Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xva_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ILE 3.A O no hydrogen 2.993 N/A THR 6.A N ASP 4.A OD1 no hydrogen 3.205 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.836 N/A THR 6.A OG1 ASP 4.A OD2 no hydrogen 3.440 N/A GLN 7.A N ASP 4.A O no hydrogen 3.128 N/A GLN 7.A NE2 THR 6.A OG1 no hydrogen 3.120 N/A LEU 8.A N PRO 5.A O no hydrogen 3.291 N/A TYR 10.A OH GLU 15.A OE1 no hydrogen 3.103 N/A LYS 13.A N ASP 11.A OD1 no hydrogen 3.297 N/A TRP 14.A N ASP 11.A O no hydrogen 3.189 N/A GLU 15.A N HIS 12.A O no hydrogen 3.259 N/A PHE 16.A N ALA 91.A O no hydrogen 2.797 N/A ARG 18.A NE HIS 94.A O no hydrogen 3.169 N/A ARG 18.A NH1 HIS 94.A O no hydrogen 2.783 N/A ARG 18.A NH1 PRO 97.A O no hydrogen 2.750 N/A ARG 18.A NH2 PRO 97.A O no hydrogen 2.814 N/A ARG 20.A N PRO 17.A O no hydrogen 3.071 N/A LEU 21.A N ARG 18.A O no hydrogen 3.301 N/A SER 22.A N THR 39.A O no hydrogen 2.950 N/A GLY 24.A N GLU 37.A O no hydrogen 2.713 N/A LEU 27.A N VAL 35.A O no hydrogen 2.742 N/A GLY 28.A N VAL 35.A O no hydrogen 3.341 N/A GLY 30.A N GLY 33.A O no hydrogen 2.869 N/A LYS 34.A N MET 56.A O no hydrogen 2.828 N/A VAL 35.A N GLY 28.A O no hydrogen 2.780 N/A VAL 36.A N VAL 54.A O no hydrogen 2.839 N/A GLU 37.A N LYS 25.A O no hydrogen 2.866 N/A ALA 38.A N VAL 52.A O no hydrogen 3.009 N/A THR 39.A N SER 22.A O no hydrogen 2.984 N/A ALA 40.A N MET 50.A O no hydrogen 2.759 N/A GLN 41.A N ARG 20.A O no hydrogen 2.991 N/A ASP 47.A N ILE 44.A O no hydrogen 3.092 N/A MET 50.A N ALA 40.A O no hydrogen 2.952 N/A VAL 52.A N ALA 38.A O no hydrogen 2.898 N/A ALA 53.A N THR 102.A O no hydrogen 2.939 N/A VAL 54.A N VAL 36.A O no hydrogen 2.751 N/A LYS 55.A N VAL 100.A O no hydrogen 2.875 N/A LYS 55.A NZ GLU 72.A OE1 no hydrogen 2.813 N/A LYS 55.A NZ GLU 72.A OE2 no hydrogen 2.812 N/A LYS 55.A NZ ASP 173.A O no hydrogen 3.095 N/A LYS 55.A NZ PHE 174.A O no hydrogen 3.044 N/A MET 56.A N LYS 34.A O no hydrogen 2.983 N/A LYS 58.A N PHE 32.A O no hydrogen 2.818 N/A LYS 58.A NZ GLY 30.A O no hydrogen 2.997 N/A SER 60.A OG ALA 31.A O no hydrogen 2.737 N/A ALA 61.A N LYS 58.A O no hydrogen 2.800 N/A HIS 62.A N GLU 65.A OE2 no hydrogen 2.849 N/A ARG 66.A N HIS 62.A O no hydrogen 3.176 N/A GLU 67.A N SER 63.A O no hydrogen 2.970 N/A ALA 68.A N THR 64.A O no hydrogen 2.935 N/A LEU 69.A N GLU 65.A O no hydrogen 3.024 N/A MET 70.A N ARG 66.A O no hydrogen 3.342 N/A SER 71.A N GLU 67.A O no hydrogen 2.908 N/A SER 71.A OG GLU 67.A O no hydrogen 3.069 N/A GLU 72.A N ALA 68.A O no hydrogen 2.981 N/A LEU 73.A N LEU 69.A O no hydrogen 3.096 N/A LYS 74.A N MET 70.A O no hydrogen 3.037 N/A LYS 74.A NZ THR 6.A O no hydrogen 3.558 N/A VAL 75.A N SER 71.A O no hydrogen 2.999 N/A LEU 76.A N GLU 72.A O no hydrogen 2.935 N/A SER 77.A N LEU 73.A O no hydrogen 2.892 N/A TYR 78.A N LYS 74.A O no hydrogen 3.103 N/A TYR 78.A OH LYS 149.A O no hydrogen 2.630 N/A LEU 79.A N VAL 75.A O no hydrogen 2.941 N/A ASN 84.A N HIS 82.A ND1 no hydrogen 2.958 N/A ASN 84.A ND2 THR 169.A O no hydrogen 3.184 N/A VAL 86.A N ILE 171.A O no hydrogen 3.107 N/A ASN 87.A N GLU 103.A OE2 no hydrogen 2.776 N/A ASN 87.A ND2 HIS 82.A O no hydrogen 3.071 N/A LEU 89.A N ILE 101.A O no hydrogen 2.780 N/A GLY 90.A N ILE 101.A O no hydrogen 3.226 N/A ALA 91.A N TRP 14.A O no hydrogen 2.961 N/A CYS 92.A N LEU 99.A O no hydrogen 2.985 N/A CYS 92.A SG PHE 16.A O no hydrogen 3.274 N/A THR 93.A N GLU 15.A OE1 no hydrogen 3.156 N/A THR 93.A N GLU 15.A OE2 no hydrogen 3.159 N/A THR 93.A OG1 GLU 15.A OE1 no hydrogen 2.657 N/A HIS 94.A N GLU 15.A OE2 no hydrogen 3.409 N/A LEU 99.A N CYS 92.A O no hydrogen 3.051 N/A VAL 100.A N LYS 55.A O no hydrogen 2.925 N/A ILE 101.A N GLY 90.A O no hydrogen 2.881 N/A THR 102.A N ALA 53.A O no hydrogen 2.901 N/A THR 102.A OG1 GLU 103.A O no hydrogen 3.309 N/A GLU 103.A N ASN 87.A O no hydrogen 3.006 N/A TYR 104.A OH GLU 37.A OE1 no hydrogen 3.004 N/A CYS 106.A SG THR 164.A OG1 no hydrogen 3.631 N/A TYR 107.A N LEU 163.A O no hydrogen 3.003 N/A GLY 108.A N CYS 105.A O no hydrogen 3.195 N/A LEU 110.A N ILE 161.A O no hydrogen 2.794 N/A LEU 111.A N ALA 158.A O no hydrogen 3.225 N/A ASN 112.A N ASP 109.A OD2 no hydrogen 3.495 N/A ASN 112.A ND2 ASP 109.A OD1 no hydrogen 2.904 N/A PHE 113.A N ASP 109.A O no hydrogen 3.270 N/A LEU 114.A N LEU 110.A O no hydrogen 2.785 N/A ARG 115.A N LEU 111.A O no hydrogen 3.102 N/A ARG 115.A NE GLY 229.A O no hydrogen 2.723 N/A ARG 115.A NH1 GLY 229.A O no hydrogen 3.080 N/A ARG 116.A N ASN 112.A O no hydrogen 2.981 N/A LYS 117.A N PHE 113.A O no hydrogen 2.908 N/A LYS 117.A NZ ASP 125.A O no hydrogen 2.728 N/A LYS 117.A NZ ASP 125.A OD2 no hydrogen 3.532 N/A GLU 120.A N LYS 117.A O no hydrogen 3.022 N/A VAL 122.A N LEU 127.A O no hydrogen 2.982 N/A LEU 127.A N GLU 120.A O no hydrogen 3.180 N/A THR 128.A N HIS 131.A ND1 no hydrogen 2.956 N/A THR 128.A OG1 HIS 131.A ND1 no hydrogen 2.835 N/A LEU 129.A N PRO 123.A O no hydrogen 3.176 N/A LEU 132.A N THR 128.A O no hydrogen 3.378 N/A LEU 133.A N LEU 129.A O no hydrogen 2.862 N/A SER 134.A N GLU 130.A O no hydrogen 3.078 N/A PHE 135.A N HIS 131.A O no hydrogen 2.851 N/A SER 136.A N LEU 132.A O no hydrogen 2.963 N/A SER 136.A OG LEU 132.A O no hydrogen 3.550 N/A SER 136.A OG LEU 133.A O no hydrogen 2.897 N/A TYR 137.A N LEU 133.A O no hydrogen 3.203 N/A TYR 137.A OH GLU 288.A OE2 no hydrogen 2.711 N/A GLN 138.A N SER 134.A O no hydrogen 3.040 N/A GLN 138.A NE2 SER 134.A O no hydrogen 3.485 N/A GLN 138.A NE2 SER 134.A OG no hydrogen 3.270 N/A GLN 138.A NE2 ASN 167.A O no hydrogen 2.793 N/A VAL 139.A N PHE 135.A O no hydrogen 3.078 N/A ALA 140.A N SER 136.A O no hydrogen 3.214 N/A LYS 141.A N TYR 137.A O no hydrogen 2.842 N/A LYS 141.A NZ ASN 84.A OD1 no hydrogen 3.299 N/A GLY 142.A N GLN 138.A O no hydrogen 2.968 N/A MET 143.A N VAL 139.A O no hydrogen 2.913 N/A ALA 144.A N ALA 140.A O no hydrogen 2.792 N/A PHE 145.A N LYS 141.A O no hydrogen 3.112 N/A LEU 146.A N GLY 142.A O no hydrogen 3.072 N/A ALA 147.A N MET 143.A O no hydrogen 2.959 N/A SER 148.A N ALA 144.A O no hydrogen 3.139 N/A SER 148.A OG PHE 145.A O no hydrogen 2.640 N/A LYS 149.A N PHE 145.A O no hydrogen 3.161 N/A LYS 149.A N LEU 146.A O no hydrogen 3.225 N/A LYS 149.A NZ TYR 78.A O no hydrogen 3.468 N/A ASN 150.A N ALA 147.A O no hydrogen 3.064 N/A CYS 151.A N LEU 146.A O no hydrogen 2.844 N/A CYS 151.A SG LYS 149.A O no hydrogen 3.637 N/A HIS 153.A N ASP 214.A OD2 no hydrogen 2.795 N/A HIS 153.A NE2 CYS 172.A O no hydrogen 2.623 N/A ARG 154.A N ASP 214.A OD1 no hydrogen 3.129 N/A ASP 155.A N HIS 153.A ND1 no hydrogen 3.101 N/A ALA 158.A N GLU 224.A OE2 no hydrogen 2.956 N/A ARG 159.A NE TYR 186.A OH no hydrogen 2.879 N/A ARG 159.A NH1 ASP 155.A OD1 no hydrogen 3.133 N/A ASN 160.A N ALA 157.A O no hydrogen 3.092 N/A ASN 160.A ND2 ASP 155.A O no hydrogen 2.741 N/A ILE 161.A N ALA 158.A O no hydrogen 3.302 N/A LEU 162.A N LYS 170.A O no hydrogen 2.756 N/A LEU 163.A N GLY 108.A O no hydrogen 2.831 N/A THR 164.A N ILE 168.A O no hydrogen 2.844 N/A ILE 168.A N HIS 165.A O no hydrogen 3.106 N/A THR 169.A N GLN 138.A OE1 no hydrogen 3.111 N/A LYS 170.A N LEU 162.A O no hydrogen 2.773 N/A LYS 170.A NZ GLU 83.A O no hydrogen 2.781 N/A LYS 170.A NZ ILE 85.A O no hydrogen 3.523 N/A LYS 170.A NZ ASN 87.A OD1 no hydrogen 3.133 N/A LYS 170.A NZ GLU 103.A OE2 no hydrogen 3.275 N/A ILE 171.A N ASN 84.A O no hydrogen 2.828 N/A CYS 172.A N ASN 160.A O no hydrogen 2.825 N/A PHE 174.A N ASN 160.A OD1 no hydrogen 3.267 N/A ALA 177.A N PHE 174.A O no hydrogen 2.796 N/A ARG 178.A N GLY 175.A O no hydrogen 3.162 N/A ARG 178.A NH1 ASN 160.A OD1 no hydrogen 3.206 N/A ARG 178.A NH2 ASN 160.A OD1 no hydrogen 3.048 N/A ILE 180.A N ARG 178.A O no hydrogen 2.980 N/A ASN 182.A N ASP 179.A O no hydrogen 3.227 N/A ASN 182.A ND2 ASP 179.A OD1 no hydrogen 3.398 N/A ASN 182.A ND2 ASP 179.A OD2 no hydrogen 2.991 N/A ASP 183.A N ASP 179.A O no hydrogen 3.166 N/A ASN 185.A N ASP 183.A OD1 no hydrogen 3.420 N/A ASN 185.A ND2 ASP 183.A OD1 no hydrogen 2.928 N/A TYR 186.A N ASP 183.A O no hydrogen 3.300 N/A TYR 186.A OH ASP 155.A OD2 no hydrogen 2.650 N/A VAL 187.A N LEU 194.A O no hydrogen 2.859 N/A LYS 189.A N ALA 192.A O no hydrogen 2.871 N/A ALA 192.A N LYS 189.A O no hydrogen 3.283 N/A ARG 193.A NE ILE 180.A O no hydrogen 2.822 N/A ARG 193.A NH1 ASP 183.A O no hydrogen 2.870 N/A LEU 194.A N VAL 187.A O no hydrogen 2.901 N/A VAL 196.A N LEU 194.A O no hydrogen 2.905 N/A LYS 197.A NZ PRO 232.A O no hydrogen 3.208 N/A LYS 197.A NZ TYR 233.A O no hydrogen 3.177 N/A LYS 197.A NZ MET 236.A O no hydrogen 2.759 N/A TRP 198.A N PRO 195.A O no hydrogen 2.943 N/A TRP 198.A NE1 GLU 224.A OE2 no hydrogen 2.768 N/A MET 199.A N VAL 196.A O no hydrogen 3.109 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 3.147 N/A SER 203.A N ALA 200.A O no hydrogen 2.998 N/A SER 203.A OG VAL 208.A O no hydrogen 2.695 N/A ILE 204.A N ALA 200.A O no hydrogen 3.179 N/A PHE 205.A N PRO 201.A O no hydrogen 2.904 N/A ASN 206.A N GLU 202.A O no hydrogen 2.939 N/A VAL 208.A N GLU 202.A O no hydrogen 3.265 N/A THR 210.A N SER 213.A OG no hydrogen 3.009 N/A THR 210.A OG1 GLU 212.A OE1 no hydrogen 3.173 N/A SER 213.A OG THR 210.A O no hydrogen 3.088 N/A VAL 215.A N PHE 211.A O no hydrogen 3.283 N/A TRP 216.A N GLU 212.A O no hydrogen 3.223 N/A SER 217.A N SER 213.A O no hydrogen 3.315 N/A SER 217.A OG TRP 198.A O no hydrogen 2.851 N/A SER 217.A OG SER 213.A O no hydrogen 3.224 N/A TYR 218.A N ASP 214.A O no hydrogen 3.062 N/A TYR 218.A OH SER 136.A O no hydrogen 2.576 N/A GLY 219.A N VAL 215.A O no hydrogen 3.135 N/A GLY 219.A N TRP 216.A O no hydrogen 2.899 N/A ILE 220.A N TRP 216.A O no hydrogen 3.281 N/A PHE 221.A N SER 217.A O no hydrogen 2.872 N/A LEU 222.A N TYR 218.A O no hydrogen 2.901 N/A TRP 223.A N GLY 219.A O no hydrogen 3.232 N/A TRP 223.A NE1 SER 253.A O no hydrogen 3.063 N/A GLU 224.A N ILE 220.A O no hydrogen 2.986 N/A LEU 225.A N PHE 221.A O no hydrogen 2.882 N/A PHE 226.A N LEU 222.A O no hydrogen 3.012 N/A SER 227.A OG TRP 223.A O no hydrogen 2.894 N/A SER 227.A OG GLU 224.A O no hydrogen 2.831 N/A LEU 228.A N LEU 225.A O no hydrogen 3.225 N/A GLY 229.A N GLU 224.A O no hydrogen 2.814 N/A SER 230.A N SER 227.A OG no hydrogen 3.090 N/A SER 230.A OG SER 227.A O no hydrogen 3.207 N/A MET 236.A N TYR 233.A O no hydrogen 3.170 N/A PHE 242.A N ASP 239.A OD1 no hydrogen 2.897 N/A TYR 243.A N ASP 239.A O no hydrogen 3.375 N/A LYS 244.A N SER 240.A O no hydrogen 3.137 N/A MET 245.A N LYS 241.A O no hydrogen 3.080 N/A ILE 246.A N PHE 242.A O no hydrogen 3.237 N/A LYS 247.A N TYR 243.A O no hydrogen 3.140 N/A GLU 248.A N LYS 244.A O no hydrogen 2.970 N/A GLU 248.A N MET 245.A O no hydrogen 3.260 N/A GLY 249.A N ILE 246.A O no hydrogen 3.265 N/A PHE 250.A N MET 245.A O no hydrogen 2.857 N/A ARG 251.A NE TRP 270.A O no hydrogen 2.734 N/A ARG 251.A NH1 ILE 246.A O no hydrogen 2.941 N/A ARG 251.A NH1 PHE 250.A O no hydrogen 2.871 N/A ARG 251.A NH2 TRP 270.A O no hydrogen 3.394 N/A TYR 257.A N PHE 226.A O no hydrogen 3.047 N/A ALA 258.A N PRO 255.A O no hydrogen 3.288 N/A MET 262.A N PRO 259.A O no hydrogen 2.949 N/A TYR 263.A N PRO 259.A O no hydrogen 3.191 N/A TYR 263.A OH MET 252.A O no hydrogen 2.916 N/A ASP 264.A N ALA 260.A O no hydrogen 3.108 N/A MET 266.A N MET 262.A O no hydrogen 3.040 N/A LYS 267.A N TYR 263.A O no hydrogen 2.916 N/A LYS 267.A NZ ASP 264.A OD1 no hydrogen 3.473 N/A THR 268.A N ASP 264.A O no hydrogen 3.214 N/A THR 268.A OG1 ASP 264.A O no hydrogen 3.468 N/A THR 268.A OG1 ILE 265.A O no hydrogen 2.661 N/A CYS 269.A N ILE 265.A O no hydrogen 3.009 N/A CYS 269.A SG VAL 215.A O no hydrogen 3.577 N/A CYS 269.A SG ILE 265.A O no hydrogen 3.418 N/A TRP 270.A N MET 266.A O no hydrogen 3.056 N/A ASP 271.A N THR 268.A O no hydrogen 3.183 N/A ASP 273.A N ASP 271.A OD1 no hydrogen 3.000 N/A ASP 275.A N ASP 273.A OD1 no hydrogen 3.079 N/A LYS 276.A N ASP 273.A O no hydrogen 2.988 N/A LYS 276.A NZ ASP 273.A OD2 no hydrogen 3.315 N/A ARG 277.A N PRO 274.A O no hydrogen 3.270 N/A ARG 277.A NE ASP 271.A O no hydrogen 2.813 N/A ARG 277.A NH1 GLU 202.A OE1 no hydrogen 3.337 N/A ARG 277.A NH1 GLU 202.A OE2 no hydrogen 2.829 N/A ARG 277.A NH1 GLU 212.A O no hydrogen 2.883 N/A ARG 277.A NH2 GLU 202.A OE1 no hydrogen 2.901 N/A ARG 277.A NH2 ASP 271.A O no hydrogen 3.084 N/A THR 279.A N GLN 282.A OE1 no hydrogen 2.991 N/A GLN 282.A N THR 279.A OG1 no hydrogen 3.041 N/A ILE 283.A N THR 279.A O no hydrogen 3.145 N/A VAL 284.A N PHE 280.A O no hydrogen 2.958 N/A GLN 285.A N LYS 281.A O no hydrogen 3.132 N/A ASP 286.A N GLN 282.A O no hydrogen 2.853 N/A ILE 287.A N ILE 283.A O no hydrogen 2.901 N/A GLU 288.A N VAL 284.A O no hydrogen 2.921 N/A LYS 289.A N GLN 285.A O no hydrogen 3.263 N/A LYS 289.A NZ GLU 293.A OE1 no hydrogen 3.563 N/A GLN 290.A N ASP 286.A O no hydrogen 3.310 N/A GLN 290.A NE2 ASP 286.A OD1 no hydrogen 2.787 N/A ILE 291.A N ILE 287.A O no hydrogen 2.829 N/A SER 292.A N GLU 288.A O no hydrogen 2.942 N/A SER 292.A OG LYS 289.A O no hydrogen 2.966 N/A GLU 293.A N LYS 289.A O no hydrogen 3.126 N/A SER 294.A N ILE 291.A O no hydrogen 3.184 N/A SER 294.A OG GLN 290.A O no hydrogen 3.092 N/A SER 294.A OG ILE 291.A O no hydrogen 3.360 N/A