Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6twi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 9.A ND1 HIS 10.A O no hydrogen 3.238 N/A VAL 12.A N ASN 317.A OD1 no hydrogen 2.919 N/A THR 16.A N VAL 28.A O no hydrogen 2.871 N/A VAL 18.A N GLU 26.A O no hydrogen 2.775 N/A THR 20.A N ASN 23.A O no hydrogen 2.871 N/A THR 20.A OG1 ASN 23.A O no hydrogen 3.238 N/A THR 22.A N THR 20.A OG1 no hydrogen 3.298 N/A ASN 23.A N THR 20.A OG1 no hydrogen 2.890 N/A ASN 23.A ND2 GLU 26.A OE1 no hydrogen 2.934 N/A GLN 25.A N ASN 23.A OD1 no hydrogen 3.050 N/A GLU 26.A N VAL 18.A O no hydrogen 3.073 N/A VAL 28.A N THR 16.A O no hydrogen 2.833 N/A THR 29.A N MET 315.A O no hydrogen 2.965 N/A THR 29.A OG1 MET 315.A O no hydrogen 3.569 N/A THR 32.A N LEU 311.A O no hydrogen 2.800 N/A THR 34.A N GLU 33.A OE2 no hydrogen 3.288 N/A THR 34.A N LEU 309.A O no hydrogen 3.096 N/A THR 34.A OG1 LEU 309.A O no hydrogen 2.740 N/A VAL 35.A N GLU 33.A OE2 no hydrogen 3.085 N/A GLU 36.A N PHE 289.A O no hydrogen 2.840 N/A THR 38.A N GLU 36.A OE2 no hydrogen 3.006 N/A THR 38.A OG1 GLU 36.A OE2 no hydrogen 2.700 N/A SER 39.A OG LEU 40.A O no hydrogen 3.287 N/A SER 39.A OG SER 282.A O no hydrogen 2.726 N/A LEU 40.A N SER 282.A O no hydrogen 3.104 N/A ARG 42.A NH2 ASP 269.A OD2 no hydrogen 2.686 N/A LEU 43.A N PRO 267.A O no hydrogen 2.869 N/A CYS 44.A N SER 282.A OG no hydrogen 2.994 N/A CYS 44.A SG ARG 42.A O no hydrogen 3.905 N/A CYS 44.A SG SER 282.A OG no hydrogen 3.512 N/A MET 45.A N ASP 269.A O no hydrogen 2.927 N/A LYS 46.A N CYS 272.A O no hydrogen 3.038 N/A ARG 48.A NE SER 274.A O no hydrogen 3.441 N/A ARG 48.A NH1 THR 78.A OG1 no hydrogen 3.237 N/A ARG 48.A NH2 SER 274.A O no hydrogen 3.022 N/A ASN 49.A N ASP 77.A OD2 no hydrogen 2.841 N/A ASN 49.A ND2 THR 75.A O no hydrogen 3.023 N/A LYS 51.A N THR 78.A O no hydrogen 3.034 N/A LYS 51.A NZ HIS 71.A ND1 no hydrogen 3.115 N/A LEU 53.A N ILE 80.A O no hydrogen 3.093 N/A GLY 54.A N ASP 52.A OD1 no hydrogen 3.306 N/A CYS 56.A N LEU 53.A O no hydrogen 3.173 N/A CYS 56.A SG HIS 57.A O no hydrogen 3.361 N/A HIS 57.A N ILE 86.A O no hydrogen 3.132 N/A ILE 59.A N HIS 57.A ND1 no hydrogen 3.389 N/A MET 61.A N PRO 58.A O no hydrogen 3.157 N/A LEU 62.A N ILE 59.A O no hydrogen 3.085 N/A ILE 63.A N ILE 59.A O no hydrogen 3.412 N/A GLY 64.A N GLY 60.A O no hydrogen 2.859 N/A THR 65.A N GLY 60.A O no hydrogen 3.113 N/A THR 65.A OG1 ALA 87.A O no hydrogen 2.573 N/A CYS 68.A N THR 65.A O no hydrogen 2.831 N/A CYS 68.A SG HIS 57.A O no hydrogen 3.585 N/A ASP 69.A N PRO 66.A O no hydrogen 3.316 N/A HIS 71.A N CYS 68.A O no hydrogen 2.928 N/A GLY 74.A N ILE 110.A O no hydrogen 3.198 N/A TRP 76.A N GLY 108.A O no hydrogen 3.136 N/A ASP 77.A N ASN 49.A O no hydrogen 2.766 N/A THR 78.A OG1 ASP 77.A OD1 no hydrogen 2.699 N/A LEU 79.A N LEU 260.A O no hydrogen 3.147 N/A ILE 80.A N LYS 51.A O no hydrogen 2.885 N/A GLU 81.A N ILE 262.A O no hydrogen 2.769 N/A ARG 82.A NE ASP 52.A OD1 no hydrogen 2.986 N/A ARG 82.A NH1 SER 264.A O no hydrogen 2.935 N/A ARG 82.A NH1 ALA 266.A O no hydrogen 2.732 N/A ARG 82.A NH2 ASP 52.A OD2 no hydrogen 3.186 N/A ARG 82.A NH2 ALA 266.A O no hydrogen 2.924 N/A LYS 83.A NZ GLU 265.A OE1 no hydrogen 2.751 N/A ILE 86.A N ASN 55.A O no hydrogen 2.790 N/A TYR 88.A OH THR 94.A OG1 no hydrogen 2.678 N/A TYR 88.A OH GLU 97.A OE2 no hydrogen 2.696 N/A TYR 90.A N TYR 141.A OH no hydrogen 3.127 N/A TYR 90.A OH SER 223.A OG no hydrogen 2.525 N/A THR 94.A N TYR 88.A OH no hydrogen 3.301 N/A THR 94.A N GLU 97.A OE2 no hydrogen 3.409 N/A THR 94.A OG1 TYR 88.A OH no hydrogen 2.678 N/A VAL 95.A N PHE 227.A O no hydrogen 2.922 N/A ARG 101.A N GLU 97.A O no hydrogen 3.121 N/A ARG 101.A NE GLU 98.A OE1 no hydrogen 3.205 N/A ARG 101.A NH1 GLU 81.A OE1 no hydrogen 2.733 N/A ARG 101.A NH2 GLU 98.A OE1 no hydrogen 2.716 N/A GLN 102.A N GLU 98.A O no hydrogen 2.986 N/A GLN 102.A NE2 GLU 98.A OE1 no hydrogen 3.536 N/A LYS 103.A N ALA 99.A O no hydrogen 3.021 N/A ILE 104.A N LEU 100.A O no hydrogen 3.144 N/A MET 105.A N ARG 101.A O no hydrogen 2.908 N/A GLU 106.A N GLN 102.A O no hydrogen 2.939 N/A SER 107.A N ILE 104.A O no hydrogen 3.129 N/A SER 107.A OG ILE 104.A O no hydrogen 2.673 N/A GLY 108.A N ILE 256.A O no hydrogen 2.736 N/A ILE 110.A N GLY 74.A O no hydrogen 2.862 N/A SER 111.A N LYS 254.A O no hydrogen 3.013 N/A LYS 112.A NZ MET 61.A O no hydrogen 2.870 N/A LYS 112.A NZ LEU 72.A O no hydrogen 2.837 N/A LYS 112.A NZ GLU 143.A OE2 no hydrogen 2.647 N/A ILE 113.A N VAL 252.A O no hydrogen 2.959 N/A THR 115.A N SER 250.A O no hydrogen 2.872 N/A THR 115.A OG1 PRO 249.A O no hydrogen 2.819 N/A THR 115.A OG1 SER 250.A O no hydrogen 2.943 N/A ILE 123.A N GLY 120.A O no hydrogen 3.156 N/A ASN 124.A N VAL 148.A O no hydrogen 2.668 N/A ALA 126.A N ASN 124.A OD1 no hydrogen 3.506 N/A GLY 127.A N TRP 146.A O no hydrogen 3.319 N/A THR 129.A N SER 139.A O no hydrogen 2.925 N/A ARG 134.A N GLY 137.A O no hydrogen 3.021 N/A ARG 134.A NE ASP 69.A OD2 no hydrogen 2.950 N/A ARG 134.A NH1 SER 139.A OG no hydrogen 2.803 N/A ARG 134.A NH1 PHE 140.A O no hydrogen 3.030 N/A ARG 134.A NH2 GLY 64.A O no hydrogen 3.480 N/A ARG 134.A NH2 ASP 69.A OD1 no hydrogen 2.955 N/A GLY 137.A N ARG 134.A O no hydrogen 3.268 N/A SER 139.A N THR 129.A O no hydrogen 3.455 N/A ALA 142.A N GLY 64.A O no hydrogen 2.806 N/A GLU 143.A N ILE 63.A O no hydrogen 3.099 N/A LEU 144.A N TYR 141.A O no hydrogen 3.129 N/A LYS 145.A N ALA 248.A O no hydrogen 2.818 N/A TRP 146.A NE1 TYR 190.A OH no hydrogen 3.022 N/A VAL 148.A N ASN 124.A O no hydrogen 2.948 N/A SER 149.A N LEU 189.A O no hydrogen 2.821 N/A SER 149.A OG GLN 154.A O no hydrogen 3.001 N/A SER 149.A OG LEU 189.A O no hydrogen 3.013 N/A LYS 150.A N SER 122.A O no hydrogen 2.740 N/A LYS 150.A NZ SER 121.A O no hydrogen 2.962 N/A ASN 151.A ND2 GLN 154.A OE1 no hydrogen 2.769 N/A GLY 153.A N ASP 188.A O no hydrogen 3.068 N/A GLN 154.A N ASN 151.A O no hydrogen 3.326 N/A PHE 156.A N TYR 190.A O no hydrogen 2.796 N/A GLN 158.A NE2 SER 241.A OG no hydrogen 2.904 N/A THR 159.A N HIS 242.A O no hydrogen 2.941 N/A THR 159.A OG1 PRO 157.A O no hydrogen 3.066 N/A THR 160.A OG1 SER 241.A OG no hydrogen 3.192 N/A ASN 161.A N PHE 240.A O no hydrogen 2.801 N/A ASN 161.A ND2 THR 118.A O no hydrogen 3.313 N/A THR 162.A OG1 THR 239.A OG1 no hydrogen 3.019 N/A TYR 163.A N ILE 238.A O no hydrogen 2.932 N/A TYR 163.A OH HIS 171.A ND1 no hydrogen 2.650 N/A ASN 165.A N ASP 236.A O no hydrogen 3.107 N/A ASN 165.A ND2 ALA 169.A O no hydrogen 3.123 N/A ASN 165.A ND2 VAL 232.A O no hydrogen 2.791 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 2.973 N/A THR 168.A OG1 ASP 167.A OD1 no hydrogen 3.423 N/A ALA 169.A N ASP 167.A OD1 no hydrogen 3.369 N/A HIS 171.A N VAL 232.A O no hydrogen 3.050 N/A HIS 171.A ND1 TYR 163.A OH no hydrogen 2.650 N/A LEU 172.A N SER 253.A O no hydrogen 2.676 N/A ILE 173.A N THR 230.A O no hydrogen 3.167 N/A TRP 175.A N HIS 228.A O no hydrogen 3.121 N/A GLY 176.A N ILE 247.A O no hydrogen 2.973 N/A ILE 177.A N ASP 226.A O no hydrogen 2.862 N/A HIS 178.A N GLY 245.A O no hydrogen 2.901 N/A HIS 179.A N ARG 224.A O no hydrogen 2.875 N/A SER 181.A N GLU 185.A OE2 no hydrogen 3.148 N/A SER 181.A OG GLU 185.A OE1 no hydrogen 2.790 N/A GLN 184.A NE2 GLN 184.A O no hydrogen 2.962 N/A GLN 184.A NE2 ASP 188.A OD1 no hydrogen 3.272 N/A GLU 185.A N SER 182.A OG no hydrogen 3.141 N/A LYS 186.A N SER 182.A O no hydrogen 3.321 N/A LYS 186.A NZ GLY 191.A O no hydrogen 2.957 N/A LYS 186.A NZ GLN 193.A O no hydrogen 2.684 N/A ASN 187.A N THR 183.A O no hydrogen 3.206 N/A ASP 188.A N GLN 184.A O no hydrogen 2.987 N/A LEU 189.A N GLU 185.A O no hydrogen 3.140 N/A TYR 190.A N LYS 186.A O no hydrogen 2.991 N/A TYR 190.A OH HIS 178.A ND1 no hydrogen 2.726 N/A GLY 191.A N LYS 186.A O no hydrogen 3.271 N/A GLN 193.A N ASN 155.A OD1 no hydrogen 3.179 N/A GLN 193.A NE2 PHE 156.A O no hydrogen 2.751 N/A GLN 193.A NE2 ASN 243.A O no hydrogen 2.765 N/A SER 196.A N ASN 243.A OD1 no hydrogen 2.965 N/A ILE 197.A N PHE 208.A O no hydrogen 2.748 N/A SER 198.A N SER 241.A O no hydrogen 2.825 N/A VAL 199.A N ASN 206.A O no hydrogen 2.977 N/A GLY 200.A N THR 239.A O no hydrogen 3.070 N/A SER 201.A N TYR 204.A O no hydrogen 2.678 N/A SER 201.A OG TYR 204.A O no hydrogen 3.291 N/A SER 202.A N ASP 236.A OD2 no hydrogen 3.234 N/A SER 202.A OG ASP 236.A OD1 no hydrogen 2.651 N/A ASN 206.A N VAL 199.A O no hydrogen 2.884 N/A ASN 207.A N ASN 206.A OD1 no hydrogen 2.829 N/A PHE 208.A N ILE 197.A O no hydrogen 2.695 N/A VAL 211.A N HIS 179.A ND1 no hydrogen 3.494 N/A ARG 215.A NH1 VAL 211.A O no hydrogen 3.530 N/A ARG 215.A NH2 HIS 179.A O no hydrogen 3.546 N/A ARG 215.A NH2 PRO 180.A O no hydrogen 3.551 N/A ARG 215.A NH2 SER 222.A O no hydrogen 3.378 N/A VAL 218.A N LEU 221.A O no hydrogen 3.194 N/A SER 223.A OG TYR 90.A OH no hydrogen 2.525 N/A ARG 224.A N HIS 179.A O no hydrogen 3.024 N/A ARG 224.A NH1 SER 223.A O no hydrogen 3.026 N/A ARG 224.A NH2 PRO 216.A O no hydrogen 2.919 N/A ILE 225.A N PRO 91.A O no hydrogen 2.879 N/A ASP 226.A N ILE 177.A O no hydrogen 3.269 N/A PHE 227.A N ALA 93.A O no hydrogen 2.974 N/A HIS 228.A N TRP 175.A O no hydrogen 2.895 N/A TRP 229.A NE1 ASN 96.A O no hydrogen 3.273 N/A THR 230.A N ILE 173.A O no hydrogen 3.287 N/A VAL 232.A N HIS 171.A O no hydrogen 2.746 N/A GLN 233.A NE2 GLU 170.A OE1 no hydrogen 2.675 N/A GLY 235.A N ASN 165.A O no hydrogen 2.948 N/A ASP 236.A N GLN 233.A O no hydrogen 3.159 N/A ILE 238.A N TYR 163.A O no hydrogen 2.882 N/A THR 239.A N GLY 200.A O no hydrogen 2.827 N/A THR 239.A OG1 THR 162.A OG1 no hydrogen 3.019 N/A PHE 240.A N ASN 161.A O no hydrogen 2.681 N/A SER 241.A N SER 198.A O no hydrogen 2.934 N/A SER 241.A OG THR 160.A OG1 no hydrogen 3.192 N/A HIS 242.A N THR 159.A O no hydrogen 2.975 N/A HIS 242.A NE2 ASN 161.A OD1 no hydrogen 2.779 N/A ASN 243.A ND2 SER 194.A O no hydrogen 3.178 N/A ILE 247.A N GLY 176.A O no hydrogen 2.730 N/A ALA 248.A N LYS 145.A O no hydrogen 3.186 N/A SER 250.A N GLU 143.A O no hydrogen 2.995 N/A ARG 251.A N GLU 143.A O no hydrogen 3.482 N/A VAL 252.A N ILE 113.A O no hydrogen 2.759 N/A SER 253.A N LEU 172.A O no hydrogen 2.799 N/A LYS 254.A N SER 111.A O no hydrogen 2.913 N/A LYS 254.A NZ ASP 167.A OD2 no hydrogen 2.745 N/A ILE 256.A N GLY 109.A O no hydrogen 2.950 N/A ARG 258.A NH2 GLU 106.A O no hydrogen 3.291 N/A GLY 259.A N GLU 106.A O no hydrogen 2.949 N/A LEU 260.A N ASP 77.A O no hydrogen 2.862 N/A ILE 262.A N LEU 79.A O no hydrogen 2.861 N/A GLN 263.A NE2 GLU 81.A OE1 no hydrogen 3.232 N/A GLN 263.A NE2 GLU 81.A OE2 no hydrogen 3.018 N/A SER 264.A N GLU 81.A O no hydrogen 3.346 N/A SER 264.A OG TRP 278.A O no hydrogen 3.061 N/A SER 264.A OG ARG 279.A O no hydrogen 2.766 N/A GLU 265.A N ARG 279.A O no hydrogen 2.831 N/A ALA 266.A N SER 264.A OG no hydrogen 3.278 N/A ASP 269.A N LEU 43.A O no hydrogen 2.935 N/A SER 271.A N ASP 269.A OD1 no hydrogen 3.280 N/A SER 271.A OG ASP 269.A OD1 no hydrogen 2.735 N/A SER 271.A OG ASP 269.A OD2 no hydrogen 2.911 N/A CYS 272.A SG ASP 269.A OD2 no hydrogen 3.301 N/A SER 274.A OG CYS 276.A O no hydrogen 3.153 N/A SER 274.A OG ASN 284.A OD1 no hydrogen 2.817 N/A CYS 276.A N SER 274.A OG no hydrogen 3.316 N/A PHE 277.A N VAL 297.A O no hydrogen 3.032 N/A TRP 278.A N GLY 281.A O no hydrogen 2.926 N/A TRP 278.A NE1 SER 39.A OG no hydrogen 2.949 N/A ARG 279.A NE GLU 265.A OE2 no hydrogen 3.311 N/A GLY 281.A N TRP 278.A O no hydrogen 3.379 N/A SER 282.A N LEU 40.A O no hydrogen 3.080 N/A SER 282.A OG ARG 42.A O no hydrogen 2.659 N/A ILE 283.A N CYS 276.A O no hydrogen 3.017 N/A THR 285.A OG1 GLU 36.A OE1 no hydrogen 2.658 N/A LEU 287.A N THR 285.A OG1 no hydrogen 3.214 N/A PHE 289.A N THR 34.A O no hydrogen 3.293 N/A GLN 290.A N LYS 302.A O no hydrogen 3.093 N/A GLN 290.A NE2 SER 293.A O no hydrogen 2.944 N/A GLN 290.A NE2 PRO 301.A O no hydrogen 3.638 N/A ASN 291.A N GLU 36.A O no hydrogen 3.157 N/A ASN 291.A ND2 LYS 306.A O no hydrogen 2.965 N/A LEU 292.A N GLN 290.A OE1 no hydrogen 2.843 N/A SER 293.A N GLN 290.A OE1 no hydrogen 3.248 N/A SER 293.A OG ARG 295.A O no hydrogen 3.333 N/A ARG 295.A N SER 293.A OG no hydrogen 3.093 N/A VAL 297.A N PHE 277.A O no hydrogen 3.025 N/A GLN 299.A N LYS 275.A O no hydrogen 2.722 N/A CYS 300.A SG THR 296.A OG1 no hydrogen 3.563 N/A CYS 300.A SG VAL 297.A O no hydrogen 3.431 N/A LYS 302.A N PRO 288.A O no hydrogen 3.081 N/A VAL 304.A N GLN 290.A O no hydrogen 2.993 N/A SER 308.A OG GLU 33.A OE1 no hydrogen 2.690 N/A SER 308.A OG GLU 33.A OE2 no hydrogen 3.453 N/A LEU 309.A N GLU 33.A OE2 no hydrogen 2.884 N/A LEU 311.A N THR 32.A O no hydrogen 2.734 N/A THR 313.A N ASN 30.A O no hydrogen 2.958 N/A ARG 316.A NE GLU 26.A OE2 no hydrogen 2.742 N/A ARG 316.A NH2 GLU 26.A OE1 no hydrogen 3.431 N/A ASN 317.A N GLU 27.A O no hydrogen 3.135 N/A ASN 317.A ND2 VAL 12.A O no hydrogen 3.084 N/A ASN 317.A ND2 GLU 27.A OE2 no hydrogen 3.066 N/A