Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gmd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 6.A N ARG 3.A O no hydrogen 2.616 N/A LEU 7.A N PRO 4.A O no hydrogen 2.988 N/A GLN 8.A N GLU 5.A O no hydrogen 3.305 N/A GLN 8.A NE2 GLU 5.A O no hydrogen 3.523 N/A GLY 9.A N GLY 33.A O no hydrogen 2.445 N/A LYS 10.A N LEU 7.A O no hydrogen 3.181 N/A LYS 11.A N ASP 89.A OD2 no hydrogen 2.732 N/A VAL 12.A N HIS 35.A O no hydrogen 3.039 N/A ILE 13.A N MET 90.A O no hydrogen 2.868 N/A VAL 14.A N VAL 37.A O no hydrogen 3.205 N/A THR 15.A N ILE 92.A O no hydrogen 3.082 N/A THR 15.A OG1 ILE 92.A O no hydrogen 3.321 N/A THR 15.A OG1 HIS 95.A ND1 no hydrogen 3.083 N/A ALA 17.A N THR 39.A O no hydrogen 3.479 N/A ARG 23.A N LYS 19.A O no hydrogen 3.295 N/A GLU 24.A N GLY 20.A O no hydrogen 3.205 N/A MET 25.A N ILE 21.A O no hydrogen 3.096 N/A ALA 26.A N GLY 22.A O no hydrogen 3.307 N/A TYR 27.A N ARG 23.A O no hydrogen 3.066 N/A HIS 28.A N GLU 24.A O no hydrogen 2.932 N/A LEU 29.A N MET 25.A O no hydrogen 2.966 N/A SER 30.A N ALA 26.A O no hydrogen 2.921 N/A SER 30.A OG ALA 26.A O no hydrogen 2.784 N/A LYS 31.A N TYR 27.A O no hydrogen 2.997 N/A MET 32.A N HIS 28.A O no hydrogen 2.994 N/A GLY 33.A N SER 30.A O no hydrogen 2.809 N/A ALA 34.A N LEU 29.A O no hydrogen 3.039 N/A HIS 35.A N LYS 10.A O no hydrogen 2.848 N/A VAL 36.A N SER 60.A O no hydrogen 3.095 N/A VAL 37.A N VAL 12.A O no hydrogen 3.096 N/A LEU 38.A N HIS 62.A O no hydrogen 2.778 N/A THR 39.A N VAL 14.A O no hydrogen 3.305 N/A THR 39.A OG1 ILE 64.A O no hydrogen 2.682 N/A LEU 46.A N SER 42.A O no hydrogen 3.018 N/A GLN 47.A N GLU 43.A O no hydrogen 3.255 N/A GLN 47.A N GLU 44.A O no hydrogen 2.825 N/A GLN 47.A NE2 SER 51.A OG no hydrogen 2.425 N/A LYS 48.A N GLU 44.A O no hydrogen 3.137 N/A VAL 50.A N LEU 46.A O no hydrogen 3.118 N/A SER 51.A N GLN 47.A O no hydrogen 2.904 N/A SER 51.A OG GLN 47.A O no hydrogen 2.732 N/A ARG 52.A N LYS 48.A O no hydrogen 2.859 N/A ARG 52.A NH1 GLU 55.A OE1 no hydrogen 3.207 N/A CYS 53.A N VAL 49.A O no hydrogen 2.852 N/A CYS 53.A SG SER 30.A OG no hydrogen 3.172 N/A CYS 53.A SG VAL 49.A O no hydrogen 3.069 N/A LEU 54.A N VAL 50.A O no hydrogen 2.983 N/A GLU 55.A N SER 51.A O no hydrogen 3.194 N/A LEU 56.A N ARG 52.A O no hydrogen 2.971 N/A GLY 57.A N CYS 53.A O no hydrogen 3.210 N/A ALA 58.A N CYS 53.A O no hydrogen 3.120 N/A HIS 62.A N VAL 36.A O no hydrogen 3.038 N/A TYR 63.A OH GLU 43.A OE2 no hydrogen 2.673 N/A ILE 64.A N LEU 38.A O no hydrogen 2.842 N/A GLY 66.A N ALA 40.A O no hydrogen 3.034 N/A GLU 69.A N THR 67.A OG1 no hydrogen 3.176 N/A ASP 70.A N THR 67.A O no hydrogen 3.421 N/A THR 72.A N ASP 70.A OD1 no hydrogen 2.601 N/A PHE 73.A N ASP 70.A OD1 no hydrogen 3.224 N/A ALA 74.A N ASP 70.A O no hydrogen 3.151 N/A GLU 75.A N MET 71.A O no hydrogen 3.001 N/A GLN 76.A N THR 72.A O no hydrogen 3.051 N/A PHE 77.A N PHE 73.A O no hydrogen 2.685 N/A VAL 79.A N GLU 75.A O no hydrogen 3.278 N/A LYS 80.A N GLN 76.A O no hydrogen 3.030 N/A ALA 81.A N PHE 77.A O no hydrogen 2.750 N/A GLY 82.A N ILE 78.A O no hydrogen 2.827 N/A LYS 83.A N VAL 79.A O no hydrogen 3.046 N/A LEU 84.A N LYS 80.A O no hydrogen 2.906 N/A MET 85.A N ALA 81.A O no hydrogen 3.150 N/A GLY 86.A N GLY 82.A O no hydrogen 2.634 N/A GLY 86.A N LYS 83.A O no hydrogen 2.861 N/A GLY 87.A N GLY 82.A O no hydrogen 2.909 N/A ASP 89.A N LYS 11.A O no hydrogen 2.755 N/A MET 90.A N LYS 11.A O no hydrogen 3.199 N/A LEU 91.A N SER 139.A O no hydrogen 2.987 N/A ILE 92.A N ILE 13.A O no hydrogen 2.591 N/A LEU 93.A N ALA 141.A O no hydrogen 3.108 N/A ASN 94.A N THR 15.A OG1 no hydrogen 2.784 N/A ASN 94.A ND2 THR 15.A O no hydrogen 3.170 N/A HIS 95.A N THR 15.A OG1 no hydrogen 3.216 N/A HIS 95.A ND1 THR 15.A OG1 no hydrogen 3.083 N/A HIS 95.A NE2 SER 121.A OG no hydrogen 2.881 N/A THR 97.A N ASN 118.A OD1 no hydrogen 2.894 N/A GLN 98.A NE2 SER 100.A OG no hydrogen 2.943 N/A THR 99.A OG1 THR 97.A O no hydrogen 2.641 N/A SER 102.A N MET 154.A O no hydrogen 3.003 N/A SER 102.A OG LEU 103.A O no hydrogen 3.450 N/A HIS 105.A ND1 LEU 103.A O no hydrogen 2.909 N/A SER 110.A N ASP 107.A OD1 no hydrogen 3.316 N/A SER 110.A OG ASP 107.A OD1 no hydrogen 3.458 N/A VAL 111.A N ASP 107.A O no hydrogen 3.333 N/A ARG 112.A N ILE 108.A O no hydrogen 2.752 N/A ARG 113.A N HIS 109.A O no hydrogen 2.905 N/A VAL 114.A N SER 110.A O no hydrogen 2.862 N/A MET 115.A N VAL 111.A O no hydrogen 3.031 N/A GLU 116.A N ARG 112.A O no hydrogen 2.839 N/A VAL 117.A N ARG 113.A O no hydrogen 3.208 N/A ASN 118.A N VAL 114.A O no hydrogen 2.916 N/A ASN 118.A ND2 SER 161.A OG no hydrogen 3.222 N/A PHE 119.A N MET 115.A O no hydrogen 3.031 N/A LEU 120.A N MET 115.A O no hydrogen 2.676 N/A SER 121.A N GLU 116.A O no hydrogen 2.702 N/A SER 121.A OG HIS 95.A NE2 no hydrogen 2.881 N/A SER 121.A OG VAL 117.A O no hydrogen 2.559 N/A TYR 122.A N PHE 119.A O no hydrogen 2.865 N/A TYR 122.A OH HIS 95.A O no hydrogen 2.587 N/A VAL 123.A N PHE 119.A O no hydrogen 3.264 N/A VAL 124.A N LEU 120.A O no hydrogen 2.992 N/A MET 125.A N SER 121.A O no hydrogen 3.162 N/A SER 126.A N TYR 122.A O no hydrogen 3.214 N/A SER 126.A OG TYR 122.A O no hydrogen 3.290 N/A SER 126.A OG VAL 123.A O no hydrogen 3.026 N/A THR 127.A N VAL 123.A O no hydrogen 3.148 N/A THR 127.A OG1 VAL 123.A O no hydrogen 2.697 N/A ALA 128.A N VAL 124.A O no hydrogen 3.056 N/A ALA 129.A N MET 125.A O no hydrogen 2.644 N/A LEU 133.A N ALA 129.A O no hydrogen 3.042 N/A LYS 134.A N LEU 130.A O no hydrogen 2.767 N/A GLN 135.A N PRO 131.A O no hydrogen 2.866 N/A SER 136.A N MET 132.A O no hydrogen 2.749 N/A SER 136.A OG LEU 88.A O no hydrogen 2.637 N/A SER 136.A OG ASP 89.A OD1 no hydrogen 3.346 N/A ASN 137.A N LYS 134.A O no hydrogen 3.151 N/A GLY 138.A N LEU 133.A O no hydrogen 2.682 N/A SER 139.A N ASP 89.A O no hydrogen 2.743 N/A SER 139.A OG SER 184.A OG no hydrogen 2.577 N/A SER 139.A OG THR 224.A O no hydrogen 3.552 N/A ILE 140.A N SER 184.A O no hydrogen 2.804 N/A ALA 141.A N LEU 91.A O no hydrogen 2.991 N/A VAL 142.A N THR 186.A O no hydrogen 2.796 N/A ILE 143.A N LEU 93.A O no hydrogen 3.214 N/A SER 144.A N CYS 188.A O no hydrogen 2.640 N/A LEU 146.A N LEU 190.A O no hydrogen 3.016 N/A ALA 147.A N SER 145.A OG no hydrogen 3.043 N/A GLY 148.A N SER 145.A O no hydrogen 2.666 N/A LYS 149.A N LEU 146.A O no hydrogen 2.986 N/A LYS 149.A NZ ASP 166.A OD2 no hydrogen 3.059 N/A LYS 149.A NZ GLU 230.A OE2 no hydrogen 2.696 N/A VAL 150.A N LEU 146.A O no hydrogen 2.901 N/A SER 159.A N VAL 155.A O no hydrogen 2.714 N/A SER 159.A OG ALA 147.A O no hydrogen 2.752 N/A ALA 160.A N ALA 156.A O no hydrogen 2.952 N/A ALA 160.A N PRO 157.A O no hydrogen 3.129 N/A SER 161.A N PRO 157.A O no hydrogen 3.187 N/A SER 161.A OG TYR 158.A O no hydrogen 2.819 N/A LYS 162.A N TYR 158.A O no hydrogen 3.096 N/A LYS 162.A NZ ILE 143.A O no hydrogen 3.161 N/A PHE 163.A N SER 159.A O no hydrogen 3.009 N/A ALA 164.A N ALA 160.A O no hydrogen 2.817 N/A LEU 165.A N LYS 162.A O no hydrogen 2.868 N/A ASP 166.A N LYS 162.A O no hydrogen 3.338 N/A GLY 167.A N PHE 163.A O no hydrogen 3.208 N/A PHE 168.A N ALA 164.A O no hydrogen 3.301 N/A PHE 169.A N LEU 165.A O no hydrogen 2.832 N/A SER 170.A N ASP 166.A O no hydrogen 3.068 N/A SER 170.A OG ASP 166.A O no hydrogen 2.899 N/A SER 170.A OG ASP 166.A OD1 no hydrogen 2.842 N/A THR 171.A N GLY 167.A O no hydrogen 3.350 N/A THR 171.A OG1 GLY 167.A O no hydrogen 2.710 N/A ILE 172.A N PHE 168.A O no hydrogen 3.018 N/A ARG 173.A N PHE 169.A O no hydrogen 2.937 N/A ARG 173.A NE ILE 185.A O no hydrogen 2.969 N/A ARG 173.A NH2 ILE 185.A O no hydrogen 2.916 N/A THR 174.A N SER 170.A O no hydrogen 3.186 N/A THR 174.A OG1 SER 170.A O no hydrogen 3.062 N/A GLU 175.A N THR 171.A O no hydrogen 2.889 N/A LEU 176.A N ILE 172.A O no hydrogen 2.720 N/A TYR 177.A N ARG 173.A O no hydrogen 2.991 N/A TYR 177.A N THR 174.A O no hydrogen 3.102 N/A ILE 178.A N THR 174.A O no hydrogen 3.016 N/A THR 179.A OG1 GLU 175.A O no hydrogen 2.699 N/A THR 179.A OG1 LEU 176.A O no hydrogen 3.170 N/A LYS 180.A N TYR 177.A O no hydrogen 3.373 N/A VAL 181.A N LEU 176.A O no hydrogen 2.778 N/A ASN 182.A ND2 ASN 137.A O no hydrogen 3.491 N/A ASN 182.A ND2 ASN 182.A O no hydrogen 2.362 N/A SER 184.A N GLY 138.A O no hydrogen 3.457 N/A SER 184.A OG SER 139.A OG no hydrogen 2.577 N/A THR 186.A N ILE 140.A O no hydrogen 2.752 N/A THR 186.A OG1 LYS 228.A O no hydrogen 2.786 N/A LEU 187.A N SER 229.A O no hydrogen 2.935 N/A CYS 188.A N VAL 142.A O no hydrogen 2.858 N/A CYS 188.A SG THR 186.A O no hydrogen 3.947 N/A VAL 189.A N VAL 231.A O no hydrogen 2.808 N/A LEU 190.A N SER 144.A O no hydrogen 3.327 N/A GLY 191.A N TYR 233.A O no hydrogen 2.831 N/A ASP 194.A N SER 211.A O no hydrogen 3.119 N/A THR 195.A N ILE 193.A O no hydrogen 2.583 N/A THR 195.A OG1 ILE 193.A O no hydrogen 3.332 N/A MET 199.A N THR 195.A O no hydrogen 3.243 N/A LYS 200.A N GLU 196.A O no hydrogen 3.229 N/A LYS 200.A NZ THR 197.A O no hydrogen 2.900 N/A ALA 201.A N THR 197.A O no hydrogen 2.992 N/A VAL 202.A N ALA 198.A O no hydrogen 2.808 N/A ILE 205.A N VAL 202.A O no hydrogen 2.784 N/A VAL 206.A N VAL 202.A O no hydrogen 2.856 N/A SER 211.A N LEU 192.A O no hydrogen 2.753 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.724 N/A CYS 216.A N PRO 212.A O no hydrogen 3.067 N/A ALA 217.A N LYS 213.A O no hydrogen 3.041 N/A LEU 218.A N GLU 214.A O no hydrogen 3.397 N/A GLU 219.A N GLU 215.A O no hydrogen 2.791 N/A ILE 220.A N CYS 216.A O no hydrogen 2.987 N/A ILE 221.A N ALA 217.A O no hydrogen 3.094 N/A LYS 222.A N LEU 218.A O no hydrogen 2.839 N/A LYS 222.A NZ GLU 219.A OE1 no hydrogen 2.959 N/A GLY 223.A N GLU 219.A O no hydrogen 3.281 N/A THR 224.A N ILE 220.A O no hydrogen 3.092 N/A THR 224.A OG1 ILE 220.A O no hydrogen 3.063 N/A ALA 225.A N ILE 221.A O no hydrogen 2.999 N/A LEU 226.A N LYS 222.A O no hydrogen 2.882 N/A ARG 227.A N THR 224.A O no hydrogen 3.147 N/A ARG 227.A NH1 ASN 137.A O no hydrogen 3.362 N/A ARG 227.A NH2 ASN 137.A O no hydrogen 3.142 N/A ARG 227.A NH2 GLY 138.A O no hydrogen 3.455 N/A LYS 228.A N GLY 223.A O no hydrogen 3.084 N/A VAL 231.A N LEU 187.A O no hydrogen 2.934 N/A TYR 233.A N VAL 189.A O no hydrogen 3.233 N/A TYR 233.A OH PRO 212.A O no hydrogen 3.374 N/A TYR 233.A OH GLU 215.A OE1 no hydrogen 2.536 N/A THR 239.A OG1 ASP 234.A OD2 no hydrogen 2.662 N/A THR 239.A OG1 SER 236.A O no hydrogen 3.195 N/A LEU 242.A N LEU 238.A O no hydrogen 3.478 N/A LEU 243.A N THR 239.A O no hydrogen 3.008 N/A GLY 244.A N ILE 241.A O no hydrogen 2.579 N/A ARG 248.A N ASN 245.A OD1 no hydrogen 3.132 N/A ARG 248.A NE GLU 252.A OE2 no hydrogen 2.727 N/A ARG 248.A NH1 ASP 166.A OD1 no hydrogen 3.329 N/A ARG 248.A NH1 ASP 166.A OD2 no hydrogen 2.674 N/A ARG 248.A NH2 ASP 166.A OD1 no hydrogen 3.153 N/A ARG 248.A NH2 GLU 252.A OE2 no hydrogen 3.257 N/A ILE 250.A N PRO 246.A O no hydrogen 2.754 N/A MET 251.A N GLY 247.A O no hydrogen 2.800 N/A GLU 252.A N ARG 248.A O no hydrogen 2.669 N/A PHE 253.A N LYS 249.A O no hydrogen 3.048 N/A PHE 254.A N ILE 250.A O no hydrogen 3.387 N/A SER 255.A N MET 251.A O no hydrogen 3.259 N/A SER 255.A OG MET 251.A O no hydrogen 2.692 N/A LEU 256.A N PHE 253.A O no hydrogen 3.436 N/A ARG 257.A N PHE 254.A O no hydrogen 3.131 N/A TYR 258.A N SER 255.A O no hydrogen 3.229 N/A TYR 259.A N LEU 256.A O no hydrogen 2.919 N/A ASN 260.A ND2 ASP 262.A OD2 no hydrogen 3.028 N/A ASP 262.A N ASN 260.A OD1 no hydrogen 3.238 N/A MET 263.A N ASN 260.A O no hydrogen 3.343 N/A PHE 264.A N LYS 261.A O no hydrogen 2.617 N/A