Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N THR 17.A O no hydrogen 3.242 N/A GLU 7.A N VAL 15.A O no hydrogen 3.460 N/A LEU 9.A N VAL 13.A O no hydrogen 2.883 N/A ASP 10.A N VAL 13.A O no hydrogen 3.196 N/A GLU 11.A N ASP 10.A OD1 no hydrogen 2.404 N/A VAL 13.A N ASP 10.A O no hydrogen 3.263 N/A TYR 14.A N VAL 34.A O no hydrogen 2.904 N/A VAL 15.A N GLU 7.A O no hydrogen 2.804 N/A HIS 16.A NE2 ILE 44.A O no hydrogen 3.127 N/A THR 17.A N LYS 5.A O no hydrogen 2.639 N/A THR 17.A OG1 VAL 15.A O no hydrogen 3.515 N/A SER 18.A N LYS 30.A O no hydrogen 3.030 N/A SER 18.A OG LYS 30.A O no hydrogen 3.364 N/A GLU 20.A N VAL 28.A O no hydrogen 3.432 N/A VAL 22.A N GLU 20.A O no hydrogen 2.814 N/A VAL 28.A N GLU 20.A O no hydrogen 3.297 N/A LYS 30.A N SER 18.A O no hydrogen 2.607 N/A LYS 30.A NZ HIS 31.A O no hydrogen 3.182 N/A LYS 30.A NZ ASP 45.A OD2 no hydrogen 2.476 N/A LYS 30.A NZ GLU 78.A O no hydrogen 3.279 N/A HIS 31.A N SER 193.A O no hydrogen 2.845 N/A GLY 32.A N HIS 16.A O no hydrogen 2.781 N/A LEU 33.A N ILE 44.A O no hydrogen 3.081 N/A VAL 34.A N TYR 14.A O no hydrogen 2.959 N/A VAL 35.A N TYR 42.A O no hydrogen 2.960 N/A LEU 36.A N GLY 12.A O no hydrogen 2.649 N/A ALA 41.A N LYS 66.A O no hydrogen 2.711 N/A TYR 42.A N VAL 35.A O no hydrogen 2.680 N/A LEU 43.A N GLY 69.A O no hydrogen 2.811 N/A ILE 44.A N LEU 33.A O no hydrogen 2.616 N/A ASP 45.A N ILE 71.A O no hydrogen 2.410 N/A THR 46.A N SER 79.A O no hydrogen 3.341 N/A THR 46.A OG1 PRO 47.A O no hydrogen 3.080 N/A THR 49.A OG1 ASP 52.A OD1 no hydrogen 3.261 N/A THR 53.A N THR 49.A O no hydrogen 2.985 N/A THR 53.A OG1 THR 49.A O no hydrogen 2.605 N/A GLU 54.A N ALA 50.A O no hydrogen 2.530 N/A LYS 55.A N LYS 51.A O no hydrogen 2.641 N/A LEU 56.A N ASP 52.A O no hydrogen 2.627 N/A VAL 57.A N THR 53.A O no hydrogen 2.688 N/A THR 58.A N GLU 54.A O no hydrogen 2.768 N/A THR 58.A OG1 GLU 54.A O no hydrogen 3.150 N/A THR 58.A OG1 GLU 54.A OE2 no hydrogen 3.098 N/A THR 58.A OG1 LYS 55.A O no hydrogen 3.322 N/A TRP 59.A N LYS 55.A O no hydrogen 2.633 N/A PHE 60.A N LEU 56.A O no hydrogen 3.098 N/A VAL 61.A N VAL 57.A O no hydrogen 2.659 N/A GLU 62.A N THR 58.A O no hydrogen 2.482 N/A ARG 63.A N PHE 60.A O no hydrogen 3.091 N/A GLY 64.A N VAL 61.A O no hydrogen 2.705 N/A TYR 65.A N VAL 61.A O no hydrogen 3.428 N/A LYS 66.A N ALA 39.A O no hydrogen 3.223 N/A SER 70.A N PRO 92.A O no hydrogen 3.147 N/A ILE 71.A N LEU 43.A O no hydrogen 2.517 N/A SER 72.A N TYR 94.A O no hydrogen 2.923 N/A SER 72.A OG SER 79.A O no hydrogen 2.236 N/A SER 73.A N ASP 45.A OD1 no hydrogen 2.681 N/A SER 73.A OG ASP 45.A OD1 no hydrogen 3.460 N/A SER 73.A OG HIS 74.A ND1 no hydrogen 2.606 N/A SER 73.A OG SER 79.A OG no hydrogen 2.962 N/A HIS 74.A ND1 SER 73.A OG no hydrogen 2.606 N/A HIS 76.A ND1 HIS 74.A NE2 no hydrogen 2.845 N/A HIS 76.A NE2 ASP 167.A OD2 no hydrogen 2.760 N/A SER 79.A N HIS 76.A O no hydrogen 3.128 N/A SER 79.A OG ASP 45.A OD2 no hydrogen 2.664 N/A SER 79.A OG SER 73.A OG no hydrogen 2.962 N/A THR 80.A N SER 77.A O no hydrogen 3.011 N/A THR 80.A OG1 PHE 75.A O no hydrogen 3.226 N/A THR 80.A OG1 HIS 76.A O no hydrogen 3.068 N/A GLY 81.A N SER 77.A O no hydrogen 2.746 N/A GLY 82.A N THR 46.A OG1 no hydrogen 2.468 N/A ILE 83.A N THR 80.A O no hydrogen 2.963 N/A LEU 86.A N GLY 82.A O no hydrogen 2.652 N/A ASN 87.A N ILE 83.A O no hydrogen 2.771 N/A ASN 87.A N GLU 84.A O no hydrogen 2.795 N/A ASN 87.A ND2 ILE 91.A O no hydrogen 3.649 N/A ASN 87.A ND2 THR 93.A OG1 no hydrogen 2.839 N/A SER 88.A N GLU 84.A O no hydrogen 3.126 N/A SER 88.A OG TRP 85.A O no hydrogen 2.724 N/A ARG 89.A N TRP 85.A O no hydrogen 2.850 N/A SER 90.A N ASN 87.A O no hydrogen 2.969 N/A ILE 91.A N LEU 86.A O no hydrogen 2.529 N/A THR 93.A OG1 THR 112.A OG1 no hydrogen 3.161 N/A TYR 94.A N SER 70.A O no hydrogen 2.738 N/A ALA 95.A N ASN 113.A O no hydrogen 2.992 N/A SER 96.A OG THR 99.A OG1 no hydrogen 3.184 N/A GLU 97.A N PHE 115.A O no hydrogen 2.721 N/A THR 99.A N SER 96.A OG no hydrogen 2.881 N/A THR 99.A OG1 SER 96.A O no hydrogen 2.658 N/A THR 99.A OG1 SER 96.A OG no hydrogen 3.184 N/A ASN 100.A N SER 96.A O no hydrogen 3.293 N/A ASN 100.A ND2 ALA 111.A O no hydrogen 3.507 N/A GLU 101.A N GLU 97.A O no hydrogen 3.026 N/A LEU 102.A N LEU 98.A O no hydrogen 3.165 N/A LEU 103.A N THR 99.A O no hydrogen 2.485 N/A LYS 104.A N ASN 100.A O no hydrogen 2.623 N/A LYS 105.A N GLU 101.A O no hydrogen 2.921 N/A LYS 105.A NZ GLU 101.A OE1 no hydrogen 3.292 N/A ASP 106.A N LEU 103.A O no hydrogen 2.649 N/A GLY 107.A N LYS 104.A O no hydrogen 3.138 N/A LYS 108.A N LEU 103.A O no hydrogen 2.945 N/A ALA 111.A N ASN 100.A OD1 no hydrogen 2.790 N/A THR 112.A N THR 93.A OG1 no hydrogen 2.837 N/A THR 112.A OG1 THR 93.A OG1 no hydrogen 3.161 N/A ASN 113.A N THR 93.A O no hydrogen 2.818 N/A ASN 113.A ND2 THR 93.A O no hydrogen 3.690 N/A TYR 120.A N VAL 129.A O no hydrogen 3.181 N/A LEU 122.A N ILE 127.A O no hydrogen 2.736 N/A LYS 126.A N VAL 123.A O no hydrogen 3.042 N/A ILE 127.A N VAL 123.A O no hydrogen 3.372 N/A GLU 128.A N TRP 144.A O no hydrogen 2.962 N/A VAL 129.A N TYR 120.A O no hydrogen 2.671 N/A TYR 131.A N VAL 118.A O no hydrogen 2.567 N/A TYR 131.A OH PRO 138.A O no hydrogen 2.235 N/A GLY 135.A N THR 137.A O no hydrogen 3.090 N/A HIS 136.A N ASN 140.A OD1 no hydrogen 2.613 N/A THR 137.A N ASN 140.A OD1 no hydrogen 3.227 N/A ASN 140.A ND2 GLY 133.A O no hydrogen 3.162 N/A ASN 140.A ND2 ASN 140.A O no hydrogen 2.430 N/A VAL 141.A N SER 73.A O no hydrogen 2.790 N/A VAL 142.A N PHE 130.A O no hydrogen 2.935 N/A VAL 143.A N PHE 152.A O no hydrogen 3.156 N/A TRP 144.A N GLU 128.A O no hydrogen 2.622 N/A LEU 145.A N ILE 150.A O no hydrogen 2.519 N/A ARG 148.A NE GLU 147.A O no hydrogen 3.122 N/A ARG 148.A NH2 GLU 147.A O no hydrogen 3.168 N/A LYS 149.A N PRO 146.A O no hydrogen 2.760 N/A ILE 150.A N LEU 145.A O no hydrogen 3.117 N/A LEU 151.A N LEU 189.A O no hydrogen 2.991 N/A PHE 152.A N VAL 143.A O no hydrogen 2.641 N/A GLY 154.A N VAL 191.A O no hydrogen 2.956 N/A CYS 155.A SG GLU 78.A OE2 no hydrogen 2.670 N/A CYS 155.A SG SER 193.A OG no hydrogen 3.184 N/A CYS 155.A SG HIS 194.A NE2 no hydrogen 3.077 N/A PHE 156.A N GLY 153.A O no hydrogen 3.008 N/A ALA 168.A N LEU 165.A O no hydrogen 2.711 N/A ASN 169.A N GLY 135.A O no hydrogen 2.923 N/A ALA 172.A N ASN 169.A O no hydrogen 2.824 N/A TRP 173.A N ASN 169.A O no hydrogen 2.705 N/A SER 176.A N ALA 172.A O no hydrogen 2.878 N/A SER 176.A OG PRO 132.A O no hydrogen 3.166 N/A SER 176.A OG PRO 134.A O no hydrogen 2.427 N/A SER 176.A OG ALA 172.A O no hydrogen 3.029 N/A ALA 177.A N TRP 173.A O no hydrogen 2.465 N/A LYS 178.A N PRO 174.A O no hydrogen 2.656 N/A LEU 179.A N LYS 175.A O no hydrogen 2.845 N/A LEU 180.A N SER 176.A O no hydrogen 2.717 N/A LYS 181.A N ALA 177.A O no hydrogen 2.622 N/A SER 182.A OG LYS 178.A O no hydrogen 2.728 N/A LYS 183.A N LEU 179.A O no hydrogen 3.054 N/A LYS 183.A N LEU 180.A O no hydrogen 2.835 N/A LYS 183.A NZ GLU 128.A OE1 no hydrogen 3.258 N/A TYR 184.A N LEU 180.A O no hydrogen 3.000 N/A ALA 187.A N TYR 184.A O no hydrogen 3.365 N/A LYS 188.A N LYS 149.A O no hydrogen 2.693 N/A LEU 189.A N LYS 149.A O no hydrogen 3.412 N/A VAL 190.A N GLY 198.A O no hydrogen 2.929 N/A VAL 191.A N LEU 151.A O no hydrogen 2.621 N/A SER 193.A OG HIS 194.A NE2 no hydrogen 3.430 N/A GLY 198.A N VAL 190.A O no hydrogen 3.224 N/A SER 201.A OG ASP 199.A OD1 no hydrogen 2.752 N/A LEU 202.A N ASP 199.A O no hydrogen 2.767 N/A LEU 203.A N ALA 200.A O no hydrogen 3.281 N/A LYS 204.A N SER 201.A O no hydrogen 2.926 N/A LEU 205.A N SER 201.A O no hydrogen 3.046 N/A THR 206.A N LEU 202.A O no hydrogen 2.911 N/A THR 206.A OG1 LEU 202.A O no hydrogen 2.804 N/A LEU 207.A N LEU 203.A O no hydrogen 3.335 N/A GLU 208.A N LYS 204.A O no hydrogen 2.742 N/A GLN 209.A N LEU 205.A O no hydrogen 2.618 N/A GLN 209.A NE2 LEU 205.A O no hydrogen 3.682 N/A ALA 210.A N THR 206.A O no hydrogen 2.762 N/A VAL 211.A N LEU 207.A O no hydrogen 2.824 N/A LYS 212.A N GLU 208.A O no hydrogen 2.615 N/A LYS 212.A NZ GLN 209.A OE1 no hydrogen 2.583 N/A GLY 213.A N GLN 209.A O no hydrogen 2.513 N/A LEU 214.A N ALA 210.A O no hydrogen 2.625 N/A ASN 215.A N VAL 211.A O no hydrogen 2.578 N/A GLU 216.A N LYS 212.A O no hydrogen 3.329 N/A