Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kr4_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 8.A N GLY 5.A O no hydrogen 3.262 N/A ASN 13.A N LYS 9.A O no hydrogen 2.986 N/A LYS 14.A N ASP 10.A O no hydrogen 3.063 N/A ARG 15.A N ARG 11.A O no hydrogen 3.118 N/A LYS 16.A N ARG 12.A O no hydrogen 3.072 N/A HIS 17.A N ASN 13.A O no hydrogen 3.201 N/A GLU 18.A N LYS 14.A O no hydrogen 2.846 N/A LEU 19.A N ARG 15.A O no hydrogen 2.959 N/A LEU 20.A N LYS 16.A O no hydrogen 3.150 N/A GLU 21.A N HIS 17.A O no hydrogen 2.919 N/A GLU 22.A N GLU 18.A O no hydrogen 2.914 N/A ALA 23.A N LEU 19.A O no hydrogen 2.883 N/A CYS 24.A N LEU 20.A O no hydrogen 2.934 N/A CYS 24.A SG LEU 20.A O no hydrogen 3.658 N/A ARG 25.A N GLU 21.A O no hydrogen 2.875 N/A GLN 26.A N GLU 22.A O no hydrogen 3.161 N/A GLY 27.A N ALA 23.A O no hydrogen 3.269 N/A PHE 30.A N THR 100.A OG1 no hydrogen 3.331 N/A ALA 32.A N PRO 29.A O no hydrogen 2.999 N/A TRP 33.A N PHE 30.A O no hydrogen 3.352 N/A TRP 33.A NE1 LEU 28.A O no hydrogen 3.021 N/A VAL 38.A N ASP 34.A O no hydrogen 3.253 N/A VAL 38.A N GLY 35.A O no hydrogen 3.042 N/A VAL 39.A N GLY 35.A O no hydrogen 3.228 N/A SER 40.A N PRO 36.A O no hydrogen 3.141 N/A SER 40.A OG PRO 36.A O no hydrogen 3.181 N/A SER 40.A OG THR 37.A O no hydrogen 2.965 N/A TRP 41.A N THR 37.A O no hydrogen 3.164 N/A LEU 42.A N VAL 38.A O no hydrogen 2.967 N/A GLU 43.A N VAL 39.A O no hydrogen 3.277 N/A LEU 44.A N SER 40.A O no hydrogen 3.209 N/A TRP 45.A N TRP 41.A O no hydrogen 3.045 N/A VAL 46.A N TRP 41.A O no hydrogen 3.194 N/A GLY 47.A N LEU 42.A O no hydrogen 2.959 N/A MET 48.A N LEU 42.A O no hydrogen 3.136 N/A TYR 52.A N PRO 49.A O no hydrogen 3.072 N/A TYR 52.A OH HIS 85.A ND1 no hydrogen 2.810 N/A VAL 53.A N PRO 49.A O no hydrogen 3.353 N/A ALA 54.A N ALA 50.A O no hydrogen 3.013 N/A ALA 55.A N TRP 51.A O no hydrogen 3.368 N/A CYS 56.A N TYR 52.A O no hydrogen 3.086 N/A ARG 57.A N VAL 53.A O no hydrogen 3.038 N/A ASN 59.A ND2 GLU 77.A O no hydrogen 2.698 N/A VAL 60.A N CYS 56.A O no hydrogen 2.984 N/A GLY 63.A N TRP 33.A O no hydrogen 3.326 N/A MET 66.A N SER 62.A O no hydrogen 3.301 N/A ALA 67.A N GLY 63.A O no hydrogen 2.925 N/A ASN 68.A N ALA 64.A O no hydrogen 3.231 N/A LEU 69.A N MET 66.A O no hydrogen 3.158 N/A SER 70.A N GLU 73.A OE1 no hydrogen 3.463 N/A GLU 73.A N SER 70.A OG no hydrogen 3.195 N/A ILE 74.A N SER 70.A O no hydrogen 3.034 N/A ARG 76.A N GLU 73.A O no hydrogen 3.232 N/A GLU 77.A N GLU 73.A O no hydrogen 2.910 N/A ILE 78.A N ILE 74.A O no hydrogen 3.048 N/A GLY 79.A N ILE 74.A O no hydrogen 3.220 N/A LEU 84.A N ASN 82.A OD1 no hydrogen 2.871 N/A HIS 85.A N ASN 82.A OD1 no hydrogen 3.289 N/A HIS 85.A ND1 TYR 52.A OH no hydrogen 2.810 N/A HIS 85.A NE2 GLU 126.A O no hydrogen 3.056 N/A ARG 86.A N ASN 82.A O no hydrogen 3.002 N/A ARG 86.A NE ASP 71.A OD1 no hydrogen 2.485 N/A LEU 87.A N PRO 83.A O no hydrogen 2.942 N/A LYS 88.A N LEU 84.A O no hydrogen 2.945 N/A LYS 88.A NZ LEU 128.A O no hydrogen 3.262 N/A LYS 88.A NZ ASP 130.A OD2 no hydrogen 2.798 N/A LEU 89.A N HIS 85.A O no hydrogen 3.107 N/A ARG 90.A N ARG 86.A O no hydrogen 2.760 N/A LEU 91.A N LEU 87.A O no hydrogen 3.056 N/A ALA 92.A N LYS 88.A O no hydrogen 3.115 N/A ILE 93.A N LEU 89.A O no hydrogen 2.897 N/A GLN 94.A N ARG 90.A O no hydrogen 2.939 N/A GLU 95.A N LEU 91.A O no hydrogen 2.956 N/A MET 96.A N ALA 92.A O no hydrogen 3.104 N/A VAL 97.A N ILE 93.A O no hydrogen 3.141 N/A SER 98.A N GLN 94.A O no hydrogen 3.267 N/A SER 98.A OG GLN 94.A O no hydrogen 3.350 N/A LEU 99.A N MET 96.A O no hydrogen 3.314 N/A THR 100.A N VAL 97.A O no hydrogen 3.263 N/A THR 100.A OG1 MET 96.A O no hydrogen 2.696 N/A MET 102.A N ASP 101.A OD1 no hydrogen 2.429 N/A VAL 107.A N ASN 103.A O no hydrogen 2.973 N/A GLY 108.A N HIS 104.A O no hydrogen 2.731 N/A ASN 109.A N GLU 105.A O no hydrogen 2.840 N/A ASP 110.A N TRP 106.A O no hydrogen 2.885 N/A TRP 111.A N TRP 106.A O no hydrogen 2.996 N/A LEU 112.A N VAL 107.A O no hydrogen 2.996 N/A SER 114.A N ASP 110.A O no hydrogen 3.326 N/A SER 114.A OG TRP 111.A O no hydrogen 2.548 N/A LEU 115.A N TRP 111.A O no hydrogen 3.206 N/A LEU 115.A N LEU 112.A O no hydrogen 3.063 N/A GLY 116.A N PRO 113.A O no hydrogen 2.880 N/A LEU 117.A N LEU 112.A O no hydrogen 3.036 N/A TYR 120.A OH HIS 153.A ND1 no hydrogen 2.779 N/A ARG 121.A N PRO 118.A O no hydrogen 3.085 N/A ARG 121.A NE ASN 109.A OD1 no hydrogen 2.860 N/A ARG 121.A NH2 ASN 109.A OD1 no hydrogen 3.190 N/A PHE 124.A N TYR 120.A O no hydrogen 3.132 N/A MET 125.A N ARG 121.A O no hydrogen 2.966 N/A GLU 126.A N SER 122.A O no hydrogen 2.946 N/A SER 127.A N TYR 123.A O no hydrogen 3.086 N/A SER 127.A OG TYR 123.A O no hydrogen 2.736 N/A LEU 128.A N MET 125.A O no hydrogen 2.931 N/A VAL 129.A N PHE 124.A O no hydrogen 2.878 N/A ALA 131.A N MET 102.A O no hydrogen 3.313 N/A MET 133.A N ASP 130.A O no hydrogen 3.279 N/A LEU 134.A N ALA 131.A O no hydrogen 3.291 N/A HIS 136.A N MET 133.A O no hydrogen 2.825 N/A ASN 138.A N GLU 141.A OE1 no hydrogen 2.592 N/A LEU 142.A N ASN 138.A O no hydrogen 3.196 N/A ARG 143.A N LYS 139.A O no hydrogen 3.032 N/A ARG 143.A NH2 VAL 149.A O no hydrogen 2.922 N/A GLY 144.A N LYS 140.A O no hydrogen 3.117 N/A GLN 145.A NE2 ASN 82.A OD1 no hydrogen 2.753 N/A LEU 146.A N GLU 141.A O no hydrogen 3.036 N/A LYS 147.A N GLY 144.A O no hydrogen 3.359 N/A MET 148.A N LEU 142.A O no hydrogen 2.747 N/A VAL 149.A N LYS 147.A O no hydrogen 3.089 N/A PHE 152.A N ASP 150.A OD1 no hydrogen 3.132 N/A HIS 153.A ND1 TYR 120.A OH no hydrogen 2.779 N/A ARG 154.A N ASP 150.A O no hydrogen 3.340 N/A ARG 154.A NH1 MET 148.A O no hydrogen 3.075 N/A ARG 154.A NH1 VAL 149.A O no hydrogen 3.094 N/A VAL 155.A N SER 151.A O no hydrogen 2.982 N/A SER 156.A N PHE 152.A O no hydrogen 2.611 N/A SER 156.A OG GLY 216.A O no hydrogen 2.283 N/A SER 156.A OG HIS 218.A NE2 no hydrogen 3.057 N/A LEU 157.A N HIS 153.A O no hydrogen 2.783 N/A HIS 158.A N ARG 154.A O no hydrogen 2.815 N/A TYR 159.A N VAL 155.A O no hydrogen 2.918 N/A TYR 159.A OH ASP 225.A OD1 no hydrogen 3.369 N/A GLY 160.A N SER 156.A O no hydrogen 3.147 N/A ILE 161.A N LEU 157.A O no hydrogen 3.048 N/A MET 162.A N HIS 158.A O no hydrogen 3.063 N/A CYS 163.A N TYR 159.A O no hydrogen 3.103 N/A CYS 163.A SG MET 189.A O no hydrogen 3.663 N/A LEU 164.A N GLY 160.A O no hydrogen 3.150 N/A LYS 165.A N ILE 161.A O no hydrogen 2.985 N/A LYS 165.A NZ ASP 135.A OD1 no hydrogen 3.037 N/A ARG 166.A N MET 162.A O no hydrogen 2.956 N/A LEU 167.A N CYS 163.A O no hydrogen 3.178 N/A LEU 167.A N LEU 164.A O no hydrogen 3.110 N/A ASN 168.A N LYS 165.A O no hydrogen 3.025 N/A TYR 169.A N LEU 164.A O no hydrogen 2.934 N/A ASP 170.A N LEU 167.A O no hydrogen 3.109 N/A ARG 171.A NE GLU 175.A OE2 no hydrogen 3.028 N/A ARG 171.A NH1 ASP 101.A O no hydrogen 3.299 N/A LEU 174.A N ASP 170.A O no hydrogen 2.891 N/A GLU 175.A N ARG 171.A O no hydrogen 2.925 N/A ARG 176.A N LYS 172.A O no hydrogen 3.038 N/A ARG 176.A NE GLU 180.A OE2 no hydrogen 3.237 N/A ARG 177.A N ASP 173.A O no hydrogen 2.967 N/A ARG 177.A NE ASP 187.A OD1 no hydrogen 3.531 N/A ARG 177.A NE ASP 187.A OD2 no hydrogen 2.842 N/A ARG 178.A N LEU 174.A O no hydrogen 3.009 N/A ARG 178.A NE VAL 190.A O no hydrogen 2.978 N/A ARG 178.A NH2 SER 114.A OG no hydrogen 3.233 N/A GLU 179.A N GLU 175.A O no hydrogen 3.155 N/A GLU 180.A N ARG 176.A O no hydrogen 3.107 N/A SER 181.A N ARG 178.A O no hydrogen 3.439 N/A SER 181.A OG ARG 177.A O no hydrogen 3.007 N/A SER 181.A OG ARG 178.A O no hydrogen 3.177 N/A GLN 182.A NE2 ARG 178.A O no hydrogen 2.785 N/A VAL 188.A N GLY 261.A O no hydrogen 3.206 N/A TRP 191.A N VAL 188.A O no hydrogen 2.912 N/A ASN 193.A N SER 114.A O no hydrogen 2.775 N/A ASN 193.A ND2 LEU 212.A O no hydrogen 3.147 N/A ASN 193.A ND2 VAL 217.A O no hydrogen 2.557 N/A ARG 195.A N SER 192.A OG no hydrogen 3.282 N/A ARG 195.A NE SER 181.A O no hydrogen 2.707 N/A ARG 195.A NH1 ARG 195.A O no hydrogen 3.299 N/A ARG 195.A NH2 SER 181.A O no hydrogen 3.006 N/A VAL 196.A N SER 192.A O no hydrogen 2.993 N/A MET 197.A N ASN 193.A O no hydrogen 2.909 N/A GLY 198.A N GLU 194.A O no hydrogen 2.543 N/A TRP 199.A N ARG 195.A O no hydrogen 2.696 N/A VAL 200.A N VAL 196.A O no hydrogen 2.896 N/A SER 201.A N MET 197.A O no hydrogen 3.028 N/A SER 201.A OG MET 197.A O no hydrogen 3.342 N/A SER 201.A OG GLY 198.A O no hydrogen 3.302 N/A GLY 202.A N TRP 199.A O no hydrogen 3.118 N/A LEU 203.A N VAL 200.A O no hydrogen 3.216 N/A GLY 204.A N SER 201.A O no hydrogen 3.142 N/A LEU 205.A N VAL 200.A O no hydrogen 3.367 N/A PHE 208.A N LEU 205.A O no hydrogen 3.242 N/A ASN 211.A N PHE 208.A O no hydrogen 2.942 N/A ASN 211.A ND2 LEU 237.A O no hydrogen 3.228 N/A LEU 212.A N ALA 209.A O no hydrogen 3.157 N/A THR 213.A N THR 210.A O no hydrogen 3.173 N/A THR 213.A OG1 THR 210.A O no hydrogen 2.817 N/A SER 215.A N LEU 212.A O no hydrogen 3.123 N/A SER 215.A OG LEU 212.A O no hydrogen 2.405 N/A GLY 216.A N GLY 116.A O no hydrogen 2.880 N/A VAL 217.A N SER 215.A OG no hydrogen 3.188 N/A HIS 218.A NE2 SER 156.A O no hydrogen 2.810 N/A GLY 219.A N TRP 191.A O no hydrogen 2.817 N/A LEU 221.A N HIS 218.A O no hydrogen 3.184 N/A LEU 222.A N HIS 218.A O no hydrogen 3.438 N/A ALA 223.A N GLY 219.A O no hydrogen 3.040 N/A LEU 224.A N ALA 220.A O no hydrogen 3.001 N/A ASP 225.A N LEU 221.A O no hydrogen 3.044 N/A THR 227.A N ASP 225.A OD1 no hydrogen 3.308 N/A THR 227.A OG1 ASP 225.A OD1 no hydrogen 2.925 N/A THR 227.A OG1 ASP 225.A OD2 no hydrogen 3.134 N/A ASP 229.A N ASP 232.A OD2 no hydrogen 3.230 N/A SER 231.A OG ASP 229.A OD2 no hydrogen 3.363 N/A LEU 233.A N ASP 229.A O no hydrogen 3.507 N/A ALA 234.A N TYR 230.A O no hydrogen 2.738 N/A LEU 235.A N SER 231.A O no hydrogen 3.260 N/A LEU 236.A N ASP 232.A O no hydrogen 3.324 N/A LEU 237.A N LEU 233.A O no hydrogen 2.990 N/A LEU 237.A N ALA 234.A O no hydrogen 3.246 N/A GLN 238.A N LEU 235.A O no hydrogen 3.027 N/A ILE 239.A N ALA 234.A O no hydrogen 2.989 N/A THR 241.A OG1 GLN 242.A OE1 no hydrogen 3.398 N/A GLN 242.A N GLN 242.A OE1 no hydrogen 2.895 N/A ASN 243.A N PRO 240.A O no hydrogen 3.199 N/A ALA 246.A N ASN 243.A OD1 no hydrogen 3.025 N/A ARG 247.A NE PRO 240.A O no hydrogen 3.330 N/A ARG 247.A NH2 ILE 239.A O no hydrogen 2.956 N/A GLN 248.A N GLN 245.A O no hydrogen 2.994 N/A LEU 249.A N GLN 245.A O no hydrogen 2.961 N/A LEU 250.A N ALA 246.A O no hydrogen 2.875 N/A LYS 252.A N GLN 248.A O no hydrogen 2.912 N/A GLU 253.A N LEU 249.A O no hydrogen 2.834 N/A PHE 254.A N LEU 250.A O no hydrogen 2.638 N/A SER 255.A N GLU 251.A O no hydrogen 3.128 N/A SER 255.A OG GLU 251.A O no hydrogen 2.928 N/A ASN 256.A N LYS 252.A O no hydrogen 3.054 N/A LEU 257.A N GLU 253.A O no hydrogen 2.910 N/A ILE 258.A N PHE 254.A O no hydrogen 3.000 N/A SER 259.A N SER 255.A O no hydrogen 2.960 N/A SER 259.A OG SER 255.A O no hydrogen 2.491 N/A LEU 260.A N ASN 256.A O no hydrogen 2.905 N/A GLY 261.A N LEU 257.A O no hydrogen 2.929 N/A THR 262.A N ILE 258.A O no hydrogen 3.041 N/A THR 262.A OG1 ILE 258.A O no hydrogen 2.577 N/A ARG 264.A N THR 262.A OG1 no hydrogen 3.080 N/A ARG 264.A NH1 PHE 228.A O no hydrogen 3.074 N/A ARG 264.A NH2 LEU 222.A O no hydrogen 2.949 N/A ARG 264.A NH2 PHE 228.A O no hydrogen 2.788 N/A