Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s50_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 SER 4.A O no hydrogen 3.016 N/A ARG 3.A NH1 ASP 83.A OD2 no hydrogen 2.936 N/A ARG 3.A NH2 ASP 83.A OD1 no hydrogen 2.619 N/A ARG 3.A NH2 ASP 83.A OD2 no hydrogen 3.513 N/A SER 4.A OG THR 49.A OG1 no hydrogen 2.845 N/A LEU 5.A N THR 49.A O no hydrogen 2.849 N/A ILE 6.A N ASP 83.A OD2 no hydrogen 2.712 N/A VAL 7.A N GLU 51.A O no hydrogen 2.875 N/A THR 8.A N LEU 84.A O no hydrogen 2.869 N/A THR 8.A OG1 GLU 76.A OE1 no hydrogen 2.716 N/A THR 9.A N ARG 53.A O no hydrogen 3.283 N/A THR 9.A OG1 VAL 86.A O no hydrogen 2.728 N/A GLU 12.A N VAL 16.A O no hydrogen 2.806 N/A TYR 15.A N GLU 12.A O no hydrogen 2.791 N/A TYR 15.A OH THR 192.A OG1 no hydrogen 3.121 N/A TYR 15.A OH THR 193.A OG1 no hydrogen 2.980 N/A VAL 16.A N GLU 12.A O no hydrogen 2.843 N/A LEU 17.A N GLU 32.A O no hydrogen 2.961 N/A LYS 19.A N ARG 30.A O no hydrogen 2.887 N/A SER 21.A OG LYS 23.A O no hydrogen 2.556 N/A ASN 28.A ND2 TYR 50.A O no hydrogen 2.852 N/A ASP 29.A N TYR 26.A O no hydrogen 3.132 N/A ARG 30.A N GLY 27.A O no hydrogen 3.080 N/A ARG 30.A NE GLY 27.A O no hydrogen 2.804 N/A PHE 31.A N ASN 28.A O no hydrogen 3.186 N/A GLU 32.A N LEU 17.A O no hydrogen 3.098 N/A TYR 34.A N PRO 14.A O no hydrogen 2.957 N/A CYS 35.A N TYR 15.A O no hydrogen 2.891 N/A ASP 37.A N GLY 33.A O no hydrogen 2.882 N/A LEU 38.A N TYR 34.A O no hydrogen 2.892 N/A LEU 39.A N CYS 35.A O no hydrogen 2.866 N/A ARG 40.A N ILE 36.A O no hydrogen 2.947 N/A GLU 41.A N ASP 37.A O no hydrogen 3.044 N/A LEU 42.A N LEU 38.A O no hydrogen 2.907 N/A SER 43.A N LEU 39.A O no hydrogen 2.920 N/A SER 43.A OG LEU 39.A O no hydrogen 3.532 N/A SER 43.A OG ARG 40.A O no hydrogen 2.614 N/A THR 44.A N ARG 40.A O no hydrogen 3.190 N/A THR 44.A OG1 ARG 40.A O no hydrogen 3.514 N/A THR 44.A OG1 GLU 41.A O no hydrogen 2.919 N/A ILE 45.A N GLU 41.A O no hydrogen 2.925 N/A LEU 46.A N LEU 42.A O no hydrogen 2.871 N/A GLY 47.A N SER 43.A O no hydrogen 2.736 N/A PHE 48.A N SER 43.A O no hydrogen 2.934 N/A THR 49.A OG1 SER 4.A OG no hydrogen 2.845 N/A GLU 51.A N LEU 5.A O no hydrogen 2.891 N/A ILE 52.A N ASN 28.A OD1 no hydrogen 2.804 N/A ARG 53.A N VAL 7.A O no hydrogen 2.860 N/A ARG 53.A NE GLU 51.A OE2 no hydrogen 2.576 N/A ARG 53.A NH2 GLU 51.A OE1 no hydrogen 3.522 N/A VAL 55.A N THR 9.A O no hydrogen 2.845 N/A GLU 56.A N GLU 76.A OE2 no hydrogen 3.070 N/A GLY 58.A N VAL 55.A O no hydrogen 3.017 N/A LYS 59.A N ASP 57.A OD1 no hydrogen 2.852 N/A LYS 59.A NZ ASP 139.A OD2 no hydrogen 2.956 N/A TYR 60.A OH GLU 12.A OE2 no hydrogen 2.556 N/A GLY 61.A N ASP 139.A O no hydrogen 3.042 N/A ALA 62.A N ASN 71.A OD1 no hydrogen 2.892 N/A GLN 63.A NE2 GLY 68.A O no hydrogen 2.586 N/A ASP 64.A N GLN 69.A O no hydrogen 2.859 N/A VAL 66.A N ASP 64.A OD1 no hydrogen 2.684 N/A ASN 67.A N ASP 64.A OD1 no hydrogen 3.166 N/A GLY 68.A N ASP 64.A O no hydrogen 2.975 N/A GLN 69.A N ASN 67.A OD1 no hydrogen 2.648 N/A ASN 71.A ND2 ASP 139.A OD2 no hydrogen 3.359 N/A GLY 72.A N ASP 57.A OD2 no hydrogen 2.769 N/A MET 73.A N LYS 59.A O no hydrogen 3.136 N/A VAL 74.A N TYR 60.A O no hydrogen 3.354 N/A ARG 75.A N ASN 71.A O no hydrogen 3.177 N/A ARG 75.A NE ASP 79.A OD1 no hydrogen 3.505 N/A ARG 75.A NE ASP 79.A OD2 no hydrogen 2.626 N/A ARG 75.A NH1 GLN 69.A OE1 no hydrogen 3.124 N/A ARG 75.A NH1 TRP 70.A O no hydrogen 2.702 N/A ARG 75.A NH2 GLN 69.A OE1 no hydrogen 3.089 N/A GLU 76.A N GLY 72.A O no hydrogen 3.117 N/A LEU 77.A N MET 73.A O no hydrogen 3.121 N/A ILE 78.A N VAL 74.A O no hydrogen 3.016 N/A ASP 79.A N ARG 75.A O no hydrogen 2.936 N/A HIS 80.A N LEU 77.A O no hydrogen 2.968 N/A LYS 81.A N GLU 76.A O no hydrogen 2.724 N/A ASP 83.A N ILE 6.A O no hydrogen 2.769 N/A LEU 84.A N ILE 6.A O no hydrogen 3.217 N/A ALA 85.A N GLY 219.A O no hydrogen 2.828 N/A VAL 86.A N THR 8.A O no hydrogen 3.144 N/A LEU 89.A N ALA 87.A O no hydrogen 2.645 N/A ILE 91.A N GLY 215.A O no hydrogen 2.880 N/A ARG 95.A N THR 92.A OG1 no hydrogen 3.406 N/A ARG 95.A NH1 ALA 90.A O no hydrogen 2.993 N/A ARG 95.A NH2 GLY 61.A O no hydrogen 2.896 N/A GLU 96.A N THR 92.A O no hydrogen 2.864 N/A LYS 97.A N TYR 93.A O no hydrogen 3.224 N/A VAL 98.A N ARG 95.A O no hydrogen 2.991 N/A ILE 99.A N ARG 95.A O no hydrogen 2.952 N/A ASP 100.A N THR 220.A O no hydrogen 3.004 N/A SER 102.A N VAL 218.A O no hydrogen 2.900 N/A SER 102.A OG LYS 103.A O no hydrogen 2.935 N/A LYS 103.A N THR 231.A OG1 no hydrogen 2.947 N/A PHE 105.A N TYR 216.A O no hydrogen 2.916 N/A LEU 108.A N LYS 214.A O no hydrogen 2.789 N/A GLY 109.A N SER 191.A OG no hydrogen 3.025 N/A ILE 110.A N ASP 212.A OD1 no hydrogen 2.706 N/A SER 111.A N MET 189.A O no hydrogen 2.977 N/A SER 111.A OG ILE 207.A O no hydrogen 3.532 N/A SER 111.A OG GLY 209.A O no hydrogen 2.794 N/A LEU 113.A N PHE 187.A O no hydrogen 2.730 N/A TYR 114.A N THR 205.A O no hydrogen 3.000 N/A TYR 114.A OH ASP 184.A OD1 no hydrogen 2.733 N/A ARG 115.A NH1 ASP 184.A OD1 no hydrogen 2.869 N/A ARG 115.A NH2 ASP 184.A OD1 no hydrogen 3.110 N/A LYS 116.A N ASN 203.A O no hydrogen 3.409 N/A LYS 116.A NZ CYS 202.A O no hydrogen 2.893 N/A ASP 121.A N ASP 125.A OD2 no hydrogen 2.705 N/A SER 122.A N ASP 125.A OD2 no hydrogen 3.279 N/A ASP 125.A N SER 122.A O no hydrogen 3.053 N/A LEU 126.A N ALA 123.A O no hydrogen 2.952 N/A ALA 127.A N ALA 123.A O no hydrogen 2.856 N/A LYS 128.A N ASP 124.A O no hydrogen 3.294 N/A GLN 129.A N LEU 126.A O no hydrogen 3.257 N/A GLN 129.A NE2 LEU 126.A O no hydrogen 3.016 N/A GLN 129.A NE2 ILE 132.A O no hydrogen 2.868 N/A ILE 132.A N GLN 129.A OE1 no hydrogen 2.721 N/A GLU 133.A N ASP 184.A O no hydrogen 3.023 N/A GLU 138.A N VAL 170.A O no hydrogen 2.749 N/A THR 144.A N GLY 140.A O no hydrogen 3.143 N/A THR 144.A OG1 GLY 140.A O no hydrogen 3.141 N/A PHE 145.A N ALA 141.A O no hydrogen 2.833 N/A PHE 146.A N THR 142.A O no hydrogen 3.275 N/A LYS 147.A N MET 143.A O no hydrogen 2.935 N/A LYS 147.A NZ ASP 65.A OD2 no hydrogen 3.090 N/A LYS 148.A N THR 144.A O no hydrogen 3.191 N/A SER 149.A N PHE 145.A O no hydrogen 3.059 N/A ILE 151.A N SER 149.A OG no hydrogen 3.188 N/A THR 153.A OG1 ASP 124.A OD1 no hydrogen 3.109 N/A ASP 155.A N ILE 151.A O no hydrogen 2.784 N/A LYS 156.A N SER 152.A O no hydrogen 3.037 N/A LYS 156.A NZ ALA 127.A O no hydrogen 2.869 N/A MET 157.A N THR 153.A O no hydrogen 3.081 N/A TRP 158.A N TYR 154.A O no hydrogen 2.956 N/A ALA 159.A N ASP 155.A O no hydrogen 3.027 N/A PHE 160.A N LYS 156.A O no hydrogen 3.077 N/A MET 161.A N MET 157.A O no hydrogen 2.962 N/A SER 162.A N TRP 158.A O no hydrogen 2.744 N/A SER 163.A N ALA 159.A O no hydrogen 3.359 N/A SER 163.A OG ALA 159.A O no hydrogen 3.510 N/A SER 163.A OG PHE 160.A O no hydrogen 3.324 N/A ARG 164.A N MET 161.A O no hydrogen 3.106 N/A ARG 164.A NH1 PHE 160.A O no hydrogen 3.141 N/A ARG 165.A N SER 162.A O no hydrogen 3.418 N/A SER 167.A N ARG 164.A O no hydrogen 2.885 N/A SER 167.A OG ARG 164.A O no hydrogen 3.155 N/A VAL 168.A N ARG 164.A O no hydrogen 2.924 N/A LEU 169.A N ARG 165.A O no hydrogen 3.072 N/A VAL 170.A N ALA 136.A O no hydrogen 2.925 N/A ASN 173.A ND2 GLU 12.A OE2 no hydrogen 2.717 N/A GLU 175.A N SER 172.A OG no hydrogen 3.220 N/A GLY 176.A N SER 172.A O no hydrogen 3.062 N/A ILE 177.A N ASN 173.A O no hydrogen 2.936 N/A GLN 178.A N GLU 174.A O no hydrogen 2.994 N/A GLN 178.A NE2 GLU 174.A O no hydrogen 3.268 N/A ARG 179.A N GLU 175.A O no hydrogen 2.881 N/A ARG 179.A NE GLU 175.A OE1 no hydrogen 2.826 N/A ARG 179.A NH1 SER 167.A O no hydrogen 2.962 N/A VAL 180.A N GLY 176.A O no hydrogen 3.171 N/A LEU 181.A N ILE 177.A O no hydrogen 3.097 N/A THR 182.A N GLN 178.A O no hydrogen 2.897 N/A THR 182.A N ARG 179.A O no hydrogen 3.227 N/A THR 182.A OG1 GLN 178.A O no hydrogen 2.820 N/A SER 183.A OG ARG 179.A O no hydrogen 2.805 N/A TYR 185.A OH VAL 168.A O no hydrogen 2.646 N/A ALA 186.A N GLU 133.A O no hydrogen 2.838 N/A PHE 187.A N LEU 113.A O no hydrogen 2.861 N/A LEU 188.A N GLY 135.A O no hydrogen 2.926 N/A MET 189.A N SER 111.A O no hydrogen 3.053 N/A SER 191.A N GLY 109.A O no hydrogen 2.728 N/A SER 191.A OG GLY 109.A O no hydrogen 3.150 N/A THR 192.A OG1 TYR 15.A OH no hydrogen 3.121 N/A THR 192.A OG1 TYR 216.A OH no hydrogen 3.075 N/A THR 193.A OG1 TYR 15.A OH no hydrogen 2.980 N/A ILE 194.A N GLU 190.A O no hydrogen 2.935 N/A GLU 195.A N SER 191.A O no hydrogen 2.847 N/A PHE 196.A N THR 192.A O no hydrogen 3.298 N/A VAL 197.A N THR 193.A O no hydrogen 2.965 N/A THR 198.A N ILE 194.A O no hydrogen 2.831 N/A THR 198.A OG1 ILE 194.A O no hydrogen 2.961 N/A THR 198.A OG1 GLU 195.A O no hydrogen 3.386 N/A GLN 199.A N GLU 195.A O no hydrogen 3.314 N/A ARG 200.A N VAL 197.A O no hydrogen 3.040 N/A ARG 200.A NH1 PHE 196.A O no hydrogen 3.122 N/A ASN 201.A N VAL 197.A O no hydrogen 2.864 N/A ASN 203.A N ASN 201.A OD1 no hydrogen 2.998 N/A ASN 203.A ND2 ASN 201.A OD1 no hydrogen 3.060 N/A LEU 204.A N ASN 201.A O no hydrogen 3.152 N/A THR 205.A N TYR 114.A O no hydrogen 2.874 N/A THR 205.A OG1 GLN 206.A O no hydrogen 3.466 N/A GLN 206.A NE2 GLY 208.A O no hydrogen 3.025 N/A ILE 207.A N ILE 112.A O no hydrogen 2.767 N/A ILE 211.A N ILE 110.A O no hydrogen 2.703 N/A LYS 214.A N LEU 108.A O no hydrogen 2.917 N/A LYS 214.A NZ ASP 212.A OD2 no hydrogen 2.830 N/A TYR 216.A N MET 106.A O no hydrogen 2.862 N/A TYR 216.A OH GLU 190.A OE1 no hydrogen 2.545 N/A TYR 216.A OH THR 192.A OG1 no hydrogen 3.075 N/A GLY 217.A N LEU 89.A O no hydrogen 3.048 N/A VAL 218.A N SER 102.A OG no hydrogen 2.933 N/A GLY 219.A N ALA 85.A O no hydrogen 3.022 N/A THR 220.A N ASP 100.A O no hydrogen 2.920 N/A THR 220.A OG1 PRO 221.A O no hydrogen 3.191 N/A GLY 223.A N ASP 100.A OD2 no hydrogen 2.916 N/A SER 224.A N PRO 221.A O no hydrogen 3.061 N/A TYR 226.A N SER 224.A OG no hydrogen 3.100 N/A ARG 227.A NE ASP 228.A OD1 no hydrogen 3.050 N/A ARG 227.A NH1 PHE 101.A O no hydrogen 3.009 N/A ILE 230.A N TYR 226.A O no hydrogen 2.761 N/A THR 231.A N ARG 227.A O no hydrogen 2.996 N/A THR 231.A OG1 ARG 227.A O no hydrogen 3.438 N/A ILE 232.A N ASP 228.A O no hydrogen 3.161 N/A ALA 233.A N LYS 229.A O no hydrogen 3.138 N/A ILE 234.A N ILE 230.A O no hydrogen 2.833 N/A LEU 235.A N THR 231.A O no hydrogen 2.962 N/A GLN 236.A N ILE 232.A O no hydrogen 2.958 N/A GLN 236.A NE2 GLU 240.A OE2 no hydrogen 3.205 N/A LEU 237.A N ALA 233.A O no hydrogen 2.936 N/A GLN 238.A N ILE 234.A O no hydrogen 2.823 N/A GLU 239.A N LEU 235.A O no hydrogen 2.868 N/A GLU 240.A N GLN 236.A O no hydrogen 3.066 N/A GLY 241.A N GLN 238.A O no hydrogen 2.993 N/A LYS 242.A NZ GLU 41.A OE1 no hydrogen 3.499 N/A LYS 242.A NZ GLU 41.A OE2 no hydrogen 2.619 N/A LEU 243.A N LEU 237.A O no hydrogen 3.286 N/A MET 245.A N GLY 241.A O no hydrogen 3.044 N/A MET 246.A N LYS 242.A O no hydrogen 2.842 N/A LYS 247.A N LEU 243.A O no hydrogen 2.960 N/A GLU 248.A N HIS 244.A O no hydrogen 3.040 N/A LYS 249.A N MET 245.A O no hydrogen 2.875 N/A TRP 250.A N MET 246.A O no hydrogen 3.164 N/A TRP 250.A NE1 ASP 37.A OD2 no hydrogen 2.845 N/A TRP 251.A N LYS 247.A O no hydrogen 2.881 N/A TRP 251.A NE1 THR 192.A O no hydrogen 2.926 N/A GLY 255.A N GLY 253.A O no hydrogen 2.443 N/A CYS 256.A SG THR 198.A O no hydrogen 3.195 N/A