Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2zuf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NH2 LEU 29.A O no hydrogen 3.413 N/A GLU 6.A N GLU 3.A O no hydrogen 2.753 N/A SER 7.A N ILE 4.A O no hydrogen 3.195 N/A VAL 8.A N ILE 4.A O no hydrogen 3.441 N/A LYS 9.A N ARG 5.A O no hydrogen 3.052 N/A LYS 9.A NZ GLU 6.A OE2 no hydrogen 3.228 N/A GLU 10.A N GLU 6.A O no hydrogen 3.044 N/A ARG 11.A N SER 7.A O no hydrogen 2.981 N/A ARG 11.A NE ASN 70.A O no hydrogen 2.931 N/A ILE 12.A N VAL 8.A O no hydrogen 3.159 N/A GLU 13.A N LYS 9.A O no hydrogen 2.855 N/A GLU 14.A N GLU 10.A O no hydrogen 3.147 N/A GLU 14.A N ARG 11.A O no hydrogen 3.002 N/A ILE 15.A N ARG 11.A O no hydrogen 3.209 N/A ILE 16.A N ILE 12.A O no hydrogen 3.111 N/A LYS 17.A N GLU 13.A O no hydrogen 3.329 N/A GLU 18.A N GLU 14.A O no hydrogen 3.242 N/A ILE 19.A N ILE 15.A O no hydrogen 3.058 N/A TRP 23.A N ALA 20.A O no hydrogen 2.999 N/A LYS 30.A N GLY 41.A O no hydrogen 2.816 N/A THR 32.A N ASP 39.A O no hydrogen 3.454 N/A THR 32.A OG1 ASP 34.A O no hydrogen 3.073 N/A THR 32.A OG1 GLY 38.A O no hydrogen 2.364 N/A LYS 36.A N ASP 34.A OD1 no hydrogen 2.766 N/A LEU 37.A N ASP 34.A O no hydrogen 2.773 N/A GLY 38.A N PRO 35.A O no hydrogen 2.995 N/A ASP 39.A N VAL 87.A O no hydrogen 3.074 N/A GLY 41.A N LYS 30.A O no hydrogen 2.822 N/A THR 42.A N ILE 85.A O no hydrogen 2.945 N/A THR 42.A OG1 GLU 28.A O no hydrogen 3.395 N/A ILE 44.A N THR 42.A OG1 no hydrogen 2.826 N/A PHE 46.A N PRO 43.A O no hydrogen 2.989 N/A LYS 47.A N ILE 44.A O no hydrogen 2.844 N/A LEU 48.A N ILE 44.A O no hydrogen 3.093 N/A ALA 49.A N ALA 45.A O no hydrogen 2.758 N/A LEU 52.A N LEU 48.A O no hydrogen 3.196 N/A LYS 53.A N LYS 50.A O no hydrogen 3.239 N/A ILE 59.A N PRO 55.A O no hydrogen 3.277 N/A ALA 60.A N PRO 56.A O no hydrogen 2.833 N/A GLU 61.A N ILE 57.A O no hydrogen 2.991 N/A LYS 62.A N GLU 58.A O no hydrogen 2.953 N/A ILE 63.A N ILE 59.A O no hydrogen 3.014 N/A VAL 64.A N ALA 60.A O no hydrogen 3.163 N/A GLU 65.A N GLU 61.A O no hydrogen 2.967 N/A LYS 66.A N LYS 62.A O no hydrogen 3.346 N/A LEU 67.A N ILE 63.A O no hydrogen 3.006 N/A LYS 68.A N VAL 64.A O no hydrogen 3.024 N/A LYS 68.A N GLU 65.A O no hydrogen 3.272 N/A ASN 70.A N LEU 67.A O no hydrogen 2.948 N/A ILE 75.A N PRO 72.A O no hydrogen 3.060 N/A LYS 76.A N PHE 88.A O no hydrogen 2.663 N/A ASP 77.A N PHE 88.A O no hydrogen 3.352 N/A LYS 79.A N ASN 86.A O no hydrogen 2.921 N/A VAL 81.A N TYR 84.A O no hydrogen 2.693 N/A TYR 84.A N VAL 81.A O no hydrogen 2.740 N/A ILE 85.A N THR 42.A O no hydrogen 3.141 N/A ASN 86.A N LYS 79.A O no hydrogen 3.055 N/A VAL 87.A N PHE 40.A O no hydrogen 2.927 N/A PHE 88.A N ASP 77.A O no hydrogen 2.657 N/A ILE 89.A N ASP 39.A OD2 no hydrogen 2.937 N/A ASP 90.A N GLY 74.A O no hydrogen 2.741 N/A TYR 91.A OH ASP 39.A OD1 no hydrogen 2.407 N/A ALA 95.A N TYR 91.A O no hydrogen 2.641 N/A ARG 96.A N PRO 92.A O no hydrogen 3.217 N/A ARG 96.A NH1 PHE 533.A O no hydrogen 3.555 N/A ARG 96.A NH2 PHE 533.A O no hydrogen 3.219 N/A ARG 96.A NH2 ALA 536.A O no hydrogen 2.737 N/A ILE 97.A N HIS 93.A O no hydrogen 2.872 N/A LEU 98.A N PHE 94.A O no hydrogen 3.052 N/A ILE 99.A N ALA 95.A O no hydrogen 2.996 N/A ASN 100.A N ARG 96.A O no hydrogen 3.007 N/A ASP 101.A N ILE 97.A O no hydrogen 3.069 N/A ILE 102.A N LEU 98.A O no hydrogen 2.928 N/A LEU 103.A N ILE 99.A O no hydrogen 2.977 N/A ALA 104.A N ASN 100.A O no hydrogen 2.952 N/A LYS 105.A N ASP 101.A O no hydrogen 2.984 N/A GLY 106.A N ILE 102.A O no hydrogen 2.871 N/A ARG 108.A N LYS 105.A O no hydrogen 3.096 N/A PHE 109.A N GLY 106.A O no hydrogen 2.952 N/A SER 111.A N ARG 108.A O no hydrogen 2.842 N/A SER 111.A OG ARG 108.A O no hydrogen 2.980 N/A SER 112.A N PHE 153.A O no hydrogen 3.067 N/A SER 112.A OG GLU 560.A OE1 no hydrogen 3.045 N/A ILE 114.A N SER 112.A OG no hydrogen 3.081 N/A GLY 115.A N LEU 154.A O no hydrogen 2.902 N/A LYS 116.A N GLU 113.A O no hydrogen 2.951 N/A LYS 116.A NZ GLU 113.A OE1 no hydrogen 3.414 N/A LYS 118.A N GLY 115.A O no hydrogen 2.983 N/A LYS 119.A NZ GLU 159.A OE1 no hydrogen 2.489 N/A LYS 119.A NZ GLY 373.A O no hydrogen 2.945 N/A VAL 120.A N GLU 157.A O no hydrogen 2.682 N/A ILE 121.A N ILE 377.A O no hydrogen 2.977 N/A VAL 122.A N GLU 159.A O no hydrogen 2.794 N/A GLU 123.A N ILE 379.A O no hydrogen 3.009 N/A HIS 124.A N GLN 161.A O no hydrogen 3.304 N/A HIS 124.A ND1 THR 125.A OG1 no hydrogen 2.772 N/A THR 125.A N ASN 140.A OD1 no hydrogen 2.733 N/A THR 125.A OG1 HIS 124.A ND1 no hydrogen 2.772 N/A THR 125.A OG1 TYR 263.A OH no hydrogen 2.728 N/A SER 126.A N ASN 162.A OD1 no hydrogen 2.974 N/A SER 126.A OG GLU 123.A OE2 no hydrogen 3.040 N/A SER 126.A OG HIS 124.A O no hydrogen 3.491 N/A THR 130.A N ASN 128.A O no hydrogen 2.637 N/A LYS 131.A NZ GLN 170.A OE1 no hydrogen 3.328 N/A HIS 134.A N HIS 137.A ND1 no hydrogen 2.889 N/A ALA 138.A N HIS 134.A O no hydrogen 2.955 N/A ARG 139.A N MET 135.A O no hydrogen 2.817 N/A ARG 139.A NH1 LYS 486.A O no hydrogen 3.557 N/A ARG 139.A NH2 GLU 415.A O no hydrogen 2.717 N/A ARG 139.A NH2 LYS 486.A O no hydrogen 2.780 N/A ASN 140.A N GLY 136.A O no hydrogen 3.284 N/A ASN 140.A ND2 VAL 381.A O no hydrogen 3.128 N/A ASN 140.A ND2 TYR 414.A OH no hydrogen 2.929 N/A ALA 141.A N HIS 137.A O no hydrogen 2.841 N/A ILE 142.A N ALA 138.A O no hydrogen 2.844 N/A LEU 143.A N ARG 139.A O no hydrogen 3.023 N/A GLY 144.A N ASN 140.A O no hydrogen 3.008 N/A ASP 145.A N ALA 141.A O no hydrogen 2.878 N/A VAL 146.A N ILE 142.A O no hydrogen 2.809 N/A MET 147.A N LEU 143.A O no hydrogen 3.135 N/A ALA 148.A N GLY 144.A O no hydrogen 2.987 N/A ARG 149.A N ASP 145.A O no hydrogen 3.099 N/A ARG 149.A NE ASP 145.A OD2 no hydrogen 2.622 N/A ARG 149.A NH1 TYR 618.A O no hydrogen 3.156 N/A ARG 149.A NH2 GLY 260.A O no hydrogen 2.834 N/A ILE 150.A N VAL 146.A O no hydrogen 2.800 N/A LEU 151.A N MET 147.A O no hydrogen 2.795 N/A ARG 152.A N ALA 148.A O no hydrogen 2.937 N/A PHE 153.A N ARG 149.A O no hydrogen 3.030 N/A LEU 154.A N ILE 150.A O no hydrogen 3.040 N/A LEU 154.A N LEU 151.A O no hydrogen 2.994 N/A GLY 155.A N ARG 152.A O no hydrogen 2.869 N/A TYR 156.A N LEU 151.A O no hydrogen 3.097 N/A GLU 157.A N LYS 118.A O no hydrogen 2.855 N/A GLU 159.A N VAL 120.A O no hydrogen 2.758 N/A VAL 160.A N ASP 264.A OD2 no hydrogen 2.735 N/A GLN 161.A N VAL 122.A O no hydrogen 2.698 N/A GLN 161.A NE2 GLU 159.A OE2 no hydrogen 2.709 N/A ASN 162.A N LEU 265.A O no hydrogen 3.007 N/A TYR 163.A N SER 126.A OG no hydrogen 3.048 N/A TYR 163.A OH GLU 269.A OE2 no hydrogen 2.413 N/A ILE 164.A N VAL 267.A O no hydrogen 2.656 N/A ASP 166.A N ILE 164.A O no hydrogen 3.224 N/A ASP 166.A N ASP 166.A OD2 no hydrogen 2.559 N/A LEU 167.A N ASP 165.A OD1 no hydrogen 3.212 N/A ALA 172.A N GLY 168.A O no hydrogen 2.870 N/A GLN 173.A N ILE 169.A O no hydrogen 2.811 N/A VAL 174.A N GLN 170.A O no hydrogen 3.175 N/A TYR 175.A N PHE 171.A O no hydrogen 2.869 N/A TRP 176.A N ALA 172.A O no hydrogen 3.029 N/A TRP 176.A NE1 GLU 226.A OE1 no hydrogen 2.921 N/A GLY 177.A N GLN 173.A O no hydrogen 3.213 N/A TYR 178.A N VAL 174.A O no hydrogen 2.685 N/A LEU 179.A N TYR 175.A O no hydrogen 2.765 N/A ARG 180.A N TRP 176.A O no hydrogen 2.753 N/A ARG 180.A NE GLU 226.A OE1 no hydrogen 3.390 N/A PHE 185.A N LEU 181.A O no hydrogen 2.812 N/A GLU 186.A N LYS 182.A O no hydrogen 3.098 N/A ARG 187.A N GLU 183.A O no hydrogen 3.237 N/A ILE 188.A N GLU 184.A O no hydrogen 3.078 N/A MET 189.A N PHE 185.A O no hydrogen 2.951 N/A ASN 190.A N GLU 186.A O no hydrogen 3.047 N/A GLU 191.A N ARG 187.A O no hydrogen 3.117 N/A LEU 192.A N ILE 188.A O no hydrogen 3.071 N/A ARG 193.A N MET 189.A O no hydrogen 3.004 N/A ARG 195.A N LEU 192.A O no hydrogen 3.025 N/A ARG 195.A NH1 GLU 438.A OE1 no hydrogen 3.233 N/A ARG 195.A NH2 GLU 438.A OE1 no hydrogen 3.298 N/A GLY 196.A N ARG 193.A O no hydrogen 3.220 N/A LYS 198.A NZ ASP 203.A OD2 no hydrogen 2.727 N/A LYS 198.A NZ ALA 251.A O no hydrogen 2.818 N/A LYS 198.A NZ THR 255.A OG1 no hydrogen 2.820 N/A LYS 198.A NZ ASP 437.A OD1 no hydrogen 2.728 N/A ASN 200.A ND2 GLU 247.A OE1 no hydrogen 3.082 N/A ILE 202.A N ASN 200.A O no hydrogen 2.673 N/A HIS 204.A N ASP 203.A OD1 no hydrogen 2.741 N/A HIS 204.A ND1 ASP 203.A OD1 no hydrogen 3.345 N/A HIS 204.A NE2 THR 435.A OG1 no hydrogen 3.212 N/A ALA 205.A N PRO 201.A O no hydrogen 2.996 N/A LEU 206.A N ILE 202.A O no hydrogen 3.054 N/A GLY 207.A N ASP 203.A O no hydrogen 3.053 N/A LEU 208.A N HIS 204.A O no hydrogen 3.014 N/A LEU 209.A N ALA 205.A O no hydrogen 3.017 N/A TYR 210.A N LEU 206.A O no hydrogen 2.788 N/A VAL 213.A N LEU 209.A O no hydrogen 2.850 N/A ASN 214.A N TYR 210.A O no hydrogen 2.869 N/A ARG 215.A N VAL 211.A O no hydrogen 3.046 N/A ARG 215.A NH2 GLU 212.A OE2 no hydrogen 3.119 N/A ARG 216.A N GLU 212.A O no hydrogen 2.870 N/A LEU 217.A N VAL 213.A O no hydrogen 2.920 N/A GLU 218.A N ASN 214.A O no hydrogen 2.909 N/A ASP 219.A N ARG 215.A O no hydrogen 3.042 N/A ASN 220.A N ARG 216.A O no hydrogen 2.775 N/A LEU 223.A N ASN 220.A O no hydrogen 2.798 N/A GLU 224.A N PRO 221.A O no hydrogen 3.309 N/A ASN 225.A N GLU 222.A O no hydrogen 3.156 N/A ASN 225.A ND2 GLU 222.A O no hydrogen 3.137 N/A ILE 227.A N LEU 223.A O no hydrogen 3.127 N/A ARG 228.A N GLU 224.A O no hydrogen 3.009 N/A ASP 229.A N ASN 225.A O no hydrogen 3.026 N/A ILE 230.A N GLU 226.A O no hydrogen 3.099 N/A MET 231.A N ILE 227.A O no hydrogen 2.923 N/A LYS 232.A N ARG 228.A O no hydrogen 2.790 N/A LYS 232.A NZ ASP 229.A OD1 no hydrogen 3.469 N/A LYS 233.A N ASP 229.A O no hydrogen 3.001 N/A LYS 233.A NZ ASP 229.A OD2 no hydrogen 2.946 N/A LEU 234.A N ILE 230.A O no hydrogen 3.033 N/A LEU 234.A N MET 231.A O no hydrogen 3.116 N/A GLU 235.A N MET 231.A O no hydrogen 3.030 N/A SER 236.A N LYS 232.A O no hydrogen 2.986 N/A SER 236.A OG LYS 232.A O no hydrogen 3.333 N/A SER 236.A OG LYS 233.A O no hydrogen 3.404 N/A GLY 237.A N LYS 233.A O no hydrogen 2.987 N/A GLU 238.A N SER 236.A OG no hydrogen 3.188 N/A LEU 239.A N LYS 233.A O no hydrogen 2.752 N/A ALA 245.A N GLY 241.A O no hydrogen 3.112 N/A GLU 246.A N ARG 242.A O no hydrogen 2.691 N/A GLU 247.A N LYS 243.A O no hydrogen 3.293 N/A VAL 248.A N LEU 244.A O no hydrogen 3.089 N/A VAL 249.A N ALA 245.A O no hydrogen 2.809 N/A ARG 250.A N GLU 246.A O no hydrogen 2.926 N/A ARG 250.A NH1 TRP 354.A O no hydrogen 2.731 N/A ARG 250.A NH2 TRP 354.A O no hydrogen 3.092 N/A ALA 251.A N GLU 247.A O no hydrogen 3.090 N/A GLN 252.A N VAL 248.A O no hydrogen 2.906 N/A GLN 252.A NE2 ASN 128.A O no hydrogen 3.332 N/A GLN 252.A NE2 LYS 131.A O no hydrogen 2.907 N/A MET 253.A N VAL 249.A O no hydrogen 2.893 N/A VAL 254.A N ARG 250.A O no hydrogen 2.980 N/A VAL 254.A N ALA 251.A O no hydrogen 3.027 N/A THR 255.A N ALA 251.A O no hydrogen 3.392 N/A THR 255.A OG1 ALA 251.A O no hydrogen 3.424 N/A THR 255.A OG1 ASP 437.A OD1 no hydrogen 3.288 N/A THR 255.A OG1 ASP 437.A OD2 no hydrogen 2.687 N/A THR 256.A N GLN 252.A O no hydrogen 3.018 N/A THR 256.A OG1 GLN 252.A O no hydrogen 3.496 N/A THR 256.A OG1 MET 253.A O no hydrogen 3.071 N/A TYR 257.A N MET 253.A O no hydrogen 2.830 N/A TYR 257.A OH ASP 355.A OD2 no hydrogen 2.480 N/A LYS 258.A N VAL 254.A O no hydrogen 3.131 N/A LYS 258.A NZ GLU 468.A OE2 no hydrogen 3.355 N/A LEU 259.A N THR 255.A O no hydrogen 3.322 N/A GLY 260.A N TYR 257.A O no hydrogen 2.894 N/A VAL 261.A N THR 256.A O no hydrogen 2.871 N/A TYR 263.A OH THR 125.A OG1 no hydrogen 2.728 N/A ASP 264.A N VAL 160.A O no hydrogen 2.974 N/A LEU 265.A N VAL 160.A O no hydrogen 3.169 N/A LEU 266.A N TRP 359.A O no hydrogen 2.840 N/A VAL 267.A N ASN 162.A O no hydrogen 2.890 N/A TRP 268.A N THR 361.A OG1 no hydrogen 3.090 N/A TRP 268.A NE1 THR 360.A OG1 no hydrogen 2.849 N/A GLU 269.A N ILE 164.A O no hydrogen 2.779 N/A SER 270.A N ASP 166.A OD2 no hydrogen 2.988 N/A SER 270.A OG ASP 166.A OD1 no hydrogen 2.623 N/A SER 270.A OG ASP 166.A OD2 no hydrogen 3.545 N/A ASP 271.A N TRP 268.A O no hydrogen 3.080 N/A ILE 272.A N TRP 268.A O no hydrogen 3.123 N/A ILE 272.A N GLU 269.A O no hydrogen 2.763 N/A VAL 273.A N GLU 269.A O no hydrogen 3.027 N/A ARG 274.A N SER 270.A O no hydrogen 3.157 N/A ARG 275.A N ASP 271.A O no hydrogen 3.146 N/A ARG 275.A NE ASP 348.A O no hydrogen 2.713 N/A ARG 275.A NH2 ASP 348.A O no hydrogen 2.850 N/A LYS 276.A N VAL 273.A O no hydrogen 2.873 N/A LYS 276.A NZ VAL 273.A O no hydrogen 3.440 N/A LEU 277.A N ILE 272.A O no hydrogen 3.064 N/A ILE 280.A N LYS 276.A O no hydrogen 3.255 N/A ALA 281.A N LEU 277.A O no hydrogen 3.105 N/A LEU 282.A N PHE 278.A O no hydrogen 2.989 N/A GLU 283.A N GLU 279.A O no hydrogen 3.154 N/A LEU 284.A N ILE 280.A O no hydrogen 3.400 N/A LEU 285.A N ALA 281.A O no hydrogen 2.902 N/A SER 286.A N LEU 282.A O no hydrogen 2.706 N/A SER 286.A OG LEU 282.A O no hydrogen 2.967 N/A LYS 287.A N LEU 284.A O no hydrogen 3.320 N/A ASN 288.A N LEU 285.A O no hydrogen 2.898 N/A ASN 288.A ND2 LEU 399.A O no hydrogen 3.288 N/A ASN 290.A N ASN 288.A OD1 no hydrogen 2.614 N/A ASN 290.A ND2 ASN 288.A OD1 no hydrogen 2.890 N/A ASN 290.A ND2 LEU 399.A O no hydrogen 3.403 N/A PHE 291.A N ASN 288.A O no hydrogen 3.196 N/A TYR 292.A N VAL 304.A O no hydrogen 3.200 N/A TYR 292.A OH ASP 306.A OD2 no hydrogen 2.513 N/A ARG 300.A NE GLY 297.A O no hydrogen 3.112 N/A GLY 301.A N PRO 294.A O no hydrogen 3.211 N/A ALA 302.A N TYR 299.A O no hydrogen 3.029 N/A PHE 303.A N ARG 322.A O no hydrogen 2.999 N/A VAL 304.A N TYR 292.A O no hydrogen 2.866 N/A MET 305.A N LEU 319.A O no hydrogen 2.702 N/A ASP 306.A N ASN 290.A O no hydrogen 2.864 N/A LEU 307.A N PRO 317.A O no hydrogen 2.870 N/A ARG 308.A N ASP 306.A OD1 no hydrogen 2.849 N/A LEU 310.A N LEU 307.A O no hydrogen 2.958 N/A PHE 311.A N LEU 307.A O no hydrogen 2.763 N/A ASN 316.A ND2 TYR 299.A OH no hydrogen 3.208 N/A ASN 316.A ND2 ILE 318.A O no hydrogen 3.426 N/A LEU 319.A N MET 305.A O no hydrogen 2.932 N/A LEU 321.A N PHE 303.A O no hydrogen 2.741 N/A ARG 322.A N PHE 303.A O no hydrogen 3.035 N/A ARG 323.A N THR 327.A O no hydrogen 2.625 N/A ARG 323.A NH1 ALA 328.A O no hydrogen 2.959 N/A SER 324.A OG ARG 300.A O no hydrogen 2.921 N/A GLY 326.A N ARG 323.A O no hydrogen 3.173 N/A THR 327.A N ASP 325.A OD2 no hydrogen 2.805 N/A THR 327.A OG1 ASP 325.A OD1 no hydrogen 3.276 N/A THR 327.A OG1 ASP 325.A OD2 no hydrogen 2.435 N/A THR 329.A N LEU 321.A O no hydrogen 2.886 N/A THR 329.A OG1 VAL 320.A O no hydrogen 2.644 N/A THR 329.A OG1 LEU 321.A O no hydrogen 2.823 N/A GLY 332.A N THR 329.A OG1 no hydrogen 3.144 N/A LYS 333.A N THR 329.A O no hydrogen 3.103 N/A LYS 333.A NZ GLU 269.A OE1 no hydrogen 2.878 N/A ASP 334.A N TYR 330.A O no hydrogen 2.893 N/A ILE 335.A N THR 331.A O no hydrogen 2.939 N/A ALA 336.A N GLY 332.A O no hydrogen 2.962 N/A TYR 337.A N LYS 333.A O no hydrogen 3.002 N/A TYR 337.A OH GLN 161.A OE1 no hydrogen 2.669 N/A HIS 338.A N ASP 334.A O no hydrogen 3.144 N/A HIS 338.A ND1 ASP 334.A O no hydrogen 2.989 N/A LEU 339.A N ILE 335.A O no hydrogen 2.972 N/A TRP 340.A N ALA 336.A O no hydrogen 3.228 N/A LYS 341.A N TYR 337.A O no hydrogen 2.950 N/A LYS 341.A NZ GLU 123.A OE1 no hydrogen 2.656 N/A LYS 341.A NZ HIS 338.A NE2 no hydrogen 3.136 N/A PHE 342.A N HIS 338.A O no hydrogen 2.970 N/A GLY 343.A N TRP 340.A O no hydrogen 2.817 N/A LYS 344.A N LEU 339.A O no hydrogen 2.664 N/A TYR 351.A N LYS 366.A O no hydrogen 2.786 N/A LYS 352.A N THR 360.A O no hydrogen 2.867 N/A LYS 352.A NZ ASP 364.A OD1 no hydrogen 3.258 N/A LYS 352.A NZ ASP 364.A OD2 no hydrogen 3.223 N/A TRP 354.A N THR 358.A O no hydrogen 2.723 N/A ASP 355.A N THR 358.A O no hydrogen 3.049 N/A THR 358.A OG1 TYR 257.A OH no hydrogen 3.329 N/A THR 358.A OG1 TYR 263.A O no hydrogen 3.135 N/A THR 358.A OG1 ASP 355.A OD2 no hydrogen 3.348 N/A TRP 359.A N ASP 264.A O no hydrogen 3.069 N/A THR 360.A N LYS 352.A O no hydrogen 2.784 N/A THR 360.A OG1 LEU 266.A O no hydrogen 3.531 N/A THR 360.A OG1 THR 361.A O no hydrogen 3.030 N/A THR 361.A N LEU 266.A O no hydrogen 3.063 N/A THR 361.A OG1 ASP 271.A OD2 no hydrogen 3.027 N/A ALA 362.A N LEU 350.A O no hydrogen 2.728 N/A GLY 365.A N ALA 362.A O no hydrogen 2.903 N/A LYS 366.A N TYR 351.A O no hydrogen 2.674 N/A SER 367.A OG ASP 348.A OD2 no hydrogen 2.655 N/A LYS 371.A N MET 368.A O no hydrogen 3.215 N/A GLY 373.A N GLU 159.A OE2 no hydrogen 2.997 N/A ALA 375.A N LYS 341.A O no hydrogen 2.750 N/A ASN 376.A N LYS 119.A O no hydrogen 2.837 N/A ILE 377.A N LYS 119.A O no hydrogen 3.101 N/A VAL 378.A N ASN 408.A O no hydrogen 3.043 N/A ILE 379.A N ILE 121.A O no hydrogen 2.994 N/A ASN 380.A N TYR 410.A O no hydrogen 2.837 N/A ASN 380.A ND2 HIS 338.A NE2 no hydrogen 2.774 N/A VAL 381.A N GLU 123.A O no hydrogen 2.997 N/A ILE 382.A N LEU 412.A O no hydrogen 3.247 N/A ALA 384.A N TYR 414.A O no hydrogen 2.901 N/A GLU 385.A N GLU 385.A OE2 no hydrogen 2.612 N/A GLN 386.A N GLY 383.A O no hydrogen 2.918 N/A GLN 390.A N GLN 386.A O no hydrogen 3.414 N/A LEU 391.A N LYS 387.A O no hydrogen 2.950 N/A ALA 392.A N HIS 388.A O no hydrogen 2.866 N/A ILE 393.A N PRO 389.A O no hydrogen 3.292 N/A LYS 394.A N GLN 390.A O no hydrogen 3.120 N/A LYS 394.A NZ ALA 406.A O no hydrogen 2.883 N/A LYS 394.A NZ LEU 409.A O no hydrogen 3.049 N/A TYR 395.A N LEU 391.A O no hydrogen 2.750 N/A ALA 396.A N ALA 392.A O no hydrogen 2.943 N/A LEU 397.A N ILE 393.A O no hydrogen 3.037 N/A GLN 398.A N LYS 394.A O no hydrogen 3.084 N/A LEU 399.A N TYR 395.A O no hydrogen 2.826 N/A LEU 400.A N ALA 396.A O no hydrogen 3.030 N/A PHE 402.A N LEU 397.A O no hydrogen 2.948 N/A ALA 406.A N PHE 402.A O no hydrogen 2.950 N/A ALA 407.A N GLU 403.A O no hydrogen 2.958 N/A ASN 408.A N ALA 405.A O no hydrogen 2.914 N/A LEU 409.A N ALA 406.A O no hydrogen 3.311 N/A TYR 410.A N VAL 378.A O no hydrogen 2.830 N/A HIS 411.A NE2 ILE 382.A O no hydrogen 3.192 N/A LEU 412.A N ASN 380.A O no hydrogen 2.651 N/A TYR 414.A N ILE 382.A O no hydrogen 3.308 N/A GLU 415.A N PRO 484.A O no hydrogen 2.807 N/A GLU 418.A N ILE 488.A O no hydrogen 2.754 N/A ARG 419.A N GLY 422.A O no hydrogen 2.811 N/A ARG 419.A NH1 PHE 490.A O no hydrogen 2.629 N/A GLY 422.A N ARG 419.A O no hydrogen 2.932 N/A SER 425.A N THR 430.A OG1 no hydrogen 2.700 N/A LYS 428.A N SER 425.A OG no hydrogen 3.298 N/A THR 430.A N SER 425.A O no hydrogen 3.207 N/A VAL 432.A N GLY 429.A O no hydrogen 3.337 N/A PHE 434.A N TRP 431.A O no hydrogen 2.856 N/A THR 435.A N GLU 438.A OE2 no hydrogen 2.993 N/A THR 435.A OG1 HIS 204.A NE2 no hydrogen 3.212 N/A THR 435.A OG1 GLU 438.A OE2 no hydrogen 2.573 N/A VAL 436.A N LEU 133.A O no hydrogen 2.956 N/A GLU 438.A N THR 435.A OG1 no hydrogen 3.273 N/A VAL 439.A N THR 435.A O no hydrogen 2.855 N/A ILE 440.A N VAL 436.A O no hydrogen 2.774 N/A GLN 441.A N ASP 437.A O no hydrogen 3.174 N/A GLU 442.A N GLU 438.A O no hydrogen 3.134 N/A ALA 443.A N VAL 439.A O no hydrogen 3.012 N/A VAL 444.A N ILE 440.A O no hydrogen 3.060 N/A LYS 445.A N GLN 441.A O no hydrogen 3.113 N/A LYS 445.A NZ GLU 442.A OE2 no hydrogen 3.425 N/A ARG 446.A N GLU 442.A O no hydrogen 3.241 N/A ALA 447.A N ALA 443.A O no hydrogen 3.003 N/A ARG 448.A N VAL 444.A O no hydrogen 2.806 N/A ARG 448.A NH1 GLU 452.A OE2 no hydrogen 2.875 N/A GLU 449.A N LYS 445.A O no hydrogen 2.969 N/A LEU 450.A N ARG 446.A O no hydrogen 2.869 N/A ILE 451.A N ALA 447.A O no hydrogen 2.899 N/A GLU 452.A N ARG 448.A O no hydrogen 3.235 N/A GLU 453.A N GLU 449.A O no hydrogen 3.186 N/A LYS 454.A N LEU 450.A O no hydrogen 2.889 N/A ASN 455.A N ILE 451.A O no hydrogen 2.852 N/A ASN 455.A ND2 MET 628.A OXT no hydrogen 3.332 N/A GLU 462.A N SER 459.A OG no hydrogen 3.410 N/A LYS 463.A N SER 459.A O no hydrogen 2.894 N/A LYS 463.A NZ GLU 452.A OE2 no hydrogen 2.565 N/A LYS 463.A NZ PRO 456.A O no hydrogen 3.321 N/A ALA 464.A N ASP 460.A O no hydrogen 2.884 N/A ALA 464.A N GLU 461.A O no hydrogen 3.178 N/A GLU 465.A N GLU 461.A O no hydrogen 3.020 N/A VAL 466.A N GLU 462.A O no hydrogen 2.946 N/A ALA 467.A N LYS 463.A O no hydrogen 3.207 N/A GLU 468.A N ALA 464.A O no hydrogen 3.147 N/A LYS 469.A N GLU 465.A O no hydrogen 3.008 N/A VAL 470.A N VAL 466.A O no hydrogen 2.727 N/A GLY 471.A N ALA 467.A O no hydrogen 2.709 N/A ILE 472.A N GLU 468.A O no hydrogen 2.914 N/A GLY 473.A N LYS 469.A O no hydrogen 3.161 N/A ALA 474.A N VAL 470.A O no hydrogen 2.888 N/A ILE 475.A N GLY 471.A O no hydrogen 3.253 N/A ARG 476.A N ILE 472.A O no hydrogen 2.905 N/A ARG 476.A NE MET 620.A O no hydrogen 2.931 N/A ARG 476.A NH1 ASP 145.A OD2 no hydrogen 3.041 N/A ARG 476.A NH1 LEU 259.A O no hydrogen 2.765 N/A ARG 476.A NH2 ASP 145.A OD2 no hydrogen 2.795 N/A ARG 476.A NH2 MET 620.A O no hydrogen 3.020 N/A TYR 477.A N GLY 473.A O no hydrogen 2.866 N/A TYR 477.A OH ALA 572.A O no hydrogen 2.946 N/A ASN 478.A N ALA 474.A O no hydrogen 3.079 N/A LEU 479.A N ARG 476.A O no hydrogen 3.074 N/A ILE 480.A N TYR 477.A O no hydrogen 3.154 N/A LYS 481.A N TYR 477.A O no hydrogen 2.915 N/A LYS 481.A NZ GLU 501.A O no hydrogen 2.959 N/A LYS 486.A N SER 483.A O no hydrogen 3.129 N/A ILE 488.A N HIS 416.A O no hydrogen 3.088 N/A PHE 490.A N GLU 418.A O no hydrogen 2.640 N/A ASP 494.A N ARG 491.A O no hydrogen 2.792 N/A VAL 495.A N TRP 492.A O no hydrogen 2.774 N/A LEU 496.A N GLU 493.A O no hydrogen 3.283 N/A SER 502.A N GLY 500.A O no hydrogen 2.797 N/A TYR 505.A N SER 502.A OG no hydrogen 3.269 N/A GLN 507.A N ALA 503.A O no hydrogen 2.814 N/A GLN 507.A NE2 LYS 469.A O no hydrogen 2.983 N/A GLN 507.A NE2 GLU 623.A O no hydrogen 2.882 N/A TYR 508.A N PRO 504.A O no hydrogen 2.735 N/A ALA 509.A N TYR 505.A O no hydrogen 3.291 N/A HIS 510.A N ILE 506.A O no hydrogen 3.022 N/A HIS 510.A ND1 PRO 625.A O no hydrogen 3.073 N/A ALA 511.A N GLN 507.A O no hydrogen 2.814 N/A ARG 512.A N TYR 508.A O no hydrogen 2.799 N/A CYS 513.A N ALA 509.A O no hydrogen 3.161 N/A CYS 513.A SG ALA 509.A O no hydrogen 3.388 N/A CYS 513.A SG VAL 606.A O no hydrogen 3.804 N/A SER 514.A N HIS 510.A O no hydrogen 2.980 N/A SER 514.A OG HIS 510.A O no hydrogen 3.531 N/A SER 514.A OG GLU 610.A OE1 no hydrogen 2.928 N/A SER 515.A N ALA 511.A O no hydrogen 2.931 N/A SER 515.A OG ALA 511.A O no hydrogen 2.892 N/A ILE 516.A N ARG 512.A O no hydrogen 3.083 N/A LEU 517.A N CYS 513.A O no hydrogen 3.182 N/A ARG 518.A N SER 514.A O no hydrogen 2.794 N/A ARG 518.A NH2 GLU 626.A O no hydrogen 2.468 N/A LYS 519.A N SER 515.A O no hydrogen 2.720 N/A LYS 519.A NZ GLU 523.A OE2 no hydrogen 2.482 N/A ALA 520.A N ILE 516.A O no hydrogen 2.937 N/A GLU 521.A N LEU 517.A O no hydrogen 3.022 N/A GLU 522.A N ARG 518.A O no hydrogen 3.039 N/A GLU 523.A N ALA 520.A O no hydrogen 3.091 N/A GLY 524.A N GLU 521.A O no hydrogen 2.937 N/A ILE 525.A N ALA 520.A O no hydrogen 3.159 N/A THR 531.A N ASP 528.A OD2 no hydrogen 3.070 N/A THR 531.A OG1 ASP 528.A OD1 no hydrogen 2.869 N/A THR 531.A OG1 ASP 528.A OD2 no hydrogen 2.965 N/A LEU 532.A N ASP 528.A O no hydrogen 3.091 N/A PHE 533.A N PRO 529.A O no hydrogen 2.931 N/A LYS 534.A N GLU 530.A O no hydrogen 3.109 N/A ASN 535.A N THR 531.A O no hydrogen 3.272 N/A ALA 536.A N LEU 532.A O no hydrogen 2.812 N/A ASP 537.A N GLY 597.A O no hydrogen 2.828 N/A THR 539.A N ASP 537.A OD1 no hydrogen 3.220 N/A THR 539.A OG1 ASP 537.A OD1 no hydrogen 2.803 N/A LYS 540.A NZ GLU 595.A OE1 no hydrogen 2.937 N/A SER 542.A N GLU 545.A OE2 no hydrogen 3.400 N/A SER 542.A OG GLU 545.A OE2 no hydrogen 2.907 N/A ARG 544.A NH1 GLU 547.A OE1 no hydrogen 2.656 N/A ARG 546.A N SER 542.A O no hydrogen 3.053 N/A ARG 546.A NH1 LEU 541.A O no hydrogen 2.614 N/A GLU 547.A N GLU 543.A O no hydrogen 2.815 N/A LEU 548.A N ARG 544.A O no hydrogen 2.785 N/A VAL 549.A N GLU 545.A O no hydrogen 3.073 N/A ILE 550.A N ARG 546.A O no hydrogen 3.087 N/A MET 551.A N GLU 547.A O no hydrogen 2.937 N/A LEU 552.A N LEU 548.A O no hydrogen 2.926 N/A SER 553.A N VAL 549.A O no hydrogen 2.954 N/A SER 553.A OG VAL 549.A O no hydrogen 3.570 N/A SER 553.A OG ILE 550.A O no hydrogen 2.564 N/A LYS 554.A N MET 551.A O no hydrogen 2.796 N/A PHE 555.A N LEU 552.A O no hydrogen 3.296 N/A ARG 557.A NH1 SER 553.A O no hydrogen 2.794 N/A ILE 558.A N LYS 554.A O no hydrogen 3.060 N/A VAL 559.A N PHE 555.A O no hydrogen 3.019 N/A GLU 560.A N PRO 556.A O no hydrogen 3.116 N/A GLN 561.A N ARG 557.A O no hydrogen 2.909 N/A ALA 562.A N ILE 558.A O no hydrogen 2.903 N/A GLY 563.A N VAL 559.A O no hydrogen 2.997 N/A LYS 564.A N GLU 560.A O no hydrogen 2.817 N/A ASP 565.A N GLN 561.A O no hydrogen 2.883 N/A VAL 566.A N GLY 563.A O no hydrogen 3.273 N/A LYS 567.A N ALA 562.A O no hydrogen 2.803 N/A LEU 570.A N LYS 567.A O no hydrogen 3.049 N/A ILE 571.A N PRO 568.A O no hydrogen 2.915 N/A TRP 573.A N HIS 569.A O no hydrogen 2.975 N/A PHE 574.A N LEU 570.A O no hydrogen 3.123 N/A ALA 575.A N ILE 571.A O no hydrogen 3.012 N/A ASN 576.A N ALA 572.A O no hydrogen 3.038 N/A GLU 577.A N TRP 573.A O no hydrogen 3.004 N/A LEU 578.A N PHE 574.A O no hydrogen 2.926 N/A ALA 579.A N ALA 575.A O no hydrogen 2.900 N/A SER 580.A N ASN 576.A O no hydrogen 2.812 N/A LEU 581.A N GLU 577.A O no hydrogen 2.930 N/A PHE 582.A N LEU 578.A O no hydrogen 2.975 N/A ASN 583.A N ALA 579.A O no hydrogen 2.823 N/A LYS 584.A N SER 580.A O no hydrogen 2.985 N/A LYS 584.A NZ SER 580.A OG no hydrogen 3.204 N/A PHE 585.A N LEU 581.A O no hydrogen 2.988 N/A TYR 586.A N PHE 582.A O no hydrogen 2.692 N/A MET 587.A N ASN 583.A O no hydrogen 3.366 N/A MET 587.A N LYS 584.A O no hydrogen 3.232 N/A HIS 589.A N PHE 585.A O no hydrogen 2.966 N/A ALA 594.A N VAL 591.A O no hydrogen 3.345 N/A GLY 597.A N GLU 600.A OE1 no hydrogen 2.569 N/A ARG 599.A N GLU 595.A O no hydrogen 2.823 N/A ARG 599.A NH1 LEU 592.A O no hydrogen 3.360 N/A ALA 601.A N GLY 597.A O no hydrogen 3.140 N/A ARG 602.A N VAL 598.A O no hydrogen 2.906 N/A ARG 602.A NE GLU 545.A OE1 no hydrogen 3.416 N/A ARG 602.A NE GLU 545.A OE2 no hydrogen 3.366 N/A ARG 602.A NH1 PRO 590.A O no hydrogen 2.811 N/A ARG 602.A NH2 GLU 545.A OE2 no hydrogen 3.198 N/A LEU 603.A N ARG 599.A O no hydrogen 2.951 N/A LEU 604.A N GLU 600.A O no hydrogen 2.912 N/A LEU 605.A N ALA 601.A O no hydrogen 3.071 N/A VAL 606.A N ARG 602.A O no hydrogen 2.889 N/A MET 607.A N LEU 603.A O no hydrogen 2.930 N/A ALA 608.A N LEU 604.A O no hydrogen 2.968 N/A VAL 609.A N LEU 605.A O no hydrogen 2.926 N/A GLU 610.A N VAL 606.A O no hydrogen 3.040 N/A GLN 611.A N MET 607.A O no hydrogen 3.063 N/A GLN 611.A NE2 ASP 107.A OD1 no hydrogen 2.902 N/A GLN 611.A NE2 GLN 611.A O no hydrogen 3.364 N/A GLN 611.A NE2 ASN 615.A OD1 no hydrogen 2.977 N/A VAL 612.A N ALA 608.A O no hydrogen 2.981 N/A LEU 613.A N VAL 609.A O no hydrogen 2.864 N/A LYS 614.A N GLU 610.A O no hydrogen 2.951 N/A LYS 614.A NZ ASP 107.A OD1 no hydrogen 2.960 N/A ASN 615.A N GLN 611.A O no hydrogen 2.925 N/A ASN 615.A ND2 GLY 106.A O no hydrogen 3.152 N/A ALA 616.A N VAL 612.A O no hydrogen 2.838 N/A LEU 617.A N LEU 613.A O no hydrogen 2.810 N/A TYR 618.A N LYS 614.A O no hydrogen 2.881 N/A LEU 619.A N ASN 615.A O no hydrogen 2.947 N/A MET 620.A N LEU 617.A O no hydrogen 2.970 N/A GLY 621.A N TYR 618.A O no hydrogen 2.759 N/A ILE 622.A N LEU 617.A O no hydrogen 2.862 N/A ARG 627.A NE GLU 462.A OE2 no hydrogen 3.146 N/A ARG 627.A NH2 GLU 462.A OE1 no hydrogen 3.149 N/A