Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r4r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N VAL 67.A O no hydrogen 2.853 N/A SER 7.A OG GLN 63.A OE1 no hydrogen 2.978 N/A LEU 8.A N LEU 62.A O no hydrogen 2.707 N/A VAL 9.A N VAL 140.A O no hydrogen 3.004 N/A LEU 10.A N TYR 60.A O no hydrogen 2.816 N/A LEU 11.A N VAL 142.A O no hydrogen 2.990 N/A THR 12.A N SER 58.A O no hydrogen 3.366 N/A THR 12.A OG1 SER 58.A O no hydrogen 3.252 N/A THR 18.A N GLU 21.A OE1 no hydrogen 3.169 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.293 N/A LEU 22.A N THR 18.A O no hydrogen 3.050 N/A LEU 22.A N THR 19.A O no hydrogen 3.229 N/A THR 23.A N GLU 20.A O no hydrogen 2.986 N/A THR 23.A OG1 THR 19.A O no hydrogen 2.801 N/A THR 23.A OG1 GLU 20.A O no hydrogen 3.305 N/A ILE 24.A N TYR 60.A OH no hydrogen 3.319 N/A GLN 25.A N ASN 84.A OD1 no hydrogen 2.663 N/A GLN 25.A NE2 SER 119.A O no hydrogen 2.791 N/A CYS 27.A N PHE 44.A O no hydrogen 3.002 N/A HIS 28.A N VAL 82.A O no hydrogen 2.813 N/A HIS 28.A ND1 ASN 43.A OD1 no hydrogen 2.731 N/A HIS 28.A NE2 TYR 106.A OH no hydrogen 2.554 N/A VAL 29.A N LYS 42.A O no hydrogen 2.886 N/A ALA 30.A N LEU 80.A O no hydrogen 2.922 N/A VAL 31.A N TYR 40.A O no hydrogen 2.763 N/A PHE 32.A N SER 78.A O no hydrogen 2.891 N/A ASP 33.A N LYS 37.A O no hydrogen 2.987 N/A ASP 35.A N ASP 33.A OD1 no hydrogen 3.066 N/A GLY 36.A N ASP 33.A O no hydrogen 3.161 N/A LYS 37.A N ASP 33.A OD1 no hydrogen 2.903 N/A ARG 38.A N THR 97.A O no hydrogen 3.139 N/A ARG 38.A NH1 PHE 93.A O no hydrogen 3.038 N/A ARG 38.A NH1 TYR 106.A OH no hydrogen 2.808 N/A ARG 38.A NH2 ASP 94.A O no hydrogen 2.749 N/A ILE 39.A N VAL 31.A O no hydrogen 2.811 N/A TYR 40.A N VAL 31.A O no hydrogen 3.309 N/A TYR 40.A OH GLU 65.A O no hydrogen 3.197 N/A LYS 42.A N VAL 29.A O no hydrogen 2.934 N/A ASN 43.A ND2 ASP 94.A OD1 no hydrogen 3.001 N/A ASN 43.A ND2 ASP 94.A OD2 no hydrogen 3.518 N/A PHE 44.A N CYS 27.A O no hydrogen 2.883 N/A TYR 45.A N ASP 48.A OD2 no hydrogen 2.798 N/A TYR 45.A OH ASN 87.A O no hydrogen 3.139 N/A TYR 45.A OH ASN 90.A O no hydrogen 3.277 N/A ASP 48.A N TYR 45.A O no hydrogen 2.845 N/A LEU 49.A N TYR 45.A O no hydrogen 3.065 N/A THR 53.A OG1 LEU 57.A O no hydrogen 3.347 N/A ILE 54.A N LEU 57.A O no hydrogen 3.163 N/A LEU 57.A N ILE 54.A O no hydrogen 3.138 N/A SER 58.A N GLY 13.A O no hydrogen 3.313 N/A SER 58.A OG GLY 13.A O no hydrogen 3.462 N/A GLY 59.A N LYS 52.A O no hydrogen 2.955 N/A TYR 60.A N LEU 10.A O no hydrogen 2.985 N/A LEU 62.A N LEU 8.A O no hydrogen 2.787 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.885 N/A GLY 66.A N ASP 6.A OD1 no hydrogen 3.259 N/A VAL 67.A N PHE 5.A O no hydrogen 2.748 N/A THR 69.A N LEU 3.A O no hydrogen 3.039 N/A PHE 70.A N THR 69.A OG1 no hydrogen 2.867 N/A LYS 75.A N LEU 131.A O no hydrogen 3.278 N/A VAL 77.A N THR 129.A O no hydrogen 2.753 N/A SER 78.A N PHE 32.A O no hydrogen 3.071 N/A VAL 79.A N SER 127.A O no hydrogen 2.807 N/A LEU 80.A N ALA 30.A O no hydrogen 2.932 N/A VAL 81.A N GLY 125.A O no hydrogen 2.879 N/A VAL 82.A N HIS 28.A O no hydrogen 2.865 N/A ALA 83.A N LYS 123.A O no hydrogen 2.751 N/A ASN 84.A N ASN 26.A O no hydrogen 2.714 N/A ASN 84.A ND2 THR 23.A O no hydrogen 3.151 N/A ASN 84.A ND2 LEU 121.A O no hydrogen 2.718 N/A ASN 86.A N ASN 26.A OD1 no hydrogen 3.087 N/A ASN 86.A ND2 CYS 27.A O no hydrogen 2.963 N/A ASN 87.A N ASN 90.A O no hydrogen 2.693 N/A SER 91.A N ASP 94.A OD2 no hydrogen 3.343 N/A SER 91.A OG HIS 28.A ND1 no hydrogen 3.168 N/A SER 91.A OG ASN 43.A OD1 no hydrogen 3.401 N/A SER 91.A OG ASP 94.A OD1 no hydrogen 2.734 N/A PHE 93.A N SER 91.A OG no hydrogen 3.095 N/A ASP 94.A N SER 91.A O no hydrogen 3.453 N/A LEU 96.A N PHE 93.A O no hydrogen 3.059 N/A THR 97.A N ASN 104.A O no hydrogen 3.279 N/A TYR 99.A N GLY 36.A O no hydrogen 2.928 N/A SER 105.A OG.A GLY 101.A O no hydrogen 2.843 N/A SER 105.A OG.B THR 98.A O no hydrogen 3.341 N/A SER 105.A OG.B TYR 99.A O no hydrogen 2.454 N/A SER 105.A OG.B THR 107.A OG1 no hydrogen 3.099 N/A TYR 106.A N THR 98.A O no hydrogen 3.352 N/A TYR 106.A OH HIS 28.A NE2 no hydrogen 2.554 N/A THR 107.A N TYR 99.A O no hydrogen 3.055 N/A THR 107.A OG1 TYR 99.A O no hydrogen 3.247 N/A THR 107.A OG1 ASP 100.A OD1 no hydrogen 2.736 N/A THR 107.A OG1 SER 105.A OG.B no hydrogen 3.099 N/A LYS 109.A NZ PRO 92.A O no hydrogen 3.514 N/A ILE 111.A N SER 180.A O no hydrogen 2.928 N/A LEU 120.A N THR 117.A O no hydrogen 3.068 N/A LYS 123.A N ALA 83.A O no hydrogen 3.241 N/A LYS 123.A NZ GLU 21.A O no hydrogen 2.968 N/A LYS 123.A NZ LEU 121.A O no hydrogen 2.803 N/A LYS 123.A NZ GLN 146.A OE1 no hydrogen 2.608 N/A ILE 124.A N ILE 145.A O no hydrogen 2.966 N/A GLY 125.A N VAL 81.A O no hydrogen 3.102 N/A SER 127.A N VAL 79.A O no hydrogen 2.939 N/A SER 127.A OG THR 141.A O no hydrogen 2.876 N/A THR 129.A N VAL 77.A O no hydrogen 2.881 N/A LEU 131.A N LYS 75.A O no hydrogen 2.935 N/A VAL 140.A N SER 7.A O no hydrogen 3.080 N/A VAL 142.A N VAL 9.A O no hydrogen 2.688 N/A LEU 144.A N LEU 11.A O no hydrogen 2.859 N/A ILE 145.A N ILE 124.A O no hydrogen 2.911 N/A GLN 146.A NE2 GLU 21.A O no hydrogen 3.451 N/A LEU 147.A N VAL 122.A O no hydrogen 3.012 N/A ALA 149.A N THR 210.A O no hydrogen 2.848 N/A LYS 150.A N ASN 244.A O no hydrogen 2.929 N/A LYS 150.A NZ TYR 16.A O no hydrogen 3.285 N/A LYS 150.A NZ GLU 21.A OE1 no hydrogen 2.816 N/A LYS 150.A NZ GLU 21.A OE2 no hydrogen 3.350 N/A ILE 151.A N PHE 208.A O no hydrogen 2.853 N/A GLU 152.A N TYR 246.A O no hydrogen 2.813 N/A TYR 153.A N VAL 206.A O no hydrogen 2.907 N/A TYR 153.A OH PHE 168.A O no hydrogen 2.783 N/A THR 154.A N ILE 248.A O no hydrogen 2.853 N/A THR 154.A OG1 ILE 248.A O no hydrogen 3.214 N/A TYR 157.A N GLY 250.A O no hydrogen 2.807 N/A TYR 157.A OH THR 154.A O no hydrogen 2.971 N/A LYS 158.A N GLU 163.A O no hydrogen 2.737 N/A LYS 159.A N LYS 252.A O no hydrogen 3.054 N/A LYS 159.A NZ GLU 258.A OE1 no hydrogen 2.586 N/A ASN 161.A N LYS 158.A O no hydrogen 3.300 N/A GLY 162.A N LYS 158.A O no hydrogen 2.800 N/A GLU 163.A N ASN 161.A OD1 no hydrogen 3.133 N/A LEU 165.A N VAL 156.A O no hydrogen 3.042 N/A THR 171.A N SER 223.A O no hydrogen 2.822 N/A THR 171.A OG1 SER 223.A O no hydrogen 2.685 N/A ALA 174.A N ILE 221.A O no hydrogen 2.934 N/A ASN 177.A N THR 210.A OG1 no hydrogen 2.820 N/A ASN 177.A ND2 ALA 194.A O no hydrogen 2.933 N/A ASN 177.A ND2 GLU 212.A O no hydrogen 2.817 N/A ALA 178.A N SER 196.A O no hydrogen 2.841 N/A SER 179.A N ASN 177.A OD1 no hydrogen 2.822 N/A SER 179.A OG SER 196.A OG no hydrogen 2.717 N/A SER 180.A N ILE 111.A O no hydrogen 2.880 N/A SER 180.A OG LYS 181.A O no hydrogen 2.833 N/A LYS 181.A N ASN 192.A OD1 no hydrogen 2.927 N/A ASN 186.A N GLU 191.A OE1 no hydrogen 2.878 N/A THR 187.A OG1 THR 187.A O no hydrogen 2.600 N/A THR 187.A OG1 LYS 242.A O no hydrogen 3.113 N/A THR 187.A OG1 GLY 243.A O no hydrogen 3.370 N/A SER 188.A N ASN 186.A OD1 no hydrogen 3.073 N/A GLU 191.A N GLU 212.A OE1 no hydrogen 2.847 N/A ASN 192.A N GLU 212.A OE1 no hydrogen 2.989 N/A ASN 192.A ND2 SER 179.A O no hydrogen 2.916 N/A ASN 192.A ND2 GLU 212.A O no hydrogen 3.205 N/A ALA 194.A N ASN 192.A OD1 no hydrogen 3.222 N/A SER 196.A N ASN 177.A OD1 no hydrogen 3.166 N/A SER 196.A OG SER 179.A OG no hydrogen 2.717 N/A LEU 198.A N LEU 176.A O no hydrogen 2.852 N/A TYR 200.A OH PRO 205.A O no hydrogen 2.921 N/A LYS 204.A N PRO 201.A O no hydrogen 3.140 N/A LYS 204.A NZ THR 171.A O no hydrogen 2.692 N/A PHE 208.A N ILE 151.A O no hydrogen 2.873 N/A TYR 209.A OH GLU 21.A OE2 no hydrogen 2.469 N/A THR 210.A N ALA 149.A O no hydrogen 3.385 N/A THR 210.A OG1 TYR 211.A O no hydrogen 2.894 N/A TYR 211.A N ASN 177.A O no hydrogen 3.162 N/A TYR 211.A OH LYS 113.A O no hydrogen 2.737 N/A SER 214.A N ASN 192.A O no hydrogen 3.242 N/A SER 214.A OG.A ASN 192.A O no hydrogen 3.235 N/A SER 214.A OG.B ASN 192.A O no hydrogen 2.663 N/A PHE 217.A N ASP 215.A OD1 no hydrogen 3.027 N/A LYS 218.A N ASP 215.A O no hydrogen 3.493 N/A LYS 218.A NZ ASP 215.A OD2 no hydrogen 3.179 N/A VAL 220.A N PHE 235.A O no hydrogen 3.141 N/A ILE 221.A N ALA 174.A O no hydrogen 2.845 N/A LEU 222.A N TYR 233.A O no hydrogen 2.917 N/A SER 223.A N LYS 172.A O no hydrogen 2.889 N/A VAL 224.A N LYS 231.A O no hydrogen 3.080 N/A GLN 225.A N SER 169.A O no hydrogen 3.078 N/A SER 226.A OG VAL 224.A O no hydrogen 3.274 N/A SER 226.A OG TYR 233.A OH no hydrogen 3.155 N/A LYS 231.A N VAL 224.A O no hydrogen 3.000 N/A TYR 233.A N LEU 222.A O no hydrogen 2.794 N/A TYR 233.A OH SER 226.A OG no hydrogen 3.155 N/A PHE 235.A N VAL 220.A O no hydrogen 2.969 N/A ALA 237.A N LYS 218.A O no hydrogen 3.293 N/A LYS 239.A N PRO 236.A O no hydrogen 3.039 N/A PHE 240.A N ALA 237.A O no hydrogen 3.474 N/A ILE 241.A N TYR 246.A OH no hydrogen 2.922 N/A LYS 242.A N GLU 212.A OE2 no hydrogen 3.218 N/A LYS 242.A NZ ASN 186.A O no hydrogen 2.798 N/A LYS 242.A NZ GLU 191.A OE1 no hydrogen 2.597 N/A LYS 242.A NZ GLU 212.A OE1 no hydrogen 2.987 N/A LYS 242.A NZ GLU 212.A OE2 no hydrogen 2.684 N/A GLY 243.A N SER 148.A O no hydrogen 3.034 N/A ASN 244.A ND2 THR 187.A O no hydrogen 3.086 N/A ASN 244.A ND2 ILE 241.A O no hydrogen 3.136 N/A TYR 245.A N GLU 265.A OE1 no hydrogen 3.040 N/A TYR 245.A N GLU 265.A OE2 no hydrogen 2.835 N/A TYR 245.A OH GLU 152.A OE1 no hydrogen 2.502 N/A TYR 246.A N LYS 150.A O no hydrogen 2.763 N/A ARG 247.A N GLU 262.A O no hydrogen 3.095 N/A ARG 247.A NE TYR 245.A OH no hydrogen 3.410 N/A ARG 247.A NH1 GLU 262.A OE1 no hydrogen 3.340 N/A ILE 248.A N GLU 152.A O no hydrogen 2.864 N/A LYS 249.A N VAL 260.A O no hydrogen 3.162 N/A GLY 250.A N GLY 155.A O no hydrogen 3.057 N/A LEU 251.A N GLU 258.A O no hydrogen 2.918 N/A LYS 252.A N TYR 157.A O no hydrogen 2.823 N/A LYS 252.A NZ SER 254.A OG no hydrogen 2.909 N/A THR 255.A OG1 SER 253.A O no hydrogen 3.256 N/A GLU 258.A N LEU 251.A O no hydrogen 2.875 N/A VAL 260.A N LYS 249.A O no hydrogen 2.755 N/A LEU 261.A N THR 270.A O no hydrogen 2.834 N/A GLU 262.A N ARG 247.A O no hydrogen 2.988 N/A ASN 263.A N GLU 268.A O no hydrogen 2.756 N/A ASN 263.A ND2 ASN 244.A OD1 no hydrogen 3.381 N/A VAL 264.A N TYR 245.A O no hydrogen 2.972 N/A ASP 266.A N ASN 263.A OD1 no hydrogen 3.446 N/A LYS 267.A N VAL 264.A O no hydrogen 3.307 N/A GLU 268.A N ASN 263.A O no hydrogen 3.282 N/A THR 270.A N LEU 261.A O no hydrogen 2.760 N/A