Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aaf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLN 2.A OE1 no hydrogen 2.614 N/A ASP 7.A N ALA 4.A O no hydrogen 3.161 N/A PHE 8.A N LEU 5.A O no hydrogen 3.380 N/A GLU 9.A N ARG 26.A O no hydrogen 2.909 N/A GLY 11.A N LEU 24.A O no hydrogen 2.536 N/A LEU 14.A N VAL 22.A O no hydrogen 2.859 N/A GLY 15.A N VAL 22.A O no hydrogen 3.405 N/A GLY 17.A N GLY 20.A O no hydrogen 3.401 N/A ASN 21.A N VAL 38.A O no hydrogen 3.068 N/A ASN 21.A ND2 TYR 23.A OH no hydrogen 3.285 N/A VAL 22.A N GLY 15.A O no hydrogen 3.151 N/A TYR 23.A N LEU 36.A O no hydrogen 3.139 N/A LEU 24.A N ARG 12.A O no hydrogen 2.798 N/A ALA 25.A N LEU 34.A O no hydrogen 2.908 N/A ARG 26.A N GLU 9.A O no hydrogen 3.164 N/A ARG 26.A NH2 GLU 9.A OE1 no hydrogen 2.483 N/A GLU 27.A N PHE 32.A O no hydrogen 2.978 N/A LYS 28.A N ASP 7.A O no hydrogen 2.951 N/A LYS 28.A NZ GLU 6.A O no hydrogen 2.849 N/A LEU 34.A N ALA 25.A O no hydrogen 2.956 N/A ALA 35.A N LEU 85.A O no hydrogen 2.972 N/A LEU 36.A N TYR 23.A O no hydrogen 2.818 N/A LYS 37.A N LEU 83.A O no hydrogen 2.917 N/A VAL 38.A N ASN 21.A O no hydrogen 2.659 N/A LEU 39.A N VAL 81.A O no hydrogen 2.729 N/A LEU 44.A N PHE 40.A O no hydrogen 3.214 N/A GLU 45.A N LYS 41.A O no hydrogen 3.176 N/A LYS 46.A N ALA 42.A O no hydrogen 3.149 N/A GLY 48.A N GLU 45.A O no hydrogen 3.208 N/A VAL 49.A N LEU 44.A O no hydrogen 3.437 N/A GLN 52.A N VAL 49.A O no hydrogen 3.134 N/A LEU 53.A N VAL 49.A O no hydrogen 3.521 N/A ARG 54.A N GLU 50.A O no hydrogen 3.162 N/A ARG 55.A N HIS 51.A O no hydrogen 2.553 N/A GLU 56.A N GLN 52.A O no hydrogen 2.292 N/A VAL 57.A N LEU 53.A O no hydrogen 3.014 N/A GLU 58.A N ARG 54.A O no hydrogen 2.976 N/A ILE 59.A N ARG 55.A O no hydrogen 2.911 N/A GLN 60.A N GLU 56.A O no hydrogen 3.023 N/A GLN 60.A NE2 LEU 69.A O no hydrogen 2.641 N/A SER 61.A N VAL 57.A O no hydrogen 3.118 N/A SER 61.A OG VAL 57.A O no hydrogen 2.274 N/A SER 61.A OG GLU 58.A O no hydrogen 3.270 N/A SER 61.A OG HIS 62.A ND1 no hydrogen 3.060 N/A HIS 62.A N ILE 59.A O no hydrogen 3.365 N/A HIS 62.A ND1 GLU 58.A O no hydrogen 2.578 N/A LEU 63.A N ILE 59.A O no hydrogen 3.240 N/A ARG 64.A N TYR 121.A OH no hydrogen 3.283 N/A ARG 64.A NH2 SER 61.A O no hydrogen 3.357 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.161 N/A ASN 67.A ND2 LEU 145.A O no hydrogen 3.119 N/A ILE 68.A N HIS 65.A O no hydrogen 2.958 N/A LEU 69.A N ILE 147.A O no hydrogen 2.687 N/A ARG 70.A N GLU 86.A OE1 no hydrogen 3.154 N/A TYR 72.A N ILE 84.A O no hydrogen 2.969 N/A PHE 75.A N TYR 82.A O no hydrogen 3.265 N/A ALA 78.A N ASP 77.A OD1 no hydrogen 2.398 N/A VAL 81.A N LEU 39.A O no hydrogen 2.566 N/A TYR 82.A N PHE 75.A O no hydrogen 2.992 N/A LEU 83.A N LYS 37.A O no hydrogen 2.739 N/A ILE 84.A N GLY 73.A O no hydrogen 3.060 N/A LEU 85.A N ALA 35.A O no hydrogen 2.757 N/A GLU 86.A N ARG 70.A O no hydrogen 2.936 N/A LEU 90.A N LEU 139.A O no hydrogen 3.281 N/A GLY 91.A N ALA 88.A O no hydrogen 3.184 N/A VAL 93.A N LEU 137.A O no hydrogen 2.840 N/A ARG 95.A N THR 92.A OG1 no hydrogen 2.947 N/A LEU 97.A N TYR 94.A O no hydrogen 2.939 N/A GLN 98.A N TYR 94.A O no hydrogen 3.005 N/A LYS 99.A N ARG 95.A O no hydrogen 2.907 N/A LYS 102.A N LEU 100.A O no hydrogen 2.622 N/A PHE 103.A N PHE 188.A O no hydrogen 2.882 N/A ARG 107.A N ASP 104.A OD1 no hydrogen 2.848 N/A ARG 107.A NH1 TYR 111.A OH no hydrogen 3.466 N/A THR 108.A N ASP 104.A O no hydrogen 2.999 N/A THR 108.A OG1 ASP 104.A O no hydrogen 2.736 N/A ALA 109.A N GLU 105.A O no hydrogen 3.049 N/A THR 110.A N GLN 106.A O no hydrogen 3.141 N/A THR 110.A OG1 GLN 106.A O no hydrogen 2.291 N/A THR 110.A OG1 SER 254.A OG no hydrogen 3.350 N/A TYR 111.A N ARG 107.A O no hydrogen 3.201 N/A ILE 112.A N THR 108.A O no hydrogen 3.000 N/A THR 113.A N ALA 109.A O no hydrogen 3.053 N/A THR 113.A OG1 ALA 109.A O no hydrogen 2.762 N/A THR 113.A OG1 SER 253.A OG no hydrogen 2.664 N/A GLU 114.A N THR 110.A O no hydrogen 3.060 N/A LEU 115.A N TYR 111.A O no hydrogen 2.854 N/A ALA 116.A N ILE 112.A O no hydrogen 2.763 N/A ASN 117.A N THR 113.A O no hydrogen 2.982 N/A ALA 118.A N GLU 114.A O no hydrogen 3.233 N/A LEU 119.A N LEU 115.A O no hydrogen 2.696 N/A SER 120.A N ALA 116.A O no hydrogen 2.519 N/A TYR 121.A N ASN 117.A O no hydrogen 3.030 N/A CYS 122.A N ALA 118.A O no hydrogen 3.090 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.218 N/A HIS 123.A N LEU 119.A O no hydrogen 2.816 N/A HIS 123.A NE2 ASP 177.A OD2 no hydrogen 3.049 N/A SER 124.A N SER 120.A O no hydrogen 3.435 N/A SER 124.A OG SER 120.A O no hydrogen 3.008 N/A SER 124.A OG TYR 121.A O no hydrogen 2.814 N/A LYS 125.A N CYS 122.A O no hydrogen 3.133 N/A ARG 126.A N HIS 123.A O no hydrogen 2.914 N/A VAL 127.A N CYS 122.A O no hydrogen 2.944 N/A ILE 128.A N VAL 154.A O no hydrogen 3.072 N/A HIS 129.A N ASP 177.A OD2 no hydrogen 3.197 N/A ASP 131.A N HIS 129.A O no hydrogen 2.200 N/A LYS 133.A NZ THR 158.A OG1 no hydrogen 2.724 N/A ASN 136.A N LYS 133.A O no hydrogen 3.239 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.805 N/A LEU 137.A N PRO 134.A O no hydrogen 3.219 N/A LEU 138.A N LYS 146.A O no hydrogen 2.888 N/A LEU 139.A N GLY 91.A O no hydrogen 2.751 N/A GLY 140.A N GLU 144.A O no hydrogen 2.816 N/A ALA 142.A N GLU 144.A OE1 no hydrogen 3.118 N/A GLY 143.A N GLY 140.A O no hydrogen 2.939 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.721 N/A LEU 145.A N GLU 114.A OE1 no hydrogen 3.294 N/A LEU 145.A N GLU 114.A OE2 no hydrogen 3.468 N/A LYS 146.A N LEU 138.A O no hydrogen 2.813 N/A LYS 146.A NZ PRO 66.A O no hydrogen 2.626 N/A LYS 146.A NZ GLU 144.A OE2 no hydrogen 3.376 N/A ILE 147.A N ASN 67.A O no hydrogen 2.792 N/A ALA 148.A N ASN 136.A O no hydrogen 2.871 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 2.768 N/A SER 153.A OG ILE 128.A O no hydrogen 3.015 N/A VAL 154.A N ILE 128.A O no hydrogen 3.385 N/A HIS 155.A ND1 ARG 126.A O no hydrogen 3.036 N/A TYR 161.A OH GLU 187.A OE1 no hydrogen 2.260 N/A TYR 161.A OH GLU 187.A OE2 no hydrogen 3.128 N/A LEU 162.A N LEU 159.A O no hydrogen 2.744 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.855 N/A MET 166.A N PRO 163.A O no hydrogen 3.299 N/A ILE 167.A N PRO 163.A O no hydrogen 3.233 N/A GLU 168.A N PRO 164.A O no hydrogen 3.231 N/A GLY 169.A N MET 166.A O no hydrogen 3.328 N/A ARG 170.A NE GLU 168.A OE1 no hydrogen 2.943 N/A ARG 170.A NH2 GLU 168.A OE1 no hydrogen 2.799 N/A ARG 170.A NH2 HIS 232.A NE2 no hydrogen 3.107 N/A HIS 172.A ND1 ARG 170.A O no hydrogen 3.209 N/A LYS 175.A N ASP 173.A OD1 no hydrogen 3.308 N/A LYS 175.A NZ ARG 237.A O no hydrogen 2.439 N/A LYS 175.A NZ PRO 238.A O no hydrogen 2.951 N/A VAL 176.A N ASP 173.A O no hydrogen 3.491 N/A LEU 178.A N LYS 175.A O no hydrogen 3.207 N/A SER 180.A N VAL 176.A O no hydrogen 3.255 N/A SER 180.A OG TYR 161.A O no hydrogen 3.304 N/A SER 180.A OG VAL 176.A O no hydrogen 2.879 N/A LEU 181.A N ASP 177.A O no hydrogen 2.930 N/A GLY 182.A N LEU 178.A O no hydrogen 3.298 N/A VAL 183.A N TRP 179.A O no hydrogen 2.940 N/A LEU 184.A N SER 180.A O no hydrogen 2.786 N/A CYS 185.A N LEU 181.A O no hydrogen 2.943 N/A TYR 186.A N GLY 182.A O no hydrogen 3.116 N/A TYR 186.A OH THR 213.A O no hydrogen 2.531 N/A GLU 187.A N VAL 183.A O no hydrogen 3.123 N/A PHE 188.A N LEU 184.A O no hydrogen 2.916 N/A LEU 189.A N CYS 185.A O no hydrogen 3.224 N/A LEU 189.A N TYR 186.A O no hydrogen 2.882 N/A VAL 190.A N TYR 186.A O no hydrogen 2.862 N/A GLY 191.A N GLU 187.A O no hydrogen 2.689 N/A GLU 196.A N PRO 193.A O no hydrogen 3.465 N/A GLN 201.A N GLN 201.A OE1 no hydrogen 3.001 N/A GLU 202.A N THR 199.A OG1 no hydrogen 2.903 N/A THR 203.A N THR 199.A O no hydrogen 3.013 N/A THR 203.A OG1 THR 199.A O no hydrogen 2.931 N/A TYR 204.A N TYR 200.A O no hydrogen 3.000 N/A LYS 205.A N GLU 202.A O no hydrogen 3.100 N/A ARG 206.A N GLU 202.A O no hydrogen 3.052 N/A ILE 207.A N THR 203.A O no hydrogen 3.043 N/A SER 208.A N TYR 204.A O no hydrogen 3.201 N/A SER 208.A OG GLU 168.A OE2 no hydrogen 2.495 N/A ARG 209.A N LYS 205.A O no hydrogen 3.082 N/A VAL 210.A N ILE 207.A O no hydrogen 3.130 N/A GLU 211.A N ARG 206.A O no hydrogen 2.962 N/A VAL 218.A N PRO 215.A O no hydrogen 3.217 N/A THR 219.A OG1 GLU 105.A OE1 no hydrogen 2.856 N/A ARG 223.A N THR 219.A O no hydrogen 3.128 N/A ARG 223.A NE VAL 218.A O no hydrogen 3.034 N/A ARG 223.A NH2 PRO 215.A O no hydrogen 3.045 N/A ASP 224.A N GLU 220.A O no hydrogen 3.173 N/A ILE 226.A N ALA 222.A O no hydrogen 3.021 N/A SER 227.A N ARG 223.A O no hydrogen 3.084 N/A SER 227.A OG ARG 223.A O no hydrogen 2.512 N/A ARG 228.A N ASP 224.A O no hydrogen 3.082 N/A ARG 228.A NE ASP 224.A OD1 no hydrogen 2.557 N/A LEU 229.A N LEU 225.A O no hydrogen 3.132 N/A LEU 229.A N ILE 226.A O no hydrogen 3.226 N/A LEU 230.A N ILE 226.A O no hydrogen 2.909 N/A SER 235.A N ASN 233.A OD1 no hydrogen 3.263 N/A SER 235.A OG ASN 233.A OD1 no hydrogen 2.908 N/A SER 235.A OG GLN 236.A OE1 no hydrogen 2.760 N/A GLN 236.A N ASN 233.A O no hydrogen 3.122 N/A ARG 237.A NE LYS 231.A O no hydrogen 2.889 N/A ARG 237.A NH1 GLU 165.A OE2 no hydrogen 2.404 N/A ARG 237.A NH1 LYS 175.A O no hydrogen 3.182 N/A ARG 237.A NH2 GLU 165.A OE1 no hydrogen 3.157 N/A ARG 237.A NH2 LYS 231.A O no hydrogen 2.977 N/A MET 239.A N GLU 242.A OE2 no hydrogen 2.942 N/A VAL 243.A N MET 239.A O no hydrogen 3.272 N/A LEU 244.A N LEU 240.A O no hydrogen 3.227 N/A GLU 245.A N ARG 241.A O no hydrogen 3.188 N/A HIS 246.A N VAL 243.A O no hydrogen 3.154 N/A HIS 246.A NE2 ASP 224.A OD1 no hydrogen 3.108 N/A TRP 248.A N HIS 246.A ND1 no hydrogen 3.054 N/A TRP 248.A NE1 GLU 105.A OE1 no hydrogen 2.750 N/A THR 250.A N HIS 246.A O no hydrogen 2.768 N/A THR 250.A OG1 LEU 244.A O no hydrogen 3.360 N/A THR 250.A OG1 HIS 246.A O no hydrogen 3.200 N/A ALA 251.A N PRO 247.A O no hydrogen 2.795 N/A ASN 252.A N ILE 249.A O no hydrogen 3.056 N/A ASN 252.A ND2 TRP 248.A O no hydrogen 3.446 N/A SER 253.A OG THR 113.A OG1 no hydrogen 2.664 N/A SER 254.A OG GLN 106.A OE1 no hydrogen 2.302 N/A SER 254.A OG THR 110.A OG1 no hydrogen 3.350 N/A