Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 83.A OD1 no hydrogen 3.058 N/A SER 1.A N ILE 84.A O no hydrogen 3.039 N/A SER 1.A OG ILE 84.A O no hydrogen 3.387 N/A TYR 3.A N VAL 82.A O no hydrogen 2.811 N/A GLU 4.A N VAL 305.A O no hydrogen 2.866 N/A VAL 5.A N ILE 80.A O no hydrogen 2.946 N/A THR 6.A N GLN 307.A OE1 no hydrogen 2.923 N/A GLY 7.A N VAL 78.A O no hydrogen 2.981 N/A VAL 8.A N ASP 25.A OD2 no hydrogen 3.028 N/A ALA 9.A N VAL 76.A O no hydrogen 3.004 N/A ILE 11.A N GLY 74.A O no hydrogen 2.841 N/A THR 17.A N SER 14.A OG no hydrogen 3.232 N/A THR 17.A OG1 SER 14.A O no hydrogen 3.179 N/A ALA 18.A N SER 14.A O no hydrogen 3.095 N/A ARG 19.A N.A GLU 15.A O no hydrogen 2.884 N/A ARG 19.A N.B GLU 15.A O no hydrogen 2.883 N/A ARG 19.A NE.A GLU 69.A OE1 no hydrogen 2.991 N/A ARG 19.A NH1.A LEU 47.A O no hydrogen 3.016 N/A ARG 19.A NH2.A LEU 47.A O no hydrogen 3.345 N/A LEU 20.A N GLU 16.A O no hydrogen 3.134 N/A HIS 21.A N THR 17.A O no hydrogen 2.967 N/A ALA 22.A N ALA 18.A O no hydrogen 2.970 N/A LEU 23.A N ARG 19.A O.A no hydrogen 2.977 N/A LEU 23.A N ARG 19.A O.B no hydrogen 2.974 N/A GLU 24.A N LEU 20.A O no hydrogen 2.990 N/A ASP 25.A N HIS 21.A O no hydrogen 2.856 N/A ALA 26.A N ALA 22.A O no hydrogen 2.966 N/A LEU 27.A N LEU 23.A O no hydrogen 2.859 N/A PHE 28.A N GLU 24.A O no hydrogen 2.942 N/A LYS 29.A N ASP 25.A O no hydrogen 3.434 N/A LYS 29.A NZ THR 6.A O no hydrogen 2.776 N/A LYS 29.A NZ GLN 307.A OE1 no hydrogen 3.316 N/A ALA 30.A N ALA 26.A O no hydrogen 3.275 N/A VAL 31.A N LEU 27.A O no hydrogen 2.791 N/A ASN 32.A N PHE 28.A O no hydrogen 2.769 N/A PHE 33.A N LYS 29.A O no hydrogen 3.079 N/A SER 34.A N ALA 30.A O no hydrogen 2.897 N/A SER 34.A OG ALA 30.A O no hydrogen 3.283 N/A SER 34.A OG VAL 31.A O no hydrogen 2.923 N/A GLY 35.A N VAL 31.A O no hydrogen 3.279 N/A GLY 35.A N ASN 32.A O no hydrogen 3.288 N/A ALA 36.A N VAL 31.A O no hydrogen 3.164 N/A ALA 36.A N SER 34.A OG no hydrogen 3.156 N/A ASP 37.A N GLU 60.A OE1 no hydrogen 2.879 N/A GLY 39.A N ASP 37.A OD1 no hydrogen 2.661 N/A SER 40.A N ASP 37.A O no hydrogen 3.069 N/A SER 40.A OG ASP 37.A O no hydrogen 2.666 N/A SER 40.A OG HIS 59.A NE2 no hydrogen 3.204 N/A ILE 41.A N ILE 38.A O no hydrogen 3.225 N/A ASN 43.A N SER 40.A O no hydrogen 3.248 N/A LEU 44.A N ILE 41.A O no hydrogen 2.805 N/A LEU 46.A N LEU 44.A O no hydrogen 2.909 N/A GLU 48.A N PRO 45.A O no hydrogen 3.264 N/A ARG 51.A N TYR 54.A OH no hydrogen 2.732 N/A ARG 51.A NE GLU 49.A OE2 no hydrogen 2.530 N/A ARG 51.A NH2 GLU 49.A OE2 no hydrogen 3.202 N/A TYR 54.A N ILE 64.A O no hydrogen 2.742 N/A TYR 54.A OH GLU 49.A O no hydrogen 2.629 N/A PHE 56.A N ARG 62.A O no hydrogen 2.991 N/A HIS 59.A NE2 SER 40.A O no hydrogen 3.015 N/A VAL 61.A N HIS 59.A ND1 no hydrogen 2.790 N/A ARG 62.A N ASP 83.A O no hydrogen 2.800 N/A TYR 63.A N ASP 83.A O no hydrogen 3.412 N/A ILE 64.A N TYR 54.A O no hydrogen 2.942 N/A LEU 65.A N ARG 81.A O no hydrogen 2.825 N/A VAL 66.A N ASN 52.A O no hydrogen 2.767 N/A GLU 67.A N LYS 79.A O no hydrogen 2.822 N/A SER 68.A N LYS 79.A O no hydrogen 3.235 N/A ARG 70.A N GLU 77.A O no hydrogen 2.941 N/A ARG 70.A NH1 GLU 69.A O no hydrogen 3.155 N/A LYS 71.A NZ GLU 15.A OE1 no hydrogen 2.479 N/A ARG 72.A N LYS 75.A O no hydrogen 2.650 N/A ARG 72.A NH1 LYS 71.A O no hydrogen 3.028 N/A LYS 75.A N ARG 72.A O no hydrogen 2.843 N/A VAL 76.A N ALA 9.A O no hydrogen 2.853 N/A GLU 77.A N ARG 70.A O no hydrogen 2.794 N/A VAL 78.A N GLY 7.A O no hydrogen 2.953 N/A LYS 79.A N SER 68.A O no hydrogen 2.817 N/A LYS 79.A NZ GLU 67.A OE2 no hydrogen 3.203 N/A ILE 80.A N VAL 5.A O no hydrogen 2.872 N/A ARG 81.A N LEU 65.A O no hydrogen 2.795 N/A ARG 81.A NH1 GLU 4.A OE1 no hydrogen 2.585 N/A ARG 81.A NH1 GLU 67.A OE1 no hydrogen 2.537 N/A ARG 81.A NH2 GLU 67.A OE1 no hydrogen 3.079 N/A VAL 82.A N TYR 3.A O no hydrogen 2.655 N/A ASP 83.A N TYR 63.A O no hydrogen 2.919 N/A ILE 84.A N SER 1.A O no hydrogen 3.045 N/A TYR 85.A N GLU 60.A O no hydrogen 2.856 N/A TYR 85.A OH ASP 83.A OD2 no hydrogen 2.620 N/A SER 87.A N GLU 60.A OE2 no hydrogen 2.787 N/A SER 87.A OG GLU 60.A OE2 no hydrogen 3.300 N/A GLY 90.A N SER 87.A O no hydrogen 2.879 N/A CYS 91.A SG HIS 92.A O no hydrogen 3.723 N/A HIS 92.A N CYS 257.A O no hydrogen 3.031 N/A GLN 95.A NE2 THR 93.A O no hydrogen 2.998 N/A TYR 96.A OH ASP 284.A OD2 no hydrogen 2.594 N/A LYS 97.A N HIS 278.A O no hydrogen 2.907 N/A LYS 98.A N SER 138.A O no hydrogen 2.755 N/A LYS 98.A NZ LYS 258.A O no hydrogen 2.791 N/A LYS 98.A NZ THR 260.A OG1 no hydrogen 2.982 N/A THR 99.A N GLN 166.A OE1 no hydrogen 2.519 N/A THR 99.A OG1 GLN 166.A OE1 no hydrogen 3.341 N/A THR 99.A OG1 HIS 278.A NE2 no hydrogen 2.664 N/A ILE 100.A N VAL 140.A O no hydrogen 2.867 N/A LEU 101.A N TYR 167.A O no hydrogen 2.966 N/A VAL 102.A N GLY 143.A O no hydrogen 3.231 N/A GLY 103.A N ILE 169.A O no hydrogen 2.649 N/A ASN 104.A N THR 145.A O no hydrogen 2.611 N/A ASN 104.A ND2 ASP 146.A OD1 no hydrogen 3.514 N/A ILE 105.A N SER 125.A OG no hydrogen 2.768 N/A GLU 106.A N GLY 171.A O no hydrogen 3.323 N/A ALA 108.A N ILE 173.A O no hydrogen 2.953 N/A GLN 112.A N SER 109.A O no hydrogen 2.871 N/A ALA 113.A N PRO 110.A O no hydrogen 2.854 N/A VAL 114.A N GLN 111.A O no hydrogen 3.219 N/A GLN 116.A N VAL 114.A O no hydrogen 2.786 N/A ILE 117.A N ALA 113.A O no hydrogen 3.094 N/A VAL 120.A N ILE 117.A O no hydrogen 3.063 N/A ASP 123.A N GLN 119.A O no hydrogen 3.011 N/A PHE 124.A N VAL 120.A O no hydrogen 2.841 N/A SER 125.A N GLY 121.A O no hydrogen 3.046 N/A SER 125.A OG GLY 103.A O no hydrogen 3.155 N/A SER 125.A OG GLY 121.A O no hydrogen 3.332 N/A ARG 126.A N ASP 122.A O no hydrogen 3.112 N/A VAL 127.A N ASP 123.A O no hydrogen 3.091 N/A VAL 128.A N PHE 124.A O no hydrogen 2.784 N/A ASN 129.A N SER 125.A O no hydrogen 2.849 N/A ARG 130.A N ARG 126.A O no hydrogen 2.994 N/A GLN 131.A N VAL 127.A O no hydrogen 2.784 N/A GLN 131.A NE2 THR 135.A OG1 no hydrogen 2.880 N/A LEU 132.A N VAL 128.A O no hydrogen 2.970 N/A ASP 133.A N ASN 129.A O no hydrogen 3.050 N/A GLN 134.A N ARG 130.A O no hydrogen 2.901 N/A THR 135.A N GLN 131.A O no hydrogen 2.944 N/A THR 135.A OG1 GLN 131.A O no hydrogen 2.814 N/A SER 136.A N LEU 132.A O no hydrogen 3.305 N/A SER 136.A OG LEU 132.A O no hydrogen 2.621 N/A ARG 137.A N GLU 252.A OE1 no hydrogen 2.641 N/A SER 138.A N GLU 252.A OE1 no hydrogen 2.930 N/A SER 138.A OG GLU 252.A OE2 no hydrogen 2.755 N/A PHE 139.A N SER 136.A OG no hydrogen 3.097 N/A VAL 140.A N LYS 98.A O no hydrogen 2.865 N/A SER 141.A N ASP 133.A OD2 no hydrogen 3.059 N/A SER 141.A OG ASN 129.A OD1 no hydrogen 2.236 N/A VAL 142.A N ILE 100.A O no hydrogen 3.061 N/A THR 145.A N VAL 102.A O no hydrogen 3.223 N/A TYR 147.A OH THR 157.A OG1 no hydrogen 2.697 N/A SER 148.A OG GLU 106.A OE1 no hydrogen 3.201 N/A SER 150.A N SER 148.A OG no hydrogen 2.917 N/A SER 151.A N SER 148.A OG no hydrogen 3.052 N/A ASN 152.A ND2 TYR 147.A OH no hydrogen 2.724 N/A ASN 152.A ND2 SER 148.A O no hydrogen 3.597 N/A THR 157.A N TYR 153.A O no hydrogen 3.024 N/A THR 157.A OG1 TYR 147.A OH no hydrogen 2.697 N/A THR 157.A OG1 TYR 153.A O no hydrogen 3.300 N/A GLN 158.A N PRO 154.A O no hydrogen 2.906 N/A GLN 158.A NE2 LYS 203.A O no hydrogen 2.848 N/A ALA 160.A N THR 157.A O no hydrogen 2.974 N/A GLN 161.A N GLN 158.A O no hydrogen 3.006 N/A ASN 163.A N ILE 159.A O no hydrogen 3.286 N/A ASN 163.A N ALA 160.A O no hydrogen 3.125 N/A ASN 163.A ND2 ILE 159.A O no hydrogen 3.190 N/A GLY 164.A N GLN 161.A O no hydrogen 3.154 N/A ALA 165.A N ALA 160.A O no hydrogen 2.974 N/A GLN 166.A N THR 99.A O no hydrogen 2.961 N/A TYR 167.A N THR 99.A O no hydrogen 3.340 N/A ILE 168.A N PHE 200.A O no hydrogen 3.000 N/A ILE 169.A N LEU 101.A O no hydrogen 2.860 N/A GLY 170.A N LYS 198.A O no hydrogen 2.928 N/A VAL 172.A N GLU 197.A O no hydrogen 2.987 N/A ILE 173.A N GLU 106.A O no hydrogen 2.654 N/A THR 174.A N ALA 195.A O no hydrogen 2.927 N/A LEU 176.A N GLN 112.A OE1 no hydrogen 2.905 N/A THR 177.A N ASP 175.A OD1 no hydrogen 2.813 N/A THR 177.A OG1 ASP 175.A OD1 no hydrogen 2.595 N/A THR 179.A N ASN 191.A O no hydrogen 3.129 N/A GLU 181.A N ILE 189.A O no hydrogen 2.686 N/A GLN 183.A N ASP 188.A OD1 no hydrogen 2.834 N/A LEU 184.A N ASP 188.A OD2 no hydrogen 2.753 N/A LEU 185.A N ASP 188.A OD2 no hydrogen 2.692 N/A ASP 187.A N SER 182.A OG no hydrogen 2.718 N/A ASP 188.A N LEU 185.A O no hydrogen 3.243 N/A ILE 189.A N GLU 181.A O no hydrogen 3.102 N/A ASN 191.A N THR 179.A O no hydrogen 3.154 N/A ARG 192.A N ALA 217.A O no hydrogen 2.840 N/A ARG 192.A NE LEU 176.A O no hydrogen 2.793 N/A ARG 192.A NH2 GLN 112.A O no hydrogen 2.833 N/A GLN 193.A N THR 177.A O no hydrogen 2.835 N/A PHE 194.A N GLU 215.A O no hydrogen 2.992 N/A ALA 195.A N ASP 175.A O no hydrogen 3.105 N/A LEU 196.A N TYR 213.A O no hydrogen 2.701 N/A GLU 197.A N VAL 172.A O no hydrogen 3.005 N/A VAL 199.A N PHE 209.A O no hydrogen 3.021 N/A PHE 200.A N ILE 168.A O no hydrogen 2.843 N/A ASP 201.A N HIS 206.A O no hydrogen 2.938 N/A GLY 202.A N GLN 166.A O no hydrogen 2.921 N/A LYS 203.A N ASP 201.A OD1 no hydrogen 2.587 N/A THR 204.A N ASP 201.A OD1 no hydrogen 3.147 N/A GLY 205.A N ASP 201.A O no hydrogen 2.723 N/A HIS 206.A N THR 204.A OG1 no hydrogen 3.178 N/A VAL 208.A N VAL 199.A O no hydrogen 2.704 N/A ASN 210.A ND2 GLU 207.A OE1 no hydrogen 2.509 N/A LYS 211.A NZ ASP 250.A OD1 no hydrogen 3.054 N/A LYS 211.A NZ ASP 250.A OD2 no hydrogen 2.971 N/A TYR 213.A N LEU 196.A O no hydrogen 2.733 N/A TYR 213.A OH ASP 250.A OD2 no hydrogen 2.568 N/A ARG 214.A NH1 ASP 175.A OD2 no hydrogen 3.088 N/A ARG 214.A NH1 GLN 193.A OE1 no hydrogen 2.946 N/A ARG 214.A NH2 ASP 175.A OD2 no hydrogen 3.516 N/A GLU 215.A N PHE 194.A O no hydrogen 2.965 N/A ALA 217.A N ARG 192.A O no hydrogen 3.090 N/A ARG 218.A NH1 ASN 191.A OD1 no hydrogen 3.566 N/A TRP 219.A N ILE 190.A O no hydrogen 2.717 N/A SER 225.A N ALA 222.A O no hydrogen 3.077 N/A GLN 226.A NE2 GLN 116.A OE1 no hydrogen 3.401 N/A VAL 227.A N GLY 115.A O no hydrogen 2.994 N/A THR 229.A OG1 ASP 123.A OD2 no hydrogen 2.347 N/A ARG 230.A N ASP 228.A OD1 no hydrogen 2.752 N/A SER 231.A N ASP 228.A O no hydrogen 3.102 N/A SER 231.A OG ASP 228.A O no hydrogen 2.688 N/A PHE 234.A N SER 231.A OG no hydrogen 3.392 N/A TRP 235.A N SER 231.A O no hydrogen 3.434 N/A TRP 235.A NE1 THR 229.A O no hydrogen 2.805 N/A ALA 236.A N ALA 232.A O no hydrogen 3.091 N/A ALA 236.A N ARG 233.A O no hydrogen 3.358 N/A SER 237.A N PHE 234.A O no hydrogen 3.059 N/A SER 237.A OG PHE 234.A O no hydrogen 2.577 N/A THR 238.A OG1 ARG 218.A O no hydrogen 2.796 N/A TYR 239.A OH GLN 193.A O no hydrogen 2.653 N/A GLY 240.A N SER 237.A OG no hydrogen 3.094 N/A GLU 241.A N SER 237.A O no hydrogen 2.757 N/A ARG 243.A N GLU 241.A O no hydrogen 2.964 N/A SER 245.A OG GLN 131.A OE1 no hydrogen 2.937 N/A ARG 246.A N LEU 242.A O no hydrogen 3.111 N/A ASN 247.A N ARG 243.A O no hydrogen 2.986 N/A ILE 248.A N VAL 244.A O no hydrogen 2.827 N/A ASP 250.A N ASN 247.A O no hydrogen 2.848 N/A LEU 251.A N ILE 248.A O no hydrogen 2.908 N/A SER 253.A N LEU 249.A O no hydrogen 2.970 N/A GLU 254.A N ASP 250.A O no hydrogen 2.981 N/A LEU 255.A N LEU 251.A O no hydrogen 2.738 N/A SER 256.A N GLU 252.A O no hydrogen 2.886 N/A SER 256.A OG GLU 252.A O no hydrogen 2.700 N/A LYS 258.A N LEU 255.A O no hydrogen 2.935 N/A THR 260.A N GLN 95.A OE1 no hydrogen 3.020 N/A THR 260.A OG1 TYR 96.A O no hydrogen 2.732 N/A VAL 264.A N ASP 339.A O no hydrogen 2.903 N/A VAL 265.A N THR 273.A O no hydrogen 2.830 N/A PHE 268.A N THR 271.A O no hydrogen 2.821 N/A ASN 270.A ND2 ILE 326.A O no hydrogen 3.130 N/A THR 271.A N PHE 268.A O no hydrogen 2.931 N/A VAL 272.A N LEU 324.A O no hydrogen 2.790 N/A THR 273.A N ALA 266.A O no hydrogen 2.819 N/A GLY 276.A N HIS 278.A ND1 no hydrogen 2.982 N/A ARG 277.A N TYR 318.A O no hydrogen 2.740 N/A ARG 277.A NE GLU 319.A OE1 no hydrogen 2.659 N/A ARG 277.A NH2 GLU 319.A OE1 no hydrogen 2.956 N/A HIS 278.A NE2 THR 99.A OG1 no hydrogen 2.664 N/A GLY 279.A N ARG 277.A O no hydrogen 2.977 N/A VAL 280.A N GLY 276.A O no hydrogen 3.172 N/A LYS 281.A N ASP 284.A OD2 no hydrogen 2.998 N/A LYS 281.A NZ GLY 279.A O no hydrogen 3.222 N/A ASP 284.A N LYS 281.A O no hydrogen 2.883 N/A LEU 286.A N LEU 312.A O no hydrogen 2.808 N/A GLN 287.A N ASN 341.A O no hydrogen 2.854 N/A GLN 287.A NE2 LEU 288.A O no hydrogen 3.010 N/A GLN 287.A NE2 SER 308.A O no hydrogen 2.768 N/A LEU 288.A N ILE 310.A O no hydrogen 3.245 N/A TRP 289.A N VAL 340.A O no hydrogen 2.811 N/A TRP 289.A NE1 ASN 341.A OD1 no hydrogen 2.952 N/A HIS 290.A N SER 306.A O no hydrogen 2.816 N/A ALA 292.A N LYS 304.A O no hydrogen 2.862 N/A SER 293.A OG ARG 302.A O no hydrogen 3.440 N/A PHE 294.A N ARG 302.A O no hydrogen 2.822 N/A ASP 296.A N LEU 300.A O no hydrogen 3.466 N/A ASN 298.A N ASP 296.A OD2 no hydrogen 2.755 N/A GLY 299.A N ASP 296.A O no hydrogen 3.227 N/A GLY 299.A N ASP 296.A OD2 no hydrogen 3.012 N/A ARG 302.A N PHE 294.A O no hydrogen 2.694 N/A LYS 304.A N ALA 292.A O no hydrogen 2.669 N/A LYS 304.A NZ GLU 4.A OE1 no hydrogen 2.621 N/A VAL 305.A N TRP 2.A O no hydrogen 2.976 N/A SER 306.A N HIS 290.A O no hydrogen 2.684 N/A SER 306.A OG GLU 4.A OE2 no hydrogen 2.935 N/A GLN 307.A N GLU 4.A O no hydrogen 2.882 N/A GLN 307.A NE2 THR 6.A OG1 no hydrogen 3.000 N/A GLN 307.A NE2 SER 308.A O no hydrogen 2.988 N/A SER 308.A N LEU 288.A O no hydrogen 3.083 N/A ILE 310.A N SER 308.A OG no hydrogen 2.936 N/A THR 311.A N GLN 328.A OE1 no hydrogen 3.052 N/A THR 311.A OG1 ASP 327.A OD2 no hydrogen 2.756 N/A LEU 312.A N LEU 286.A O no hydrogen 2.725 N/A THR 313.A N THR 325.A O no hydrogen 3.016 N/A THR 313.A OG1 ASP 327.A OD1 no hydrogen 2.918 N/A VAL 314.A N ASP 284.A O no hydrogen 2.902 N/A SER 315.A N GLU 323.A O no hydrogen 2.843 N/A SER 315.A OG GLU 323.A O no hydrogen 3.078 N/A ARG 316.A N GLU 323.A O no hydrogen 3.343 N/A ARG 316.A NH1 SER 315.A O no hydrogen 3.070 N/A TYR 318.A N GLU 321.A O no hydrogen 2.872 N/A TYR 318.A OH GLU 323.A OE1 no hydrogen 2.756 N/A GLU 323.A N ARG 316.A O no hydrogen 2.904 N/A LEU 324.A N VAL 272.A O no hydrogen 2.718 N/A THR 325.A N THR 313.A O no hydrogen 2.777 N/A THR 325.A OG1 THR 313.A O no hydrogen 3.412 N/A ILE 326.A N ASN 270.A O no hydrogen 3.000 N/A ASP 327.A N THR 311.A O no hydrogen 2.905 N/A GLN 328.A NE2 THR 311.A OG1 no hydrogen 2.959 N/A LEU 331.A N GLN 328.A O no hydrogen 2.779 N/A ALA 332.A N PRO 329.A O no hydrogen 3.086 N/A SER 334.A N LEU 331.A O no hydrogen 2.771 N/A SER 334.A OG LEU 331.A O no hydrogen 2.607 N/A VAL 335.A N ALA 332.A O no hydrogen 3.155 N/A GLN 336.A N ASP 339.A OD2 no hydrogen 2.780 N/A GLY 338.A N VAL 264.A O no hydrogen 2.984 N/A ASP 339.A N GLN 336.A O no hydrogen 3.062 N/A ILE 343.A N LYS 285.A O no hydrogen 2.957 N/A HIS 346.A N HIS 346.A ND1 no hydrogen 2.785 N/A