Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cki_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N ASP 1.A O no hydrogen 2.336 N/A LYS 4.A N ASP 1.A O no hydrogen 3.146 N/A LYS 4.A NZ PHE 252.A O no hydrogen 3.336 N/A ASN 5.A ND2 GLN 253.A O no hydrogen 3.390 N/A THR 6.A N GLN 253.A O no hydrogen 2.891 N/A THR 6.A OG1 GLN 253.A O no hydrogen 3.530 N/A CYS 7.A N GLY 58.A O no hydrogen 2.838 N/A LYS 8.A NZ SER 256.A O no hydrogen 3.385 N/A LEU 9.A N GLN 60.A O no hydrogen 2.866 N/A LEU 10.A N LEU 116.A O no hydrogen 2.769 N/A VAL 11.A N GLN 63.A O no hydrogen 2.952 N/A VAL 12.A N HIS 118.A O no hydrogen 2.900 N/A ALA 13.A N ARG 65.A O no hydrogen 2.777 N/A ASP 14.A N PHE 120.A O no hydrogen 3.249 N/A HIS 15.A N ASN 81.A OD1 no hydrogen 2.851 N/A HIS 15.A ND1 ASN 81.A OD1 no hydrogen 2.968 N/A ARG 16.A NH1 ASP 92.A O no hydrogen 2.827 N/A PHE 17.A N ASP 14.A OD1 no hydrogen 2.892 N/A TYR 18.A N ASP 14.A O no hydrogen 3.142 N/A ARG 19.A N HIS 15.A O no hydrogen 3.085 N/A TYR 20.A N ARG 16.A O no hydrogen 2.850 N/A MET 21.A N PHE 17.A O no hydrogen 2.770 N/A GLY 22.A N PHE 17.A O no hydrogen 2.962 N/A GLY 24.A N TYR 18.A O no hydrogen 2.845 N/A GLU 25.A N GLY 22.A O no hydrogen 2.803 N/A THR 29.A N GLU 25.A O no hydrogen 3.184 N/A THR 29.A OG1 GLU 25.A O no hydrogen 3.054 N/A THR 30.A N GLU 26.A O no hydrogen 2.883 N/A THR 30.A OG1 GLU 26.A O no hydrogen 3.078 N/A ASN 31.A N SER 27.A O no hydrogen 2.842 N/A TYR 32.A N THR 28.A O no hydrogen 3.089 N/A LEU 33.A N THR 29.A O no hydrogen 3.135 N/A ILE 34.A N THR 30.A O no hydrogen 3.017 N/A GLU 35.A N ASN 31.A O no hydrogen 3.049 N/A LEU 36.A N TYR 32.A O no hydrogen 3.005 N/A ILE 37.A N LEU 33.A O no hydrogen 2.819 N/A ASP 38.A N ILE 34.A O no hydrogen 2.840 N/A ARG 39.A N GLU 35.A O no hydrogen 3.081 N/A ARG 39.A NE ASP 182.A OD1 no hydrogen 3.189 N/A ARG 39.A NE ASP 182.A OD2 no hydrogen 2.593 N/A ARG 39.A NH2 ASP 182.A OD1 no hydrogen 2.884 N/A VAL 40.A N LEU 36.A O no hydrogen 3.021 N/A ASP 41.A N ILE 37.A O no hydrogen 2.800 N/A ASP 42.A N ASP 38.A O no hydrogen 2.954 N/A ILE 43.A N ARG 39.A O no hydrogen 3.464 N/A TYR 44.A N VAL 40.A O no hydrogen 3.138 N/A TYR 44.A OH THR 186.A O no hydrogen 2.847 N/A ARG 45.A N ASP 41.A O no hydrogen 2.817 N/A ARG 45.A NH1 ASP 41.A OD2 no hydrogen 3.075 N/A ASN 46.A ND2 ASP 42.A O no hydrogen 2.957 N/A THR 47.A N TYR 44.A O no hydrogen 2.870 N/A THR 47.A OG1 ILE 43.A O no hydrogen 2.782 N/A TRP 49.A N PHE 54.A O no hydrogen 2.937 N/A ASN 51.A N ALA 48.A O no hydrogen 3.011 N/A ASN 51.A ND2 GLN 234.A OE1 no hydrogen 2.513 N/A ALA 52.A N ASP 50.A OD1 no hydrogen 2.593 N/A PHE 54.A N ASP 50.A OD1 no hydrogen 3.259 N/A GLY 56.A N ARG 45.A O no hydrogen 2.871 N/A GLY 58.A N ASN 5.A O no hydrogen 2.909 N/A ILE 59.A N ASP 41.A OD1 no hydrogen 2.854 N/A GLN 60.A N CYS 7.A O no hydrogen 3.193 N/A GLU 62.A N LEU 9.A O no hydrogen 2.920 N/A ARG 65.A N VAL 11.A O no hydrogen 2.822 N/A LEU 67.A N ALA 13.A O no hydrogen 2.812 N/A LYS 68.A NZ GLU 26.A OE1 no hydrogen 2.794 N/A GLN 71.A N ASN 81.A O no hydrogen 2.599 N/A GLN 71.A NE2 GLU 72.A O no hydrogen 3.200 N/A GLU 77.A N LYS 74.A O no hydrogen 3.044 N/A LYS 78.A NZ GLN 102.A OE1 no hydrogen 2.873 N/A TYR 80.A N ASP 106.A OD2 no hydrogen 3.229 N/A ASN 81.A ND2 SER 69.A O no hydrogen 2.878 N/A MET 82.A N HIS 79.A O no hydrogen 3.079 N/A SER 85.A OG ASN 88.A O no hydrogen 2.969 N/A SER 85.A OG GLU 89.A O no hydrogen 3.001 N/A SER 85.A OG LYS 91.A O no hydrogen 2.723 N/A LYS 91.A N ASN 88.A O no hydrogen 3.212 N/A LYS 91.A NZ ASN 88.A OD1 no hydrogen 2.895 N/A TRP 94.A N GLN 123.A OE1 no hydrogen 2.737 N/A ASP 95.A N TYR 86.A O no hydrogen 2.830 N/A MET 98.A N ASP 95.A OD2 no hydrogen 2.697 N/A LEU 99.A N ASP 95.A O no hydrogen 2.952 N/A LEU 99.A N VAL 96.A O no hydrogen 3.232 N/A LEU 100.A N VAL 96.A O no hydrogen 3.351 N/A GLU 101.A N LYS 97.A O no hydrogen 3.295 N/A GLN 102.A N MET 98.A O no hydrogen 3.097 N/A GLN 102.A NE2 ASP 106.A OD2 no hydrogen 3.211 N/A PHE 103.A N LEU 99.A O no hydrogen 2.840 N/A SER 104.A N LEU 100.A O no hydrogen 2.851 N/A SER 104.A OG LEU 100.A O no hydrogen 2.864 N/A SER 104.A OG SER 164.A OG no hydrogen 2.761 N/A PHE 105.A N GLU 101.A O no hydrogen 2.843 N/A ASP 106.A N GLN 102.A O no hydrogen 2.820 N/A ILE 107.A N PHE 103.A O no hydrogen 2.857 N/A ALA 111.A N ILE 107.A O no hydrogen 2.828 N/A SER 112.A N ALA 108.A O no hydrogen 2.991 N/A SER 112.A OG GLU 109.A O no hydrogen 2.678 N/A LYS 113.A N GLU 110.A O no hydrogen 3.144 N/A VAL 114.A N ALA 111.A O no hydrogen 3.161 N/A LEU 116.A N LYS 8.A O no hydrogen 3.403 N/A ALA 117.A N ASN 163.A O no hydrogen 2.837 N/A HIS 118.A N LEU 10.A O no hydrogen 2.835 N/A HIS 118.A NE2 THR 167.A OG1 no hydrogen 2.751 N/A LEU 119.A N GLY 165.A O no hydrogen 2.952 N/A PHE 120.A N VAL 12.A O no hydrogen 2.722 N/A THR 121.A N THR 167.A O no hydrogen 2.781 N/A THR 121.A OG1 ASP 14.A OD1 no hydrogen 3.474 N/A THR 121.A OG1 ASP 14.A OD2 no hydrogen 2.451 N/A TYR 122.A OH THR 175.A OG1 no hydrogen 2.627 N/A GLN 123.A N SER 168.A OG no hydrogen 3.304 N/A GLN 123.A NE2 THR 121.A OG1 no hydrogen 2.925 N/A ASP 124.A N ASP 92.A OD2 no hydrogen 2.995 N/A PHE 125.A N GLN 123.A O no hydrogen 3.094 N/A THR 129.A N ASP 126.A O no hydrogen 3.286 N/A THR 129.A OG1 ASP 126.A O no hydrogen 3.153 N/A LEU 132.A N LEU 166.A O no hydrogen 3.382 N/A TYR 134.A N SER 164.A O no hydrogen 3.357 N/A GLY 136.A N HIS 191.A O no hydrogen 2.559 N/A ARG 139.A N SER 137.A OG no hydrogen 2.985 N/A SER 142.A N ARG 139.A O no hydrogen 2.704 N/A SER 142.A OG GLY 144.A O no hydrogen 3.097 N/A GLY 145.A N LEU 162.A O no hydrogen 3.054 N/A VAL 146.A N ASN 192.A O no hydrogen 2.998 N/A CYS 147.A N CYS 115.A O no hydrogen 3.085 N/A CYS 147.A SG LYS 247.A O no hydrogen 3.503 N/A LYS 149.A NZ ALA 140.A O no hydrogen 3.270 N/A TYR 151.A N ILE 160.A O no hydrogen 2.841 N/A SER 153.A N LYS 158.A O no hydrogen 3.026 N/A GLY 156.A N SER 153.A OG no hydrogen 3.361 N/A LYS 157.A N SER 153.A O no hydrogen 2.750 N/A LYS 157.A N PRO 154.A O no hydrogen 3.291 N/A LYS 157.A NZ PRO 154.A O no hydrogen 3.063 N/A LYS 158.A NZ PHE 105.A O no hydrogen 2.889 N/A ILE 160.A N TYR 151.A O no hydrogen 2.784 N/A ASN 163.A N ASN 163.A OD1 no hydrogen 2.649 N/A ASN 163.A ND2 ALA 111.A O no hydrogen 2.983 N/A ASN 163.A ND2 VAL 114.A O no hydrogen 2.972 N/A ASN 163.A ND2 CYS 115.A O no hydrogen 3.244 N/A SER 164.A OG SER 104.A OG no hydrogen 2.761 N/A LEU 166.A N LEU 132.A O no hydrogen 3.066 N/A THR 167.A N LEU 119.A O no hydrogen 2.851 N/A THR 167.A OG1 HIS 118.A NE2 no hydrogen 2.751 N/A THR 167.A OG1 THR 185.A OG1 no hydrogen 2.865 N/A SER 168.A N LEU 130.A O no hydrogen 2.907 N/A SER 168.A OG GLN 123.A O no hydrogen 2.770 N/A SER 168.A OG LYS 170.A O no hydrogen 3.261 N/A THR 169.A N THR 121.A O no hydrogen 3.160 N/A LYS 170.A N SER 168.A OG no hydrogen 3.173 N/A LYS 170.A NZ ASP 92.A OD2 no hydrogen 3.403 N/A ASN 171.A N LYS 174.A O no hydrogen 2.826 N/A TYR 172.A N ASP 124.A OD1 no hydrogen 2.864 N/A GLY 173.A N ASP 124.A OD2 no hydrogen 2.567 N/A LYS 174.A N ASN 171.A O no hydrogen 3.053 N/A THR 175.A OG1 TYR 122.A OH no hydrogen 2.627 N/A ILE 176.A N THR 169.A O no hydrogen 2.886 N/A LEU 177.A N GLU 180.A OE1 no hydrogen 2.965 N/A LYS 179.A NZ ASP 225.A OD1 no hydrogen 3.541 N/A GLU 180.A N LEU 177.A O no hydrogen 2.865 N/A ALA 181.A N LEU 177.A O no hydrogen 2.844 N/A ASP 182.A N THR 178.A O no hydrogen 2.780 N/A VAL 184.A N GLU 180.A O no hydrogen 3.019 N/A THR 185.A N ALA 181.A O no hydrogen 3.214 N/A THR 185.A OG1 THR 167.A OG1 no hydrogen 2.865 N/A THR 185.A OG1 ALA 181.A O no hydrogen 3.495 N/A THR 186.A N ASP 182.A O no hydrogen 3.055 N/A THR 186.A OG1 ASP 182.A O no hydrogen 2.693 N/A HIS 187.A N LEU 183.A O no hydrogen 3.071 N/A HIS 187.A ND1 VAL 216.A O no hydrogen 2.635 N/A GLU 188.A N VAL 184.A O no hydrogen 2.911 N/A LEU 189.A N THR 185.A O no hydrogen 2.833 N/A GLY 190.A N THR 186.A O no hydrogen 2.737 N/A HIS 191.A N HIS 187.A O no hydrogen 3.186 N/A HIS 191.A ND1 ALA 195.A O no hydrogen 2.695 N/A ASN 192.A N GLU 188.A O no hydrogen 3.155 N/A ASN 192.A ND2 TYR 134.A O no hydrogen 2.821 N/A ASN 192.A ND2 SER 164.A O no hydrogen 3.164 N/A PHE 193.A N LEU 189.A O no hydrogen 2.836 N/A GLY 194.A N HIS 191.A O no hydrogen 2.728 N/A ALA 195.A N GLY 190.A O no hydrogen 2.927 N/A ASP 198.A N MET 217.A O no hydrogen 3.191 N/A LEU 202.A N ASP 200.A O no hydrogen 2.357 N/A CYS 205.A SG SER 233.A OG no hydrogen 3.750 N/A GLN 211.A N ASN 208.A O no hydrogen 2.782 N/A GLY 212.A N GLU 209.A O no hydrogen 2.893 N/A GLY 213.A N ASN 208.A O no hydrogen 3.115 N/A LYS 214.A NZ PRO 207.A O no hydrogen 3.010 N/A VAL 216.A N MET 231.A O no hydrogen 3.037 N/A TYR 218.A N TYR 215.A O no hydrogen 2.929 N/A TYR 218.A OH ASP 200.A OD1 no hydrogen 3.183 N/A TYR 218.A OH ASP 200.A OD2 no hydrogen 3.365 N/A SER 223.A OG ASP 225.A OD2 no hydrogen 2.581 N/A GLY 224.A N SER 223.A OG no hydrogen 2.520 N/A ASP 225.A N SER 223.A OG no hydrogen 3.154 N/A HIS 226.A ND1 ASN 229.A OD1 no hydrogen 3.019 N/A ASN 228.A N GLY 212.A O no hydrogen 2.965 N/A ASN 228.A ND2 GLN 211.A O no hydrogen 3.452 N/A ASN 228.A ND2 GLY 213.A O no hydrogen 2.766 N/A ASN 229.A N HIS 226.A O no hydrogen 3.299 N/A ASN 229.A ND2 LYS 214.A O no hydrogen 2.838 N/A MET 231.A N ASN 228.A O no hydrogen 2.900 N/A SER 233.A OG ASP 198.A OD1 no hydrogen 2.600 N/A GLN 234.A NE2 ASN 51.A OD1 no hydrogen 3.678 N/A SER 236.A N SER 233.A OG no hydrogen 3.008 N/A SER 236.A OG ASP 198.A OD1 no hydrogen 3.394 N/A LYS 237.A N SER 233.A O no hydrogen 2.941 N/A LYS 237.A NZ ALA 48.A O no hydrogen 3.464 N/A LYS 237.A NZ ASN 51.A OD1 no hydrogen 3.386 N/A GLN 238.A N GLN 234.A O no hydrogen 3.136 N/A SER 239.A N CYS 235.A O no hydrogen 3.289 N/A SER 239.A OG GLY 194.A O no hydrogen 2.624 N/A ILE 240.A N SER 236.A O no hydrogen 2.673 N/A TYR 241.A N LYS 237.A O no hydrogen 2.752 N/A LYS 242.A N GLN 238.A O no hydrogen 3.259 N/A THR 243.A N SER 239.A O no hydrogen 3.461 N/A THR 243.A OG1 SER 239.A O no hydrogen 3.427 N/A ILE 244.A N ILE 240.A O no hydrogen 2.819 N/A GLU 245.A N TYR 241.A O no hydrogen 2.897 N/A SER 246.A N LYS 242.A O no hydrogen 3.159 N/A SER 246.A N THR 243.A O no hydrogen 3.248 N/A SER 246.A OG PRO 138.A O no hydrogen 3.008 N/A LYS 247.A N THR 243.A O no hydrogen 2.826 N/A LYS 247.A NZ SER 137.A O no hydrogen 2.803 N/A ALA 248.A N ILE 244.A O no hydrogen 2.836 N/A CYS 251.A N LYS 247.A O no hydrogen 3.156 N/A PHE 252.A N ALA 248.A O no hydrogen 2.960 N/A GLN 253.A N THR 6.A O no hydrogen 2.794 N/A ARG 255.A NH1 ASP 41.A OD1 no hydrogen 3.429 N/A ARG 255.A NH1 ASP 41.A OD2 no hydrogen 3.200 N/A ARG 255.A NH2 ASP 41.A OD2 no hydrogen 2.657 N/A SER 256.A N GLN 60.A OE1 no hydrogen 2.644 N/A