Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2b31_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N ALA 325.A O no hydrogen 3.063 N/A LEU 3.A N THR 31.A OG1 no hydrogen 2.962 N/A ILE 4.A N ALA 327.A O no hydrogen 2.944 N/A CYS 5.A N HIS 32.A O no hydrogen 2.750 N/A CYS 5.A SG LEU 3.A O no hydrogen 3.778 N/A TYR 6.A N VAL 329.A O no hydrogen 3.233 N/A TYR 6.A OH ASP 115.A OD2 no hydrogen 2.561 N/A TYR 7.A N ILE 34.A O no hydrogen 3.092 N/A TYR 7.A OH CYS 20.A O no hydrogen 2.810 N/A THR 8.A N ASP 333.A OD2 no hydrogen 2.907 N/A THR 8.A OG1 ASP 333.A OD1 no hydrogen 3.193 N/A THR 8.A OG1 ASP 333.A OD2 no hydrogen 2.611 N/A SER 9.A OG TYR 35.A OH no hydrogen 3.365 N/A SER 9.A OG ASP 52.A OD1 no hydrogen 3.511 N/A SER 11.A N THR 8.A O no hydrogen 3.241 N/A SER 11.A OG THR 8.A O no hydrogen 2.836 N/A SER 11.A OG CYS 20.A O no hydrogen 3.476 N/A GLN 12.A NE2 SER 9.A O no hydrogen 3.382 N/A GLN 12.A NE2 ASN 51.A OD1 no hydrogen 3.341 N/A TYR 13.A OH GLU 49.A OE1 no hydrogen 2.449 N/A ARG 14.A NH1 ASP 333.A OD1 no hydrogen 3.213 N/A GLY 18.A N GLU 15.A O no hydrogen 3.099 N/A SER 19.A N GLY 16.A O no hydrogen 3.190 N/A SER 19.A OG GLN 12.A O no hydrogen 2.927 N/A CYS 20.A N SER 11.A O no hydrogen 2.819 N/A ALA 24.A N PHE 21.A O no hydrogen 2.786 N/A ILE 25.A N PRO 22.A O no hydrogen 3.105 N/A PHE 28.A N ASP 26.A OD1 no hydrogen 3.027 N/A LEU 29.A N ASP 26.A O no hydrogen 3.065 N/A THR 31.A N LEU 3.A O no hydrogen 3.184 N/A THR 31.A OG1 LEU 3.A O no hydrogen 3.381 N/A THR 31.A OG1 HIS 32.A ND1 no hydrogen 2.834 N/A HIS 32.A N LEU 3.A O no hydrogen 3.474 N/A HIS 32.A ND1 THR 31.A OG1 no hydrogen 2.834 N/A VAL 33.A N LYS 70.A O no hydrogen 3.115 N/A ILE 34.A N CYS 5.A O no hydrogen 3.084 N/A TYR 35.A N LEU 72.A O no hydrogen 2.892 N/A TYR 35.A OH SER 9.A OG no hydrogen 3.365 N/A TYR 35.A OH ASP 52.A OD1 no hydrogen 2.526 N/A ALA 38.A N SER 74.A O no hydrogen 2.768 N/A ASN 39.A N ASP 46.A O no hydrogen 2.762 N/A SER 41.A N GLU 44.A O no hydrogen 3.011 N/A SER 41.A OG ASP 46.A OD2 no hydrogen 3.428 N/A GLU 44.A N SER 41.A O no hydrogen 3.275 N/A ILE 45.A N SER 101.A OG no hydrogen 3.168 N/A ASP 46.A N ASN 39.A O no hydrogen 2.838 N/A TRP 48.A N ASP 52.A OD2 no hydrogen 2.829 N/A GLU 49.A N ASP 52.A OD2 no hydrogen 2.849 N/A ASN 51.A ND2 GLN 12.A OE1 no hydrogen 3.217 N/A ASP 52.A N GLU 49.A O no hydrogen 3.326 N/A LEU 55.A N ASN 51.A O no hydrogen 3.194 N/A TYR 56.A N ASP 52.A O no hydrogen 2.548 N/A ASP 57.A N VAL 53.A O no hydrogen 3.213 N/A THR 58.A N THR 54.A O no hydrogen 3.123 N/A THR 58.A OG1 THR 54.A O no hydrogen 3.270 N/A LEU 59.A N LEU 55.A O no hydrogen 3.072 N/A ASN 60.A N TYR 56.A O no hydrogen 2.975 N/A THR 61.A N THR 58.A O no hydrogen 3.323 N/A THR 61.A OG1 ASP 57.A O no hydrogen 3.322 N/A THR 61.A OG1 THR 58.A O no hydrogen 2.467 N/A LEU 62.A N LEU 59.A O no hydrogen 3.199 N/A LYS 63.A NZ GLY 110.A O no hydrogen 2.957 N/A LYS 63.A NZ ASP 112.A OD1 no hydrogen 3.234 N/A LYS 63.A NZ ASP 112.A OD2 no hydrogen 2.935 N/A ASN 64.A N THR 61.A O no hydrogen 2.594 N/A ARG 65.A N LEU 62.A O no hydrogen 2.961 N/A ASN 66.A N LEU 62.A O no hydrogen 3.020 N/A ASN 66.A ND2 PRO 27.A O no hydrogen 2.799 N/A LYS 68.A N ASN 66.A OD1 no hydrogen 3.229 N/A LEU 69.A N ASN 66.A O no hydrogen 3.181 N/A LYS 70.A N THR 31.A O no hydrogen 3.197 N/A LYS 70.A NZ GLU 149.A OE2 no hydrogen 3.036 N/A THR 71.A N ASP 112.A OD2 no hydrogen 2.820 N/A THR 71.A OG1 ASP 112.A OD2 no hydrogen 3.360 N/A LEU 72.A N VAL 33.A O no hydrogen 3.038 N/A LEU 73.A N GLY 113.A O no hydrogen 2.923 N/A SER 74.A N TYR 35.A O no hydrogen 3.137 N/A SER 74.A OG ASP 115.A O no hydrogen 3.384 N/A SER 74.A OG ASP 115.A OD2 no hydrogen 2.808 N/A VAL 75.A N ASP 115.A O no hydrogen 2.758 N/A GLY 77.A N ALA 117.A O no hydrogen 2.915 N/A PHE 80.A N GLY 77.A O no hydrogen 3.271 N/A ARG 84.A NH1 ASN 39.A OD1 no hydrogen 3.438 N/A ARG 84.A NH2 ASN 39.A OD1 no hydrogen 3.539 N/A SER 86.A N PRO 82.A O no hydrogen 2.613 N/A SER 86.A OG ASP 125.A OD1 no hydrogen 2.665 N/A LYS 87.A N GLU 83.A O no hydrogen 3.151 N/A LYS 87.A N ARG 84.A O no hydrogen 3.299 N/A ILE 88.A N PHE 85.A O no hydrogen 2.981 N/A ALA 89.A N PHE 85.A O no hydrogen 3.098 N/A SER 90.A OG SER 86.A O no hydrogen 2.575 N/A SER 94.A OG ILE 88.A O no hydrogen 3.214 N/A SER 94.A OG LYS 91.A O no hydrogen 2.943 N/A ARG 95.A N LYS 91.A O no hydrogen 2.909 N/A ARG 95.A NE GLU 135.A OE1 no hydrogen 2.631 N/A ARG 95.A NH1 ALA 89.A O no hydrogen 2.666 N/A ARG 95.A NH2 GLU 135.A OE1 no hydrogen 3.480 N/A ARG 95.A NH2 GLU 135.A OE2 no hydrogen 2.919 N/A ARG 96.A N THR 92.A O no hydrogen 2.849 N/A THR 97.A N GLN 93.A O no hydrogen 3.326 N/A THR 97.A OG1 GLN 93.A O no hydrogen 3.081 N/A PHE 98.A N SER 94.A O no hydrogen 3.313 N/A ILE 99.A N ARG 95.A O no hydrogen 3.084 N/A LYS 100.A N ARG 96.A O no hydrogen 3.187 N/A SER 101.A N THR 97.A O no hydrogen 3.303 N/A SER 101.A N PHE 98.A O no hydrogen 3.062 N/A SER 101.A OG PHE 98.A O no hydrogen 2.705 N/A VAL 102.A N ILE 99.A O no hydrogen 2.966 N/A LEU 106.A N VAL 102.A O no hydrogen 3.054 N/A ARG 107.A N PRO 103.A O no hydrogen 2.882 N/A ARG 107.A NH1 GLU 143.A OE2 no hydrogen 2.602 N/A ARG 107.A NH2 GLU 149.A O no hydrogen 2.530 N/A THR 108.A N PRO 104.A O no hydrogen 2.853 N/A THR 108.A OG1 PRO 104.A O no hydrogen 2.781 N/A HIS 109.A N PHE 105.A O no hydrogen 3.146 N/A GLY 110.A N ARG 107.A O no hydrogen 3.260 N/A PHE 111.A N LEU 106.A O no hydrogen 2.919 N/A ASP 112.A N THR 71.A O no hydrogen 2.737 N/A LEU 114.A N LEU 152.A O no hydrogen 3.012 N/A ASP 115.A N LEU 73.A O no hydrogen 2.670 N/A LEU 116.A N SER 154.A O no hydrogen 2.955 N/A ALA 117.A N VAL 75.A O no hydrogen 2.907 N/A TYR 120.A N TRP 118.A O no hydrogen 2.815 N/A GLY 122.A N ASP 125.A OD2 no hydrogen 3.069 N/A ASP 125.A N GLY 122.A O no hydrogen 2.714 N/A LYS 126.A N GLY 122.A O no hydrogen 3.332 N/A LYS 126.A NZ ASP 165.A O no hydrogen 2.698 N/A LEU 129.A N ASP 125.A O no hydrogen 2.953 N/A THR 130.A N LYS 126.A O no hydrogen 3.290 N/A THR 130.A OG1 LYS 126.A O no hydrogen 3.022 N/A ALA 131.A N ARG 127.A O no hydrogen 3.133 N/A LEU 132.A N HIS 128.A O no hydrogen 2.841 N/A VAL 133.A N LEU 129.A O no hydrogen 3.042 N/A LYS 134.A N THR 130.A O no hydrogen 3.082 N/A GLU 135.A N ALA 131.A O no hydrogen 2.830 N/A MET 136.A N LEU 132.A O no hydrogen 3.028 N/A LYS 137.A N VAL 133.A O no hydrogen 2.844 N/A LYS 137.A NZ HIS 176.A O no hydrogen 3.167 N/A ALA 138.A N LYS 134.A O no hydrogen 3.011 N/A GLU 139.A N GLU 135.A O no hydrogen 3.108 N/A PHE 140.A N MET 136.A O no hydrogen 3.163 N/A PHE 140.A N LYS 137.A O no hydrogen 2.921 N/A ALA 141.A N LYS 137.A O no hydrogen 3.116 N/A ARG 142.A N ALA 138.A O no hydrogen 3.098 N/A GLU 143.A N GLU 139.A O no hydrogen 3.264 N/A ALA 144.A N PHE 140.A O no hydrogen 3.140 N/A ALA 144.A N ALA 141.A O no hydrogen 3.050 N/A ALA 146.A N GLU 143.A O no hydrogen 3.312 N/A GLY 147.A N ALA 144.A O no hydrogen 3.169 N/A LEU 152.A N ASP 112.A O no hydrogen 2.876 N/A LEU 153.A N ASP 178.A OD2 no hydrogen 2.704 N/A SER 154.A N LEU 114.A O no hydrogen 3.213 N/A SER 154.A OG ASP 115.A OD1 no hydrogen 2.669 N/A ALA 155.A N PHE 179.A O no hydrogen 3.370 N/A ALA 156.A N LEU 116.A O no hydrogen 3.003 N/A VAL 157.A N SER 181.A O no hydrogen 2.840 N/A GLY 160.A N SER 158.A OG no hydrogen 3.302 N/A LYS 161.A NZ ASP 165.A OD2 no hydrogen 2.962 N/A LYS 161.A NZ TYR 221.A OH no hydrogen 3.020 N/A ALA 163.A N GLY 160.A O no hydrogen 2.634 N/A ILE 164.A N GLY 160.A O no hydrogen 3.030 N/A ILE 164.A N LYS 161.A O no hydrogen 3.238 N/A ASP 165.A N LYS 161.A O no hydrogen 3.115 N/A ARG 166.A N ILE 162.A O no hydrogen 3.177 N/A GLY 167.A N ALA 163.A O no hydrogen 3.186 N/A TYR 168.A N ILE 164.A O no hydrogen 3.316 N/A GLN 172.A N ASP 169.A O no hydrogen 2.977 N/A ILE 173.A N ASP 169.A O no hydrogen 3.261 N/A SER 174.A N ILE 170.A O no hydrogen 3.117 N/A SER 174.A OG ILE 170.A O no hydrogen 2.509 N/A ARG 175.A N GLN 172.A O no hydrogen 3.150 N/A LEU 177.A N ILE 173.A O no hydrogen 3.141 N/A ASP 178.A N LEU 153.A O no hydrogen 2.690 N/A ILE 180.A N LYS 231.A O no hydrogen 2.852 N/A SER 181.A N ALA 155.A O no hydrogen 2.843 N/A LEU 182.A N VAL 233.A O no hydrogen 2.762 N/A LEU 183.A N VAL 157.A O no hydrogen 2.890 N/A THR 184.A N LEU 182.A O no hydrogen 2.650 N/A THR 184.A OG1 LEU 182.A O no hydrogen 3.135 N/A THR 184.A OG1 GLY 235.A O no hydrogen 2.933 N/A TYR 185.A N LEU 183.A O no hydrogen 3.023 N/A GLY 189.A N PHE 187.A O no hydrogen 2.529 N/A VAL 195.A N ALA 254.A O no hydrogen 2.839 N/A HIS 197.A NE2 TYR 306.A O no hydrogen 2.953 N/A HIS 198.A ND1 TYR 185.A O no hydrogen 2.701 N/A SER 199.A N HIS 197.A ND1 no hydrogen 3.016 N/A SER 199.A OG ASP 307.A OD1 no hydrogen 2.896 N/A LEU 201.A N GLN 292.A O no hydrogen 3.223 N/A SER 206.A N GLY 204.A O no hydrogen 2.207 N/A ASP 207.A N GLY 204.A O no hydrogen 2.662 N/A SER 210.A OG SER 213.A OG no hydrogen 2.970 N/A ARG 211.A NH2 ASP 216.A OD1 no hydrogen 2.892 N/A SER 213.A OG SER 210.A OG no hydrogen 2.970 N/A ASN 214.A ND2 ARG 211.A O no hydrogen 3.192 N/A ASN 214.A ND2 SER 213.A O no hydrogen 2.760 N/A ALA 215.A N PRO 200.A O no hydrogen 3.243 N/A ASP 216.A N LEU 201.A O no hydrogen 3.082 N/A TYR 217.A N ASN 214.A OD1 no hydrogen 3.074 N/A ALA 218.A N ASN 214.A O no hydrogen 3.184 N/A VAL 219.A N ALA 215.A O no hydrogen 2.836 N/A SER 220.A N ASP 216.A O no hydrogen 3.125 N/A SER 220.A OG ASP 216.A O no hydrogen 3.276 N/A TYR 221.A N TYR 217.A O no hydrogen 2.918 N/A TYR 221.A OH ASP 165.A OD1 no hydrogen 2.484 N/A TYR 221.A OH ASP 165.A OD2 no hydrogen 3.160 N/A MET 222.A N ALA 218.A O no hydrogen 3.037 N/A LEU 223.A N VAL 219.A O no hydrogen 3.061 N/A ARG 224.A N SER 220.A O no hydrogen 2.969 N/A LEU 225.A N TYR 221.A O no hydrogen 2.783 N/A GLY 226.A N MET 222.A O no hydrogen 3.193 N/A GLY 226.A N LEU 223.A O no hydrogen 3.089 N/A ALA 227.A N MET 222.A O no hydrogen 3.100 N/A LYS 231.A N PRO 228.A O no hydrogen 2.937 N/A LYS 231.A NZ LEU 177.A O no hydrogen 2.634 N/A LEU 232.A N ALA 229.A O no hydrogen 3.148 N/A VAL 233.A N ILE 180.A O no hydrogen 2.771 N/A MET 234.A N GLY 326.A O no hydrogen 3.096 N/A GLY 235.A N LEU 182.A O no hydrogen 2.886 N/A ILE 236.A N MET 328.A O no hydrogen 2.502 N/A GLY 240.A N LEU 272.A O no hydrogen 2.903 N/A ARG 241.A N ALA 305.A O no hydrogen 3.089 N/A ARG 241.A NH1 ASP 186.A OD2 no hydrogen 2.414 N/A SER 242.A N GLY 270.A O no hydrogen 3.102 N/A PHE 243.A N TRP 303.A O no hydrogen 2.986 N/A THR 244.A N GLY 258.A O no hydrogen 2.953 N/A THR 244.A OG1 PRO 259.A O no hydrogen 2.409 N/A THR 244.A OG1 GLN 302.A OE1 no hydrogen 3.082 N/A LEU 245.A N ASN 301.A O no hydrogen 2.777 N/A ALA 246.A N PRO 255.A O no hydrogen 3.154 N/A LYS 249.A N SER 247.A OG no hydrogen 2.982 N/A LYS 249.A NZ ASP 251.A OD1 no hydrogen 3.465 N/A LYS 249.A NZ ASP 251.A OD2 no hydrogen 2.810 N/A ALA 254.A N ASP 251.A O no hydrogen 3.113 N/A ILE 256.A N GLN 193.A O no hydrogen 3.364 N/A SER 257.A N THR 244.A O no hydrogen 3.036 N/A SER 257.A OG THR 244.A O no hydrogen 3.349 N/A PHE 265.A N GLU 276.A OE2 no hydrogen 3.135 N/A THR 266.A N GLU 276.A OE2 no hydrogen 2.967 N/A LYS 267.A N GLY 263.A O no hydrogen 2.886 N/A LYS 267.A NZ ARG 264.A O no hydrogen 3.116 N/A GLY 270.A N GLY 260.A O no hydrogen 3.340 N/A ILE 271.A N GLU 268.A O no hydrogen 3.429 N/A ALA 273.A N GLU 276.A OE1 no hydrogen 2.704 N/A TYR 274.A N LEU 334.A O no hydrogen 2.869 N/A GLU 276.A N ALA 273.A O no hydrogen 3.214 N/A ILE 277.A N ALA 273.A O no hydrogen 3.147 N/A CYS 278.A N TYR 274.A O no hydrogen 2.955 N/A CYS 278.A SG TYR 274.A O no hydrogen 3.571 N/A PHE 280.A N GLU 276.A O no hydrogen 2.897 N/A LEU 281.A N ILE 277.A O no hydrogen 2.984 N/A HIS 282.A N ASP 279.A O no hydrogen 3.145 N/A ALA 284.A N LEU 281.A O no hydrogen 2.880 N/A THR 285.A N THR 298.A O no hydrogen 2.742 N/A HIS 287.A N TYR 296.A O no hydrogen 2.841 N/A ARG 288.A NH2 ASP 308.A OD1 no hydrogen 3.331 N/A ARG 288.A NH2 ASP 308.A OD2 no hydrogen 2.508 N/A PHE 289.A N VAL 294.A O no hydrogen 3.096 N/A GLN 293.A N PHE 289.A O no hydrogen 2.841 N/A TYR 296.A N HIS 287.A O no hydrogen 3.008 N/A ALA 297.A N VAL 304.A O no hydrogen 2.748 N/A THR 298.A N THR 285.A O no hydrogen 2.976 N/A LYS 299.A N GLN 302.A O no hydrogen 3.088 N/A LYS 299.A NZ PHE 280.A O no hydrogen 3.076 N/A GLN 302.A N LYS 299.A O no hydrogen 3.177 N/A TRP 303.A N PHE 243.A O no hydrogen 3.068 N/A VAL 304.A N ALA 297.A O no hydrogen 2.596 N/A ALA 305.A N ARG 241.A O no hydrogen 2.985 N/A TYR 306.A N PRO 295.A O no hydrogen 3.219 N/A ASP 308.A N SER 311.A OG no hydrogen 3.234 N/A SER 311.A N ASP 308.A OD1 no hydrogen 3.179 N/A SER 311.A OG ASP 307.A OD2 no hydrogen 2.643 N/A SER 311.A OG ASP 308.A O no hydrogen 3.235 N/A SER 311.A OG ASP 308.A OD1 no hydrogen 3.143 N/A VAL 312.A N ASP 308.A O no hydrogen 3.051 N/A LYS 313.A N GLN 309.A O no hydrogen 2.984 N/A ASN 314.A N GLU 310.A O no hydrogen 3.133 N/A LYS 315.A N SER 311.A O no hydrogen 3.193 N/A LYS 315.A NZ SER 199.A O no hydrogen 2.845 N/A LYS 315.A NZ SER 199.A OG no hydrogen 3.095 N/A LYS 315.A NZ ASP 307.A OD2 no hydrogen 2.623 N/A ALA 316.A N VAL 312.A O no hydrogen 3.082 N/A ARG 317.A N LYS 313.A O no hydrogen 3.264 N/A TYR 318.A N ASN 314.A O no hydrogen 2.920 N/A TYR 318.A OH ASP 216.A OD2 no hydrogen 2.677 N/A LEU 319.A N LYS 315.A O no hydrogen 3.096 N/A LYS 320.A N ALA 316.A O no hydrogen 3.320 N/A LYS 320.A NZ VAL 357.A O no hydrogen 2.719 N/A LYS 320.A NZ VAL 361.A OXT no hydrogen 2.694 N/A ASN 321.A N ARG 317.A O no hydrogen 3.304 N/A ARG 322.A N TYR 318.A O no hydrogen 2.995 N/A ARG 322.A NH2 SER 220.A OG no hydrogen 2.815 N/A GLN 323.A N LYS 320.A O no hydrogen 2.819 N/A LEU 324.A N LEU 319.A O no hydrogen 3.022 N/A ALA 325.A N LEU 232.A O no hydrogen 2.919 N/A ALA 327.A N LYS 2.A O no hydrogen 2.975 N/A MET 328.A N MET 234.A O no hydrogen 2.870 N/A VAL 329.A N ILE 4.A O no hydrogen 2.890 N/A TRP 330.A N ILE 236.A O no hydrogen 2.989 N/A LEU 332.A N TYR 6.A O no hydrogen 2.973 N/A LEU 334.A N ALA 331.A O no hydrogen 3.079 N/A ASP 336.A N ASP 335.A OD1 no hydrogen 2.365 N/A PHE 337.A N ASP 335.A O no hydrogen 3.014 N/A ARG 338.A NE ASP 17.A O no hydrogen 2.900 N/A GLY 339.A N ASP 336.A OD1 no hydrogen 3.090 N/A PHE 341.A N ASP 336.A OD2 no hydrogen 3.052 N/A CYS 342.A N ASP 336.A OD2 no hydrogen 3.055 N/A CYS 342.A SG ASP 336.A OD2 no hydrogen 3.548 N/A THR 347.A OG1 PHE 337.A O no hydrogen 2.824 N/A THR 347.A OG1 ARG 338.A O no hydrogen 3.381 N/A PHE 348.A N ASP 336.A O no hydrogen 2.827 N/A THR 351.A N ASP 335.A OD2 no hydrogen 2.877 N/A THR 351.A OG1 ASP 335.A OD2 no hydrogen 3.064 N/A SER 352.A N PHE 348.A O no hydrogen 3.053 N/A SER 352.A OG PHE 348.A O no hydrogen 2.590 N/A SER 352.A OG PRO 349.A O no hydrogen 3.167 N/A ALA 353.A N PRO 349.A O no hydrogen 3.163 N/A VAL 354.A N LEU 350.A O no hydrogen 3.245 N/A LYS 355.A N THR 351.A O no hydrogen 3.200 N/A LYS 355.A NZ PHE 28.A O no hydrogen 3.089 N/A ASP 356.A N SER 352.A O no hydrogen 2.800 N/A VAL 357.A N ALA 353.A O no hydrogen 3.358 N/A LEU 358.A N VAL 354.A O no hydrogen 2.950 N/A ALA 359.A N LYS 355.A O no hydrogen 2.890 N/A ALA 359.A N ASP 356.A O no hydrogen 3.103 N/A ARG 360.A N VAL 357.A O no hydrogen 3.273 N/A