Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lli_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N TYR 7.A OH no hydrogen 2.621 N/A SER 4.A N ASP 2.A OD1 no hydrogen 2.721 N/A SER 4.A OG ASP 2.A OD1 no hydrogen 2.659 N/A LYS 5.A NZ ASN 246.A OD1 no hydrogen 2.984 N/A MET 8.A N ILE 248.A O no hydrogen 3.312 N/A ASP 10.A N TYR 7.A O no hydrogen 2.683 N/A LEU 11.A N TYR 7.A O no hydrogen 3.467 N/A GLU 12.A N MET 8.A O no hydrogen 2.936 N/A SER 13.A N ALA 9.A O no hydrogen 3.059 N/A SER 13.A OG ALA 9.A O no hydrogen 2.854 N/A SER 13.A OG ASN 96.A O no hydrogen 3.259 N/A ALA 14.A N ASP 10.A O no hydrogen 2.972 N/A LEU 15.A N LEU 11.A O no hydrogen 3.324 N/A HIS 16.A N GLU 12.A O no hydrogen 2.965 N/A HIS 16.A ND1 GLU 87.A OE1 no hydrogen 2.840 N/A TYR 17.A N SER 13.A O no hydrogen 2.768 N/A ILE 18.A N ALA 14.A O no hydrogen 2.848 N/A LEU 19.A N LEU 15.A O no hydrogen 3.006 N/A ARG 20.A N HIS 16.A O no hydrogen 3.103 N/A ARG 20.A NH1 ASP 83.A OD1 no hydrogen 3.010 N/A ARG 20.A NH2 ASP 83.A OD1 no hydrogen 2.992 N/A ILE 21.A N TYR 17.A O no hydrogen 2.840 N/A GLU 22.A N TYR 17.A O no hydrogen 3.151 N/A VAL 23.A N ILE 18.A O no hydrogen 2.921 N/A ARG 25.A N GLU 22.A O no hydrogen 3.319 N/A PHE 26.A N VAL 23.A O no hydrogen 3.359 N/A LEU 29.A N ILE 73.A O no hydrogen 2.959 N/A ARG 33.A NE TYR 152.A O no hydrogen 2.891 N/A ARG 33.A NH2 TYR 152.A O no hydrogen 3.437 N/A LEU 34.A N GLU 30.A O no hydrogen 3.258 N/A LEU 34.A N GLY 31.A O no hydrogen 3.146 N/A VAL 35.A N GLY 31.A O no hydrogen 3.143 N/A ALA 36.A N GLN 32.A O no hydrogen 2.901 N/A LEU 37.A N ARG 33.A O no hydrogen 3.089 N/A LYS 38.A N LEU 34.A O no hydrogen 2.901 N/A LYS 39.A N VAL 35.A O no hydrogen 2.912 N/A LYS 39.A NZ GLU 141.A OE2 no hydrogen 2.659 N/A PHE 40.A N ALA 36.A O no hydrogen 2.911 N/A VAL 41.A N LEU 37.A O no hydrogen 2.981 N/A ALA 42.A N LYS 38.A O no hydrogen 3.102 N/A VAL 43.A N LYS 39.A O no hydrogen 3.061 N/A LEU 44.A N PHE 40.A O no hydrogen 2.877 N/A ALA 45.A N VAL 41.A O no hydrogen 2.940 N/A LYS 46.A N ALA 42.A O no hydrogen 3.256 N/A LYS 46.A NZ TYR 47.A OH no hydrogen 2.977 N/A LYS 46.A NZ GLU 135.A OE2 no hydrogen 3.092 N/A TYR 47.A N VAL 43.A O no hydrogen 2.829 N/A PHE 48.A N LEU 44.A O no hydrogen 2.666 N/A ARG 51.A NH2 VAL 90.A O no hydrogen 2.931 N/A GLN 55.A N ARG 51.A O no hydrogen 3.050 N/A GLN 55.A NE2 LEU 44.A O no hydrogen 3.494 N/A GLN 55.A NE2 ALA 45.A O no hydrogen 2.525 N/A ASN 56.A N PRO 52.A O no hydrogen 3.048 N/A PHE 57.A N LEU 53.A O no hydrogen 2.897 N/A LEU 58.A N VAL 54.A O no hydrogen 2.921 N/A HIS 59.A N GLN 55.A O no hydrogen 3.035 N/A HIS 59.A ND1 GLN 55.A O no hydrogen 2.479 N/A SER 60.A N ASN 56.A O no hydrogen 2.933 N/A VAL 61.A N PHE 57.A O no hydrogen 2.888 N/A ASN 62.A N LEU 58.A O no hydrogen 2.815 N/A GLU 63.A N HIS 59.A O no hydrogen 2.835 N/A TRP 64.A N SER 60.A O no hydrogen 2.890 N/A LEU 65.A N VAL 61.A O no hydrogen 3.020 N/A LYS 66.A N ASN 62.A O no hydrogen 3.236 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 2.498 N/A ARG 67.A N GLU 63.A O no hydrogen 3.150 N/A ARG 67.A N TRP 64.A O no hydrogen 3.185 N/A GLN 68.A N TRP 64.A O no hydrogen 3.264 N/A GLN 68.A N LEU 65.A O no hydrogen 2.881 N/A GLN 68.A NE2 TRP 64.A O no hydrogen 2.859 N/A ILE 73.A N LEU 29.A O no hydrogen 2.753 N/A TYR 75.A N PRO 27.A O no hydrogen 2.780 N/A TYR 75.A OH LEU 19.A O no hydrogen 2.736 N/A PHE 78.A N PRO 74.A O no hydrogen 3.326 N/A LYS 79.A N TYR 75.A O no hydrogen 2.705 N/A LYS 79.A NZ ASP 83.A OD2 no hydrogen 3.127 N/A THR 80.A N SER 76.A O no hydrogen 3.241 N/A THR 80.A OG1 SER 76.A O no hydrogen 3.336 N/A LEU 82.A N PHE 78.A O no hydrogen 3.239 N/A ASP 83.A N LYS 79.A O no hydrogen 3.032 N/A ASP 84.A N THR 80.A O no hydrogen 2.641 N/A ARG 85.A N ALA 81.A O no hydrogen 3.112 N/A ARG 85.A NH1 ALA 81.A O no hydrogen 3.174 N/A LYS 86.A N ASP 83.A O no hydrogen 2.704 N/A LYS 86.A NZ ASP 84.A O no hydrogen 3.523 N/A GLU 87.A N LEU 82.A O no hydrogen 2.977 N/A VAL 90.A N LYS 86.A O no hydrogen 3.215 N/A LEU 91.A N GLU 87.A O no hydrogen 2.823 N/A ASN 96.A N SER 13.A OG no hydrogen 2.557 N/A ILE 98.A N ASP 10.A OD1 no hydrogen 2.838 N/A GLY 99.A N ASP 10.A OD2 no hydrogen 3.078 N/A CYS 100.A N ASP 10.A OD1 no hydrogen 3.361 N/A GLN 101.A N ILE 98.A O no hydrogen 3.257 N/A SER 103.A N ASP 202.A OD2 no hydrogen 2.770 N/A SER 103.A OG ASP 202.A OD1 no hydrogen 2.537 N/A PHE 107.A N GLU 104.A O no hydrogen 2.973 N/A ARG 108.A NH1 GLN 101.A O no hydrogen 3.096 N/A ARG 108.A NH2 GLY 99.A O no hydrogen 2.985 N/A GLY 109.A N CYS 100.A O no hydrogen 2.790 N/A SER 113.A N GLY 109.A O no hydrogen 3.099 N/A SER 113.A OG PHE 110.A O no hydrogen 2.662 N/A LEU 114.A N PHE 110.A O no hydrogen 2.724 N/A TRP 115.A N PRO 111.A O no hydrogen 3.062 N/A VAL 116.A N CYS 112.A O no hydrogen 3.157 N/A LEU 117.A N SER 113.A O no hydrogen 2.903 N/A PHE 118.A N LEU 114.A O no hydrogen 2.815 N/A HIS 119.A N TRP 115.A O no hydrogen 2.796 N/A HIS 119.A NE2 HIS 188.A ND1 no hydrogen 2.905 N/A PHE 120.A N VAL 116.A O no hydrogen 2.885 N/A LEU 121.A N LEU 117.A O no hydrogen 2.952 N/A THR 122.A N PHE 118.A O no hydrogen 3.138 N/A THR 122.A OG1 PHE 118.A O no hydrogen 3.503 N/A THR 122.A OG1 HIS 119.A O no hydrogen 2.499 N/A VAL 123.A N HIS 119.A O no hydrogen 2.924 N/A GLN 124.A N PHE 120.A O no hydrogen 2.756 N/A GLN 124.A NE2 TYR 47.A O no hydrogen 3.113 N/A ALA 125.A N LEU 121.A O no hydrogen 3.100 N/A ALA 126.A N VAL 123.A O no hydrogen 2.788 N/A ARG 127.A N GLN 124.A O no hydrogen 3.286 N/A GLU 135.A N HIS 132.A O no hydrogen 2.967 N/A ALA 136.A N HIS 132.A O no hydrogen 2.706 N/A ALA 139.A N GLU 135.A O no hydrogen 3.053 N/A GLU 141.A N LYS 138.A O no hydrogen 3.357 N/A VAL 142.A N ALA 139.A O no hydrogen 3.420 N/A ALA 145.A N GLU 141.A O no hydrogen 2.976 N/A ILE 146.A N VAL 142.A O no hydrogen 2.927 N/A ARG 147.A N LEU 143.A O no hydrogen 2.779 N/A ARG 147.A NE GLU 164.A OE1 no hydrogen 2.942 N/A ARG 147.A NE GLU 164.A OE2 no hydrogen 3.377 N/A ARG 147.A NH2 GLU 164.A OE2 no hydrogen 2.641 N/A GLY 148.A N PRO 144.A O no hydrogen 2.730 N/A TYR 149.A N ALA 145.A O no hydrogen 2.906 N/A TYR 149.A OH GLU 22.A OE1 no hydrogen 2.424 N/A VAL 150.A N ILE 146.A O no hydrogen 3.175 N/A HIS 151.A N ARG 147.A O no hydrogen 3.149 N/A TYR 152.A N GLY 148.A O no hydrogen 3.016 N/A PHE 153.A N TYR 149.A O no hydrogen 2.782 N/A PHE 154.A N TYR 149.A O no hydrogen 3.317 N/A GLY 155.A N GLU 22.A OE2 no hydrogen 2.730 N/A ARG 157.A NH1 HIS 151.A O no hydrogen 2.685 N/A ARG 157.A NH2 VAL 150.A O no hydrogen 2.803 N/A ARG 157.A NH2 HIS 151.A O no hydrogen 3.187 N/A ARG 157.A NH2 PHE 154.A O no hydrogen 2.658 N/A CYS 159.A N CYS 156.A O no hydrogen 2.919 N/A ALA 160.A N CYS 156.A O no hydrogen 3.054 N/A SER 161.A N ARG 157.A O no hydrogen 2.753 N/A SER 161.A OG ARG 157.A O no hydrogen 2.816 N/A SER 161.A OG ASP 158.A O no hydrogen 2.886 N/A PHE 163.A N CYS 159.A O no hydrogen 3.251 N/A GLU 164.A N ALA 160.A O no hydrogen 3.054 N/A GLN 165.A N SER 161.A O no hydrogen 3.055 N/A MET 166.A N HIS 162.A O no hydrogen 3.419 N/A ALA 167.A N PHE 163.A O no hydrogen 2.746 N/A ALA 168.A N GLU 164.A O no hydrogen 2.868 N/A ALA 169.A N GLN 165.A O no hydrogen 3.158 N/A SER 170.A N MET 166.A O no hydrogen 3.063 N/A MET 171.A N ALA 167.A O no hydrogen 2.852 N/A ARG 173.A N SER 170.A O no hydrogen 3.214 N/A VAL 174.A N MET 171.A O no hydrogen 3.062 N/A ALA 179.A N SER 176.A OG no hydrogen 3.174 N/A ALA 180.A N SER 176.A O no hydrogen 2.824 N/A VAL 181.A N PRO 177.A O no hydrogen 2.870 N/A LEU 182.A N ASN 178.A O no hydrogen 2.935 N/A TRP 183.A N ALA 179.A O no hydrogen 2.888 N/A TRP 183.A NE1 SER 170.A OG no hydrogen 3.019 N/A LEU 184.A N ALA 180.A O no hydrogen 3.047 N/A TRP 185.A N VAL 181.A O no hydrogen 3.055 N/A TRP 185.A NE1 TRP 210.A O no hydrogen 3.017 N/A SER 186.A N LEU 182.A O no hydrogen 2.846 N/A SER 186.A OG LEU 182.A O no hydrogen 2.994 N/A SER 186.A OG TRP 183.A O no hydrogen 3.162 N/A SER 187.A N TRP 183.A O no hydrogen 2.764 N/A SER 187.A OG TRP 183.A O no hydrogen 2.923 N/A HIS 188.A N LEU 184.A O no hydrogen 2.979 N/A HIS 188.A ND1 HIS 119.A NE2 no hydrogen 2.905 N/A ASN 189.A N TRP 185.A O no hydrogen 3.167 N/A ASN 189.A ND2 TRP 210.A O no hydrogen 2.762 N/A ARG 190.A N SER 186.A O no hydrogen 2.910 N/A VAL 191.A N SER 187.A O no hydrogen 3.113 N/A ASN 192.A N HIS 188.A O no hydrogen 2.754 N/A ASN 192.A ND2 ASN 189.A OD1 no hydrogen 2.997 N/A ALA 193.A N ASN 189.A O no hydrogen 2.918 N/A ARG 194.A N ARG 190.A O no hydrogen 3.045 N/A LEU 195.A N VAL 191.A O no hydrogen 2.983 N/A ALA 196.A N ASN 192.A O no hydrogen 2.967 N/A GLY 197.A N GLU 201.A OE2 no hydrogen 3.172 N/A ALA 198.A N LEU 195.A O no hydrogen 3.037 N/A GLU 201.A N ALA 198.A O no hydrogen 3.152 N/A GLN 204.A N ASP 202.A OD1 no hydrogen 3.061 N/A PHE 205.A N ASP 202.A O no hydrogen 2.618 N/A LYS 207.A N GLU 201.A OE2 no hydrogen 2.646 N/A GLN 209.A NE2 ASN 189.A O no hydrogen 3.142 N/A TRP 210.A N ASN 189.A OD1 no hydrogen 2.885 N/A ARG 213.A NH2 GLU 222.A OE1 no hydrogen 3.214 N/A LEU 215.A N PRO 212.A O no hydrogen 2.870 N/A CYS 216.A N PRO 212.A O no hydrogen 2.717 N/A CYS 219.A N CYS 216.A O no hydrogen 3.465 N/A HIS 220.A NE2 PRO 211.A O no hydrogen 2.843 N/A ASN 221.A N VAL 228.A O no hydrogen 2.921 N/A ASN 221.A ND2 PRO 227.A O no hydrogen 2.770 N/A ARG 223.A NE ASP 225.A OD1 no hydrogen 2.906 N/A ARG 223.A NH2 ASP 225.A OD2 no hydrogen 2.715 N/A ASP 230.A N CYS 219.A O no hydrogen 2.901 N/A ALA 233.A N ASP 230.A OD1 no hydrogen 3.239 N/A THR 234.A N ASP 230.A O no hydrogen 2.882 N/A THR 234.A OG1 CYS 219.A O no hydrogen 3.531 N/A THR 234.A OG1 ASP 230.A O no hydrogen 2.882 N/A LEU 235.A N VAL 231.A O no hydrogen 2.771 N/A ASN 236.A N GLU 232.A O no hydrogen 3.087 N/A PHE 237.A N ALA 233.A O no hydrogen 2.985 N/A LEU 238.A N THR 234.A O no hydrogen 2.839 N/A LYS 239.A N LEU 235.A O no hydrogen 2.969 N/A LYS 239.A NZ ALA 126.A O no hydrogen 3.436 N/A LYS 239.A NZ ASN 178.A OD1 no hydrogen 2.495 N/A ALA 240.A N ASN 236.A O no hydrogen 3.187 N/A HIS 241.A N PHE 237.A O no hydrogen 2.756 N/A PHE 242.A N LEU 238.A O no hydrogen 2.618 N/A SER 243.A OG ALA 240.A O no hydrogen 2.565 N/A SER 243.A OG SER 245.A OG no hydrogen 3.309 N/A SER 245.A OG SER 243.A OG no hydrogen 3.309 N/A ASN 246.A N SER 243.A O no hydrogen 3.053 N/A ASN 246.A ND2 SER 4.A O no hydrogen 2.871 N/A ASN 246.A ND2 HIS 241.A O no hydrogen 2.655 N/A ILE 247.A N PRO 244.A O no hydrogen 2.985 N/A ILE 248.A N ILE 6.A O no hydrogen 2.763 N/A