Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mes_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.835 N/A ILE 4.A N ASP 1.A O no hydrogen 3.172 N/A ILE 5.A N ASP 1.A O no hydrogen 3.336 N/A ILE 6.A N THR 2.A O no hydrogen 3.019 N/A GLY 7.A N GLU 3.A O no hydrogen 2.984 N/A ILE 8.A N ILE 4.A O no hydrogen 3.189 N/A CYS 9.A N ILE 5.A O no hydrogen 3.022 N/A CYS 9.A SG ILE 5.A O no hydrogen 3.089 N/A ARG 10.A N ILE 6.A O no hydrogen 2.873 N/A ARG 10.A NE ILE 19.A O no hydrogen 2.828 N/A ARG 10.A NH2 ILE 19.A O no hydrogen 3.124 N/A LYS 11.A N GLY 7.A O no hydrogen 3.104 N/A ASN 12.A N ILE 8.A O no hydrogen 3.232 N/A ASN 12.A N CYS 9.A O no hydrogen 3.378 N/A ASN 12.A ND2 ILE 8.A O no hydrogen 2.735 N/A ILE 13.A N CYS 9.A O no hydrogen 2.873 N/A TRP 16.A N ILE 13.A O no hydrogen 2.938 N/A TRP 16.A NE1 HIS 48.A O no hydrogen 2.878 N/A ILE 19.A N TRP 16.A O no hydrogen 3.174 N/A GLU 21.A N GLU 21.A OE2 no hydrogen 2.619 N/A SER 22.A N ASN 20.A OD1 no hydrogen 3.234 N/A SER 22.A OG ASN 20.A OD1 no hydrogen 2.900 N/A TYR 23.A N ASN 20.A O no hydrogen 3.043 N/A ILE 24.A N GLU 21.A O no hydrogen 3.106 N/A GLU 25.A N SER 41.A O no hydrogen 2.834 N/A LYS 27.A N VAL 39.A O no hydrogen 3.357 N/A ILE 29.A N LEU 37.A O no hydrogen 2.993 N/A GLN 36.A N ILE 55.A O no hydrogen 3.017 N/A PHE 38.A N PHE 53.A O no hydrogen 2.843 N/A VAL 39.A N LYS 27.A O no hydrogen 2.940 N/A VAL 40.A N ILE 51.A O no hydrogen 3.167 N/A SER 41.A N GLU 25.A O no hydrogen 2.988 N/A ILE 42.A N PRO 49.A O no hydrogen 3.090 N/A VAL 43.A N TYR 23.A O no hydrogen 2.674 N/A ILE 51.A N VAL 40.A O no hydrogen 3.031 N/A LEU 52.A N GLU 94.A O no hydrogen 2.657 N/A PHE 53.A N PHE 38.A O no hydrogen 2.775 N/A ARG 54.A N ARG 92.A O no hydrogen 3.056 N/A ARG 54.A NE GLU 94.A OE2 no hydrogen 2.790 N/A ILE 55.A N GLN 36.A O no hydrogen 2.911 N/A TYR 56.A N GLU 90.A O no hydrogen 3.067 N/A GLY 57.A N ASN 35.A OD1 no hydrogen 2.734 N/A PHE 62.A N GLU 153.A OE1 no hydrogen 3.232 N/A TYR 63.A OH GLU 68.A OE1 no hydrogen 2.369 N/A LYS 66.A N ASP 64.A OD2 no hydrogen 3.166 N/A VAL 67.A N ASP 64.A OD2 no hydrogen 3.483 N/A LEU 69.A N SER 65.A O no hydrogen 3.143 N/A ASP 70.A N LYS 66.A O no hydrogen 3.019 N/A VAL 71.A N VAL 67.A O no hydrogen 2.996 N/A PHE 72.A N GLU 68.A O no hydrogen 2.865 N/A ARG 73.A N LEU 69.A O no hydrogen 3.012 N/A ARG 73.A NH2 ASP 87.A OD1 no hydrogen 3.341 N/A ARG 73.A NH2 ASP 87.A OD2 no hydrogen 2.872 N/A TYR 74.A N ASP 70.A O no hydrogen 3.478 N/A TYR 74.A OH ASP 132.A OD1 no hydrogen 2.791 N/A LEU 75.A N VAL 71.A O no hydrogen 3.131 N/A SER 76.A N PHE 72.A O no hydrogen 2.778 N/A SER 76.A OG PRO 82.A O no hydrogen 2.602 N/A ASN 77.A N ARG 73.A O no hydrogen 2.832 N/A ILE 78.A N TYR 74.A O no hydrogen 2.974 N/A ASN 79.A N SER 76.A O no hydrogen 3.125 N/A ILE 80.A N LEU 75.A O no hydrogen 3.044 N/A ALA 81.A N LEU 75.A O no hydrogen 3.266 N/A ASN 83.A N GLU 95.A OE1 no hydrogen 2.879 N/A ILE 85.A N ILE 93.A O no hydrogen 2.760 N/A PHE 88.A N GLY 91.A O no hydrogen 2.907 N/A GLY 91.A N PHE 88.A O no hydrogen 3.145 N/A ARG 92.A N ARG 54.A O no hydrogen 2.967 N/A ARG 92.A NH2 GLU 94.A OE2 no hydrogen 2.735 N/A ILE 93.A N ALA 86.A O no hydrogen 2.785 N/A GLU 94.A N LEU 52.A O no hydrogen 2.702 N/A GLU 95.A N ASN 83.A O no hydrogen 2.822 N/A LEU 102.A N LEU 217.A O no hydrogen 2.966 N/A THR 103.A N GLN 106.A OE1 no hydrogen 2.879 N/A THR 104.A OG1 GLU 214.A OE1 no hydrogen 2.966 N/A THR 104.A OG1 TYR 250.A O no hydrogen 3.429 N/A GLN 106.A N THR 103.A OG1 no hydrogen 3.049 N/A GLN 108.A N LYS 105.A O no hydrogen 2.954 N/A GLN 108.A NE2 ASP 266.A O no hydrogen 2.899 N/A LEU 109.A N GLN 106.A O no hydrogen 2.943 N/A CYS 113.A N LEU 109.A O no hydrogen 2.844 N/A CYS 113.A SG TYR 248.A OH no hydrogen 3.675 N/A VAL 114.A N THR 110.A O no hydrogen 3.043 N/A VAL 116.A N ILE 112.A O no hydrogen 3.433 N/A ALA 117.A N CYS 113.A O no hydrogen 3.311 N/A LYS 118.A N VAL 114.A O no hydrogen 3.098 N/A ASN 119.A N GLU 115.A O no hydrogen 2.784 N/A MET 120.A N VAL 116.A O no hydrogen 2.667 N/A GLY 121.A N ALA 117.A O no hydrogen 3.024 N/A SER 122.A N LYS 118.A O no hydrogen 3.104 N/A SER 122.A OG LYS 118.A O no hydrogen 3.056 N/A LEU 123.A N ASN 119.A O no hydrogen 3.226 N/A HIS 124.A N MET 120.A O no hydrogen 2.867 N/A HIS 124.A ND1 TYR 280.A OH no hydrogen 2.460 N/A HIS 124.A NE2 ASP 240.A OD2 no hydrogen 2.797 N/A ILE 125.A N GLY 121.A O no hydrogen 3.275 N/A ILE 126.A N LEU 123.A O no hydrogen 3.478 N/A SER 128.A N ILE 125.A O no hydrogen 3.058 N/A SER 128.A OG ILE 125.A O no hydrogen 3.370 N/A LYS 129.A N ILE 125.A O no hydrogen 2.880 N/A LYS 129.A NZ THR 284.A O no hydrogen 2.674 N/A ARG 130.A NE ASP 132.A OD1 no hydrogen 3.053 N/A ARG 130.A NH2 ASP 132.A OD2 no hydrogen 3.118 N/A PHE 133.A N ARG 130.A O no hydrogen 3.149 N/A ARG 136.A NE ASP 70.A OD1 no hydrogen 3.282 N/A ARG 136.A NE ASP 70.A OD2 no hydrogen 2.696 N/A ARG 136.A NH2 ASP 70.A OD1 no hydrogen 2.878 N/A PHE 137.A N PRO 134.A O no hydrogen 3.384 N/A GLU 140.A N ASP 138.A OD1 no hydrogen 2.842 N/A LYS 145.A NZ ASP 138.A OD2 no hydrogen 2.735 N/A LYS 145.A NZ GLU 140.A OE1 no hydrogen 3.346 N/A ARG 146.A N ILE 142.A O no hydrogen 2.857 N/A ARG 146.A NH1 TYR 231.A O no hydrogen 3.190 N/A ILE 147.A N LEU 143.A O no hydrogen 3.171 N/A TYR 148.A N PHE 144.A O no hydrogen 2.846 N/A TYR 148.A OH GLU 179.A OE2 no hydrogen 2.393 N/A LEU 149.A N LYS 145.A O no hydrogen 2.766 N/A TRP 150.A N ARG 146.A O no hydrogen 2.815 N/A ARG 151.A N ILE 147.A O no hydrogen 2.939 N/A GLU 152.A N TYR 148.A O no hydrogen 3.253 N/A GLU 153.A N LEU 149.A O no hydrogen 3.290 N/A ALA 154.A N TRP 150.A O no hydrogen 2.896 N/A LYS 155.A N ARG 151.A O no hydrogen 2.977 N/A LYS 155.A NZ GLU 152.A OE1 no hydrogen 3.474 N/A LYS 155.A NZ GLU 152.A OE2 no hydrogen 2.949 N/A ILE 156.A N GLU 152.A O no hydrogen 3.344 N/A GLN 157.A N GLU 153.A O no hydrogen 3.294 N/A VAL 158.A N ALA 154.A O no hydrogen 2.819 N/A SER 159.A N LYS 155.A O no hydrogen 2.972 N/A SER 159.A OG LYS 155.A O no hydrogen 3.439 N/A SER 159.A OG ILE 156.A O no hydrogen 2.489 N/A LYS 160.A N ILE 156.A O no hydrogen 3.041 N/A ASN 161.A N VAL 158.A O no hydrogen 2.619 N/A GLU 166.A N ASP 164.A OD2 no hydrogen 2.853 N/A LEU 167.A N ASP 164.A OD2 no hydrogen 2.946 N/A TYR 168.A N ASP 164.A O no hydrogen 2.921 N/A SER 169.A N LYS 165.A O no hydrogen 3.110 N/A LYS 170.A N GLU 166.A O no hydrogen 3.215 N/A ILE 171.A N LEU 167.A O no hydrogen 2.823 N/A LEU 172.A N TYR 168.A O no hydrogen 3.109 N/A GLU 173.A N SER 169.A O no hydrogen 3.286 N/A GLU 174.A N LYS 170.A O no hydrogen 3.076 N/A ILE 175.A N ILE 171.A O no hydrogen 3.151 N/A GLN 177.A N GLU 174.A O no hydrogen 2.951 N/A LEU 178.A N ILE 175.A O no hydrogen 2.785 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.671 N/A LEU 181.A N GLN 177.A O no hydrogen 3.088 N/A ILE 182.A N LEU 178.A O no hydrogen 3.121 N/A MET 183.A N GLU 179.A O no hydrogen 2.874 N/A GLY 185.A N GLU 180.A O no hydrogen 2.853 N/A LYS 187.A NZ GLU 180.A OE2 no hydrogen 2.475 N/A PHE 188.A N GLU 179.A OE1 no hydrogen 2.964 N/A ARG 192.A N SER 189.A OG no hydrogen 2.847 N/A ARG 192.A NE GLU 195.A OE1 no hydrogen 2.817 N/A ARG 192.A NH1 MET 183.A O no hydrogen 2.681 N/A ARG 192.A NH2 GLU 195.A OE1 no hydrogen 2.647 N/A ARG 192.A NH2 GLU 195.A OE2 no hydrogen 3.094 N/A ALA 193.A N SER 189.A O no hydrogen 2.934 N/A LEU 194.A N MET 190.A O no hydrogen 2.928 N/A GLU 195.A N GLU 191.A O no hydrogen 2.953 N/A LEU 196.A N ARG 192.A O no hydrogen 3.102 N/A LYS 197.A N ALA 193.A O no hydrogen 3.091 N/A LEU 198.A N GLU 195.A O no hydrogen 3.188 N/A TYR 199.A N LEU 196.A O no hydrogen 2.870 N/A SER 200.A N LEU 196.A O no hydrogen 3.360 N/A SER 200.A N LYS 197.A O no hydrogen 3.170 N/A ALA 202.A N SER 200.A OG no hydrogen 3.186 N/A PHE 203.A N SER 200.A O no hydrogen 3.039 N/A SER 204.A N PRO 201.A O no hydrogen 2.949 N/A VAL 206.A N ASN 235.A O no hydrogen 2.933 N/A PHE 207.A N HIS 124.A O no hydrogen 3.339 N/A ALA 208.A N ALA 233.A O no hydrogen 3.151 N/A HIS 209.A N ASP 240.A OD2 no hydrogen 2.790 N/A HIS 209.A NE2 ILE 227.A O no hydrogen 2.818 N/A ASN 210.A N ASP 240.A OD1 no hydrogen 2.774 N/A ASN 210.A ND2 TYR 231.A O no hydrogen 2.734 N/A ASN 210.A ND2 ALA 233.A O no hydrogen 3.328 N/A ASP 211.A N HIS 209.A ND1 no hydrogen 3.239 N/A GLN 213.A N ASP 211.A O no hydrogen 2.788 N/A GLU 214.A N GLU 214.A OE2 no hydrogen 2.666 N/A ASN 216.A N GLN 213.A O no hydrogen 2.750 N/A ASN 216.A ND2 ASP 211.A O no hydrogen 3.092 N/A ASN 216.A ND2 ASP 228.A OD1 no hydrogen 3.146 N/A LEU 217.A N GLU 214.A O no hydrogen 3.113 N/A LEU 218.A N ARG 225.A O no hydrogen 2.906 N/A GLN 219.A N GLU 100.A O no hydrogen 2.761 N/A THR 220.A N ASN 223.A O no hydrogen 2.784 N/A THR 220.A OG1 ASN 223.A O no hydrogen 2.794 N/A ASN 223.A N THR 220.A OG1 no hydrogen 3.248 N/A ILE 224.A N GLU 115.A OE2 no hydrogen 2.745 N/A ARG 225.A N LEU 218.A O no hydrogen 2.774 N/A ILE 227.A N ASN 216.A O no hydrogen 2.940 N/A TYR 229.A OH MET 226.A O no hydrogen 2.717 N/A SER 232.A N TYR 229.A O no hydrogen 3.097 N/A SER 232.A OG HIS 209.A O no hydrogen 3.259 N/A SER 232.A OG TYR 229.A O no hydrogen 3.246 N/A ALA 233.A N ALA 208.A O no hydrogen 3.032 N/A ASN 235.A N VAL 206.A O no hydrogen 2.749 N/A ASN 235.A ND2 ASN 210.A OD1 no hydrogen 3.254 N/A PHE 236.A N ASN 235.A OD1 no hydrogen 2.699 N/A ALA 237.A N SER 204.A O no hydrogen 2.823 N/A GLY 238.A N ALA 202.A O no hydrogen 2.955 N/A ALA 239.A N PHE 236.A O no hydrogen 2.926 N/A ILE 241.A N ALA 237.A O no hydrogen 3.153 N/A ALA 242.A N GLY 238.A O no hydrogen 2.745 N/A ASN 243.A N ALA 239.A O no hydrogen 2.980 N/A TYR 244.A N ASP 240.A O no hydrogen 3.183 N/A TYR 244.A OH TYR 248.A OH no hydrogen 3.055 N/A PHE 245.A N ILE 241.A O no hydrogen 3.050 N/A CYS 246.A N ALA 242.A O no hydrogen 3.099 N/A CYS 246.A SG ALA 242.A O no hydrogen 3.187 N/A CYS 246.A SG THR 307.A O no hydrogen 3.922 N/A GLU 247.A N ASN 243.A O no hydrogen 3.159 N/A GLU 247.A N TYR 244.A O no hydrogen 3.125 N/A TYR 248.A N PHE 245.A O no hydrogen 3.080 N/A TYR 248.A OH LEU 107.A O no hydrogen 2.693 N/A TYR 248.A OH TYR 244.A OH no hydrogen 3.055 N/A ILE 249.A N CYS 246.A O no hydrogen 2.819 N/A TYR 250.A N GLU 247.A O no hydrogen 3.301 N/A TYR 250.A OH HIS 335.A ND1 no hydrogen 2.767 N/A ASP 251.A N LYS 261.A O no hydrogen 2.877 N/A TYR 252.A OH GLU 247.A OE1 no hydrogen 2.599 N/A TYR 252.A OH GLU 247.A OE2 no hydrogen 2.978 N/A TYR 252.A OH TYR 328.A OH no hydrogen 2.977 N/A CYS 253.A N ASP 251.A OD1 no hydrogen 2.665 N/A TYR 259.A N LYS 256.A O no hydrogen 2.534 N/A LYS 261.A N ASP 251.A O no hydrogen 2.885 N/A LYS 263.A N ILE 249.A O no hydrogen 3.034 N/A TYR 264.A OH GLU 342.A OE1 no hydrogen 2.470 N/A ASP 266.A N LYS 263.A O no hydrogen 2.923 N/A TYR 267.A N TYR 264.A O no hydrogen 3.327 N/A TYR 267.A OH GLU 304.A OE1 no hydrogen 2.497 N/A ARG 273.A N CYS 269.A O no hydrogen 3.029 N/A LYS 274.A N GLU 270.A O no hydrogen 2.954 N/A LEU 275.A N GLU 271.A O no hydrogen 2.957 N/A PHE 276.A N LEU 272.A O no hydrogen 2.848 N/A ILE 277.A N ARG 273.A O no hydrogen 3.131 N/A SER 278.A N LYS 274.A O no hydrogen 2.962 N/A SER 278.A OG LYS 274.A O no hydrogen 2.961 N/A VAL 279.A N LEU 275.A O no hydrogen 3.215 N/A TYR 280.A N PHE 276.A O no hydrogen 2.848 N/A TYR 280.A OH HIS 124.A ND1 no hydrogen 2.460 N/A LEU 281.A N ILE 277.A O no hydrogen 2.751 N/A SER 282.A N SER 278.A O no hydrogen 3.026 N/A SER 282.A OG SER 278.A O no hydrogen 2.791 N/A SER 282.A OG GLU 287.A O no hydrogen 3.115 N/A GLN 283.A N VAL 279.A O no hydrogen 3.139 N/A GLN 283.A N TYR 280.A O no hydrogen 2.917 N/A GLN 283.A NE2 LYS 118.A O no hydrogen 3.423 N/A THR 284.A N TYR 280.A O no hydrogen 2.998 N/A THR 284.A OG1 LEU 281.A O no hydrogen 3.271 N/A LEU 285.A N LEU 281.A O no hydrogen 2.676 N/A GLN 286.A NE2 GLN 283.A O no hydrogen 3.293 N/A VAL 289.A N SER 282.A OG no hydrogen 3.125 N/A MET 290.A N GLN 293.A OE1 no hydrogen 2.955 N/A GLN 293.A N MET 290.A O no hydrogen 2.998 N/A GLN 293.A NE2 GLN 288.A O no hydrogen 3.242 N/A VAL 296.A N GLN 293.A O no hydrogen 3.200 N/A HIS 297.A N GLN 293.A O no hydrogen 3.301 N/A ILE 298.A N GLN 294.A O no hydrogen 3.024 N/A MET 299.A N ILE 295.A O no hydrogen 3.199 N/A THR 300.A N VAL 296.A O no hydrogen 2.919 N/A ALA 302.A N ILE 298.A O no hydrogen 3.006 N/A VAL 303.A N MET 299.A O no hydrogen 2.689 N/A GLU 304.A N THR 300.A O no hydrogen 3.313 N/A GLU 304.A N LYS 301.A O no hydrogen 3.175 N/A VAL 305.A N ALA 302.A O no hydrogen 3.023 N/A THR 307.A N GLU 304.A O no hydrogen 3.266 N/A THR 307.A OG1 GLU 304.A O no hydrogen 2.422 N/A LEU 308.A N VAL 305.A O no hydrogen 3.179 N/A ILE 309.A N PHE 306.A O no hydrogen 3.145 N/A SER 310.A N PHE 306.A O no hydrogen 3.414 N/A SER 310.A OG ASN 243.A OD1 no hydrogen 2.804 N/A HIS 311.A N THR 307.A O no hydrogen 3.131 N/A ILE 312.A N LEU 308.A O no hydrogen 3.116 N/A THR 313.A N ILE 309.A O no hydrogen 2.886 N/A THR 313.A OG1 ILE 309.A O no hydrogen 2.519 N/A TRP 314.A N SER 310.A O no hydrogen 3.266 N/A TRP 314.A NE1 ASN 243.A OD1 no hydrogen 2.905 N/A GLY 315.A N HIS 311.A O no hydrogen 3.163 N/A LEU 316.A N ILE 312.A O no hydrogen 3.060 N/A TRP 317.A N THR 313.A O no hydrogen 2.950 N/A SER 318.A N TRP 314.A O no hydrogen 2.773 N/A SER 318.A OG PHE 325.A O no hydrogen 2.670 N/A ILE 319.A N GLY 315.A O no hydrogen 3.303 N/A ALA 320.A N LEU 316.A O no hydrogen 2.758 N/A ASP 324.A N PRO 258.A O no hydrogen 3.355 N/A GLU 327.A N ASP 324.A OD1 no hydrogen 2.750 N/A TYR 328.A N ASP 324.A O no hydrogen 3.143 N/A TYR 328.A OH TYR 252.A OH no hydrogen 2.977 N/A ALA 329.A N PHE 325.A O no hydrogen 3.084 N/A ASN 330.A N THR 326.A O no hydrogen 3.120 N/A THR 331.A N GLU 327.A O no hydrogen 3.055 N/A THR 331.A OG1 GLU 327.A O no hydrogen 2.946 N/A ARG 332.A N TYR 328.A O no hydrogen 3.021 N/A ARG 332.A NE HIS 311.A ND1 no hydrogen 3.094 N/A ARG 332.A NH1 TYR 328.A OH no hydrogen 2.715 N/A ARG 332.A NH2 SER 310.A OG no hydrogen 3.312 N/A ARG 332.A NH2 HIS 311.A ND1 no hydrogen 3.008 N/A PHE 333.A N ALA 329.A O no hydrogen 2.927 N/A THR 334.A N ASN 330.A O no hydrogen 2.779 N/A THR 334.A OG1 ASN 330.A O no hydrogen 2.517 N/A HIS 335.A N THR 331.A O no hydrogen 2.859 N/A HIS 335.A ND1 TYR 250.A OH no hydrogen 2.767 N/A TYR 336.A N ARG 332.A O no hydrogen 2.985 N/A TYR 336.A OH GLU 174.A OE1 no hydrogen 2.918 N/A LEU 337.A N PHE 333.A O no hydrogen 3.327 N/A GLN 338.A N THR 334.A O no hydrogen 3.128 N/A LYS 339.A N HIS 335.A O no hydrogen 2.645 N/A LYS 339.A NZ GLU 304.A OE2 no hydrogen 2.720 N/A LYS 340.A N TYR 336.A O no hydrogen 2.751 N/A LYS 341.A N LEU 337.A O no hydrogen 2.763 N/A LYS 341.A NZ ASP 345.A OD2 no hydrogen 2.799 N/A GLU 342.A N GLN 338.A O no hydrogen 2.965 N/A LEU 343.A N LYS 339.A O no hydrogen 2.767 N/A ILE 344.A N LYS 340.A O no hydrogen 3.099 N/A ASP 345.A N LYS 341.A O no hydrogen 3.157 N/A GLN 346.A N LEU 343.A O no hydrogen 3.096 N/A GLY 347.A N ILE 344.A O no hydrogen 3.092 N/A ILE 348.A N LEU 343.A O no hydrogen 3.037 N/A LEU 349.A N LEU 343.A O no hydrogen 3.439 N/A SER 353.A N PRO 350.A O no hydrogen 3.088 N/A SER 353.A OG PRO 350.A O no hydrogen 2.608 N/A TRP 354.A N LEU 351.A O no hydrogen 3.211 N/A TRP 354.A NE1 ILE 348.A O no hydrogen 2.922 N/A LEU 355.A N LEU 351.A O no hydrogen 2.762 N/A ASN 357.A N TRP 354.A O no hydrogen 2.615 N/A