Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q8b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG TYR 402.A OH no hydrogen 2.897 N/A GLN 3.A NE2 PHE 404.A O no hydrogen 3.164 N/A GLY 4.A N GLN 3.A OE1 no hydrogen 3.442 N/A LEU 5.A N SER 24.A O no hydrogen 3.185 N/A LEU 6.A N SER 49.A O no hydrogen 2.919 N/A GLY 7.A N THR 22.A O no hydrogen 2.743 N/A TYR 8.A N ILE 47.A O no hydrogen 2.834 N/A TYR 8.A OH GLY 150.A O no hydrogen 2.528 N/A TYR 9.A N VAL 20.A O no hydrogen 2.946 N/A TYR 9.A OH LEU 29.A O no hydrogen 2.904 N/A PHE 10.A N SER 45.A O no hydrogen 2.886 N/A SER 11.A N ALA 17.A O no hydrogen 3.224 N/A ASN 14.A N ASP 12.A OD2 no hydrogen 2.973 N/A PHE 15.A N SER 45.A OG no hydrogen 3.233 N/A GLN 16.A N ASP 12.A OD1 no hydrogen 3.095 N/A GLN 16.A N ASP 12.A OD2 no hydrogen 3.107 N/A GLN 16.A NE2 ASN 14.A O no hydrogen 2.764 N/A ALA 17.A N ASP 12.A OD1 no hydrogen 2.846 N/A MET 19.A N TYR 9.A O no hydrogen 2.766 N/A VAL 20.A N TYR 9.A O no hydrogen 3.324 N/A VAL 21.A N LEU 171.A O no hydrogen 2.788 N/A THR 22.A N GLY 7.A O no hydrogen 3.006 N/A THR 22.A OG1 THR 169.A O no hydrogen 2.829 N/A SER 24.A N LEU 5.A O no hydrogen 3.172 N/A SER 24.A OG THR 26.A O no hydrogen 3.384 N/A GLY 27.A N ILE 122.A O no hydrogen 2.760 N/A ASP 28.A N THR 26.A OG1 no hydrogen 2.924 N/A LEU 29.A N PHE 108.A O no hydrogen 2.908 N/A SER 30.A N ASP 28.A OD1 no hydrogen 3.236 N/A SER 30.A OG ASP 28.A OD1 no hydrogen 2.536 N/A SER 30.A OG PHE 108.A O no hydrogen 3.358 N/A ILE 31.A N LEU 106.A O no hydrogen 2.766 N/A GLU 35.A N PRO 32.A O no hydrogen 2.913 N/A LEU 36.A N SER 33.A O no hydrogen 2.903 N/A GLN 41.A N SER 38.A O no hydrogen 3.145 N/A GLN 41.A NE2 PRO 37.A O no hydrogen 2.950 N/A GLN 44.A NE2 SER 11.A O no hydrogen 2.706 N/A SER 45.A N PHE 10.A O no hydrogen 3.417 N/A SER 45.A OG ASP 12.A O no hydrogen 2.642 N/A ALA 46.A N TYR 96.A O no hydrogen 3.025 N/A ILE 47.A N TYR 8.A O no hydrogen 2.857 N/A TRP 48.A N ILE 94.A O no hydrogen 2.857 N/A TRP 48.A NE1 TYR 9.A OH no hydrogen 3.096 N/A SER 49.A N LEU 6.A O no hydrogen 2.959 N/A GLY 50.A N ILE 92.A O no hydrogen 3.207 N/A PHE 51.A N GLN 128.A O no hydrogen 2.762 N/A ILE 52.A N TYR 90.A O no hydrogen 2.837 N/A LYS 53.A N ASN 126.A O no hydrogen 2.990 N/A SER 55.A OG LEU 84.A O no hydrogen 3.546 N/A ASP 56.A N LEU 84.A O no hydrogen 3.128 N/A GLU 57.A N ASP 56.A OD1 no hydrogen 2.796 N/A TYR 58.A N ILE 82.A O no hydrogen 3.090 N/A THR 59.A N THR 113.A O no hydrogen 2.897 N/A ALA 61.A N TYR 111.A O no hydrogen 3.171 N/A THR 62.A N ASP 65.A OD1 no hydrogen 2.885 N/A THR 62.A OG1 ASP 65.A OD1 no hydrogen 2.659 N/A SER 63.A N LYS 109.A O no hydrogen 2.966 N/A ALA 64.A N THR 62.A OG1 no hydrogen 3.176 N/A HIS 67.A N ALA 64.A O no hydrogen 3.000 N/A HIS 67.A ND1 GLN 97.A O no hydrogen 3.071 N/A THR 69.A N GLN 95.A O no hydrogen 2.970 N/A MET 70.A N ILE 78.A O no hydrogen 2.907 N/A TRP 71.A N LYS 93.A O no hydrogen 2.823 N/A VAL 72.A N GLN 75.A O no hydrogen 3.122 N/A ASP 73.A N GLN 91.A O no hydrogen 2.966 N/A GLN 75.A N VAL 72.A O no hydrogen 2.808 N/A VAL 77.A N MET 70.A O no hydrogen 2.951 N/A ILE 78.A N MET 70.A O no hydrogen 3.377 N/A ILE 82.A N TYR 58.A O no hydrogen 3.076 N/A ARG 83.A NE GLU 85.A OE2 no hydrogen 3.325 N/A ARG 83.A NH2 GLU 85.A OE1 no hydrogen 3.062 N/A LEU 84.A N ASP 56.A O no hydrogen 3.145 N/A GLU 85.A N TYR 90.A OH no hydrogen 2.996 N/A TYR 90.A N ILE 52.A O no hydrogen 3.004 N/A GLN 91.A N ASP 73.A OD1 no hydrogen 2.897 N/A GLN 91.A NE2 LYS 141.A O no hydrogen 3.310 N/A ILE 92.A N GLY 50.A O no hydrogen 2.883 N/A LYS 93.A N TRP 71.A O no hydrogen 3.022 N/A ILE 94.A N TRP 48.A O no hydrogen 2.892 N/A GLN 95.A N THR 69.A O no hydrogen 2.824 N/A TYR 96.A N ALA 46.A O no hydrogen 2.922 N/A GLN 97.A N HIS 67.A O no hydrogen 3.330 N/A GLN 97.A NE2 LEU 13.A O no hydrogen 2.851 N/A ARG 98.A N GLN 44.A O no hydrogen 3.110 N/A ARG 98.A NE TYR 96.A OH no hydrogen 3.059 N/A GLY 105.A N GLN 41.A O no hydrogen 2.902 N/A LEU 106.A N ILE 31.A O no hydrogen 3.006 N/A PHE 108.A N SER 30.A OG no hydrogen 3.221 N/A LYS 109.A N SER 63.A OG no hydrogen 3.136 N/A LEU 110.A N GLY 27.A O no hydrogen 2.907 N/A TYR 111.A N ALA 61.A O no hydrogen 2.791 N/A TRP 112.A N GLU 120.A O no hydrogen 3.253 N/A THR 113.A N THR 59.A O no hydrogen 2.938 N/A ASP 114.A N LYS 118.A O no hydrogen 3.188 N/A SER 115.A OG ASP 56.A OD1 no hydrogen 2.607 N/A LYS 118.A N ASP 114.A OD1 no hydrogen 3.126 N/A GLU 120.A N TRP 112.A O no hydrogen 3.154 N/A ILE 122.A N LEU 110.A O no hydrogen 3.035 N/A ASN 126.A N SER 123.A O no hydrogen 3.099 N/A LEU 127.A N SER 124.A O no hydrogen 3.175 N/A GLN 128.A N PHE 51.A O no hydrogen 3.032 N/A LEU 129.A N GLN 3.A OE1 no hydrogen 2.969 N/A LYS 133.A NZ GLU 205.A OE2 no hydrogen 2.698 N/A LYS 133.A NZ TYR 402.A O no hydrogen 3.075 N/A SER 137.A N ARG 140.A O no hydrogen 3.272 N/A SER 139.A N SER 137.A OG no hydrogen 3.167 N/A ARG 140.A N SER 137.A OG no hydrogen 2.976 N/A ARG 140.A NE GLU 131.A OE1 no hydrogen 2.794 N/A ARG 140.A NH1 GLN 128.A OE1 no hydrogen 2.915 N/A ARG 140.A NH1 LEU 129.A O no hydrogen 2.862 N/A ARG 140.A NH2 LEU 129.A O no hydrogen 2.741 N/A ARG 140.A NH2 GLU 131.A OE1 no hydrogen 2.955 N/A LYS 142.A N SER 136.A OG no hydrogen 3.179 N/A LYS 142.A NZ GLN 134.A O no hydrogen 3.085 N/A ARG 146.A N ASP 153.A OD1 no hydrogen 2.807 N/A ARG 146.A NE GLU 192.A OE1 no hydrogen 3.254 N/A ASN 148.A N ASP 145.A O no hydrogen 2.908 N/A ASP 149.A N ASP 147.A OD1 no hydrogen 3.063 N/A GLY 150.A N ASP 145.A OD2 no hydrogen 2.653 N/A ILE 151.A N ASP 149.A OD1 no hydrogen 2.822 N/A ASP 153.A N PRO 144.A O no hydrogen 2.994 N/A LEU 155.A N PRO 152.A O no hydrogen 3.054 N/A GLU 156.A N PRO 152.A O no hydrogen 3.270 N/A VAL 157.A N ASP 153.A O no hydrogen 3.173 N/A GLU 158.A N SER 154.A O no hydrogen 3.021 N/A GLY 159.A N LEU 155.A O no hydrogen 2.902 N/A TYR 160.A N TYR 187.A O no hydrogen 2.898 N/A TYR 160.A OH SER 189.A OG no hydrogen 2.641 N/A THR 161.A N SER 172.A O no hydrogen 2.933 N/A ASP 163.A N PHE 170.A O no hydrogen 2.912 N/A LYS 165.A N ASP 163.A O no hydrogen 3.207 N/A ARG 168.A NH1 SER 23.A O no hydrogen 3.498 N/A ARG 168.A NH2 SER 30.A O no hydrogen 3.463 N/A ARG 168.A NH2 GLU 35.A OE1 no hydrogen 2.942 N/A PHE 170.A N ASP 163.A O no hydrogen 3.162 N/A LEU 171.A N VAL 21.A O no hydrogen 2.988 N/A SER 172.A N THR 161.A O no hydrogen 3.102 N/A SER 172.A OG MET 19.A O no hydrogen 3.100 N/A TRP 174.A N GLY 159.A O no hydrogen 3.099 N/A ILE 175.A N HIS 179.A ND1 no hydrogen 3.102 N/A HIS 179.A N ILE 175.A O no hydrogen 3.129 N/A GLU 180.A N SER 176.A O no hydrogen 3.223 N/A GLY 183.A N GLU 180.A O no hydrogen 3.222 N/A LEU 184.A N HIS 179.A O no hydrogen 3.081 N/A TYR 187.A N TYR 160.A O no hydrogen 2.828 N/A SER 189.A N GLU 156.A O no hydrogen 3.087 N/A SER 189.A OG GLU 156.A OE1 no hydrogen 2.619 N/A SER 189.A OG TYR 160.A OH no hydrogen 2.641 N/A SER 190.A N THR 196.A OG1 no hydrogen 2.830 N/A SER 190.A OG THR 457.A OG1 no hydrogen 2.478 N/A GLU 192.A N SER 190.A OG no hydrogen 3.111 N/A LYS 193.A NZ SER 198.A OG no hydrogen 3.155 N/A LYS 193.A NZ GLU 455.A OE1 no hydrogen 3.316 N/A LYS 193.A NZ GLU 455.A OE2 no hydrogen 2.747 N/A TRP 194.A NE1 LEU 132.A O no hydrogen 2.889 N/A SER 195.A OG ASP 199.A O no hydrogen 3.229 N/A SER 195.A OG ASP 199.A OD1 no hydrogen 2.952 N/A SER 195.A OG TYR 201.A O no hydrogen 3.111 N/A THR 196.A N ASP 203.A OD1 no hydrogen 2.779 N/A THR 196.A OG1 ASP 203.A OD1 no hydrogen 3.380 N/A THR 196.A OG1 ASP 203.A OD2 no hydrogen 2.727 N/A SER 198.A N SER 195.A O no hydrogen 2.985 N/A SER 198.A OG THR 427.A OG1 no hydrogen 3.237 N/A ASP 199.A N SER 195.A OG no hydrogen 2.916 N/A TYR 201.A N ASP 199.A OD1 no hydrogen 2.971 N/A SER 202.A N GLU 205.A OE1 no hydrogen 2.977 N/A ASP 203.A N TRP 194.A O no hydrogen 2.928 N/A PHE 204.A N SER 202.A OG no hydrogen 3.072 N/A GLU 205.A N SER 202.A OG no hydrogen 2.993 N/A LYS 206.A N SER 202.A O no hydrogen 2.883 N/A LYS 206.A NZ ASP 199.A OD2 no hydrogen 2.760 N/A LYS 206.A NZ ALA 219.A O no hydrogen 3.299 N/A VAL 207.A N ASP 203.A O no hydrogen 3.283 N/A THR 208.A N PHE 204.A O no hydrogen 3.053 N/A THR 208.A OG1 PHE 204.A O no hydrogen 2.827 N/A GLY 209.A N LYS 206.A O no hydrogen 3.352 N/A ARG 210.A NE SER 2.A O no hydrogen 3.231 N/A ARG 210.A NH1 THR 208.A OG1 no hydrogen 2.892 N/A ARG 210.A NH2 SER 2.A O no hydrogen 2.981 N/A ASN 214.A N ASP 212.A OD1 no hydrogen 3.020 N/A VAL 215.A N ASP 212.A O no hydrogen 3.067 N/A SER 216.A N THR 311.A O no hydrogen 2.945 N/A GLU 218.A N GLU 218.A OE1 no hydrogen 2.876 N/A ALA 219.A N SER 216.A O no hydrogen 2.992 N/A ARG 220.A N PRO 217.A O no hydrogen 3.181 N/A ARG 220.A NE VAL 215.A O no hydrogen 3.106 N/A ARG 220.A NH2 VAL 215.A O no hydrogen 2.977 N/A HIS 221.A N GLU 218.A O no hydrogen 3.317 N/A LEU 223.A N HIS 221.A ND1 no hydrogen 3.011 N/A VAL 224.A N HIS 221.A O no hydrogen 3.075 N/A ALA 225.A N ARG 444.A O no hydrogen 3.020 N/A ALA 226.A N ASP 199.A OD2 no hydrogen 2.734 N/A TYR 227.A N THR 311.A OG1 no hydrogen 3.034 N/A TYR 227.A OH GLU 442.A OE2 no hydrogen 2.681 N/A ILE 229.A N ASN 308.A OD1 no hydrogen 3.299 N/A HIS 231.A N VAL 307.A O no hydrogen 2.915 N/A ASP 233.A N ARG 305.A O no hydrogen 2.813 N/A MET 234.A N THR 256.A OG1 no hydrogen 3.047 N/A GLU 235.A N ASN 303.A O no hydrogen 2.821 N/A ILE 237.A N LYS 252.A O no hydrogen 2.925 N/A ILE 238.A N ASN 301.A O no hydrogen 2.869 N/A LEU 239.A N ILE 250.A O no hydrogen 2.751 N/A SER 240.A N ARG 299.A O no hydrogen 2.866 N/A LYS 241.A NZ GLY 291.A O no hydrogen 3.434 N/A ASN 242.A N THR 297.A O no hydrogen 2.772 N/A ASN 242.A ND2 THR 297.A OG1 no hydrogen 3.163 N/A ASN 242.A ND2 THR 373.A OG1 no hydrogen 3.134 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 3.038 N/A ILE 250.A N LEU 239.A O no hydrogen 2.979 N/A LYS 252.A N ILE 237.A O no hydrogen 2.936 N/A LYS 252.A NZ SER 278.A O no hydrogen 2.541 N/A LYS 252.A NZ SER 280.A OG no hydrogen 2.960 N/A THR 254.A N GLU 235.A O no hydrogen 3.063 N/A THR 254.A OG1 MET 234.A O no hydrogen 2.897 N/A SER 255.A N ALA 274.A O no hydrogen 2.948 N/A THR 256.A OG1 MET 234.A O no hydrogen 2.841 N/A SER 257.A N THR 272.A O no hydrogen 3.192 N/A ARG 258.A NH1 ASN 269.A OD1 no hydrogen 3.199 N/A ARG 258.A NH2 ASN 269.A OD1 no hydrogen 3.031 N/A THR 259.A N SER 270.A O no hydrogen 2.980 N/A THR 259.A OG1 SER 270.A O no hydrogen 3.402 N/A HIS 260.A N ASN 541.A O no hydrogen 3.062 N/A GLY 264.A N HIS 260.A NE2 no hydrogen 3.252 N/A SER 266.A OG SER 268.A OG no hydrogen 3.132 N/A SER 268.A N SER 266.A OG no hydrogen 3.256 N/A SER 268.A OG SER 266.A OG no hydrogen 3.132 N/A ASN 269.A ND2 THR 392.A O no hydrogen 3.553 N/A ASN 269.A ND2 ASP 393.A O no hydrogen 3.319 N/A ASN 269.A ND2 TYR 396.A OH no hydrogen 2.846 N/A SER 270.A OG LEU 390.A O no hydrogen 3.509 N/A SER 270.A OG ASP 391.A OD1 no hydrogen 2.886 N/A SER 271.A N LEU 390.A O no hydrogen 3.001 N/A SER 271.A OG VAL 232.A O no hydrogen 2.744 N/A THR 272.A N SER 257.A O no hydrogen 2.988 N/A VAL 273.A N LEU 388.A O no hydrogen 2.785 N/A ALA 274.A N SER 255.A O no hydrogen 2.735 N/A ILE 275.A N LYS 386.A O no hydrogen 2.898 N/A ASP 276.A N ASN 253.A O no hydrogen 3.115 N/A SER 278.A N ASP 276.A OD1 no hydrogen 3.094 N/A SER 278.A OG ASP 276.A OD1 no hydrogen 2.936 N/A SER 278.A OG ASP 276.A OD2 no hydrogen 2.914 N/A LEU 279.A N ASP 601.A O no hydrogen 2.657 N/A THR 285.A N GLU 288.A OE1 no hydrogen 3.063 N/A TRP 286.A N GLU 383.A OE2 no hydrogen 2.897 N/A GLU 288.A N THR 285.A OG1 no hydrogen 2.754 N/A THR 289.A N THR 285.A O no hydrogen 2.923 N/A THR 289.A OG1 THR 285.A O no hydrogen 2.733 N/A MET 290.A N TRP 286.A O no hydrogen 2.906 N/A LEU 292.A N ALA 287.A O no hydrogen 2.802 N/A ASN 293.A N ASP 296.A OD2 no hydrogen 2.846 N/A ALA 295.A N ASN 293.A OD1 no hydrogen 3.077 N/A ASP 296.A N ASN 293.A O no hydrogen 3.064 N/A ALA 298.A N MET 374.A O no hydrogen 2.976 N/A ARG 299.A N SER 240.A O no hydrogen 2.868 N/A ARG 299.A NH1 ASN 242.A OD1 no hydrogen 2.823 N/A ARG 299.A NH1 GLU 243.A OE1 no hydrogen 3.041 N/A LEU 300.A N ILE 372.A O no hydrogen 3.049 N/A ASN 301.A N ILE 238.A O no hydrogen 2.901 N/A ASN 301.A ND2 ASN 362.A O no hydrogen 3.388 N/A ALA 302.A N ASN 301.A OD1 no hydrogen 2.894 N/A ASN 303.A N ASN 236.A O no hydrogen 3.098 N/A ILE 304.A N ILE 359.A O no hydrogen 2.821 N/A ARG 305.A N ASP 233.A O no hydrogen 2.885 N/A ARG 305.A NE GLU 235.A OE2 no hydrogen 2.803 N/A ARG 305.A NH1 PRO 352.A O no hydrogen 2.775 N/A ARG 305.A NH1 LEU 356.A O no hydrogen 3.180 N/A ARG 305.A NH2 LEU 356.A O no hydrogen 2.812 N/A TYR 306.A N TYR 351.A O no hydrogen 2.841 N/A VAL 307.A N HIS 231.A O no hydrogen 2.743 N/A ASN 308.A N ASN 349.A O no hydrogen 3.029 N/A ASN 308.A ND2 ALA 312.A O no hydrogen 2.947 N/A ASN 308.A ND2 LEU 345.A O no hydrogen 3.229 N/A THR 309.A N ILE 229.A O no hydrogen 2.900 N/A GLY 310.A N ASN 308.A OD1 no hydrogen 2.907 N/A THR 311.A N TYR 227.A O no hydrogen 2.850 N/A THR 311.A OG1 ALA 225.A O no hydrogen 2.767 N/A THR 311.A OG1 TYR 227.A O no hydrogen 3.424 N/A ILE 314.A N LEU 345.A O no hydrogen 3.095 N/A TYR 315.A OH ASP 212.A OD1 no hydrogen 3.159 N/A TYR 315.A OH ASP 212.A OD2 no hydrogen 2.730 N/A ASN 316.A ND2 ASN 339.A OD1 no hydrogen 3.220 N/A ASN 316.A ND2 ASN 398.A OD1 no hydrogen 2.983 N/A THR 320.A N ASP 393.A OD1 no hydrogen 3.226 N/A THR 321.A N ILE 334.A O no hydrogen 3.094 N/A THR 321.A OG1 THR 392.A OG1 no hydrogen 3.018 N/A SER 322.A N ASP 391.A O no hydrogen 2.749 N/A LEU 323.A N ALA 332.A O no hydrogen 2.834 N/A VAL 324.A N ARG 389.A O no hydrogen 2.774 N/A LEU 325.A N GLN 329.A O no hydrogen 2.912 N/A GLN 329.A N LEU 325.A O no hydrogen 3.079 N/A GLN 329.A NE2 LEU 325.A O no hydrogen 3.618 N/A GLN 329.A NE2 GLU 381.A OE1 no hydrogen 3.058 N/A GLN 329.A NE2 GLU 381.A OE2 no hydrogen 3.161 N/A LEU 331.A N LEU 323.A O no hydrogen 2.755 N/A ALA 332.A N LEU 323.A O no hydrogen 3.430 N/A ILE 334.A N THR 321.A O no hydrogen 2.704 N/A LYS 335.A NZ THR 320.A OG1 no hydrogen 3.270 N/A ASN 339.A N ASN 316.A O no hydrogen 2.814 N/A GLN 340.A N LYS 337.A O no hydrogen 3.192 N/A SER 342.A N TYR 351.A OH no hydrogen 3.026 N/A SER 342.A OG TYR 351.A OH no hydrogen 2.674 N/A GLN 343.A NE2 SER 353.A OG no hydrogen 3.085 N/A LEU 345.A N ILE 314.A O no hydrogen 3.046 N/A ASN 348.A N ASN 308.A O no hydrogen 2.626 N/A ASN 349.A N ASN 308.A O no hydrogen 3.439 N/A TYR 350.A N ASN 349.A OD1 no hydrogen 2.878 N/A TYR 351.A N TYR 306.A O no hydrogen 2.816 N/A TYR 351.A OH SER 342.A OG no hydrogen 2.674 N/A SER 353.A OG GLN 343.A OE1 no hydrogen 3.020 N/A LEU 356.A N SER 353.A O no hydrogen 3.088 N/A ILE 359.A N ILE 304.A O no hydrogen 3.018 N/A LEU 361.A N ALA 302.A O no hydrogen 2.977 N/A ASN 362.A N ASN 301.A OD1 no hydrogen 3.080 N/A ASN 362.A ND2 LEU 361.A O no hydrogen 3.041 N/A ASN 362.A ND2 THR 370.A O no hydrogen 3.217 N/A ASP 366.A N ALA 363.A O no hydrogen 3.335 N/A SER 368.A N ASP 366.A OD1 no hydrogen 3.352 N/A SER 369.A OG ASP 366.A O no hydrogen 3.274 N/A MET 374.A N ALA 298.A O no hydrogen 2.738 N/A ASN 375.A N GLN 378.A OE1 no hydrogen 3.072 N/A GLN 378.A N ASN 375.A OD1 no hydrogen 2.942 N/A GLN 378.A NE2 GLN 329.A OE1 no hydrogen 3.277 N/A PHE 379.A N ASN 375.A O no hydrogen 2.985 N/A LEU 380.A N TYR 376.A O no hydrogen 3.111 N/A GLU 381.A N ASN 377.A O no hydrogen 3.098 N/A LEU 382.A N GLN 378.A O no hydrogen 2.924 N/A GLU 383.A N PHE 379.A O no hydrogen 3.020 N/A LYS 384.A N LEU 380.A O no hydrogen 2.977 N/A THR 385.A N GLU 381.A O no hydrogen 2.919 N/A THR 385.A OG1 GLU 381.A O no hydrogen 3.105 N/A LYS 386.A N LEU 382.A O no hydrogen 2.720 N/A LYS 386.A NZ GLU 383.A O no hydrogen 2.834 N/A LYS 386.A NZ ILE 648.A O no hydrogen 2.791 N/A GLN 387.A N THR 385.A OG1 no hydrogen 3.306 N/A LEU 388.A N VAL 273.A O no hydrogen 3.215 N/A ARG 389.A N VAL 324.A O no hydrogen 2.929 N/A ARG 389.A NE ASP 391.A OD1 no hydrogen 3.136 N/A ARG 389.A NE ASP 391.A OD2 no hydrogen 3.187 N/A ARG 389.A NH1 GLY 326.A O no hydrogen 3.374 N/A ARG 389.A NH1 LYS 327.A O no hydrogen 3.188 N/A ARG 389.A NH2 LYS 327.A O no hydrogen 3.263 N/A ARG 389.A NH2 ASP 391.A OD2 no hydrogen 2.903 N/A LEU 390.A N SER 271.A O no hydrogen 2.886 N/A ASP 391.A N SER 322.A O no hydrogen 2.873 N/A THR 392.A N ASN 269.A O no hydrogen 2.963 N/A THR 392.A OG1 THR 321.A OG1 no hydrogen 3.018 N/A ASP 393.A N THR 320.A O no hydrogen 2.955 N/A VAL 395.A N ASP 393.A OD1 no hydrogen 3.104 N/A ASN 398.A N ASN 316.A OD1 no hydrogen 3.026 N/A ASN 398.A ND2 ASP 412.A O no hydrogen 3.481 N/A ASN 398.A ND2 SER 415.A O no hydrogen 2.917 N/A ILE 399.A N SER 415.A O no hydrogen 3.075 N/A THR 401.A N ARG 410.A O no hydrogen 3.100 N/A TYR 402.A OH SER 2.A OG no hydrogen 2.897 N/A ASN 403.A N ARG 408.A O no hydrogen 2.759 N/A GLU 405.A N ASN 403.A OD1 no hydrogen 2.785 N/A GLY 407.A N ASN 403.A O no hydrogen 2.766 N/A ARG 408.A N ASN 406.A OD1 no hydrogen 2.798 N/A ARG 410.A N THR 401.A O no hydrogen 3.225 N/A ARG 410.A NH1 VAL 409.A O no hydrogen 3.171 N/A ASP 412.A N ILE 399.A O no hydrogen 2.905 N/A GLY 414.A N ASP 412.A OD1 no hydrogen 2.687 N/A SER 415.A N ASP 412.A O no hydrogen 3.023 N/A SER 415.A OG ASP 412.A OD2 no hydrogen 2.694 N/A TRP 417.A N GLY 397.A O no hydrogen 2.854 N/A SER 418.A N ASN 416.A OD1 no hydrogen 2.846 N/A GLU 419.A N ASN 416.A O no hydrogen 2.861 N/A VAL 420.A N TRP 417.A O no hydrogen 2.951 N/A LEU 421.A N TRP 417.A O no hydrogen 3.123 N/A GLN 423.A N GLN 423.A OE1 no hydrogen 2.927 N/A GLN 423.A NE2 GLU 419.A O no hydrogen 3.164 N/A ILE 424.A N VAL 420.A O no hydrogen 2.992 N/A GLN 425.A N LEU 421.A O no hydrogen 2.808 N/A GLN 425.A NE2 GLN 394.A OE1 no hydrogen 3.039 N/A GLU 426.A N GLN 423.A O no hydrogen 3.176 N/A THR 427.A N GLN 423.A O no hydrogen 3.095 N/A THR 427.A N ILE 424.A O no hydrogen 3.415 N/A THR 427.A OG1 SER 198.A OG no hydrogen 3.237 N/A THR 427.A OG1 GLN 423.A O no hydrogen 2.966 N/A THR 428.A OG1 ILE 424.A O no hydrogen 2.751 N/A ALA 429.A N ILE 445.A O no hydrogen 2.904 N/A ARG 430.A N MET 527.A O no hydrogen 2.911 N/A ARG 430.A NE ASN 528.A OD1 no hydrogen 2.978 N/A ARG 430.A NH1 SER 266.A O no hydrogen 3.008 N/A ARG 430.A NH1 GLU 442.A OE1 no hydrogen 2.958 N/A ARG 430.A NH2 GLY 264.A O no hydrogen 2.717 N/A ARG 430.A NH2 SER 266.A O no hydrogen 2.940 N/A ARG 430.A NH2 ASN 528.A OD1 no hydrogen 3.281 N/A ILE 431.A N ARG 443.A O no hydrogen 2.923 N/A ILE 432.A N ILE 529.A O no hydrogen 2.949 N/A PHE 433.A N VAL 441.A O no hydrogen 2.892 N/A ASN 434.A N ILE 531.A O no hydrogen 3.189 N/A ASN 434.A ND2 TYR 538.A OH no hydrogen 3.011 N/A ASN 439.A N LYS 436.A O no hydrogen 3.156 N/A ASN 439.A N ASP 437.A OD1 no hydrogen 3.177 N/A VAL 441.A N PHE 433.A O no hydrogen 3.016 N/A ARG 443.A N ILE 431.A O no hydrogen 2.833 N/A ARG 443.A NE GLU 218.A OE2 no hydrogen 2.726 N/A ARG 443.A NH1 THR 309.A O no hydrogen 3.032 N/A ARG 443.A NH1 GLU 442.A O no hydrogen 2.817 N/A ARG 443.A NH2 GLU 218.A OE2 no hydrogen 2.854 N/A ARG 444.A NH1 THR 428.A OG1 no hydrogen 3.004 N/A ARG 444.A NH2 ASN 267.A OD1 no hydrogen 2.767 N/A ILE 445.A N ALA 429.A O no hydrogen 2.998 N/A ALA 446.A N LEU 223.A O no hydrogen 2.726 N/A ALA 447.A N THR 427.A O no hydrogen 3.384 N/A SER 451.A N ASN 449.A OD1 no hydrogen 2.867 N/A ASP 452.A N ASN 449.A O no hydrogen 2.947 N/A THR 456.A N ASP 452.A O no hydrogen 3.265 N/A THR 456.A N PRO 453.A O no hydrogen 2.976 N/A THR 456.A OG1 PRO 453.A O no hydrogen 2.607 N/A THR 457.A N LEU 454.A O no hydrogen 3.014 N/A THR 457.A OG1 SER 190.A OG no hydrogen 2.478 N/A THR 457.A OG1 LEU 454.A O no hydrogen 2.625 N/A LYS 458.A N GLU 455.A O no hydrogen 3.356 N/A LYS 458.A NZ ALA 447.A O no hydrogen 2.584 N/A LYS 458.A NZ GLU 455.A OE1 no hydrogen 2.784 N/A LEU 463.A N ILE 521.A O no hydrogen 2.888 N/A LYS 464.A N LEU 518.A O no hydrogen 3.221 N/A LYS 464.A NZ GLU 475.A OE1 no hydrogen 3.026 N/A GLU 465.A N THR 462.A OG1 no hydrogen 3.187 N/A ALA 466.A N THR 462.A O no hydrogen 2.934 N/A LEU 467.A N LEU 463.A O no hydrogen 3.155 N/A LYS 468.A N LYS 464.A O no hydrogen 3.037 N/A LYS 468.A NZ GLU 475.A OE2 no hydrogen 3.041 N/A ILE 469.A N GLU 465.A O no hydrogen 2.900 N/A ALA 470.A N ALA 466.A O no hydrogen 2.859 N/A PHE 471.A N LEU 467.A O no hydrogen 3.200 N/A GLY 472.A N LYS 468.A O no hydrogen 3.198 N/A PHE 473.A N LEU 467.A O no hydrogen 3.348 N/A ASN 474.A N GLN 481.A O no hydrogen 2.934 N/A GLN 481.A N ASN 474.A O no hydrogen 2.903 N/A TYR 482.A N LYS 485.A O no hydrogen 2.788 N/A LYS 485.A N TYR 482.A O no hydrogen 3.124 N/A LYS 485.A NZ GLU 489.A OE1 no hydrogen 2.631 N/A ASP 486.A N GLU 489.A OE2 no hydrogen 3.075 N/A ILE 487.A N LEU 480.A O no hydrogen 3.006 N/A THR 488.A N ASP 486.A OD2 no hydrogen 3.077 N/A THR 488.A OG1 ASP 486.A OD2 no hydrogen 2.735 N/A GLU 489.A N ASP 486.A O no hydrogen 2.928 N/A PHE 490.A N ILE 487.A O no hydrogen 2.953 N/A ASP 491.A N ARG 532.A O no hydrogen 2.863 N/A ASN 493.A N LEU 530.A O no hydrogen 2.935 N/A ASP 495.A N ASN 528.A O no hydrogen 3.364 N/A THR 498.A N ASP 495.A OD1 no hydrogen 2.954 N/A THR 498.A OG1 ASP 495.A OD1 no hydrogen 2.736 N/A SER 499.A N ASP 495.A O no hydrogen 2.824 N/A GLN 500.A N GLN 496.A O no hydrogen 3.118 N/A GLN 500.A NE2 ASN 504.A OD1 no hydrogen 2.905 N/A ASN 501.A N GLN 497.A O no hydrogen 3.063 N/A ASN 501.A ND2 ASN 524.A OD1 no hydrogen 3.142 N/A ILE 502.A N THR 498.A O no hydrogen 2.852 N/A LYS 503.A N SER 499.A O no hydrogen 2.825 N/A ASN 504.A N GLN 500.A O no hydrogen 3.002 N/A GLN 505.A N ASN 501.A O no hydrogen 3.192 N/A GLN 505.A NE2 ASN 501.A OD1 no hydrogen 2.841 N/A GLN 505.A NE2 LYS 522.A O no hydrogen 2.861 N/A LEU 506.A N ILE 502.A O no hydrogen 3.137 N/A ALA 507.A N LYS 503.A O no hydrogen 3.265 N/A GLU 508.A N ASN 504.A O no hydrogen 2.987 N/A LEU 509.A N GLN 505.A O no hydrogen 2.881 N/A ASN 510.A N ALA 507.A O no hydrogen 2.987 N/A ALA 511.A N LEU 506.A O no hydrogen 2.904 N/A TYR 515.A N ASN 513.A OD1 no hydrogen 2.908 N/A TYR 515.A OH PHE 490.A O no hydrogen 2.712 N/A THR 516.A N ASN 513.A O no hydrogen 3.340 N/A THR 516.A OG1 ASN 513.A O no hydrogen 3.168 N/A VAL 517.A N ILE 514.A O no hydrogen 3.197 N/A LYS 520.A N VAL 517.A O no hydrogen 2.904 N/A LYS 520.A NZ ASP 519.A OD2 no hydrogen 2.947 N/A ILE 521.A N LEU 518.A O no hydrogen 3.420 N/A LYS 522.A N GLN 505.A OE1 no hydrogen 2.773 N/A LEU 523.A N MET 461.A O no hydrogen 2.854 N/A ASN 524.A ND2 VAL 448.A O no hydrogen 3.205 N/A ASN 524.A ND2 LEU 523.A O no hydrogen 3.180 N/A ALA 525.A N VAL 448.A O no hydrogen 2.897 N/A LYS 526.A N THR 428.A O no hydrogen 2.712 N/A LYS 526.A NZ GLU 426.A O no hydrogen 2.924 N/A MET 527.A N ASN 524.A O no hydrogen 3.196 N/A ASN 528.A N THR 498.A OG1 no hydrogen 3.116 N/A ASN 528.A ND2 ASP 495.A OD2 no hydrogen 3.094 N/A ILE 529.A N ARG 430.A O no hydrogen 2.906 N/A LEU 530.A N ASN 493.A O no hydrogen 2.870 N/A ILE 531.A N ILE 432.A O no hydrogen 2.821 N/A ARG 532.A N ASP 491.A O no hydrogen 3.334 N/A ARG 532.A N ASP 491.A OD2 no hydrogen 2.954 N/A ARG 532.A NE ASP 491.A OD1 no hydrogen 3.331 N/A ARG 532.A NE ASP 491.A OD2 no hydrogen 3.477 N/A ARG 532.A NH1 ASN 542.A OD1 no hydrogen 2.880 N/A ARG 532.A NH2 ASP 491.A OD1 no hydrogen 3.045 N/A ASP 533.A N ASN 434.A OD1 no hydrogen 2.880 N/A LYS 534.A N GLU 489.A O no hydrogen 3.025 N/A LYS 534.A NZ THR 488.A O no hydrogen 2.824 N/A LYS 534.A NZ TYR 515.A OH no hydrogen 2.832 N/A ARG 535.A N ASP 533.A OD1 no hydrogen 2.841 N/A ARG 535.A NE ASP 533.A OD1 no hydrogen 3.275 N/A ARG 535.A NE ASP 533.A OD2 no hydrogen 3.335 N/A ARG 535.A NH1 ASP 572.A OD1 no hydrogen 3.306 N/A ARG 535.A NH2 ASP 533.A OD2 no hydrogen 2.841 N/A ARG 535.A NH2 ASP 574.A OD2 no hydrogen 3.011 N/A HIS 537.A N GLY 546.A O no hydrogen 2.914 N/A TYR 538.A OH ASP 533.A O no hydrogen 2.569 N/A ASP 539.A N ILE 543.A O no hydrogen 3.177 N/A ASN 541.A N ASP 539.A OD1 no hydrogen 2.760 N/A ASN 542.A N ASP 539.A O no hydrogen 2.906 N/A ASN 542.A ND2 HIS 260.A O no hydrogen 2.769 N/A ASN 542.A ND2 SER 262.A OG no hydrogen 3.386 N/A ILE 543.A N ASP 539.A OD1 no hydrogen 3.176 N/A VAL 545.A N HIS 537.A O no hydrogen 2.943 N/A GLY 546.A N HIS 537.A O no hydrogen 3.276 N/A VAL 552.A N ASP 548.A O no hydrogen 2.886 N/A LYS 553.A N GLU 549.A O no hydrogen 2.893 N/A LYS 553.A NZ LEU 665.A O no hydrogen 3.015 N/A GLU 554.A N SER 550.A O no hydrogen 2.988 N/A ALA 555.A N VAL 551.A O no hydrogen 2.951 N/A HIS 556.A N LYS 553.A O no hydrogen 3.016 N/A ARG 557.A N GLU 554.A O no hydrogen 3.074 N/A ARG 557.A NE GLU 554.A OE1 no hydrogen 3.068 N/A ARG 557.A NH2 GLU 554.A OE2 no hydrogen 3.374 N/A ILE 560.A N LEU 568.A O no hydrogen 2.887 N/A ASN 561.A N LEU 568.A O no hydrogen 3.289 N/A SER 563.A N GLY 566.A O no hydrogen 3.147 N/A GLU 565.A N SER 563.A OG no hydrogen 3.039 N/A LEU 567.A N ILE 616.A O no hydrogen 2.858 N/A LEU 568.A N ASN 561.A O no hydrogen 3.105 N/A LEU 569.A N THR 614.A O no hydrogen 2.857 N/A ASP 574.A N ASP 572.A OD2 no hydrogen 2.801 N/A ILE 575.A N ASP 572.A O no hydrogen 2.799 N/A ARG 576.A N ASP 572.A O no hydrogen 3.132 N/A LYS 577.A N ASP 574.A O no hydrogen 3.188 N/A LYS 577.A NZ ASP 437.A O no hydrogen 3.177 N/A LYS 577.A NZ ASN 439.A OD1 no hydrogen 2.945 N/A ILE 578.A N ILE 575.A O no hydrogen 2.943 N/A LEU 579.A N ARG 576.A O no hydrogen 3.475 N/A SER 580.A N VAL 641.A O no hydrogen 2.930 N/A SER 580.A OG VAL 641.A O no hydrogen 3.281 N/A SER 580.A OG THR 646.A OG1 no hydrogen 2.514 N/A TYR 582.A N LEU 603.A O no hydrogen 2.909 N/A ILE 583.A N TYR 639.A O no hydrogen 3.004 N/A VAL 584.A N ASN 597.A OD1 no hydrogen 2.954 N/A GLU 585.A N ASN 637.A O no hydrogen 2.925 N/A ILE 586.A N GLU 594.A O no hydrogen 2.861 N/A GLU 587.A N LYS 635.A O no hydrogen 2.862 N/A ASP 588.A N LEU 592.A O no hydrogen 2.848 N/A THR 589.A OG1 GLU 590.A OE1 no hydrogen 3.289 N/A GLY 591.A N ASP 588.A O no hydrogen 3.127 N/A GLY 591.A N ASP 588.A OD1 no hydrogen 2.891 N/A LEU 592.A N ASP 588.A OD1 no hydrogen 3.010 N/A GLU 594.A N ILE 586.A O no hydrogen 2.732 N/A ILE 596.A N VAL 584.A O no hydrogen 2.928 N/A ASN 597.A ND2 TYR 582.A O no hydrogen 2.906 N/A ASN 597.A ND2 MET 602.A O no hydrogen 2.815 N/A ARG 599.A N ASN 597.A O no hydrogen 3.018 N/A ARG 599.A NE ASP 601.A OD1 no hydrogen 2.851 N/A ARG 599.A NH2 ASP 601.A OD1 no hydrogen 3.516 N/A ARG 599.A NH2 ASP 601.A OD2 no hydrogen 2.951 N/A TYR 600.A N THR 656.A O no hydrogen 3.002 N/A MET 602.A N ARG 599.A O no hydrogen 3.145 N/A ILE 605.A N LEU 603.A O no hydrogen 2.857 N/A SER 607.A N PHE 615.A O no hydrogen 3.112 N/A ARG 609.A N LYS 613.A O no hydrogen 2.908 N/A GLY 612.A N ARG 609.A O no hydrogen 2.985 N/A LYS 613.A N ASP 611.A OD1 no hydrogen 3.202 N/A THR 614.A N LEU 569.A O no hydrogen 2.746 N/A PHE 615.A N SER 607.A O no hydrogen 3.170 N/A ILE 616.A N LEU 567.A O no hydrogen 2.746 N/A ASP 617.A N ILE 605.A O no hydrogen 2.927 N/A PHE 618.A N GLU 565.A O no hydrogen 3.025 N/A LYS 620.A N ASP 617.A OD1 no hydrogen 3.104 N/A LYS 620.A NZ ASN 604.A O no hydrogen 3.013 N/A TYR 621.A OH ASN 604.A OD1 no hydrogen 3.061 N/A ASN 622.A N LYS 619.A O no hydrogen 2.869 N/A ASN 622.A ND2 LEU 625.A O no hydrogen 2.723 N/A LYS 624.A N LYS 619.A O no hydrogen 3.005 N/A LEU 625.A N ASN 622.A O no hydrogen 3.187 N/A LEU 627.A N THR 564.A O no hydrogen 2.805 N/A ASN 633.A N ASN 631.A OD1 no hydrogen 2.886 N/A TYR 634.A N ASN 631.A O no hydrogen 2.772 N/A LYS 635.A N GLU 587.A O no hydrogen 3.023 N/A LYS 635.A NZ SER 668.A OG no hydrogen 3.325 N/A VAL 636.A N LYS 669.A O no hydrogen 2.842 N/A ASN 637.A N GLU 585.A O no hydrogen 2.936 N/A VAL 638.A N PHE 667.A O no hydrogen 2.859 N/A TYR 639.A N ILE 583.A O no hydrogen 2.879 N/A TYR 639.A OH GLU 585.A OE2 no hydrogen 2.316 N/A ALA 640.A N ILE 664.A O no hydrogen 2.807 N/A VAL 641.A N GLY 581.A O no hydrogen 2.992 N/A LYS 643.A N ILE 578.A O no hydrogen 2.934 N/A LYS 643.A NZ LYS 577.A O no hydrogen 3.394 N/A GLU 644.A N VAL 545.A O no hydrogen 2.852 N/A ASN 645.A N THR 642.A O no hydrogen 2.838 N/A THR 646.A N LYS 643.A O no hydrogen 2.994 N/A THR 646.A OG1 SER 580.A OG no hydrogen 2.514 N/A THR 646.A OG1 THR 642.A O no hydrogen 2.960 N/A THR 646.A OG1 LYS 643.A O no hydrogen 3.436 N/A ASN 649.A ND2 GLU 383.A O no hydrogen 3.418 N/A SER 651.A N ASP 655.A O no hydrogen 2.910 N/A SER 651.A OG ASN 653.A OD1 no hydrogen 2.967 N/A SER 651.A OG ASP 655.A O no hydrogen 3.446 N/A GLY 654.A N SER 651.A O no hydrogen 2.920 N/A ASP 655.A N SER 651.A OG no hydrogen 3.160 N/A ASP 655.A N ASN 653.A OD1 no hydrogen 3.124 N/A THR 656.A OG1 GLU 283.A OE2 no hydrogen 2.946 N/A SER 657.A N ASP 655.A OD1 no hydrogen 2.961 N/A SER 657.A OG ASP 655.A OD1 no hydrogen 2.861 N/A SER 657.A OG ASP 655.A OD2 no hydrogen 3.025 N/A THR 658.A N ASP 598.A OD1 no hydrogen 2.950 N/A THR 658.A OG1 ASP 598.A OD1 no hydrogen 2.722 N/A ASN 659.A N SER 657.A OG no hydrogen 3.246 N/A ILE 661.A N THR 658.A O no hydrogen 2.952 N/A ILE 664.A N ALA 640.A O no hydrogen 2.955 N/A ILE 666.A N VAL 638.A O no hydrogen 2.935 N/A LYS 669.A N VAL 636.A O no hydrogen 3.202 N/A LYS 669.A NZ SER 668.A O no hydrogen 3.499 N/A LYS 670.A N GLU 673.A OE1 no hydrogen 2.872 N/A GLY 671.A N TYR 634.A O no hydrogen 2.762 N/A TYR 672.A N PRO 632.A O no hydrogen 3.100 N/A GLU 673.A N LYS 670.A O no hydrogen 2.914 N/A ILE 674.A N GLY 671.A O no hydrogen 3.245 N/A