Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kka_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD2 no hydrogen 2.270 N/A VAL 3.A N SER 26.A OG no hydrogen 2.661 N/A THR 5.A N SER 24.A O no hydrogen 2.952 N/A GLN 6.A NE2 TYR 85.A O no hydrogen 2.575 N/A SER 7.A N THR 22.A O no hydrogen 3.245 N/A MET 11.A N LYS 102.A O no hydrogen 3.100 N/A SER 12.A OG GLU 104.A O no hydrogen 2.674 N/A SER 12.A OG TYR 139.A OH no hydrogen 3.099 N/A GLY 16.A N MET 77.A O no hydrogen 3.098 N/A LYS 18.A NZ ASN 75.A OD1 no hydrogen 2.419 N/A VAL 19.A N ILE 74.A O no hydrogen 3.286 N/A THR 20.A OG1 VAL 19.A O no hydrogen 2.742 N/A THR 20.A OG1 THR 73.A OG1 no hydrogen 3.417 N/A MET 21.A N LEU 72.A O no hydrogen 3.279 N/A CYS 23.A N TYR 70.A O no hydrogen 3.468 N/A SER 24.A N THR 5.A O no hydrogen 3.164 N/A ALA 25.A N THR 68.A O no hydrogen 3.228 N/A SER 26.A N VAL 3.A O no hydrogen 3.078 N/A SER 28.A OG GLY 67.A O no hydrogen 3.513 N/A VAL 29.A N GLY 67.A O no hydrogen 2.913 N/A HIS 33.A N GLN 88.A O no hydrogen 2.667 N/A TRP 34.A N ILE 47.A O no hydrogen 2.707 N/A TYR 35.A N TYR 86.A O no hydrogen 2.563 N/A TYR 35.A OH GLN 88.A OE1 no hydrogen 2.273 N/A GLN 36.A N LYS 44.A O no hydrogen 2.808 N/A GLN 37.A N THR 84.A O no hydrogen 2.792 N/A LYS 38.A NZ GLU 80.A O no hydrogen 3.532 N/A LYS 38.A NZ ALA 82.A O no hydrogen 3.166 N/A THR 41.A N LYS 38.A O no hydrogen 3.458 N/A THR 41.A OG1 SER 42.A O no hydrogen 3.444 N/A LYS 44.A N GLN 36.A O no hydrogen 2.824 N/A LYS 44.A NZ SER 42.A O no hydrogen 3.121 N/A TRP 46.A N TRP 34.A O no hydrogen 2.576 N/A ILE 47.A N TRP 34.A O no hydrogen 3.179 N/A TYR 48.A N LYS 52.A O no hydrogen 2.899 N/A ASP 49.A N HIS 33.A ND1 no hydrogen 3.222 N/A THR 50.A N ILE 32.A O no hydrogen 3.070 N/A SER 51.A N ASP 49.A O no hydrogen 2.261 N/A LYS 52.A N TYR 48.A O no hydrogen 2.815 N/A LYS 52.A NZ ASP 49.A OD2 no hydrogen 3.070 N/A THR 54.A N TRP 46.A O no hydrogen 3.477 N/A THR 54.A OG1 ARG 45.A O no hydrogen 3.492 N/A VAL 57.A N THR 54.A O no hydrogen 2.994 N/A ARG 60.A NH2 GLU 80.A OE1 no hydrogen 3.436 N/A ARG 60.A NH2 ASP 81.A OD1 no hydrogen 2.254 N/A PHE 61.A N PRO 58.A O no hydrogen 3.049 N/A SER 64.A N SER 71.A O no hydrogen 3.241 N/A SER 66.A N SER 69.A O no hydrogen 2.937 N/A THR 68.A OG1 ALA 25.A O no hydrogen 2.452 N/A THR 68.A OG1 SER 27.A O no hydrogen 3.428 N/A THR 68.A OG1 THR 68.A O no hydrogen 2.639 N/A SER 69.A N SER 66.A O no hydrogen 3.156 N/A TYR 70.A N CYS 23.A O no hydrogen 3.090 N/A TYR 70.A OH VAL 29.A O no hydrogen 2.105 N/A SER 71.A N SER 64.A O no hydrogen 3.232 N/A SER 71.A OG LEU 72.A O no hydrogen 3.346 N/A SER 71.A OG THR 73.A OG1 no hydrogen 3.186 N/A LEU 72.A N MET 21.A O no hydrogen 3.116 N/A THR 73.A OG1 THR 20.A OG1 no hydrogen 3.417 N/A THR 73.A OG1 SER 71.A OG no hydrogen 3.186 N/A THR 73.A OG1 LEU 72.A O no hydrogen 2.677 N/A ILE 74.A N VAL 19.A O no hydrogen 3.052 N/A ASN 75.A N ARG 60.A O no hydrogen 2.885 N/A MET 77.A N ASP 17.A O no hydrogen 3.064 N/A ALA 82.A N ALA 79.A O no hydrogen 3.305 N/A THR 84.A N GLN 37.A O no hydrogen 2.784 N/A TYR 85.A N THR 101.A O no hydrogen 3.004 N/A TYR 85.A OH GLN 36.A OE1 no hydrogen 2.802 N/A TYR 85.A OH ASP 81.A O no hydrogen 2.814 N/A TYR 86.A N TYR 35.A O no hydrogen 2.730 N/A CYS 87.A N GLN 6.A OE1 no hydrogen 2.838 N/A GLN 88.A N HIS 33.A O no hydrogen 2.662 N/A GLN 88.A NE2 GLN 89.A O no hydrogen 2.777 N/A GLN 89.A N THR 96.A O no hydrogen 2.913 N/A GLN 89.A NE2 SER 92.A O no hydrogen 3.426 N/A GLN 89.A NE2 PRO 94.A O no hydrogen 3.205 N/A TRP 90.A NE1 HIS 93.A ND1 no hydrogen 2.995 N/A SER 91.A OG GLN 89.A OE1 no hydrogen 3.498 N/A SER 91.A OG SER 92.A OG no hydrogen 3.157 N/A SER 92.A N GLN 89.A OE1 no hydrogen 2.943 N/A SER 92.A OG SER 91.A OG no hydrogen 3.157 N/A GLN 95.A N GLN 95.A OE1 no hydrogen 2.028 N/A THR 96.A N GLN 89.A O no hydrogen 3.299 N/A THR 96.A OG1 ILE 2.A O no hydrogen 3.131 N/A GLY 98.A N CYS 87.A O no hydrogen 2.717 N/A THR 101.A OG1 PRO 8.A O no hydrogen 3.059 N/A THR 101.A OG1 GLY 100.A O no hydrogen 2.970 N/A LYS 102.A N ALA 9.A O no hydrogen 2.829 N/A LEU 103.A N ALA 83.A O no hydrogen 2.813 N/A GLU 104.A N MET 11.A O no hydrogen 2.776 N/A ILE 105.A N GLN 165.A OE1 no hydrogen 2.965 N/A LEU 106.A N ALA 13.A O no hydrogen 3.404 N/A ARG 107.A NE ALA 108.A O no hydrogen 2.544 N/A ARG 107.A NH1 ASP 169.A O no hydrogen 3.004 N/A ARG 107.A NH2 ALA 108.A O no hydrogen 3.410 N/A ALA 110.A N TYR 139.A O no hydrogen 3.129 N/A THR 113.A N ASN 136.A O no hydrogen 3.026 N/A SER 115.A N PHE 134.A O no hydrogen 2.921 N/A PHE 117.A N VAL 132.A O no hydrogen 2.938 N/A SER 121.A OG GLU 122.A OE1 no hydrogen 3.349 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.930 N/A GLN 123.A NE2 SER 130.A OG no hydrogen 3.014 N/A LEU 124.A N SER 120.A O no hydrogen 3.220 N/A THR 125.A N SER 121.A O no hydrogen 3.370 N/A THR 125.A OG1 SER 121.A O no hydrogen 2.788 N/A SER 126.A N LEU 124.A O no hydrogen 2.541 N/A SER 126.A OG GLU 122.A O no hydrogen 3.315 N/A SER 126.A OG THR 125.A O no hydrogen 2.547 N/A GLY 127.A N LEU 124.A O no hydrogen 2.857 N/A ALA 129.A N LEU 180.A O no hydrogen 2.723 N/A SER 130.A N GLN 123.A OE1 no hydrogen 3.012 N/A SER 130.A OG THR 179.A OG1 no hydrogen 3.090 N/A VAL 131.A N LEU 178.A O no hydrogen 2.670 N/A VAL 132.A N PHE 117.A O no hydrogen 3.175 N/A CYS 133.A N SER 176.A O no hydrogen 2.705 N/A CYS 133.A SG SER 115.A O no hydrogen 3.142 N/A PHE 134.A N SER 115.A O no hydrogen 2.807 N/A LEU 135.A N MET 174.A O no hydrogen 2.848 N/A ASN 136.A N THR 113.A O no hydrogen 3.426 N/A ASN 137.A N SER 173.A OG no hydrogen 3.267 N/A PHE 138.A N TYR 172.A O no hydrogen 2.926 N/A TYR 139.A N ALA 110.A O no hydrogen 3.078 N/A ASN 144.A N THR 196.A O no hydrogen 2.790 N/A LYS 146.A N GLU 194.A O no hydrogen 2.819 N/A LYS 146.A NZ GLU 153.A OE1 no hydrogen 2.526 N/A TRP 147.A NE1 SER 176.A OG no hydrogen 3.125 N/A LYS 148.A N THR 192.A O no hydrogen 2.685 N/A LYS 148.A NZ GLU 194.A OE2 no hydrogen 3.135 N/A ILE 149.A N SER 152.A O no hydrogen 2.753 N/A ASP 150.A N SER 190.A O no hydrogen 2.500 N/A SER 152.A N ILE 149.A O no hydrogen 3.323 N/A SER 152.A OG GLU 153.A O no hydrogen 3.454 N/A ARG 154.A N TRP 147.A O no hydrogen 2.790 N/A ARG 154.A NH1 GLU 184.A OE1 no hydrogen 3.260 N/A LEU 159.A N THR 177.A O no hydrogen 2.970 N/A SER 161.A N SER 175.A O no hydrogen 2.968 N/A THR 163.A N SER 173.A O no hydrogen 3.025 N/A THR 163.A OG1 ASP 164.A O no hydrogen 3.421 N/A GLN 165.A NE2 ILE 105.A O no hydrogen 2.877 N/A ASP 166.A N THR 171.A O no hydrogen 2.797 N/A LYS 168.A N ASP 166.A OD2 no hydrogen 3.223 N/A THR 171.A N ASP 169.A OD1 no hydrogen 2.915 N/A THR 171.A OG1 ASP 169.A OD1 no hydrogen 2.165 N/A TYR 172.A N PHE 138.A O no hydrogen 2.802 N/A TYR 172.A OH GLU 104.A OE2 no hydrogen 3.019 N/A SER 173.A N THR 163.A OG1 no hydrogen 3.157 N/A MET 174.A N LEU 135.A O no hydrogen 2.852 N/A SER 175.A N SER 161.A O no hydrogen 3.108 N/A SER 176.A N CYS 133.A O no hydrogen 2.961 N/A SER 176.A OG ASN 160.A OD1 no hydrogen 2.204 N/A THR 177.A N LEU 159.A O no hydrogen 3.076 N/A LEU 178.A N VAL 131.A O no hydrogen 3.065 N/A THR 179.A N GLY 157.A O no hydrogen 2.971 N/A THR 179.A OG1 SER 130.A OG no hydrogen 3.090 N/A LEU 180.A N ALA 129.A O no hydrogen 2.424 N/A LYS 182.A N GLY 127.A O no hydrogen 2.841 N/A GLU 184.A N THR 181.A OG1 no hydrogen 3.308 N/A TYR 185.A N THR 181.A O no hydrogen 2.879 N/A GLU 186.A N LYS 182.A O no hydrogen 2.928 N/A ARG 187.A N ASP 183.A O no hydrogen 3.303 N/A ARG 187.A N GLU 184.A O no hydrogen 3.295 N/A ARG 187.A NH1 GLU 184.A OE2 no hydrogen 2.944 N/A HIS 188.A N TYR 185.A O no hydrogen 3.265 N/A ASN 189.A N ASP 150.A OD1 no hydrogen 3.290 N/A ASN 189.A N ASP 150.A OD2 no hydrogen 3.193 N/A SER 190.A N ASP 150.A OD2 no hydrogen 2.993 N/A TYR 191.A N PHE 208.A O no hydrogen 3.161 N/A TYR 191.A OH TYR 185.A O no hydrogen 3.020 N/A THR 192.A N LYS 148.A O no hydrogen 2.650 N/A CYS 193.A N LYS 206.A O no hydrogen 2.828 N/A GLU 194.A N LYS 146.A O no hydrogen 2.643 N/A THR 196.A N ASN 144.A O no hydrogen 2.656 N/A LYS 198.A NZ ASP 109.A OD1 no hydrogen 3.428 N/A LYS 198.A NZ ASP 109.A OD2 no hydrogen 2.627 N/A THR 199.A OG1 HIS 197.A ND1 no hydrogen 2.349 N/A SER 200.A N HIS 197.A O no hydrogen 3.481 N/A SER 200.A OG SER 202.A O no hydrogen 3.305 N/A SER 202.A N SER 200.A OG no hydrogen 2.929 N/A ILE 204.A N ALA 195.A O no hydrogen 3.053 N/A LYS 206.A N CYS 193.A O no hydrogen 3.143 N/A PHE 208.A N TYR 191.A O no hydrogen 3.158 N/A ARG 210.A N ASN 189.A O no hydrogen 2.723 N/A ARG 210.A NE HIS 188.A O no hydrogen 2.728 N/A ARG 210.A NH2 GLU 186.A O no hydrogen 2.867 N/A ALA 211.A N ASN 189.A OD1 no hydrogen 2.858 N/A