Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3htt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 10.A N ASN 320.A OD1 no hydrogen 3.009 N/A ASN 10.A ND2 HIS 8.A NE2 no hydrogen 3.232 N/A ASN 10.A ND2 THR 27.A O no hydrogen 3.317 N/A SER 12.A N ASN 10.A OD1 no hydrogen 2.910 N/A SER 12.A OG VAL 26.A O no hydrogen 2.711 N/A SER 12.A OG THR 27.A O no hydrogen 3.477 N/A ASP 14.A N SER 12.A OG no hydrogen 3.375 N/A VAL 16.A N VAL 24.A O no hydrogen 2.975 N/A THR 18.A N GLU 21.A O no hydrogen 2.830 N/A THR 18.A OG1 GLU 21.A O no hydrogen 2.935 N/A GLU 21.A N THR 18.A OG1 no hydrogen 2.775 N/A ASN 23.A N ASP 17.A OD1 no hydrogen 3.191 N/A VAL 24.A N VAL 16.A O no hydrogen 2.774 N/A VAL 26.A N ASP 14.A O no hydrogen 2.994 N/A THR 27.A N LEU 318.A O no hydrogen 2.838 N/A SER 29.A OG ASP 14.A OD1 no hydrogen 3.089 N/A VAL 30.A N MET 314.A O no hydrogen 2.788 N/A ASN 31.A ND2 LEU 312.A O no hydrogen 3.020 N/A LEU 32.A N LEU 312.A O no hydrogen 3.095 N/A GLU 34.A N PHE 292.A O no hydrogen 2.838 N/A ASN 36.A N GLU 34.A OE1 no hydrogen 3.134 N/A ASN 38.A N ALA 285.A O no hydrogen 3.420 N/A ASN 38.A ND2 LYS 40.A O no hydrogen 3.210 N/A GLY 39.A N HIS 37.A ND1 no hydrogen 2.910 N/A LEU 41.A N PRO 271.A O no hydrogen 2.828 N/A CYS 42.A N GLN 280.A OE1 no hydrogen 2.701 N/A CYS 42.A SG ASN 38.A OD1 no hydrogen 3.341 N/A LYS 43.A N CYS 275.A O no hydrogen 2.732 N/A LYS 43.A NZ ASN 274.A OD1 no hydrogen 3.096 N/A ASN 45.A N THR 277.A O no hydrogen 2.838 N/A GLY 46.A N ASP 276.A OD2 no hydrogen 2.531 N/A LEU 50.A N TYR 78.A O no hydrogen 2.936 N/A LEU 52.A N ILE 80.A O no hydrogen 3.220 N/A LYS 54.A NZ GLU 66.A OE2 no hydrogen 3.388 N/A CYS 55.A N LEU 52.A O no hydrogen 3.028 N/A CYS 55.A SG ASN 87.A O no hydrogen 3.838 N/A ASN 56.A N ASN 87.A O no hydrogen 3.301 N/A VAL 57.A N GLU 81.A OE1 no hydrogen 3.007 N/A ALA 58.A N TYR 98.A OH no hydrogen 2.742 N/A GLY 59.A N ASN 56.A OD1 no hydrogen 2.870 N/A TRP 60.A N ASN 56.A O no hydrogen 3.049 N/A LEU 61.A N VAL 57.A O no hydrogen 2.953 N/A LEU 62.A N ALA 58.A O no hydrogen 2.934 N/A GLY 63.A N GLY 59.A O no hydrogen 3.064 N/A ASN 64.A N GLY 59.A O no hydrogen 2.910 N/A ASN 64.A ND2 ASN 87.A OD1 no hydrogen 2.785 N/A ASN 64.A ND2 GLY 88.A O no hydrogen 2.967 N/A GLU 66.A N ASN 64.A OD1 no hydrogen 2.617 N/A CYS 67.A N ASN 64.A O no hydrogen 2.859 N/A CYS 67.A SG ASN 64.A O no hydrogen 3.618 N/A CYS 67.A SG ASN 87.A O no hydrogen 3.930 N/A LEU 70.A N CYS 67.A O no hydrogen 2.808 N/A LEU 71.A N ASP 68.A O no hydrogen 3.465 N/A ALA 73.A N LEU 70.A O no hydrogen 3.408 N/A SER 75.A OG SER 109.A O no hydrogen 3.230 N/A TRP 76.A NE1 LEU 105.A O no hydrogen 3.299 N/A SER 77.A N ALA 48.A O no hydrogen 3.244 N/A SER 77.A OG ILE 47.A O no hydrogen 2.737 N/A TYR 78.A OH CYS 42.A O no hydrogen 2.846 N/A ILE 79.A N GLY 264.A O no hydrogen 3.176 N/A ILE 80.A N LEU 50.A O no hydrogen 2.788 N/A GLU 81.A N ILE 266.A O no hydrogen 2.857 N/A THR 82.A N SER 85.A OG no hydrogen 2.606 N/A SER 83.A N ASP 269.A OD1 no hydrogen 2.922 N/A SER 83.A OG ASP 269.A OD1 no hydrogen 2.968 N/A SER 83.A OG ASP 269.A OD2 no hydrogen 2.674 N/A SER 85.A N THR 82.A O no hydrogen 2.934 N/A SER 85.A OG GLY 53.A O no hydrogen 2.671 N/A SER 85.A OG CYS 55.A O no hydrogen 3.169 N/A SER 85.A OG THR 82.A O no hydrogen 3.214 N/A GLU 86.A N LYS 54.A O no hydrogen 2.857 N/A GLU 86.A N ASN 84.A O no hydrogen 3.039 N/A ASN 87.A N LYS 54.A O no hydrogen 2.940 N/A THR 89.A OG1 THR 89.A O no hydrogen 2.654 N/A CYS 90.A N GLY 88.A O no hydrogen 3.012 N/A TYR 91.A N TYR 145.A OH no hydrogen 3.106 N/A TYR 91.A OH HIS 180.A NE2 no hydrogen 3.154 N/A GLU 94.A N ASN 228.A OD1 no hydrogen 3.236 N/A ILE 96.A N TYR 229.A O no hydrogen 2.956 N/A TYR 98.A N PHE 95.A O no hydrogen 3.176 N/A LEU 101.A N ASP 97.A O no hydrogen 3.057 N/A ARG 102.A N TYR 98.A O no hydrogen 2.869 N/A ARG 102.A NH1 GLU 81.A OE1 no hydrogen 2.735 N/A ARG 102.A NH1 TYR 98.A OH no hydrogen 3.016 N/A ARG 102.A NH2 GLU 81.A OE1 no hydrogen 3.162 N/A ARG 102.A NH2 GLU 81.A OE2 no hydrogen 2.787 N/A GLU 103.A N GLU 99.A O no hydrogen 2.855 N/A GLN 104.A N GLU 100.A O no hydrogen 2.988 N/A LEU 105.A N LEU 101.A O no hydrogen 2.976 N/A SER 106.A N GLU 103.A O no hydrogen 3.285 N/A SER 106.A OG ARG 102.A O no hydrogen 3.013 N/A SER 106.A OG GLU 103.A O no hydrogen 2.790 N/A VAL 108.A N TRP 76.A O no hydrogen 3.517 N/A SER 109.A N ASN 258.A O no hydrogen 2.776 N/A GLU 112.A N ALA 256.A O no hydrogen 2.815 N/A ARG 113.A NH1 ASN 147.A OD1 no hydrogen 2.639 N/A PHE 114.A N ALA 254.A O no hydrogen 2.938 N/A PHE 117.A N TRP 252.A O no hydrogen 3.196 N/A LYS 119.A N GLU 115.A OE2 no hydrogen 3.317 N/A GLU 127.A N THR 152.A O no hydrogen 2.855 N/A THR 133.A N SER 143.A O no hydrogen 2.690 N/A ALA 135.A N THR 133.A OG1 no hydrogen 3.088 N/A SER 137.A OG ALA 134.A O no hydrogen 3.072 N/A ALA 141.A N TYR 138.A O no hydrogen 3.243 N/A SER 143.A N THR 133.A O no hydrogen 3.068 N/A TYR 145.A OH TYR 91.A O no hydrogen 3.405 N/A TYR 145.A OH TYR 229.A OH no hydrogen 2.568 N/A ARG 146.A N GLY 63.A O no hydrogen 2.789 N/A ARG 146.A NE ASP 68.A OD1 no hydrogen 2.736 N/A ARG 146.A NH2 ASP 68.A OD1 no hydrogen 3.443 N/A ASN 147.A N LEU 62.A O no hydrogen 3.162 N/A ASN 147.A ND2 LEU 61.A O no hydrogen 2.817 N/A LEU 149.A N ALA 250.A O no hydrogen 2.799 N/A TRP 150.A NE1 TYR 192.A OH no hydrogen 3.007 N/A THR 152.A N GLU 127.A O no hydrogen 2.773 N/A THR 152.A OG1 GLU 127.A O no hydrogen 3.337 N/A LYS 153.A N LEU 191.A O no hydrogen 2.922 N/A LYS 153.A NZ GLN 189.A O no hydrogen 2.542 N/A LYS 153.A NZ GLN 193.A OE1 no hydrogen 2.917 N/A LYS 154.A N SER 157.A O no hydrogen 3.218 N/A SER 157.A N LYS 154.A O no hydrogen 2.928 N/A SER 157.A OG LYS 154.A O no hydrogen 3.555 N/A LYS 160.A NZ TYR 198.A OH no hydrogen 3.401 N/A LEU 161.A N ALA 244.A O no hydrogen 2.983 N/A LYS 163.A N PHE 242.A O no hydrogen 2.741 N/A SER 164.A OG THR 241.A OG1 no hydrogen 2.914 N/A TYR 165.A N ILE 240.A O no hydrogen 2.878 N/A ASN 167.A N ASP 238.A O no hydrogen 2.927 N/A ASN 167.A ND2 LYS 171.A O no hydrogen 2.785 N/A ASN 167.A ND2 LEU 234.A O no hydrogen 2.598 N/A LYS 169.A N ASN 167.A OD1 no hydrogen 3.080 N/A LYS 171.A NZ SER 110.A OG no hydrogen 3.393 N/A LYS 171.A NZ GLU 112.A OE1 no hydrogen 3.186 N/A VAL 173.A N LEU 234.A O no hydrogen 3.141 N/A LEU 174.A N PHE 255.A O no hydrogen 2.688 N/A VAL 175.A N THR 232.A O no hydrogen 2.992 N/A TRP 177.A N TYR 230.A O no hydrogen 2.987 N/A GLY 178.A N ILE 249.A O no hydrogen 3.003 N/A VAL 179.A N ASN 228.A O no hydrogen 3.018 N/A HIS 180.A N ASN 247.A O no hydrogen 2.769 N/A HIS 180.A NE2 TYR 91.A OH no hydrogen 3.154 N/A HIS 181.A N ARG 226.A O no hydrogen 2.660 N/A GLU 187.A N THR 184.A O no hydrogen 3.036 N/A GLU 187.A N THR 184.A OG1 no hydrogen 3.160 N/A GLN 188.A N THR 184.A O no hydrogen 3.233 N/A GLN 188.A NE2 ASN 247.A OD1 no hydrogen 2.644 N/A GLN 189.A NE2 SER 186.A O no hydrogen 3.072 N/A THR 190.A N SER 186.A O no hydrogen 3.353 N/A LEU 191.A N GLU 187.A O no hydrogen 3.006 N/A TYR 192.A N GLN 188.A O no hydrogen 3.148 N/A TYR 192.A OH HIS 180.A ND1 no hydrogen 2.935 N/A GLN 193.A N GLN 189.A O no hydrogen 2.870 N/A ALA 197.A N ASN 194.A O no hydrogen 3.321 N/A TYR 198.A N THR 245.A OG1 no hydrogen 3.031 N/A VAL 199.A N PHE 210.A O no hydrogen 2.808 N/A SER 200.A N GLU 243.A O no hydrogen 3.002 N/A SER 200.A OG GLU 243.A O no hydrogen 3.316 N/A SER 200.A OG GLU 243.A OE1 no hydrogen 3.186 N/A GLY 202.A N THR 241.A O no hydrogen 2.745 N/A SER 203.A N TYR 206.A O no hydrogen 3.195 N/A SER 203.A OG ASP 238.A OD1 no hydrogen 2.846 N/A SER 204.A N ASP 238.A OD1 no hydrogen 3.179 N/A SER 204.A OG ASP 238.A OD1 no hydrogen 2.478 N/A LYS 205.A N SER 203.A OG no hydrogen 3.132 N/A LYS 205.A NZ LEU 233.A O no hydrogen 2.620 N/A TYR 206.A N SER 203.A O no hydrogen 3.352 N/A PHE 210.A N VAL 199.A O no hydrogen 2.600 N/A GLU 213.A N HIS 181.A ND1 no hydrogen 2.756 N/A ARG 217.A NH1 HIS 181.A O no hydrogen 3.021 N/A ARG 217.A NH1 ALA 224.A O no hydrogen 2.901 N/A ARG 217.A NH2 PRO 182.A O no hydrogen 3.065 N/A VAL 220.A N GLN 223.A O no hydrogen 2.779 N/A ARG 221.A NH1 CYS 90.A O no hydrogen 2.728 N/A ARG 221.A NH1 ALA 135.A O no hydrogen 2.635 N/A ARG 226.A N HIS 181.A O no hydrogen 3.000 N/A ARG 226.A NH1 PRO 218.A O no hydrogen 2.885 N/A ARG 226.A NH1 GLY 225.A O no hydrogen 3.440 N/A ARG 226.A NH2 PRO 218.A O no hydrogen 2.648 N/A MET 227.A N PRO 92.A O no hydrogen 2.795 N/A ASN 228.A N VAL 179.A O no hydrogen 3.109 N/A TYR 229.A N GLU 94.A O no hydrogen 2.972 N/A TYR 229.A OH TYR 91.A O no hydrogen 2.630 N/A TYR 230.A N TRP 177.A O no hydrogen 2.629 N/A THR 232.A N VAL 175.A O no hydrogen 3.262 N/A LEU 234.A N VAL 173.A O no hydrogen 2.825 N/A GLY 237.A N ASN 167.A O no hydrogen 2.766 N/A ASP 238.A N ASP 235.A O no hydrogen 2.888 N/A THR 239.A N ASP 238.A OD2 no hydrogen 2.715 N/A ILE 240.A N TYR 165.A O no hydrogen 2.873 N/A THR 241.A N GLY 202.A O no hydrogen 2.623 N/A THR 241.A OG1 SER 164.A OG no hydrogen 2.914 N/A PHE 242.A N LYS 163.A O no hydrogen 2.688 N/A GLU 243.A N SER 200.A O no hydrogen 3.328 N/A ALA 244.A N LEU 161.A O no hydrogen 3.022 N/A THR 245.A N TYR 198.A O no hydrogen 3.018 N/A ASN 247.A ND2 GLN 188.A OE1 no hydrogen 2.722 N/A ILE 249.A N GLY 178.A O no hydrogen 2.857 N/A TRP 252.A N ASN 147.A O no hydrogen 2.731 N/A TRP 252.A NE1 GLU 115.A OE2 no hydrogen 2.987 N/A TYR 253.A N ASN 147.A O no hydrogen 2.945 N/A ALA 254.A N PHE 114.A O no hydrogen 2.862 N/A PHE 255.A N LEU 174.A O no hydrogen 3.103 N/A ALA 256.A N GLU 112.A O no hydrogen 2.655 N/A LEU 257.A N GLU 172.A O no hydrogen 3.009 N/A ASN 258.A N SER 110.A O no hydrogen 2.779 N/A SER 263.A OG SER 77.A O no hydrogen 2.581 N/A SER 263.A OG SER 106.A O no hydrogen 3.262 N/A ILE 266.A N ILE 79.A O no hydrogen 2.695 N/A SER 268.A N GLU 81.A O no hydrogen 2.946 N/A SER 268.A OG PRO 282.A O no hydrogen 3.060 N/A ALA 270.A N SER 268.A OG no hydrogen 3.254 N/A CYS 275.A SG HIS 273.A O no hydrogen 3.493 N/A THR 277.A OG1 CYS 279.A O no hydrogen 2.754 N/A GLN 280.A N ILE 300.A O no hydrogen 3.002 N/A GLN 280.A NE2 LYS 40.A O no hydrogen 3.385 N/A GLN 280.A NE2 THR 281.A O no hydrogen 2.661 N/A THR 281.A N GLY 284.A O no hydrogen 3.084 N/A THR 281.A OG1 GLY 284.A O no hydrogen 2.586 N/A GLY 284.A N THR 281.A O no hydrogen 3.267 N/A GLY 284.A N THR 281.A OG1 no hydrogen 3.189 N/A ILE 286.A N CYS 279.A O no hydrogen 3.187 N/A SER 288.A OG GLU 302.A O no hydrogen 2.896 N/A GLN 293.A N LYS 305.A O no hydrogen 3.143 N/A GLN 293.A NE2 PRO 304.A O no hydrogen 2.920 N/A ASN 294.A N GLU 34.A O no hydrogen 3.387 N/A ASN 294.A ND2 SER 309.A O no hydrogen 2.898 N/A HIS 296.A N GLN 293.A OE1 no hydrogen 2.648 N/A ILE 300.A N GLN 280.A O no hydrogen 2.959 N/A GLU 302.A N LYS 278.A O no hydrogen 3.194 N/A CYS 303.A SG THR 299.A OG1 no hydrogen 3.098 N/A VAL 307.A N GLN 293.A O no hydrogen 2.795 N/A LYS 311.A NZ THR 15.A O no hydrogen 3.127 N/A LYS 311.A NZ THR 15.A OG1 no hydrogen 3.034 N/A ARG 313.A NH1 SER 29.A OG no hydrogen 2.787 N/A MET 314.A N VAL 30.A O no hydrogen 2.759 N/A THR 316.A N HIS 28.A O no hydrogen 2.909 N/A THR 316.A OG1 HIS 28.A O no hydrogen 2.604 N/A GLY 317.A N HIS 28.A O no hydrogen 2.713 N/A ASN 320.A N THR 25.A O no hydrogen 2.923 N/A ASN 320.A ND2 ASN 10.A O no hydrogen 2.914 N/A ASN 320.A ND2 SER 12.A O no hydrogen 3.032 N/A THR 129A.A N GLU 127.A OE1 no hydrogen 2.961 N/A