Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wyw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N ASP 57.A O no hydrogen 2.803 N/A LEU 4.A N ASN 28.A O no hydrogen 2.873 N/A TYR 5.A N THR 55.A O no hydrogen 2.882 N/A TYR 6.A N LYS 30.A O no hydrogen 3.281 N/A SER 10.A N VAL 7.A O no hydrogen 3.433 N/A CYS 13.A N SER 10.A OG no hydrogen 3.244 N/A CYS 13.A SG SER 10.A OG no hydrogen 3.556 N/A ARG 14.A N SER 10.A O no hydrogen 2.958 N/A ARG 14.A NE PRO 8.A O no hydrogen 2.971 N/A ARG 14.A NH1 ALA 162.A O no hydrogen 3.438 N/A ARG 14.A NH1 THR 166.A OG1 no hydrogen 3.392 N/A ARG 14.A NH1 ASN 198.A OD1 no hydrogen 2.859 N/A ARG 14.A NH2 GLY 9.A O no hydrogen 2.964 N/A ARG 14.A NH2 THR 166.A OG1 no hydrogen 2.923 N/A ASN 15.A N ALA 11.A O no hydrogen 2.863 N/A ASN 15.A ND2 SER 66.A OG no hydrogen 2.966 N/A VAL 16.A N CYS 13.A O no hydrogen 2.999 N/A LEU 17.A N CYS 13.A O no hydrogen 3.027 N/A LEU 18.A N ARG 14.A O no hydrogen 2.793 N/A ALA 19.A N ASN 15.A O no hydrogen 3.093 N/A ALA 20.A N VAL 16.A O no hydrogen 2.791 N/A LYS 21.A N LEU 17.A O no hydrogen 3.169 N/A ALA 22.A N LEU 18.A O no hydrogen 3.075 N/A VAL 23.A N ALA 19.A O no hydrogen 2.946 N/A GLY 24.A N ALA 20.A O no hydrogen 2.816 N/A VAL 25.A N ALA 20.A O no hydrogen 2.800 N/A ASN 28.A N ILE 2.A O no hydrogen 2.809 N/A ASN 28.A ND2 ASP 3.A OD1 no hydrogen 2.850 N/A LYS 30.A N LEU 4.A O no hydrogen 2.800 N/A LYS 30.A NZ TYR 5.A OH no hydrogen 3.024 N/A THR 32.A N TYR 6.A O no hydrogen 2.826 N/A THR 32.A OG1 LYS 30.A O no hydrogen 3.074 N/A SER 36.A N ASP 33.A OD2 no hydrogen 2.972 N/A SER 36.A OG ASP 33.A O no hydrogen 3.506 N/A SER 36.A OG ASP 33.A OD2 no hydrogen 2.465 N/A GLY 37.A N LEU 34.A O no hydrogen 2.977 N/A GLN 38.A N ASP 33.A O no hydrogen 2.997 N/A HIS 39.A ND1 HIS 51.A O no hydrogen 3.245 N/A HIS 39.A NE2 LEU 34.A O no hydrogen 3.126 N/A LEU 40.A N GLY 37.A O no hydrogen 2.845 N/A THR 41.A OG1 GLN 38.A O no hydrogen 3.559 N/A PHE 44.A N THR 41.A O no hydrogen 3.002 N/A PHE 44.A N THR 41.A OG1 no hydrogen 3.090 N/A ILE 45.A N THR 41.A O no hydrogen 3.015 N/A LYS 46.A N PRO 42.A O no hydrogen 2.904 N/A LEU 47.A N PHE 44.A O no hydrogen 2.580 N/A ASN 48.A N PHE 44.A O no hydrogen 2.711 N/A ASN 48.A ND2 ASN 52.A O no hydrogen 3.004 N/A ASN 48.A ND2 ASN 52.A OD1 no hydrogen 3.004 N/A ASN 48.A ND2 THR 55.A OG1 no hydrogen 2.885 N/A GLN 50.A N ASN 48.A OD1 no hydrogen 3.058 N/A HIS 51.A N ASN 48.A O no hydrogen 2.906 N/A HIS 51.A ND1 HIS 51.A O no hydrogen 2.631 N/A THR 55.A N TYR 5.A O no hydrogen 3.098 N/A THR 55.A OG1 ASN 52.A O no hydrogen 2.697 N/A LEU 56.A N LEU 63.A O no hydrogen 2.853 N/A ASP 57.A N ASP 3.A O no hydrogen 2.877 N/A ASP 58.A N PHE 61.A O no hydrogen 2.861 N/A ASN 59.A N PRO 1.A O no hydrogen 3.238 N/A GLY 60.A N ASP 57.A OD1 no hydrogen 2.832 N/A PHE 61.A N ASP 58.A O no hydrogen 2.924 N/A LEU 63.A N LEU 56.A O no hydrogen 2.919 N/A ASN 64.A ND2 GLN 50.A OE1 no hydrogen 3.212 N/A ASN 64.A ND2 ASN 52.A OD1 no hydrogen 3.022 N/A ARG 67.A NE ASP 101.A OD2 no hydrogen 2.988 N/A ARG 67.A NH2 ASP 101.A OD2 no hydrogen 2.869 N/A ALA 68.A N GLU 65.A O no hydrogen 2.942 N/A ILE 69.A N GLU 65.A O no hydrogen 2.980 N/A MET 70.A N SER 66.A O no hydrogen 2.843 N/A THR 71.A N ARG 67.A O no hydrogen 3.318 N/A THR 71.A OG1 ARG 67.A O no hydrogen 3.330 N/A THR 71.A OG1 ALA 68.A O no hydrogen 3.269 N/A TYR 72.A N ALA 68.A O no hydrogen 2.974 N/A TYR 72.A OH ASP 58.A OD2 no hydrogen 2.596 N/A LEU 73.A N ILE 69.A O no hydrogen 3.024 N/A ALA 74.A N MET 70.A O no hydrogen 3.258 N/A ASP 75.A N THR 71.A O no hydrogen 2.854 N/A GLN 76.A N TYR 72.A O no hydrogen 2.790 N/A GLN 76.A NE2 GLN 76.A O no hydrogen 3.256 N/A TYR 77.A N LEU 73.A O no hydrogen 2.901 N/A TYR 77.A OH ASP 58.A OD1 no hydrogen 3.233 N/A TYR 77.A OH ASP 58.A OD2 no hydrogen 2.470 N/A GLY 78.A N ALA 74.A O no hydrogen 2.852 N/A LYS 79.A NZ VAL 23.A O no hydrogen 3.219 N/A SER 82.A N ASP 80.A OD1 no hydrogen 3.025 N/A SER 82.A OG ASP 80.A OD1 no hydrogen 2.799 N/A SER 82.A OG ASP 80.A OD2 no hydrogen 3.457 N/A LEU 83.A N ASP 80.A O no hydrogen 2.998 N/A TYR 84.A N ASP 81.A O no hydrogen 3.021 N/A TYR 84.A OH ASN 95.A OD1 no hydrogen 2.738 N/A LYS 86.A N ASP 81.A OD1 no hydrogen 2.897 N/A LYS 90.A N ASP 87.A OD2 no hydrogen 2.978 N/A ARG 91.A N ASP 87.A O no hydrogen 2.750 N/A ARG 91.A NE PRO 85.A O no hydrogen 2.736 N/A ARG 91.A NH1 ASP 75.A OD1 no hydrogen 2.945 N/A ARG 91.A NH2 TYR 84.A O no hydrogen 2.854 N/A ARG 91.A NH2 PRO 85.A O no hydrogen 3.246 N/A ALA 92.A N PRO 88.A O no hydrogen 2.921 N/A LYS 93.A N LYS 89.A O no hydrogen 3.174 N/A VAL 94.A N LYS 90.A O no hydrogen 3.208 N/A ASN 95.A N ARG 91.A O no hydrogen 2.757 N/A GLN 96.A N ALA 92.A O no hydrogen 2.787 N/A ARG 97.A N LYS 93.A O no hydrogen 3.179 N/A ARG 97.A NE VAL 148.A O no hydrogen 2.885 N/A LEU 98.A N VAL 94.A O no hydrogen 2.931 N/A TYR 99.A N ASN 95.A O no hydrogen 2.952 N/A PHE 100.A N GLN 96.A O no hydrogen 2.867 N/A ASP 101.A N ARG 97.A O no hydrogen 2.885 N/A MET 102.A N LEU 98.A O no hydrogen 3.086 N/A GLY 103.A N TYR 99.A O no hydrogen 2.785 N/A THR 104.A N PHE 100.A O no hydrogen 2.926 N/A LEU 105.A N PHE 100.A O no hydrogen 2.987 N/A TYR 106.A N ASP 101.A O no hydrogen 2.743 N/A TYR 106.A OH TYR 114.A OH no hydrogen 2.437 N/A GLN 107.A N MET 102.A O no hydrogen 3.199 N/A GLN 107.A NE2 ASP 111.A OD1 no hydrogen 2.975 N/A SER 108.A N THR 104.A O no hydrogen 3.022 N/A SER 108.A OG THR 104.A O no hydrogen 2.887 N/A SER 108.A OG LEU 105.A O no hydrogen 3.126 N/A PHE 109.A N LEU 105.A O no hydrogen 3.104 N/A GLY 110.A N TYR 106.A O no hydrogen 2.808 N/A ASP 111.A N GLN 107.A O no hydrogen 2.838 N/A ALA 112.A N SER 108.A O no hydrogen 3.168 N/A ALA 112.A N PHE 109.A O no hydrogen 3.152 N/A TYR 113.A N PHE 109.A O no hydrogen 2.876 N/A TYR 114.A N GLY 110.A O no hydrogen 2.903 N/A TYR 114.A OH TYR 106.A OH no hydrogen 2.437 N/A HIS 116.A NE2 THR 213.A OG1 no hydrogen 2.824 N/A MET 117.A N TYR 113.A O no hydrogen 2.828 N/A PHE 118.A N TYR 114.A O no hydrogen 2.757 N/A ALA 121.A N PRO 115.A O no hydrogen 3.248 N/A ASP 126.A N ASP 124.A OD1 no hydrogen 2.630 N/A LYS 127.A N ASP 124.A OD1 no hydrogen 3.293 N/A LYS 128.A N ASP 124.A O no hydrogen 3.066 N/A LYS 128.A NZ GLU 125.A OE1 no hydrogen 3.508 N/A LYS 128.A NZ GLU 125.A OE2 no hydrogen 3.425 N/A LYS 129.A N GLU 125.A O no hydrogen 3.093 N/A LYS 130.A N ASP 126.A O no hydrogen 3.059 N/A LEU 131.A N LYS 127.A O no hydrogen 3.151 N/A GLY 132.A N LYS 128.A O no hydrogen 2.824 N/A ASP 133.A N LYS 129.A O no hydrogen 2.943 N/A ALA 134.A N LYS 130.A O no hydrogen 3.108 N/A LEU 135.A N LEU 131.A O no hydrogen 2.923 N/A VAL 136.A N GLY 132.A O no hydrogen 2.835 N/A PHE 137.A N ASP 133.A O no hydrogen 3.103 N/A LEU 138.A N ALA 134.A O no hydrogen 2.990 N/A ASP 139.A N LEU 135.A O no hydrogen 2.848 N/A GLY 140.A N VAL 136.A O no hydrogen 3.046 N/A PHE 141.A N PHE 137.A O no hydrogen 2.949 N/A LEU 142.A N LEU 138.A O no hydrogen 3.148 N/A GLU 143.A N GLY 140.A O no hydrogen 3.166 N/A LYS 144.A NZ PHE 141.A O no hydrogen 3.426 N/A SER 145.A OG PHE 147.A O no hydrogen 2.903 N/A SER 145.A OG GLY 150.A O no hydrogen 2.547 N/A ALA 146.A N GLU 151.A OE2 no hydrogen 2.943 N/A PHE 147.A N GLY 150.A O no hydrogen 2.870 N/A VAL 148.A N ASP 157.A OD1 no hydrogen 2.872 N/A GLY 150.A N PHE 147.A O no hydrogen 3.476 N/A THR 154.A N ASP 157.A OD2 no hydrogen 2.866 N/A THR 154.A OG1 ASP 157.A OD2 no hydrogen 3.442 N/A LEU 155.A N LEU 83.A O no hydrogen 2.988 N/A ALA 156.A N THR 154.A OG1 no hydrogen 3.208 N/A ASP 157.A N THR 154.A O no hydrogen 2.988 N/A LEU 158.A N THR 154.A O no hydrogen 3.385 N/A ALA 159.A N LEU 155.A O no hydrogen 3.130 N/A ILE 160.A N ALA 156.A O no hydrogen 3.020 N/A VAL 161.A N ASP 157.A O no hydrogen 2.807 N/A ALA 162.A N LEU 158.A O no hydrogen 3.069 N/A SER 163.A N ALA 159.A O no hydrogen 3.026 N/A SER 163.A OG ASP 101.A OD1 no hydrogen 2.607 N/A SER 163.A OG ASP 101.A OD2 no hydrogen 3.482 N/A SER 163.A OG ALA 159.A O no hydrogen 3.283 N/A ILE 164.A N ILE 160.A O no hydrogen 2.779 N/A SER 165.A N VAL 161.A O no hydrogen 2.966 N/A SER 165.A OG VAL 161.A O no hydrogen 3.152 N/A SER 165.A OG ALA 162.A O no hydrogen 2.984 N/A THR 166.A N ALA 162.A O no hydrogen 3.238 N/A THR 166.A OG1 ALA 162.A O no hydrogen 2.653 N/A ILE 167.A N SER 163.A O no hydrogen 2.944 N/A GLU 168.A N ILE 164.A O no hydrogen 2.815 N/A ALA 169.A N SER 165.A O no hydrogen 2.999 N/A VAL 170.A N THR 166.A O no hydrogen 3.200 N/A VAL 170.A N ILE 167.A O no hydrogen 3.391 N/A GLU 171.A N GLU 168.A O no hydrogen 2.904 N/A TYR 172.A N ILE 167.A O no hydrogen 3.396 N/A TYR 172.A OH LYS 128.A O no hydrogen 3.313 N/A SER 175.A N ASP 173.A OD1 no hydrogen 3.007 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.846 N/A SER 175.A OG ASP 173.A OD2 no hydrogen 3.439 N/A TYR 177.A N LEU 174.A O no hydrogen 2.950 N/A LYS 178.A NZ SER 175.A O no hydrogen 3.478 N/A ASN 179.A N ASP 139.A OD1 no hydrogen 2.932 N/A ASN 179.A ND2 ASP 139.A O no hydrogen 3.002 N/A ASN 179.A ND2 GLU 143.A OE1 no hydrogen 2.881 N/A ILE 180.A N ASP 139.A OD1 no hydrogen 2.969 N/A ASN 181.A N TYR 177.A O no hydrogen 3.006 N/A ASN 181.A ND2 LEU 174.A O no hydrogen 3.114 N/A SER 182.A N LYS 178.A O no hydrogen 3.085 N/A TRP 183.A N ASN 179.A O no hydrogen 2.971 N/A TRP 183.A NE1 ASP 157.A OD1 no hydrogen 2.835 N/A TYR 184.A N ILE 180.A O no hydrogen 2.795 N/A TYR 184.A OH GLU 168.A OE1 no hydrogen 2.776 N/A SER 185.A N ASN 181.A O no hydrogen 3.237 N/A SER 185.A OG ASN 181.A O no hydrogen 3.373 N/A LYS 186.A N SER 182.A O no hydrogen 3.200 N/A LYS 186.A NZ ALA 146.A O no hydrogen 2.973 N/A VAL 187.A N TRP 183.A O no hydrogen 2.893 N/A LYS 188.A N TYR 184.A O no hydrogen 2.965 N/A ALA 189.A N SER 185.A O no hydrogen 3.385 N/A ALA 190.A N LYS 186.A O no hydrogen 2.789 N/A ALA 191.A N VAL 187.A O no hydrogen 2.919 N/A TYR 194.A N ALA 191.A O no hydrogen 3.159 N/A LYS 195.A NZ GLU 199.A OE2 no hydrogen 2.968 N/A ALA 197.A N GLY 193.A O no hydrogen 2.833 N/A ASN 198.A N TYR 194.A O no hydrogen 2.944 N/A ASN 198.A ND2 SER 165.A OG no hydrogen 3.018 N/A ASN 198.A ND2 TYR 194.A OH no hydrogen 3.049 N/A GLU 199.A N TYR 194.A O no hydrogen 3.466 N/A ALA 202.A N ASN 198.A O no hydrogen 3.013 N/A LYS 203.A N GLU 199.A O no hydrogen 3.003 N/A LYS 203.A NZ GLU 200.A OE1.A no hydrogen 2.733 N/A GLY 204.A N GLU 200.A O no hydrogen 2.814 N/A PHE 205.A N GLY 201.A O no hydrogen 2.843 N/A GLY 206.A N ALA 202.A O no hydrogen 3.010 N/A GLN 207.A N LYS 203.A O no hydrogen 2.993 N/A MET 208.A N GLY 204.A O no hydrogen 2.958 N/A PHE 209.A N PHE 205.A O no hydrogen 2.836 N/A LYS 210.A N GLY 206.A O no hydrogen 2.907 N/A ALA 211.A N GLN 207.A O no hydrogen 2.883 N/A MET 212.A N MET 208.A O no hydrogen 2.836 N/A THR 213.A N PHE 209.A O no hydrogen 2.773 N/A THR 213.A OG1 HIS 116.A NE2 no hydrogen 2.824 N/A