Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7qra_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NE ASP 23.A OD1 no hydrogen 2.808 N/A ARG 6.A NH1 ASP 23.A OD1 no hydrogen 3.058 N/A ARG 6.A NH1 ASP 23.A OD2 no hydrogen 2.618 N/A TYR 7.A N VAL 3.A O no hydrogen 3.029 N/A ARG 8.A N THR 22.A O no hydrogen 2.988 N/A LEU 9.A N LEU 1.A O no hydrogen 3.233 N/A GLY 10.A N LEU 20.A O no hydrogen 2.665 N/A ILE 13.A N ILE 18.A O no hydrogen 2.642 N/A ILE 18.A N GLY 14.A O no hydrogen 3.365 N/A TYR 19.A N ILE 32.A O no hydrogen 2.725 N/A LEU 20.A N ARG 11.A O no hydrogen 3.138 N/A GLY 21.A N VAL 30.A O no hydrogen 3.042 N/A THR 22.A N ARG 8.A O no hydrogen 3.027 N/A THR 22.A OG1 GLU 29.A OE2 no hydrogen 2.918 N/A ASP 23.A N GLU 28.A O no hydrogen 2.725 N/A ILE 24.A N ARG 6.A O no hydrogen 3.014 N/A ALA 25.A N ASP 23.A OD1 no hydrogen 3.201 N/A ALA 26.A N ASP 23.A OD1 no hydrogen 3.256 N/A GLY 27.A N ASP 23.A O no hydrogen 2.762 N/A GLU 28.A N ASP 23.A O no hydrogen 3.391 N/A VAL 30.A N GLY 21.A O no hydrogen 3.029 N/A ALA 31.A N MET 77.A O no hydrogen 2.762 N/A ILE 32.A N TYR 19.A O no hydrogen 2.853 N/A LYS 33.A N MET 75.A O no hydrogen 2.901 N/A LYS 33.A NZ GLU 47.A OE1 no hydrogen 2.784 N/A LEU 34.A N ASP 17.A O no hydrogen 3.276 N/A GLU 35.A N ASN 73.A O no hydrogen 2.917 N/A VAL 37.A N ASP 71.A O no hydrogen 3.011 N/A GLN 43.A N GLU 35.A OE2 no hydrogen 2.890 N/A LEU 44.A N GLU 35.A OE2 no hydrogen 3.125 N/A GLU 47.A N GLN 43.A O no hydrogen 2.881 N/A SER 48.A N LEU 44.A O no hydrogen 2.774 N/A SER 48.A OG LEU 44.A O no hydrogen 3.458 N/A SER 48.A OG HIS 45.A O no hydrogen 2.735 N/A LYS 49.A N HIS 45.A O no hydrogen 3.122 N/A ILE 50.A N ILE 46.A O no hydrogen 3.381 N/A TYR 51.A N GLU 47.A O no hydrogen 2.922 N/A LYS 52.A N SER 48.A O no hydrogen 2.913 N/A MET 53.A N LYS 49.A O no hydrogen 3.146 N/A MET 54.A N ILE 50.A O no hydrogen 3.038 N/A GLN 55.A N LYS 52.A O no hydrogen 3.223 N/A GLN 55.A NE2 TYR 51.A O no hydrogen 2.908 N/A GLN 55.A NE2 PRO 61.A O no hydrogen 2.879 N/A GLY 57.A N MET 54.A O no hydrogen 3.340 N/A ILE 60.A N GLY 57.A O no hydrogen 3.193 N/A ILE 63.A N GLN 55.A OE1 no hydrogen 2.825 N/A ARG 64.A N VAL 76.A O no hydrogen 2.631 N/A TRP 65.A N VAL 76.A O no hydrogen 3.418 N/A GLY 67.A N VAL 74.A O no hydrogen 3.128 N/A GLU 69.A N TYR 72.A O no hydrogen 3.005 N/A TYR 72.A N GLU 69.A O no hydrogen 3.009 N/A ASN 73.A N GLU 35.A O no hydrogen 2.626 N/A VAL 74.A N GLY 67.A O no hydrogen 2.987 N/A MET 75.A N LYS 33.A O no hydrogen 3.046 N/A VAL 76.A N TRP 65.A O no hydrogen 2.765 N/A MET 77.A N ALA 31.A O no hydrogen 2.848 N/A GLU 78.A N THR 62.A O no hydrogen 3.216 N/A GLY 81.A N MET 131.A O no hydrogen 2.770 N/A SER 83.A N ASP 86.A OD2 no hydrogen 3.233 N/A LEU 84.A N PRO 126.A O no hydrogen 3.253 N/A LEU 84.A N PHE 129.A O no hydrogen 2.953 N/A ASP 86.A N SER 83.A OG no hydrogen 2.975 N/A LEU 87.A N SER 83.A O no hydrogen 2.939 N/A PHE 88.A N LEU 84.A O no hydrogen 2.709 N/A ASN 89.A N GLU 85.A O no hydrogen 2.834 N/A PHE 90.A N ASP 86.A O no hydrogen 2.913 N/A CYS 91.A N PHE 88.A O no hydrogen 3.117 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.305 N/A SER 92.A N ASN 89.A O no hydrogen 3.145 N/A ARG 93.A N PHE 88.A O no hydrogen 2.860 N/A ARG 93.A NH1 GLU 85.A OE2 no hydrogen 2.977 N/A ARG 93.A NH1 ASN 89.A OD1 no hydrogen 2.570 N/A ARG 93.A NH2 TYR 200.A OH no hydrogen 2.472 N/A ARG 93.A NH2 GLY 204.A O no hydrogen 3.401 N/A SER 96.A N ASP 284.A OD2 no hydrogen 2.778 N/A SER 96.A OG ASP 284.A OD1 no hydrogen 2.905 N/A SER 96.A OG ASP 284.A OD2 no hydrogen 3.479 N/A LYS 98.A NZ SER 278.A O no hydrogen 3.559 N/A LYS 98.A NZ ASP 280.A OD1 no hydrogen 2.819 N/A LYS 98.A NZ ASP 280.A OD2 no hydrogen 3.498 N/A THR 99.A N SER 96.A OG no hydrogen 3.294 N/A VAL 100.A N SER 96.A O no hydrogen 3.159 N/A LEU 101.A N LEU 97.A O no hydrogen 2.977 N/A LEU 102.A N LYS 98.A O no hydrogen 2.916 N/A LEU 103.A N THR 99.A O no hydrogen 2.959 N/A ALA 104.A N VAL 100.A O no hydrogen 2.818 N/A ASP 105.A N LEU 101.A O no hydrogen 3.245 N/A GLN 106.A NE2 ASN 138.A O no hydrogen 2.864 N/A MET 107.A N LEU 103.A O no hydrogen 2.810 N/A ILE 108.A N ALA 104.A O no hydrogen 3.071 N/A SER 109.A N ASP 105.A O no hydrogen 3.476 N/A SER 109.A OG ASP 105.A O no hydrogen 3.215 N/A ARG 110.A N GLN 106.A O no hydrogen 3.047 N/A ARG 110.A NE VAL 140.A O no hydrogen 2.755 N/A ARG 110.A NH2 VAL 140.A O no hydrogen 3.092 N/A ILE 111.A N MET 107.A O no hydrogen 3.348 N/A GLU 112.A N ILE 108.A O no hydrogen 2.991 N/A TYR 113.A N SER 109.A O no hydrogen 3.029 N/A TYR 113.A OH MET 54.A O no hydrogen 2.825 N/A ILE 114.A N ARG 110.A O no hydrogen 2.992 N/A HIS 115.A N ILE 111.A O no hydrogen 3.008 N/A HIS 115.A ND1 TYR 261.A OH no hydrogen 2.757 N/A HIS 115.A NE2 ASP 190.A OD2 no hydrogen 2.604 N/A SER 116.A N GLU 112.A O no hydrogen 2.936 N/A SER 116.A OG TYR 113.A O no hydrogen 2.543 N/A LYS 117.A N TYR 113.A O no hydrogen 3.221 N/A LYS 117.A N ILE 114.A O no hydrogen 2.997 N/A ASN 118.A N HIS 115.A O no hydrogen 3.016 N/A PHE 119.A N ILE 114.A O no hydrogen 3.351 N/A ILE 120.A N LYS 149.A O no hydrogen 2.973 N/A HIS 121.A N ASP 190.A OD2 no hydrogen 3.030 N/A HIS 121.A NE2 ILE 143.A O no hydrogen 2.945 N/A ARG 122.A N ASP 190.A OD1 no hydrogen 3.004 N/A ARG 122.A NE LEU 147.A O no hydrogen 2.918 N/A ARG 122.A NH2 LEU 147.A O no hydrogen 3.071 N/A ASP 123.A N HIS 121.A ND1 no hydrogen 3.293 N/A LYS 125.A NZ ASP 123.A OD1 no hydrogen 3.378 N/A LYS 125.A NZ ASP 123.A OD2 no hydrogen 2.744 N/A ASN 128.A N LYS 125.A O no hydrogen 3.088 N/A ASN 128.A ND2 ASP 123.A O no hydrogen 2.881 N/A ASN 128.A ND2 ASP 123.A OD2 no hydrogen 3.224 N/A ASN 128.A ND2 ASP 144.A OD2 no hydrogen 3.530 N/A PHE 129.A N PRO 126.A O no hydrogen 3.499 N/A LEU 130.A N TYR 141.A O no hydrogen 2.977 N/A MET 131.A N PRO 82.A O no hydrogen 3.068 N/A GLY 132.A N LEU 139.A O no hydrogen 3.029 N/A LYS 136.A N LEU 133.A O no hydrogen 2.971 N/A GLY 137.A N GLY 134.A O no hydrogen 3.310 N/A ASN 138.A N ASN 138.A OD1 no hydrogen 2.647 N/A LEU 139.A N LYS 136.A O no hydrogen 3.120 N/A VAL 140.A N GLN 106.A OE1 no hydrogen 2.825 N/A TYR 141.A N LEU 130.A O no hydrogen 2.813 N/A ILE 142.A N GLY 59.A O no hydrogen 3.027 N/A ILE 143.A N ASN 128.A O no hydrogen 2.996 N/A ASP 144.A N TYR 51.A OH no hydrogen 2.910 N/A PHE 145.A N GLU 47.A OE2 no hydrogen 2.989 N/A GLY 146.A N ASP 144.A OD1 no hydrogen 3.234 N/A ALA 148.A N PHE 145.A O no hydrogen 3.446 N/A LYS 149.A N ILE 120.A O no hydrogen 3.192 N/A LYS 149.A NZ GLU 184.A OE2 no hydrogen 3.162 N/A TYR 151.A N ASN 118.A O no hydrogen 3.136 N/A TYR 151.A OH HIS 115.A O no hydrogen 2.714 N/A ARG 152.A NE ASN 118.A OD1 no hydrogen 2.792 N/A ARG 152.A NH2 SER 116.A O no hydrogen 3.505 N/A ARG 152.A NH2 ASN 118.A OD1 no hydrogen 3.055 N/A ASP 153.A N GLN 158.A O no hydrogen 3.105 N/A ARG 155.A N ASP 153.A OD1 no hydrogen 2.703 N/A THR 156.A N ASP 153.A OD1 no hydrogen 3.092 N/A HIS 157.A N ASP 153.A O no hydrogen 2.816 N/A ILE 160.A N TYR 151.A O no hydrogen 2.907 N/A LYS 166.A N GLY 182.A O no hydrogen 3.142 N/A LYS 166.A NZ GLU 184.A OE1 no hydrogen 3.353 N/A ASN 167.A N ASN 167.A OD1 no hydrogen 2.490 N/A THR 171.A OG1 ASP 123.A OD1 no hydrogen 2.869 N/A ARG 173.A NH1 TYR 174.A OH no hydrogen 3.259 N/A TYR 174.A N THR 171.A O no hydrogen 3.430 N/A ALA 175.A N ALA 172.A O no hydrogen 3.394 N/A SER 176.A OG THR 179.A OG1 no hydrogen 3.195 N/A SER 176.A OG ASP 189.A OD1 no hydrogen 2.702 N/A ILE 177.A N GLU 192.A OE2 no hydrogen 3.256 N/A THR 179.A N SER 176.A OG no hydrogen 2.948 N/A THR 179.A OG1 SER 176.A OG no hydrogen 3.195 N/A HIS 180.A N SER 176.A O no hydrogen 3.044 N/A LEU 181.A N ILE 177.A O no hydrogen 2.956 N/A GLY 182.A N THR 179.A O no hydrogen 2.883 N/A ILE 183.A N ASN 178.A O no hydrogen 2.990 N/A GLU 184.A N ARG 163.A O no hydrogen 3.125 N/A SER 186.A N ASP 189.A OD2 no hydrogen 2.674 N/A SER 186.A OG PHE 255.A O no hydrogen 2.672 N/A ARG 188.A NH1 LEU 253.A O no hydrogen 3.000 N/A ASP 189.A N SER 186.A O no hydrogen 2.968 N/A LEU 191.A N ARG 187.A O no hydrogen 3.469 N/A GLU 192.A N ARG 188.A O no hydrogen 2.888 N/A SER 193.A N ASP 189.A O no hydrogen 3.081 N/A SER 193.A OG TYR 174.A O no hydrogen 2.376 N/A SER 193.A OG ASP 189.A O no hydrogen 3.403 N/A LEU 194.A N ASP 190.A O no hydrogen 3.127 N/A GLY 195.A N LEU 191.A O no hydrogen 3.001 N/A TYR 196.A N GLU 192.A O no hydrogen 3.114 N/A TYR 196.A OH GLU 192.A OE2 no hydrogen 2.544 N/A VAL 197.A N SER 193.A O no hydrogen 2.985 N/A LEU 198.A N LEU 194.A O no hydrogen 2.945 N/A MET 199.A N GLY 195.A O no hydrogen 3.308 N/A TYR 200.A N TYR 196.A O no hydrogen 2.950 N/A TYR 200.A OH GLU 85.A OE1 no hydrogen 2.805 N/A TYR 200.A OH GLU 85.A OE2 no hydrogen 3.027 N/A PHE 201.A N VAL 197.A O no hydrogen 3.083 N/A ASN 202.A N LEU 198.A O no hydrogen 3.151 N/A LEU 203.A N MET 199.A O no hydrogen 2.813 N/A GLY 204.A N TYR 200.A O no hydrogen 2.801 N/A LEU 206.A N GLN 209.A OE1 no hydrogen 2.969 N/A TRP 208.A NE1 ARG 173.A O no hydrogen 2.827 N/A GLN 209.A N LEU 206.A O no hydrogen 2.872 N/A GLN 218.A N THR 215.A OG1 no hydrogen 3.258 N/A TYR 220.A N LYS 216.A O no hydrogen 3.075 N/A GLU 221.A N ARG 217.A O no hydrogen 3.234 N/A ARG 222.A N GLN 218.A O no hydrogen 3.064 N/A ILE 223.A N LYS 219.A O no hydrogen 2.950 N/A SER 224.A N TYR 220.A O no hydrogen 2.941 N/A GLU 225.A N GLU 221.A O no hydrogen 3.072 N/A LYS 226.A N ARG 222.A O no hydrogen 3.094 N/A LYS 227.A N ILE 223.A O no hydrogen 2.919 N/A LYS 227.A NZ ALA 172.A O no hydrogen 2.659 N/A LYS 227.A NZ ARG 173.A O no hydrogen 3.307 N/A LYS 227.A NZ ALA 175.A O no hydrogen 2.538 N/A LYS 227.A NZ HIS 180.A NE2 no hydrogen 2.849 N/A MET 228.A N SER 224.A O no hydrogen 2.998 N/A SER 229.A N GLU 225.A O no hydrogen 2.922 N/A SER 229.A N LYS 226.A O no hydrogen 3.235 N/A SER 229.A OG GLU 225.A O no hydrogen 3.058 N/A SER 229.A OG LYS 226.A O no hydrogen 3.247 N/A THR 230.A N LYS 227.A O no hydrogen 3.282 N/A THR 230.A OG1 LYS 226.A O no hydrogen 2.726 N/A VAL 234.A N PRO 231.A O no hydrogen 2.917 N/A LEU 235.A N PRO 231.A O no hydrogen 2.995 N/A CYS 236.A N ILE 232.A O no hydrogen 3.054 N/A CYS 236.A SG ILE 232.A O no hydrogen 3.539 N/A LYS 237.A N VAL 234.A O no hydrogen 3.239 N/A TYR 239.A N CYS 236.A O no hydrogen 3.097 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.862 N/A PHE 243.A N PRO 240.A O no hydrogen 3.303 N/A ALA 244.A N SER 241.A O no hydrogen 2.808 N/A THR 245.A N SER 241.A O no hydrogen 2.925 N/A THR 245.A OG1 SER 241.A O no hydrogen 3.271 N/A TYR 246.A N GLU 242.A O no hydrogen 2.884 N/A TYR 246.A OH LEU 191.A O no hydrogen 2.756 N/A LEU 247.A N PHE 243.A O no hydrogen 3.222 N/A ASN 248.A N ALA 244.A O no hydrogen 2.912 N/A PHE 249.A N THR 245.A O no hydrogen 3.086 N/A CYS 250.A N TYR 246.A O no hydrogen 3.075 N/A CYS 250.A SG TYR 246.A O no hydrogen 3.385 N/A ARG 251.A N LEU 247.A O no hydrogen 2.983 N/A SER 252.A N PHE 249.A O no hydrogen 3.094 N/A SER 252.A OG ASN 248.A O no hydrogen 3.020 N/A LEU 253.A N CYS 250.A O no hydrogen 3.173 N/A ARG 254.A N ASP 257.A OD2 no hydrogen 2.821 N/A ARG 254.A NE ASP 257.A OD2 no hydrogen 3.169 N/A ARG 254.A NH2 ASP 257.A OD1 no hydrogen 2.941 N/A ASP 257.A N ARG 254.A O no hydrogen 2.990 N/A TYR 261.A OH HIS 115.A ND1 no hydrogen 2.757 N/A TYR 263.A N ASP 260.A OD1 no hydrogen 3.046 N/A LEU 264.A N ASP 260.A O no hydrogen 3.179 N/A ARG 265.A N TYR 261.A O no hydrogen 2.862 N/A ARG 265.A NH1 GLU 112.A OE1 no hydrogen 2.682 N/A ARG 265.A NH2 GLU 112.A OE1 no hydrogen 2.742 N/A GLN 266.A N SER 262.A O no hydrogen 2.884 N/A GLN 266.A NE2 ASN 270.A OD1 no hydrogen 2.578 N/A LEU 267.A N TYR 263.A O no hydrogen 3.060 N/A ARG 269.A N ARG 265.A O no hydrogen 2.941 N/A ASN 270.A N GLN 266.A O no hydrogen 2.951 N/A LEU 271.A N LEU 267.A O no hydrogen 3.324 N/A PHE 272.A N PHE 268.A O no hydrogen 2.830 N/A HIS 273.A N ARG 269.A O no hydrogen 2.957 N/A ARG 274.A N ASN 270.A O no hydrogen 2.923 N/A ARG 274.A NH1 GLU 242.A OE2 no hydrogen 2.473 N/A GLN 275.A N LEU 271.A O no hydrogen 3.049 N/A GLY 276.A N HIS 273.A O no hydrogen 2.959 N/A PHE 277.A N PHE 272.A O no hydrogen 3.262 N/A ASP 280.A N SER 278.A O no hydrogen 2.879 N/A VAL 282.A N ASP 280.A OD1 no hydrogen 3.233 N/A PHE 283.A N ASN 286.A OD1 no hydrogen 2.835 N/A ASP 284.A N THR 99.A OG1 no hydrogen 3.033 N/A ASN 286.A N PHE 283.A O no hydrogen 2.894 N/A MET 287.A N ASP 284.A O no hydrogen 3.183 N/A