Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1uh3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 8.A OE1 no hydrogen 3.445 N/A ALA 1.A N ASP 42.A OD1 no hydrogen 3.567 N/A ASP 4.A N ASP 96.A OD2 no hydrogen 3.205 N/A ASN 6.A N ASP 96.A OD2 no hydrogen 2.672 N/A VAL 7.A N SER 99.A OG no hydrogen 3.425 N/A GLU 8.A N ASP 42.A OD2 no hydrogen 2.925 N/A GLY 11.A N GLU 8.A O no hydrogen 3.123 N/A LEU 12.A N TRP 9.A O no hydrogen 3.059 N/A PHE 13.A N ARG 37.A O no hydrogen 3.120 N/A GLN 16.A NE2 TYR 90.A OH no hydrogen 2.958 N/A GLN 16.A NE2 TYR 119.A O no hydrogen 2.897 N/A GLY 17.A N ASP 15.A OD1 no hydrogen 2.636 N/A PHE 20.A N GLY 17.A O no hydrogen 3.016 N/A ASP 21.A N GLY 17.A O no hydrogen 3.021 N/A ASN 22.A N THR 33.A O no hydrogen 3.275 N/A ALA 23.A N ASP 21.A OD2 no hydrogen 2.894 N/A THR 27.A OG1 THR 29.A OG1 no hydrogen 3.350 N/A SER 28.A OG ASN 123.A OD1 no hydrogen 3.043 N/A THR 29.A N THR 27.A OG1 no hydrogen 3.293 N/A THR 29.A OG1 THR 27.A OG1 no hydrogen 3.350 N/A GLN 30.A N THR 27.A O no hydrogen 3.263 N/A VAL 32.A N ILE 81.A O no hydrogen 3.171 N/A THR 33.A N ASN 22.A OD1 no hydrogen 2.702 N/A THR 33.A OG1 THR 80.A OG1 no hydrogen 3.067 N/A LEU 34.A N GLY 79.A O no hydrogen 2.767 N/A LYS 35.A N PHE 20.A O no hydrogen 2.838 N/A LEU 36.A N TRP 77.A O no hydrogen 2.560 N/A ARG 37.A N PHE 13.A O no hydrogen 3.096 N/A ARG 37.A NH1 GLY 11.A O no hydrogen 2.840 N/A THR 38.A N ASP 75.A O no hydrogen 2.918 N/A THR 38.A OG1 PHE 39.A O no hydrogen 2.948 N/A LYS 40.A N THR 73.A O no hydrogen 2.856 N/A GLY 41.A N ASP 75.A OD2 no hydrogen 2.813 N/A ASP 42.A N PHE 39.A O no hydrogen 3.354 N/A THR 44.A N ASN 95.A O no hydrogen 2.746 N/A THR 44.A OG1 ASN 95.A O no hydrogen 3.178 N/A SER 45.A N ASN 95.A O no hydrogen 3.158 N/A ASN 47.A N GLN 93.A O no hydrogen 2.998 N/A ASN 47.A ND2 GLN 93.A OE1 no hydrogen 2.926 N/A ILE 48.A N VAL 61.A O no hydrogen 2.980 N/A LYS 49.A N ARG 91.A O no hydrogen 2.910 N/A LYS 49.A NZ GLU 112.A OE1 no hydrogen 3.445 N/A LYS 49.A NZ GLU 112.A OE2 no hydrogen 2.723 N/A TYR 50.A N HIS 59.A O no hydrogen 3.095 N/A TRP 51.A N TYR 89.A O no hydrogen 2.565 N/A ASP 52.A N ALA 57.A O no hydrogen 3.128 N/A THR 53.A N ILE 87.A O no hydrogen 3.180 N/A THR 53.A OG1 ILE 87.A O no hydrogen 2.749 N/A ALA 54.A N ASP 52.A OD2 no hydrogen 2.999 N/A ASP 55.A N ASP 52.A O no hydrogen 3.439 N/A HIS 59.A N TYR 50.A O no hydrogen 2.759 N/A HIS 59.A NE2 ASP 55.A OD1 no hydrogen 3.102 N/A VAL 61.A N ILE 48.A O no hydrogen 2.978 N/A MET 63.A N ALA 46.A O no hydrogen 2.906 N/A VAL 64.A N LYS 78.A O no hydrogen 2.784 N/A TRP 65.A NE1 ASP 75.A OD1 no hydrogen 2.708 N/A ASP 66.A N TYR 76.A O no hydrogen 2.594 N/A SER 67.A N TYR 76.A O no hydrogen 3.327 N/A SER 67.A OG ASP 66.A OD1 no hydrogen 3.357 N/A ASN 68.A ND2 PHE 74.A O no hydrogen 3.415 N/A ASP 69.A N PHE 74.A O no hydrogen 3.271 N/A THR 71.A N ASP 69.A OD2 no hydrogen 3.154 N/A THR 71.A OG1 ASP 69.A OD2 no hydrogen 2.928 N/A THR 71.A OG1 THR 73.A OG1 no hydrogen 2.798 N/A GLY 72.A N ASP 69.A O no hydrogen 2.719 N/A THR 73.A N ASP 69.A OD1 no hydrogen 2.831 N/A THR 73.A OG1 THR 71.A O no hydrogen 3.304 N/A THR 73.A OG1 THR 71.A OG1 no hydrogen 2.798 N/A PHE 74.A N ASP 69.A OD1 no hydrogen 2.683 N/A ASP 75.A N THR 38.A O no hydrogen 2.601 N/A TYR 76.A N SER 67.A O no hydrogen 2.736 N/A TRP 77.A N LEU 36.A O no hydrogen 2.608 N/A LYS 78.A N VAL 64.A O no hydrogen 2.764 N/A GLY 79.A N LEU 34.A O no hydrogen 3.079 N/A THR 80.A OG1 THR 33.A OG1 no hydrogen 3.067 N/A ILE 81.A N VAL 32.A O no hydrogen 2.806 N/A SER 84.A OG SER 86.A OG no hydrogen 2.820 N/A SER 86.A N SER 84.A OG no hydrogen 3.299 N/A SER 86.A OG ASP 52.A OD1 no hydrogen 3.436 N/A SER 86.A OG ASP 52.A OD2 no hydrogen 2.605 N/A SER 86.A OG SER 84.A OG no hydrogen 2.820 N/A LYS 88.A N ILE 120.A O no hydrogen 3.015 N/A LYS 88.A NZ SER 84.A OG no hydrogen 2.656 N/A LYS 88.A NZ SER 86.A O no hydrogen 3.163 N/A TYR 89.A N TRP 51.A O no hydrogen 2.949 N/A TYR 90.A N PHE 118.A O no hydrogen 3.113 N/A ARG 91.A N LYS 49.A O no hydrogen 2.921 N/A ARG 91.A NE ASP 117.A OD2 no hydrogen 3.098 N/A ARG 91.A NH1 GLU 112.A OE2 no hydrogen 3.001 N/A ARG 91.A NH2 ASP 117.A OD1 no hydrogen 2.913 N/A PHE 92.A N TYR 103.A O no hydrogen 2.819 N/A GLN 93.A N ASN 47.A O no hydrogen 2.989 N/A ILE 94.A N ALA 101.A O no hydrogen 2.634 N/A ASN 95.A N SER 45.A O no hydrogen 2.833 N/A ASN 95.A ND2 GLN 93.A OE1 no hydrogen 2.895 N/A ASP 96.A N SER 99.A O no hydrogen 2.887 N/A GLY 97.A N THR 44.A OG1 no hydrogen 3.152 N/A THR 98.A N ASN 5.A OD1 no hydrogen 2.671 N/A SER 99.A N ASP 96.A O no hydrogen 3.041 N/A THR 100.A OG1 ASN 95.A OD1 no hydrogen 2.367 N/A ALA 101.A N ILE 94.A O no hydrogen 2.745 N/A TRP 102.A N SER 109.A O no hydrogen 2.899 N/A TYR 103.A N PHE 92.A O no hydrogen 3.002 N/A ASN 104.A N GLY 107.A O no hydrogen 3.419 N/A ASN 104.A ND2 ALA 115.A O no hydrogen 2.603 N/A ASN 104.A ND2 ASP 117.A OD2 no hydrogen 3.249 N/A ASN 106.A N ASN 104.A OD1 no hydrogen 2.977 N/A GLY 107.A N ASN 104.A O no hydrogen 2.809 N/A SER 109.A OG THR 111.A O no hydrogen 2.727 N/A PHE 118.A N TYR 90.A O no hydrogen 2.980 N/A ILE 120.A N LYS 88.A O no hydrogen 3.004 N/A ASN 123.A N PRO 26.A O no hydrogen 2.528 N/A PHE 124.A N ILE 121.A O no hydrogen 3.164 N/A LYS 125.A NZ GLU 25.A OE1 no hydrogen 2.803 N/A LYS 125.A NZ ASP 128.A OD1 no hydrogen 3.156 N/A LYS 125.A NZ ASP 128.A OD2 no hydrogen 2.715 N/A THR 126.A N GLU 25.A OE2 no hydrogen 3.113 N/A THR 126.A OG1 ASN 459.A O no hydrogen 3.353 N/A THR 126.A OG1 SER 463.A OG no hydrogen 3.218 N/A TRP 129.A NE1 ASN 390.A O no hydrogen 2.736 N/A LYS 131.A N PRO 127.A O no hydrogen 3.411 N/A LYS 131.A NZ GLU 25.A OE2 no hydrogen 3.150 N/A LYS 131.A NZ THR 126.A OG1 no hydrogen 3.049 N/A LYS 131.A NZ ASP 128.A OD1 no hydrogen 3.227 N/A ASN 132.A N ASP 128.A O no hydrogen 2.885 N/A ASN 132.A ND2 ASP 128.A O no hydrogen 3.344 N/A MET 135.A N PRO 501.A O no hydrogen 2.794 N/A TYR 136.A N ILE 208.A O no hydrogen 2.698 N/A TYR 136.A OH GLU 508.A OE2 no hydrogen 2.622 N/A GLN 137.A N ILE 503.A O no hydrogen 2.823 N/A ILE 138.A N TYR 210.A O no hydrogen 2.858 N/A ARG 142.A N PHE 139.A O no hydrogen 2.778 N/A ARG 142.A NE ASP 141.A OD1 no hydrogen 2.853 N/A ARG 142.A NH1 VAL 184.A O no hydrogen 3.050 N/A ARG 142.A NH2 ARG 520.A O no hydrogen 2.764 N/A PHE 143.A N PRO 140.A O no hydrogen 3.201 N/A ASN 145.A ND2 ASP 151.A OD1 no hydrogen 2.611 N/A ASN 145.A ND2 ASP 151.A OD2 no hydrogen 3.009 N/A GLY 146.A N ASP 189.A OD1 no hydrogen 3.012 N/A ASP 147.A N ASN 145.A OD1 no hydrogen 3.235 N/A ASP 147.A N ASP 189.A OD2 no hydrogen 3.149 N/A SER 149.A N ASP 147.A OD1 no hydrogen 2.870 N/A SER 149.A OG ASP 147.A OD1 no hydrogen 2.324 N/A GLN 153.A N SER 156.A OG no hydrogen 2.623 N/A GLY 155.A N THR 164.A O no hydrogen 2.599 N/A SER 156.A N GLN 153.A O no hydrogen 2.945 N/A SER 156.A OG GLN 153.A O no hydrogen 3.009 N/A TYR 157.A OH PRO 218.A O no hydrogen 3.022 N/A TYR 159.A N THR 162.A O no hydrogen 2.726 N/A TYR 159.A OH ASP 270.A OD1 no hydrogen 2.619 N/A TYR 159.A OH ASP 270.A OD2 no hydrogen 3.401 N/A THR 162.A N TYR 159.A O no hydrogen 3.078 N/A THR 164.A N TYR 157.A O no hydrogen 2.985 N/A THR 164.A OG1 GLN 153.A O no hydrogen 2.583 N/A GLU 165.A N LEU 183.A O no hydrogen 2.997 N/A LYS 166.A N THR 154.A OG1 no hydrogen 2.842 N/A LYS 167.A N PHE 185.A O no hydrogen 2.903 N/A LYS 167.A NZ TYR 174.A O no hydrogen 2.815 N/A LYS 167.A NZ ASP 176.A OD2 no hydrogen 3.147 N/A TRP 169.A NE1 PHE 523.A O no hydrogen 2.834 N/A SER 171.A N ALA 168.A O no hydrogen 3.011 N/A SER 171.A OG ALA 168.A O no hydrogen 2.508 N/A ALA 175.A N ASN 181.A OD1 no hydrogen 2.744 N/A ASP 176.A N GLU 165.A OE1 no hydrogen 2.932 N/A TYR 179.A N ASP 176.A O no hydrogen 3.034 N/A SER 182.A N ASP 180.A OD2 no hydrogen 2.956 N/A LEU 183.A N ASP 180.A O no hydrogen 3.029 N/A PHE 185.A N GLU 165.A O no hydrogen 2.904 N/A PHE 186.A N ASP 141.A OD1 no hydrogen 2.720 N/A PHE 186.A N ASP 141.A OD2 no hydrogen 3.228 N/A GLY 187.A N ASP 141.A OD2 no hydrogen 2.878 N/A GLY 188.A N ASP 141.A O no hydrogen 2.717 N/A ASP 189.A N TYR 144.A O no hydrogen 3.267 N/A LEU 190.A N PHE 235.A O no hydrogen 3.145 N/A GLY 192.A N ASP 189.A OD1 no hydrogen 2.697 N/A ILE 193.A N ASP 189.A O no hydrogen 3.219 N/A ASP 194.A N LEU 190.A O no hydrogen 2.910 N/A GLN 195.A N ALA 191.A O no hydrogen 2.873 N/A LYS 196.A N GLY 192.A O no hydrogen 3.035 N/A LYS 196.A N ILE 193.A O no hydrogen 3.284 N/A LEU 197.A N ASP 194.A O no hydrogen 3.188 N/A TYR 199.A OH GLU 508.A OE2 no hydrogen 3.021 N/A ILE 200.A N LYS 196.A O no hydrogen 3.245 N/A LYS 201.A N LEU 197.A O no hydrogen 3.021 N/A LYS 201.A NZ ILE 248.A O no hydrogen 3.113 N/A LYS 201.A NZ SER 250.A O no hydrogen 2.679 N/A LYS 202.A N GLY 198.A O no hydrogen 2.982 N/A THR 203.A N GLY 198.A O no hydrogen 3.275 N/A LEU 204.A N TYR 199.A O no hydrogen 3.077 N/A GLY 205.A N ILE 200.A O no hydrogen 2.864 N/A ASN 207.A N VAL 134.A O no hydrogen 3.251 N/A ASN 207.A ND2 VAL 134.A O no hydrogen 2.891 N/A ILE 208.A N VAL 134.A O no hydrogen 3.068 N/A LEU 209.A N TYR 258.A O no hydrogen 3.004 N/A TYR 210.A N TYR 136.A O no hydrogen 2.972 N/A TYR 210.A OH ASP 262.A OD1 no hydrogen 3.052 N/A LEU 211.A N ILE 260.A O no hydrogen 3.044 N/A ASN 212.A N ILE 138.A O no hydrogen 3.091 N/A ASN 212.A ND2 TYR 223.A OH no hydrogen 2.958 N/A LYS 216.A N ALA 230.A O no hydrogen 2.883 N/A ALA 217.A N ASP 232.A OD2 no hydrogen 3.040 N/A THR 219.A OG1 ASP 224.A OD1 no hydrogen 2.531 N/A ASN 220.A N SER 182.A O no hydrogen 2.839 N/A LYS 222.A N THR 219.A OG1 no hydrogen 2.904 N/A LYS 222.A NZ ALA 217.A O no hydrogen 2.872 N/A LYS 222.A NZ THR 219.A O no hydrogen 2.904 N/A LYS 222.A NZ ASP 232.A OD2 no hydrogen 3.036 N/A TYR 223.A OH ASP 262.A OD1 no hydrogen 2.799 N/A GLN 226.A N LYS 216.A O no hydrogen 2.636 N/A GLN 226.A NE2 SER 271.A O no hydrogen 3.045 N/A ASP 227.A N LYS 216.A O no hydrogen 3.108 N/A TYR 228.A OH VAL 264.A O no hydrogen 2.904 N/A MET 229.A N ASP 227.A OD2 no hydrogen 2.914 N/A ALA 230.A N ASP 227.A O no hydrogen 3.415 N/A VAL 231.A N ASN 238.A OD1 no hydrogen 3.035 N/A ASP 232.A N ILE 214.A O no hydrogen 3.016 N/A ALA 234.A N ASP 232.A OD1 no hydrogen 2.925 N/A PHE 235.A N ASP 232.A O no hydrogen 2.713 N/A GLY 236.A N ASP 232.A O no hydrogen 3.108 N/A GLY 236.A N PRO 233.A O no hydrogen 3.271 N/A ASP 237.A N THR 240.A OG1 no hydrogen 3.211 N/A ASN 238.A ND2 MET 229.A O no hydrogen 3.094 N/A ASN 238.A ND2 TYR 348.A OH no hydrogen 2.749 N/A THR 240.A N ASP 237.A OD2 no hydrogen 2.707 N/A THR 240.A OG1 ASP 237.A OD2 no hydrogen 2.993 N/A LEU 241.A N ASP 237.A O no hydrogen 3.260 N/A GLN 242.A N ASN 238.A O no hydrogen 3.072 N/A THR 243.A N SER 239.A O no hydrogen 3.111 N/A THR 243.A OG1 SER 239.A O no hydrogen 3.427 N/A LEU 244.A N THR 240.A O no hydrogen 2.977 N/A ILE 245.A N LEU 241.A O no hydrogen 2.739 N/A ASN 246.A N GLN 242.A O no hydrogen 2.802 N/A ASP 247.A N THR 243.A O no hydrogen 2.840 N/A ILE 248.A N LEU 244.A O no hydrogen 2.789 N/A ILE 248.A N ILE 245.A O no hydrogen 3.034 N/A HIS 249.A N ILE 245.A O no hydrogen 2.802 N/A HIS 249.A NE2 ASP 351.A OD1 no hydrogen 2.637 N/A SER 250.A N ASN 246.A O no hydrogen 2.891 N/A ALA 252.A N SER 250.A OG no hydrogen 3.102 N/A ASN 253.A ND2 SER 250.A O no hydrogen 2.796 N/A LYS 256.A NZ TYR 258.A OH no hydrogen 3.539 N/A TYR 258.A N ASN 207.A O no hydrogen 2.910 N/A LEU 259.A N ASP 351.A OD1 no hydrogen 2.871 N/A ILE 260.A N LEU 209.A O no hydrogen 2.812 N/A LEU 261.A N GLY 352.A O no hydrogen 2.932 N/A GLY 263.A N ARG 354.A O no hydrogen 2.794 N/A HIS 267.A ND1 ASN 266.A OD1 no hydrogen 3.036 N/A THR 268.A N PRO 317.A O no hydrogen 3.144 N/A THR 268.A OG1 THR 225.A O no hydrogen 3.169 N/A THR 268.A OG1 GLY 269.A O no hydrogen 3.559 N/A GLY 269.A N THR 225.A O no hydrogen 2.791 N/A HIS 272.A N GLY 269.A O no hydrogen 3.331 N/A PHE 275.A N HIS 272.A O no hydrogen 2.734 N/A ASP 276.A N HIS 272.A O no hydrogen 2.539 N/A LYS 277.A N ASP 270.A O no hydrogen 3.040 N/A LYS 277.A NZ TYR 307.A OH no hydrogen 3.483 N/A TYR 278.A OH ASP 270.A OD2 no hydrogen 2.615 N/A ASN 279.A N ASP 276.A O no hydrogen 3.258 N/A ASN 280.A N ASP 276.A OD1 no hydrogen 2.628 N/A PHE 281.A N ASP 276.A OD2 no hydrogen 3.397 N/A GLY 285.A N GLU 288.A OE2 no hydrogen 3.186 N/A ALA 286.A N TRP 274.A O no hydrogen 2.671 N/A TYR 287.A N PHE 275.A O no hydrogen 3.213 N/A TYR 287.A OH ASP 305.A OD2 no hydrogen 2.776 N/A GLU 288.A N GLY 285.A O no hydrogen 2.980 N/A SER 289.A N GLY 285.A O no hydrogen 3.047 N/A SER 291.A N SER 289.A OG no hydrogen 3.201 N/A SER 292.A N SER 289.A O no hydrogen 2.741 N/A SER 292.A OG GLN 284.A O no hydrogen 2.806 N/A TRP 294.A N SER 292.A OG no hydrogen 3.084 N/A TYR 295.A N SER 292.A O no hydrogen 3.114 N/A TYR 297.A N TRP 294.A O no hydrogen 2.860 N/A TYR 298.A N TYR 295.A O no hydrogen 3.274 N/A TYR 301.A N SER 306.A O no hydrogen 2.844 N/A THR 302.A N SER 306.A O no hydrogen 3.120 N/A TRP 303.A NE1 ALA 286.A O no hydrogen 2.905 N/A SER 306.A N THR 302.A O no hydrogen 2.988 N/A TYR 307.A OH ASN 314.A O no hydrogen 2.438 N/A ALA 308.A N THR 299.A O no hydrogen 2.933 N/A PHE 310.A N LEU 316.A O no hydrogen 3.071 N/A PHE 313.A N PHE 310.A O no hydrogen 3.065 N/A LEU 316.A N PHE 313.A O no hydrogen 3.072 N/A LYS 318.A N ALA 308.A O no hydrogen 2.959 N/A LYS 318.A NZ TYR 360.A O no hydrogen 2.899 N/A LYS 318.A NZ ASN 366.A O no hydrogen 2.846 N/A LEU 319.A N ASN 266.A O no hydrogen 2.971 N/A ASN 320.A N TYR 297.A O no hydrogen 2.747 N/A ASN 320.A ND2 ASN 296.A O no hydrogen 3.021 N/A TYR 321.A N ASP 362.A O no hydrogen 3.182 N/A TYR 321.A OH PHE 265.A O no hydrogen 2.626 N/A GLY 322.A N ASN 320.A OD1 no hydrogen 2.906 N/A SER 324.A OG GLU 379.A OE2 no hydrogen 2.734 N/A SER 326.A N ASN 323.A O no hydrogen 2.955 N/A SER 326.A OG TYR 321.A O no hydrogen 2.849 N/A ARG 329.A N SER 326.A OG no hydrogen 3.149 N/A ARG 329.A NE TYR 321.A O no hydrogen 2.840 N/A ARG 329.A NH1 GLN 375.A OE1 no hydrogen 3.204 N/A ARG 329.A NH1 GLU 379.A OE1 no hydrogen 2.805 N/A ARG 329.A NH2 GLY 322.A O no hydrogen 2.639 N/A ARG 329.A NH2 GLN 375.A OE1 no hydrogen 3.244 N/A GLY 330.A N SER 326.A O no hydrogen 3.186 N/A VAL 331.A N ALA 327.A O no hydrogen 2.869 N/A ILE 332.A N VAL 328.A O no hydrogen 3.070 N/A TYR 333.A N ARG 329.A O no hydrogen 3.119 N/A TYR 333.A OH GLU 379.A OE1 no hydrogen 2.924 N/A ASN 334.A N ARG 329.A O no hydrogen 2.749 N/A ASN 335.A N GLY 330.A O no hydrogen 2.818 N/A SER 338.A N ASN 335.A O no hydrogen 3.004 N/A SER 338.A OG ILE 332.A O no hydrogen 3.550 N/A SER 338.A OG ASN 335.A O no hydrogen 2.757 N/A VAL 339.A N VAL 331.A O no hydrogen 2.981 N/A ALA 340.A N ILE 332.A O no hydrogen 2.896 N/A LYS 341.A N SER 338.A OG no hydrogen 3.145 N/A LYS 341.A NZ ASN 334.A O no hydrogen 2.746 N/A THR 342.A N SER 338.A O no hydrogen 2.812 N/A THR 342.A OG1 SER 338.A O no hydrogen 2.450 N/A TYR 343.A OH TYR 228.A O no hydrogen 2.490 N/A LEU 344.A N LYS 341.A O no hydrogen 3.176 N/A ASN 345.A N LYS 341.A O no hydrogen 2.899 N/A TYR 348.A N ASN 345.A O no hydrogen 3.251 N/A SER 349.A N ASN 345.A O no hydrogen 3.158 N/A VAL 350.A N TYR 343.A O no hydrogen 2.778 N/A ASP 351.A N LEU 259.A O no hydrogen 2.851 N/A TRP 353.A N ALA 392.A O no hydrogen 3.023 N/A TRP 353.A NE1 ALA 340.A O no hydrogen 3.277 N/A ARG 354.A N LEU 261.A O no hydrogen 2.701 N/A ARG 354.A NE ASP 262.A OD2 no hydrogen 3.119 N/A ARG 354.A NH1 ASP 262.A OD2 no hydrogen 2.788 N/A ARG 354.A NH1 ASP 356.A OD2 no hydrogen 2.830 N/A LEU 355.A N ILE 394.A O no hydrogen 2.757 N/A ASP 356.A N GLY 263.A O no hydrogen 3.195 N/A ALA 357.A N GLU 396.A OE1 no hydrogen 2.813 N/A TYR 360.A N ALA 357.A O no hydrogen 3.143 N/A ALA 363.A N ASP 362.A OD1 no hydrogen 2.518 N/A ASN 364.A N ASN 320.A OD1 no hydrogen 2.747 N/A ASN 366.A N ALA 363.A O no hydrogen 3.031 N/A GLY 368.A N ASP 362.A OD2 no hydrogen 2.986 N/A SER 369.A N GLN 359.A O no hydrogen 3.011 N/A ASN 373.A N ASP 370.A OD1 no hydrogen 2.914 N/A ASN 373.A ND2 ALA 358.A O no hydrogen 3.057 N/A ASN 373.A ND2 VAL 361.A O no hydrogen 2.659 N/A HIS 374.A N ASP 370.A O no hydrogen 3.164 N/A HIS 374.A ND1 ASP 370.A O no hydrogen 2.956 N/A GLN 375.A N VAL 371.A O no hydrogen 2.801 N/A ILE 376.A N THR 372.A O no hydrogen 2.896 N/A TRP 377.A N ASN 373.A O no hydrogen 3.175 N/A TRP 377.A NE1 ALA 358.A O no hydrogen 2.852 N/A SER 378.A N HIS 374.A O no hydrogen 3.226 N/A SER 378.A N GLN 375.A O no hydrogen 3.199 N/A SER 378.A OG HIS 374.A O no hydrogen 2.813 N/A SER 378.A OG ASN 409.A OD1 no hydrogen 3.505 N/A GLU 379.A N GLN 375.A O no hydrogen 3.233 N/A PHE 380.A N ILE 376.A O no hydrogen 2.932 N/A ARG 381.A N TRP 377.A O no hydrogen 3.200 N/A ARG 381.A NH1 ASP 412.A OD1 no hydrogen 2.817 N/A ARG 381.A NH2 GLN 410.A O no hydrogen 2.894 N/A ARG 381.A NH2 ASP 412.A OD1 no hydrogen 3.027 N/A ASN 382.A N SER 378.A O no hydrogen 3.241 N/A ALA 383.A N GLU 379.A O no hydrogen 2.948 N/A VAL 384.A N PHE 380.A O no hydrogen 2.892 N/A LYS 385.A N ARG 381.A O no hydrogen 2.907 N/A LYS 385.A NZ SER 389.A O no hydrogen 3.334 N/A LYS 385.A NZ ALA 391.A O no hydrogen 3.176 N/A LYS 385.A NZ ASP 412.A OD1 no hydrogen 3.548 N/A LYS 385.A NZ ASP 412.A OD2 no hydrogen 2.958 N/A VAL 387.A N ALA 383.A O no hydrogen 3.295 N/A VAL 387.A N VAL 384.A O no hydrogen 2.639 N/A ASN 388.A N VAL 384.A O no hydrogen 3.050 N/A ASN 390.A N ASN 388.A OD1 no hydrogen 2.967 N/A ALA 391.A N ASN 388.A O no hydrogen 3.064 N/A ALA 392.A N ASP 351.A O no hydrogen 2.972 N/A ILE 393.A N ASP 412.A OD2 no hydrogen 3.104 N/A ILE 394.A N TRP 353.A O no hydrogen 3.065 N/A GLY 395.A N ALA 413.A O no hydrogen 3.146 N/A GLU 396.A N LEU 355.A O no hydrogen 2.930 N/A TYR 397.A N THR 415.A OG1 no hydrogen 2.772 N/A TRP 398.A NE1 GLU 396.A OE2 no hydrogen 3.258 N/A ALA 401.A N TYR 456.A OH no hydrogen 3.273 N/A ASN 402.A N ASN 400.A OD1 no hydrogen 2.832 N/A ASN 402.A ND2 TYR 119.A OH no hydrogen 2.910 N/A ASN 402.A ND2 ASN 455.A O no hydrogen 2.661 N/A TRP 404.A N ALA 401.A O no hydrogen 3.334 N/A TRP 404.A NE1 ASN 373.A OD1 no hydrogen 2.833 N/A THR 405.A N ASN 402.A O no hydrogen 3.120 N/A THR 405.A OG1 ALA 401.A O no hydrogen 2.822 N/A ALA 406.A N ASN 402.A O no hydrogen 2.903 N/A GLY 408.A N THR 405.A O no hydrogen 3.160 N/A GLN 410.A NE2 PRO 403.A O no hydrogen 3.486 N/A TRP 411.A N TRP 404.A O no hydrogen 3.041 N/A ASP 412.A N ILE 393.A O no hydrogen 2.778 N/A ALA 413.A N ILE 393.A O no hydrogen 3.263 N/A THR 415.A N GLY 395.A O no hydrogen 2.970 N/A THR 415.A OG1 TYR 397.A O no hydrogen 2.841 N/A ASN 416.A N MET 465.A O no hydrogen 3.092 N/A ASN 416.A ND2 ASN 466.A OD1 no hydrogen 3.240 N/A PHE 417.A N THR 415.A O no hydrogen 2.835 N/A PHE 420.A N ASN 416.A O no hydrogen 2.981 N/A THR 421.A N ASN 416.A O no hydrogen 3.262 N/A THR 421.A OG1 PHE 467.A O no hydrogen 2.690 N/A GLN 422.A N PHE 417.A O no hydrogen 2.830 N/A VAL 424.A N PHE 420.A O no hydrogen 3.039 N/A SER 425.A N THR 421.A O no hydrogen 3.095 N/A SER 425.A OG LYS 431.A O no hydrogen 2.578 N/A GLU 426.A N GLN 422.A O no hydrogen 3.035 N/A TRP 427.A N PRO 423.A O no hydrogen 3.088 N/A ILE 428.A N VAL 424.A O no hydrogen 2.968 N/A THR 429.A N SER 425.A O no hydrogen 2.935 N/A THR 429.A OG1 SER 425.A O no hydrogen 2.676 N/A LYS 431.A N THR 429.A OG1 no hydrogen 3.168 N/A ASP 432.A N ASN 436.A O no hydrogen 2.869 N/A TYR 433.A N GLN 422.A OE1 no hydrogen 2.810 N/A GLN 434.A N ASP 432.A OD2 no hydrogen 3.044 N/A ASN 435.A N ASP 432.A O no hydrogen 3.013 N/A ASN 436.A N ASP 432.A OD2 no hydrogen 2.657 N/A ALA 438.A N GLY 430.A O no hydrogen 2.997 N/A SER 441.A OG THR 443.A OG1 no hydrogen 2.931 N/A SER 441.A OG ASP 563.A OD2 no hydrogen 3.273 N/A THR 443.A N ASP 563.A OD1 no hydrogen 2.963 N/A THR 443.A OG1 SER 441.A OG no hydrogen 2.931 N/A THR 443.A OG1 ASP 563.A OD1 no hydrogen 3.422 N/A THR 443.A OG1 ASP 563.A OD2 no hydrogen 2.700 N/A GLN 444.A N SER 441.A OG no hydrogen 3.395 N/A PHE 445.A N SER 441.A O no hydrogen 2.840 N/A ASP 446.A N THR 442.A O no hydrogen 2.890 N/A SER 447.A N THR 443.A O no hydrogen 3.113 N/A TRP 448.A N GLN 444.A O no hydrogen 2.903 N/A TRP 448.A NE1 ASP 418.A O no hydrogen 2.860 N/A LEU 449.A N PHE 445.A O no hydrogen 3.038 N/A ARG 450.A N ASP 446.A O no hydrogen 3.144 N/A ARG 450.A NE ASN 106.A O no hydrogen 3.019 N/A ARG 450.A NE ASN 106.A OD1 no hydrogen 3.450 N/A GLY 451.A N SER 447.A O no hydrogen 2.921 N/A THR 452.A N TRP 448.A O no hydrogen 3.163 N/A THR 452.A OG1 TRP 448.A O no hydrogen 2.991 N/A THR 452.A OG1 LEU 449.A O no hydrogen 3.108 N/A ARG 453.A N LEU 449.A O no hydrogen 2.896 N/A ARG 453.A NH2 TYR 497.A OH no hydrogen 2.903 N/A ALA 454.A N ARG 450.A O no hydrogen 2.991 N/A ASN 455.A N THR 452.A O no hydrogen 3.250 N/A ASN 455.A ND2 THR 452.A O no hydrogen 3.691 N/A TYR 456.A N ARG 453.A O no hydrogen 3.311 N/A THR 458.A OG1 GLN 16.A OE1 no hydrogen 2.746 N/A VAL 460.A N PRO 457.A O no hydrogen 3.047 N/A GLN 461.A N PRO 457.A O no hydrogen 3.048 N/A GLN 461.A NE2 TYR 456.A O no hydrogen 2.896 N/A GLN 462.A N THR 458.A O no hydrogen 3.084 N/A SER 463.A N VAL 460.A O no hydrogen 3.031 N/A SER 463.A OG THR 126.A OG1 no hydrogen 3.218 N/A SER 463.A OG ASN 459.A O no hydrogen 2.627 N/A MET 464.A N GLN 461.A O no hydrogen 3.290 N/A MET 465.A N ALA 414.A O no hydrogen 3.107 N/A ASN 466.A N THR 500.A O no hydrogen 3.050 N/A ASN 466.A ND2 VAL 498.A O no hydrogen 2.977 N/A SER 469.A OG ASP 507.A OD2 no hydrogen 3.025 N/A ASP 472.A N ASN 470.A OD1 no hydrogen 2.816 N/A ILE 473.A N ASN 470.A O no hydrogen 3.214 N/A THR 474.A N TYR 433.A O no hydrogen 3.136 N/A THR 474.A OG1 TYR 433.A O no hydrogen 2.618 N/A ARG 475.A N GLY 513.A O no hydrogen 2.954 N/A ARG 475.A NE ASN 519.A O no hydrogen 3.432 N/A ARG 475.A NH1 TYR 505.A O no hydrogen 2.924 N/A ARG 475.A NH1 ASN 519.A O no hydrogen 3.421 N/A ARG 475.A NH2 TYR 504.A O no hydrogen 3.267 N/A ARG 475.A NH2 TYR 505.A O no hydrogen 2.798 N/A ARG 475.A NH2 ASP 507.A OD1 no hydrogen 2.721 N/A PHE 476.A N SER 469.A OG no hydrogen 2.860 N/A THR 478.A N ARG 475.A O no hydrogen 3.220 N/A THR 478.A OG1 GLY 513.A O no hydrogen 3.303 N/A ARG 479.A N ARG 475.A O no hydrogen 3.064 N/A ARG 479.A NE SER 425.A OG no hydrogen 3.235 N/A ARG 479.A NH1 LEU 468.A O no hydrogen 3.330 N/A ARG 479.A NH2 LEU 468.A O no hydrogen 3.271 N/A ARG 479.A NH2 THR 474.A O no hydrogen 2.640 N/A SER 480.A N PHE 476.A O no hydrogen 2.752 N/A SER 480.A OG PHE 476.A O no hydrogen 2.696 N/A GLY 481.A N THR 478.A O no hydrogen 2.993 N/A GLY 482.A N ALA 477.A O no hydrogen 2.962 N/A ASP 483.A N SER 480.A O no hydrogen 3.367 N/A TRP 485.A N ASP 483.A OD2 no hydrogen 2.927 N/A LYS 486.A N ASP 483.A O no hydrogen 3.066 N/A LYS 486.A NZ ASP 483.A OD1 no hydrogen 2.860 N/A THR 487.A N LEU 484.A O no hydrogen 3.041 N/A TYR 488.A N LEU 484.A O no hydrogen 3.168 N/A LEU 489.A N TRP 485.A O no hydrogen 3.149 N/A ALA 490.A N LYS 486.A O no hydrogen 3.069 N/A LEU 491.A N THR 487.A O no hydrogen 2.889 N/A ILE 492.A N TYR 488.A O no hydrogen 2.965 N/A PHE 493.A N LEU 489.A O no hydrogen 2.946 N/A GLN 494.A N ALA 490.A O no hydrogen 2.893 N/A MET 495.A N LEU 491.A O no hydrogen 2.922 N/A THR 496.A N PHE 493.A O no hydrogen 2.772 N/A THR 496.A OG1 ILE 492.A O no hydrogen 2.913 N/A THR 496.A OG1 PHE 493.A O no hydrogen 3.048 N/A THR 496.A OG1 TYR 570.A OH no hydrogen 2.594 N/A THR 500.A N MET 464.A O no hydrogen 2.857 N/A THR 500.A OG1 LEU 130.A O no hydrogen 2.605 N/A THR 502.A N ASN 466.A O no hydrogen 2.664 N/A THR 502.A OG1 THR 500.A O no hydrogen 3.158 N/A ILE 503.A N MET 135.A O no hydrogen 2.808 N/A TYR 504.A OH ASN 519.A O no hydrogen 2.782 N/A TYR 505.A N GLN 137.A O no hydrogen 3.136 N/A TYR 505.A OH ARG 521.A O no hydrogen 2.724 N/A GLY 506.A N GLU 508.A OE1 no hydrogen 2.701 N/A ASP 507.A N TYR 504.A O no hydrogen 2.913 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.673 N/A TYR 509.A N GLY 506.A O no hydrogen 3.378 N/A GLY 510.A N ASP 507.A O no hydrogen 3.213 N/A MET 511.A N GLY 506.A O no hydrogen 2.880 N/A GLY 513.A N THR 478.A OG1 no hydrogen 2.709 N/A GLY 514.A N ASP 518.A OD2 no hydrogen 2.738 N/A ASP 518.A N ALA 515.A O no hydrogen 2.898 N/A ARG 520.A N PRO 517.A O no hydrogen 2.931 N/A ARG 520.A NH1 HIS 471.A O no hydrogen 2.497 N/A ARG 521.A NE ASP 518.A O no hydrogen 3.377 N/A ARG 521.A NE ASP 518.A OD1 no hydrogen 2.899 N/A ARG 521.A NH2 ASP 518.A OD1 no hydrogen 3.290 N/A ARG 521.A NH2 ASP 518.A OD2 no hydrogen 2.843 N/A PHE 523.A N ARG 142.A O no hydrogen 2.937 N/A ASP 524.A N TYR 509.A OH no hydrogen 3.307 N/A TRP 525.A NE1 PHE 143.A O no hydrogen 2.869 N/A SER 526.A N ASP 524.A OD1 no hydrogen 2.948 N/A SER 526.A OG ASP 524.A OD1 no hydrogen 2.444 N/A GLN 527.A N ASP 524.A O no hydrogen 3.134 N/A SER 531.A N THR 529.A OG1 no hydrogen 3.120 N/A ASN 532.A N THR 529.A O no hydrogen 2.915 N/A ASN 532.A ND2 TYR 509.A O no hydrogen 3.256 N/A VAL 535.A N ASN 532.A OD1 no hydrogen 2.965 N/A ALA 536.A N ASN 532.A O no hydrogen 3.041 N/A LEU 537.A N SER 533.A O no hydrogen 3.215 N/A THR 538.A N ALA 534.A O no hydrogen 3.019 N/A THR 538.A OG1 GLU 508.A O no hydrogen 3.552 N/A THR 538.A OG1 ALA 534.A O no hydrogen 2.840 N/A GLN 539.A N VAL 535.A O no hydrogen 3.182 N/A LYS 540.A N ALA 536.A O no hydrogen 2.889 N/A LEU 541.A N LEU 537.A O no hydrogen 2.550 N/A ILE 542.A N THR 538.A O no hydrogen 2.764 N/A THR 543.A N GLN 539.A O no hydrogen 3.000 N/A THR 543.A OG1 GLN 539.A O no hydrogen 2.780 N/A ILE 544.A N LYS 540.A O no hydrogen 3.086 N/A ARG 545.A N LEU 541.A O no hydrogen 2.900 N/A ARG 545.A NH1 MET 495.A O no hydrogen 2.742 N/A ARG 545.A NH1 TYR 497.A O no hydrogen 3.022 N/A ARG 545.A NH2 TYR 497.A O no hydrogen 2.982 N/A ASN 546.A N ILE 542.A O no hydrogen 3.003 N/A GLN 547.A N ILE 544.A O no hydrogen 3.088 N/A TYR 548.A N ILE 544.A O no hydrogen 3.323 N/A TYR 548.A N ARG 545.A O no hydrogen 3.194 N/A LEU 551.A N TYR 548.A O no hydrogen 3.057 N/A ARG 552.A N PRO 549.A O no hydrogen 2.796 N/A ARG 552.A NE ASN 132.A OD1 no hydrogen 2.667 N/A ARG 552.A NH1 ASN 132.A OD1 no hydrogen 3.235 N/A ARG 552.A NH2 ARG 545.A O no hydrogen 2.805 N/A THR 553.A N PRO 549.A O no hydrogen 2.816 N/A THR 553.A OG1 PRO 549.A O no hydrogen 3.349 N/A SER 555.A N PHE 573.A O no hydrogen 2.793 N/A SER 555.A OG ASP 15.A OD1 no hydrogen 2.668 N/A PHE 556.A N ASP 15.A OD2 no hydrogen 3.177 N/A MET 557.A N GLY 571.A O no hydrogen 3.077 N/A THR 558.A OG1 ASP 446.A OD1 no hydrogen 3.502 N/A THR 558.A OG1 ASP 446.A OD2 no hydrogen 2.455 N/A LEU 559.A N SER 569.A O no hydrogen 2.673 N/A ILE 560.A N SER 569.A O no hydrogen 2.751 N/A ASP 562.A N ILE 567.A O no hydrogen 3.030 N/A THR 564.A N ASP 562.A OD2 no hydrogen 2.655 N/A ASN 565.A N ASP 562.A OD2 no hydrogen 3.098 N/A ASN 565.A ND2 ASP 562.A OD1 no hydrogen 2.724 N/A LYS 566.A NZ ASP 586.A OD2 no hydrogen 3.444 N/A ILE 567.A N ASP 562.A O no hydrogen 3.088 N/A TYR 568.A N LEU 583.A O no hydrogen 2.904 N/A TYR 568.A OH ASP 446.A OD2 no hydrogen 2.769 N/A SER 569.A N ILE 560.A O no hydrogen 3.037 N/A SER 569.A OG VAL 581.A O no hydrogen 2.795 N/A TYR 570.A N VAL 581.A O no hydrogen 2.939 N/A TYR 570.A OH THR 496.A OG1 no hydrogen 2.594 N/A GLY 571.A N MET 557.A O no hydrogen 2.841 N/A ARG 572.A N ILE 579.A O no hydrogen 2.881 N/A ARG 572.A NE SER 555.A O no hydrogen 2.964 N/A ARG 572.A NH1 THR 496.A O no hydrogen 2.800 N/A ARG 572.A NH1 LEU 551.A O no hydrogen 2.857 N/A ARG 572.A NH2 GLY 554.A O no hydrogen 3.343 N/A PHE 573.A N SER 555.A O no hydrogen 3.366 N/A ASP 574.A N ASN 577.A O no hydrogen 3.111 N/A VAL 576.A N ASP 574.A OD1 no hydrogen 2.809 N/A ASN 577.A N ASP 574.A OD1 no hydrogen 2.901 N/A ASN 577.A ND2 GLN 637.A O no hydrogen 2.701 N/A ARG 578.A N GLN 637.A O no hydrogen 3.404 N/A ILE 579.A N ARG 572.A O no hydrogen 2.798 N/A ALA 580.A N LEU 635.A O no hydrogen 2.765 N/A VAL 581.A N TYR 570.A O no hydrogen 2.731 N/A VAL 582.A N ALA 633.A O no hydrogen 3.061 N/A LEU 583.A N TYR 568.A O no hydrogen 2.729 N/A ASN 584.A N TYR 631.A O no hydrogen 2.797 N/A ASN 584.A ND2 VAL 588.A O no hydrogen 3.161 N/A ASN 584.A ND2 HIS 590.A ND1 no hydrogen 3.621 N/A ASN 584.A ND2 VAL 627.A O no hydrogen 3.014 N/A ASN 585.A N LYS 566.A O no hydrogen 3.037 N/A ASP 586.A N ASN 584.A OD1 no hydrogen 2.739 N/A SER 587.A N ASP 586.A OD2 no hydrogen 2.825 N/A SER 589.A OG VAL 627.A O no hydrogen 3.172 N/A HIS 590.A N VAL 627.A O no hydrogen 2.955 N/A VAL 592.A N VAL 625.A O no hydrogen 2.852 N/A VAL 594.A N VAL 623.A O no hydrogen 2.821 N/A VAL 596.A N VAL 594.A O no hydrogen 2.931 N/A TRP 597.A N GLY 621.A O no hydrogen 3.292 N/A GLN 598.A N PRO 595.A O no hydrogen 3.133 N/A LEU 599.A N VAL 596.A O no hydrogen 3.047 N/A SER 600.A N TRP 597.A O no hydrogen 2.816 N/A SER 600.A OG ASP 69.A OD2 no hydrogen 2.717 N/A MET 601.A N VAL 596.A O no hydrogen 3.194 N/A GLY 604.A N VAL 618.A O no hydrogen 2.583 N/A SER 605.A N PRO 602.A O no hydrogen 3.394 N/A SER 605.A OG PRO 602.A O no hydrogen 2.863 N/A SER 605.A OG GLN 637.A OE1 no hydrogen 3.032 N/A VAL 607.A N TYR 616.A O no hydrogen 2.897 N/A THR 608.A N ALA 636.A O no hydrogen 2.816 N/A ASP 609.A N HIS 614.A O no hydrogen 3.055 N/A LYS 610.A N THR 608.A O no hydrogen 2.876 N/A LYS 610.A N VAL 634.A O no hydrogen 3.205 N/A ILE 611.A N ASP 609.A OD1 no hydrogen 3.312 N/A THR 612.A N ASP 609.A O no hydrogen 2.694 N/A THR 612.A OG1 ASP 609.A O no hydrogen 3.443 N/A THR 612.A OG1 ASP 609.A OD2 no hydrogen 3.361 N/A GLY 613.A N ASP 609.A O no hydrogen 2.884 N/A HIS 614.A N THR 612.A OG1 no hydrogen 3.141 N/A SER 615.A OG VAL 607.A O no hydrogen 3.428 N/A TYR 616.A N VAL 607.A O no hydrogen 2.840 N/A VAL 618.A N SER 605.A O no hydrogen 3.006 N/A GLN 619.A N MET 622.A O no hydrogen 3.176 N/A MET 622.A N GLN 619.A O no hydrogen 3.014 N/A VAL 623.A N VAL 594.A O no hydrogen 3.031 N/A THR 624.A OG1 ASN 593.A OD1 no hydrogen 2.794 N/A VAL 625.A N VAL 592.A O no hydrogen 3.098 N/A VAL 627.A N HIS 590.A O no hydrogen 2.836 N/A TYR 631.A N ASN 584.A O no hydrogen 3.190 N/A ALA 633.A N VAL 582.A O no hydrogen 2.886 N/A VAL 634.A N ASP 609.A OD1 no hydrogen 2.658 N/A ALA 636.A N THR 608.A O no hydrogen 2.751 N/A GLN 637.A N ARG 578.A O no hydrogen 3.324 N/A