Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l42_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 7.A N ARG 4.A O no hydrogen 2.777 N/A CYS 7.A SG LYS 2.A O no hydrogen 3.663 N/A CYS 7.A SG THR 29.A OG1 no hydrogen 3.742 N/A PHE 8.A N PRO 5.A O no hydrogen 3.010 N/A GLU 9.A N ARG 26.A O no hydrogen 2.668 N/A LEU 11.A N GLN 24.A O no hydrogen 2.682 N/A ARG 12.A N GLN 24.A O no hydrogen 3.160 N/A LEU 14.A N VAL 22.A O no hydrogen 2.489 N/A GLY 15.A N VAL 22.A O no hydrogen 3.203 N/A GLY 17.A N GLY 20.A O no hydrogen 2.893 N/A GLY 18.A N GLU 159.A O no hydrogen 3.077 N/A TYR 19.A OH ASP 53.A OD2 no hydrogen 3.130 N/A TYR 19.A OH HIS 168.A NE2 no hydrogen 2.922 N/A LYS 21.A N VAL 41.A O no hydrogen 2.975 N/A VAL 22.A N GLY 15.A O no hydrogen 2.910 N/A PHE 23.A N MET 39.A O no hydrogen 2.842 N/A GLN 24.A N ARG 12.A O no hydrogen 2.584 N/A VAL 25.A N PHE 37.A O no hydrogen 2.989 N/A ARG 26.A N GLU 9.A O no hydrogen 2.811 N/A LYS 27.A N LYS 35.A O no hydrogen 3.045 N/A LYS 27.A NZ THR 29.A O no hydrogen 3.217 N/A LYS 27.A NZ THR 29.A OG1 no hydrogen 2.654 N/A VAL 28.A N CYS 7.A O no hydrogen 2.767 N/A ASN 32.A ND2 TYR 77.A OH no hydrogen 3.450 N/A THR 33.A OG1 VAL 28.A O no hydrogen 2.996 N/A THR 33.A OG1 THR 29.A O no hydrogen 2.628 N/A GLY 34.A N LYS 27.A O no hydrogen 2.815 N/A LYS 35.A N ASN 32.A O no hydrogen 3.301 N/A PHE 37.A N VAL 25.A O no hydrogen 2.974 N/A ALA 38.A N LEU 89.A O no hydrogen 2.892 N/A MET 39.A N PHE 23.A O no hydrogen 2.831 N/A LYS 40.A N LEU 87.A O no hydrogen 2.732 N/A LYS 40.A NZ GLU 60.A OE1 no hydrogen 2.561 N/A VAL 41.A N LYS 21.A O no hydrogen 2.902 N/A LEU 42.A N LEU 85.A O no hydrogen 2.979 N/A LYS 43.A N TYR 19.A O no hydrogen 2.785 N/A LYS 44.A N GLY 83.A O no hydrogen 3.002 N/A LYS 44.A NZ GLN 80.A OE1 no hydrogen 2.889 N/A LYS 44.A NZ THR 81.A O no hydrogen 2.394 N/A ILE 47.A N LYS 44.A O no hydrogen 3.120 N/A VAL 48.A N LYS 44.A O no hydrogen 2.865 N/A ASN 50.A N ILE 47.A O no hydrogen 3.095 N/A THR 54.A N ASN 50.A O no hydrogen 2.807 N/A THR 54.A OG1 ILE 47.A O no hydrogen 2.410 N/A THR 54.A OG1 ASN 50.A O no hydrogen 2.861 N/A ALA 55.A N ALA 51.A O no hydrogen 2.881 N/A HIS 56.A N LYS 52.A O no hydrogen 2.812 N/A HIS 56.A NE2 PHE 154.A O no hydrogen 3.048 N/A THR 57.A N ASP 53.A O no hydrogen 2.885 N/A THR 57.A OG1 ASP 53.A O no hydrogen 3.336 N/A LYS 58.A N THR 54.A O no hydrogen 2.975 N/A ALA 59.A N ALA 55.A O no hydrogen 2.894 N/A GLU 60.A N HIS 56.A O no hydrogen 2.891 N/A ARG 61.A N THR 57.A O no hydrogen 3.238 N/A ARG 61.A NE PHE 293.A O no hydrogen 3.166 N/A ARG 61.A NH2 PHE 293.A O no hydrogen 2.511 N/A ASN 62.A N LYS 58.A O no hydrogen 2.990 N/A ILE 63.A N ALA 59.A O no hydrogen 2.908 N/A LEU 64.A N GLU 60.A O no hydrogen 3.123 N/A GLU 65.A N ASN 62.A O no hydrogen 2.997 N/A GLU 66.A N ASN 62.A O no hydrogen 2.623 N/A LYS 68.A NZ TYR 295.A OH no hydrogen 3.343 N/A ILE 72.A N HIS 69.A O no hydrogen 3.156 N/A VAL 73.A N LEU 151.A O no hydrogen 3.210 N/A ASP 74.A N GLU 90.A OE1 no hydrogen 3.033 N/A ILE 76.A N ILE 88.A O no hydrogen 2.659 N/A TYR 77.A N ILE 88.A O no hydrogen 3.137 N/A ALA 78.A N TYR 295.A O no hydrogen 2.991 N/A PHE 79.A N TYR 86.A O no hydrogen 3.006 N/A GLN 80.A NE2 PHE 290.A O no hydrogen 2.660 N/A GLN 80.A NE2 GLU 294.A OE2 no hydrogen 2.901 N/A THR 81.A N LYS 84.A O no hydrogen 2.889 N/A LEU 85.A N LEU 42.A O no hydrogen 3.124 N/A TYR 86.A N PHE 79.A O no hydrogen 2.658 N/A LEU 87.A N LYS 40.A O no hydrogen 2.867 N/A ILE 88.A N TYR 77.A O no hydrogen 2.738 N/A LEU 89.A N ALA 38.A O no hydrogen 2.935 N/A GLU 90.A N ASP 74.A O no hydrogen 3.128 N/A GLY 94.A N LEU 143.A O no hydrogen 2.828 N/A LEU 97.A N ILE 141.A O no hydrogen 2.946 N/A PHE 98.A N PRO 138.A O no hydrogen 2.897 N/A LEU 101.A N LEU 97.A O no hydrogen 3.216 N/A GLU 102.A N PHE 98.A O no hydrogen 2.866 N/A ARG 103.A N MET 99.A O no hydrogen 3.273 N/A ARG 103.A NH2 GLU 104.A OE2 no hydrogen 3.463 N/A GLU 104.A N GLN 100.A O no hydrogen 2.937 N/A GLY 105.A N LEU 101.A O no hydrogen 2.769 N/A PHE 107.A N MET 203.A O no hydrogen 2.964 N/A ALA 112.A N MET 108.A O no hydrogen 2.831 N/A CYS 113.A N GLU 109.A O no hydrogen 2.575 N/A CYS 113.A SG PHE 268.A O no hydrogen 3.471 N/A PHE 114.A N ASP 110.A O no hydrogen 3.141 N/A TYR 115.A N THR 111.A O no hydrogen 3.372 N/A LEU 116.A N ALA 112.A O no hydrogen 3.037 N/A ALA 117.A N CYS 113.A O no hydrogen 2.833 N/A ALA 117.A N PHE 114.A O no hydrogen 3.174 N/A GLU 118.A N PHE 114.A O no hydrogen 3.079 N/A ILE 119.A N TYR 115.A O no hydrogen 2.949 N/A SER 120.A N LEU 116.A O no hydrogen 2.753 N/A SER 120.A OG ALA 117.A O no hydrogen 2.565 N/A MET 121.A N ALA 117.A O no hydrogen 3.094 N/A ALA 122.A N GLU 118.A O no hydrogen 3.047 N/A LEU 123.A N ILE 119.A O no hydrogen 2.974 N/A GLY 124.A N SER 120.A O no hydrogen 2.997 N/A HIS 125.A N MET 121.A O no hydrogen 2.984 N/A LEU 126.A N ALA 122.A O no hydrogen 3.139 N/A HIS 127.A N LEU 123.A O no hydrogen 2.874 N/A HIS 127.A ND1 ASP 259.A OD1 no hydrogen 2.764 N/A HIS 127.A NE2 ASP 192.A OD2 no hydrogen 2.410 N/A GLN 128.A N GLY 124.A O no hydrogen 3.093 N/A LYS 129.A N HIS 125.A O no hydrogen 3.212 N/A LYS 129.A N LEU 126.A O no hydrogen 2.937 N/A GLY 130.A N HIS 127.A O no hydrogen 2.831 N/A ILE 131.A N LEU 126.A O no hydrogen 2.659 N/A TYR 133.A N ASP 192.A OD2 no hydrogen 3.371 N/A TYR 133.A OH ASN 140.A O no hydrogen 3.121 N/A ARG 134.A N ASP 192.A OD1 no hydrogen 3.078 N/A ARG 134.A NE HIS 187.A NE2 no hydrogen 3.168 N/A ASP 135.A N TYR 133.A O no hydrogen 3.009 N/A ASN 140.A N LYS 137.A O no hydrogen 3.011 N/A MET 142.A N LYS 150.A O no hydrogen 3.090 N/A LEU 143.A N GLY 95.A O no hydrogen 2.897 N/A ASN 144.A N HIS 148.A O no hydrogen 2.886 N/A GLY 147.A N ASN 144.A O no hydrogen 3.194 N/A HIS 148.A N ASN 144.A OD1 no hydrogen 2.754 N/A HIS 148.A ND1 GLU 118.A OE2 no hydrogen 2.657 N/A VAL 149.A N GLU 118.A OE1 no hydrogen 3.030 N/A LYS 150.A N MET 142.A O no hydrogen 2.584 N/A LYS 150.A NZ HIS 69.A O no hydrogen 3.547 N/A LYS 150.A NZ PRO 70.A O no hydrogen 3.202 N/A LYS 150.A NZ ILE 72.A O no hydrogen 3.505 N/A LYS 150.A NZ ASP 74.A OD2 no hydrogen 3.417 N/A LEU 151.A N PHE 71.A O no hydrogen 2.677 N/A THR 152.A N TYR 133.A OH no hydrogen 3.126 N/A THR 152.A N ASN 140.A O no hydrogen 3.183 N/A CYS 157.A SG HIS 162.A ND1 no hydrogen 3.567 N/A LYS 158.A NZ GLU 159.A OE1 no hydrogen 3.201 N/A THR 167.A N THR 165.A O no hydrogen 2.518 N/A HIS 168.A ND1 HIS 162.A ND1 no hydrogen 3.048 N/A CYS 171.A SG HIS 162.A ND1 no hydrogen 3.449 N/A CYS 171.A SG HIS 168.A ND1 no hydrogen 3.353 N/A GLU 175.A N THR 173.A OG1 no hydrogen 3.196 N/A TYR 176.A OH ASP 202.A OD2 no hydrogen 2.720 N/A MET 177.A N ILE 174.A O no hydrogen 2.920 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.558 N/A ILE 181.A N ALA 178.A O no hydrogen 3.139 N/A LEU 182.A N PRO 179.A O no hydrogen 2.730 N/A MET 183.A N PRO 179.A O no hydrogen 3.120 N/A MET 183.A N GLU 180.A O no hydrogen 3.129 N/A ARG 184.A N ILE 181.A O no hydrogen 3.382 N/A SER 185.A OG SER 185.A O no hydrogen 2.224 N/A GLY 186.A N ARG 184.A O no hydrogen 2.845 N/A ARG 189.A NH1 GLY 254.A O no hydrogen 2.805 N/A ARG 189.A NH1 GLY 256.A O no hydrogen 2.945 N/A ARG 189.A NH1 ASP 259.A OD1 no hydrogen 2.763 N/A ARG 189.A NH2 GLY 256.A O no hydrogen 2.775 N/A VAL 191.A N ASN 188.A O no hydrogen 3.007 N/A ASP 192.A N ARG 189.A O no hydrogen 3.038 N/A TRP 193.A NE1 ASP 259.A OD1 no hydrogen 3.066 N/A TRP 194.A N ALA 190.A O no hydrogen 3.174 N/A SER 195.A N VAL 191.A O no hydrogen 3.076 N/A SER 195.A OG TYR 176.A O no hydrogen 2.506 N/A LEU 196.A N ASP 192.A O no hydrogen 2.808 N/A GLY 197.A N TRP 193.A O no hydrogen 3.026 N/A ALA 198.A N TRP 194.A O no hydrogen 2.893 N/A LEU 199.A N SER 195.A O no hydrogen 2.757 N/A MET 200.A N LEU 196.A O no hydrogen 2.829 N/A TYR 201.A N GLY 197.A O no hydrogen 2.879 N/A TYR 201.A OH ASN 228.A O no hydrogen 2.721 N/A ASP 202.A N ALA 198.A O no hydrogen 3.160 N/A MET 203.A N LEU 199.A O no hydrogen 2.854 N/A LEU 204.A N MET 200.A O no hydrogen 2.864 N/A THR 205.A N TYR 201.A O no hydrogen 2.821 N/A THR 205.A OG1 TYR 201.A O no hydrogen 3.097 N/A GLY 206.A N ASP 202.A O no hydrogen 2.696 N/A ALA 207.A N THR 205.A OG1 no hydrogen 3.346 N/A THR 211.A OG1 GLU 175.A OE2 no hydrogen 2.919 N/A GLY 212.A N THR 218.A OG1 no hydrogen 3.023 N/A ARG 215.A NH1 GLY 172.A O no hydrogen 2.911 N/A ARG 215.A NH2 PHE 170.A O no hydrogen 2.648 N/A LYS 217.A N ASN 214.A OD1 no hydrogen 3.486 N/A THR 218.A N ASN 214.A O no hydrogen 2.534 N/A THR 218.A OG1 ASN 214.A O no hydrogen 2.390 N/A ILE 219.A N ARG 215.A O no hydrogen 2.906 N/A ASP 220.A N LYS 216.A O no hydrogen 2.994 N/A LYS 221.A N LYS 217.A O no hydrogen 3.150 N/A LYS 221.A NZ THR 211.A O no hydrogen 2.810 N/A ILE 222.A N THR 218.A O no hydrogen 3.178 N/A LEU 223.A N ILE 219.A O no hydrogen 3.214 N/A LYS 224.A N ASP 220.A O no hydrogen 2.996 N/A CYS 225.A N LYS 221.A O no hydrogen 2.752 N/A CYS 225.A SG LEU 245.A O no hydrogen 3.300 N/A LEU 233.A N PRO 230.A O no hydrogen 3.427 N/A THR 234.A OG1 GLU 109.A OE1 no hydrogen 2.974 N/A THR 234.A OG1 GLU 109.A OE2 no hydrogen 2.699 N/A THR 234.A OG1 GLU 236.A OE1 no hydrogen 2.984 N/A ALA 237.A N THR 234.A OG1 no hydrogen 3.244 N/A ARG 238.A N THR 234.A O no hydrogen 2.874 N/A ARG 238.A NH1 LEU 229.A O no hydrogen 3.527 N/A ASP 239.A N GLN 235.A O no hydrogen 2.755 N/A LEU 240.A N GLU 236.A O no hydrogen 2.671 N/A LEU 241.A N ALA 237.A O no hydrogen 2.950 N/A LYS 242.A N ARG 238.A O no hydrogen 3.021 N/A LYS 243.A N ASP 239.A O no hydrogen 3.116 N/A LYS 243.A N LEU 240.A O no hydrogen 2.917 N/A LYS 243.A NZ ASP 239.A OD1 no hydrogen 3.508 N/A LYS 243.A NZ ASP 239.A OD2 no hydrogen 3.041 N/A LEU 244.A N LEU 240.A O no hydrogen 2.888 N/A LEU 245.A N LEU 241.A O no hydrogen 2.945 N/A SER 251.A N ASN 248.A O no hydrogen 3.246 N/A SER 251.A OG ASN 248.A O no hydrogen 3.074 N/A ARG 252.A N ASN 248.A O no hydrogen 3.326 N/A ARG 252.A N ALA 249.A O no hydrogen 3.095 N/A ARG 252.A NE LYS 246.A O no hydrogen 2.808 N/A ARG 252.A NH1 GLU 180.A OE2 no hydrogen 2.678 N/A ARG 252.A NH1 ALA 190.A O no hydrogen 3.162 N/A ARG 252.A NH2 GLU 180.A OE1 no hydrogen 2.901 N/A ARG 252.A NH2 GLU 180.A OE2 no hydrogen 2.935 N/A ARG 252.A NH2 LYS 246.A O no hydrogen 3.257 N/A ARG 252.A NH2 ARG 247.A O no hydrogen 3.233 N/A LEU 253.A N LYS 243.A O no hydrogen 2.949 N/A GLY 254.A N GLU 262.A OE2 no hydrogen 3.001 N/A ALA 255.A N ARG 252.A O no hydrogen 2.960 N/A GLY 258.A N GLU 262.A OE1 no hydrogen 3.056 N/A ASP 259.A N GLY 256.A O no hydrogen 3.062 N/A GLY 261.A N GLY 258.A O no hydrogen 2.950 N/A GLN 264.A N ALA 260.A O no hydrogen 2.707 N/A GLN 264.A NE2 SER 120.A OG no hydrogen 3.027 N/A ALA 265.A N GLY 261.A O no hydrogen 2.830 N/A HIS 266.A NE2 ASP 239.A OD2 no hydrogen 2.608 N/A PHE 268.A N HIS 266.A ND1 no hydrogen 2.731 N/A PHE 269.A N HIS 266.A O no hydrogen 2.712 N/A ARG 270.A N PRO 267.A O no hydrogen 3.201 N/A ARG 270.A NE HIS 271.A NE2 no hydrogen 2.814 N/A ARG 270.A NH2 HIS 271.A NE2 no hydrogen 3.397 N/A ILE 272.A N PHE 269.A O no hydrogen 2.848 N/A ASN 273.A ND2 GLU 276.A OE1 no hydrogen 3.427 N/A LEU 277.A N ASN 273.A O no hydrogen 2.846 N/A LEU 278.A N TRP 274.A O no hydrogen 2.918 N/A ALA 279.A N GLU 275.A O no hydrogen 3.280 N/A ARG 280.A N LEU 277.A O no hydrogen 2.914 N/A LYS 281.A N GLU 276.A O no hydrogen 3.380 N/A GLU 288.A N GLU 288.A OE2 no hydrogen 3.248 N/A TYR 295.A N ALA 78.A O no hydrogen 2.890 N/A TYR 295.A OH TRP 299.A O no hydrogen 2.909 N/A ALA 297.A N ILE 76.A O no hydrogen 3.183 N/A