Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rfr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 107.A NE2 no hydrogen 2.988 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.892 N/A SER 5.A N GLY 2.A O no hydrogen 2.845 N/A SER 5.A OG GLY 2.A O no hydrogen 2.734 N/A GLN 6.A N GLU 3.A O no hydrogen 2.944 N/A GLN 6.A NE2 PRO 117.A O no hydrogen 2.874 N/A GLN 7.A NE2 ASP 354.A OD1 no hydrogen 3.175 N/A PHE 9.A N ASP 354.A OD2 no hydrogen 3.153 N/A ARG 11.A N GLN 7.A O no hydrogen 3.065 N/A ARG 11.A NE GLN 6.A O no hydrogen 3.023 N/A ARG 11.A NH1 GLN 6.A O no hydrogen 3.059 N/A ARG 11.A NH1 GLU 346.A O no hydrogen 2.920 N/A ARG 11.A NH2 GLU 346.A O no hydrogen 2.790 N/A MET 12.A N ALA 8.A O no hydrogen 2.829 N/A ARG 13.A N PHE 9.A O no hydrogen 2.965 N/A ARG 13.A NE VAL 359.A O no hydrogen 3.072 N/A THR 14.A OG1 LEU 10.A O no hydrogen 2.760 N/A ASN 16.A N HIS 40.A O no hydrogen 2.913 N/A ASN 16.A ND2 HIS 40.A ND1 no hydrogen 3.504 N/A TYR 18.A N LYS 38.A O no hydrogen 2.951 N/A TYR 18.A OH ASP 89.A OD2 no hydrogen 2.538 N/A GLN 21.A N SER 36.A O no hydrogen 2.688 N/A TRP 22.A NE1 VAL 106.A O no hydrogen 3.082 N/A LYS 24.A NZ GLU 31.A OE2 no hydrogen 3.296 N/A LYS 24.A NZ GLU 32.A O no hydrogen 3.160 N/A VAL 27.A N GLU 126.A O no hydrogen 2.935 N/A ASN 28.A N GLU 31.A OE1 no hydrogen 2.791 N/A VAL 29.A N LYS 128.A O no hydrogen 2.946 N/A ASN 30.A N GLY 98.A O no hydrogen 2.753 N/A GLU 31.A N ASN 28.A O no hydrogen 3.031 N/A MET 33.A N LEU 96.A O no hydrogen 3.045 N/A ILE 34.A N SER 23.A OG no hydrogen 3.338 N/A LEU 35.A N ILE 94.A O no hydrogen 2.877 N/A SER 36.A N GLN 21.A O no hydrogen 3.020 N/A GLY 37.A N PHE 92.A O no hydrogen 3.057 N/A LYS 38.A N TYR 18.A O no hydrogen 2.786 N/A LYS 38.A NZ ASP 19.A OD2 no hydrogen 2.355 N/A VAL 39.A N TYR 90.A O no hydrogen 2.685 N/A HIS 40.A N ASN 16.A O no hydrogen 2.941 N/A VAL 41.A N LYS 88.A O no hydrogen 2.835 N/A PHE 42.A N THR 14.A O no hydrogen 3.027 N/A SER 43.A N GLU 376.A OE1 no hydrogen 2.977 N/A SER 43.A OG GLU 376.A OE1 no hydrogen 3.442 N/A SER 43.A OG GLU 376.A OE2 no hydrogen 2.590 N/A TRP 45.A NE1 VAL 49.A O no hydrogen 2.951 N/A VAL 49.A N PRO 46.A O no hydrogen 3.116 N/A ALA 50.A N GLY 114.A O no hydrogen 3.433 N/A SER 55.A N VAL 82.A O no hydrogen 2.763 N/A SER 55.A OG PRO 52.A O no hydrogen 2.893 N/A PHE 56.A N ASN 111.A O no hydrogen 2.915 N/A ASN 58.A N GLN 109.A O no hydrogen 2.704 N/A GLY 60.A N HIS 107.A O no hydrogen 2.863 N/A GLY 63.A N GLU 61.A O no hydrogen 2.721 N/A VAL 65.A N GLY 63.A O no hydrogen 2.876 N/A LEU 66.A N GLU 61.A OE1 no hydrogen 2.965 N/A VAL 67.A N ARG 97.A O no hydrogen 2.881 N/A ARG 68.A NH1 ASN 58.A OD1 no hydrogen 3.253 N/A ARG 68.A NH2 ASN 58.A OD1 no hydrogen 2.667 N/A THR 69.A N ASN 95.A O no hydrogen 2.858 N/A PHE 72.A N SER 93.A O no hydrogen 2.788 N/A ILE 73.A N GLN 76.A O no hydrogen 3.033 N/A GLY 74.A N ALA 91.A O no hydrogen 3.280 N/A GLN 76.A N ILE 73.A O no hydrogen 3.271 N/A ALA 78.A N GLN 71.A O no hydrogen 3.017 N/A ARG 80.A NE GLY 235.A O no hydrogen 2.735 N/A VAL 82.A N SER 55.A O no hydrogen 2.594 N/A SER 83.A OG ARG 53.A O no hydrogen 2.591 N/A LEU 84.A N PRO 52.A O no hydrogen 2.868 N/A GLU 85.A N TYR 90.A OH no hydrogen 2.912 N/A GLY 87.A N VAL 41.A O no hydrogen 2.758 N/A LYS 88.A N GLU 85.A O no hydrogen 3.208 N/A TYR 90.A N VAL 39.A O no hydrogen 2.668 N/A TYR 90.A OH GLU 85.A OE2 no hydrogen 3.336 N/A PHE 92.A N GLY 37.A O no hydrogen 2.912 N/A SER 93.A N PHE 72.A O no hydrogen 2.952 N/A ILE 94.A N LEU 35.A O no hydrogen 2.706 N/A ASN 95.A N ALA 70.A O no hydrogen 2.955 N/A LEU 96.A N MET 33.A O no hydrogen 2.975 N/A ARG 97.A N VAL 67.A O no hydrogen 2.762 N/A ARG 97.A NE THR 135.A O no hydrogen 2.959 N/A ARG 97.A NH1 GLU 32.A OE2 no hydrogen 3.170 N/A ARG 97.A NH2 THR 135.A O no hydrogen 3.204 N/A GLY 98.A N GLU 31.A O no hydrogen 3.053 N/A ARG 99.A N VAL 65.A O no hydrogen 2.845 N/A ARG 99.A NE GLU 149.A OE1 no hydrogen 2.798 N/A ARG 99.A NH1 GLU 149.A OE1 no hydrogen 3.155 N/A ARG 99.A NH1 GLU 149.A OE2 no hydrogen 2.977 N/A ARG 99.A NH2 PRO 64.A O no hydrogen 3.036 N/A ARG 100.A N VAL 65.A O no hydrogen 3.052 N/A GLY 102.A N ILE 127.A O no hydrogen 2.737 N/A TRP 104.A N ILE 125.A O no hydrogen 2.938 N/A TRP 104.A NE1 ARG 100.A O no hydrogen 2.908 N/A HIS 105.A ND1 HIS 107.A NE2 no hydrogen 2.986 N/A VAL 106.A N GLN 123.A O no hydrogen 3.048 N/A HIS 107.A N GLY 60.A O no hydrogen 2.770 N/A HIS 107.A ND1 GLY 120.A O no hydrogen 2.904 N/A ALA 108.A N PRO 121.A O no hydrogen 3.168 N/A GLN 109.A N ASN 58.A O no hydrogen 3.055 N/A GLN 109.A NE2 ASN 111.A OD1 no hydrogen 3.382 N/A ILE 110.A N ILE 118.A O no hydrogen 2.917 N/A ASN 111.A N PHE 56.A O no hydrogen 2.889 N/A VAL 112.A N GLY 116.A O no hydrogen 3.106 N/A GLU 113.A N VAL 54.A O no hydrogen 3.011 N/A GLY 115.A N VAL 112.A O no hydrogen 2.913 N/A GLY 116.A N VAL 112.A O no hydrogen 3.041 N/A ILE 118.A N ILE 110.A O no hydrogen 2.845 N/A GLY 120.A N ALA 108.A O no hydrogen 2.557 N/A GLY 122.A N TYR 313.A OH no hydrogen 3.059 N/A GLN 123.A N VAL 106.A O no hydrogen 3.071 N/A TRP 124.A N GLN 123.A OE1 no hydrogen 3.019 N/A ILE 125.A N TRP 104.A O no hydrogen 2.784 N/A GLU 126.A N THR 25.A O no hydrogen 3.018 N/A ILE 127.A N GLY 102.A O no hydrogen 2.882 N/A LYS 128.A N VAL 27.A O no hydrogen 2.924 N/A LYS 132.A N ASP 130.A OD1 no hydrogen 3.207 N/A ASP 133.A N ASP 130.A O no hydrogen 2.661 N/A PHE 134.A N MET 131.A O no hydrogen 3.123 N/A THR 135.A OG1 ASP 133.A O no hydrogen 3.406 N/A ASP 136.A N ASP 147.A OD1 no hydrogen 2.962 N/A VAL 138.A N VAL 146.A O no hydrogen 3.019 N/A THR 139.A OG1 THR 145.A OG1 no hydrogen 3.236 N/A LEU 140.A N SER 144.A O no hydrogen 2.869 N/A GLY 143.A N LEU 140.A O no hydrogen 3.121 N/A SER 144.A N ASP 142.A OD1 no hydrogen 2.982 N/A SER 144.A OG ASP 142.A OD1 no hydrogen 2.700 N/A THR 145.A OG1 THR 139.A OG1 no hydrogen 3.236 N/A VAL 146.A N VAL 138.A O no hydrogen 2.903 N/A GLU 149.A N ASP 147.A OD1 no hydrogen 3.228 N/A ASN 150.A N ASP 147.A O no hydrogen 3.019 N/A TYR 151.A N ASP 147.A O no hydrogen 2.769 N/A ILE 153.A N ASN 150.A O no hydrogen 3.358 N/A ILE 156.A N GLY 152.A O no hydrogen 3.114 N/A TYR 157.A N ILE 153.A O no hydrogen 3.090 N/A ALA 158.A N SER 154.A O no hydrogen 2.770 N/A TRP 159.A N ARG 155.A O no hydrogen 3.252 N/A TRP 159.A N ILE 156.A O no hydrogen 3.096 N/A HIS 160.A N ILE 156.A O no hydrogen 2.743 N/A LEU 161.A N TYR 157.A O no hydrogen 2.816 N/A LEU 164.A N HIS 160.A O no hydrogen 3.024 N/A ALA 165.A N LEU 161.A O no hydrogen 2.844 N/A VAL 166.A N PRO 162.A O no hydrogen 2.709 N/A GLY 167.A N TRP 163.A O no hydrogen 2.716 N/A ALA 168.A N LEU 164.A O no hydrogen 3.087 N/A ALA 169.A N ALA 165.A O no hydrogen 3.048 N/A TRP 170.A N VAL 166.A O no hydrogen 3.088 N/A ILE 171.A N GLY 167.A O no hydrogen 3.238 N/A LEU 172.A N ALA 168.A O no hydrogen 2.807 N/A PHE 173.A N ALA 169.A O no hydrogen 2.869 N/A TRP 174.A N TRP 170.A O no hydrogen 3.494 N/A PHE 175.A N ILE 171.A O no hydrogen 2.969 N/A ILE 176.A N LEU 172.A O no hydrogen 2.850 N/A ARG 177.A N PHE 173.A O no hydrogen 2.849 N/A LYS 178.A N ILE 176.A O no hydrogen 2.869 N/A SER 183.A N ILE 180.A O no hydrogen 2.877 N/A SER 183.A OG GLY 179.A O no hydrogen 2.976 N/A TYR 184.A N ILE 180.A O no hydrogen 2.841 N/A VAL 185.A N ILE 181.A O no hydrogen 2.974 N/A ARG 186.A N ALA 182.A O no hydrogen 3.287 N/A VAL 187.A N SER 183.A O no hydrogen 3.104 N/A ALA 188.A N TYR 184.A O no hydrogen 2.914 N/A GLU 189.A N VAL 185.A O no hydrogen 2.767 N/A ASP 194.A N PRO 192.A O no hydrogen 2.152 N/A GLY 197.A N ASP 200.A OD2 no hydrogen 3.303 N/A ASP 199.A N ASP 199.A OD1 no hydrogen 2.633 N/A ASP 200.A N GLY 197.A O no hydrogen 2.789 N/A ARG 201.A NH2 ASP 198.A OD1 no hydrogen 3.529 N/A ILE 203.A N ASP 199.A O no hydrogen 3.063 N/A GLY 204.A N ASP 200.A O no hydrogen 3.281 N/A ALA 205.A N ARG 201.A O no hydrogen 2.759 N/A ILE 206.A N ARG 202.A O no hydrogen 2.816 N/A VAL 207.A N ILE 203.A O no hydrogen 2.703 N/A LEU 208.A N GLY 204.A O no hydrogen 2.877 N/A ALA 209.A N ALA 205.A O no hydrogen 3.085 N/A LEU 210.A N ILE 206.A O no hydrogen 2.976 N/A THR 211.A N VAL 207.A O no hydrogen 2.774 N/A THR 211.A OG1 VAL 207.A O no hydrogen 3.172 N/A ILE 212.A N LEU 208.A O no hydrogen 2.935 N/A LEU 213.A N ALA 209.A O no hydrogen 3.144 N/A ALA 214.A N LEU 210.A O no hydrogen 2.787 N/A THR 215.A N THR 211.A O no hydrogen 2.892 N/A THR 215.A OG1 THR 211.A O no hydrogen 3.129 N/A ILE 216.A N ILE 212.A O no hydrogen 2.857 N/A VAL 217.A N LEU 213.A O no hydrogen 2.804 N/A GLY 218.A N ALA 214.A O no hydrogen 2.885 N/A TYR 219.A N THR 215.A O no hydrogen 2.979 N/A ALA 220.A N ILE 216.A O no hydrogen 2.943 N/A VAL 221.A N VAL 217.A O no hydrogen 2.761 N/A THR 222.A N GLY 218.A O no hydrogen 3.097 N/A THR 222.A OG1 GLY 218.A O no hydrogen 2.888 N/A THR 222.A OG1 TYR 219.A O no hydrogen 3.222 N/A ASN 223.A N TYR 219.A O no hydrogen 3.145 N/A SER 224.A N VAL 221.A O no hydrogen 2.934 N/A THR 225.A N VAL 221.A O no hydrogen 3.198 N/A THR 225.A OG1 VAL 221.A O no hydrogen 2.919 N/A GLN 237.A N SER 81.A O no hydrogen 3.074 N/A ILE 243.A N ASP 89.A O no hydrogen 2.957 N/A THR 248.A OG1 THR 245.A O no hydrogen 3.274 N/A THR 257.A N LYS 279.A O no hydrogen 3.010 N/A THR 258.A OG1 GLU 376.A O no hydrogen 2.893 N/A GLU 259.A N LYS 277.A O no hydrogen 3.014 N/A ASN 261.A N ASN 275.A O no hydrogen 2.750 N/A VAL 264.A N THR 273.A O no hydrogen 2.821 N/A TYR 265.A N ILE 382.A O no hydrogen 3.039 N/A TYR 265.A OH SER 357.A OG no hydrogen 3.037 N/A LYS 266.A N GLU 271.A O no hydrogen 3.363 N/A VAL 267.A N LYS 384.A O no hydrogen 2.772 N/A LEU 272.A N ILE 338.A O no hydrogen 2.754 N/A THR 273.A N VAL 264.A O no hydrogen 2.769 N/A ILE 274.A N VAL 336.A O no hydrogen 2.823 N/A ASN 275.A N GLY 262.A O no hydrogen 3.192 N/A ASN 275.A ND2 ASN 261.A O no hydrogen 3.250 N/A VAL 276.A N ILE 334.A O no hydrogen 2.929 N/A LYS 277.A N GLU 259.A O no hydrogen 2.793 N/A VAL 278.A N LYS 332.A O no hydrogen 2.683 N/A LYS 279.A N THR 257.A O no hydrogen 2.980 N/A ASN 280.A N GLU 330.A O no hydrogen 3.002 N/A ASN 280.A ND2 GLN 284.A O no hydrogen 3.156 N/A ASN 280.A ND2 ILE 326.A O no hydrogen 2.988 N/A THR 282.A N ASN 280.A OD1 no hydrogen 2.843 N/A THR 282.A OG1 ASN 280.A OD1 no hydrogen 2.690 N/A SER 283.A N GLU 254.A OE1 no hydrogen 3.031 N/A SER 283.A OG GLU 254.A OE1 no hydrogen 2.985 N/A GLN 284.A N THR 282.A OG1 no hydrogen 3.032 N/A GLN 284.A NE2 ASP 369.A OD1 no hydrogen 2.736 N/A VAL 286.A N ILE 326.A O no hydrogen 2.955 N/A ARG 287.A N PHE 366.A O no hydrogen 2.792 N/A ARG 287.A NH2 THR 367.A O no hydrogen 3.205 N/A GLY 289.A N PHE 364.A O no hydrogen 2.737 N/A GLU 290.A N PHE 364.A O no hydrogen 3.319 N/A TYR 291.A N PHE 298.A O no hydrogen 2.928 N/A TYR 291.A OH GLY 360.A O no hydrogen 2.596 N/A THR 292.A N LEU 362.A O no hydrogen 2.985 N/A THR 292.A OG1 LEU 362.A O no hydrogen 3.521 N/A ALA 293.A N LEU 296.A O no hydrogen 3.251 N/A ARG 297.A N LEU 314.A O no hydrogen 2.988 N/A ARG 297.A NE GLU 290.A OE2 no hydrogen 2.745 N/A ARG 297.A NH2 GLU 290.A OE1 no hydrogen 2.927 N/A PHE 298.A N TYR 291.A O no hydrogen 2.779 N/A LEU 299.A N ALA 316.A O no hydrogen 2.757 N/A ASN 300.A N GLY 289.A O no hydrogen 2.917 N/A ASN 300.A ND2 LEU 288.A O no hydrogen 2.912 N/A THR 302.A N ASN 300.A OD1 no hydrogen 3.085 N/A VAL 303.A N ASN 300.A O no hydrogen 2.827 N/A PHE 304.A N ASN 300.A O no hydrogen 2.728 N/A ALA 316.A N ARG 297.A O no hydrogen 2.659 N/A GLY 319.A N LEU 299.A O no hydrogen 2.609 N/A ILE 326.A N VAL 286.A O no hydrogen 2.874 N/A ALA 327.A N GLU 330.A OE1 no hydrogen 2.649 N/A GLU 330.A N ALA 327.A O no hydrogen 2.881 N/A LYS 332.A N VAL 278.A O no hydrogen 2.916 N/A ILE 334.A N VAL 276.A O no hydrogen 2.914 N/A VAL 336.A N ILE 274.A O no hydrogen 2.756 N/A LYS 337.A N LEU 320.A O no hydrogen 2.832 N/A ILE 338.A N LEU 272.A O no hydrogen 2.703 N/A GLN 339.A N ARG 318.A O no hydrogen 3.476 N/A ASP 340.A N ARG 270.A O no hydrogen 3.318 N/A ARG 342.A N ASP 340.A OD2 no hydrogen 3.104 N/A ARG 342.A NE ASP 312.A O no hydrogen 3.347 N/A ARG 342.A NH1 ASP 340.A OD2 no hydrogen 2.639 N/A ARG 342.A NH2 ASP 312.A O no hydrogen 3.479 N/A TRP 343.A N ASP 340.A O no hydrogen 3.238 N/A ILE 345.A N ALA 341.A O no hydrogen 2.876 N/A GLU 346.A N ARG 342.A O no hydrogen 3.011 N/A ARG 347.A N ASP 344.A O no hydrogen 2.913 N/A ARG 347.A NH1 LYS 4.A O no hydrogen 2.678 N/A LEU 348.A N TRP 343.A O no hydrogen 2.974 N/A SER 349.A N TRP 343.A O no hydrogen 3.374 N/A SER 349.A OG ASP 344.A OD1 no hydrogen 2.978 N/A ASP 350.A N ARG 347.A O no hydrogen 3.235 N/A LEU 351.A N LEU 348.A O no hydrogen 3.285 N/A TYR 353.A N ASP 350.A O no hydrogen 3.101 N/A ASP 354.A N LEU 351.A O no hydrogen 3.028 N/A SER 357.A OG TYR 265.A OH no hydrogen 3.037 N/A SER 357.A OG VAL 381.A O no hydrogen 2.900 N/A VAL 359.A N GLY 379.A O no hydrogen 2.913 N/A LEU 362.A N THR 292.A O no hydrogen 3.099 N/A LEU 363.A N ALA 375.A O no hydrogen 2.782 N/A PHE 364.A N GLU 290.A O no hydrogen 2.800 N/A PHE 365.A N PHE 373.A O no hydrogen 2.784 N/A PHE 366.A N ARG 287.A O no hydrogen 2.723 N/A THR 367.A N LYS 371.A O no hydrogen 3.033 N/A THR 367.A OG1 ASP 369.A OD1 no hydrogen 2.711 N/A ARG 372.A NH1 ASP 19.A OD2 no hydrogen 2.868 N/A ARG 372.A NH2 ASP 19.A OD1 no hydrogen 2.868 N/A PHE 373.A N PHE 365.A O no hydrogen 2.724 N/A ALA 375.A N LEU 363.A O no hydrogen 3.081 N/A ILE 377.A N GLY 361.A O no hydrogen 2.828 N/A GLY 379.A N VAL 359.A O no hydrogen 2.981 N/A VAL 381.A N SER 357.A O no hydrogen 3.148 N/A ILE 382.A N GLY 263.A O no hydrogen 2.821 N/A LYS 384.A N TYR 265.A O no hydrogen 2.822 N/A VAL 386.A N VAL 267.A O no hydrogen 2.635 N/A