Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r6c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 2.A OG no hydrogen 3.115 N/A ILE 6.A N SER 2.A O no hydrogen 2.970 N/A LEU 7.A N TRP 3.A O no hydrogen 2.826 N/A GLY 8.A N PRO 4.A O no hydrogen 2.917 N/A ARG 9.A N GLN 5.A O no hydrogen 3.053 N/A ARG 9.A NE ASP 15.A O no hydrogen 2.843 N/A ARG 9.A NH2 ASP 15.A O no hydrogen 3.404 N/A LEU 10.A N ILE 6.A O no hydrogen 2.974 N/A THR 11.A N LEU 7.A O no hydrogen 2.772 N/A THR 11.A OG1 LEU 7.A O no hydrogen 2.988 N/A THR 11.A OG1 GLY 8.A O no hydrogen 3.204 N/A ASP 12.A N GLY 8.A O no hydrogen 2.952 N/A ASN 13.A N LEU 10.A O no hydrogen 2.804 N/A ARG 14.A N ARG 9.A O no hydrogen 3.059 N/A LEU 16.A N GLU 54.A OE2 no hydrogen 2.688 N/A ALA 17.A N GLN 20.A OE1 no hydrogen 2.837 N/A GLY 19.A N GLU 57.A OE2 no hydrogen 2.829 N/A GLN 20.A N ALA 17.A O no hydrogen 3.037 N/A GLN 20.A NE2 GLN 5.A OE1 no hydrogen 3.280 N/A ALA 22.A N GLU 57.A OE1 no hydrogen 2.889 N/A TRP 23.A N GLY 19.A O no hydrogen 2.857 N/A ALA 24.A N GLN 20.A O no hydrogen 3.001 N/A MET 25.A N ALA 21.A O no hydrogen 2.916 N/A ASP 26.A N ALA 22.A O no hydrogen 2.877 N/A GLN 27.A N TRP 23.A O no hydrogen 2.883 N/A ILE 28.A N ALA 24.A O no hydrogen 2.996 N/A MET 29.A N MET 25.A O no hydrogen 2.821 N/A THR 30.A N ASP 26.A O no hydrogen 2.990 N/A THR 30.A N GLN 27.A O no hydrogen 3.386 N/A THR 30.A OG1 ASP 26.A O no hydrogen 2.695 N/A THR 30.A OG1 GLN 27.A O no hydrogen 3.307 N/A THR 30.A OG1 ASN 32.A OD1 no hydrogen 2.954 N/A ASN 32.A N GLN 27.A O no hydrogen 2.990 N/A ARG 34.A N GLN 37.A OE1 no hydrogen 2.845 N/A ILE 38.A N ARG 34.A O no hydrogen 2.948 N/A ALA 39.A N PRO 35.A O no hydrogen 2.889 N/A ALA 40.A N ALA 36.A O no hydrogen 2.931 N/A PHE 41.A N GLN 37.A O no hydrogen 2.934 N/A ALA 42.A N ILE 38.A O no hydrogen 2.887 N/A VAL 43.A N ALA 39.A O no hydrogen 2.889 N/A ALA 44.A N ALA 40.A O no hydrogen 2.756 N/A MET 45.A N PHE 41.A O no hydrogen 2.900 N/A THR 46.A N ALA 42.A O no hydrogen 3.170 N/A THR 46.A OG1 ALA 42.A O no hydrogen 2.684 N/A MET 47.A N VAL 43.A O no hydrogen 3.038 N/A LYS 48.A N ALA 44.A O no hydrogen 3.037 N/A LYS 48.A NZ ASP 15.A OD1 no hydrogen 2.805 N/A LYS 48.A NZ ALA 49.A O no hydrogen 2.782 N/A LYS 48.A NZ GLU 54.A OE1 no hydrogen 2.661 N/A LYS 48.A NZ GLU 54.A OE2 no hydrogen 3.171 N/A ALA 49.A N MET 45.A O no hydrogen 3.262 N/A ALA 49.A N THR 46.A O no hydrogen 3.305 N/A THR 51.A N GLU 54.A OE1 no hydrogen 3.058 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.009 N/A VAL 55.A N THR 51.A O no hydrogen 2.993 N/A GLY 56.A N ALA 52.A O no hydrogen 2.809 N/A GLU 57.A N ASP 53.A O no hydrogen 2.947 N/A LEU 58.A N GLU 54.A O no hydrogen 3.086 N/A ALA 59.A N VAL 55.A O no hydrogen 2.904 N/A GLY 60.A N GLY 56.A O no hydrogen 2.780 N/A VAL 61.A N GLU 57.A O no hydrogen 2.920 N/A MET 62.A N LEU 58.A O no hydrogen 3.182 N/A LEU 63.A N ALA 59.A O no hydrogen 2.868 N/A SER 64.A N GLY 60.A O no hydrogen 2.850 N/A SER 64.A OG VAL 61.A O no hydrogen 2.701 N/A HIS 65.A N VAL 61.A O no hydrogen 3.066 N/A HIS 65.A N MET 62.A O no hydrogen 3.158 N/A HIS 65.A NE2 ASP 26.A OD1 no hydrogen 2.646 N/A ALA 66.A N LEU 63.A O no hydrogen 3.172 N/A HIS 67.A N PHE 158.A O no hydrogen 3.010 N/A THR 73.A OG1 PRO 70.A O no hydrogen 2.637 N/A ALA 78.A N PRO 75.A O no hydrogen 3.170 N/A VAL 79.A N PRO 108.A O no hydrogen 2.826 N/A ASP 80.A N ALA 192.A O no hydrogen 3.080 N/A VAL 82.A N LEU 194.A O no hydrogen 3.200 N/A THR 84.A N GLY 196.A O no hydrogen 2.971 N/A THR 84.A OG1 GLY 85.A O no hydrogen 2.686 N/A GLY 85.A N ASP 227.A OD2 no hydrogen 2.812 N/A VAL 89.A N ASP 87.A OD1 no hydrogen 3.119 N/A THR 91.A OG1 VAL 92.A O no hydrogen 2.890 N/A VAL 92.A N LEU 265.A O no hydrogen 2.875 N/A ASN 93.A ND2 SER 121.A O no hydrogen 2.919 N/A SER 95.A OG GLU 228.A OE1 no hydrogen 2.769 N/A SER 95.A OG GLU 228.A OE2 no hydrogen 3.139 N/A MET 97.A N ASN 93.A O no hydrogen 3.056 N/A ALA 98.A N LEU 94.A O no hydrogen 2.899 N/A ALA 99.A N SER 95.A O no hydrogen 2.827 N/A ILE 100.A N THR 96.A O no hydrogen 3.153 N/A VAL 101.A N MET 97.A O no hydrogen 3.154 N/A VAL 102.A N ALA 98.A O no hydrogen 2.787 N/A ALA 103.A N ALA 99.A O no hydrogen 2.980 N/A ALA 104.A N ILE 100.A O no hydrogen 2.928 N/A ALA 105.A N VAL 101.A O no hydrogen 2.934 N/A GLY 106.A N ALA 103.A O no hydrogen 2.882 N/A VAL 107.A N VAL 102.A O no hydrogen 3.275 N/A VAL 109.A N GLY 149.A O no hydrogen 3.288 N/A VAL 110.A N VAL 79.A O no hydrogen 3.010 N/A LYS 111.A N GLY 151.A O no hydrogen 2.903 N/A LYS 111.A NZ VAL 81.A O no hydrogen 2.730 N/A LYS 111.A NZ HIS 112.A O no hydrogen 2.893 N/A HIS 112.A N ASP 80.A OD1 no hydrogen 3.053 N/A HIS 112.A ND1 GLY 182.A O no hydrogen 2.815 N/A GLY 113.A N CYS 153.A O no hydrogen 2.967 N/A ARG 115.A N ASN 114.A OD1 no hydrogen 2.812 N/A ARG 115.A NH1 ASP 125.A OD1 no hydrogen 3.138 N/A ARG 115.A NH1 GLU 128.A OE1 no hydrogen 2.956 N/A ARG 115.A NH2 GLU 128.A OE1 no hydrogen 3.507 N/A ARG 115.A NH2 GLU 128.A OE2 no hydrogen 2.759 N/A ALA 116.A N ASP 125.A OD2 no hydrogen 2.797 N/A LEU 120.A N ASN 90.A OD1 no hydrogen 2.830 N/A SER 121.A OG GLY 122.A O no hydrogen 3.567 N/A SER 121.A OG THR 126.A OG1 no hydrogen 2.821 N/A GLY 122.A N ASP 125.A OD2 no hydrogen 2.766 N/A ALA 124.A N ASN 114.A O no hydrogen 3.218 N/A THR 126.A N GLY 122.A O no hydrogen 3.040 N/A THR 126.A OG1 ASN 93.A OD1 no hydrogen 2.437 N/A THR 126.A OG1 SER 121.A OG no hydrogen 2.821 N/A THR 126.A OG1 GLY 122.A O no hydrogen 3.420 N/A LEU 127.A N GLY 123.A O no hydrogen 2.915 N/A GLU 128.A N ALA 124.A O no hydrogen 2.956 N/A ALA 129.A N ASP 125.A O no hydrogen 3.044 N/A LEU 130.A N THR 126.A O no hydrogen 3.006 N/A LEU 130.A N LEU 127.A O no hydrogen 3.134 N/A GLY 131.A N GLU 128.A O no hydrogen 3.076 N/A VAL 132.A N LEU 127.A O no hydrogen 2.979 N/A ARG 133.A NE ASP 135.A OD1 no hydrogen 2.738 N/A ARG 133.A NH1 GLY 343.A O no hydrogen 3.002 N/A ARG 133.A NH2 ASP 135.A OD1 no hydrogen 3.476 N/A ARG 133.A NH2 ASP 135.A OD2 no hydrogen 2.826 N/A VAL 141.A N GLY 137.A O no hydrogen 2.969 N/A ALA 142.A N PRO 138.A O no hydrogen 3.059 N/A ARG 143.A N ASP 139.A O no hydrogen 3.077 N/A SER 144.A N LEU 140.A O no hydrogen 2.889 N/A SER 144.A OG ILE 150.A O no hydrogen 2.588 N/A LEU 145.A N VAL 141.A O no hydrogen 2.873 N/A ALA 146.A N ALA 142.A O no hydrogen 3.017 N/A GLU 147.A N ARG 143.A O no hydrogen 2.815 N/A VAL 148.A N SER 144.A O no hydrogen 2.761 N/A GLY 149.A N SER 144.A O no hydrogen 3.349 N/A GLY 149.A N LEU 145.A O no hydrogen 3.055 N/A GLY 151.A N VAL 109.A O no hydrogen 2.959 N/A CYS 153.A N LYS 111.A O no hydrogen 2.687 N/A ALA 155.A N GLY 113.A O no hydrogen 2.837 N/A ARG 157.A N PHE 154.A O no hydrogen 2.958 N/A ARG 157.A NH1 ARG 157.A O no hydrogen 2.919 N/A PHE 158.A N PHE 154.A O no hydrogen 3.335 N/A PHE 158.A N ALA 155.A O no hydrogen 3.113 N/A HIS 159.A N ALA 155.A O no hydrogen 2.803 N/A TYR 162.A N HIS 159.A O no hydrogen 2.987 N/A ARG 163.A N PRO 160.A O no hydrogen 3.229 N/A ARG 163.A NH1 PRO 160.A O no hydrogen 3.181 N/A ALA 166.A N TYR 162.A O no hydrogen 2.908 N/A ALA 167.A N ARG 163.A O no hydrogen 3.006 N/A VAL 168.A N HIS 164.A O no hydrogen 3.325 N/A ARG 169.A N ALA 165.A O no hydrogen 2.823 N/A ARG 170.A N ALA 166.A O no hydrogen 2.993 N/A GLU 171.A N ALA 167.A O no hydrogen 2.895 N/A ILE 172.A N VAL 168.A O no hydrogen 2.972 N/A VAL 174.A N ILE 172.A O no hydrogen 2.717 N/A VAL 177.A N THR 46.A OG1 no hydrogen 2.821 N/A PHE 178.A N THR 176.A OG1 no hydrogen 3.097 N/A ASN 179.A N THR 176.A O no hydrogen 2.887 N/A ASN 179.A ND2 THR 176.A O no hydrogen 3.258 N/A LEU 180.A N VAL 177.A O no hydrogen 3.087 N/A LEU 181.A N PHE 178.A O no hydrogen 3.045 N/A LEU 184.A N LEU 181.A O no hydrogen 3.054 N/A THR 185.A N GLY 182.A O no hydrogen 3.124 N/A THR 185.A OG1 LEU 181.A O no hydrogen 2.753 N/A THR 185.A OG1 GLY 182.A O no hydrogen 3.366 N/A ASN 186.A ND2 ASP 80.A OD2 no hydrogen 2.801 N/A ASN 186.A ND2 VAL 110.A O no hydrogen 2.817 N/A ALA 188.A N ASN 186.A OD1 no hydrogen 2.862 N/A ARG 189.A N ASN 186.A O no hydrogen 2.905 N/A ARG 189.A NH2 LEU 63.A O no hydrogen 3.443 N/A ARG 191.A NH1 ASP 76.A O no hydrogen 3.157 N/A GLY 193.A N SER 216.A O no hydrogen 3.021 N/A LEU 194.A N ASP 80.A O no hydrogen 2.948 N/A ILE 195.A N LEU 218.A O no hydrogen 2.804 N/A GLY 196.A N VAL 82.A O no hydrogen 2.962 N/A CYS 197.A N VAL 220.A O no hydrogen 2.832 N/A CYS 197.A SG PHE 199.A O no hydrogen 3.344 N/A ALA 198.A N THR 84.A OG1 no hydrogen 2.976 N/A LEU 202.A N PHE 199.A O no hydrogen 2.898 N/A ALA 203.A N PHE 199.A O no hydrogen 3.213 N/A MET 206.A N LEU 202.A O no hydrogen 3.074 N/A ALA 207.A N ALA 203.A O no hydrogen 2.930 N/A GLY 208.A N GLU 204.A O no hydrogen 2.882 N/A VAL 209.A N VAL 205.A O no hydrogen 3.089 N/A PHE 210.A N MET 206.A O no hydrogen 3.212 N/A ALA 211.A N ALA 207.A O no hydrogen 2.778 N/A ALA 212.A N GLY 208.A O no hydrogen 2.941 N/A ARG 213.A N VAL 209.A O no hydrogen 3.340 N/A ARG 213.A N PHE 210.A O no hydrogen 3.182 N/A ARG 213.A NH1 LEU 184.A O no hydrogen 3.086 N/A ARG 213.A NH2 LEU 184.A O no hydrogen 2.785 N/A ARG 214.A N ALA 211.A O no hydrogen 2.869 N/A SER 215.A N PHE 210.A O no hydrogen 3.053 N/A SER 216.A N ARG 191.A O no hydrogen 2.745 N/A SER 216.A OG ALA 302.A O no hydrogen 2.599 N/A VAL 217.A N VAL 240.A O no hydrogen 3.176 N/A LEU 218.A N GLY 193.A O no hydrogen 3.100 N/A VAL 219.A N TRP 238.A O no hydrogen 2.922 N/A VAL 220.A N ILE 195.A O no hydrogen 2.724 N/A HIS 221.A N THR 236.A O no hydrogen 2.944 N/A HIS 221.A ND1 CYS 197.A O no hydrogen 2.761 N/A GLY 222.A N LEU 226.A O no hydrogen 2.825 N/A ASP 223.A N THR 234.A O no hydrogen 2.891 N/A GLY 225.A N GLY 222.A O no hydrogen 2.753 N/A LEU 226.A N ASP 224.A OD1 no hydrogen 3.149 N/A ASP 227.A N ASP 87.A OD2 no hydrogen 3.448 N/A LEU 229.A N ASN 295.A OD1 no hydrogen 2.890 N/A THR 230.A N SER 235.A OG no hydrogen 3.052 N/A THR 230.A OG1 ASP 224.A OD2 no hydrogen 2.463 N/A THR 232.A N THR 230.A OG1 no hydrogen 3.120 N/A THR 232.A OG1 ASP 224.A OD2 no hydrogen 2.512 N/A THR 234.A N THR 233.A OG1 no hydrogen 2.626 N/A THR 234.A OG1 ASP 223.A OD2 no hydrogen 2.527 N/A SER 235.A N PHE 250.A O no hydrogen 2.838 N/A THR 236.A N HIS 221.A O no hydrogen 2.770 N/A THR 236.A OG1 ASP 223.A OD1 no hydrogen 2.778 N/A ILE 237.A N LEU 248.A O no hydrogen 2.722 N/A TRP 238.A N VAL 219.A O no hydrogen 2.736 N/A ARG 239.A N ASP 246.A O no hydrogen 2.671 N/A ARG 239.A NH2 ASP 246.A OD2 no hydrogen 2.580 N/A VAL 240.A N VAL 217.A O no hydrogen 2.790 N/A ALA 241.A N SER 244.A O no hydrogen 3.169 N/A SER 244.A N ALA 241.A O no hydrogen 3.004 N/A SER 244.A OG ALA 241.A O no hydrogen 3.414 N/A ASP 246.A N ARG 239.A O no hydrogen 2.782 N/A LEU 248.A N ILE 237.A O no hydrogen 2.771 N/A PHE 250.A N SER 235.A O no hydrogen 2.678 N/A ALA 253.A N ASP 251.A OD1 no hydrogen 2.944 N/A GLY 254.A N ASP 251.A O no hydrogen 2.946 N/A PHE 255.A N PRO 252.A O no hydrogen 2.764 N/A GLY 256.A N ALA 253.A O no hydrogen 3.062 N/A PHE 257.A N PRO 252.A O no hydrogen 3.170 N/A ARG 259.A NH1 ASP 251.A OD1 no hydrogen 2.863 N/A ARG 259.A NH2 ASP 251.A OD1 no hydrogen 2.986 N/A ARG 259.A NH2 ASP 251.A OD2 no hydrogen 3.137 N/A ALA 260.A N THR 231.A O no hydrogen 2.897 N/A GLN 261.A N GLN 264.A OE1 no hydrogen 2.764 N/A GLN 264.A N GLN 261.A O no hydrogen 2.990 N/A LEU 265.A N LEU 262.A O no hydrogen 2.848 N/A ALA 266.A N ASP 263.A O no hydrogen 3.287 N/A GLY 267.A N ASN 90.A O no hydrogen 2.620 N/A GLY 268.A N ASN 273.A OD1 no hydrogen 2.764 N/A ALA 272.A N ASP 269.A OD1 no hydrogen 2.922 N/A ASN 273.A N ASP 269.A O no hydrogen 2.897 N/A ASN 273.A ND2 THR 91.A O no hydrogen 3.641 N/A ASN 273.A ND2 ASN 93.A OD1 no hydrogen 2.906 N/A ALA 274.A N ALA 270.A O no hydrogen 2.817 N/A ALA 275.A N GLN 271.A O no hydrogen 3.019 N/A ALA 276.A N ALA 272.A O no hydrogen 3.016 N/A VAL 277.A N ASN 273.A O no hydrogen 3.061 N/A ARG 278.A N ALA 274.A O no hydrogen 3.014 N/A ALA 279.A N ALA 275.A O no hydrogen 2.928 N/A VAL 280.A N ALA 276.A O no hydrogen 3.021 N/A LEU 281.A N VAL 277.A O no hydrogen 2.925 N/A GLY 282.A N ARG 278.A O no hydrogen 2.948 N/A GLY 282.A N ALA 279.A O no hydrogen 3.174 N/A GLY 283.A N VAL 280.A O no hydrogen 3.036 N/A ALA 284.A N ALA 279.A O no hydrogen 3.166 N/A ARG 289.A NH1 ASP 328.A OD1 no hydrogen 3.235 N/A ARG 289.A NH2 ASP 328.A OD1 no hydrogen 2.834 N/A ARG 289.A NH2 ASP 328.A OD2 no hydrogen 3.426 N/A ASP 290.A N GLY 286.A O no hydrogen 3.082 N/A ALA 291.A N PRO 287.A O no hydrogen 3.066 N/A VAL 292.A N VAL 288.A O no hydrogen 2.903 N/A VAL 293.A N ARG 289.A O no hydrogen 2.859 N/A LEU 294.A N ASP 290.A O no hydrogen 2.989 N/A ASN 295.A N ALA 291.A O no hydrogen 2.989 N/A ASN 295.A ND2 LEU 229.A O no hydrogen 2.819 N/A ASN 295.A ND2 ALA 291.A O no hydrogen 2.849 N/A ALA 296.A N VAL 292.A O no hydrogen 2.795 N/A ALA 297.A N VAL 293.A O no hydrogen 2.799 N/A GLY 298.A N LEU 294.A O no hydrogen 2.995 N/A ALA 299.A N ASN 295.A O no hydrogen 3.004 N/A ILE 300.A N ALA 296.A O no hydrogen 2.985 N/A VAL 301.A N ALA 297.A O no hydrogen 2.779 N/A ALA 302.A N GLY 298.A O no hydrogen 2.954 N/A HIS 303.A N ALA 299.A O no hydrogen 3.034 N/A HIS 303.A NE2 ASP 77.A OD2 no hydrogen 2.575 N/A ALA 304.A N ILE 300.A O no hydrogen 2.870 N/A GLY 305.A N VAL 301.A O no hydrogen 3.020 N/A LEU 306.A N HIS 303.A O no hydrogen 3.121 N/A SER 307.A N ALA 304.A O no hydrogen 3.130 N/A ALA 310.A N SER 307.A O no hydrogen 3.323 N/A ALA 315.A N GLU 311.A O no hydrogen 2.919 N/A TRP 316.A N TRP 312.A O no hydrogen 3.056 N/A GLU 317.A N LEU 313.A O no hydrogen 2.994 N/A GLU 318.A N PRO 314.A O no hydrogen 2.901 N/A GLY 319.A N ALA 315.A O no hydrogen 2.720 N/A LEU 320.A N TRP 316.A O no hydrogen 2.844 N/A ARG 321.A N GLU 317.A O no hydrogen 3.030 N/A ARG 322.A N GLU 318.A O no hydrogen 2.849 N/A ARG 322.A NH2 ALA 105.A O no hydrogen 2.920 N/A ALA 323.A N GLY 319.A O no hydrogen 2.900 N/A SER 324.A N LEU 320.A O no hydrogen 2.985 N/A SER 324.A OG LEU 320.A O no hydrogen 3.431 N/A ALA 325.A N ARG 321.A O no hydrogen 2.907 N/A ALA 326.A N ARG 322.A O no hydrogen 2.929 N/A ILE 327.A N ALA 323.A O no hydrogen 3.303 N/A ASP 328.A N SER 324.A O no hydrogen 2.832 N/A THR 329.A N ALA 325.A O no hydrogen 2.885 N/A THR 329.A OG1 ALA 325.A O no hydrogen 2.749 N/A THR 329.A OG1 ALA 326.A O no hydrogen 3.527 N/A GLY 330.A N ILE 327.A O no hydrogen 2.926 N/A ALA 331.A N THR 329.A OG1 no hydrogen 3.236 N/A ALA 332.A N ALA 326.A O no hydrogen 2.921 N/A GLN 334.A N GLY 330.A O no hydrogen 2.911 N/A LEU 335.A N ALA 331.A O no hydrogen 2.727 N/A LEU 336.A N ALA 332.A O no hydrogen 3.037 N/A ALA 337.A N GLU 333.A O no hydrogen 3.182 N/A ARG 338.A N GLN 334.A O no hydrogen 2.804 N/A TRP 339.A N LEU 335.A O no hydrogen 2.789 N/A VAL 340.A N LEU 336.A O no hydrogen 2.933 N/A ARG 341.A N ALA 337.A O no hydrogen 2.946 N/A PHE 342.A N ARG 338.A O no hydrogen 2.875 N/A GLY 343.A N TRP 339.A O no hydrogen 3.244 N/A ARG 344.A N VAL 340.A O no hydrogen 3.172 N/A GLN 345.A N PHE 342.A O no hydrogen 3.208 N/A