Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dqx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 70.A O no hydrogen 3.373 N/A ARG 6.A NH1 PRO 75.A O no hydrogen 2.779 N/A ARG 6.A NH2 GLU 73.A O no hydrogen 2.962 N/A ARG 6.A NH2 PRO 75.A O no hydrogen 3.038 N/A SER 8.A N PRO 5.A O no hydrogen 3.221 N/A SER 8.A OG PRO 5.A O no hydrogen 3.030 N/A LEU 9.A N ARG 6.A O no hydrogen 3.283 N/A ARG 10.A N THR 27.A O no hydrogen 3.014 N/A GLU 12.A N MET 25.A O no hydrogen 2.862 N/A VAL 13.A N MET 25.A O no hydrogen 3.133 N/A LEU 15.A N VAL 23.A O no hydrogen 2.912 N/A GLY 16.A N VAL 23.A O no hydrogen 3.372 N/A GLN 17.A NE2 GLU 22.A OE1 no hydrogen 2.947 N/A GLY 18.A N GLY 21.A O no hydrogen 3.239 N/A GLU 22.A N THR 38.A O no hydrogen 3.016 N/A GLU 22.A N THR 38.A OG1 no hydrogen 3.177 N/A VAL 23.A N GLY 16.A O no hydrogen 2.960 N/A TRP 24.A N ILE 36.A O no hydrogen 2.859 N/A MET 25.A N VAL 13.A O no hydrogen 2.807 N/A GLY 26.A N VAL 34.A O no hydrogen 2.974 N/A THR 27.A N ARG 10.A O no hydrogen 3.171 N/A TRP 28.A N THR 32.A O no hydrogen 2.654 N/A ASN 29.A N SER 8.A O no hydrogen 2.672 N/A THR 31.A N TRP 28.A O no hydrogen 3.318 N/A THR 32.A N TRP 28.A O no hydrogen 3.075 N/A THR 32.A OG1 TRP 28.A O no hydrogen 3.558 N/A VAL 34.A N GLY 26.A O no hydrogen 2.672 N/A ALA 35.A N THR 80.A O no hydrogen 2.985 N/A ILE 36.A N TRP 24.A O no hydrogen 2.764 N/A LYS 37.A N ILE 78.A O no hydrogen 2.920 N/A THR 38.A N GLU 22.A O no hydrogen 2.998 N/A LYS 40.A N PHE 20.A O no hydrogen 3.365 N/A THR 43.A OG1 CYS 19.A O no hydrogen 3.429 N/A THR 43.A OG1 PHE 20.A O no hydrogen 3.109 N/A THR 43.A OG1 LYS 40.A O no hydrogen 3.367 N/A ALA 48.A N SER 45.A O no hydrogen 3.124 N/A PHE 49.A N SER 45.A O no hydrogen 3.440 N/A GLN 54.A N LEU 50.A O no hydrogen 3.440 N/A VAL 55.A N GLN 51.A O no hydrogen 3.104 N/A MET 56.A N GLU 52.A O no hydrogen 3.067 N/A LYS 57.A N ALA 53.A O no hydrogen 2.922 N/A LYS 58.A N VAL 55.A O no hydrogen 3.007 N/A ARG 60.A N TYR 118.A OH no hydrogen 3.001 N/A LYS 63.A N HIS 61.A ND1 no hydrogen 2.945 N/A LYS 63.A NZ GLN 111.A OE1 no hydrogen 2.913 N/A LEU 64.A N HIS 61.A O no hydrogen 2.977 N/A VAL 65.A N VAL 144.A O no hydrogen 3.040 N/A TYR 68.A N VAL 79.A O no hydrogen 2.685 N/A ALA 69.A N VAL 79.A O no hydrogen 3.252 N/A VAL 70.A N TRP 2.A O no hydrogen 3.100 N/A VAL 71.A N TYR 77.A O no hydrogen 2.998 N/A SER 72.A N GLU 3.A OE2 no hydrogen 3.210 N/A SER 72.A OG GLU 3.A OE1 no hydrogen 2.620 N/A SER 72.A OG GLU 3.A OE2 no hydrogen 3.129 N/A TYR 77.A N VAL 71.A O no hydrogen 3.313 N/A ILE 78.A N LYS 37.A O no hydrogen 3.185 N/A VAL 79.A N ALA 69.A O no hydrogen 2.775 N/A THR 80.A N ALA 35.A O no hydrogen 2.889 N/A THR 80.A OG1 ALA 35.A O no hydrogen 3.559 N/A GLU 81.A N GLN 66.A O no hydrogen 3.047 N/A SER 84.A OG GLU 138.A OE1 no hydrogen 3.003 N/A LYS 85.A N VAL 136.A O no hydrogen 2.954 N/A GLY 86.A N MET 83.A O no hydrogen 3.245 N/A SER 87.A OG ALA 132.A O no hydrogen 3.536 N/A LEU 88.A N ILE 134.A O no hydrogen 2.809 N/A LEU 89.A N ALA 131.A O no hydrogen 3.344 N/A PHE 91.A N SER 87.A O no hydrogen 2.924 N/A LEU 92.A N LEU 88.A O no hydrogen 2.805 N/A LYS 93.A N LEU 89.A O no hydrogen 3.014 N/A GLY 94.A N ASP 90.A O no hydrogen 2.906 N/A GLY 94.A N PHE 91.A O no hydrogen 3.353 N/A GLY 97.A N GLY 94.A O no hydrogen 2.864 N/A ARG 101.A N GLN 104.A OE1 no hydrogen 2.829 N/A ARG 101.A NH1 LYS 98.A O no hydrogen 2.630 N/A ARG 101.A NH1 LEU 100.A O no hydrogen 2.751 N/A ARG 101.A NH2 LYS 98.A O no hydrogen 3.212 N/A LEU 102.A N LEU 267.A O no hydrogen 3.027 N/A LEU 105.A N ARG 101.A O no hydrogen 3.078 N/A VAL 106.A N LEU 102.A O no hydrogen 2.726 N/A ASP 107.A N PRO 103.A O no hydrogen 3.247 N/A MET 108.A N GLN 104.A O no hydrogen 3.010 N/A ALA 109.A N LEU 105.A O no hydrogen 3.037 N/A ALA 110.A N VAL 106.A O no hydrogen 2.878 N/A GLN 111.A N ASP 107.A O no hydrogen 3.074 N/A GLN 111.A NE2 ASP 107.A O no hydrogen 3.280 N/A GLN 111.A NE2 LEU 140.A O no hydrogen 3.099 N/A ILE 112.A N MET 108.A O no hydrogen 3.047 N/A ALA 113.A N ALA 109.A O no hydrogen 2.800 N/A SER 114.A N ALA 110.A O no hydrogen 2.934 N/A GLY 115.A N GLN 111.A O no hydrogen 3.073 N/A MET 116.A N ILE 112.A O no hydrogen 2.871 N/A ALA 117.A N ALA 113.A O no hydrogen 2.727 N/A TYR 118.A N SER 114.A O no hydrogen 3.239 N/A VAL 119.A N GLY 115.A O no hydrogen 3.151 N/A GLU 120.A N MET 116.A O no hydrogen 2.820 N/A ARG 121.A N ALA 117.A O no hydrogen 2.972 N/A MET 122.A N TYR 118.A O no hydrogen 2.984 N/A MET 122.A N VAL 119.A O no hydrogen 3.247 N/A ASN 123.A N GLU 120.A O no hydrogen 3.135 N/A TYR 124.A N VAL 119.A O no hydrogen 3.133 N/A VAL 125.A N ARG 151.A O no hydrogen 2.914 N/A HIS 126.A N ASP 178.A OD2 no hydrogen 2.636 N/A HIS 126.A NE2 ALA 145.A O no hydrogen 2.701 N/A ARG 127.A N ASP 178.A OD1 no hydrogen 3.055 N/A ARG 127.A NE LEU 149.A O no hydrogen 2.631 N/A ARG 127.A NH1 LEU 149.A O no hydrogen 3.067 N/A ASP 128.A N HIS 126.A ND1 no hydrogen 3.148 N/A ALA 131.A N GLU 188.A OE2 no hydrogen 2.842 N/A ASN 133.A N ARG 130.A O no hydrogen 2.818 N/A ASN 133.A ND2 ASP 128.A O no hydrogen 2.805 N/A ILE 134.A N ALA 131.A O no hydrogen 3.161 N/A LEU 135.A N LYS 143.A O no hydrogen 2.801 N/A VAL 136.A N GLY 86.A O no hydrogen 2.787 N/A GLY 137.A N VAL 141.A O no hydrogen 2.719 N/A VAL 141.A N GLU 138.A O no hydrogen 3.325 N/A CYS 142.A N GLN 111.A OE1 no hydrogen 2.873 N/A CYS 142.A SG LEU 140.A O no hydrogen 3.781 N/A LYS 143.A N LEU 135.A O no hydrogen 2.771 N/A LYS 143.A NZ GLU 62.A O no hydrogen 3.304 N/A LYS 143.A NZ GLU 81.A OE1 no hydrogen 3.079 N/A LYS 143.A NZ GLU 81.A OE2 no hydrogen 2.965 N/A VAL 144.A N LYS 63.A O no hydrogen 2.901 N/A ALA 145.A N ASN 133.A O no hydrogen 2.954 N/A PHE 147.A N GLU 52.A OE1 no hydrogen 3.164 N/A ALA 150.A N PHE 147.A O no hydrogen 2.931 N/A ARG 151.A N VAL 125.A O no hydrogen 3.145 N/A ILE 153.A N ASN 123.A O no hydrogen 2.637 N/A LYS 161.A NZ PRO 196.A O no hydrogen 3.144 N/A LYS 161.A NZ TYR 197.A O no hydrogen 3.334 N/A LYS 161.A NZ MET 200.A O no hydrogen 2.687 N/A TRP 162.A N PRO 159.A O no hydrogen 3.005 N/A TRP 162.A NE1 GLU 188.A OE2 no hydrogen 2.923 N/A THR 163.A N PRO 159.A O no hydrogen 3.054 N/A THR 163.A OG1 PRO 159.A O no hydrogen 2.806 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.811 N/A ALA 167.A N ALA 164.A O no hydrogen 2.795 N/A ALA 168.A N ALA 164.A O no hydrogen 3.000 N/A LEU 169.A N PRO 165.A O no hydrogen 2.801 N/A TYR 170.A N GLU 166.A O no hydrogen 3.008 N/A GLY 171.A N ALA 167.A O no hydrogen 3.072 N/A ARG 172.A N GLU 166.A O no hydrogen 3.247 N/A PHE 173.A N GLY 171.A O no hydrogen 3.019 N/A THR 174.A N SER 177.A OG no hydrogen 2.913 N/A LYS 176.A NZ ARG 240.A O no hydrogen 2.819 N/A SER 177.A N THR 174.A O no hydrogen 3.129 N/A SER 177.A N THR 174.A OG1 no hydrogen 3.305 N/A SER 177.A OG THR 174.A O no hydrogen 2.639 N/A ASP 178.A N THR 174.A O no hydrogen 3.406 N/A VAL 179.A N ILE 175.A O no hydrogen 3.013 N/A TRP 180.A N LYS 176.A O no hydrogen 3.115 N/A SER 181.A N SER 177.A O no hydrogen 3.167 N/A SER 181.A OG TRP 162.A O no hydrogen 2.401 N/A SER 181.A OG SER 177.A O no hydrogen 3.412 N/A PHE 182.A N ASP 178.A O no hydrogen 2.917 N/A GLY 183.A N VAL 179.A O no hydrogen 3.042 N/A ILE 184.A N TRP 180.A O no hydrogen 3.264 N/A LEU 185.A N SER 181.A O no hydrogen 2.840 N/A LEU 186.A N PHE 182.A O no hydrogen 2.905 N/A THR 187.A N GLY 183.A O no hydrogen 3.345 N/A THR 187.A N ILE 184.A O no hydrogen 2.892 N/A THR 187.A OG1 ILE 184.A O no hydrogen 2.708 N/A GLU 188.A N ILE 184.A O no hydrogen 3.122 N/A LEU 189.A N LEU 185.A O no hydrogen 2.929 N/A THR 190.A N LEU 186.A O no hydrogen 3.213 N/A THR 190.A OG1 LEU 186.A O no hydrogen 3.228 N/A THR 191.A N THR 187.A O no hydrogen 2.897 N/A THR 191.A OG1 THR 187.A O no hydrogen 2.799 N/A LYS 192.A NZ GLY 97.A O no hydrogen 3.298 N/A LYS 192.A NZ LEU 100.A O no hydrogen 2.847 N/A LYS 192.A NZ ASN 266.A O no hydrogen 2.703 N/A GLY 193.A N GLU 188.A O no hydrogen 2.753 N/A ARG 194.A N THR 191.A OG1 no hydrogen 3.325 N/A MET 200.A N TYR 197.A O no hydrogen 2.955 N/A VAL 205.A N VAL 201.A O no hydrogen 2.941 N/A LEU 206.A N ASN 202.A O no hydrogen 3.065 N/A GLN 208.A N GLU 204.A O no hydrogen 3.093 N/A VAL 209.A N VAL 205.A O no hydrogen 2.815 N/A GLU 210.A N LEU 206.A O no hydrogen 2.916 N/A ARG 211.A N ASP 207.A O no hydrogen 2.946 N/A GLY 212.A N VAL 209.A O no hydrogen 3.260 N/A TYR 213.A N GLN 208.A O no hydrogen 2.860 N/A ARG 214.A NE TRP 233.A O no hydrogen 2.820 N/A ARG 214.A NH1 VAL 209.A O no hydrogen 3.094 N/A ARG 214.A NH1 TYR 213.A O no hydrogen 2.772 N/A ARG 214.A NH2 TRP 233.A O no hydrogen 2.775 N/A CYS 217.A SG PRO 218.A O no hydrogen 3.764 N/A CYS 217.A SG CYS 221.A O no hydrogen 2.980 N/A CYS 217.A SG GLU 223.A OE1 no hydrogen 3.492 N/A CYS 221.A N PRO 218.A O no hydrogen 3.002 N/A CYS 221.A SG PRO 222.A O no hydrogen 3.509 N/A SER 224.A OG TYR 253.A OH no hydrogen 2.901 N/A SER 224.A OG GLU 258.A OE2 no hydrogen 2.702 N/A LEU 225.A N PRO 222.A O no hydrogen 3.019 N/A HIS 226.A N PRO 222.A O no hydrogen 3.240 N/A HIS 226.A ND1 GLU 223.A OE2 no hydrogen 2.845 N/A HIS 226.A NE2 MET 215.A O no hydrogen 2.824 N/A ASP 227.A N GLU 223.A O no hydrogen 2.712 N/A LEU 228.A N SER 224.A O no hydrogen 3.371 N/A MET 229.A N LEU 225.A O no hydrogen 3.045 N/A CYS 230.A N HIS 226.A O no hydrogen 2.898 N/A CYS 230.A SG HIS 226.A O no hydrogen 3.540 N/A GLN 231.A N ASP 227.A O no hydrogen 3.019 N/A CYS 232.A N LEU 228.A O no hydrogen 3.246 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.374 N/A TRP 233.A N MET 229.A O no hydrogen 3.152 N/A TRP 233.A N CYS 230.A O no hydrogen 3.180 N/A ARG 234.A NH1 GLU 239.A O no hydrogen 2.916 N/A GLU 239.A N ASP 236.A O no hydrogen 3.161 N/A ARG 240.A N PRO 237.A O no hydrogen 3.095 N/A ARG 240.A NE LYS 176.A O no hydrogen 3.279 N/A ARG 240.A NH1 GLU 166.A OE1 no hydrogen 3.394 N/A ARG 240.A NH1 ARG 234.A O no hydrogen 2.989 N/A ARG 240.A NH2 GLU 166.A OE2 no hydrogen 2.784 N/A ARG 240.A NH2 LYS 176.A O no hydrogen 2.709 N/A PHE 243.A N GLU 120.A OE2 no hydrogen 2.923 N/A GLU 244.A N GLU 120.A OE1 no hydrogen 3.391 N/A TYR 245.A N THR 242.A OG1 no hydrogen 2.887 N/A LEU 246.A N THR 242.A O no hydrogen 2.952 N/A GLN 247.A N PHE 243.A O no hydrogen 2.714 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 2.750 N/A ALA 248.A N GLU 244.A O no hydrogen 3.181 N/A PHE 249.A N TYR 245.A O no hydrogen 2.914 N/A LEU 250.A N LEU 246.A O no hydrogen 2.983 N/A GLU 251.A N GLN 247.A O no hydrogen 2.901 N/A ASP 252.A N ALA 248.A O no hydrogen 3.152 N/A TYR 253.A N LEU 250.A O no hydrogen 3.405 N/A TYR 253.A OH SER 224.A OG no hydrogen 2.901 N/A THR 255.A N ASP 252.A O no hydrogen 2.949 N/A SER 256.A N ASP 252.A O no hydrogen 2.922 N/A THR 257.A N TYR 253.A O no hydrogen 3.008 N/A GLU 258.A N TYR 253.A O no hydrogen 2.785 N/A TYR 261.A N GLU 258.A O no hydrogen 3.389 N/A TYR 261.A OH LEU 267.A O no hydrogen 2.379 N/A GLY 264.A N LEU 267.A OXT no hydrogen 2.689 N/A ASN 266.A N GLU 220.A OE2 no hydrogen 2.680 N/A LEU 267.A N GLU 220.A OE2 no hydrogen 2.813 N/A