Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xby_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 2.A O no hydrogen 2.497 N/A ALA 7.A N THR 3.A O no hydrogen 2.450 N/A LYS 8.A N GLU 4.A O no hydrogen 2.536 N/A THR 9.A N ASP 5.A O no hydrogen 3.380 N/A THR 9.A OG1 ASP 5.A O no hydrogen 3.063 N/A PHE 10.A N LEU 6.A O no hydrogen 3.174 N/A LEU 11.A N ALA 7.A O no hydrogen 2.744 N/A GLU 12.A N LYS 8.A O no hydrogen 2.693 N/A LYS 13.A N THR 9.A O no hydrogen 3.100 N/A PHE 14.A N PHE 10.A O no hydrogen 2.826 N/A ASN 15.A N LEU 11.A O no hydrogen 2.952 N/A ASN 15.A ND2 GLN 78.A OE1 no hydrogen 3.475 N/A SER 16.A N LYS 13.A O no hydrogen 3.312 N/A ALA 18.A N PHE 14.A O no hydrogen 2.852 N/A LEU 21.A N GLU 17.A O no hydrogen 3.097 N/A SER 22.A N ALA 18.A O no hydrogen 2.961 N/A SER 22.A OG TYR 372.A OH no hydrogen 2.585 N/A HIS 23.A ND1 LEU 333.A O no hydrogen 2.871 N/A GLN 24.A N GLU 20.A O no hydrogen 3.149 N/A SER 25.A N LEU 21.A O no hydrogen 3.318 N/A SER 26.A N SER 22.A O no hydrogen 3.171 N/A SER 26.A OG SER 22.A O no hydrogen 3.373 N/A LEU 27.A N HIS 23.A O no hydrogen 2.911 N/A ALA 28.A N GLN 24.A O no hydrogen 2.970 N/A SER 29.A N SER 25.A O no hydrogen 2.852 N/A TRP 30.A N SER 26.A O no hydrogen 2.620 N/A SER 31.A N LEU 27.A O no hydrogen 2.863 N/A SER 31.A OG LEU 27.A O no hydrogen 2.904 N/A TYR 32.A N ALA 28.A O no hydrogen 3.173 N/A ASN 33.A N SER 29.A O no hydrogen 2.981 N/A ASN 33.A ND2 SER 29.A O no hydrogen 3.174 N/A THR 34.A N TRP 30.A O no hydrogen 2.929 N/A THR 34.A OG1 TRP 30.A O no hydrogen 2.352 N/A ASN 35.A N TYR 32.A O no hydrogen 3.136 N/A ILE 36.A N LYS 323.A O no hydrogen 2.857 N/A ASN 40.A ND2 ASN 35.A O no hydrogen 2.794 N/A VAL 41.A N THR 37.A O no hydrogen 2.940 N/A LYS 43.A N GLU 39.A O no hydrogen 3.240 N/A MET 44.A N ASN 40.A O no hydrogen 3.087 N/A ASN 45.A N VAL 41.A O no hydrogen 2.892 N/A GLU 46.A N GLN 42.A O no hydrogen 2.819 N/A ALA 47.A N LYS 43.A O no hydrogen 2.820 N/A GLY 48.A N MET 44.A O no hydrogen 3.006 N/A ALA 49.A N ASN 45.A O no hydrogen 2.818 N/A ARG 50.A N GLU 46.A O no hydrogen 2.867 N/A TRP 51.A N ALA 47.A O no hydrogen 2.947 N/A SER 52.A N GLY 48.A O no hydrogen 2.770 N/A ALA 53.A N ALA 49.A O no hydrogen 2.932 N/A PHE 54.A N ARG 50.A O no hydrogen 2.941 N/A TYR 55.A N TRP 51.A O no hydrogen 3.082 N/A TYR 55.A OH ALA 81.A O no hydrogen 3.242 N/A GLU 56.A N SER 52.A O no hydrogen 3.250 N/A GLU 57.A N ALA 53.A O no hydrogen 3.132 N/A GLN 58.A N PHE 54.A O no hydrogen 2.948 N/A CYS 59.A N TYR 55.A O no hydrogen 3.049 N/A CYS 59.A SG LEU 82.A O no hydrogen 3.142 N/A LEU 61.A N GLU 57.A O no hydrogen 3.246 N/A ALA 62.A N GLN 58.A O no hydrogen 2.732 N/A LYS 63.A N CYS 59.A O no hydrogen 2.792 N/A LYS 63.A N LYS 60.A O no hydrogen 3.096 N/A THR 64.A N LEU 61.A O no hydrogen 3.248 N/A THR 64.A OG1 LEU 61.A O no hydrogen 3.045 N/A GLU 69.A N PRO 66.A O no hydrogen 3.118 N/A GLN 71.A N GLU 4.A OE1 no hydrogen 2.715 N/A ASN 72.A N GLU 4.A OE1 no hydrogen 2.831 N/A LYS 76.A N ASN 72.A O no hydrogen 2.875 N/A LYS 76.A NZ LEU 67.A O no hydrogen 2.983 N/A LYS 76.A NZ ILE 70.A O no hydrogen 2.133 N/A ARG 77.A N LEU 73.A O no hydrogen 2.590 N/A GLN 78.A N THR 74.A O no hydrogen 2.933 N/A GLN 78.A NE2 THR 74.A O no hydrogen 3.562 N/A LEU 79.A N VAL 75.A O no hydrogen 2.951 N/A GLN 80.A N LYS 76.A O no hydrogen 2.753 N/A ALA 81.A N ARG 77.A O no hydrogen 3.231 N/A ALA 81.A N GLN 78.A O no hydrogen 3.114 N/A LEU 82.A N LEU 79.A O no hydrogen 3.123 N/A GLN 83.A N GLN 80.A O no hydrogen 3.387 N/A SER 88.A OG GLU 56.A OE2 no hydrogen 3.533 N/A LEU 90.A N SER 87.A O no hydrogen 3.146 N/A LYS 94.A NZ GLU 171.A OE2 no hydrogen 3.125 N/A SER 95.A N SER 91.A O no hydrogen 2.515 N/A SER 95.A OG SER 87.A O no hydrogen 3.569 N/A LYS 96.A N ALA 92.A O no hydrogen 3.384 N/A ARG 97.A NE GLU 164.A OE2 no hydrogen 2.775 N/A ARG 97.A NH1 GLU 100.A OE1 no hydrogen 3.216 N/A ARG 97.A NH2 GLU 164.A OE2 no hydrogen 3.323 N/A LEU 98.A N LYS 94.A O no hydrogen 3.145 N/A ASN 99.A N SER 95.A O no hydrogen 3.336 N/A GLU 100.A N LYS 96.A O no hydrogen 2.992 N/A ILE 101.A N ARG 97.A O no hydrogen 3.057 N/A LEU 102.A N LEU 98.A O no hydrogen 2.904 N/A ASN 103.A N ASN 99.A O no hydrogen 3.212 N/A THR 104.A N GLU 100.A O no hydrogen 2.982 N/A THR 104.A OG1 GLU 100.A O no hydrogen 2.561 N/A MET 105.A N ILE 101.A O no hydrogen 2.798 N/A SER 106.A N LEU 102.A O no hydrogen 2.959 N/A SER 106.A OG ASN 490.A OD1 no hydrogen 2.726 N/A THR 107.A N ASN 103.A O no hydrogen 3.118 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.587 N/A THR 107.A OG1 THR 104.A O no hydrogen 2.812 N/A ILE 108.A N THR 104.A O no hydrogen 3.041 N/A TYR 109.A N MET 105.A O no hydrogen 3.207 N/A SER 110.A N SER 106.A O no hydrogen 3.211 N/A SER 110.A OG SER 106.A O no hydrogen 2.656 N/A SER 110.A OG THR 107.A O no hydrogen 3.021 N/A THR 111.A N THR 107.A O no hydrogen 2.832 N/A THR 111.A OG1 THR 107.A O no hydrogen 2.575 N/A VAL 114.A N LEU 124.A O no hydrogen 2.974 N/A ASN 116.A N GLU 122.A O no hydrogen 2.912 N/A ASN 116.A ND2 GLU 122.A OE1 no hydrogen 3.216 N/A SER 118.A N ASN 116.A OD1 no hydrogen 3.310 N/A ASN 119.A N ASN 116.A O no hydrogen 3.042 N/A GLU 122.A N ASN 119.A O no hydrogen 2.934 N/A CYS 123.A SG PRO 120.A O no hydrogen 3.307 N/A LEU 124.A N VAL 114.A O no hydrogen 2.801 N/A LEU 130.A N LEU 125.A O no hydrogen 2.772 N/A ASP 131.A N LEU 126.A O no hydrogen 2.790 N/A ALA 132.A N PRO 128.A O no hydrogen 3.230 N/A ILE 133.A N GLY 129.A O no hydrogen 3.322 N/A MET 134.A N LEU 130.A O no hydrogen 3.078 N/A GLU 135.A N ASP 131.A O no hydrogen 2.973 N/A ASN 136.A ND2 ALA 132.A O no hydrogen 3.116 N/A SER 137.A N ILE 133.A O no hydrogen 2.952 N/A SER 137.A OG GLN 142.A OE1 no hydrogen 2.517 N/A LYS 138.A NZ ASN 136.A O no hydrogen 3.539 N/A ASP 139.A N SER 137.A OG no hydrogen 3.250 N/A GLN 142.A N ASP 139.A OD2 no hydrogen 2.654 N/A ARG 143.A N ASP 139.A O no hydrogen 3.123 N/A ARG 143.A NE HIS 247.A O no hydrogen 2.538 N/A ARG 143.A NH1 MET 134.A O no hydrogen 2.836 N/A ARG 143.A NH1 SER 137.A O no hydrogen 2.946 N/A ARG 143.A NH2 MET 134.A O no hydrogen 3.015 N/A ARG 143.A NH2 HIS 247.A O no hydrogen 3.266 N/A LEU 144.A N TYR 140.A O no hydrogen 3.051 N/A LEU 144.A N ASN 141.A O no hydrogen 2.978 N/A TRP 145.A N ASN 141.A O no hydrogen 3.156 N/A TRP 147.A N ARG 143.A O no hydrogen 3.040 N/A GLU 148.A N LEU 144.A O no hydrogen 2.761 N/A GLY 149.A N TRP 145.A O no hydrogen 2.735 N/A TRP 150.A N ALA 146.A O no hydrogen 2.996 N/A TRP 150.A NE1 ALA 484.A O no hydrogen 2.876 N/A ARG 151.A N TRP 147.A O no hydrogen 3.252 N/A ARG 151.A NH1 TRP 147.A O no hydrogen 3.486 N/A ARG 151.A NH1 MET 252.A O no hydrogen 3.157 N/A ARG 151.A NH2 MET 252.A O no hydrogen 2.758 N/A SER 152.A N GLU 148.A O no hydrogen 2.712 N/A SER 152.A N GLY 149.A O no hydrogen 3.261 N/A GLU 153.A N GLY 149.A O no hydrogen 2.790 N/A VAL 154.A N TRP 150.A O no hydrogen 3.273 N/A GLY 155.A N TRP 150.A O no hydrogen 3.371 N/A LEU 158.A N VAL 154.A O no hydrogen 3.300 N/A ARG 159.A N LYS 156.A O no hydrogen 3.295 N/A ARG 159.A NE GLU 163.A OE2 no hydrogen 2.903 N/A ARG 159.A NH1 GLU 477.A OE1 no hydrogen 3.162 N/A ARG 159.A NH1 TYR 479.A O no hydrogen 2.962 N/A ARG 159.A NH2 LYS 452.A O no hydrogen 2.558 N/A ARG 159.A NH2 GLU 477.A OE1 no hydrogen 3.469 N/A TYR 162.A N LEU 158.A O no hydrogen 2.838 N/A GLU 163.A N ARG 159.A O no hydrogen 3.208 N/A GLU 164.A N PRO 160.A O no hydrogen 3.289 N/A TYR 165.A N LEU 161.A O no hydrogen 2.687 N/A TYR 165.A OH ASP 491.A OD1 no hydrogen 2.667 N/A VAL 166.A N TYR 162.A O no hydrogen 2.738 N/A VAL 167.A N GLU 163.A O no hydrogen 3.372 N/A LEU 168.A N GLU 164.A O no hydrogen 2.942 N/A LYS 169.A N TYR 165.A O no hydrogen 2.887 N/A LYS 169.A NZ TYR 181.A OH no hydrogen 3.006 N/A LYS 169.A NZ ASP 491.A OD1 no hydrogen 3.540 N/A LYS 169.A NZ ASP 491.A OD2 no hydrogen 2.495 N/A ASN 170.A N VAL 166.A O no hydrogen 2.944 N/A ASN 170.A ND2 PHE 446.A O no hydrogen 3.680 N/A GLU 171.A N VAL 167.A O no hydrogen 3.140 N/A MET 172.A N LEU 168.A O no hydrogen 3.209 N/A ALA 173.A N LYS 169.A O no hydrogen 3.187 N/A ARG 174.A N ASN 170.A O no hydrogen 2.773 N/A ALA 175.A N GLU 171.A O no hydrogen 3.028 N/A ASN 176.A N ALA 173.A O no hydrogen 2.970 N/A TYR 178.A N ALA 173.A O no hydrogen 3.129 N/A GLU 179.A N ASP 183.A OD2 no hydrogen 2.996 N/A TYR 181.A N ASN 170.A OD1 no hydrogen 3.138 N/A TYR 181.A OH ASP 491.A OD1 no hydrogen 2.741 N/A ASP 183.A N ASP 180.A OD2 no hydrogen 3.199 N/A TYR 184.A N ASP 180.A O no hydrogen 2.920 N/A TRP 185.A N TYR 181.A O no hydrogen 2.923 N/A ARG 186.A N GLY 182.A O no hydrogen 3.039 N/A GLY 187.A N TYR 184.A O no hydrogen 3.140 N/A ASP 188.A N TRP 185.A O no hydrogen 3.408 N/A TYR 189.A N ARG 186.A O no hydrogen 3.093 N/A TYR 189.A OH GLU 380.A OE2 no hydrogen 2.930 N/A TYR 189.A OH THR 499.A OG1 no hydrogen 2.956 N/A GLU 190.A N GLY 187.A O no hydrogen 3.321 N/A ALA 191.A N TYR 199.A O no hydrogen 2.901 N/A TYR 197.A N PRO 194.A O no hydrogen 2.961 N/A TYR 197.A OH GLU 553.A OE1 no hydrogen 2.879 N/A TYR 199.A N ALA 191.A O no hydrogen 2.649 N/A TYR 199.A OH ASP 207.A OD2 no hydrogen 2.932 N/A SER 200.A N GLN 203.A OE1 no hydrogen 3.217 N/A SER 200.A OG GLN 203.A OE1 no hydrogen 3.281 N/A ARG 201.A NE ASP 183.A OD1 no hydrogen 3.102 N/A ARG 201.A NE ASP 183.A OD2 no hydrogen 3.154 N/A ARG 201.A NH1 GLU 190.A OE1 no hydrogen 2.421 N/A ARG 201.A NH2 ASP 183.A OD2 no hydrogen 3.035 N/A GLN 203.A N SER 200.A OG no hydrogen 3.098 N/A LEU 204.A N ARG 201.A O no hydrogen 3.350 N/A ASP 207.A N GLN 203.A O no hydrogen 2.850 N/A VAL 208.A N LEU 204.A O no hydrogen 2.952 N/A GLU 209.A N ILE 205.A O no hydrogen 2.941 N/A ARG 210.A N GLU 206.A O no hydrogen 2.702 N/A ARG 210.A NE ASP 207.A OD1 no hydrogen 3.441 N/A ARG 210.A NH2 ASP 207.A OD1 no hydrogen 3.473 N/A ARG 210.A NH2 MET 561.A O no hydrogen 3.161 N/A THR 211.A N ASP 207.A O no hydrogen 3.000 N/A THR 211.A OG1 ASP 207.A O no hydrogen 2.668 N/A THR 211.A OG1 VAL 208.A O no hydrogen 2.728 N/A THR 211.A OG1 TYR 498.A OH no hydrogen 2.784 N/A PHE 212.A N VAL 208.A O no hydrogen 2.909 N/A ALA 213.A N GLU 209.A O no hydrogen 3.134 N/A ILE 215.A N THR 211.A O no hydrogen 3.150 N/A ILE 215.A N PHE 212.A O no hydrogen 2.942 N/A LYS 216.A N PHE 212.A O no hydrogen 2.836 N/A LYS 216.A NZ GLU 220.A OE2 no hydrogen 3.361 N/A TYR 219.A N ILE 215.A O no hydrogen 3.052 N/A TYR 219.A OH VAL 467.A O no hydrogen 2.534 N/A GLU 220.A N LYS 216.A O no hydrogen 2.904 N/A HIS 221.A N PRO 217.A O no hydrogen 3.379 N/A LEU 222.A N LEU 218.A O no hydrogen 3.131 N/A HIS 223.A N TYR 219.A O no hydrogen 2.617 N/A HIS 223.A NE2 GLY 468.A O no hydrogen 2.923 N/A ALA 224.A N GLU 220.A O no hydrogen 2.759 N/A TYR 225.A N HIS 221.A O no hydrogen 3.008 N/A TYR 225.A OH THR 264.A O no hydrogen 2.727 N/A VAL 226.A N LEU 222.A O no hydrogen 3.012 N/A ARG 227.A N HIS 223.A O no hydrogen 2.923 N/A ARG 227.A NH1 GLY 242.A O no hydrogen 2.808 N/A ARG 227.A NH1 GLY 587.A O no hydrogen 2.770 N/A ARG 227.A NH2 GLY 587.A O no hydrogen 2.775 N/A ALA 228.A N ALA 224.A O no hydrogen 2.831 N/A LYS 229.A N TYR 225.A O no hydrogen 3.109 N/A LEU 230.A N VAL 226.A O no hydrogen 2.870 N/A MET 231.A N ARG 227.A O no hydrogen 3.153 N/A ASP 232.A N LYS 229.A O no hydrogen 3.234 N/A THR 233.A N LEU 230.A O no hydrogen 3.139 N/A TYR 234.A N LEU 230.A O no hydrogen 2.888 N/A HIS 237.A N TYR 234.A O no hydrogen 3.190 N/A GLY 242.A N ASN 239.A O no hydrogen 3.120 N/A CYS 243.A SG ARG 464.A O no hydrogen 3.404 N/A CYS 243.A SG SER 589.A O no hydrogen 3.992 N/A LEU 244.A N GLY 468.A O no hydrogen 3.099 N/A ALA 246.A N VAL 470.A O no hydrogen 2.904 N/A TRP 253.A N ASP 251.A OD1 no hydrogen 3.155 N/A TRP 253.A NE1 ALA 484.A O no hydrogen 2.680 N/A GLY 254.A N ASP 251.A OD1 no hydrogen 2.425 N/A ARG 255.A N ASP 251.A OD1 no hydrogen 3.143 N/A PHE 256.A N ASP 251.A OD2 no hydrogen 3.005 N/A TRP 257.A N LEU 426.A O no hydrogen 3.131 N/A THR 258.A OG1 THR 427.A OG1 no hydrogen 2.882 N/A ASN 259.A ND2 GLY 250.A O no hydrogen 2.674 N/A LEU 260.A N TRP 257.A O no hydrogen 3.208 N/A TYR 261.A N THR 258.A O no hydrogen 3.435 N/A THR 264.A N TYR 261.A O no hydrogen 3.202 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.461 N/A PHE 267.A N ASN 419.A OD1 no hydrogen 2.822 N/A LYS 270.A N PHE 267.A O no hydrogen 3.197 N/A LYS 270.A NZ ASP 413.A OD2 no hydrogen 2.573 N/A LYS 270.A NZ GLU 415.A OE1 no hydrogen 3.442 N/A THR 276.A N ASP 274.A OD1 no hydrogen 3.148 N/A THR 276.A OG1 ASP 274.A OD1 no hydrogen 2.763 N/A MET 279.A N VAL 275.A O no hydrogen 2.940 N/A VAL 280.A N THR 276.A O no hydrogen 3.088 N/A ASP 281.A N ASP 277.A O no hydrogen 2.811 N/A GLN 282.A N ALA 278.A O no hydrogen 2.875 N/A GLN 282.A NE2 GLY 404.A O no hydrogen 2.589 N/A SER 283.A N VAL 280.A O no hydrogen 3.070 N/A TRP 284.A N MET 279.A O no hydrogen 2.892 N/A ARG 288.A N ASP 285.A OD1 no hydrogen 3.076 N/A ARG 288.A NE GLU 292.A OE1 no hydrogen 2.808 N/A ILE 289.A N ASP 285.A O no hydrogen 3.226 N/A PHE 290.A N ALA 286.A O no hydrogen 3.336 N/A GLU 291.A N LYS 287.A O no hydrogen 2.997 N/A GLU 292.A N ARG 288.A O no hydrogen 2.992 N/A ALA 293.A N ILE 289.A O no hydrogen 3.059 N/A GLU 294.A N PHE 290.A O no hydrogen 2.835 N/A LYS 295.A N GLU 291.A O no hydrogen 2.963 N/A PHE 296.A N GLU 292.A O no hydrogen 3.043 N/A PHE 297.A N ALA 293.A O no hydrogen 3.191 N/A VAL 298.A N GLU 294.A O no hydrogen 2.937 N/A SER 299.A N LYS 295.A O no hydrogen 2.794 N/A SER 299.A OG LYS 295.A O no hydrogen 3.365 N/A SER 299.A OG PHE 296.A O no hydrogen 2.351 N/A VAL 300.A N PHE 297.A O no hydrogen 3.338 N/A GLY 301.A N VAL 298.A O no hydrogen 3.026 N/A LEU 302.A N PHE 297.A O no hydrogen 2.847 N/A MET 305.A N GLU 294.A OE2 no hydrogen 3.288 N/A GLN 307.A NE2 GLU 311.A OE2 no hydrogen 2.888 N/A PHE 309.A N THR 306.A O no hydrogen 3.121 N/A PHE 309.A N THR 306.A OG1 no hydrogen 3.077 N/A TRP 310.A N GLN 307.A O no hydrogen 3.245 N/A GLU 311.A N GLN 307.A O no hydrogen 3.285 N/A ASN 312.A N GLY 308.A O no hydrogen 2.846 N/A SER 313.A N PHE 309.A O no hydrogen 3.270 N/A SER 313.A OG PHE 309.A O no hydrogen 2.458 N/A MET 314.A N ILE 340.A O no hydrogen 3.082 N/A THR 316.A OG1 LEU 315.A O no hydrogen 2.639 N/A ARG 322.A NE THR 34.A O no hydrogen 3.203 N/A ARG 322.A NH1 ASP 320.A OD2 no hydrogen 2.776 N/A CYS 326.A SG GLU 317.A OE1 no hydrogen 3.250 N/A THR 329.A N LYS 341.A O no hydrogen 3.200 N/A THR 329.A OG1 HIS 327.A O no hydrogen 3.432 N/A TRP 331.A N ARG 339.A O no hydrogen 2.636 N/A TRP 331.A NE1 THR 329.A OG1 no hydrogen 3.130 N/A LEU 333.A N ASP 337.A O no hydrogen 3.057 N/A GLY 334.A N ASP 332.A OD1 no hydrogen 3.354 N/A ASP 337.A N GLY 334.A O no hydrogen 3.009 N/A ARG 339.A N TRP 331.A O no hydrogen 3.205 N/A ARG 339.A NE ASP 337.A OD1 no hydrogen 2.921 N/A ARG 339.A NE ASP 337.A OD2 no hydrogen 3.123 N/A ARG 339.A NH2 ASP 337.A OD2 no hydrogen 2.536 N/A ILE 340.A N SER 313.A OG no hydrogen 3.246 N/A LYS 341.A N THR 329.A O no hydrogen 2.860 N/A LYS 341.A NZ HIS 327.A O no hydrogen 2.717 N/A MET 342.A N MET 314.A O no hydrogen 2.723 N/A THR 344.A OG1 LEU 315.A O no hydrogen 2.889 N/A LYS 345.A N ASP 350.A OD2 no hydrogen 2.673 N/A LYS 345.A NZ CYS 343.A O no hydrogen 3.446 N/A MET 348.A N THR 276.A OG1 no hydrogen 2.865 N/A ASP 350.A N THR 347.A OG1 no hydrogen 3.330 N/A PHE 351.A N THR 347.A O no hydrogen 3.059 N/A LEU 352.A N MET 348.A O no hydrogen 3.059 N/A THR 353.A N ASP 349.A O no hydrogen 2.894 N/A THR 353.A OG1 ASP 350.A O no hydrogen 3.394 N/A ALA 354.A N ASP 350.A O no hydrogen 3.013 N/A HIS 355.A ND1 PHE 351.A O no hydrogen 2.800 N/A HIS 356.A N LEU 352.A O no hydrogen 3.067 N/A HIS 356.A NE2 GLU 384.A OE2 no hydrogen 2.750 N/A GLU 357.A N THR 353.A O no hydrogen 2.705 N/A MET 358.A N ALA 354.A O no hydrogen 2.853 N/A GLY 359.A N HIS 355.A O no hydrogen 2.789 N/A HIS 360.A N HIS 356.A O no hydrogen 3.139 N/A HIS 360.A ND1 HIS 383.A ND1 no hydrogen 2.903 N/A HIS 360.A NE2 HIS 356.A NE2 no hydrogen 2.963 N/A HIS 360.A NE2 GLU 384.A OE2 no hydrogen 3.122 N/A ILE 361.A N GLU 357.A O no hydrogen 3.068 N/A GLN 362.A N MET 358.A O no hydrogen 2.911 N/A GLN 362.A NE2 PRO 303.A O no hydrogen 2.952 N/A TYR 363.A N GLY 359.A O no hydrogen 3.300 N/A ASP 364.A N HIS 360.A O no hydrogen 3.038 N/A MET 365.A N ILE 361.A O no hydrogen 2.807 N/A ALA 366.A N GLN 362.A O no hydrogen 3.077 N/A TYR 367.A N TYR 363.A O no hydrogen 3.340 N/A TYR 367.A OH HIS 383.A NE2 no hydrogen 3.141 N/A ALA 368.A N MET 365.A O no hydrogen 3.406 N/A GLN 370.A N TYR 367.A O no hydrogen 3.019 N/A GLN 370.A NE2 SER 541.A O no hydrogen 2.637 N/A TYR 372.A OH SER 22.A OG no hydrogen 2.585 N/A LEU 374.A N PRO 371.A O no hydrogen 3.088 N/A ARG 375.A N TYR 372.A O no hydrogen 3.175 N/A ARG 375.A NE GLN 370.A O no hydrogen 2.804 N/A ARG 375.A NH1 GLU 19.A OE2 no hydrogen 3.112 N/A ARG 375.A NH2 GLN 370.A O no hydrogen 3.190 N/A ASN 376.A N LEU 374.A O no hydrogen 3.215 N/A ALA 378.A N TYR 363.A OH no hydrogen 3.248 N/A ASN 379.A ND2 TYR 503.A OH no hydrogen 3.155 N/A GLY 381.A N ASN 379.A OD1 no hydrogen 2.791 N/A PHE 382.A N ASN 379.A O no hydrogen 3.387 N/A HIS 383.A ND1 HIS 360.A ND1 no hydrogen 2.903 N/A HIS 383.A NE2 TYR 367.A OH no hydrogen 3.141 N/A ALA 385.A N GLY 381.A O no hydrogen 3.404 N/A VAL 386.A N PHE 382.A O no hydrogen 2.948 N/A GLY 387.A N HIS 383.A O no hydrogen 3.040 N/A GLU 388.A N GLU 384.A O no hydrogen 2.910 N/A ILE 389.A N ALA 385.A O no hydrogen 3.201 N/A SER 391.A OG LEU 352.A O no hydrogen 3.050 N/A LEU 392.A N GLU 388.A O no hydrogen 3.160 N/A SER 393.A N ILE 389.A O no hydrogen 3.394 N/A ALA 394.A N MET 390.A O no hydrogen 3.058 N/A ALA 395.A N SER 391.A O no hydrogen 2.951 N/A THR 396.A OG1 SER 393.A O no hydrogen 2.653 N/A HIS 399.A N THR 396.A OG1 no hydrogen 3.321 N/A LEU 400.A N THR 396.A O no hydrogen 3.060 N/A LYS 401.A N PRO 397.A O no hydrogen 2.886 N/A ALA 402.A N ASN 398.A O no hydrogen 3.376 N/A ILE 403.A N HIS 399.A O no hydrogen 2.905 N/A GLY 404.A N LEU 400.A O no hydrogen 3.001 N/A LEU 405.A N LEU 400.A O no hydrogen 3.096 N/A PHE 410.A N PRO 407.A O no hydrogen 2.970 N/A GLU 417.A N ASP 413.A O no hydrogen 3.066 N/A ILE 418.A N SER 414.A O no hydrogen 3.031 N/A ASN 419.A N GLU 415.A O no hydrogen 2.854 N/A ASN 419.A ND2 PHE 267.A O no hydrogen 2.641 N/A PHE 420.A N THR 416.A O no hydrogen 2.918 N/A LEU 421.A N GLU 417.A O no hydrogen 2.866 N/A LEU 422.A N ILE 418.A O no hydrogen 2.850 N/A LYS 423.A N ASN 419.A O no hydrogen 3.265 N/A LYS 423.A NZ ASN 272.A OD1 no hydrogen 2.912 N/A GLN 424.A N PHE 420.A O no hydrogen 2.995 N/A GLN 424.A NE2 TYR 569.A OH no hydrogen 3.107 N/A ALA 425.A N LEU 421.A O no hydrogen 2.878 N/A LEU 426.A N LEU 422.A O no hydrogen 3.033 N/A THR 427.A N LYS 423.A O no hydrogen 3.467 N/A THR 427.A OG1 THR 258.A OG1 no hydrogen 2.882 N/A THR 427.A OG1 LYS 423.A O no hydrogen 3.318 N/A ILE 428.A N GLN 424.A O no hydrogen 2.693 N/A GLY 430.A N ALA 425.A O no hydrogen 2.833 N/A THR 431.A OG1 ARG 255.A O no hydrogen 2.775 N/A LEU 432.A N VAL 429.A O no hydrogen 3.263 N/A THR 435.A N THR 431.A O no hydrogen 2.740 N/A THR 435.A OG1 THR 431.A O no hydrogen 2.771 N/A TYR 436.A N LEU 432.A O no hydrogen 2.910 N/A MET 437.A N PRO 433.A O no hydrogen 3.012 N/A LEU 438.A N PHE 434.A O no hydrogen 3.090 N/A GLU 439.A N THR 435.A O no hydrogen 3.185 N/A LYS 440.A N TYR 436.A O no hydrogen 2.916 N/A LYS 440.A NZ GLU 209.A OE2 no hydrogen 2.859 N/A TRP 441.A N MET 437.A O no hydrogen 2.935 N/A TRP 441.A NE1 TRP 455.A O no hydrogen 3.115 N/A ARG 442.A N LEU 438.A O no hydrogen 3.116 N/A ARG 442.A NE GLU 439.A OE1 no hydrogen 3.467 N/A ARG 442.A NH1 TYR 492.A O no hydrogen 3.017 N/A ARG 442.A NH2 GLU 439.A OE1 no hydrogen 2.866 N/A ARG 442.A NH2 TYR 492.A O no hydrogen 2.658 N/A TRP 443.A N GLU 439.A O no hydrogen 2.765 N/A MET 444.A N LYS 440.A O no hydrogen 2.971 N/A VAL 445.A N TRP 441.A O no hydrogen 2.913 N/A PHE 446.A N ARG 442.A O no hydrogen 2.990 N/A LYS 447.A N TRP 443.A O no hydrogen 2.913 N/A GLY 448.A N VAL 445.A O no hydrogen 3.093 N/A GLU 449.A N MET 444.A O no hydrogen 2.919 N/A GLU 454.A N PRO 451.A O no hydrogen 2.707 N/A MET 456.A N GLU 477.A OE1 no hydrogen 3.047 N/A LYS 457.A N GLU 477.A OE2 no hydrogen 3.243 N/A LYS 458.A N GLU 454.A O no hydrogen 2.773 N/A LYS 458.A NZ GLU 461.A OE1 no hydrogen 2.647 N/A TRP 459.A N TRP 455.A O no hydrogen 3.129 N/A TRP 460.A NE1 ASP 481.A OD2 no hydrogen 3.139 N/A GLU 461.A N LYS 457.A O no hydrogen 3.209 N/A MET 462.A N LYS 458.A O no hydrogen 2.637 N/A LYS 463.A N TRP 459.A O no hydrogen 2.873 N/A ARG 464.A N TRP 460.A O no hydrogen 2.835 N/A ARG 464.A NE GLU 471.A OE1 no hydrogen 3.246 N/A GLU 465.A N GLU 461.A O no hydrogen 3.102 N/A ILE 466.A N MET 462.A O no hydrogen 2.749 N/A VAL 469.A N LYS 463.A O no hydrogen 2.910 N/A VAL 470.A N LEU 244.A O no hydrogen 2.952 N/A GLU 471.A N GLU 471.A OE1 no hydrogen 2.471 N/A HIS 475.A ND1 ASP 481.A OD2 no hydrogen 2.656 N/A HIS 475.A NE2 GLU 148.A OE1 no hydrogen 2.648 N/A THR 478.A N ASP 476.A OD1 no hydrogen 3.219 N/A THR 478.A OG1 ASP 476.A OD1 no hydrogen 2.443 N/A TYR 479.A N ASP 476.A O no hydrogen 3.288 N/A TYR 479.A OH GLU 148.A OE2 no hydrogen 2.247 N/A ALA 484.A N ASP 481.A O no hydrogen 2.969 N/A LEU 485.A N PRO 482.A O no hydrogen 3.170 N/A ALA 489.A N LEU 485.A O no hydrogen 3.082 N/A ASN 490.A N PHE 486.A O no hydrogen 2.891 N/A ASN 490.A ND2 PHE 486.A O no hydrogen 2.871 N/A TYR 492.A N HIS 487.A O no hydrogen 3.020 N/A PHE 494.A N GLU 439.A OE1 no hydrogen 3.290 N/A PHE 494.A N GLU 439.A OE2 no hydrogen 3.135 N/A ILE 495.A N GLU 439.A OE2 no hydrogen 3.198 N/A TYR 497.A OH HIS 487.A NE2 no hydrogen 2.781 N/A TYR 498.A N ILE 495.A O no hydrogen 3.023 N/A TYR 498.A OH THR 211.A OG1 no hydrogen 2.784 N/A THR 499.A N ILE 495.A O no hydrogen 3.092 N/A THR 499.A OG1 TYR 189.A OH no hydrogen 2.956 N/A THR 499.A OG1 ARG 496.A O no hydrogen 3.211 N/A ARG 500.A N ARG 496.A O no hydrogen 3.000 N/A THR 501.A OG1 TYR 497.A O no hydrogen 2.749 N/A ILE 502.A N TYR 498.A O no hydrogen 3.404 N/A TYR 503.A N THR 499.A O no hydrogen 2.778 N/A GLN 504.A N ARG 500.A O no hydrogen 3.089 N/A GLN 506.A N ILE 502.A O no hydrogen 3.160 N/A GLN 506.A NE2 ASN 560.A O no hydrogen 3.105 N/A PHE 507.A N TYR 503.A O no hydrogen 2.752 N/A GLN 508.A N GLN 504.A O no hydrogen 2.836 N/A GLN 508.A NE2 SER 393.A OG no hydrogen 3.307 N/A GLU 509.A N PHE 505.A O no hydrogen 2.990 N/A ALA 510.A N GLN 506.A O no hydrogen 3.279 N/A LEU 511.A N PHE 507.A O no hydrogen 2.948 N/A CYS 512.A N GLN 508.A O no hydrogen 2.772 N/A CYS 512.A SG GLN 508.A O no hydrogen 3.010 N/A GLN 513.A N GLU 509.A O no hydrogen 2.893 N/A THR 514.A N ALA 510.A O no hydrogen 3.040 N/A THR 514.A OG1 ALA 510.A O no hydrogen 3.181 N/A ALA 515.A N LEU 511.A O no hydrogen 2.941 N/A LYS 516.A N GLN 513.A O no hydrogen 3.023 N/A HIS 517.A N CYS 512.A O no hydrogen 3.014 N/A LYS 523.A N PRO 520.A O no hydrogen 3.204 N/A LYS 523.A NZ GLU 417.A OE2 no hydrogen 2.434 N/A CYS 524.A N LEU 521.A O no hydrogen 3.005 N/A SER 527.A N ASP 525.A OD1 no hydrogen 3.158 N/A SER 527.A OG HIS 399.A ND1 no hydrogen 2.897 N/A SER 527.A OG ASP 525.A OD1 no hydrogen 2.577 N/A SER 527.A OG ASP 525.A OD2 no hydrogen 3.340 N/A SER 529.A N ILE 526.A O no hydrogen 3.283 N/A ALA 532.A N SER 529.A OG no hydrogen 3.285 N/A GLY 533.A N SER 529.A O no hydrogen 3.270 N/A GLN 534.A N THR 530.A O no hydrogen 3.072 N/A LYS 535.A N GLU 531.A O no hydrogen 3.250 N/A LEU 536.A N ALA 532.A O no hydrogen 2.900 N/A LEU 537.A N GLY 533.A O no hydrogen 2.579 N/A GLN 538.A N GLN 534.A O no hydrogen 2.795 N/A MET 539.A N LEU 536.A O no hydrogen 3.147 N/A LEU 540.A N LEU 536.A O no hydrogen 2.993 N/A SER 541.A N LEU 537.A O no hydrogen 3.047 N/A SER 541.A OG LEU 537.A O no hydrogen 2.835 N/A LEU 542.A N MET 539.A O no hydrogen 3.300 N/A GLY 543.A N LEU 540.A O no hydrogen 3.361 N/A LYS 544.A N LEU 374.A O no hydrogen 2.877 N/A SER 545.A N LEU 542.A O no hydrogen 3.151 N/A SER 545.A OG LEU 542.A O no hydrogen 2.665 N/A TRP 548.A NE1 TYR 189.A O no hydrogen 2.789 N/A THR 549.A OG1 TYR 197.A O no hydrogen 2.578 N/A ALA 551.A N PRO 547.A O no hydrogen 2.972 N/A LEU 552.A N TRP 548.A O no hydrogen 2.789 N/A GLU 553.A N THR 549.A O no hydrogen 2.937 N/A ARG 554.A N LEU 550.A O no hydrogen 3.054 N/A ILE 555.A N LEU 552.A O no hydrogen 3.314 N/A VAL 556.A N LEU 552.A O no hydrogen 3.031 N/A GLY 557.A N GLU 553.A O no hydrogen 2.911 N/A ASN 560.A ND2 ASP 207.A OD1 no hydrogen 3.490 N/A ASN 560.A ND2 ASP 207.A OD2 no hydrogen 2.973 N/A MET 561.A N ASN 560.A OD1 no hydrogen 2.524 N/A ASP 562.A N GLN 506.A OE1 no hydrogen 3.000 N/A ARG 564.A N ASP 562.A OD1 no hydrogen 3.159 N/A LEU 567.A N VAL 563.A O no hydrogen 2.823 N/A ASN 568.A N ARG 564.A O no hydrogen 2.666 N/A ASN 568.A ND2 GLU 509.A OE2 no hydrogen 2.842 N/A TYR 569.A N PRO 565.A O no hydrogen 2.945 N/A PHE 570.A N LEU 566.A O no hydrogen 3.205 N/A GLU 571.A N ASN 568.A O no hydrogen 3.350 N/A PHE 574.A N PHE 570.A O no hydrogen 2.833 N/A THR 575.A N GLU 571.A O no hydrogen 3.171 N/A THR 575.A OG1 PRO 572.A O no hydrogen 3.099 N/A TRP 576.A N PRO 572.A O no hydrogen 3.254 N/A LEU 577.A N LEU 573.A O no hydrogen 2.776 N/A LYS 578.A N PHE 574.A O no hydrogen 3.007 N/A ASP 579.A N THR 575.A O no hydrogen 3.122 N/A GLN 580.A N TRP 576.A O no hydrogen 2.999 N/A ASN 581.A N LEU 577.A O no hydrogen 2.901 N/A ASN 581.A ND2 HIS 221.A ND1 no hydrogen 3.285 N/A ASN 581.A ND2 HIS 221.A O no hydrogen 2.983 N/A LYS 582.A N ASP 579.A O no hydrogen 3.489 N/A LYS 582.A NZ ASP 579.A OD2 no hydrogen 3.523 N/A SER 584.A N ASN 581.A O no hydrogen 3.031 N/A TRP 588.A NE1 GLU 465.A O no hydrogen 3.030 N/A SER 589.A N THR 241.A O no hydrogen 2.907 N/A THR 590.A OG1 ASN 591.A OD1 no hydrogen 3.483 N/A TYR 595.A OH GLU 471.A OE2 no hydrogen 3.081 N/A ALA 596.A N SER 593.A O no hydrogen 3.085 N/A