Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kai_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N GLU 5.A OE1 no hydrogen 2.818 N/A GLU 5.A N ASN 2.A OD1 no hydrogen 3.302 N/A ARG 6.A N ASN 2.A O no hydrogen 3.356 N/A PHE 7.A N LEU 3.A O no hydrogen 2.905 N/A CYS 8.A N TRP 4.A O no hydrogen 2.973 N/A CYS 8.A SG TRP 4.A O no hydrogen 3.213 N/A ASN 9.A N GLU 5.A O no hydrogen 2.995 N/A TRP 10.A N ARG 6.A O no hydrogen 3.213 N/A VAL 11.A N PHE 7.A O no hydrogen 3.033 N/A THR 12.A N CYS 8.A O no hydrogen 3.251 N/A THR 12.A OG1 CYS 8.A O no hydrogen 2.814 N/A SER 13.A N TRP 10.A O no hydrogen 3.302 N/A THR 14.A OG1 ASP 15.A OD1 no hydrogen 3.459 N/A ASP 15.A N SER 13.A OG no hydrogen 3.398 N/A ASN 16.A ND2 TRP 10.A O no hydrogen 3.182 N/A ARG 17.A NH1 ARG 17.A O no hydrogen 3.122 N/A TYR 19.A OH GLU 122.A OE1 no hydrogen 2.902 N/A GLY 21.A N VAL 11.A O no hydrogen 2.815 N/A TRP 22.A N GLU 122.A OE1 no hydrogen 2.835 N/A PHE 23.A N GLU 122.A OE2 no hydrogen 3.238 N/A VAL 25.A N GLY 21.A O no hydrogen 3.149 N/A ILE 26.A N PHE 23.A O no hydrogen 3.312 N/A MET 27.A N PHE 23.A O no hydrogen 3.076 N/A ILE 28.A N GLY 24.A O no hydrogen 3.058 N/A THR 30.A N ILE 26.A O no hydrogen 3.465 N/A THR 30.A OG1 ILE 26.A O no hydrogen 2.669 N/A THR 30.A OG1 MET 27.A O no hydrogen 3.071 N/A LEU 31.A N MET 27.A O no hydrogen 2.879 N/A LEU 32.A N ILE 28.A O no hydrogen 3.061 N/A ALA 33.A N PRO 29.A O no hydrogen 3.006 N/A ALA 34.A N THR 30.A O no hydrogen 3.124 N/A THR 35.A N LEU 31.A O no hydrogen 2.869 N/A THR 35.A OG1 LEU 31.A O no hydrogen 2.758 N/A ILE 36.A N LEU 32.A O no hydrogen 2.794 N/A CYS 37.A N ALA 33.A O no hydrogen 3.184 N/A PHE 38.A N ALA 34.A O no hydrogen 3.107 N/A PHE 38.A N THR 35.A O no hydrogen 3.190 N/A VAL 39.A N THR 35.A O no hydrogen 3.095 N/A ILE 40.A N ILE 36.A O no hydrogen 3.372 N/A ALA 41.A N CYS 37.A O no hydrogen 3.100 N/A PHE 42.A N PHE 38.A O no hydrogen 2.784 N/A ILE 43.A N ILE 40.A O no hydrogen 3.165 N/A ALA 44.A N ILE 40.A O no hydrogen 2.952 N/A ALA 45.A N ALA 41.A O no hydrogen 3.184 N/A VAL 48.A N VAL 57.A O no hydrogen 3.075 N/A ASP 49.A N TYR 97.A O no hydrogen 3.125 N/A ILE 53.A N ASP 49.A OD1 no hydrogen 3.224 N/A ARG 54.A N ASP 49.A OD2 no hydrogen 2.815 N/A GLU 55.A N ASP 49.A OD1 no hydrogen 3.284 N/A VAL 57.A N VAL 48.A O no hydrogen 2.632 N/A SER 58.A OG TYR 63.A O no hydrogen 3.082 N/A SER 60.A OG ILE 43.A O no hydrogen 3.411 N/A SER 60.A OG ALA 45.A O no hydrogen 2.921 N/A LEU 61.A N PHE 42.A O no hydrogen 3.112 N/A LEU 62.A N ILE 43.A O no hydrogen 2.941 N/A TYR 63.A N SER 60.A O no hydrogen 3.317 N/A GLY 64.A N LEU 61.A O no hydrogen 3.191 N/A ASN 65.A N LEU 61.A O no hydrogen 3.483 N/A ASN 65.A ND2 SER 58.A OG no hydrogen 3.010 N/A ASN 65.A ND2 SER 60.A O no hydrogen 2.637 N/A ASN 66.A N THR 69.A OG1 no hydrogen 2.965 N/A THR 69.A N ASN 66.A OD1 no hydrogen 2.784 N/A THR 69.A OG1 ASN 65.A OD1 no hydrogen 3.185 N/A THR 69.A OG1 ASN 66.A O no hydrogen 3.529 N/A THR 69.A OG1 ASN 66.A OD1 no hydrogen 3.339 N/A GLY 70.A N ASN 66.A O no hydrogen 2.786 N/A ALA 71.A N GLY 59.A O no hydrogen 2.835 N/A VAL 72.A N LEU 164.A O no hydrogen 3.180 N/A SER 76.A N ASN 98.A O no hydrogen 3.143 N/A ALA 78.A N SER 76.A OG no hydrogen 3.195 N/A ILE 79.A N SER 76.A O no hydrogen 3.210 N/A HIS 82.A N ILE 79.A O no hydrogen 3.035 N/A TYR 84.A N GLN 103.A OE1 no hydrogen 2.831 N/A TYR 84.A OH GLU 94.A O no hydrogen 3.325 N/A TYR 84.A OH GLU 94.A OE2 no hydrogen 3.288 N/A GLU 88.A N PRO 85.A O no hydrogen 3.371 N/A ALA 89.A N ILE 86.A O no hydrogen 3.323 N/A ALA 90.A N GLU 94.A OE1 no hydrogen 3.117 N/A SER 91.A OG ASP 93.A OD1 no hydrogen 3.471 N/A GLU 94.A N SER 91.A OG no hydrogen 3.363 N/A TRP 95.A N SER 91.A O no hydrogen 3.069 N/A LEU 96.A N LEU 92.A O no hydrogen 2.769 N/A TYR 97.A N ASP 93.A O no hydrogen 2.858 N/A ASN 98.A N GLU 94.A O no hydrogen 3.046 N/A ASN 98.A ND2 GLU 94.A O no hydrogen 2.499 N/A GLY 100.A N TRP 95.A O no hydrogen 2.786 N/A TYR 102.A N GLY 99.A O no hydrogen 3.225 N/A TYR 102.A OH MET 162.A O no hydrogen 2.690 N/A GLN 103.A NE2 HIS 82.A O no hydrogen 3.077 N/A LEU 104.A N GLY 100.A O no hydrogen 3.435 N/A ILE 105.A N PRO 101.A O no hydrogen 2.995 N/A ILE 105.A N TYR 102.A O no hydrogen 3.173 N/A ILE 106.A N TYR 102.A O no hydrogen 3.080 N/A PHE 107.A N GLN 103.A O no hydrogen 3.111 N/A HIS 108.A N LEU 104.A O no hydrogen 3.355 N/A HIS 108.A ND1 LEU 104.A O no hydrogen 2.870 N/A PHE 109.A N ILE 105.A O no hydrogen 2.868 N/A LEU 110.A N ILE 106.A O no hydrogen 2.873 N/A LEU 111.A N PHE 107.A O no hydrogen 3.183 N/A GLY 112.A N HIS 108.A O no hydrogen 3.030 N/A ALA 113.A N PHE 109.A O no hydrogen 2.642 N/A SER 114.A N LEU 110.A O no hydrogen 2.972 N/A SER 114.A OG LEU 110.A O no hydrogen 2.984 N/A CYS 115.A N LEU 111.A O no hydrogen 3.366 N/A CYS 115.A SG LEU 111.A O no hydrogen 3.421 N/A TYR 116.A N GLY 112.A O no hydrogen 2.968 N/A MET 117.A N ALA 113.A O no hydrogen 3.226 N/A MET 117.A N SER 114.A O no hydrogen 3.072 N/A GLY 118.A N SER 114.A O no hydrogen 3.167 N/A ARG 119.A N CYS 115.A O no hydrogen 2.766 N/A ARG 119.A NE TYR 19.A O no hydrogen 2.838 N/A ARG 119.A NH2 TYR 19.A O no hydrogen 2.818 N/A GLN 120.A N MET 117.A O no hydrogen 3.040 N/A GLU 122.A N GLY 118.A O no hydrogen 3.123 N/A LEU 123.A N ARG 119.A O no hydrogen 3.305 N/A SER 124.A N GLN 120.A O no hydrogen 3.460 N/A SER 124.A OG GLN 120.A O no hydrogen 3.276 N/A SER 124.A OG TRP 121.A O no hydrogen 2.529 N/A TYR 125.A N TRP 121.A O no hydrogen 2.895 N/A ARG 126.A N GLU 122.A O no hydrogen 3.117 N/A LEU 127.A N LEU 123.A O no hydrogen 3.046 N/A MET 129.A N SER 124.A O no hydrogen 2.925 N/A CYS 134.A SG PRO 131.A O no hydrogen 3.527 N/A TYR 137.A N ILE 133.A O no hydrogen 3.262 N/A SER 138.A N VAL 135.A O no hydrogen 3.238 N/A SER 138.A OG VAL 135.A O no hydrogen 2.389 N/A ALA 139.A N ALA 136.A O no hydrogen 3.371 N/A LEU 141.A N TYR 137.A O no hydrogen 3.174 N/A ALA 142.A N SER 138.A O no hydrogen 2.750 N/A SER 143.A N ALA 139.A O no hydrogen 3.129 N/A SER 143.A OG ALA 139.A O no hydrogen 2.848 N/A ALA 144.A N PRO 140.A O no hydrogen 3.166 N/A PHE 145.A N LEU 141.A O no hydrogen 3.035 N/A ALA 146.A N ALA 142.A O no hydrogen 3.193 N/A PHE 148.A N ALA 144.A O no hydrogen 3.185 N/A LEU 149.A N PHE 145.A O no hydrogen 3.044 N/A ILE 150.A N PHE 145.A O no hydrogen 2.874 N/A TYR 151.A N ALA 146.A O no hydrogen 2.904 N/A TYR 151.A OH HIS 180.A NE2 no hydrogen 2.691 N/A ILE 153.A N LEU 149.A O no hydrogen 3.071 N/A GLY 154.A N ILE 150.A O no hydrogen 3.013 N/A GLN 155.A N TYR 151.A O no hydrogen 3.024 N/A GLN 155.A NE2 ALA 284.A O no hydrogen 3.093 N/A GLN 155.A NE2 ASN 286.A OD1 no hydrogen 3.038 N/A GLY 156.A N PRO 152.A O no hydrogen 2.652 N/A SER 157.A OG ASN 77.A OD1 no hydrogen 3.114 N/A SER 157.A OG SER 159.A OG no hydrogen 2.774 N/A PHE 158.A N GLY 80.A O no hydrogen 3.099 N/A SER 159.A N SER 157.A OG no hydrogen 3.141 N/A SER 159.A OG ASN 77.A OD1 no hydrogen 3.417 N/A SER 159.A OG SER 157.A OG no hydrogen 2.774 N/A ASP 160.A N SER 157.A O no hydrogen 3.371 N/A GLY 161.A N PHE 158.A O no hydrogen 3.065 N/A MET 162.A N VAL 147.A O no hydrogen 2.985 N/A LEU 164.A N VAL 72.A O no hydrogen 3.407 N/A SER 167.A N ILE 68.A O no hydrogen 2.920 N/A SER 167.A OG ILE 68.A O no hydrogen 2.708 N/A THR 169.A N GLY 165.A O no hydrogen 2.986 N/A THR 169.A N ILE 166.A O no hydrogen 3.201 N/A THR 169.A OG1 GLY 165.A O no hydrogen 2.492 N/A PHE 170.A N ILE 166.A O no hydrogen 3.474 N/A ASN 171.A N SER 167.A O no hydrogen 3.158 N/A PHE 172.A N GLY 168.A O no hydrogen 3.149 N/A MET 173.A N THR 169.A O no hydrogen 3.054 N/A ILE 174.A N PHE 170.A O no hydrogen 3.188 N/A VAL 175.A N ASN 171.A O no hydrogen 3.311 N/A PHE 176.A N PHE 172.A O no hydrogen 3.286 N/A GLN 177.A N MET 173.A O no hydrogen 3.168 N/A GLN 177.A NE2 ASN 181.A OD1 no hydrogen 2.927 N/A GLN 177.A NE2 ASN 315.A OD1 no hydrogen 2.719 N/A ALA 178.A N ILE 174.A O no hydrogen 3.168 N/A GLU 179.A N VAL 175.A O no hydrogen 3.096 N/A HIS 180.A N PHE 176.A O no hydrogen 3.077 N/A HIS 180.A ND1 ASN 288.A OD1 no hydrogen 2.774 N/A HIS 180.A NE2 TYR 151.A OH no hydrogen 2.691 N/A ASN 181.A N GLN 177.A O no hydrogen 2.741 N/A LEU 183.A N GLN 177.A OE1 no hydrogen 3.283 N/A MET 184.A N ASN 181.A O no hydrogen 3.088 N/A HIS 185.A N ILE 182.A O no hydrogen 3.048 N/A PHE 187.A N HIS 185.A ND1 no hydrogen 3.052 N/A GLN 189.A N HIS 185.A O no hydrogen 3.254 N/A GLN 189.A NE2 LEU 183.A O no hydrogen 3.232 N/A LEU 190.A N PRO 186.A O no hydrogen 3.214 N/A GLY 191.A N PHE 187.A O no hydrogen 2.967 N/A VAL 192.A N HIS 188.A O no hydrogen 2.819 N/A ALA 193.A N GLN 189.A O no hydrogen 3.104 N/A GLY 194.A N LEU 190.A O no hydrogen 2.942 N/A GLY 194.A N GLY 191.A O no hydrogen 3.225 N/A VAL 195.A N GLY 191.A O no hydrogen 3.181 N/A PHE 196.A N VAL 192.A O no hydrogen 2.881 N/A GLY 197.A N ALA 193.A O no hydrogen 3.257 N/A GLY 198.A N GLY 194.A O no hydrogen 2.931 N/A ALA 199.A N VAL 195.A O no hydrogen 2.896 N/A LEU 200.A N PHE 196.A O no hydrogen 2.782 N/A PHE 201.A N GLY 197.A O no hydrogen 2.571 N/A CYS 202.A N GLY 198.A O no hydrogen 2.863 N/A ALA 203.A N ALA 199.A O no hydrogen 3.026 N/A MET 204.A N LEU 200.A O no hydrogen 2.805 N/A HIS 205.A N PHE 201.A O no hydrogen 2.968 N/A GLY 206.A N CYS 202.A O no hydrogen 3.039 N/A SER 207.A N ALA 203.A O no hydrogen 2.962 N/A SER 207.A OG ALA 203.A O no hydrogen 2.877 N/A SER 207.A OG MET 204.A O no hydrogen 2.930 N/A LEU 208.A N MET 204.A O no hydrogen 3.059 N/A VAL 209.A N HIS 205.A O no hydrogen 3.259 N/A THR 210.A N GLY 206.A O no hydrogen 3.178 N/A THR 210.A OG1 GLY 206.A O no hydrogen 2.674 N/A SER 211.A N SER 207.A O no hydrogen 2.953 N/A SER 211.A OG SER 207.A O no hydrogen 2.956 N/A SER 211.A OG LEU 208.A O no hydrogen 2.662 N/A SER 212.A N LEU 208.A O no hydrogen 3.290 N/A SER 212.A N VAL 209.A O no hydrogen 3.142 N/A SER 212.A OG LEU 208.A O no hydrogen 3.124 N/A SER 212.A OG VAL 209.A O no hydrogen 3.478 N/A SER 212.A OG ASN 237.A O no hydrogen 3.380 N/A ILE 214.A N THR 235.A O no hydrogen 3.295 N/A ASN 224.A N SER 222.A OG no hydrogen 3.222 N/A GLY 226.A N ALA 223.A O no hydrogen 3.225 N/A GLN 231.A N LYS 228.A O no hydrogen 3.304 N/A GLN 231.A NE2 GLU 233.A O no hydrogen 2.780 N/A THR 235.A N GLU 234.A OE1 no hydrogen 3.091 N/A ASN 237.A N SER 212.A O no hydrogen 3.068 N/A HIS 242.A N ILE 238.A O no hydrogen 3.262 N/A GLY 243.A N VAL 239.A O no hydrogen 3.248 N/A TYR 244.A N ALA 240.A O no hydrogen 3.343 N/A PHE 245.A N ALA 241.A O no hydrogen 2.868 N/A GLY 246.A N HIS 242.A O no hydrogen 2.536 N/A ARG 247.A N GLY 243.A O no hydrogen 3.273 N/A ARG 247.A NH2 GLY 243.A O no hydrogen 3.279 N/A LEU 248.A N TYR 244.A O no hydrogen 3.244 N/A ALA 253.A N PHE 250.A O no hydrogen 3.002 N/A SER 258.A OG HIS 262.A ND1 no hydrogen 3.154 N/A SER 260.A N ASN 257.A OD1 no hydrogen 2.467 N/A LEU 261.A N ASN 257.A O no hydrogen 2.988 N/A HIS 262.A N SER 258.A O no hydrogen 2.844 N/A HIS 262.A ND1 SER 258.A O no hydrogen 3.006 N/A PHE 263.A N ARG 259.A O no hydrogen 3.014 N/A PHE 264.A N SER 260.A O no hydrogen 3.168 N/A LEU 265.A N LEU 261.A O no hydrogen 2.999 N/A ALA 266.A N HIS 262.A O no hydrogen 3.319 N/A ALA 266.A N PHE 263.A O no hydrogen 3.216 N/A ALA 267.A N PHE 263.A O no hydrogen 2.940 N/A TRP 268.A N PHE 264.A O no hydrogen 3.202 N/A TRP 268.A NE1 ALA 193.A O no hydrogen 2.717 N/A VAL 271.A N ALA 267.A O no hydrogen 3.120 N/A GLY 272.A N TRP 268.A O no hydrogen 3.068 N/A VAL 273.A N PRO 269.A O no hydrogen 2.880 N/A TRP 274.A N VAL 270.A O no hydrogen 2.794 N/A TRP 274.A NE1 SER 138.A OG no hydrogen 3.227 N/A PHE 275.A N VAL 271.A O no hydrogen 3.332 N/A THR 276.A N GLY 272.A O no hydrogen 3.340 N/A ALA 277.A N VAL 273.A O no hydrogen 2.886 N/A LEU 278.A N TRP 274.A O no hydrogen 3.043 N/A GLY 279.A N PHE 275.A O no hydrogen 2.626 N/A ILE 280.A N THR 276.A O no hydrogen 3.262 N/A SER 281.A N ALA 277.A O no hydrogen 3.184 N/A SER 281.A OG ALA 277.A O no hydrogen 3.143 N/A THR 282.A N LEU 278.A O no hydrogen 2.678 N/A THR 282.A OG1 LEU 278.A O no hydrogen 2.818 N/A THR 282.A OG1 GLY 279.A O no hydrogen 3.269 N/A MET 283.A N GLY 279.A O no hydrogen 3.103 N/A ALA 284.A N SER 281.A O no hydrogen 3.195 N/A PHE 285.A N THR 282.A O no hydrogen 3.224 N/A ASN 286.A N MET 283.A O no hydrogen 3.040 N/A GLY 289.A N HIS 180.A O no hydrogen 3.068 N/A PHE 290.A N MET 184.A O no hydrogen 3.269 N/A ASN 293.A N ASN 291.A OD1 no hydrogen 2.922 N/A HIS 294.A N ASP 309.A OD1 no hydrogen 2.758 N/A SER 295.A N PHE 292.A O no hydrogen 3.268 N/A ASP 298.A N ASN 302.A O no hydrogen 3.007 N/A GLY 301.A N ASP 298.A OD1 no hydrogen 2.893 N/A ASN 302.A ND2 ASP 298.A OD1 no hydrogen 3.468 N/A ASN 302.A ND2 ASP 298.A OD2 no hydrogen 2.925 N/A ILE 304.A N VAL 296.A O no hydrogen 2.956 N/A THR 306.A N ASP 309.A OD2 no hydrogen 2.935 N/A THR 306.A OG1 ASP 309.A OD2 no hydrogen 3.186 N/A ALA 308.A N THR 306.A OG1 no hydrogen 3.196 N/A ASP 309.A N THR 306.A O no hydrogen 3.190 N/A ILE 310.A N THR 306.A O no hydrogen 3.371 N/A ILE 311.A N TRP 307.A O no hydrogen 3.245 N/A ASN 312.A N ALA 308.A O no hydrogen 3.148 N/A ARG 313.A N ASP 309.A O no hydrogen 3.227 N/A ARG 313.A N ILE 310.A O no hydrogen 3.237 N/A ALA 314.A N ILE 310.A O no hydrogen 3.411 N/A ASN 315.A N ILE 311.A O no hydrogen 2.950 N/A ASN 315.A ND2 ASN 181.A OD1 no hydrogen 3.602 N/A LEU 316.A N ASN 312.A O no hydrogen 3.018 N/A GLY 317.A N ARG 313.A O no hydrogen 3.265 N/A MET 318.A N ALA 314.A O no hydrogen 3.260 N/A GLU 319.A N ASN 315.A O no hydrogen 2.836 N/A VAL 320.A N LEU 316.A O no hydrogen 3.127 N/A HIS 322.A N MET 318.A O no hydrogen 3.104 N/A HIS 322.A ND1 GLU 319.A O no hydrogen 2.635 N/A ASN 325.A ND2 GLU 55.A OE1 no hydrogen 3.221 N/A ALA 326.A N GLU 323.A O no hydrogen 3.260 N/A