Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pj3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N GLU 3.A OE1 no hydrogen 3.186 N/A GLY 5.A N LEU 25.A O no hydrogen 2.813 N/A LEU 8.A N GLY 5.A O no hydrogen 2.867 N/A ASN 10.A N PRO 7.A O no hydrogen 3.076 N/A ARG 12.A N ASN 10.A OD1 no hydrogen 2.690 N/A ARG 12.A NE GLU 126.A OE1 no hydrogen 3.437 N/A ARG 12.A NH1 GLU 68.A OE1 no hydrogen 2.482 N/A ARG 12.A NH2 GLU 126.A OE1 no hydrogen 3.466 N/A THR 13.A N ASN 10.A O no hydrogen 3.164 N/A THR 13.A OG1 LEU 8.A O no hydrogen 2.796 N/A THR 13.A OG1 ASN 10.A O no hydrogen 3.326 N/A ASN 14.A N ASN 10.A O no hydrogen 2.950 N/A ASN 14.A ND2 ARG 66.A O no hydrogen 2.967 N/A LYS 15.A NZ GLU 22.A OE1 no hydrogen 3.123 N/A LYS 15.A NZ GLU 22.A OE2 no hydrogen 2.796 N/A LYS 15.A NZ ASP 529.A O no hydrogen 2.626 N/A GLY 16.A N ASN 14.A OD1 no hydrogen 3.066 N/A PHE 18.A N GLY 16.A O no hydrogen 3.280 N/A THR 19.A N GLU 22.A OE1 no hydrogen 2.835 N/A GLU 22.A N THR 19.A OG1 no hydrogen 2.992 N/A ARG 23.A N THR 19.A O no hydrogen 2.967 N/A ARG 23.A NE PHE 18.A O no hydrogen 2.815 N/A ARG 23.A NH1 PRO 32.A O no hydrogen 2.770 N/A ARG 23.A NH2 PHE 18.A O no hydrogen 3.348 N/A ARG 23.A NH2 LYS 34.A O no hydrogen 2.803 N/A GLN 24.A N LEU 20.A O no hydrogen 2.980 N/A LEU 27.A N ARG 23.A O no hydrogen 2.777 N/A GLN 28.A N ARG 23.A O no hydrogen 3.167 N/A LEU 30.A N LEU 27.A O no hydrogen 2.827 N/A LYS 34.A NZ GLU 36.A OE2 no hydrogen 3.128 N/A GLN 38.A NE2 SER 526.A O no hydrogen 2.865 N/A ILE 40.A N THR 37.A O no hydrogen 3.228 N/A GLN 41.A N THR 37.A O no hydrogen 3.361 N/A GLN 41.A NE2 TYR 528.A OH no hydrogen 2.611 N/A ALA 42.A N GLN 38.A O no hydrogen 2.815 N/A LEU 43.A N ASP 39.A O no hydrogen 3.033 N/A ARG 44.A N ILE 40.A O no hydrogen 2.876 N/A ARG 44.A NH1 GLU 36.A OE1 no hydrogen 3.005 N/A ARG 44.A NH2 GLU 36.A OE1 no hydrogen 3.525 N/A ARG 44.A NH2 GLU 36.A OE2 no hydrogen 2.867 N/A PHE 45.A N GLN 41.A O no hydrogen 3.040 N/A HIS 46.A N ALA 42.A O no hydrogen 2.989 N/A ARG 47.A N LEU 43.A O no hydrogen 2.963 N/A ASN 48.A N ARG 44.A O no hydrogen 3.145 N/A ASN 48.A ND2 TYR 60.A OH no hydrogen 3.288 N/A LEU 49.A N PHE 45.A O no hydrogen 2.774 N/A LYS 50.A N HIS 46.A O no hydrogen 2.890 N/A LYS 51.A N ASN 48.A O no hydrogen 3.244 N/A THR 52.A N GLU 56.A OE2 no hydrogen 3.253 N/A THR 52.A OG1 GLU 56.A OE2 no hydrogen 3.390 N/A GLU 56.A N SER 53.A OG no hydrogen 3.303 N/A LYS 57.A N SER 53.A O no hydrogen 3.290 N/A TYR 58.A N PRO 54.A O no hydrogen 2.881 N/A ILE 59.A N LEU 55.A O no hydrogen 3.002 N/A TYR 60.A N GLU 56.A O no hydrogen 3.079 N/A ILE 61.A N LYS 57.A O no hydrogen 2.847 N/A ILE 63.A N TYR 60.A O no hydrogen 3.256 N/A ILE 63.A N ILE 61.A O no hydrogen 2.975 N/A GLU 65.A N GLY 62.A O no hydrogen 3.091 N/A ARG 66.A N ILE 63.A O no hydrogen 2.807 N/A ASN 67.A N ILE 63.A O no hydrogen 2.753 N/A ASN 67.A ND2 TYR 528.A OH no hydrogen 2.887 N/A GLU 68.A N PRO 11.A O no hydrogen 2.901 N/A LYS 69.A NZ ARG 525.A O no hydrogen 2.879 N/A LYS 69.A NZ GLU 527.A O no hydrogen 3.055 N/A LYS 69.A NZ ASP 529.A OD2 no hydrogen 3.343 N/A LEU 70.A N ASN 67.A OD1 no hydrogen 2.901 N/A PHE 71.A N ASN 67.A O no hydrogen 2.889 N/A TYR 72.A N GLU 68.A O no hydrogen 3.103 N/A ARG 73.A N LYS 69.A O no hydrogen 2.992 N/A ARG 73.A NE ASP 77.A OD1 no hydrogen 2.842 N/A ARG 73.A NH1 GLN 38.A OE1 no hydrogen 2.736 N/A ARG 73.A NH1 ASP 39.A OD2 no hydrogen 3.121 N/A ARG 73.A NH2 ASP 39.A OD2 no hydrogen 2.798 N/A ILE 74.A N LEU 70.A O no hydrogen 2.875 N/A LEU 75.A N PHE 71.A O no hydrogen 3.272 N/A GLN 76.A N TYR 72.A O no hydrogen 2.890 N/A ASP 77.A N ARG 73.A O no hydrogen 2.982 N/A ASP 77.A N ILE 74.A O no hydrogen 3.317 N/A ASP 78.A N LEU 75.A O no hydrogen 3.299 N/A SER 81.A N ASP 78.A OD1 no hydrogen 3.295 N/A SER 81.A OG ASP 78.A O no hydrogen 3.097 N/A LEU 82.A N ASP 78.A O no hydrogen 3.327 N/A ILE 84.A N LEU 82.A O no hydrogen 2.704 N/A VAL 85.A N LEU 82.A O no hydrogen 2.949 N/A TYR 86.A OH ASN 433.A OD1 no hydrogen 2.600 N/A THR 87.A OG1 SER 414.A OG no hydrogen 2.726 N/A THR 89.A N PRO 83.A O no hydrogen 3.201 N/A THR 89.A OG1 PRO 83.A O no hydrogen 2.742 N/A VAL 90.A N TYR 86.A O no hydrogen 2.792 N/A GLY 91.A N PRO 88.A O no hydrogen 2.910 N/A LEU 92.A N PRO 88.A O no hydrogen 3.451 N/A ALA 93.A N THR 89.A O no hydrogen 2.893 N/A CYS 94.A N VAL 90.A O no hydrogen 3.084 N/A CYS 94.A SG VAL 90.A O no hydrogen 3.399 N/A SER 95.A N GLY 91.A O no hydrogen 3.120 N/A SER 95.A OG GLY 91.A O no hydrogen 3.297 N/A GLN 96.A N LEU 92.A O no hydrogen 3.280 N/A GLN 96.A N ALA 93.A O no hydrogen 3.139 N/A TYR 97.A N CYS 94.A O no hydrogen 3.113 N/A HIS 99.A N GLN 96.A O no hydrogen 2.752 N/A ILE 100.A N GLN 96.A O no hydrogen 3.166 N/A LYS 105.A NZ GLN 64.A OE1 no hydrogen 3.173 N/A LEU 107.A N PRO 173.A O no hydrogen 2.785 N/A ILE 109.A N CYS 175.A O no hydrogen 2.950 N/A SER 110.A N ASP 113.A OD2 no hydrogen 3.050 N/A SER 110.A OG ASP 113.A OD2 no hydrogen 2.770 N/A ILE 111.A N ASP 177.A O no hydrogen 2.864 N/A SER 112.A N SER 110.A OG no hydrogen 3.256 N/A ASP 113.A N SER 110.A O no hydrogen 2.737 N/A ARG 114.A N ILE 111.A O no hydrogen 3.060 N/A ARG 114.A NH2 GLN 202.A O no hydrogen 2.226 N/A GLY 115.A N GLU 209.A OE1 no hydrogen 2.676 N/A HIS 116.A N ASP 113.A O no hydrogen 2.825 N/A VAL 117.A N GLU 209.A OE2 no hydrogen 2.893 N/A ARG 118.A NE ASP 122.A OD1 no hydrogen 2.959 N/A SER 119.A N HIS 116.A O no hydrogen 3.141 N/A ILE 120.A N HIS 116.A O no hydrogen 3.418 N/A VAL 121.A N VAL 117.A O no hydrogen 2.991 N/A ASP 122.A N ARG 118.A O no hydrogen 2.897 N/A ASN 123.A N ILE 120.A O no hydrogen 2.876 N/A TRP 124.A N VAL 121.A O no hydrogen 3.171 N/A LYS 130.A N ARG 170.A O no hydrogen 2.767 N/A LYS 130.A NZ ASN 220.A OD1 no hydrogen 3.339 N/A ALA 131.A N ARG 170.A O no hydrogen 3.067 N/A VAL 132.A N LEU 222.A O no hydrogen 2.813 N/A VAL 133.A N LEU 172.A O no hydrogen 3.320 N/A VAL 134.A N GLN 224.A O no hydrogen 2.896 N/A THR 135.A N VAL 174.A O no hydrogen 3.032 N/A THR 135.A OG1 GLU 226.A O no hydrogen 2.683 N/A THR 135.A OG1 ASP 227.A O no hydrogen 3.434 N/A GLY 137.A N THR 135.A OG1 no hydrogen 2.986 N/A GLU 138.A N ASP 136.A OD1 no hydrogen 3.017 N/A ARG 139.A N ASP 227.A O no hydrogen 3.190 N/A ARG 139.A NE LEU 141.A O no hydrogen 3.061 N/A ARG 139.A NH1 ASP 250.A OD1 no hydrogen 3.376 N/A ARG 139.A NH2 LEU 141.A O no hydrogen 3.098 N/A ILE 140.A N GLY 144.A O no hydrogen 3.072 N/A LEU 141.A N ASP 227.A OD2 no hydrogen 3.128 N/A LEU 143.A N ILE 140.A O no hydrogen 2.810 N/A LEU 146.A N GLY 137.A O no hydrogen 2.948 N/A GLY 147.A N GLY 137.A O no hydrogen 3.063 N/A GLY 147.A N ASP 145.A OD1 no hydrogen 2.986 N/A VAL 148.A N TYR 191.A OH no hydrogen 3.035 N/A TYR 149.A N LEU 146.A O no hydrogen 2.990 N/A TYR 149.A OH ASP 188.A OD2 no hydrogen 2.951 N/A GLY 150.A N GLY 147.A O no hydrogen 2.849 N/A ILE 152.A N GLY 150.A O no hydrogen 2.930 N/A GLY 155.A N GLY 151.A O no hydrogen 2.859 N/A LYS 156.A N ILE 152.A O no hydrogen 2.797 N/A LYS 156.A NZ TYR 86.A OH no hydrogen 2.865 N/A LYS 156.A NZ GLU 226.A OE2 no hydrogen 3.535 N/A LYS 156.A NZ ASP 249.A OD2 no hydrogen 3.171 N/A LEU 157.A N PRO 153.A O no hydrogen 3.056 N/A CYS 158.A N VAL 154.A O no hydrogen 3.195 N/A CYS 158.A SG VAL 154.A O no hydrogen 3.181 N/A LEU 159.A N GLY 155.A O no hydrogen 3.317 N/A TYR 160.A N LYS 156.A O no hydrogen 2.995 N/A TYR 160.A OH GLN 224.A OE1 no hydrogen 2.693 N/A THR 161.A N LEU 157.A O no hydrogen 3.274 N/A THR 161.A OG1 ILE 166.A O no hydrogen 2.743 N/A ALA 162.A N CYS 158.A O no hydrogen 2.808 N/A CYS 163.A N LEU 159.A O no hydrogen 2.909 N/A ALA 164.A N TYR 160.A O no hydrogen 3.123 N/A GLY 165.A N THR 161.A O no hydrogen 2.927 N/A ILE 166.A N TYR 160.A O no hydrogen 3.367 N/A ARG 167.A NE ASP 169.A OD1 no hydrogen 3.154 N/A ARG 167.A NH2 ASP 169.A OD2 no hydrogen 2.872 N/A ARG 170.A N ARG 167.A O no hydrogen 2.942 N/A CYS 171.A N PRO 168.A O no hydrogen 2.984 N/A CYS 171.A SG ARG 167.A O no hydrogen 3.373 N/A LEU 172.A N ALA 131.A O no hydrogen 2.834 N/A VAL 174.A N VAL 133.A O no hydrogen 2.898 N/A CYS 175.A N LEU 107.A O no hydrogen 2.978 N/A ILE 176.A N THR 135.A O no hydrogen 2.747 N/A ASP 177.A N ILE 109.A O no hydrogen 2.688 N/A GLY 179.A N ASP 177.A OD1 no hydrogen 3.071 N/A THR 180.A N GLN 195.A O no hydrogen 2.855 N/A THR 180.A OG1 ASP 145.A OD1 no hydrogen 2.656 N/A ASP 181.A N ASP 145.A OD2 no hydrogen 3.089 N/A ASN 182.A N THR 180.A OG1 no hydrogen 3.045 N/A ASN 182.A ND2 ASP 145.A O no hydrogen 2.952 N/A LEU 185.A N ASN 182.A O no hydrogen 3.101 N/A LEU 185.A N ASN 182.A OD1 no hydrogen 3.313 N/A LEU 186.A N ASN 182.A O no hydrogen 3.195 N/A LYS 187.A N ALA 184.A O no hydrogen 3.362 N/A ASP 188.A N LEU 185.A O no hydrogen 2.996 N/A PHE 190.A N ASP 188.A OD1 no hydrogen 2.768 N/A TYR 191.A N ASP 188.A O no hydrogen 2.998 N/A LEU 193.A N ASP 177.A OD2 no hydrogen 2.820 N/A TYR 194.A OH ASP 188.A O no hydrogen 2.624 N/A GLN 195.A N LEU 193.A O no hydrogen 3.047 N/A GLN 195.A NE2 VAL 178.A O no hydrogen 3.147 N/A GLN 195.A NE2 LYS 196.A O no hydrogen 3.427 N/A ARG 197.A N ASP 181.A OD1 no hydrogen 3.006 N/A ARG 197.A NE ASP 145.A OD2 no hydrogen 2.553 N/A ARG 197.A NH1 ASP 136.A O no hydrogen 3.171 N/A ARG 197.A NH2 ASP 136.A O no hydrogen 2.739 N/A ARG 197.A NH2 ASP 145.A OD1 no hydrogen 3.127 N/A ASP 198.A N VAL 178.A O no hydrogen 2.989 N/A ARG 199.A NH1 GLU 138.A OE2 no hydrogen 3.009 N/A ARG 199.A NH2 GLU 138.A OE2 no hydrogen 3.106 N/A ARG 199.A NH2 ASP 181.A OD2 no hydrogen 2.483 N/A THR 200.A N ASP 198.A OD1 no hydrogen 2.930 N/A THR 200.A OG1 ASP 198.A OD1 no hydrogen 2.682 N/A GLN 201.A NE2 ASP 205.A OD1 no hydrogen 3.111 N/A GLN 202.A N THR 200.A OG1 no hydrogen 3.193 N/A GLN 202.A NE2 ASP 198.A OD2 no hydrogen 2.991 N/A TYR 203.A N THR 200.A O no hydrogen 3.072 N/A TYR 203.A OH ASP 136.A OD2 no hydrogen 2.774 N/A TYR 203.A OH ASN 232.A OD1 no hydrogen 3.022 N/A ASP 205.A N GLN 201.A O no hydrogen 2.965 N/A LEU 206.A N GLN 202.A O no hydrogen 2.966 N/A ILE 207.A N TYR 203.A O no hydrogen 3.070 N/A ASP 208.A N ASP 204.A O no hydrogen 2.983 N/A GLU 209.A N ASP 205.A O no hydrogen 2.789 N/A PHE 210.A N LEU 206.A O no hydrogen 2.896 N/A ALA 212.A N GLU 209.A O no hydrogen 2.919 N/A ILE 213.A N PHE 210.A O no hydrogen 2.947 N/A THR 214.A OG1 LYS 211.A O no hydrogen 3.060 N/A ASP 215.A N LYS 211.A O no hydrogen 2.677 N/A ARG 216.A N ALA 212.A O no hydrogen 3.105 N/A ARG 216.A NH1 VAL 121.A O no hydrogen 2.826 N/A ARG 216.A NH1 TRP 124.A O no hydrogen 2.812 N/A ARG 216.A NH2 TRP 124.A O no hydrogen 3.306 N/A ARG 216.A NH2 ASN 127.A OD1 no hydrogen 3.004 N/A TYR 217.A N ILE 213.A O no hydrogen 2.913 N/A TYR 217.A OH GLU 126.A O no hydrogen 2.773 N/A GLY 218.A N THR 214.A O no hydrogen 2.734 N/A ARG 219.A NH1 LYS 243.A O no hydrogen 2.850 N/A THR 221.A N GLY 218.A O no hydrogen 3.012 N/A THR 221.A OG1 GLY 218.A O no hydrogen 2.541 N/A LEU 222.A N LYS 130.A O no hydrogen 3.092 N/A ILE 223.A N CYS 245.A O no hydrogen 2.851 N/A GLN 224.A N VAL 132.A O no hydrogen 2.704 N/A GLN 224.A NE2 GLU 226.A OE1 no hydrogen 2.724 N/A PHE 225.A N PHE 247.A O no hydrogen 2.960 N/A GLU 226.A N VAL 134.A O no hydrogen 2.844 N/A ASP 227.A N ASP 250.A OD2 no hydrogen 2.697 N/A ALA 233.A N GLY 229.A O no hydrogen 2.852 N/A ARG 235.A N HIS 231.A O no hydrogen 3.336 N/A ARG 235.A NH1 ASP 204.A OD1 no hydrogen 2.508 N/A ARG 235.A NH2 ASP 204.A OD1 no hydrogen 2.963 N/A ARG 235.A NH2 ASP 204.A OD2 no hydrogen 2.543 N/A PHE 236.A N ASN 232.A O no hydrogen 2.974 N/A LEU 237.A N ALA 233.A O no hydrogen 3.132 N/A ARG 238.A N PHE 234.A O no hydrogen 2.886 N/A LYS 239.A N ARG 235.A O no hydrogen 2.904 N/A TYR 240.A N PHE 236.A O no hydrogen 2.952 N/A TYR 240.A OH ASP 208.A OD2 no hydrogen 2.350 N/A ARG 241.A N LEU 237.A O no hydrogen 2.955 N/A ARG 241.A NH1 ASP 455.A OD1 no hydrogen 3.365 N/A ARG 241.A NH2 ILE 453.A O no hydrogen 3.137 N/A ARG 241.A NH2 ASP 455.A OD1 no hydrogen 2.910 N/A LYS 243.A N TYR 240.A O no hydrogen 2.800 N/A TYR 244.A N TYR 240.A O no hydrogen 2.819 N/A CYS 245.A SG THR 450.A O no hydrogen 3.402 N/A THR 246.A OG1 ILE 223.A O no hydrogen 2.661 N/A PHE 247.A N ILE 223.A O no hydrogen 3.264 N/A ASN 248.A N GLN 252.A OE1 no hydrogen 2.837 N/A ASP 249.A N PHE 225.A O no hydrogen 3.106 N/A ILE 251.A N ASN 248.A OD1 no hydrogen 2.786 N/A GLN 252.A N ASN 248.A O no hydrogen 2.892 N/A GLN 252.A NE2 ASP 455.A OD1 no hydrogen 2.901 N/A THR 254.A N ASP 249.A O no hydrogen 3.190 N/A THR 254.A OG1 ASP 249.A O no hydrogen 3.434 N/A THR 254.A OG1 ASP 250.A O no hydrogen 2.692 N/A ALA 256.A N GLN 252.A O no hydrogen 3.290 N/A VAL 257.A N GLY 253.A O no hydrogen 3.235 N/A ALA 258.A N THR 254.A O no hydrogen 2.993 N/A LEU 259.A N ALA 255.A O no hydrogen 3.028 N/A ALA 260.A N ALA 256.A O no hydrogen 2.972 N/A GLY 261.A N VAL 257.A O no hydrogen 3.054 N/A GLY 261.A N ALA 258.A O no hydrogen 2.841 N/A LEU 262.A N ALA 258.A O no hydrogen 3.025 N/A LEU 263.A N LEU 259.A O no hydrogen 2.825 N/A ALA 264.A N ALA 260.A O no hydrogen 3.156 N/A ALA 264.A N GLY 261.A O no hydrogen 3.183 N/A ALA 265.A N GLY 261.A O no hydrogen 2.939 N/A GLN 266.A N LEU 262.A O no hydrogen 3.030 N/A GLN 266.A NE2 LYS 271.A O no hydrogen 2.830 N/A LYS 267.A N ALA 264.A O no hydrogen 3.207 N/A VAL 268.A N ALA 265.A O no hydrogen 3.157 N/A ILE 269.A N ALA 265.A O no hydrogen 2.958 N/A ILE 269.A N GLN 266.A O no hydrogen 3.175 N/A SER 270.A N GLN 266.A O no hydrogen 2.759 N/A SER 274.A OG GLU 275.A OE1 no hydrogen 2.847 N/A SER 274.A OG GLU 275.A OE2 no hydrogen 2.928 N/A GLU 275.A N PRO 272.A O no hydrogen 2.680 N/A HIS 276.A N ILE 273.A O no hydrogen 3.120 N/A LYS 277.A N SER 355.A OG no hydrogen 3.216 N/A ILE 278.A N LYS 309.A O no hydrogen 2.858 N/A LEU 279.A N THR 356.A O no hydrogen 2.898 N/A PHE 280.A N TRP 311.A O no hydrogen 2.899 N/A LEU 281.A N ILE 358.A O no hydrogen 2.842 N/A GLY 282.A N PHE 312.A O no hydrogen 2.704 N/A LEU 288.A N GLY 284.A O no hydrogen 2.856 N/A GLY 289.A N GLU 285.A O no hydrogen 3.017 N/A ILE 290.A N ALA 286.A O no hydrogen 2.954 N/A ALA 291.A N ALA 287.A O no hydrogen 2.816 N/A ASN 292.A N LEU 288.A O no hydrogen 2.932 N/A ASN 292.A ND2 LEU 288.A O no hydrogen 3.047 N/A LEU 293.A N GLY 289.A O no hydrogen 3.094 N/A ILE 294.A N ILE 290.A O no hydrogen 2.862 N/A VAL 295.A N ALA 291.A O no hydrogen 3.009 N/A ASN 299.A N SER 296.A O no hydrogen 3.115 N/A GLY 300.A N VAL 297.A O no hydrogen 3.077 N/A SER 302.A OG GLU 305.A OE1 no hydrogen 2.638 N/A GLU 305.A N SER 302.A OG no hydrogen 3.353 N/A ALA 306.A N SER 302.A O no hydrogen 3.193 N/A GLN 307.A N GLU 303.A O no hydrogen 2.890 N/A LYS 308.A N GLN 304.A O no hydrogen 3.073 N/A LYS 308.A NZ GLN 304.A O no hydrogen 3.338 N/A LYS 309.A N ALA 306.A O no hydrogen 2.962 N/A ILE 310.A N GLN 307.A O no hydrogen 3.209 N/A TRP 311.A N ILE 278.A O no hydrogen 2.859 N/A ASP 313.A N GLY 316.A O no hydrogen 3.005 N/A TYR 315.A N ASP 313.A OD1 no hydrogen 2.788 N/A GLY 316.A N ASP 313.A O no hydrogen 2.903 N/A LYS 320.A N HIS 335.A O no hydrogen 2.862 N/A LYS 320.A NZ THR 334.A O no hydrogen 2.924 N/A ARG 322.A N VAL 319.A O no hydrogen 3.147 N/A ARG 322.A NE ALA 324.A O no hydrogen 2.958 N/A ARG 322.A NH1 ASP 313.A OD1 no hydrogen 3.062 N/A ARG 322.A NH2 ASP 313.A OD2 no hydrogen 2.976 N/A ARG 322.A NH2 LYS 325.A O no hydrogen 2.810 N/A ASP 327.A N GLN 330.A OE1 no hydrogen 2.902 N/A GLN 330.A N ASP 327.A O no hydrogen 2.939 N/A GLN 330.A N ASP 327.A OD2 no hydrogen 2.691 N/A GLN 330.A NE2 ALA 283.A O no hydrogen 2.987 N/A GLU 331.A N ASP 327.A O no hydrogen 3.006 N/A PHE 333.A N GLN 330.A O no hydrogen 2.733 N/A THR 334.A N GLU 331.A O no hydrogen 3.022 N/A THR 334.A OG1 GLN 330.A O no hydrogen 3.129 N/A HIS 335.A NE2 ILE 310.A O no hydrogen 2.532 N/A ASP 343.A N ASP 347.A OD2 no hydrogen 3.276 N/A THR 344.A N ASP 347.A OD2 no hydrogen 3.079 N/A ASP 347.A N THR 344.A OG1 no hydrogen 3.141 N/A ALA 348.A N THR 344.A O no hydrogen 3.029 N/A VAL 349.A N PHE 345.A O no hydrogen 2.996 N/A ASN 350.A N GLU 346.A O no hydrogen 3.031 N/A ILE 351.A N ASP 347.A O no hydrogen 2.722 N/A LEU 352.A N ALA 348.A O no hydrogen 2.848 N/A LYS 353.A N VAL 349.A O no hydrogen 2.804 N/A LYS 353.A NZ ASN 350.A O no hydrogen 3.004 N/A SER 355.A N LYS 277.A O no hydrogen 2.897 N/A SER 355.A OG LYS 277.A O no hydrogen 3.441 N/A THR 356.A N LYS 277.A O no hydrogen 3.345 N/A ILE 357.A N VAL 382.A O no hydrogen 3.073 N/A ILE 358.A N LEU 279.A O no hydrogen 3.037 N/A GLY 359.A N PHE 384.A O no hydrogen 2.643 N/A VAL 360.A N LEU 281.A O no hydrogen 2.983 N/A ALA 361.A N GLU 394.A OE2 no hydrogen 3.146 N/A GLY 362.A N SER 387.A OG no hydrogen 2.633 N/A GLY 364.A N GLN 392.A O no hydrogen 3.125 N/A ARG 365.A NH1 THR 390.A O no hydrogen 2.905 N/A ARG 365.A NH1 ALA 393.A O no hydrogen 2.837 N/A ARG 365.A NH2 THR 390.A O no hydrogen 3.438 N/A LEU 366.A N GLY 364.A O no hydrogen 2.737 N/A PHE 367.A N GLU 394.A O no hydrogen 3.000 N/A VAL 371.A N THR 368.A OG1 no hydrogen 3.167 N/A ILE 372.A N THR 368.A O no hydrogen 2.826 N/A ARG 373.A N PRO 369.A O no hydrogen 2.744 N/A ALA 374.A N ASP 370.A O no hydrogen 2.863 N/A SER 376.A N ARG 373.A O no hydrogen 2.938 N/A SER 376.A OG ARG 373.A O no hydrogen 3.529 N/A SER 376.A OG ALA 374.A O no hydrogen 2.764 N/A ILE 377.A N ALA 374.A O no hydrogen 2.848 N/A ASN 378.A ND2 PRO 354.A O no hydrogen 2.797 N/A ARG 380.A NE ARG 407.A O no hydrogen 2.780 N/A VAL 382.A N SER 355.A O no hydrogen 3.051 N/A ILE 383.A N LEU 409.A O no hydrogen 2.913 N/A PHE 384.A N ILE 357.A O no hydrogen 3.059 N/A ALA 385.A N ALA 411.A O no hydrogen 3.012 N/A LEU 386.A N GLY 359.A O no hydrogen 2.909 N/A SER 387.A N GLU 394.A OE1 no hydrogen 3.173 N/A SER 387.A OG GLU 394.A OE1 no hydrogen 3.397 N/A SER 387.A OG GLU 394.A OE2 no hydrogen 2.441 N/A GLN 392.A N PRO 389.A O no hydrogen 2.789 N/A ALA 393.A N THR 390.A O no hydrogen 3.029 N/A GLU 394.A N GLU 394.A OE1 no hydrogen 2.825 N/A CYS 395.A SG THR 396.A O no hydrogen 3.715 N/A THR 396.A N GLU 399.A OE2 no hydrogen 3.392 N/A GLU 399.A N THR 396.A OG1 no hydrogen 3.227 N/A ALA 400.A N THR 396.A O no hydrogen 3.167 N/A TYR 401.A N ALA 397.A O no hydrogen 2.972 N/A THR 402.A N GLU 398.A O no hydrogen 2.881 N/A THR 402.A OG1 GLU 398.A O no hydrogen 2.807 N/A THR 402.A OG1 GLU 398.A OE2 no hydrogen 3.472 N/A LEU 403.A N GLU 399.A O no hydrogen 2.949 N/A THR 404.A N ALA 400.A O no hydrogen 3.224 N/A THR 404.A OG1 ALA 400.A O no hydrogen 2.769 N/A THR 404.A OG1 TYR 401.A O no hydrogen 3.422 N/A GLU 405.A N THR 402.A O no hydrogen 3.085 N/A GLY 406.A N TYR 401.A O no hydrogen 2.666 N/A ARG 407.A N THR 404.A O no hydrogen 3.073 N/A ARG 407.A NH1 ALA 375.A O no hydrogen 3.270 N/A ARG 407.A NH1 ASN 378.A O no hydrogen 2.970 N/A ARG 407.A NH1 GLU 379.A O no hydrogen 2.546 N/A ARG 407.A NH2 ALA 375.A O no hydrogen 2.797 N/A CYS 408.A N THR 404.A OG1 no hydrogen 3.250 N/A CYS 408.A SG THR 404.A OG1 no hydrogen 3.278 N/A LEU 409.A N PRO 381.A O no hydrogen 2.983 N/A ALA 411.A N ILE 383.A O no hydrogen 3.319 N/A SER 412.A N GLY 430.A O no hydrogen 3.222 N/A SER 412.A OG SER 414.A O no hydrogen 2.722 N/A GLY 413.A N ALA 385.A O no hydrogen 3.147 N/A SER 414.A OG THR 87.A OG1 no hydrogen 2.726 N/A SER 414.A OG ASN 388.A OD1 no hydrogen 2.610 N/A VAL 419.A N PHE 427.A O no hydrogen 2.769 N/A LYS 420.A NZ GLY 424.A O no hydrogen 3.026 N/A LEU 421.A N ARG 425.A O no hydrogen 2.749 N/A GLY 424.A N LEU 421.A O no hydrogen 2.620 N/A ARG 425.A N ASP 423.A OD1 no hydrogen 2.747 N/A ARG 425.A NH1 GLU 405.A O no hydrogen 3.080 N/A PHE 427.A N VAL 419.A O no hydrogen 2.695 N/A THR 428.A N GLN 476.A O no hydrogen 2.826 N/A GLN 431.A NE2 GLY 413.A O no hydrogen 2.772 N/A ASN 433.A N GLN 431.A O no hydrogen 2.837 N/A ASN 433.A ND2 GLY 413.A O no hydrogen 3.046 N/A ASN 434.A ND2 ASP 249.A O no hydrogen 3.385 N/A VAL 435.A N ASN 433.A OD1 no hydrogen 2.954 N/A TYR 436.A N ASN 433.A O no hydrogen 3.103 N/A TYR 436.A OH PRO 481.A O no hydrogen 2.622 N/A ILE 437.A N ASN 434.A O no hydrogen 2.746 N/A PHE 438.A N ASN 434.A O no hydrogen 3.135 N/A VAL 441.A N ILE 437.A O no hydrogen 3.025 N/A ALA 442.A N PHE 438.A O no hydrogen 2.848 N/A LEU 443.A N PRO 439.A O no hydrogen 3.025 N/A ALA 444.A N GLY 440.A O no hydrogen 3.153 N/A VAL 445.A N VAL 441.A O no hydrogen 3.001 N/A ILE 446.A N ALA 442.A O no hydrogen 2.885 N/A LEU 447.A N LEU 443.A O no hydrogen 2.829 N/A CYS 448.A N ALA 444.A O no hydrogen 2.951 N/A CYS 448.A SG ALA 444.A O no hydrogen 3.234 N/A CYS 448.A SG THR 498.A OG1 no hydrogen 3.636 N/A ASN 449.A N ILE 446.A O no hydrogen 3.136 N/A ASN 449.A ND2 ILE 446.A O no hydrogen 3.295 N/A THR 450.A N VAL 445.A O no hydrogen 3.148 N/A SER 454.A OG SER 456.A OG no hydrogen 2.707 N/A SER 456.A OG SER 454.A OG no hydrogen 2.707 N/A SER 456.A OG TYR 500.A OH no hydrogen 2.861 N/A VAL 457.A N SER 454.A O no hydrogen 3.192 N/A PHE 458.A N ASP 455.A O no hydrogen 2.890 N/A LEU 459.A N ASP 455.A O no hydrogen 3.214 N/A GLU 460.A N SER 456.A O no hydrogen 2.978 N/A ALA 461.A N VAL 457.A O no hydrogen 2.936 N/A ALA 462.A N PHE 458.A O no hydrogen 2.962 N/A LYS 463.A N LEU 459.A O no hydrogen 3.150 N/A LYS 463.A NZ GLU 298.A OE1 no hydrogen 3.075 N/A LYS 463.A NZ GLU 298.A OE2 no hydrogen 3.034 N/A ALA 464.A N GLU 460.A O no hydrogen 2.780 N/A LEU 465.A N ALA 461.A O no hydrogen 2.851 N/A THR 466.A N ALA 462.A O no hydrogen 3.186 N/A SER 467.A N LYS 463.A O no hydrogen 3.093 N/A SER 467.A OG LYS 463.A O no hydrogen 3.489 N/A SER 467.A OG ALA 464.A O no hydrogen 2.961 N/A GLN 468.A N LEU 465.A O no hydrogen 3.312 N/A GLN 468.A NE2 ALA 464.A O no hydrogen 3.280 N/A GLN 468.A NE2 VAL 489.A O no hydrogen 3.172 N/A LEU 469.A N THR 466.A O no hydrogen 2.990 N/A THR 470.A N GLU 473.A OE1 no hydrogen 2.901 N/A GLU 473.A N THR 470.A OG1 no hydrogen 3.292 N/A LEU 474.A N THR 470.A O no hydrogen 2.937 N/A ALA 475.A N ASP 471.A O no hydrogen 2.883 N/A GLN 476.A N GLU 473.A O no hydrogen 3.001 N/A GLY 477.A N LEU 474.A O no hydrogen 3.116 N/A ARG 478.A N GLU 473.A O no hydrogen 3.151 N/A ARG 478.A NE GLN 476.A OE1 no hydrogen 3.164 N/A TYR 480.A OH VAL 257.A O no hydrogen 2.525 N/A ASN 485.A N PRO 482.A O no hydrogen 2.884 N/A ILE 486.A N LEU 483.A O no hydrogen 3.111 N/A VAL 489.A N ASN 485.A O no hydrogen 2.886 N/A SER 490.A N ILE 486.A O no hydrogen 2.820 N/A SER 490.A OG ILE 486.A O no hydrogen 2.823 N/A ILE 491.A N GLN 487.A O no hydrogen 3.235 N/A ASN 492.A N GLU 488.A O no hydrogen 3.010 N/A ASN 492.A ND2 GLN 468.A OE1 no hydrogen 2.694 N/A ILE 493.A N VAL 489.A O no hydrogen 3.000 N/A ALA 494.A N SER 490.A O no hydrogen 2.910 N/A ILE 495.A N ILE 491.A O no hydrogen 2.896 N/A LYS 496.A N ASN 492.A O no hydrogen 3.097 N/A LYS 496.A NZ GLU 460.A OE1 no hydrogen 3.542 N/A VAL 497.A N ILE 493.A O no hydrogen 2.900 N/A THR 498.A N ALA 494.A O no hydrogen 2.902 N/A THR 498.A OG1 ALA 494.A O no hydrogen 2.885 N/A GLU 499.A N ILE 495.A O no hydrogen 2.999 N/A TYR 500.A N LYS 496.A O no hydrogen 2.925 N/A TYR 500.A OH SER 456.A OG no hydrogen 2.861 N/A LEU 501.A N VAL 497.A O no hydrogen 2.722 N/A TYR 502.A N THR 498.A O no hydrogen 3.000 N/A TYR 502.A OH ARG 508.A O no hydrogen 2.466 N/A ALA 503.A N GLU 499.A O no hydrogen 2.856 N/A ASN 504.A N TYR 500.A O no hydrogen 3.080 N/A ASN 504.A ND2 TYR 500.A O no hydrogen 2.802 N/A LYS 505.A N TYR 502.A O no hydrogen 3.053 N/A PHE 507.A N CYS 448.A O no hydrogen 2.784 N/A ARG 508.A N CYS 448.A O no hydrogen 3.124 N/A ARG 508.A NH1 PRO 510.A O no hydrogen 2.683 N/A LYS 515.A NZ GLU 511.A OE2 no hydrogen 3.018 N/A LYS 517.A N ASP 514.A OD1 no hydrogen 3.024 N/A LYS 517.A NZ GLU 521.A OE2 no hydrogen 3.325 N/A TYR 518.A N ASP 514.A O no hydrogen 3.025 N/A TYR 518.A OH LEU 447.A O no hydrogen 2.919 N/A VAL 519.A N LYS 515.A O no hydrogen 3.172 N/A LYS 520.A N ALA 516.A O no hydrogen 3.094 N/A GLU 521.A N LYS 517.A O no hydrogen 3.003 N/A ARG 522.A N VAL 519.A O no hydrogen 2.980 N/A ARG 522.A NH1 TYR 518.A O no hydrogen 2.848 N/A ARG 522.A NH1 GLU 521.A OE1 no hydrogen 3.363 N/A THR 523.A OG1 LYS 520.A O no hydrogen 3.328 N/A TRP 524.A N GLY 165.A O no hydrogen 2.722 N/A ARG 525.A NH2 LYS 520.A O no hydrogen 3.381 N/A SER 526.A OG GLU 527.A OE2 no hydrogen 3.262 N/A LEU 531.A N GLU 22.A OE2 no hydrogen 2.753 N/A LEU 532.A N SER 530.A OG no hydrogen 3.287 N/A TRP 538.A N GLU 537.A OE2 no hydrogen 3.000 N/A