Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wxr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N ASP 2.A OD2 no hydrogen 2.641 N/A SER 7.A OG GLN 122.A O no hydrogen 2.580 N/A THR 9.A OG1 THR 121.A O no hydrogen 3.054 N/A SER 12.A N LYS 16.A O no hydrogen 2.969 N/A SER 12.A OG SER 14.A OG no hydrogen 2.818 N/A SER 12.A OG LYS 16.A O no hydrogen 3.479 N/A SER 14.A OG SER 12.A OG no hydrogen 2.818 N/A GLY 15.A N SER 12.A O no hydrogen 2.801 N/A LYS 16.A N SER 12.A OG no hydrogen 3.316 N/A ILE 20.A N LEU 17.A O no hydrogen 2.715 N/A ASP 21.A N LEU 17.A O no hydrogen 3.439 N/A TYR 22.A N GLY 18.A O no hydrogen 2.909 N/A ALA 23.A N GLN 19.A O no hydrogen 2.832 N/A LEU 24.A N ILE 20.A O no hydrogen 2.804 N/A THR 25.A N ASP 21.A O no hydrogen 2.853 N/A THR 25.A OG1 ASP 21.A O no hydrogen 3.165 N/A ALA 26.A N TYR 22.A O no hydrogen 2.955 N/A VAL 27.A N ALA 23.A O no hydrogen 3.179 N/A LYS 28.A N LEU 24.A O no hydrogen 3.012 N/A LYS 28.A NZ GLY 164.A O no hydrogen 3.431 N/A LYS 28.A NZ SER 167.A OG no hydrogen 2.802 N/A GLN 29.A N THR 25.A O no hydrogen 3.419 N/A GLY 30.A N VAL 27.A O no hydrogen 2.995 N/A SER 33.A N ILE 163.A O no hydrogen 3.065 N/A SER 33.A OG TYR 74.A O no hydrogen 2.970 N/A SER 33.A OG SER 75.A OG no hydrogen 2.720 N/A LEU 34.A N ALA 45.A O no hydrogen 2.898 N/A GLY 35.A N THR 161.A O no hydrogen 3.078 N/A ILE 36.A N VAL 43.A O no hydrogen 2.923 N/A LYS 37.A N LYS 159.A O no hydrogen 2.942 N/A ALA 38.A N GLY 41.A O no hydrogen 2.728 N/A THR 39.A N LEU 182.A O no hydrogen 2.939 N/A THR 39.A OG1 ASN 40.A OD1 no hydrogen 3.497 N/A THR 39.A OG1 LEU 182.A O no hydrogen 2.689 N/A ASN 40.A ND2 GLU 183.A OE2 no hydrogen 3.261 N/A VAL 42.A N ILE 213.A O no hydrogen 2.772 N/A VAL 43.A N ILE 36.A O no hydrogen 2.935 N/A ILE 44.A N ALA 211.A O no hydrogen 2.896 N/A ALA 45.A N LEU 34.A O no hydrogen 2.883 N/A THR 46.A N GLU 209.A O no hydrogen 3.027 N/A THR 46.A OG1 THR 32.A O no hydrogen 3.117 N/A LYS 48.A N THR 207.A O no hydrogen 2.785 N/A LYS 48.A NZ SER 57.A O no hydrogen 3.306 N/A LYS 48.A NZ LEU 60.A O no hydrogen 3.485 N/A LYS 49.A N GLU 47.A O no hydrogen 2.920 N/A SER 50.A OG SER 52.A O no hydrogen 2.943 N/A LEU 54.A N SER 52.A OG no hydrogen 3.134 N/A ALA 55.A N SER 52.A O no hydrogen 3.094 N/A THR 59.A N MET 56.A O no hydrogen 3.132 N/A THR 59.A OG1 MET 56.A O no hydrogen 2.563 N/A LEU 60.A N SER 57.A O no hydrogen 3.014 N/A LYS 62.A N GLU 209.A OE1 no hydrogen 3.018 N/A LYS 62.A N GLU 209.A OE2 no hydrogen 2.990 N/A LYS 62.A NZ THR 46.A OG1 no hydrogen 3.045 N/A LYS 62.A NZ GLU 47.A O no hydrogen 3.047 N/A VAL 63.A N GLU 209.A OE2 no hydrogen 3.029 N/A SER 64.A N ALA 72.A O no hydrogen 3.105 N/A LEU 66.A N ILE 70.A O no hydrogen 3.198 N/A THR 67.A N ILE 70.A O no hydrogen 3.387 N/A ILE 70.A N THR 67.A O no hydrogen 2.758 N/A GLY 71.A N ALA 136.A O no hydrogen 2.765 N/A ALA 72.A N SER 64.A O no hydrogen 2.663 N/A VAL 73.A N LEU 134.A O no hydrogen 2.987 N/A SER 75.A N SER 132.A O no hydrogen 3.323 N/A SER 75.A OG VAL 31.A O no hydrogen 2.731 N/A SER 75.A OG SER 33.A OG no hydrogen 2.720 N/A SER 75.A OG ILE 163.A O no hydrogen 3.356 N/A MET 77.A N GLY 130.A O no hydrogen 2.869 N/A TYR 81.A N MET 77.A O no hydrogen 3.093 N/A ARG 82.A N GLY 78.A O no hydrogen 2.668 N/A VAL 83.A N PRO 79.A O no hydrogen 3.104 N/A LEU 84.A N ASP 80.A O no hydrogen 3.253 N/A VAL 85.A N TYR 81.A O no hydrogen 3.079 N/A VAL 85.A N ARG 82.A O no hydrogen 3.271 N/A ASP 86.A N ARG 82.A O no hydrogen 3.341 N/A LYS 87.A N VAL 83.A O no hydrogen 3.087 N/A SER 88.A N LEU 84.A O no hydrogen 2.747 N/A SER 88.A OG LEU 84.A O no hydrogen 2.504 N/A ARG 89.A N VAL 85.A O no hydrogen 2.745 N/A ARG 89.A NE LEU 65.A O no hydrogen 2.954 N/A ARG 89.A NH2 LEU 65.A O no hydrogen 3.156 N/A LYS 90.A N ASP 86.A O no hydrogen 3.054 N/A VAL 91.A N LYS 87.A O no hydrogen 3.020 N/A ALA 92.A N SER 88.A O no hydrogen 3.128 N/A HIS 93.A N LYS 90.A O no hydrogen 2.683 N/A HIS 93.A ND1 ARG 89.A O no hydrogen 3.224 N/A THR 94.A N LYS 90.A O no hydrogen 2.862 N/A SER 95.A N VAL 91.A O no hydrogen 2.886 N/A TYR 96.A N HIS 93.A O no hydrogen 3.169 N/A LYS 97.A N ALA 92.A O no hydrogen 3.098 N/A LYS 97.A NZ TYR 103.A OH no hydrogen 3.532 N/A ARG 98.A N HIS 93.A O no hydrogen 2.893 N/A ILE 99.A N TYR 96.A O no hydrogen 2.728 N/A TYR 100.A N TYR 96.A O no hydrogen 2.910 N/A GLY 101.A N LYS 97.A O no hydrogen 2.968 N/A LEU 108.A N PRO 105.A O no hydrogen 3.141 N/A LEU 109.A N PRO 105.A O no hydrogen 3.283 N/A VAL 110.A N THR 106.A O no hydrogen 3.160 N/A SER 111.A N LYS 107.A O no hydrogen 3.241 N/A SER 111.A OG LYS 107.A O no hydrogen 3.000 N/A SER 111.A OG TYR 155.A OH no hydrogen 3.080 N/A GLU 112.A N LEU 108.A O no hydrogen 3.073 N/A VAL 113.A N LEU 109.A O no hydrogen 3.033 N/A ALA 114.A N VAL 110.A O no hydrogen 2.983 N/A LYS 115.A N SER 111.A O no hydrogen 2.808 N/A ILE 116.A N GLU 112.A O no hydrogen 3.377 N/A MET 117.A N VAL 113.A O no hydrogen 2.959 N/A GLN 118.A N ALA 114.A O no hydrogen 2.632 N/A GLN 118.A NE2 GLN 122.A OE1 no hydrogen 2.892 N/A GLU 119.A N LYS 115.A O no hydrogen 3.182 N/A THR 121.A N GLN 118.A O no hydrogen 2.732 N/A GLN 122.A N GLN 118.A O no hydrogen 3.467 N/A SER 123.A N GLU 119.A O no hydrogen 2.839 N/A SER 123.A OG GLU 119.A O no hydrogen 2.991 N/A GLY 125.A N PHE 6.A O no hydrogen 2.948 N/A ARG 127.A NH1 ASP 80.A OD2 no hydrogen 2.789 N/A ARG 127.A NH1 PRO 128.A O no hydrogen 3.050 N/A ARG 127.A NH2 ASP 80.A OD1 no hydrogen 3.093 N/A ARG 127.A NH2 ASP 80.A OD2 no hydrogen 3.233 N/A GLY 130.A N ASP 80.A OD2 no hydrogen 2.991 N/A SER 132.A N SER 75.A O no hydrogen 3.255 N/A SER 132.A OG ASP 150.A OD1 no hydrogen 2.873 N/A LEU 133.A N VAL 149.A O no hydrogen 2.928 N/A LEU 134.A N VAL 73.A O no hydrogen 2.857 N/A ILE 135.A N TYR 147.A O no hydrogen 2.711 N/A ALA 136.A N GLY 71.A O no hydrogen 2.937 N/A GLY 137.A N SER 145.A O no hydrogen 3.261 N/A HIS 138.A N ASP 69.A O no hydrogen 3.011 N/A ASP 139.A N GLY 143.A O no hydrogen 3.438 N/A PHE 141.A N ASP 139.A OD1 no hydrogen 3.079 N/A ASN 142.A N ASP 139.A OD1 no hydrogen 3.129 N/A ASN 142.A ND2 ASP 139.A OD2 no hydrogen 2.603 N/A GLY 143.A N ASP 139.A O no hydrogen 3.259 N/A SER 145.A N GLY 137.A O no hydrogen 2.689 N/A SER 145.A OG GLY 137.A O no hydrogen 3.533 N/A SER 145.A OG GLY 143.A O no hydrogen 3.488 N/A TYR 147.A N ILE 135.A O no hydrogen 2.854 N/A GLN 148.A N PHE 156.A O no hydrogen 2.877 N/A GLN 148.A NE2 ASP 150.A OD1 no hydrogen 3.067 N/A VAL 149.A N LEU 133.A O no hydrogen 2.839 N/A ASP 150.A N SER 154.A O no hydrogen 2.984 N/A SER 152.A OG SER 154.A OG no hydrogen 3.118 N/A GLY 153.A N ASP 150.A O no hydrogen 2.889 N/A SER 154.A N SER 152.A OG no hydrogen 3.351 N/A SER 154.A OG SER 152.A OG no hydrogen 3.118 N/A PHE 156.A N GLN 148.A O no hydrogen 3.137 N/A TRP 158.A N LEU 146.A O no hydrogen 2.553 N/A THR 161.A N GLY 35.A O no hydrogen 3.114 N/A THR 161.A OG1 ALA 162.A O no hydrogen 3.518 N/A ILE 163.A N SER 33.A O no hydrogen 2.876 N/A LYS 165.A N GLY 30.A O no hydrogen 2.789 N/A GLY 166.A N THR 32.A OG1 no hydrogen 3.106 N/A SER 167.A N GLY 164.A O no hydrogen 3.217 N/A SER 167.A OG GLY 164.A O no hydrogen 3.061 N/A ALA 170.A N GLY 166.A O no hydrogen 2.883 N/A LYS 171.A N SER 167.A O no hydrogen 2.883 N/A THR 172.A N VAL 168.A O no hydrogen 2.945 N/A THR 172.A OG1 VAL 168.A O no hydrogen 2.741 N/A PHE 173.A N ALA 169.A O no hydrogen 2.810 N/A LEU 174.A N ALA 170.A O no hydrogen 2.607 N/A GLU 175.A N LYS 171.A O no hydrogen 2.732 N/A ARG 177.A N PHE 173.A O no hydrogen 3.293 N/A ARG 177.A N LEU 174.A O no hydrogen 3.171 N/A TRP 178.A N LEU 174.A O no hydrogen 3.073 N/A TRP 178.A NE1 LYS 37.A O no hydrogen 3.009 N/A LEU 184.A N ASN 40.A OD1 no hydrogen 2.966 N/A GLU 185.A N GLU 183.A OE1 no hydrogen 3.081 N/A ASP 186.A N GLU 183.A O no hydrogen 2.905 N/A ALA 187.A N GLU 183.A O no hydrogen 3.140 N/A ILE 188.A N LEU 184.A O no hydrogen 2.808 N/A HIS 189.A N GLU 185.A O no hydrogen 3.211 N/A ILE 190.A N ASP 186.A O no hydrogen 2.906 N/A ALA 191.A N ALA 187.A O no hydrogen 2.922 N/A LEU 192.A N ILE 188.A O no hydrogen 3.102 N/A LEU 193.A N HIS 189.A O no hydrogen 3.079 N/A THR 194.A N ILE 190.A O no hydrogen 2.812 N/A THR 194.A OG1 ILE 190.A O no hydrogen 2.942 N/A LEU 195.A N ALA 191.A O no hydrogen 3.107 N/A LYS 196.A N LEU 192.A O no hydrogen 3.223 N/A VAL 199.A N LYS 196.A O no hydrogen 3.371 N/A ASN 204.A N THR 207.A OG1 no hydrogen 2.858 N/A GLY 205.A N ASN 243.A OD1 no hydrogen 3.416 N/A ASP 206.A N ASN 204.A OD1 no hydrogen 2.611 N/A THR 207.A N ASN 204.A O no hydrogen 3.005 N/A THR 207.A N ASN 204.A OD1 no hydrogen 3.299 N/A THR 207.A OG1 GLU 202.A O no hydrogen 3.245 N/A THR 207.A OG1 ASN 204.A O no hydrogen 3.141 N/A GLU 209.A N THR 46.A O no hydrogen 3.008 N/A ALA 211.A N ILE 44.A O no hydrogen 3.042 N/A ILE 212.A N ARG 235.A O no hydrogen 2.900 N/A ILE 213.A N VAL 42.A O no hydrogen 2.802 N/A GLY 214.A N ARG 233.A O no hydrogen 2.939 N/A ASN 217.A N PRO 232.A O no hydrogen 3.187 N/A ASN 217.A ND2 PRO 232.A O no hydrogen 2.669 N/A LEU 220.A N ASN 217.A O no hydrogen 2.822 N/A LEU 221.A N PRO 218.A O no hydrogen 3.049 N/A TYR 223.A OH ASP 229.A OD2 no hydrogen 2.529 N/A ASP 229.A N ILE 226.A O no hydrogen 3.291 N/A ARG 233.A N ASP 69.A OD1 no hydrogen 3.381 N/A ARG 233.A NH1 GLY 214.A O no hydrogen 2.679 N/A PHE 234.A N PRO 68.A O no hydrogen 3.031 N/A ARG 235.A N ILE 212.A O no hydrogen 2.934 N/A ARG 235.A NH1 GLU 241.A OE1 no hydrogen 2.579 N/A ARG 235.A NH1 GLU 241.A OE2 no hydrogen 3.101 N/A ARG 235.A NH2 GLU 241.A OE2 no hydrogen 2.930 N/A LYS 236.A NZ VAL 63.A O no hydrogen 2.764 N/A LYS 236.A NZ GLU 209.A OE2 no hydrogen 2.764 N/A LEU 237.A N LEU 210.A O no hydrogen 3.230 N/A SER 239.A OG GLY 205.A O no hydrogen 2.732 N/A SER 239.A OG ASP 206.A OD1 no hydrogen 2.518 N/A GLU 241.A N THR 238.A OG1 no hydrogen 3.385 N/A ILE 242.A N THR 238.A O no hydrogen 3.163 N/A ASN 243.A N SER 239.A O no hydrogen 3.121 N/A ASP 244.A N GLN 240.A O no hydrogen 3.157 N/A ARG 245.A N ILE 242.A O no hydrogen 2.771 N/A ARG 245.A NH1 GLU 185.A OE1 no hydrogen 2.446 N/A ARG 245.A NH2 GLU 185.A OE1 no hydrogen 3.211 N/A ARG 245.A NH2 GLU 185.A OE2 no hydrogen 2.767 N/A LEU 246.A N ASN 243.A O no hydrogen 2.896 N/A GLU 247.A N ASN 243.A O no hydrogen 3.099 N/A LEU 249.A N ARG 245.A O no hydrogen 3.033 N/A