Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7hkz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ASN 1.A O no hydrogen 3.125 N/A GLY 6.A N LEU 2.A O no hydrogen 2.699 N/A LYS 7.A NZ GLU 161.A OE1 no hydrogen 2.972 N/A ARG 8.A NH1 CYS 163.A O no hydrogen 3.140 N/A ARG 8.A NH1 LEU 269.A O no hydrogen 2.852 N/A ARG 8.A NH2 ILE 4.A O no hydrogen 3.119 N/A ARG 8.A NH2 LEU 269.A O no hydrogen 2.826 N/A ILE 9.A N ILE 5.A O no hydrogen 3.030 N/A GLU 10.A N GLY 6.A O no hydrogen 2.565 N/A LYS 11.A N LYS 7.A O no hydrogen 2.987 N/A LYS 11.A NZ GLU 15.A OE1 no hydrogen 3.227 N/A ILE 12.A N ARG 8.A O no hydrogen 3.301 N/A LYS 13.A N ILE 9.A O no hydrogen 2.972 N/A GLN 14.A N GLU 10.A O no hydrogen 3.317 N/A GLU 15.A N ILE 12.A O no hydrogen 3.152 N/A SER 19.A N HIS 16.A O no hydrogen 3.034 N/A HIS 21.A ND1 SER 19.A O no hydrogen 2.894 N/A ASP 23.A N HIS 21.A O no hydrogen 2.939 N/A ASP 25.A N ASP 23.A OD1 no hydrogen 2.528 N/A TYR 28.A OH ASP 286.A OD2 no hydrogen 2.862 N/A THR 30.A N ASP 76.A OD1 no hydrogen 3.013 N/A THR 30.A OG1 ASP 76.A OD1 no hydrogen 2.589 N/A THR 30.A OG1 THR 77.A O no hydrogen 3.496 N/A TRP 31.A NE1 VAL 75.A O no hydrogen 3.263 N/A ALA 32.A N SER 289.A O no hydrogen 2.882 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.595 N/A HIS 34.A NE2 SER 289.A OG no hydrogen 3.055 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.595 N/A SER 36.A OG ASP 286.A OD1 no hydrogen 3.101 N/A TYR 37.A N MET 285.A O no hydrogen 3.254 N/A SER 45.A OG ALA 68.A O no hydrogen 3.169 N/A MET 46.A N SER 436.A O.A no hydrogen 2.977 N/A MET 46.A N SER 436.A O.B no hydrogen 2.913 N/A ASN 48.A N ARG 434.A O no hydrogen 2.726 N/A ASN 48.A ND2 THR 446.A O no hydrogen 3.164 N/A VAL 51.A N ASN 48.A OD1 no hydrogen 3.189 N/A ARG 52.A N ASN 48.A O no hydrogen 3.015 N/A LEU 53.A N GLY 49.A O no hydrogen 2.991 N/A LEU 54.A N VAL 51.A O no hydrogen 3.094 N/A THR 55.A N ARG 52.A O no hydrogen 3.101 N/A THR 55.A OG1 VAL 51.A O no hydrogen 2.819 N/A THR 55.A OG1 ARG 52.A O no hydrogen 3.423 N/A TRP 58.A N THR 55.A O no hydrogen 3.060 N/A ASP 59.A N LYS 56.A O no hydrogen 2.863 N/A ILE 61.A N TRP 58.A O no hydrogen 3.212 N/A VAL 64.A N ILE 61.A O no hydrogen 2.896 N/A THR 65.A N ILE 61.A O no hydrogen 3.028 N/A THR 65.A OG1 ILE 61.A O no hydrogen 3.526 N/A THR 65.A OG1 PRO 62.A O no hydrogen 3.487 N/A GLN 66.A N PRO 62.A O no hydrogen 2.867 N/A MET 67.A N VAL 64.A O no hydrogen 3.324 N/A ALA 68.A N THR 65.A O no hydrogen 3.409 N/A MET 69.A N GLN 66.A O no hydrogen 3.211 N/A LYS 74.A N PHE 71.A O no hydrogen 3.063 N/A THR 77.A OG1 LYS 74.A O no hydrogen 2.667 N/A THR 79.A OG1 THR 238.A O no hydrogen 3.556 N/A LYS 83.A N ASP 378.A OD2 no hydrogen 2.840 N/A THR 86.A OG1 ASP 378.A OD2 no hydrogen 2.452 N/A LYS 87.A N LYS 83.A O no hydrogen 3.035 N/A LYS 87.A NZ GLU 84.A OE2 no hydrogen 2.990 N/A LYS 88.A N GLU 84.A O no hydrogen 2.973 N/A LEU 89.A N GLY 85.A O no hydrogen 3.019 N/A MET 90.A N THR 86.A O no hydrogen 2.937 N/A LYS 91.A N LYS 87.A O no hydrogen 3.036 N/A LYS 91.A NZ GLU 243.A OE2 no hydrogen 3.283 N/A LYS 91.A NZ ASN 247.A OD1 no hydrogen 3.331 N/A ILE 92.A N LYS 88.A O no hydrogen 2.998 N/A THR 93.A N LEU 89.A O no hydrogen 2.931 N/A THR 93.A OG1 LEU 89.A O no hydrogen 2.782 N/A ALA 94.A N MET 90.A O no hydrogen 2.741 N/A GLU 95.A N LYS 91.A O no hydrogen 2.977 N/A TRP 96.A N ILE 92.A O no hydrogen 3.147 N/A LEU 97.A N THR 93.A O no hydrogen 2.892 N/A TRP 98.A N ALA 94.A O no hydrogen 3.004 N/A TRP 98.A NE1 ASN 247.A O no hydrogen 3.106 N/A LYS 99.A N GLU 95.A O no hydrogen 3.366 N/A LYS 99.A NZ GLU 95.A OE2 no hydrogen 3.117 N/A GLU 100.A N TRP 96.A O no hydrogen 3.004 N/A LEU 101.A N LEU 97.A O no hydrogen 2.910 N/A GLY 102.A N TRP 98.A O no hydrogen 2.868 N/A LYS 103.A N GLU 100.A O no hydrogen 3.373 N/A LYS 103.A NZ GLU 100.A OE1 no hydrogen 2.932 N/A LYS 103.A NZ GLU 100.A OE2 no hydrogen 3.156 N/A LYS 104.A NZ GLU 199.A O no hydrogen 3.527 N/A LYS 105.A N GLY 102.A O no hydrogen 3.412 N/A LYS 105.A NZ ASP 193.A O no hydrogen 2.987 N/A ARG 108.A NE ASP 193.A OD1 no hydrogen 3.469 N/A ARG 108.A NE ASP 193.A OD2 no hydrogen 3.160 N/A ARG 108.A NH1 MET 109.A O no hydrogen 3.173 N/A ARG 108.A NH1 GLU 114.A OE1 no hydrogen 2.840 N/A ARG 108.A NH1 GLU 114.A OE2 no hydrogen 3.381 N/A ARG 108.A NH2 GLU 114.A OE2 no hydrogen 3.164 N/A ARG 108.A NH2 ASP 193.A OD1 no hydrogen 2.926 N/A CYS 110.A N GLU 185.A O no hydrogen 2.980 N/A THR 111.A N GLU 114.A OE1 no hydrogen 3.134 N/A ARG 112.A NH2 ASP 149.A OD1 no hydrogen 2.580 N/A GLU 114.A N THR 111.A OG1 no hydrogen 3.093 N/A PHE 115.A N THR 111.A O no hydrogen 2.782 N/A THR 116.A N ARG 112.A O no hydrogen 2.740 N/A THR 116.A OG1 ARG 112.A O no hydrogen 2.808 N/A ARG 117.A N GLU 113.A O no hydrogen 3.158 N/A LYS 118.A N GLU 114.A O no hydrogen 3.247 N/A LYS 118.A NZ GLU 192.A OE2 no hydrogen 2.953 N/A VAL 119.A N PHE 115.A O no hydrogen 3.186 N/A ARG 120.A N THR 116.A O no hydrogen 3.153 N/A SER 121.A N LYS 118.A O no hydrogen 3.130 N/A SER 121.A OG ARG 117.A O no hydrogen 3.229 N/A ASN 122.A N VAL 119.A O no hydrogen 3.438 N/A LEU 125.A N ALA 123.A O no hydrogen 2.908 N/A LYS 133.A N GLU 137.A OE1 no hydrogen 3.039 N/A ARG 136.A NH1 ASN 122.A OD1 no hydrogen 2.824 N/A VAL 139.A N ALA 135.A O no hydrogen 3.275 N/A GLU 140.A N GLU 137.A O no hydrogen 3.042 N/A ASP 141.A N ALA 138.A O no hydrogen 3.357 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.500 N/A PHE 144.A N ASP 141.A OD1 no hydrogen 3.261 N/A TRP 145.A NE1 VAL 139.A O no hydrogen 2.837 N/A GLU 146.A N SER 142.A O no hydrogen 3.135 N/A GLU 146.A N GLY 143.A O no hydrogen 2.912 N/A LEU 147.A N GLY 143.A O no hydrogen 3.106 N/A VAL 148.A N PHE 144.A O no hydrogen 2.911 N/A ASP 149.A N TRP 145.A O no hydrogen 2.714 N/A LYS 150.A N GLU 146.A O no hydrogen 2.906 N/A GLU 151.A N LEU 147.A O no hydrogen 3.079 N/A ARG 152.A N VAL 148.A O no hydrogen 2.873 N/A ASN 153.A N ASP 149.A O no hydrogen 2.946 N/A ASN 153.A ND2 ASP 149.A O no hydrogen 3.110 N/A LEU 154.A N LYS 150.A O no hydrogen 3.025 N/A HIS 155.A N GLU 151.A O no hydrogen 2.744 N/A LEU 156.A N ARG 152.A O no hydrogen 3.010 N/A GLU 157.A N ASN 153.A O no hydrogen 2.988 N/A GLY 158.A N HIS 155.A O no hydrogen 2.680 N/A LYS 159.A N LEU 154.A O no hydrogen 2.961 N/A LYS 159.A NZ GLU 157.A OE1 no hydrogen 3.387 N/A CYS 160.A SG GLU 151.A OE1 no hydrogen 3.766 N/A CYS 160.A SG HIS 155.A NE2 no hydrogen 3.629 N/A GLU 161.A N GLU 151.A OE2 no hydrogen 2.821 N/A CYS 163.A SG GLU 151.A OE1 no hydrogen 2.678 N/A CYS 163.A SG HIS 155.A NE2 no hydrogen 3.589 N/A VAL 164.A N THR 162.A O no hydrogen 3.175 N/A TYR 165.A N VAL 275.A O no hydrogen 2.662 N/A ASN 166.A N TYR 174.A O no hydrogen 2.854 N/A MET 167.A N ARG 277.A O no hydrogen 3.058 N/A MET 168.A N ILE 172.A O no hydrogen 3.058 N/A ILE 172.A N MET 168.A O no hydrogen 3.062 N/A TYR 174.A N ASN 166.A O no hydrogen 3.148 N/A ARG 180.A N TRP 176.A O no hydrogen 3.255 N/A ARG 180.A NE GLY 126.A O no hydrogen 2.817 N/A ARG 180.A NH2 TRP 173.A O no hydrogen 3.044 N/A PHE 181.A N LEU 177.A O no hydrogen 2.779 N/A LEU 182.A N GLY 178.A O no hydrogen 3.134 N/A GLU 183.A N ALA 179.A O no hydrogen 2.997 N/A PHE 184.A N ARG 180.A O no hydrogen 2.894 N/A GLU 185.A N PHE 181.A O no hydrogen 2.725 N/A ALA 186.A N LEU 182.A O no hydrogen 3.308 N/A ALA 186.A N GLU 183.A O no hydrogen 3.231 N/A LEU 187.A N GLU 183.A O no hydrogen 2.955 N/A GLY 188.A N PHE 184.A O no hydrogen 2.814 N/A LEU 190.A N LEU 187.A O no hydrogen 3.228 N/A GLU 192.A N GLY 188.A O no hydrogen 2.782 N/A ASP 193.A N PHE 189.A O no hydrogen 2.902 N/A HIS 194.A N ASN 191.A O no hydrogen 3.081 N/A TRP 195.A N LEU 190.A O no hydrogen 2.939 N/A SER 197.A N HIS 194.A O no hydrogen 3.246 N/A SER 197.A OG HIS 194.A O no hydrogen 3.306 N/A ARG 198.A N GLU 208.A OE2 no hydrogen 2.937 N/A ARG 198.A NH1 SER 203.A O no hydrogen 3.019 N/A ARG 198.A NH1 GLY 204.A O no hydrogen 3.166 N/A ARG 198.A NH1 MET 353.A O no hydrogen 3.178 N/A ARG 198.A NH2 MET 353.A O no hydrogen 2.930 N/A ASN 200.A N SER 197.A OG no hydrogen 2.984 N/A ASN 200.A ND2 LEU 101.A O no hydrogen 3.044 N/A ASN 200.A ND2 TRP 195.A O no hydrogen 2.898 N/A SER 201.A N SER 197.A O no hydrogen 2.992 N/A SER 201.A OG SER 197.A O no hydrogen 2.820 N/A LEU 202.A N ARG 198.A O no hydrogen 2.928 N/A SER 203.A OG LEU 350.A O no hydrogen 2.572 N/A GLY 204.A N SER 201.A OG no hydrogen 3.024 N/A GLU 206.A N PHE 196.A O no hydrogen 3.188 N/A GLU 208.A N VAL 205.A O no hydrogen 3.036 N/A LYS 212.A N GLY 209.A O no hydrogen 2.733 N/A LEU 213.A N GLY 209.A O no hydrogen 3.247 N/A TYR 215.A OH VAL 418.A O no hydrogen 3.033 N/A ILE 216.A N LYS 212.A O no hydrogen 2.916 N/A LEU 217.A N LEU 213.A O no hydrogen 2.901 N/A ARG 218.A N GLY 214.A O no hydrogen 2.947 N/A ARG 218.A NH1 GLU 410.A OE1 no hydrogen 2.988 N/A ASP 219.A N TYR 215.A O no hydrogen 2.910 N/A VAL 220.A N ILE 216.A O no hydrogen 3.042 N/A SER 221.A N LEU 217.A O no hydrogen 3.000 N/A SER 221.A OG ARG 218.A O no hydrogen 2.580 N/A LYS 222.A N ASP 219.A O no hydrogen 3.141 N/A LYS 222.A NZ ASP 219.A OD1 no hydrogen 2.922 N/A LYS 223.A N VAL 220.A O no hydrogen 3.145 N/A LYS 223.A NZ GLU 348.A OE2 no hydrogen 3.281 N/A LYS 223.A NZ SER 351.A OG no hydrogen 2.730 N/A GLY 226.A N PRO 364.A O no hydrogen 3.020 N/A ALA 227.A N ASP 367.A OD1 no hydrogen 2.838 N/A MET 228.A N TRP 395.A O no hydrogen 2.904 N/A TYR 229.A N VAL 362.A O no hydrogen 2.846 N/A TYR 229.A OH ASP 367.A OD1 no hydrogen 2.552 N/A ALA 234.A N VAL 382.A O no hydrogen 3.001 N/A TRP 236.A NE1 ASN 305.A OD1 no hydrogen 2.931 N/A THR 238.A N GLY 235.A O no hydrogen 2.973 N/A THR 238.A OG1 GLY 235.A O no hydrogen 2.679 N/A ARG 239.A N TRP 236.A O no hydrogen 2.973 N/A ARG 239.A NE ALA 234.A O no hydrogen 2.947 N/A THR 241.A N ASP 244.A OD2 no hydrogen 2.927 N/A ASP 244.A N THR 241.A OG1 no hydrogen 2.998 N/A LEU 245.A N THR 241.A O no hydrogen 3.073 N/A LYS 246.A N LEU 242.A O no hydrogen 3.078 N/A ASN 247.A N GLU 243.A O no hydrogen 2.984 N/A GLU 248.A N ASP 244.A O no hydrogen 2.907 N/A GLU 249.A N.A LEU 245.A O no hydrogen 3.035 N/A GLU 249.A N.B LEU 245.A O no hydrogen 3.024 N/A MET 250.A N ASN 247.A O no hydrogen 3.290 N/A VAL 251.A N GLU 248.A O no hydrogen 3.171 N/A THR 252.A N GLU 249.A O.A no hydrogen 2.840 N/A THR 252.A N GLU 249.A O.B no hydrogen 2.887 N/A THR 252.A OG1 GLU 249.A O.A no hydrogen 2.713 N/A THR 252.A OG1 GLU 249.A O.B no hydrogen 2.719 N/A THR 252.A OG1 GLU 249.A OE2.B no hydrogen 3.049 N/A ASN 253.A N MET 250.A O no hydrogen 3.046 N/A HIS 254.A N VAL 251.A O no hydrogen 3.009 N/A MET 255.A N THR 252.A O no hydrogen 3.099 N/A HIS 259.A NE2 ALA 186.A O no hydrogen 2.776 N/A LYS 260.A N GLU 256.A O no hydrogen 3.187 N/A LYS 260.A NZ THR 252.A O no hydrogen 3.354 N/A LEU 262.A N GLU 258.A O no hydrogen 2.859 N/A ALA 263.A N HIS 259.A O no hydrogen 2.867 N/A GLU 264.A N LYS 260.A O no hydrogen 3.031 N/A ALA 265.A N LYS 261.A O no hydrogen 3.141 N/A ILE 266.A N LEU 262.A O no hydrogen 3.132 N/A PHE 267.A N ALA 263.A O no hydrogen 3.111 N/A LYS 268.A N GLU 264.A O no hydrogen 2.972 N/A LEU 269.A N ALA 265.A O no hydrogen 2.841 N/A THR 270.A N ILE 266.A O no hydrogen 3.046 N/A THR 270.A OG1 ILE 266.A O no hydrogen 2.445 N/A TYR 271.A N ILE 266.A O no hydrogen 3.245 N/A TYR 271.A OH GLU 183.A OE1 no hydrogen 2.265 N/A GLN 272.A N PHE 267.A O no hydrogen 2.806 N/A GLN 272.A NE2 GLU 249.A OE1.A no hydrogen 2.991 N/A ASN 273.A ND2 LYS 268.A O no hydrogen 3.032 N/A LYS 274.A N ARG 290.A O no hydrogen 3.033 N/A LYS 274.A NZ TYR 271.A O no hydrogen 2.713 N/A LYS 274.A NZ ASP 292.A O no hydrogen 2.688 N/A LYS 274.A NZ GLN 293.A O no hydrogen 3.151 N/A VAL 276.A N ILE 288.A O no hydrogen 2.908 N/A ARG 277.A N TYR 165.A O no hydrogen 2.888 N/A VAL 278.A N ASP 286.A O no hydrogen 2.949 N/A ARG 280.A N VAL 284.A O no hydrogen 3.097 N/A ARG 280.A NE ASP 286.A OD2 no hydrogen 2.789 N/A ARG 280.A NH2 ASP 23.A OD2 no hydrogen 3.464 N/A ARG 280.A NH2 ASP 286.A OD1 no hydrogen 3.056 N/A VAL 284.A N ARG 280.A O no hydrogen 3.040 N/A MET 285.A N TYR 37.A O no hydrogen 2.796 N/A ASP 286.A N VAL 278.A O no hydrogen 2.893 N/A ILE 287.A N GLY 35.A O no hydrogen 3.167 N/A ILE 288.A N VAL 276.A O no hydrogen 2.926 N/A SER 289.A N ALA 32.A O no hydrogen 2.764 N/A SER 289.A OG HIS 34.A NE2 no hydrogen 3.055 N/A ARG 290.A N LYS 274.A O no hydrogen 3.401 N/A ARG 290.A NE ASP 292.A OD1 no hydrogen 2.772 N/A ARG 290.A NH1 THR 30.A OG1 no hydrogen 3.359 N/A ARG 290.A NH2 THR 77.A O no hydrogen 3.488 N/A ARG 290.A NH2 ASP 292.A OD1 no hydrogen 2.788 N/A ARG 291.A NE GLN 272.A O no hydrogen 3.148 N/A ARG 291.A NE ASN 273.A OD1 no hydrogen 3.344 N/A ARG 291.A NH2 GLN 272.A O no hydrogen 3.467 N/A GLN 293.A N ILE 240.A O no hydrogen 2.921 N/A GLN 293.A NE2 VAL 75.A O no hydrogen 2.976 N/A ARG 294.A N ASP 237.A O no hydrogen 2.904 N/A ARG 294.A NE ASN 305.A OD1 no hydrogen 3.065 N/A ARG 294.A NH1 GLU 248.A OE1 no hydrogen 2.659 N/A ARG 294.A NH1 GLU 248.A OE2 no hydrogen 3.530 N/A ARG 294.A NH2 GLU 248.A OE1 no hydrogen 3.536 N/A ARG 294.A NH2 GLU 248.A OE2 no hydrogen 2.856 N/A ARG 294.A NH2 ASN 305.A OD1 no hydrogen 2.957 N/A GLY 297.A N GLU 183.A OE1 no hydrogen 2.921 N/A GLY 297.A N GLU 183.A OE2 no hydrogen 3.163 N/A THR 301.A N GLY 297.A O no hydrogen 2.812 N/A THR 301.A OG1 GLY 297.A O no hydrogen 2.679 N/A TYR 302.A N GLN 298.A O no hydrogen 3.000 N/A GLY 303.A N VAL 299.A O no hydrogen 3.292 N/A LEU 304.A N VAL 300.A O no hydrogen 2.984 N/A ASN 305.A N THR 301.A O no hydrogen 2.864 N/A ASN 305.A ND2 ASP 237.A OD1 no hydrogen 3.053 N/A THR 306.A N TYR 302.A O no hydrogen 2.878 N/A THR 306.A OG1 TYR 302.A O no hydrogen 2.871 N/A PHE 307.A N GLY 303.A O no hydrogen 2.991 N/A THR 308.A N LEU 304.A O no hydrogen 3.009 N/A THR 308.A OG1 GLU 248.A OE2 no hydrogen 2.530 N/A THR 308.A OG1 LEU 304.A O no hydrogen 3.299 N/A ASN 309.A N ASN 305.A O no hydrogen 2.911 N/A ASN 309.A ND2 GLY 357.A O no hydrogen 2.906 N/A MET 310.A N THR 306.A O no hydrogen 2.858 N/A GLU 311.A N PHE 307.A O no hydrogen 3.007 N/A ALA 312.A N THR 308.A O no hydrogen 2.944 N/A GLN 313.A N ASN 309.A O no hydrogen 2.873 N/A GLN 313.A NE2 ASN 309.A OD1 no hydrogen 3.087 N/A LEU 314.A N MET 310.A O no hydrogen 2.973 N/A ILE 315.A N GLU 311.A O no hydrogen 3.134 N/A ARG 316.A N ALA 312.A O no hydrogen 2.924 N/A ARG 316.A NE PHE 369.A O no hydrogen 3.229 N/A ARG 316.A NE ALA 372.A O no hydrogen 3.112 N/A ARG 316.A NH1 ASP 231.A OD2 no hydrogen 2.837 N/A ARG 316.A NH2 PHE 369.A O no hydrogen 3.068 N/A ARG 316.A NH2 ALA 370.A O no hydrogen 3.319 N/A ARG 316.A NH2 SER 392.A OG no hydrogen 2.897 N/A GLN 317.A N GLN 313.A O no hydrogen 2.943 N/A GLN 317.A NE2 ARG 349.A O no hydrogen 3.129 N/A MET 318.A N LEU 314.A O no hydrogen 2.849 N/A GLU 319.A N ILE 315.A O no hydrogen 2.944 N/A GLY 320.A N ARG 316.A O no hydrogen 3.038 N/A GLU 321.A N GLN 317.A O no hydrogen 3.052 N/A GLY 322.A N GLU 319.A O no hydrogen 3.167 N/A VAL 323.A N MET 318.A O no hydrogen 2.964 N/A LYS 325.A N GLU 334.A OE1 no hydrogen 3.111 N/A GLN 328.A N SER 326.A OG no hydrogen 3.031 N/A THR 331.A N GLU 334.A OE2 no hydrogen 3.157 N/A THR 331.A OG1 THR 333.A OG1 no hydrogen 3.313 N/A THR 333.A OG1 THR 331.A OG1 no hydrogen 3.313 N/A GLU 334.A N THR 331.A OG1 no hydrogen 3.166 N/A GLU 335.A N THR 331.A O no hydrogen 3.293 N/A ILE 336.A N VAL 332.A O no hydrogen 3.268 N/A ALA 337.A N THR 333.A O no hydrogen 3.090 N/A VAL 338.A N GLU 334.A O no hydrogen 2.783 N/A LYS 339.A N GLU 335.A O no hydrogen 2.993 N/A ASN 340.A N ILE 336.A O no hydrogen 2.902 N/A TRP 341.A N ALA 337.A O no hydrogen 2.838 N/A TRP 341.A NE1 GLU 321.A OE1 no hydrogen 2.968 N/A LEU 342.A N VAL 338.A O no hydrogen 3.083 N/A VAL 343.A N LYS 339.A O no hydrogen 3.034 N/A ARG 344.A N ASN 340.A O no hydrogen 2.821 N/A VAL 345.A N TRP 341.A O no hydrogen 2.605 N/A GLY 346.A N LEU 342.A O no hydrogen 2.878 N/A ARG 347.A NH1 GLU 100.A OE1 no hydrogen 2.886 N/A ARG 349.A N VAL 345.A O no hydrogen 2.901 N/A ARG 349.A NE GLU 321.A OE1 no hydrogen 3.428 N/A ARG 349.A NE GLU 321.A OE2 no hydrogen 2.832 N/A ARG 349.A NH1 GLU 348.A OE1 no hydrogen 2.780 N/A ARG 349.A NH2 GLU 321.A OE1 no hydrogen 2.889 N/A LEU 350.A N GLY 346.A O no hydrogen 2.972 N/A SER 351.A N ARG 347.A O no hydrogen 3.185 N/A SER 351.A OG GLU 348.A O no hydrogen 2.643 N/A ARG 352.A N ARG 349.A O no hydrogen 3.363 N/A ARG 352.A NE GLU 348.A OE1 no hydrogen 2.983 N/A ARG 352.A NE GLU 348.A OE2 no hydrogen 3.133 N/A ARG 352.A NH1 GLU 224.A O no hydrogen 2.999 N/A ARG 352.A NH1 LYS 363.A O no hydrogen 2.833 N/A ARG 352.A NH2 GLU 224.A O no hydrogen 2.931 N/A ARG 352.A NH2 GLU 348.A OE2 no hydrogen 3.179 N/A MET 353.A N LEU 350.A O no hydrogen 3.060 N/A ALA 354.A N VAL 361.A O no hydrogen 2.892 N/A ILE 355.A N SER 203.A O no hydrogen 2.860 N/A SER 356.A N ASP 359.A O no hydrogen 2.885 N/A GLY 357.A N THR 306.A OG1 no hydrogen 2.918 N/A ASP 359.A N SER 356.A O no hydrogen 2.821 N/A CYS 360.A SG ASP 231.A O no hydrogen 3.898 N/A VAL 361.A N ALA 354.A O no hydrogen 2.869 N/A VAL 362.A N TYR 229.A O no hydrogen 2.831 N/A LYS 363.A N ARG 352.A O no hydrogen 2.881 N/A LYS 363.A NZ SER 221.A O no hydrogen 2.934 N/A LYS 363.A NZ LYS 223.A O no hydrogen 2.850 N/A ARG 368.A N ASP 366.A OD1 no hydrogen 3.164 N/A ARG 368.A NE ASP 366.A OD1 no hydrogen 2.856 N/A ARG 368.A NH2 ASP 366.A OD2 no hydrogen 2.790 N/A ALA 370.A N ASP 367.A O no hydrogen 3.100 N/A SER 371.A N ARG 368.A O no hydrogen 3.238 N/A ALA 372.A N PHE 369.A O no hydrogen 3.004 N/A THR 374.A N GLU 319.A OE1 no hydrogen 3.126 N/A THR 374.A OG1 GLU 319.A OE1 no hydrogen 2.437 N/A ALA 375.A N GLU 319.A OE2 no hydrogen 2.946 N/A ASN 377.A N LEU 373.A O no hydrogen 2.951 N/A ASN 377.A ND2 GLN 388.A O no hydrogen 2.993 N/A ASP 378.A N THR 374.A O no hydrogen 2.881 N/A MET 379.A N ALA 375.A O no hydrogen 2.782 N/A GLY 380.A N ASN 377.A O no hydrogen 2.916 N/A LYS 381.A N LEU 376.A O no hydrogen 3.078 N/A LYS 381.A NZ ARG 239.A O no hydrogen 2.732 N/A LYS 381.A NZ ASP 244.A OD2 no hydrogen 2.661 N/A LYS 381.A NZ MET 379.A O no hydrogen 3.217 N/A ARG 383.A NH1 GLU 390.A O no hydrogen 2.921 N/A ARG 383.A NH1 SER 392.A OG no hydrogen 3.006 N/A ARG 383.A NH2 GLN 388.A O no hydrogen 2.983 N/A ARG 383.A NH2 GLU 390.A O no hydrogen 2.867 N/A LYS 384.A N ASP 232.A O no hydrogen 2.955 N/A LYS 384.A NZ ASP 232.A OD2 no hydrogen 3.266 N/A GLU 390.A N GLN 387.A O no hydrogen 2.976 N/A SER 392.A N ALA 370.A O no hydrogen 2.898 N/A SER 392.A OG ASP 231.A OD2 no hydrogen 2.397 N/A TRP 395.A N MET 228.A O no hydrogen 2.698 N/A THR 399.A N ASP 397.A OD1 no hydrogen 3.015 N/A THR 399.A OG1 ASP 397.A OD1 no hydrogen 2.659 N/A THR 399.A OG1 ASP 397.A OD2 no hydrogen 2.878 N/A GLN 400.A N ASP 397.A O no hydrogen 2.906 N/A GLN 400.A NE2 ASP 397.A OD2 no hydrogen 3.498 N/A GLN 400.A NE2 THR 399.A OG1 no hydrogen 3.063 N/A VAL 401.A N TRP 398.A O no hydrogen 3.383 N/A PHE 403.A N HIS 406.A O no hydrogen 2.941 N/A CYS 404.A N ASP 359.A OD2 no hydrogen 2.801 N/A HIS 406.A N PHE 403.A O no hydrogen 2.963 N/A HIS 406.A ND1 CYS 404.A O no hydrogen 2.804 N/A HIS 406.A NE2 TYR 461.A OH no hydrogen 2.656 N/A HIS 407.A N CYS 423.A O no hydrogen 2.917 N/A HIS 409.A N VAL 421.A O no hydrogen 2.995 N/A LEU 411.A N LEU 419.A O no hydrogen 2.739 N/A MET 413.A N ARG 417.A O no hydrogen 2.879 N/A LYS 414.A NZ.A GLU 524.A O no hydrogen 2.749 N/A GLY 416.A N MET 413.A O no hydrogen 2.680 N/A ARG 417.A N ASP 415.A OD1 no hydrogen 2.963 N/A ARG 417.A NE ASP 415.A OD1 no hydrogen 3.364 N/A ARG 417.A NE ASP 415.A OD2 no hydrogen 3.208 N/A ARG 417.A NH1 ASP 516.A O no hydrogen 2.949 N/A ARG 417.A NH1 THR 518.A O no hydrogen 2.739 N/A ARG 417.A NH2 ASP 415.A OD2 no hydrogen 2.997 N/A ARG 417.A NH2 THR 518.A O no hydrogen 3.044 N/A LEU 419.A N LEU 411.A O no hydrogen 2.927 N/A VAL 420.A N TYR 215.A OH no hydrogen 3.406 N/A VAL 421.A N HIS 409.A O no hydrogen 2.917 N/A CYS 423.A N HIS 407.A O no hydrogen 2.878 N/A CYS 423.A SG HIS 407.A NE2 no hydrogen 3.566 N/A CYS 423.A SG HIS 409.A NE2 no hydrogen 3.501 N/A CYS 423.A SG ARG 424.A O no hydrogen 3.917 N/A ARG 424.A NE GLU 428.A OE2 no hydrogen 2.716 N/A ARG 424.A NH2 GLU 428.A OE2 no hydrogen 3.038 N/A GLN 426.A N CYS 537.A O no hydrogen 2.956 N/A GLN 426.A NE2 ASP 466.A OD2 no hydrogen 2.891 N/A ASP 427.A N ASN 425.A OD1 no hydrogen 2.931 N/A GLU 428.A N ASN 425.A O no hydrogen 3.027 N/A ILE 430.A N GLN 426.A O no hydrogen 2.948 N/A GLY 431.A N ASP 427.A O no hydrogen 2.939 N/A ARG 432.A N GLU 428.A O no hydrogen 3.127 N/A ALA 433.A N LEU 429.A O no hydrogen 3.164 N/A ARG 434.A N ILE 430.A O no hydrogen 3.156 N/A ARG 434.A NH1 THR 55.A OG1 no hydrogen 2.985 N/A ARG 434.A NH1 ASP 59.A OD1 no hydrogen 2.986 N/A ARG 434.A NH2 ASP 59.A OD1 no hydrogen 2.831 N/A ILE 435.A N ARG 432.A O no hydrogen 3.172 N/A SER 436.A N.A MET 46.A O no hydrogen 2.747 N/A SER 436.A N.B MET 46.A O no hydrogen 2.769 N/A SER 436.A OG.A GLN 437.A O no hydrogen 3.485 N/A SER 436.A OG.B MET 46.A O no hydrogen 3.516 N/A TRP 441.A NE1 GLN 437.A O no hydrogen 2.852 N/A GLU 445.A N SER 442.A OG no hydrogen 3.011 N/A THR 446.A N SER 442.A O no hydrogen 3.030 N/A THR 446.A OG1 SER 442.A O no hydrogen 2.814 N/A ALA 447.A N LEU 443.A O no hydrogen 2.814 N/A CYS 448.A N ARG 444.A O no hydrogen 2.993 N/A CYS 448.A SG ARG 444.A O no hydrogen 3.362 N/A CYS 448.A SG VAL 483.A O no hydrogen 3.299 N/A LEU 449.A N GLU 445.A O no hydrogen 3.024 N/A GLY 450.A N THR 446.A O no hydrogen 3.038 N/A LYS 451.A N ALA 447.A O no hydrogen 2.953 N/A LYS 451.A NZ PRO 479.A O no hydrogen 3.407 N/A LYS 451.A NZ SER 480.A O.A no hydrogen 2.843 N/A LYS 451.A NZ SER 480.A O.B no hydrogen 2.905 N/A LYS 451.A NZ TRP 482.A O no hydrogen 2.742 N/A SER 452.A N CYS 448.A O no hydrogen 3.042 N/A SER 452.A OG CYS 448.A O no hydrogen 3.131 N/A SER 452.A OG THR 485.A O no hydrogen 2.559 N/A TYR 453.A N LEU 449.A O no hydrogen 3.192 N/A ALA 454.A N GLY 450.A O no hydrogen 2.933 N/A GLN 455.A N LYS 451.A O no hydrogen 2.926 N/A GLN 455.A NE2 TRP 493.A O no hydrogen 2.865 N/A GLN 455.A NE2 THR 495.A O no hydrogen 2.893 N/A MET 456.A N SER 452.A O no hydrogen 2.979 N/A TRP 457.A N TYR 453.A O no hydrogen 2.908 N/A SER 458.A N.A ALA 454.A O no hydrogen 3.003 N/A SER 458.A N.B ALA 454.A O no hydrogen 3.007 N/A SER 458.A OG.A ALA 454.A O no hydrogen 3.050 N/A SER 458.A OG.B GLN 455.A O no hydrogen 2.840 N/A LEU 459.A N GLN 455.A O no hydrogen 3.034 N/A LEU 459.A N MET 456.A O no hydrogen 3.146 N/A MET 460.A N MET 456.A O no hydrogen 2.849 N/A TYR 461.A N TRP 457.A O no hydrogen 2.851 N/A TYR 461.A OH HIS 406.A NE2 no hydrogen 2.656 N/A HIS 463.A NE2 MET 460.A O no hydrogen 3.134 N/A ARG 464.A N TYR 461.A O no hydrogen 3.047 N/A ARG 464.A NE ASP 534.A OD1 no hydrogen 2.796 N/A ARG 464.A NH1 ASP 534.A OD1 no hydrogen 3.080 N/A ARG 464.A NH1 CYS 537.A O no hydrogen 2.918 N/A ARG 464.A NH2 ARG 424.A O no hydrogen 3.241 N/A ARG 464.A NH2 CYS 537.A O no hydrogen 3.331 N/A ARG 465.A N ASP 534.A OD2 no hydrogen 2.987 N/A ARG 465.A NH1 LEU 529.A O no hydrogen 2.856 N/A ARG 465.A NH1 ASP 534.A OD2 no hydrogen 2.832 N/A ARG 465.A NH2 LEU 529.A O no hydrogen 3.131 N/A LEU 467.A N ARG 464.A O no hydrogen 3.139 N/A ARG 468.A N ARG 464.A O no hydrogen 3.046 N/A ARG 468.A NE PHE 462.A O no hydrogen 2.798 N/A ARG 468.A NH1 TRP 523.A O no hydrogen 3.142 N/A ARG 468.A NH1 ILE 526.A O no hydrogen 3.308 N/A ARG 468.A NH2 PHE 462.A O no hydrogen 3.077 N/A ARG 468.A NH2 ILE 526.A O no hydrogen 2.821 N/A LEU 469.A N ARG 465.A O no hydrogen 3.220 N/A ALA 470.A N ASP 466.A O no hydrogen 2.928 N/A ALA 471.A N LEU 467.A O no hydrogen 2.852 N/A ASN 472.A N ARG 468.A O no hydrogen 3.056 N/A ALA 473.A N LEU 469.A O no hydrogen 2.950 N/A ILE 474.A N ALA 470.A O no hydrogen 2.860 N/A CYS 475.A N ALA 471.A O no hydrogen 2.935 N/A CYS 475.A SG ALA 471.A O no hydrogen 3.444 N/A SER 476.A N ASN 472.A O no hydrogen 2.965 N/A SER 476.A N ALA 473.A O no hydrogen 3.153 N/A SER 476.A OG ASN 472.A O no hydrogen 2.764 N/A ALA 477.A N ILE 474.A O no hydrogen 2.989 N/A VAL 478.A N ILE 474.A O no hydrogen 3.082 N/A SER 480.A N.A GLU 568.A O no hydrogen 3.089 N/A SER 480.A N.B GLU 568.A O no hydrogen 3.066 N/A SER 480.A OG.B GLU 568.A O no hydrogen 3.203 N/A SER 480.A OG.B THR 570.A OG1 no hydrogen 2.711 N/A TRP 482.A N PRO 479.A O no hydrogen 3.107 N/A THR 485.A N CYS 448.A O no hydrogen 3.367 N/A ARG 487.A NE GLU 445.A OE2 no hydrogen 3.345 N/A ARG 487.A NH1 ALA 439.A O no hydrogen 3.351 N/A ARG 487.A NH2 ALA 439.A O no hydrogen 3.436 N/A ARG 487.A NH2 GLU 445.A OE1 no hydrogen 3.038 N/A GLU 492.A N GLU 492.A OE2 no hydrogen 2.815 N/A MET 494.A N HIS 491.A O no hydrogen 3.133 N/A GLU 497.A N THR 495.A OG1 no hydrogen 2.965 N/A THR 501.A N ASP 498.A OD1 no hydrogen 2.938 N/A THR 501.A OG1 ASP 498.A OD1 no hydrogen 2.735 N/A VAL 502.A N ASP 498.A O no hydrogen 3.240 N/A TRP 503.A N MET 499.A O no hydrogen 2.823 N/A ASN 504.A N LEU 500.A O no hydrogen 3.041 N/A ASN 504.A ND2 LEU 500.A O no hydrogen 3.379 N/A ASN 504.A ND2 VAL 520.A O no hydrogen 2.721 N/A ARG 505.A N THR 501.A O no hydrogen 3.087 N/A ARG 505.A NH1 GLU 497.A OE2 no hydrogen 2.883 N/A ARG 505.A NH2 GLU 497.A OE1 no hydrogen 2.956 N/A ARG 505.A NH2 GLU 497.A OE2 no hydrogen 3.444 N/A VAL 506.A N VAL 502.A O no hydrogen 3.035 N/A TRP 507.A N TRP 503.A O no hydrogen 2.899 N/A TRP 507.A NE1 LEU 459.A O no hydrogen 2.837 N/A ILE 508.A N ASN 504.A O no hydrogen 3.068 N/A GLN 509.A N ASN 504.A O no hydrogen 2.961 N/A GLU 510.A N ARG 505.A O no hydrogen 2.846 N/A ASN 511.A N ILE 508.A O no hydrogen 3.336 N/A ASN 511.A ND2 TYR 215.A OH no hydrogen 3.069 N/A ASN 511.A ND2 TRP 507.A O no hydrogen 2.846 N/A TRP 513.A N ASN 511.A OD1 no hydrogen 2.969 N/A TRP 513.A NE1 ASP 219.A OD2 no hydrogen 2.879 N/A MET 514.A N ASN 511.A O no hydrogen 3.136 N/A LYS 517.A NZ ILE 508.A O no hydrogen 2.957 N/A LYS 517.A NZ GLN 509.A O no hydrogen 3.177 N/A LYS 517.A NZ MET 514.A O no hydrogen 2.894 N/A THR 518.A N ASP 516.A OD1 no hydrogen 2.880 N/A THR 518.A OG1 ASP 516.A OD1 no hydrogen 2.558 N/A VAL 520.A N ASN 504.A OD1 no hydrogen 2.699 N/A GLU 521.A N GLU 525.A OE2 no hydrogen 2.748 N/A GLU 524.A N SER 522.A OG no hydrogen 3.285 N/A GLU 525.A N SER 522.A O no hydrogen 3.178 N/A ILE 526.A N TRP 523.A O no hydrogen 2.849 N/A LEU 529.A N HIS 463.A O no hydrogen 3.033 N/A GLY 530.A N GLU 533.A OE1 no hydrogen 2.892 N/A ASP 534.A N GLY 530.A O no hydrogen 2.950 N/A GLN 535.A N LYS 531.A O no hydrogen 3.121 N/A GLN 535.A NE2 ILE 541.A O no hydrogen 3.110 N/A TRP 536.A N ARG 532.A O no hydrogen 2.858 N/A CYS 537.A N GLU 533.A O no hydrogen 3.130 N/A CYS 537.A SG HIS 407.A NE2 no hydrogen 3.569 N/A CYS 537.A SG HIS 409.A NE2 no hydrogen 3.752 N/A CYS 537.A SG GLU 533.A O no hydrogen 3.744 N/A GLY 538.A N GLN 535.A O no hydrogen 2.867 N/A SER 539.A N ASP 534.A O no hydrogen 2.891 N/A SER 539.A OG ASP 466.A OD1 no hydrogen 3.508 N/A SER 539.A OG ASP 466.A OD2 no hydrogen 3.227 N/A LEU 540.A N ASP 466.A OD2 no hydrogen 2.827 N/A ILE 541.A N SER 539.A OG no hydrogen 3.011 N/A LEU 543.A N LEU 540.A O no hydrogen 3.019 N/A ARG 546.A NE ASP 466.A OD1 no hydrogen 2.719 N/A ARG 546.A NH2 ASP 466.A OD1 no hydrogen 2.928 N/A ALA 547.A N LEU 543.A O no hydrogen 3.014 N/A THR 548.A N THR 544.A O no hydrogen 3.084 N/A THR 548.A OG1 THR 544.A O no hydrogen 3.070 N/A TRP 549.A N SER 545.A O no hydrogen 3.133 N/A TRP 549.A NE1 LEU 54.A O no hydrogen 3.031 N/A ALA 550.A N ARG 546.A O no hydrogen 2.932 N/A LYS 551.A N ALA 547.A O no hydrogen 3.002 N/A ASN 552.A N THR 548.A O no hydrogen 3.000 N/A ASN 552.A ND2 THR 548.A O no hydrogen 3.026 N/A ILE 553.A N ALA 550.A O no hydrogen 3.364 N/A GLN 554.A NE2.A ASP 571.A OD1 no hydrogen 3.308 N/A GLN 554.A NE2.B ASN 558.A OD1 no hydrogen 2.707 N/A THR 555.A N ASN 552.A O no hydrogen 2.972 N/A ILE 557.A N ILE 553.A O no hydrogen 2.928 N/A ASN 558.A N GLN 554.A O.A no hydrogen 2.923 N/A ASN 558.A N GLN 554.A O.B no hydrogen 2.964 N/A GLN 559.A N THR 555.A O no hydrogen 3.103 N/A VAL 560.A N ALA 556.A O no hydrogen 3.175 N/A ARG 561.A N ILE 557.A O no hydrogen 2.901 N/A ARG 561.A NE SER 476.A O no hydrogen 3.002 N/A ARG 561.A NH2 SER 476.A O no hydrogen 2.941 N/A ARG 561.A NH2 THR 570.A O no hydrogen 3.412 N/A SER 562.A N ASN 558.A O no hydrogen 2.959 N/A SER 562.A OG ASN 558.A O no hydrogen 2.857 N/A LEU 563.A N GLN 559.A O no hydrogen 3.225 N/A ILE 564.A N VAL 560.A O no hydrogen 3.019 N/A GLY 565.A N ARG 561.A O no hydrogen 2.865 N/A TYR 569.A OH GLY 565.A O no hydrogen 2.737 N/A THR 570.A OG1 SER 480.A OG.B no hydrogen 2.711 N/A TYR 572.A N SER 476.A OG no hydrogen 2.928 N/A MET 573.A N ASP 571.A OD1 no hydrogen 3.119 N/A SER 575.A N TYR 572.A O no hydrogen 3.219 N/A SER 575.A OG TYR 572.A O no hydrogen 2.708 N/A MET 576.A N MET 573.A O no hydrogen 2.967 N/A PHE 579.A N MET 576.A O no hydrogen 3.201 N/A ARG 580.A N MET 576.A O no hydrogen 3.042 N/A ARG 580.A N LYS 577.A O no hydrogen 3.054 N/A ARG 580.A NE GLU 524.A OE1 no hydrogen 3.307 N/A ARG 580.A NE GLU 524.A OE2 no hydrogen 2.551 N/A ARG 580.A NH2 GLU 524.A OE1 no hydrogen 2.813 N/A