Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7n3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 76.A OE1 no hydrogen 3.255 N/A TYR 3.A OH GLU 9.A OE2 no hydrogen 2.656 N/A THR 4.A N SER 1.A OG no hydrogen 2.898 N/A THR 5.A N ARG 2.A O no hydrogen 3.288 N/A THR 5.A OG1 SER 1.A O no hydrogen 2.840 N/A GLU 6.A N ARG 2.A O no hydrogen 2.728 N/A PHE 7.A N TYR 3.A O no hydrogen 3.142 N/A HIS 8.A N VAL 25.A O no hydrogen 3.070 N/A LEU 10.A N LYS 23.A O no hydrogen 2.719 N/A GLU 11.A N LYS 23.A O no hydrogen 3.255 N/A ILE 13.A N VAL 21.A O no hydrogen 2.980 N/A GLY 16.A N GLY 19.A O no hydrogen 2.723 N/A SER 20.A N ARG 37.A O no hydrogen 3.244 N/A VAL 21.A N GLY 14.A O no hydrogen 3.009 N/A PHE 22.A N ILE 35.A O no hydrogen 2.974 N/A LYS 23.A N GLU 11.A O no hydrogen 2.607 N/A CYS 24.A N TYR 33.A O no hydrogen 2.873 N/A CYS 24.A SG TYR 3.A OH no hydrogen 3.810 N/A CYS 24.A SG PHE 22.A O no hydrogen 3.590 N/A VAL 25.A N HIS 8.A O no hydrogen 3.102 N/A LYS 26.A N CYS 31.A O no hydrogen 3.095 N/A ARG 27.A N GLU 6.A O no hydrogen 2.619 N/A ARG 27.A NH1 THR 4.A O no hydrogen 2.900 N/A ARG 27.A NH1 THR 5.A O no hydrogen 3.036 N/A ASP 29.A N LYS 26.A O no hydrogen 3.261 N/A GLY 30.A N LYS 26.A O no hydrogen 2.732 N/A CYS 31.A N ASP 29.A OD1 no hydrogen 2.724 N/A TYR 33.A N CYS 24.A O no hydrogen 2.763 N/A TYR 33.A OH ASP 29.A OD2 no hydrogen 2.768 N/A ALA 34.A N ASN 84.A O no hydrogen 2.961 N/A ILE 35.A N PHE 22.A O no hydrogen 3.112 N/A LYS 36.A N ILE 82.A O no hydrogen 2.982 N/A ARG 37.A N SER 20.A O no hydrogen 2.910 N/A SER 38.A N MET 80.A O no hydrogen 2.861 N/A SER 38.A OG MET 80.A O no hydrogen 3.558 N/A GLY 44.A N GLU 48.A OE1 no hydrogen 2.499 N/A SER 45.A N LEU 42.A O no hydrogen 3.030 N/A SER 45.A OG LEU 42.A O no hydrogen 2.687 N/A GLU 48.A N SER 45.A O no hydrogen 2.882 N/A GLN 49.A N SER 45.A O no hydrogen 3.149 N/A ASN 50.A N VAL 46.A O no hydrogen 2.726 N/A ASN 50.A ND2 GLY 156.A O no hydrogen 3.053 N/A ALA 51.A N ASP 47.A O no hydrogen 3.164 N/A LEU 52.A N GLU 48.A O no hydrogen 2.749 N/A ARG 53.A N GLN 49.A O no hydrogen 2.576 N/A ARG 53.A NE GLY 156.A O no hydrogen 2.734 N/A ARG 53.A NH2 GLY 156.A O no hydrogen 3.539 N/A GLU 54.A N ASN 50.A O no hydrogen 2.997 N/A VAL 55.A N ALA 51.A O no hydrogen 3.212 N/A TYR 56.A N LEU 52.A O no hydrogen 3.414 N/A ALA 57.A N ARG 53.A O no hydrogen 3.041 N/A HIS 58.A N GLU 54.A O no hydrogen 2.940 N/A ALA 59.A N VAL 55.A O no hydrogen 3.065 N/A VAL 60.A N TYR 56.A O no hydrogen 2.991 N/A LEU 61.A N ALA 57.A O no hydrogen 3.066 N/A HIS 66.A N HIS 64.A ND1 no hydrogen 3.315 N/A HIS 66.A ND1 PHE 150.A O no hydrogen 3.174 N/A VAL 67.A N HIS 64.A O no hydrogen 3.067 N/A VAL 68.A N ILE 152.A O no hydrogen 2.907 N/A ARG 69.A N GLU 85.A OE2 no hydrogen 3.030 N/A PHE 71.A N GLN 83.A O no hydrogen 2.951 N/A SER 72.A N GLN 83.A O no hydrogen 3.073 N/A TRP 74.A N LEU 81.A O no hydrogen 2.923 N/A TRP 74.A NE1 GLU 76.A OE2 no hydrogen 3.287 N/A GLU 76.A N HIS 79.A O no hydrogen 3.165 N/A HIS 79.A ND1 ASP 77.A O no hydrogen 3.290 N/A MET 80.A N SER 38.A O no hydrogen 2.510 N/A LEU 81.A N TRP 74.A O no hydrogen 2.862 N/A ILE 82.A N LYS 36.A O no hydrogen 2.997 N/A GLN 83.A N SER 72.A O no hydrogen 2.552 N/A ASN 84.A N ALA 34.A O no hydrogen 2.879 N/A GLU 85.A N ARG 69.A O no hydrogen 2.987 N/A CYS 87.A SG SER 143.A OG no hydrogen 3.365 N/A ASN 88.A ND2 ARG 144.A O no hydrogen 3.133 N/A GLY 89.A N ILE 142.A O no hydrogen 2.769 N/A GLY 90.A N CYS 87.A O no hydrogen 3.210 N/A SER 91.A N ASP 94.A OD2 no hydrogen 3.000 N/A SER 91.A OG ASP 94.A OD2 no hydrogen 2.770 N/A LEU 92.A N ILE 140.A O no hydrogen 2.758 N/A ASP 94.A N SER 91.A OG no hydrogen 3.225 N/A ALA 95.A N SER 91.A O no hydrogen 3.095 N/A ILE 96.A N LEU 92.A O no hydrogen 2.815 N/A SER 97.A N ALA 93.A O no hydrogen 3.275 N/A SER 97.A OG ALA 93.A O no hydrogen 3.286 N/A GLU 98.A N ASP 94.A O no hydrogen 2.892 N/A ASN 99.A N ALA 95.A O no hydrogen 3.005 N/A TYR 100.A N ILE 96.A O no hydrogen 2.899 N/A ARG 101.A N SER 97.A O no hydrogen 2.976 N/A ARG 101.A NH2 GLU 98.A OE1 no hydrogen 3.505 N/A ILE 102.A N GLU 98.A O no hydrogen 3.209 N/A MET 103.A N TYR 100.A O no hydrogen 3.067 N/A SER 104.A OG TYR 105.A O no hydrogen 3.196 N/A TYR 105.A N SER 104.A OG no hydrogen 2.626 N/A PHE 106.A N ALA 201.A O no hydrogen 3.407 N/A LYS 107.A N GLU 110.A OE1 no hydrogen 3.318 N/A LYS 107.A NZ GLU 110.A OE1 no hydrogen 3.354 N/A GLU 110.A N LYS 107.A O no hydrogen 2.729 N/A LEU 111.A N LYS 107.A O no hydrogen 3.105 N/A LYS 112.A N GLU 108.A O no hydrogen 2.810 N/A LYS 112.A NZ VAL 259.A O no hydrogen 2.932 N/A ASP 113.A N ALA 109.A O no hydrogen 2.893 N/A LEU 114.A N GLU 110.A O no hydrogen 2.581 N/A LEU 115.A N LEU 111.A O no hydrogen 2.778 N/A LEU 116.A N LYS 112.A O no hydrogen 3.033 N/A GLN 117.A N ASP 113.A O no hydrogen 3.118 N/A VAL 118.A N LEU 114.A O no hydrogen 3.176 N/A GLY 119.A N LEU 115.A O no hydrogen 2.840 N/A ARG 120.A N LEU 116.A O no hydrogen 2.866 N/A GLY 121.A N GLN 117.A O no hydrogen 3.287 N/A LEU 122.A N VAL 118.A O no hydrogen 3.085 N/A ARG 123.A N GLY 119.A O no hydrogen 2.933 N/A TYR 124.A N ARG 120.A O no hydrogen 3.066 N/A TYR 124.A OH LEU 61.A O no hydrogen 2.319 N/A ILE 125.A N GLY 121.A O no hydrogen 3.065 N/A HIS 126.A N LEU 122.A O no hydrogen 2.700 N/A HIS 126.A NE2 ASP 190.A OD2 no hydrogen 2.721 N/A SER 127.A N ARG 123.A O no hydrogen 2.764 N/A SER 127.A OG TYR 124.A O no hydrogen 2.408 N/A MET 128.A N TYR 124.A O no hydrogen 3.066 N/A MET 128.A N ILE 125.A O no hydrogen 3.033 N/A SER 129.A N HIS 126.A O no hydrogen 2.704 N/A LEU 130.A N ILE 125.A O no hydrogen 3.295 N/A VAL 131.A N THR 159.A O no hydrogen 2.950 N/A HIS 132.A N ASP 190.A OD2 no hydrogen 2.906 N/A HIS 132.A NE2 GLY 153.A O no hydrogen 2.765 N/A MET 133.A N ASP 190.A OD1 no hydrogen 2.761 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.266 N/A ASN 139.A N LYS 136.A O no hydrogen 2.688 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.984 N/A ASN 139.A ND2 ASP 134.A OD2 no hydrogen 3.302 N/A ILE 140.A N PRO 137.A O no hydrogen 3.078 N/A PHE 141.A N LYS 151.A O no hydrogen 2.785 N/A ILE 142.A N GLY 90.A O no hydrogen 3.005 N/A SER 143.A N MET 149.A O no hydrogen 3.055 N/A ARG 144.A N ASN 88.A OD1 no hydrogen 2.948 N/A LYS 147.A N ASN 146.A OD1 no hydrogen 2.989 N/A MET 149.A N SER 143.A O no hydrogen 3.122 N/A LYS 151.A N PHE 141.A O no hydrogen 2.826 N/A LYS 151.A NZ SER 65.A O no hydrogen 2.526 N/A LYS 151.A NZ GLU 85.A OE1 no hydrogen 3.353 N/A LYS 151.A NZ GLU 85.A OE2 no hydrogen 3.498 N/A ILE 152.A N HIS 66.A O no hydrogen 2.807 N/A GLY 153.A N ASN 139.A O no hydrogen 2.912 N/A GLY 156.A N ASP 154.A OD1 no hydrogen 3.285 N/A VAL 158.A N LEU 155.A O no hydrogen 3.146 N/A THR 159.A N VAL 131.A O no hydrogen 3.063 N/A ILE 161.A N SER 129.A O no hydrogen 3.127 N/A SER 162.A OG SER 163.A OG no hydrogen 3.400 N/A SER 163.A OG SER 162.A OG no hydrogen 3.400 N/A GLN 165.A N THR 159.A OG1 no hydrogen 2.904 N/A ASP 170.A N ASP 134.A OD1 no hydrogen 2.992 N/A SER 171.A OG ARG 209.A O no hydrogen 2.700 N/A ARG 172.A N ASP 170.A OD1 no hydrogen 2.744 N/A ARG 172.A NE ASP 170.A OD1 no hydrogen 2.945 N/A ARG 172.A NE ASP 170.A OD2 no hydrogen 2.909 N/A ARG 172.A NH2 ASP 170.A OD2 no hydrogen 2.404 N/A PHE 173.A N ASP 170.A O no hydrogen 3.419 N/A LEU 174.A N SER 171.A O no hydrogen 3.478 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 3.226 N/A VAL 178.A N ALA 175.A O no hydrogen 3.113 N/A GLN 180.A N ASN 176.A O no hydrogen 3.034 N/A GLU 181.A N VAL 178.A O no hydrogen 2.969 N/A THR 184.A N ASN 182.A OD1 no hydrogen 3.060 N/A THR 184.A OG1 ASN 182.A OD1 no hydrogen 2.588 N/A LYS 188.A N HIS 185.A O no hydrogen 2.758 N/A LYS 188.A NZ PRO 245.A O no hydrogen 3.032 N/A LYS 188.A NZ ARG 248.A O no hydrogen 2.646 N/A ALA 189.A N LEU 186.A O no hydrogen 2.720 N/A ASP 190.A N LEU 186.A O no hydrogen 3.294 N/A ILE 191.A N PRO 187.A O no hydrogen 3.356 N/A PHE 192.A N LYS 188.A O no hydrogen 3.012 N/A ALA 193.A N ALA 189.A O no hydrogen 2.909 N/A LEU 194.A N ASP 190.A O no hydrogen 2.912 N/A ALA 195.A N ILE 191.A O no hydrogen 3.204 N/A LEU 196.A N PHE 192.A O no hydrogen 3.363 N/A THR 197.A N ALA 193.A O no hydrogen 2.843 N/A THR 197.A OG1 ALA 193.A O no hydrogen 2.683 N/A VAL 198.A N LEU 194.A O no hydrogen 2.890 N/A VAL 199.A N ALA 195.A O no hydrogen 2.814 N/A CYS 200.A N LEU 196.A O no hydrogen 2.956 N/A CYS 200.A SG LEU 196.A O no hydrogen 3.412 N/A ALA 201.A N THR 197.A O no hydrogen 3.277 N/A ALA 202.A N VAL 198.A O no hydrogen 3.145 N/A ALA 202.A N VAL 199.A O no hydrogen 3.185 N/A GLY 203.A N CYS 200.A O no hydrogen 3.166 N/A ALA 204.A N VAL 199.A O no hydrogen 3.305 N/A TRP 214.A N GLY 211.A O no hydrogen 2.974 N/A TRP 214.A NE1 SER 171.A O no hydrogen 2.919 N/A GLU 216.A N ASP 212.A O no hydrogen 3.083 N/A ILE 217.A N GLN 213.A O no hydrogen 3.295 N/A ARG 218.A N TRP 214.A O no hydrogen 3.210 N/A ARG 218.A NE LEU 174.A O no hydrogen 2.867 N/A ARG 218.A NH2 ARG 172.A O no hydrogen 2.986 N/A ARG 218.A NH2 LEU 174.A O no hydrogen 2.626 N/A GLN 219.A N GLU 216.A O no hydrogen 3.276 N/A GLY 220.A N ILE 217.A O no hydrogen 2.731 N/A GLN 227.A NE2 PHE 106.A O no hydrogen 3.079 N/A GLN 227.A NE2 ALA 202.A O no hydrogen 2.915 N/A SER 230.A N GLU 108.A OE1 no hydrogen 2.954 N/A SER 230.A N GLU 108.A OE2 no hydrogen 3.132 N/A SER 230.A OG GLU 108.A OE1 no hydrogen 2.898 N/A GLU 232.A N GLU 232.A OE1 no hydrogen 3.119 N/A PHE 233.A N SER 230.A OG no hydrogen 3.081 N/A THR 234.A N SER 230.A O no hydrogen 2.772 N/A THR 234.A OG1 LEU 229.A O no hydrogen 3.314 N/A THR 234.A OG1 SER 230.A O no hydrogen 2.716 N/A GLU 235.A N GLN 231.A O no hydrogen 2.976 N/A LEU 236.A N PHE 233.A O no hydrogen 2.922 N/A LEU 237.A N PHE 233.A O no hydrogen 3.092 N/A LYS 238.A N THR 234.A O no hydrogen 3.088 N/A LYS 238.A NZ GLY 220.A O no hydrogen 3.202 N/A VAL 239.A N GLU 235.A O no hydrogen 3.023 N/A MET 240.A N LEU 236.A O no hydrogen 3.191 N/A ILE 241.A N LYS 238.A O no hydrogen 3.208 N/A HIS 242.A N VAL 239.A O no hydrogen 3.029 N/A ASP 244.A N HIS 242.A ND1 no hydrogen 3.120 N/A GLU 246.A N ASP 244.A OD1 no hydrogen 3.034 N/A ARG 247.A N ASP 244.A O no hydrogen 3.082 N/A ARG 248.A N PRO 245.A O no hydrogen 3.010 N/A ARG 248.A NE HIS 242.A O no hydrogen 2.925 N/A ARG 248.A NH1 GLU 177.A OE1 no hydrogen 2.724 N/A ARG 248.A NH1 GLU 177.A OE2 no hydrogen 3.352 N/A ARG 248.A NH1 LYS 188.A O no hydrogen 3.021 N/A ARG 248.A NH2 GLU 177.A OE2 no hydrogen 2.990 N/A ARG 248.A NH2 HIS 242.A O no hydrogen 2.888 N/A ALA 253.A N SER 250.A OG no hydrogen 2.948 N/A LEU 254.A N SER 250.A O no hydrogen 2.677 N/A VAL 255.A N ALA 251.A O no hydrogen 2.965 N/A LYS 256.A N ALA 253.A O no hydrogen 2.982 N/A LEU 260.A N HIS 257.A O no hydrogen 2.945 N/A