Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aik_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A ND2 ASP 8.A OD1 no hydrogen 3.090 N/A ASN 4.A ND2 ARG 98.A O no hydrogen 3.093 N/A TYR 7.A N TYR 3.A O no hydrogen 3.188 N/A TYR 7.A N ASN 4.A O no hydrogen 3.306 N/A ASP 8.A N TYR 3.A O no hydrogen 3.190 N/A ASP 9.A N ASP 13.A O no hydrogen 3.105 N/A ASN 11.A N ASP 9.A OD1 no hydrogen 2.947 N/A TYR 12.A N ASP 9.A O no hydrogen 3.410 N/A ASP 13.A N ASP 9.A OD1 no hydrogen 2.964 N/A TYR 14.A OH GLU 20.A OE1 no hydrogen 2.620 N/A TYR 14.A OH GLU 20.A OE2 no hydrogen 3.404 N/A ILE 15.A N TYR 7.A O no hydrogen 2.898 N/A GLY 19.A N ILE 28.A O no hydrogen 2.852 N/A GLU 20.A N LYS 17.A O no hydrogen 3.416 N/A TRP 22.A N TYR 26.A O no hydrogen 2.805 N/A TRP 22.A NE1 GLU 20.A OE1 no hydrogen 2.960 N/A ARG 25.A N TRP 22.A O no hydrogen 2.827 N/A ARG 25.A NE ASP 45.A OD1 no hydrogen 2.994 N/A ARG 25.A NH2 ASP 45.A OD2 no hydrogen 3.194 N/A TYR 26.A N TRP 22.A O no hydrogen 3.055 N/A GLU 27.A N TYR 44.A O no hydrogen 2.819 N/A ILE 28.A N GLU 20.A O no hydrogen 2.870 N/A ASP 29.A N LYS 42.A O no hydrogen 2.949 N/A SER 30.A N LYS 42.A O no hydrogen 3.436 N/A SER 30.A OG ASP 29.A OD1 no hydrogen 2.817 N/A ILE 32.A N VAL 40.A O no hydrogen 2.930 N/A GLY 35.A N GLY 38.A O no hydrogen 2.960 N/A GLY 38.A N GLY 35.A O no hydrogen 3.172 N/A GLN 39.A N ILE 56.A O no hydrogen 3.040 N/A GLN 39.A NE2 TYR 14.A O no hydrogen 2.778 N/A VAL 40.A N GLY 33.A O no hydrogen 2.929 N/A VAL 41.A N ILE 54.A O no hydrogen 2.922 N/A LYS 42.A N SER 30.A O no hydrogen 2.920 N/A ALA 43.A N VAL 52.A O no hydrogen 2.908 N/A TYR 44.A N GLU 27.A O no hydrogen 2.901 N/A ASP 45.A N GLU 50.A O no hydrogen 2.932 N/A ARG 46.A N ARG 25.A O no hydrogen 2.998 N/A VAL 47.A N ASP 45.A OD1 no hydrogen 3.160 N/A GLU 48.A N ASP 45.A OD1 no hydrogen 3.332 N/A GLN 49.A N ASP 45.A O no hydrogen 2.824 N/A GLU 50.A N ASP 45.A O no hydrogen 3.394 N/A VAL 52.A N ALA 43.A O no hydrogen 2.737 N/A ALA 53.A N PHE 105.A O no hydrogen 2.945 N/A ILE 54.A N VAL 41.A O no hydrogen 2.871 N/A LYS 55.A N LEU 103.A O no hydrogen 2.790 N/A LYS 55.A NZ GLU 70.A OE1 no hydrogen 2.716 N/A LYS 55.A NZ ASP 174.A OD1 no hydrogen 3.536 N/A ILE 56.A N GLN 39.A O no hydrogen 2.793 N/A ILE 57.A N LEU 101.A O no hydrogen 2.923 N/A LYS 58.A N PHE 37.A O no hydrogen 2.960 N/A LYS 58.A NZ SER 36.A O no hydrogen 2.495 N/A ASN 59.A N TYR 12.A O no hydrogen 2.933 N/A ASN 59.A ND2 ASP 8.A OD2 no hydrogen 3.144 N/A LYS 60.A N LYS 58.A O no hydrogen 3.021 N/A PHE 63.A N LYS 60.A O no hydrogen 3.043 N/A LEU 64.A N LYS 60.A O no hydrogen 3.180 N/A ASN 65.A N LYS 61.A O no hydrogen 2.945 N/A GLN 66.A N ALA 62.A O no hydrogen 3.280 N/A ALA 67.A N PHE 63.A O no hydrogen 2.973 N/A GLN 68.A N LEU 64.A O no hydrogen 3.054 N/A ILE 69.A N ASN 65.A O no hydrogen 3.402 N/A GLU 70.A N GLN 66.A O no hydrogen 3.322 N/A VAL 71.A N ALA 67.A O no hydrogen 2.821 N/A ARG 72.A N GLN 68.A O no hydrogen 2.917 N/A ARG 72.A NH1 GLN 180.A OE1 no hydrogen 3.558 N/A LEU 73.A N ILE 69.A O no hydrogen 3.005 N/A LEU 74.A N GLU 70.A O no hydrogen 3.111 N/A GLU 75.A N VAL 71.A O no hydrogen 3.032 N/A LEU 76.A N ARG 72.A O no hydrogen 3.062 N/A MET 77.A N LEU 73.A O no hydrogen 3.029 N/A ASN 78.A N LEU 74.A O no hydrogen 2.937 N/A ASN 78.A ND2 LEU 91.A O no hydrogen 3.562 N/A HIS 80.A N MET 77.A O no hydrogen 3.170 N/A TYR 86.A N GLU 83.A O no hydrogen 3.435 N/A TYR 87.A N MET 84.A O no hydrogen 3.406 N/A ILE 88.A N LYS 85.A O no hydrogen 3.065 N/A VAL 89.A N ILE 172.A O no hydrogen 3.123 N/A HIS 90.A N GLU 106.A OE2 no hydrogen 3.046 N/A LYS 92.A N VAL 104.A O no hydrogen 2.790 N/A LYS 92.A NZ GLU 50.A OE2 no hydrogen 2.695 N/A ARG 93.A NE TYR 26.A OH no hydrogen 2.821 N/A PHE 95.A N CYS 102.A O no hydrogen 3.193 N/A PHE 97.A N HIS 100.A O no hydrogen 2.954 N/A ARG 98.A NH1 TYR 14.A OH no hydrogen 2.771 N/A ARG 98.A NH1 GLU 20.A OE2 no hydrogen 3.563 N/A ASN 99.A ND2 ASN 4.A OD1 no hydrogen 2.798 N/A HIS 100.A N PHE 97.A O no hydrogen 3.038 N/A HIS 100.A ND1 ILE 57.A O no hydrogen 2.735 N/A HIS 100.A NE2 ASP 8.A OD1 no hydrogen 2.640 N/A CYS 102.A N PHE 95.A O no hydrogen 2.890 N/A CYS 102.A SG HIS 100.A O no hydrogen 3.667 N/A LEU 103.A N LYS 55.A O no hydrogen 3.000 N/A VAL 104.A N ARG 93.A O no hydrogen 2.961 N/A PHE 105.A N ALA 53.A O no hydrogen 2.826 N/A GLU 106.A N HIS 90.A O no hydrogen 3.339 N/A SER 109.A N LEU 162.A O no hydrogen 2.808 N/A LEU 112.A N ILE 160.A O no hydrogen 2.975 N/A ASP 114.A N ASN 111.A OD1 no hydrogen 2.875 N/A LEU 115.A N ASN 111.A O no hydrogen 3.196 N/A LEU 116.A N LEU 112.A O no hydrogen 3.322 N/A ARG 117.A N TYR 113.A O no hydrogen 3.005 N/A ASN 118.A N ASP 114.A O no hydrogen 3.203 N/A THR 119.A N LEU 116.A O no hydrogen 3.079 N/A THR 119.A OG1 LEU 116.A O no hydrogen 2.688 N/A ASN 120.A N ARG 117.A O no hydrogen 2.977 N/A PHE 121.A N LEU 116.A O no hydrogen 2.930 N/A ARG 122.A N THR 119.A O no hydrogen 3.245 N/A ARG 122.A N THR 119.A OG1 no hydrogen 3.095 N/A GLY 123.A N THR 119.A OG1 no hydrogen 3.189 N/A VAL 124.A N MET 220.A O no hydrogen 2.934 N/A LEU 126.A N HIS 307.A NE2 no hydrogen 3.327 N/A LEU 128.A N SER 125.A OG no hydrogen 3.081 N/A THR 129.A N SER 125.A O no hydrogen 2.925 N/A THR 129.A OG1 SER 125.A O no hydrogen 2.899 N/A ARG 130.A N LEU 126.A O no hydrogen 2.912 N/A ARG 130.A NE PHE 341.A O no hydrogen 2.751 N/A ARG 130.A NH1 ASN 127.A OD1 no hydrogen 3.104 N/A LYS 131.A N ASN 127.A O no hydrogen 3.301 N/A PHE 132.A N LEU 128.A O no hydrogen 3.105 N/A ALA 133.A N THR 129.A O no hydrogen 2.803 N/A GLN 134.A N ARG 130.A O no hydrogen 2.858 N/A GLN 135.A N LYS 131.A O no hydrogen 3.250 N/A GLN 135.A NE2 LYS 131.A O no hydrogen 3.015 N/A GLN 135.A NE2 SER 168.A O no hydrogen 2.968 N/A MET 136.A N PHE 132.A O no hydrogen 3.017 N/A CYS 137.A N ALA 133.A O no hydrogen 3.029 N/A CYS 137.A SG ALA 133.A O no hydrogen 3.440 N/A THR 138.A N GLN 134.A O no hydrogen 3.145 N/A THR 138.A OG1 GLN 134.A O no hydrogen 2.860 N/A ALA 139.A N GLN 135.A O no hydrogen 2.916 N/A LEU 140.A N MET 136.A O no hydrogen 2.942 N/A LEU 141.A N CYS 137.A O no hydrogen 3.002 N/A PHE 142.A N THR 138.A O no hydrogen 3.085 N/A LEU 143.A N ALA 139.A O no hydrogen 3.011 N/A ALA 144.A N LEU 140.A O no hydrogen 2.967 N/A THR 145.A N PHE 142.A O no hydrogen 2.984 N/A THR 145.A OG1 PHE 142.A O no hydrogen 2.564 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.840 N/A LEU 148.A N THR 145.A O no hydrogen 2.847 N/A SER 149.A N THR 145.A O no hydrogen 3.015 N/A SER 149.A OG PRO 146.A O no hydrogen 2.616 N/A ILE 150.A N LEU 143.A O no hydrogen 2.933 N/A ILE 151.A N CYS 179.A O no hydrogen 2.763 N/A HIS 152.A N ASP 209.A OD2 no hydrogen 2.838 N/A HIS 152.A NE2 VAL 173.A O no hydrogen 2.985 N/A CYS 153.A N ASP 209.A OD1 no hydrogen 3.119 N/A CYS 153.A SG ILE 151.A O no hydrogen 3.497 N/A ASP 154.A N HIS 152.A ND1 no hydrogen 3.305 N/A LYS 156.A NZ SER 190.A OG no hydrogen 3.176 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 3.159 N/A ASN 159.A N LYS 156.A O no hydrogen 2.911 N/A ASN 159.A ND2 ASP 154.A O no hydrogen 2.921 N/A ASN 159.A ND2 ASP 154.A OD2 no hydrogen 3.503 N/A ILE 160.A N PRO 157.A O no hydrogen 3.104 N/A LEU 161.A N LYS 171.A O no hydrogen 2.905 N/A LEU 162.A N TYR 110.A O no hydrogen 2.870 N/A CYS 163.A N ALA 169.A O no hydrogen 2.920 N/A CYS 163.A SG ALA 169.A O no hydrogen 3.757 N/A LYS 166.A N ASN 164.A OD1 no hydrogen 2.936 N/A ARG 167.A N ASN 164.A O no hydrogen 3.258 N/A ILE 170.A N GLN 135.A OE1 no hydrogen 3.033 N/A LYS 171.A N LEU 161.A O no hydrogen 2.937 N/A LYS 171.A NZ TYR 86.A O no hydrogen 2.809 N/A LYS 171.A NZ GLU 106.A OE2 no hydrogen 3.051 N/A ILE 172.A N TYR 87.A O no hydrogen 3.035 N/A VAL 173.A N ASN 159.A O no hydrogen 3.027 N/A PHE 175.A N GLU 70.A OE2 no hydrogen 3.020 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.153 N/A SER 178.A N PHE 175.A O no hydrogen 3.347 N/A SER 178.A OG HIS 152.A O no hydrogen 3.053 N/A CYS 179.A N ILE 151.A O no hydrogen 3.092 N/A CYS 179.A SG GLN 180.A O no hydrogen 3.912 N/A GLN 180.A NE2 LEU 148.A O no hydrogen 3.042 N/A LEU 181.A N SER 149.A O no hydrogen 2.912 N/A GLN 189.A NE2 ILE 208.A O no hydrogen 3.040 N/A SER 190.A OG ASP 154.A OD1 no hydrogen 3.282 N/A ARG 191.A NH1 GLY 229.A O no hydrogen 2.870 N/A TYR 193.A N SER 190.A O no hydrogen 2.884 N/A TYR 193.A OH GLU 219.A OE1 no hydrogen 2.591 N/A TYR 193.A OH GLU 219.A OE2 no hydrogen 3.354 N/A ARG 194.A N ARG 191.A O no hydrogen 3.177 N/A ARG 194.A NE ILE 188.A O no hydrogen 3.026 N/A ARG 194.A NE GLN 189.A O no hydrogen 3.372 N/A ARG 194.A NH2 GLN 189.A O no hydrogen 2.948 N/A SER 195.A N GLN 189.A OE1 no hydrogen 2.774 N/A SER 195.A OG GLN 189.A OE1 no hydrogen 3.068 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.964 N/A LEU 199.A N SER 195.A O no hydrogen 3.042 N/A LEU 200.A N PRO 196.A O no hydrogen 2.847 N/A GLY 201.A N VAL 198.A O no hydrogen 3.204 N/A MET 202.A N GLU 197.A O no hydrogen 2.920 N/A TYR 204.A OH TYR 186.A O no hydrogen 2.741 N/A ALA 207.A N ASP 205.A OD1 no hydrogen 3.199 N/A ILE 208.A N ASP 205.A O no hydrogen 3.223 N/A ASP 209.A N LEU 206.A O no hydrogen 3.167 N/A TRP 211.A N ALA 207.A O no hydrogen 3.245 N/A SER 212.A N ILE 208.A O no hydrogen 3.313 N/A SER 212.A OG TYR 193.A O no hydrogen 2.789 N/A SER 212.A OG ILE 208.A O no hydrogen 3.472 N/A LEU 213.A N ASP 209.A O no hydrogen 2.987 N/A GLY 214.A N MET 210.A O no hydrogen 3.008 N/A CYS 215.A N TRP 211.A O no hydrogen 3.155 N/A CYS 215.A SG TRP 211.A O no hydrogen 3.514 N/A ILE 216.A N SER 212.A O no hydrogen 2.911 N/A LEU 217.A N LEU 213.A O no hydrogen 2.967 N/A VAL 218.A N GLY 214.A O no hydrogen 3.465 N/A GLU 219.A N CYS 215.A O no hydrogen 3.231 N/A MET 220.A N ILE 216.A O no hydrogen 2.889 N/A HIS 221.A N LEU 217.A O no hydrogen 3.420 N/A HIS 221.A N VAL 218.A O no hydrogen 3.199 N/A HIS 221.A ND1 VAL 124.A O no hydrogen 2.777 N/A HIS 221.A NE2 TYR 312.A OH no hydrogen 2.944 N/A THR 222.A N VAL 218.A O no hydrogen 3.038 N/A THR 222.A OG1 VAL 218.A O no hydrogen 3.101 N/A THR 222.A OG1 GLU 224.A O no hydrogen 3.030 N/A GLY 223.A N GLU 219.A O no hydrogen 2.730 N/A GLU 224.A N THR 222.A OG1 no hydrogen 3.195 N/A GLY 229.A N GLN 235.A OE1 no hydrogen 2.879 N/A ALA 230.A N ASP 234.A OD2 no hydrogen 3.013 N/A ASP 234.A N ASN 231.A OD1 no hydrogen 3.112 N/A GLN 235.A N ASN 231.A O no hydrogen 2.874 N/A GLN 235.A NE2 PHE 192.A O no hydrogen 3.297 N/A GLN 235.A NE2 PHE 227.A O no hydrogen 3.303 N/A MET 236.A N GLU 232.A O no hydrogen 3.054 N/A ASN 237.A N VAL 233.A O no hydrogen 2.966 N/A ASN 237.A ND2 VAL 233.A O no hydrogen 3.206 N/A LYS 238.A N ASP 234.A O no hydrogen 2.976 N/A LYS 238.A NZ ASP 234.A OD1 no hydrogen 3.068 N/A LYS 238.A NZ ASP 234.A OD2 no hydrogen 2.794 N/A ILE 239.A N GLN 235.A O no hydrogen 3.174 N/A VAL 240.A N MET 236.A O no hydrogen 2.942 N/A GLU 241.A N ASN 237.A O no hydrogen 2.948 N/A VAL 242.A N ILE 239.A O no hydrogen 3.236 N/A LEU 243.A N ILE 239.A O no hydrogen 3.033 N/A GLY 244.A N VAL 240.A O no hydrogen 2.855 N/A LEU 251.A N PRO 247.A O no hydrogen 3.289 N/A ASP 252.A N ALA 248.A O no hydrogen 2.838 N/A GLN 253.A N ILE 250.A O no hydrogen 2.998 N/A ALA 254.A N LEU 251.A O no hydrogen 3.358 N/A LYS 256.A N LEU 200.A O no hydrogen 3.005 N/A LYS 256.A NZ LEU 199.A O no hydrogen 3.000 N/A LYS 256.A NZ GLU 232.A OE1 no hydrogen 2.782 N/A ALA 257.A N ALA 254.A O no hydrogen 3.330 N/A LYS 259.A N LYS 256.A O no hydrogen 3.092 N/A LYS 259.A NZ GLU 232.A OE1 no hydrogen 3.012 N/A PHE 260.A N ALA 257.A O no hydrogen 3.200 N/A PHE 261.A N ALA 257.A O no hydrogen 2.959 N/A GLU 262.A N ASN 270.A O no hydrogen 2.993 N/A LYS 263.A NZ ASP 252.A OD1 no hydrogen 3.212 N/A LEU 264.A N THR 268.A O no hydrogen 2.829 N/A GLY 267.A N LEU 264.A O no hydrogen 3.027 N/A THR 268.A N ASP 266.A OD1 no hydrogen 2.944 N/A THR 268.A OG1 ASP 266.A OD1 no hydrogen 2.708 N/A TRP 269.A NE1 ASP 252.A OD1 no hydrogen 3.011 N/A ASN 270.A N GLU 262.A O no hydrogen 3.029 N/A LYS 272.A N PHE 260.A O no hydrogen 3.107 N/A TYR 278.A OH ASP 234.A OD1 no hydrogen 2.374 N/A LYS 279.A N GLU 241.A OE2 no hydrogen 2.944 N/A GLY 282.A N VAL 240.A O no hydrogen 2.990 N/A THR 283.A N PRO 280.A O no hydrogen 3.058 N/A THR 283.A OG1 PRO 280.A O no hydrogen 2.611 N/A ARG 284.A N GLU 241.A O no hydrogen 2.956 N/A ARG 284.A NH1 LEU 226.A O no hydrogen 3.240 N/A LYS 285.A NZ GLY 282.A O no hydrogen 3.308 N/A HIS 287.A NE2 GLU 293.A OE2 no hydrogen 2.936 N/A ASN 288.A N LYS 285.A O no hydrogen 3.166 N/A ILE 289.A N LYS 285.A O no hydrogen 3.238 N/A LEU 290.A N LEU 286.A O no hydrogen 3.020 N/A GLY 291.A N HIS 287.A O no hydrogen 3.157 N/A VAL 292.A N HIS 287.A O no hydrogen 3.184 N/A THR 294.A N GLY 291.A O no hydrogen 3.089 N/A GLY 296.A N GLY 291.A O no hydrogen 2.906 N/A GLY 299.A N GLY 296.A O no hydrogen 2.845 N/A ARG 300.A N PRO 297.A O no hydrogen 3.257 N/A ARG 300.A NH2 ARG 122.A O no hydrogen 3.102 N/A ARG 301.A N GLY 295.A O no hydrogen 2.836 N/A ARG 301.A NH1 GLU 304.A OE1 no hydrogen 3.558 N/A ARG 301.A NH1 GLU 304.A OE2 no hydrogen 3.056 N/A ALA 302.A N GLY 299.A O no hydrogen 3.474 N/A GLU 304.A N ARG 301.A O no hydrogen 3.068 N/A HIS 307.A ND1 SER 305.A O no hydrogen 2.928 N/A THR 308.A N ASP 311.A OD2 no hydrogen 3.261 N/A THR 308.A OG1 ASP 311.A OD2 no hydrogen 2.669 N/A ASP 311.A N THR 308.A OG1 no hydrogen 3.131 N/A TYR 312.A N THR 308.A O no hydrogen 3.043 N/A TYR 312.A OH HIS 221.A NE2 no hydrogen 2.944 N/A LEU 313.A N VAL 309.A O no hydrogen 2.962 N/A LYS 314.A N ALA 310.A O no hydrogen 3.367 N/A PHE 315.A N ASP 311.A O no hydrogen 3.244 N/A LYS 316.A N TYR 312.A O no hydrogen 2.921 N/A LYS 316.A NZ HIS 287.A ND1 no hydrogen 3.533 N/A ASP 317.A N LEU 313.A O no hydrogen 3.038 N/A LEU 318.A N LYS 314.A O no hydrogen 3.059 N/A ILE 319.A N PHE 315.A O no hydrogen 2.972 N/A LEU 320.A N LYS 316.A O no hydrogen 2.987 N/A ARG 321.A N ASP 317.A O no hydrogen 3.174 N/A ARG 321.A NH1 ASP 324.A OD2 no hydrogen 3.433 N/A ARG 321.A NH1 THR 329.A O no hydrogen 3.047 N/A ARG 321.A NH2 THR 329.A O no hydrogen 2.979 N/A MET 322.A N LEU 318.A O no hydrogen 3.079 N/A LEU 323.A N ILE 319.A O no hydrogen 2.903 N/A TYR 325.A OH GLY 244.A O no hydrogen 2.634 N/A ASP 326.A N ASP 324.A OD1 no hydrogen 2.932 N/A LYS 328.A N ASP 326.A OD1 no hydrogen 3.043 N/A THR 329.A N ASP 326.A O no hydrogen 3.249 N/A THR 329.A OG1 ASP 324.A OD2 no hydrogen 2.580 N/A THR 329.A OG1 ASP 326.A O no hydrogen 3.499 N/A ARG 330.A N ASP 326.A O no hydrogen 2.895 N/A ARG 330.A NE ASP 324.A O no hydrogen 3.011 N/A ARG 330.A NH1 GLU 197.A OE2 no hydrogen 2.785 N/A ARG 330.A NH1 ALA 207.A O no hydrogen 2.963 N/A ARG 330.A NH2 GLU 197.A OE1 no hydrogen 2.778 N/A ARG 330.A NH2 ASP 324.A O no hydrogen 3.182 N/A ARG 330.A NH2 TYR 325.A O no hydrogen 3.532 N/A ILE 331.A N ARG 321.A O no hydrogen 3.223 N/A ALA 336.A N GLN 332.A O no hydrogen 2.910 N/A LEU 337.A N PRO 333.A O no hydrogen 3.094 N/A GLN 338.A N TYR 335.A O no hydrogen 3.199 N/A HIS 339.A N ALA 336.A O no hydrogen 3.125 N/A HIS 339.A NE2 ASP 317.A OD2 no hydrogen 2.822 N/A PHE 341.A N HIS 339.A ND1 no hydrogen 3.349 N/A PHE 342.A N HIS 339.A O no hydrogen 3.089 N/A LYS 343.A N SER 340.A O no hydrogen 3.277 N/A