Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qq7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N ASP 2.A OD2 no hydrogen 3.023 N/A GLU 5.A N ASP 2.A O no hydrogen 3.263 N/A ILE 6.A N VAL 60.A O no hydrogen 3.236 N/A ARG 8.A NH1 GLU 63.A O no hydrogen 2.424 N/A ARG 8.A NH1 PRO 65.A O no hydrogen 3.333 N/A ARG 8.A NH2 PRO 65.A O no hydrogen 2.391 N/A SER 10.A N PRO 7.A O no hydrogen 3.178 N/A SER 10.A OG PRO 7.A O no hydrogen 2.470 N/A LEU 11.A N ARG 8.A O no hydrogen 2.826 N/A ARG 12.A N THR 28.A O no hydrogen 2.987 N/A GLU 14.A N MET 26.A O no hydrogen 2.918 N/A VAL 15.A N MET 26.A O no hydrogen 3.354 N/A VAL 24.A N GLY 18.A O no hydrogen 3.276 N/A TRP 25.A N ILE 37.A O no hydrogen 2.834 N/A MET 26.A N VAL 15.A O no hydrogen 3.000 N/A THR 28.A N ARG 12.A O no hydrogen 2.979 N/A THR 28.A OG1 GLU 14.A OE2 no hydrogen 2.806 N/A ASN 30.A N SER 10.A O no hydrogen 2.822 N/A THR 32.A N TRP 29.A O no hydrogen 3.158 N/A THR 33.A N TRP 29.A O no hydrogen 2.874 N/A THR 33.A OG1 TRP 29.A O no hydrogen 2.836 N/A VAL 35.A N GLY 27.A O no hydrogen 3.464 N/A ALA 36.A N MET 70.A O no hydrogen 2.980 N/A ILE 37.A N TRP 25.A O no hydrogen 2.692 N/A LYS 38.A N ILE 68.A O no hydrogen 2.894 N/A LYS 38.A NZ GLU 42.A OE1 no hydrogen 3.143 N/A THR 39.A N GLU 23.A O no hydrogen 3.191 N/A THR 39.A OG1 GLU 23.A O no hydrogen 3.201 N/A MET 46.A N GLU 42.A O no hydrogen 2.617 N/A LYS 47.A NZ ASP 2.A OD1 no hydrogen 3.025 N/A LYS 48.A N VAL 45.A O no hydrogen 2.539 N/A ARG 50.A N TYR 108.A OH no hydrogen 2.661 N/A LYS 53.A N HIS 51.A ND1 no hydrogen 2.930 N/A LYS 53.A NZ GLN 101.A OE1 no hydrogen 2.695 N/A LEU 54.A N HIS 51.A O no hydrogen 3.113 N/A VAL 55.A N VAL 134.A O no hydrogen 3.062 N/A GLN 56.A N GLU 71.A OE1 no hydrogen 2.772 N/A GLN 56.A NE2 LEU 57.A O no hydrogen 2.656 N/A TYR 58.A N VAL 69.A O no hydrogen 2.801 N/A ALA 59.A N VAL 69.A O no hydrogen 3.339 N/A VAL 60.A N TRP 4.A O no hydrogen 3.037 N/A VAL 61.A N TYR 67.A O no hydrogen 2.962 N/A SER 62.A N GLU 5.A OE2 no hydrogen 2.691 N/A ILE 68.A N LYS 38.A O no hydrogen 3.182 N/A VAL 69.A N ALA 59.A O no hydrogen 2.777 N/A MET 70.A N ALA 36.A O no hydrogen 2.926 N/A GLU 71.A N GLN 56.A O no hydrogen 2.721 N/A SER 74.A OG GLU 128.A OE1 no hydrogen 2.413 N/A LYS 75.A N VAL 126.A O no hydrogen 2.955 N/A GLY 76.A N MET 73.A O no hydrogen 3.277 N/A LEU 78.A N ILE 124.A O no hydrogen 2.595 N/A LEU 79.A N ALA 121.A O no hydrogen 3.294 N/A PHE 81.A N CYS 77.A O no hydrogen 3.263 N/A LEU 82.A N LEU 78.A O no hydrogen 2.768 N/A LYS 83.A N LEU 79.A O no hydrogen 2.872 N/A GLY 84.A N ASP 80.A O no hydrogen 2.908 N/A TYR 89.A N MET 86.A O no hydrogen 2.839 N/A LEU 90.A N MET 86.A O no hydrogen 3.268 N/A ARG 91.A N GLN 94.A OE1 no hydrogen 2.961 N/A ARG 91.A NE LEU 90.A O no hydrogen 3.105 N/A ARG 91.A NE ASN 250.A O no hydrogen 3.265 N/A ARG 91.A NH2 LEU 90.A O no hydrogen 3.377 N/A LEU 92.A N LEU 251.A OXT no hydrogen 2.840 N/A LEU 95.A N ARG 91.A O no hydrogen 2.994 N/A VAL 96.A N LEU 92.A O no hydrogen 2.891 N/A ASP 97.A N PRO 93.A O no hydrogen 3.118 N/A MET 98.A N GLN 94.A O no hydrogen 3.172 N/A ALA 99.A N LEU 95.A O no hydrogen 2.981 N/A ALA 100.A N VAL 96.A O no hydrogen 2.953 N/A GLN 101.A N ASP 97.A O no hydrogen 3.149 N/A GLN 101.A NE2 ASP 97.A O no hydrogen 3.442 N/A GLN 101.A NE2 LEU 130.A O no hydrogen 3.160 N/A ILE 102.A N MET 98.A O no hydrogen 3.070 N/A ALA 103.A N ALA 99.A O no hydrogen 2.815 N/A SER 104.A N ALA 100.A O no hydrogen 2.911 N/A GLY 105.A N GLN 101.A O no hydrogen 2.960 N/A MET 106.A N ILE 102.A O no hydrogen 2.760 N/A ALA 107.A N ALA 103.A O no hydrogen 2.636 N/A TYR 108.A N SER 104.A O no hydrogen 3.150 N/A VAL 109.A N GLY 105.A O no hydrogen 3.288 N/A GLU 110.A N MET 106.A O no hydrogen 2.963 N/A ARG 111.A N ALA 107.A O no hydrogen 2.917 N/A MET 112.A N TYR 108.A O no hydrogen 2.930 N/A ASN 113.A N GLU 110.A O no hydrogen 3.175 N/A TYR 114.A N VAL 109.A O no hydrogen 2.971 N/A VAL 115.A N ARG 141.A O no hydrogen 2.803 N/A HIS 116.A N ASP 162.A OD2 no hydrogen 2.711 N/A HIS 116.A NE2 ALA 135.A O no hydrogen 2.923 N/A ARG 117.A N ASP 162.A OD1 no hydrogen 3.090 N/A ASP 118.A N HIS 116.A ND1 no hydrogen 2.995 N/A ARG 120.A NE.A ASP 118.A OD1 no hydrogen 2.679 N/A ARG 120.A NH2.A ASP 118.A OD2 no hydrogen 3.171 N/A ALA 121.A N GLU 172.A OE2 no hydrogen 2.989 N/A ASN 123.A N ARG 120.A O no hydrogen 2.930 N/A ASN 123.A ND2 ASP 118.A O no hydrogen 2.799 N/A ASN 123.A ND2 ASP 118.A OD2 no hydrogen 3.171 N/A ILE 124.A N ALA 121.A O no hydrogen 3.303 N/A LEU 125.A N LYS 133.A O no hydrogen 2.944 N/A VAL 126.A N GLY 76.A O no hydrogen 2.759 N/A GLY 127.A N VAL 131.A O no hydrogen 2.979 N/A VAL 131.A N GLU 128.A O no hydrogen 3.289 N/A CYS 132.A N GLN 101.A OE1 no hydrogen 2.955 N/A CYS 132.A SG LEU 130.A O no hydrogen 3.825 N/A LYS 133.A N LEU 125.A O no hydrogen 2.985 N/A LYS 133.A NZ GLU 52.A O no hydrogen 2.912 N/A LYS 133.A NZ GLU 71.A OE2 no hydrogen 2.640 N/A VAL 134.A N LYS 53.A O no hydrogen 2.898 N/A ALA 135.A N ASN 123.A O no hydrogen 2.993 N/A ALA 140.A N PHE 137.A O no hydrogen 2.673 N/A ARG 141.A N VAL 115.A O no hydrogen 2.978 N/A LYS 145.A NZ PRO 180.A O no hydrogen 3.254 N/A LYS 145.A NZ TYR 181.A O no hydrogen 3.391 N/A LYS 145.A NZ MET 184.A O no hydrogen 2.857 N/A TRP 146.A N PRO 143.A O no hydrogen 3.363 N/A TRP 146.A NE1 GLU 172.A OE2 no hydrogen 2.838 N/A THR 147.A N ILE 144.A O no hydrogen 3.127 N/A THR 147.A OG1 PRO 143.A O no hydrogen 2.563 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.955 N/A ALA 151.A N ALA 148.A O no hydrogen 2.930 N/A ALA 152.A N ALA 148.A O no hydrogen 2.888 N/A LEU 153.A N PRO 149.A O no hydrogen 2.843 N/A TYR 154.A N GLU 150.A O no hydrogen 2.820 N/A GLY 155.A N ALA 151.A O no hydrogen 3.208 N/A THR 158.A N SER 161.A OG no hydrogen 2.750 N/A LYS 160.A N THR 158.A OG1 no hydrogen 3.082 N/A LYS 160.A NZ ARG 224.A O no hydrogen 2.572 N/A SER 161.A N THR 158.A OG1 no hydrogen 3.322 N/A SER 161.A OG THR 158.A O no hydrogen 3.031 N/A ASP 162.A N THR 158.A O no hydrogen 3.211 N/A VAL 163.A N ILE 159.A O no hydrogen 3.112 N/A TRP 164.A N LYS 160.A O no hydrogen 3.251 N/A SER 165.A N SER 161.A O no hydrogen 3.122 N/A SER 165.A OG TRP 146.A O no hydrogen 2.463 N/A SER 165.A OG SER 161.A O no hydrogen 3.219 N/A PHE 166.A N ASP 162.A O no hydrogen 2.836 N/A GLY 167.A N VAL 163.A O no hydrogen 2.972 N/A ILE 168.A N TRP 164.A O no hydrogen 3.380 N/A LEU 169.A N SER 165.A O no hydrogen 2.874 N/A LEU 170.A N PHE 166.A O no hydrogen 2.892 N/A THR 171.A N GLY 167.A O no hydrogen 3.243 N/A THR 171.A OG1 ILE 168.A O no hydrogen 2.574 N/A GLU 172.A N ILE 168.A O no hydrogen 3.075 N/A LEU 173.A N LEU 169.A O no hydrogen 3.017 N/A THR 174.A N LEU 170.A O no hydrogen 3.090 N/A THR 174.A OG1 LEU 170.A O no hydrogen 3.122 N/A THR 174.A OG1 THR 171.A O no hydrogen 3.570 N/A THR 175.A N GLU 172.A O no hydrogen 3.413 N/A THR 175.A OG1 THR 171.A O no hydrogen 2.747 N/A THR 175.A OG1 GLU 172.A O no hydrogen 3.452 N/A LYS 176.A N LEU 173.A O no hydrogen 3.437 N/A LYS 176.A NZ LEU 90.A O no hydrogen 3.266 N/A LYS 176.A NZ ASN 250.A O no hydrogen 2.915 N/A GLY 177.A N GLU 172.A O no hydrogen 2.467 N/A ARG 178.A N THR 175.A OG1 no hydrogen 3.230 N/A MET 184.A N TYR 181.A O no hydrogen 3.044 N/A VAL 185.A N GLU 188.A OE1 no hydrogen 3.145 N/A VAL 189.A N VAL 185.A O no hydrogen 2.968 N/A LEU 190.A N ASN 186.A O no hydrogen 2.988 N/A ASP 191.A N ARG 187.A O no hydrogen 3.158 N/A GLN 192.A N GLU 188.A O no hydrogen 2.881 N/A VAL 193.A N VAL 189.A O no hydrogen 2.943 N/A GLU 194.A N LEU 190.A O no hydrogen 3.326 N/A ARG 195.A N ASP 191.A O no hydrogen 3.223 N/A GLY 196.A N VAL 193.A O no hydrogen 3.150 N/A TYR 197.A N GLN 192.A O no hydrogen 2.867 N/A ARG 198.A NE TRP 217.A O no hydrogen 2.830 N/A ARG 198.A NH1 VAL 193.A O no hydrogen 3.226 N/A ARG 198.A NH1 TYR 197.A O no hydrogen 2.956 N/A ARG 198.A NH2 TRP 217.A O no hydrogen 2.801 N/A CYS 201.A SG PRO 202.A O no hydrogen 3.746 N/A CYS 201.A SG CYS 205.A O no hydrogen 3.059 N/A CYS 201.A SG GLU 207.A OE2 no hydrogen 3.890 N/A CYS 205.A N PRO 202.A O no hydrogen 3.113 N/A CYS 205.A SG PRO 206.A O no hydrogen 3.475 N/A SER 208.A OG TYR 237.A OH no hydrogen 2.725 N/A SER 208.A OG GLU 242.A OE2 no hydrogen 2.747 N/A LEU 209.A N PRO 206.A O no hydrogen 2.974 N/A HIS 210.A N PRO 206.A O no hydrogen 3.207 N/A HIS 210.A NE2 MET 199.A O no hydrogen 2.883 N/A ASP 211.A N GLU 207.A O no hydrogen 2.811 N/A LEU 212.A N SER 208.A O no hydrogen 3.295 N/A MET 213.A N LEU 209.A O no hydrogen 3.006 N/A CYS 214.A N HIS 210.A O no hydrogen 2.866 N/A CYS 214.A SG HIS 210.A O no hydrogen 3.404 N/A GLN 215.A N ASP 211.A O no hydrogen 3.007 N/A GLN 215.A NE2 ASP 211.A OD1.A no hydrogen 2.987 N/A CYS 216.A N LEU 212.A O no hydrogen 3.161 N/A CYS 216.A SG LEU 212.A O no hydrogen 3.472 N/A TRP 217.A N MET 213.A O no hydrogen 3.091 N/A ARG 218.A N GLN 215.A O no hydrogen 3.265 N/A ARG 218.A NH1 GLU 223.A O no hydrogen 2.814 N/A GLU 223.A N ASP 220.A O no hydrogen 2.820 N/A ARG 224.A N PRO 221.A O no hydrogen 3.151 N/A ARG 224.A NE ARG 218.A O no hydrogen 2.748 N/A ARG 224.A NH1 GLU 150.A OE2 no hydrogen 2.949 N/A ARG 224.A NH1 LYS 160.A O no hydrogen 3.059 N/A ARG 224.A NH2 GLU 150.A OE1 no hydrogen 2.970 N/A ARG 224.A NH2 ARG 218.A O no hydrogen 2.944 N/A PHE 227.A N GLU 110.A OE2 no hydrogen 2.889 N/A LEU 230.A N THR 226.A O no hydrogen 2.994 N/A GLN 231.A N PHE 227.A O no hydrogen 2.764 N/A GLN 231.A NE2 GLU 235.A OE2 no hydrogen 3.058 N/A ALA 232.A N GLU 228.A O no hydrogen 3.171 N/A PHE 233.A N TYR 229.A O no hydrogen 2.931 N/A LEU 234.A N LEU 230.A O no hydrogen 3.176 N/A GLU 235.A N GLN 231.A O no hydrogen 2.861 N/A ASP 236.A N ALA 232.A O no hydrogen 3.009 N/A TYR 237.A N LEU 234.A O no hydrogen 3.446 N/A TYR 237.A OH SER 208.A OG no hydrogen 2.725 N/A THR 239.A N ASP 236.A O no hydrogen 3.126 N/A SER 240.A N ASP 236.A O no hydrogen 3.039 N/A THR 241.A N TYR 237.A O no hydrogen 3.138 N/A GLU 242.A N TYR 237.A O no hydrogen 2.774 N/A TYR 245.A N GLU 242.A O no hydrogen 3.201 N/A TYR 245.A OH LEU 251.A OXT no hydrogen 2.844 N/A ASN 250.A N GLU 204.A OE1 no hydrogen 3.016 N/A ASN 250.A ND2 GLU 204.A OE2 no hydrogen 3.198 N/A LEU 251.A N GLU 204.A OE1 no hydrogen 3.092 N/A