no hydrogen 3.048 N/A ARG 729.A N PHE 726.A O no hydrogen 3.078 N/A ARG 733.A NE LEU 765.A O no hydrogen 2.920 N/A ARG 733.A NH2 LEU 765.A O no hydrogen 3.226 N/A LEU 734.A N SER 731.A O no hydrogen 2.848 N/A LYS 735.A N SER 731.A O no hydrogen 3.378 N/A THR 736.A OG1 GLU 732.A O no hydrogen 3.457 N/A ARG 737.A NH1 LEU 690.A O no hydrogen 3.155 N/A ARG 737.A NH2 LEU 690.A O no hydrogen 3.432 N/A GLY 738.A N GLU 710.A OE2 no hydrogen 2.746 N/A GLU 741.A N ILE 739.A O no hydrogen 3.102 N/A SER 746.A N THR 742.A O no hydrogen 3.096 N/A SER 746.A OG THR 742.A O no hydrogen 2.643 N/A GLN 747.A N LYS 743.A O no hydrogen 3.136 N/A SER 750.A N GLN 747.A O no hydrogen 2.821 N/A LEU 753.A N SER 750.A O no hydrogen 3.301 N/A ALA 754.A N GLN 757.A OE1 no hydrogen 2.859 N/A VAL 758.A N ALA 754.A O no hydrogen 3.026 N/A ARG 759.A N LEU 755.A O no hydrogen 2.728 N/A ARG 759.A NE SER 769.A O no hydrogen 2.860 N/A ARG 759.A NH1 ASP 228.A OD1 no hydrogen 3.170 N/A ARG 759.A NH1 ASP 228.A OD2 no hydrogen 3.493 N/A ARG 759.A NH2 GLU 768.A OE2 no hydrogen 3.233 N/A ALA 760.A N LEU 756.A O no hydrogen 2.586 N/A ILE 761.A N GLN 757.A O no hydrogen 3.240 N/A LEU 762.A N VAL 758.A O no hydrogen 3.302 N/A GLN 763.A N ARG 759.A O no hydrogen 2.887 N/A HIS 764.A N ALA 760.A O no hydrogen 2.627 N/A HIS 764.A ND1 HIS 764.A O no hydrogen 3.057 N/A LEU 765.A N ILE 761.A O no hydrogen 2.991 N/A LEU 765.A N LEU 762.A O no hydrogen 3.301 N/A GLY 766.A N GLN 763.A O no hydrogen 2.910 N/A LEU 767.A N LEU 762.A O no hydrogen 3.247 N/A SER 769.A OG LEU 767.A O no hydrogen 2.976 N/A THR 770.A N ASP 773.A OD2 no hydrogen 3.211 N/A CYS 771.A N GLU 229.A OE2 no hydrogen 3.366 N/A CYS 771.A SG GLU 229.A OE2 no hydrogen 3.844 N/A ASP 772.A N THR 770.A OG1 no hydrogen 2.954 N/A ASP 773.A N THR 770.A OG1 no hydrogen 3.161 N/A SER 774.A N THR 770.A O no hydrogen 2.963 N/A SER 774.A OG THR 770.A O no hydrogen 3.034 N/A VAL 777.A N ASP 773.A O no hydrogen 3.198 N/A LYS 778.A N SER 774.A O no hydrogen 3.115 N/A GLU 779.A N ILE 775.A O no hydrogen 3.245 N/A VAL 780.A N ILE 776.A O no hydrogen 2.770 N/A CYS 781.A N VAL 777.A O no hydrogen 3.069 N/A CYS 781.A SG VAL 777.A O no hydrogen 3.349 N/A THR 782.A N LYS 778.A O no hydrogen 2.987 N/A THR 782.A OG1 LYS 778.A O no hydrogen 2.446 N/A VAL 783.A N GLU 779.A O no hydrogen 2.857 N/A VAL 784.A N VAL 780.A O no hydrogen 3.157 N/A ALA 785.A N CYS 781.A O no hydrogen 2.899 N/A ARG 786.A N THR 782.A O no hydrogen 2.772 N/A ARG 787.A N VAL 783.A O no hydrogen 3.080 N/A ARG 787.A NH1 ASP 684.A OD2 no hydrogen 3.033 N/A ARG 787.A NH2 ASP 684.A OD1 no hydrogen 2.914 N/A ALA 788.A N VAL 784.A O no hydrogen 3.171 N/A ALA 789.A N ALA 785.A O no hydrogen 2.971 N/A GLN 790.A N ARG 786.A O no hydrogen 3.003 N/A LEU 791.A N ARG 787.A O no hydrogen 2.760 N/A CYS 792.A N ALA 788.A O no hydrogen 2.872 N/A GLY 793.A N ALA 789.A O no hydrogen 2.949 N/A ALA 794.A N GLN 790.A O no hydrogen 2.898 N/A GLY 795.A N LEU 791.A O no hydrogen 2.866 N/A MET 796.A N CYS 792.A O no hydrogen 2.954 N/A ALA 797.A N GLY 793.A O no hydrogen 2.897 N/A ALA 798.A N ALA 794.A O no hydrogen 3.249 N/A VAL 799.A N GLY 795.A O no hydrogen 3.330 N/A VAL 799.A N MET 796.A O no hydrogen 2.739 N/A VAL 800.A N MET 796.A O no hydrogen 3.001 N/A ASP 801.A N ALA 797.A O no hydrogen 3.112 N/A ARG 802.A N ALA 798.A O no hydrogen 3.131 N/A ILE 803.A N VAL 799.A O no hydrogen 3.162 N/A ARG 804.A N VAL 800.A O no hydrogen 2.962 N/A ARG 804.A NE ASP 801.A OD1 no hydrogen 3.023 N/A ARG 804.A NH1 LEU 809.A O no hydrogen 3.444 N/A ARG 804.A NH2 ASP 801.A OD1 no hydrogen 3.324 N/A GLU 805.A N ASP 801.A O no hydrogen 3.005 N/A ASN 806.A N ARG 802.A O no hydrogen 2.871 N/A ASN 806.A ND2 GLU 646.A OE1 no hydrogen 3.139 N/A ARG 807.A N ILE 803.A O no hydrogen 3.271 N/A ARG 807.A NE GLU 647.A OE1 no hydrogen 3.281 N/A ARG 807.A NH1 GLU 631.A OE2 no hydrogen 3.295 N/A ARG 807.A NH2 GLU 631.A OE1 no hydrogen 3.326 N/A GLY 808.A N GLU 805.A O no hydrogen 3.325 N/A LEU 812.A N LYS 843.A O no hydrogen 3.131 N/A VAL 814.A N ASP 845.A O no hydrogen 3.195 N/A THR 815.A N HIS 629.A O no hydrogen 3.335 N/A THR 815.A OG1 ASP 627.A OD2 no hydrogen 2.839 N/A VAL 816.A N SER 847.A O no hydrogen 2.710 N/A GLY 817.A N VAL 632.A O no hydrogen 2.873 N/A VAL 818.A N LEU 849.A O no hydrogen 2.869 N/A ASP 819.A N LEU 634.A O no hydrogen 3.247 N/A GLY 820.A N ASP 819.A OD1 no hydrogen 2.713 N/A TYR 823.A N VAL 636.A O no hydrogen 3.146 N/A TYR 823.A OH HIS 834.A NE2 no hydrogen 2.742 N/A LYS 824.A N GLY 820.A O no hydrogen 3.207 N/A LYS 824.A NZ ASP 819.A OD1 no hydrogen 3.408 N/A LYS 824.A NZ SER 851.A O no hydrogen 2.741 N/A LEU 825.A N THR 821.A O no hydrogen 2.958 N/A HIS 826.A N LEU 822.A O no hydrogen 3.083 N/A HIS 828.A N HIS 826.A ND1 no hydrogen 3.327 N/A HIS 828.A ND1 GLU 749.A OE2 no hydrogen 2.770 N/A HIS 828.A NE2 ASP 751.A OD1 no hydrogen 2.764 N/A PHE 829.A N HIS 826.A ND1 no hydrogen 3.069 N/A VAL 832.A N HIS 828.A O no hydrogen 2.864 N/A MET 833.A N PHE 829.A O no hydrogen 3.082 N/A HIS 834.A N ALA 830.A O no hydrogen 3.088 N/A HIS 834.A NE2 TYR 823.A OH no hydrogen 2.742 N/A GLU 835.A N LYS 831.A O no hydrogen 2.751 N/A THR 836.A N VAL 832.A O no hydrogen 3.019 N/A THR 836.A OG1 VAL 832.A O no hydrogen 2.326 N/A VAL 837.A N MET 833.A O no hydrogen 2.938 N/A LYS 838.A N HIS 834.A O no hydrogen 3.107 N/A ASP 839.A N GLU 835.A O no hydrogen 3.046 N/A LEU 840.A N THR 836.A O no hydrogen 2.988 N/A ALA 841.A N VAL 837.A O no hydrogen 2.794 N/A CYS 844.A N ALA 841.A O no hydrogen 3.166 N/A CYS 844.A SG ASP 801.A OD1 no hydrogen 3.408 N/A ASP 845.A N LEU 812.A O no hydrogen 2.569 N/A SER 847.A N VAL 814.A O no hydrogen 2.867 N/A LEU 849.A N VAL 816.A O no hydrogen 2.812 N/A SER 851.A N VAL 818.A O no hydrogen 2.757 N/A SER 851.A OG ASP 819.A OD2 no hydrogen 3.548 N/A SER 855.A OG ASP 615.A O no hydrogen 3.203 N/A SER 855.A OG THR 619.A OG1 no hydrogen 3.117 N/A LYS 857.A NZ ASP 853.A OD2 no hydrogen 3.282 N/A GLY 858.A N THR 622.A OG1 no hydrogen 3.040 N/A ALA 859.A N SER 855.A O no hydrogen 2.993 N/A ALA 860.A N GLY 856.A O no hydrogen 3.147 N/A LEU 861.A N LYS 857.A O no hydrogen 3.098 N/A LEU 861.A N GLY 858.A O no hydrogen 3.266 N/A ILE 862.A N GLY 858.A O no hydrogen 3.261 N/A ILE 862.A N ALA 859.A O no hydrogen 3.160 N/A THR 863.A N ALA 859.A O no hydrogen 3.188 N/A THR 863.A OG1 ALA 859.A O no hydrogen 3.056 N/A ALA 864.A N ALA 860.A O no hydrogen 3.079 N/A VAL 865.A N LEU 861.A O no hydrogen 3.085 N/A ALA 866.A N ILE 862.A O no hydrogen 2.833 N/A CYS 867.A N THR 863.A O no hydrogen 2.701 N/A CYS 867.A SG THR 863.A O no hydrogen 3.209 N/A ARG 868.A N ALA 864.A O no hydrogen 3.085 N/A ILE 869.A N VAL 865.A O no hydrogen 3.090 N/A ARG 870.A N ALA 866.A O no hydrogen 3.099 N/A ARG 870.A NH2 ASP 608.A OD2 no hydrogen 2.866 N/A