Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m6e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N ALA 3.A O no hydrogen 3.290 N/A GLN 7.A N PHE 4.A O no hydrogen 3.386 N/A LEU 8.A N GLY 5.A O no hydrogen 2.751 N/A LEU 9.A N GLU 6.A O no hydrogen 3.072 N/A LYS 10.A N GLN 7.A O no hydrogen 3.306 N/A LEU 13.A N ASN 11.A OD1 no hydrogen 2.777 N/A ILE 14.A N ASN 11.A OD1 no hydrogen 3.411 N/A GLU 15.A N ASN 11.A O no hydrogen 3.128 N/A PHE 16.A N PRO 12.A O no hydrogen 2.832 N/A CYS 17.A N LEU 13.A O no hydrogen 3.356 N/A ASP 18.A N ILE 14.A O no hydrogen 3.172 N/A SER 19.A N GLU 15.A O no hydrogen 3.219 N/A SER 19.A OG GLU 15.A O no hydrogen 3.431 N/A VAL 20.A N PHE 16.A O no hydrogen 3.029 N/A CYS 21.A N CYS 17.A O no hydrogen 2.639 N/A ARG 22.A N ASP 18.A O no hydrogen 2.984 N/A ARG 22.A NE ASP 18.A OD2 no hydrogen 2.794 N/A ARG 22.A NH1 ASN 31.A OD1 no hydrogen 2.842 N/A GLY 23.A N SER 19.A O no hydrogen 2.735 N/A CYS 24.A N VAL 20.A O no hydrogen 3.117 N/A CYS 24.A SG GLY 36.A O no hydrogen 3.640 N/A GLY 25.A N CYS 21.A O no hydrogen 3.354 N/A GLN 26.A N ARG 22.A O no hydrogen 2.867 N/A GLN 26.A NE2 ALA 77.A O no hydrogen 2.609 N/A VAL 27.A N CYS 24.A O no hydrogen 3.113 N/A MET 28.A N GLY 25.A O no hydrogen 3.009 N/A GLN 30.A N GLY 25.A O no hydrogen 3.038 N/A GLN 30.A NE2 MET 28.A O no hydrogen 2.816 N/A ASN 32.A ND2 ASN 206.A OD1 no hydrogen 2.980 N/A THR 33.A OG1 ASP 18.A OD1 no hydrogen 3.056 N/A VAL 34.A N ASN 32.A OD1 no hydrogen 2.878 N/A THR 35.A N ASN 32.A OD1 no hydrogen 3.128 N/A THR 35.A OG1 ALA 202.A O no hydrogen 3.097 N/A GLY 36.A N ASN 32.A O no hydrogen 3.128 N/A LEU 37.A N THR 33.A O no hydrogen 3.006 N/A LEU 38.A N VAL 34.A O no hydrogen 2.853 N/A PHE 39.A N THR 35.A O no hydrogen 2.758 N/A PHE 40.A N GLY 36.A O no hydrogen 2.790 N/A ALA 41.A N LEU 37.A O no hydrogen 2.838 N/A GLY 42.A N LEU 38.A O no hydrogen 2.916 N/A ILE 43.A N PHE 39.A O no hydrogen 3.010 N/A PHE 44.A N PHE 40.A O no hydrogen 2.829 N/A TYR 45.A N ALA 41.A O no hydrogen 2.804 N/A ASN 46.A N GLY 42.A O no hydrogen 3.322 N/A ASN 46.A ND2 GLN 190.A OE1 no hydrogen 2.850 N/A SER 47.A N ILE 43.A O no hydrogen 2.822 N/A THR 49.A N SER 47.A OG no hydrogen 3.398 N/A GLY 51.A N SER 47.A O no hydrogen 3.343 N/A VAL 52.A N THR 48.A O no hydrogen 3.124 N/A CYS 53.A N THR 49.A O no hydrogen 2.862 N/A ALA 54.A N LEU 50.A O no hydrogen 2.804 N/A VAL 55.A N GLY 51.A O no hydrogen 3.075 N/A LEU 56.A N VAL 52.A O no hydrogen 2.799 N/A GLY 57.A N CYS 53.A O no hydrogen 3.041 N/A THR 58.A N ALA 54.A O no hydrogen 3.025 N/A THR 58.A OG1 ALA 54.A O no hydrogen 2.634 N/A THR 58.A OG1 THR 85.A OG1 no hydrogen 2.690 N/A ALA 59.A N VAL 55.A O no hydrogen 2.693 N/A ALA 60.A N LEU 56.A O no hydrogen 2.637 N/A SER 61.A N GLY 57.A O no hydrogen 2.846 N/A SER 61.A OG GLY 57.A O no hydrogen 3.117 N/A SER 61.A OG THR 58.A O no hydrogen 3.174 N/A SER 61.A OG PHE 80.A O no hydrogen 2.958 N/A THR 62.A N THR 58.A O no hydrogen 2.926 N/A THR 62.A OG1 THR 58.A O no hydrogen 2.752 N/A LEU 63.A N ALA 59.A O no hydrogen 2.963 N/A THR 64.A N ALA 60.A O no hydrogen 3.146 N/A THR 64.A OG1 ALA 60.A O no hydrogen 2.514 N/A ALA 65.A N SER 61.A O no hydrogen 3.237 N/A GLN 66.A N THR 62.A O no hydrogen 3.114 N/A LEU 67.A N LEU 63.A O no hydrogen 2.700 N/A LEU 68.A N THR 64.A O no hydrogen 2.760 N/A GLY 69.A N ALA 65.A O no hydrogen 2.791 N/A GLY 69.A N GLN 66.A O no hydrogen 3.077 N/A VAL 70.A N ALA 65.A O no hydrogen 2.939 N/A LYS 72.A NZ GLU 15.A OE1 no hydrogen 3.291 N/A LYS 72.A NZ GLU 15.A OE2 no hydrogen 3.140 N/A VAL 75.A N ASP 71.A O no hydrogen 3.210 N/A ARG 76.A N LYS 72.A O no hydrogen 2.755 N/A ARG 76.A NE GLU 15.A OE2 no hydrogen 3.044 N/A ARG 76.A NH2 GLU 15.A OE2 no hydrogen 3.203 N/A ALA 77.A N PRO 73.A O no hydrogen 3.176 N/A GLY 78.A N VAL 75.A O no hydrogen 3.222 N/A GLY 81.A N GLY 78.A O no hydrogen 2.928 N/A ALA 82.A N GLY 78.A O no hydrogen 3.219 N/A THR 85.A N GLY 81.A O no hydrogen 3.051 N/A THR 85.A OG1 THR 58.A OG1 no hydrogen 2.690 N/A THR 85.A OG1 GLY 81.A O no hydrogen 3.142 N/A LEU 86.A N ALA 82.A O no hydrogen 3.391 N/A ALA 87.A N ASN 83.A O no hydrogen 3.010 N/A GLY 88.A N GLY 84.A O no hydrogen 2.933 N/A ILE 89.A N THR 85.A O no hydrogen 3.235 N/A ALA 90.A N LEU 86.A O no hydrogen 2.923 N/A PHE 93.A N ILE 89.A O no hydrogen 3.076 N/A PHE 94.A N ALA 90.A O no hydrogen 2.985 N/A PHE 95.A N LEU 91.A O no hydrogen 3.051 N/A ASN 96.A N HIS 153.A O no hydrogen 3.013 N/A MET 101.A N GLU 98.A O no hydrogen 2.819 N/A TYR 104.A N ALA 100.A O no hydrogen 3.098 N/A TYR 104.A OH LEU 142.A O no hydrogen 2.717 N/A VAL 105.A N MET 101.A O no hydrogen 2.987 N/A ALA 106.A N LEU 102.A O no hydrogen 2.891 N/A LEU 107.A N GLY 103.A O no hydrogen 2.801 N/A ASN 108.A N TYR 104.A O no hydrogen 2.744 N/A ASN 108.A ND2 ALA 87.A O no hydrogen 3.433 N/A ASN 108.A ND2 THR 139.A OG1 no hydrogen 3.160 N/A GLY 109.A N VAL 105.A O no hydrogen 2.757 N/A ALA 110.A N ALA 106.A O no hydrogen 2.763 N/A PHE 111.A N LEU 107.A O no hydrogen 2.824 N/A THR 112.A N ASN 108.A O no hydrogen 3.001 N/A THR 112.A OG1 GLY 109.A O no hydrogen 2.628 N/A ILE 115.A N PHE 111.A O no hydrogen 3.080 N/A MET 116.A N THR 112.A O no hydrogen 2.656 N/A ALA 117.A N THR 113.A O no hydrogen 2.952 N/A SER 118.A N ILE 114.A O no hydrogen 2.835 N/A SER 118.A OG ILE 114.A O no hydrogen 2.896 N/A LEU 119.A N ILE 115.A O no hydrogen 2.821 N/A LEU 120.A N MET 116.A O no hydrogen 2.903 N/A ASN 121.A N ALA 117.A O no hydrogen 3.055 N/A PHE 122.A N SER 118.A O no hydrogen 2.980 N/A LEU 123.A N LEU 119.A O no hydrogen 2.696 N/A GLY 124.A N LEU 120.A O no hydrogen 3.085 N/A LYS 125.A N PHE 122.A O no hydrogen 3.377 N/A LYS 125.A NZ ASN 121.A O no hydrogen 3.120 N/A TRP 126.A N LEU 123.A O no hydrogen 2.741 N/A GLY 127.A N GLY 124.A O no hydrogen 3.305 N/A VAL 128.A N LEU 123.A O no hydrogen 3.495 N/A THR 132.A OG1 THR 293.A OG1 no hydrogen 2.913 N/A ALA 133.A N ALA 130.A O no hydrogen 3.188 N/A PHE 135.A N ASN 83.A OD1 no hydrogen 2.957 N/A VAL 136.A N THR 132.A O no hydrogen 3.414 N/A LEU 137.A N ALA 133.A O no hydrogen 2.983 N/A ALA 138.A N PRO 134.A O no hydrogen 3.041 N/A THR 139.A N PHE 135.A O no hydrogen 3.062 N/A THR 139.A OG1 PHE 135.A O no hydrogen 2.609 N/A TRP 140.A N VAL 136.A O no hydrogen 2.943 N/A TRP 140.A NE1 PRO 290.A O no hydrogen 3.059 N/A LEU 141.A N LEU 137.A O no hydrogen 3.003 N/A LEU 142.A N ALA 138.A O no hydrogen 2.958 N/A LEU 142.A N THR 139.A O no hydrogen 3.193 N/A MET 143.A N THR 139.A O no hydrogen 2.670 N/A PHE 144.A N TRP 140.A O no hydrogen 2.870 N/A VAL 146.A N MET 143.A O no hydrogen 3.137 N/A TYR 147.A OH ILE 287.A O no hydrogen 2.738 N/A LYS 148.A N GLY 145.A O no hydrogen 2.701 N/A LEU 149.A N GLY 145.A O no hydrogen 2.873 N/A GLY 155.A N PHE 94.A O no hydrogen 2.778 N/A ILE 158.A N GLY 155.A O no hydrogen 3.184 N/A ALA 161.A N SER 285.A O no hydrogen 3.017 N/A THR 172.A N THR 175.A OG1 no hydrogen 2.768 N/A THR 172.A OG1 THR 175.A OG1 no hydrogen 3.237 N/A THR 175.A OG1 THR 172.A O no hydrogen 3.071 N/A THR 175.A OG1 THR 172.A OG1 no hydrogen 3.237 N/A THR 175.A OG1 GLU 232.A OE2 no hydrogen 2.765 N/A PHE 176.A N GLY 173.A O no hydrogen 3.089 N/A MET 177.A N GLY 173.A O no hydrogen 3.032 N/A GLU 178.A N ARG 174.A O no hydrogen 2.855 N/A GLY 179.A N THR 175.A O no hydrogen 3.134 N/A LEU 180.A N PHE 176.A O no hydrogen 3.026 N/A LYS 182.A N GLU 178.A O no hydrogen 2.986 N/A LYS 182.A NZ GLU 178.A OE1 no hydrogen 2.961 N/A LYS 182.A NZ ASP 191.A OD2 no hydrogen 2.794 N/A GLY 183.A N GLY 179.A O no hydrogen 2.798 N/A GLY 185.A N PHE 181.A O no hydrogen 2.876 N/A GLU 186.A N LYS 182.A O no hydrogen 2.683 N/A VAL 187.A N VAL 184.A O no hydrogen 3.145 N/A MET 188.A N GLY 185.A O no hydrogen 3.027 N/A PHE 189.A N GLU 186.A O no hydrogen 2.997 N/A GLN 190.A N GLY 185.A O no hydrogen 2.923 N/A GLN 190.A NE2 MET 188.A O no hydrogen 2.817 N/A ASN 192.A ND2 ASN 46.A OD1 no hydrogen 3.220 N/A THR 195.A N ASN 192.A OD1 no hydrogen 3.027 N/A THR 195.A OG1 GLY 42.A O no hydrogen 2.894 N/A GLY 196.A N ASN 192.A O no hydrogen 3.191 N/A VAL 197.A N ILE 193.A O no hydrogen 3.004 N/A ILE 198.A N VAL 194.A O no hydrogen 2.771 N/A PHE 199.A N THR 195.A O no hydrogen 2.802 N/A VAL 200.A N GLY 196.A O no hydrogen 2.951 N/A VAL 201.A N VAL 197.A O no hydrogen 2.917 N/A ALA 202.A N ILE 198.A O no hydrogen 2.732 N/A ILE 203.A N PHE 199.A O no hydrogen 3.044 N/A LEU 204.A N VAL 200.A O no hydrogen 2.794 N/A VAL 205.A N VAL 201.A O no hydrogen 2.970 N/A ASN 206.A N ILE 203.A O no hydrogen 2.815 N/A ASN 206.A ND2 GLN 30.A OE1 no hydrogen 2.846 N/A SER 207.A N ILE 203.A O no hydrogen 2.854 N/A SER 207.A OG GLU 325.A OE1 no hydrogen 2.989 N/A SER 207.A OG GLU 325.A OE2 no hydrogen 3.421 N/A ARG 208.A N GLU 325.A OE2 no hydrogen 2.829 N/A ILE 209.A N GLU 325.A OE2 no hydrogen 3.266 N/A SER 210.A N SER 207.A OG no hydrogen 2.778 N/A SER 210.A OG SER 207.A OG no hydrogen 3.423 N/A ALA 211.A N SER 207.A O no hydrogen 3.118 N/A LEU 212.A N ARG 208.A O no hydrogen 2.881 N/A PHE 213.A N ILE 209.A O no hydrogen 2.926 N/A ALA 214.A N SER 210.A O no hydrogen 3.046 N/A VAL 215.A N ALA 211.A O no hydrogen 3.217 N/A ILE 216.A N LEU 212.A O no hydrogen 2.903 N/A GLY 217.A N PHE 213.A O no hydrogen 2.858 N/A SER 218.A N ALA 214.A O no hydrogen 3.262 N/A SER 218.A OG LEU 180.A O no hydrogen 2.768 N/A LEU 219.A N VAL 215.A O no hydrogen 3.076 N/A VAL 220.A N ILE 216.A O no hydrogen 2.705 N/A GLY 221.A N GLY 217.A O no hydrogen 2.737 N/A LEU 222.A N SER 218.A O no hydrogen 2.965 N/A CYS 223.A N LEU 219.A O no hydrogen 2.993 N/A THR 224.A N VAL 220.A O no hydrogen 2.909 N/A THR 224.A OG1 VAL 220.A O no hydrogen 2.741 N/A ALA 225.A N GLY 221.A O no hydrogen 3.288 N/A LEU 226.A N LEU 222.A O no hydrogen 3.218 N/A ILE 227.A N CYS 223.A O no hydrogen 2.785 N/A MET 228.A N THR 224.A O no hydrogen 2.774 N/A HIS 229.A N LEU 226.A O no hydrogen 2.736 N/A HIS 229.A ND1 ILE 227.A O no hydrogen 3.089 N/A SER 230.A N ALA 225.A O no hydrogen 2.864 N/A SER 230.A OG PRO 231.A O no hydrogen 2.902 N/A GLU 232.A N MET 168.A O no hydrogen 2.978 N/A ARG 236.A N GLU 232.A O no hydrogen 2.897 N/A ARG 236.A NH1 GLU 178.A OE1 no hydrogen 2.793 N/A LEU 237.A N THR 233.A O no hydrogen 3.145 N/A GLY 238.A N VAL 235.A O no hydrogen 3.213 N/A LEU 239.A N PRO 234.A O no hydrogen 2.973 N/A GLY 241.A N GLY 238.A O no hydrogen 2.979 N/A ASN 243.A ND2 LEU 292.A O no hydrogen 3.605 N/A SER 244.A OG MET 270.A O no hydrogen 2.654 N/A VAL 245.A N GLY 241.A O no hydrogen 2.733 N/A LEU 246.A N PHE 242.A O no hydrogen 3.178 N/A CYS 247.A N ASN 243.A O no hydrogen 3.046 N/A CYS 247.A SG ASN 243.A O no hydrogen 3.052 N/A CYS 247.A SG CYS 269.A O no hydrogen 3.912 N/A CYS 247.A SG THR 300.A OG1 no hydrogen 3.655 N/A GLY 248.A N SER 244.A O no hydrogen 2.856 N/A ILE 249.A N VAL 245.A O no hydrogen 2.967 N/A ALA 250.A N LEU 246.A O no hydrogen 2.968 N/A MET 251.A N CYS 247.A O no hydrogen 2.888 N/A GLY 252.A N GLY 248.A O no hydrogen 2.797 N/A GLY 253.A N MET 251.A O no hydrogen 2.662 N/A PHE 255.A N ALA 250.A O no hydrogen 3.105 N/A TYR 257.A N ALA 314.A O no hydrogen 3.173 N/A ASN 259.A N THR 262.A OG1 no hydrogen 2.511 N/A ARG 261.A N ASN 259.A OD1 no hydrogen 2.962 N/A ARG 261.A NE ASN 312.A O no hydrogen 3.306 N/A THR 262.A N ASN 259.A OD1 no hydrogen 3.060 N/A THR 262.A OG1 TYR 257.A O no hydrogen 2.561 N/A THR 262.A OG1 ASN 259.A O no hydrogen 2.946 N/A PHE 263.A N ASN 259.A O no hydrogen 2.723 N/A LEU 264.A N ILE 260.A O no hydrogen 3.373 N/A TYR 265.A N ARG 261.A O no hydrogen 2.975 N/A TYR 265.A OH PHE 303.A O no hydrogen 2.867 N/A ALA 266.A N THR 262.A O no hydrogen 2.906 N/A LEU 267.A N PHE 263.A O no hydrogen 2.912 N/A GLY 268.A N LEU 264.A O no hydrogen 2.981 N/A CYS 269.A N TYR 265.A O no hydrogen 3.275 N/A MET 270.A N ALA 266.A O no hydrogen 2.970 N/A VAL 271.A N LEU 267.A O no hydrogen 3.019 N/A LEU 272.A N GLY 268.A O no hydrogen 3.134 N/A GLY 273.A N CYS 269.A O no hydrogen 2.826 N/A ALA 274.A N MET 270.A O no hydrogen 3.238 N/A ILE 275.A N VAL 271.A O no hydrogen 3.108 N/A ALA 276.A N LEU 272.A O no hydrogen 2.729 N/A THR 277.A N GLY 273.A O no hydrogen 3.107 N/A THR 277.A N ALA 274.A O no hydrogen 2.943 N/A THR 277.A OG1 GLY 273.A O no hydrogen 2.794 N/A ALA 279.A N ILE 275.A O no hydrogen 3.084 N/A PHE 280.A N ALA 276.A O no hydrogen 2.948 N/A SER 281.A N THR 277.A O no hydrogen 3.088 N/A VAL 282.A N GLY 278.A O no hydrogen 3.016 N/A LEU 283.A N ALA 279.A O no hydrogen 2.972 N/A LEU 284.A N PHE 280.A O no hydrogen 3.059 N/A LEU 284.A N SER 281.A O no hydrogen 3.345 N/A SER 285.A N VAL 282.A O no hydrogen 3.031 N/A SER 285.A OG ALA 161.A O no hydrogen 3.567 N/A SER 285.A OG VAL 282.A O no hydrogen 2.732 N/A ILE 287.A N LEU 284.A O no hydrogen 3.289 N/A GLY 288.A N SER 285.A O no hydrogen 2.874 N/A MET 289.A N LEU 284.A O no hydrogen 3.139 N/A THR 293.A OG1 THR 132.A OG1 no hydrogen 2.913 N/A TRP 294.A N ALA 291.A O no hydrogen 3.153 N/A PHE 296.A N ASN 243.A OD1 no hydrogen 3.219 N/A ILE 297.A N THR 293.A O no hydrogen 2.990 N/A VAL 298.A N TRP 294.A O no hydrogen 2.915 N/A VAL 299.A N PRO 295.A O no hydrogen 3.346 N/A THR 300.A N PHE 296.A O no hydrogen 2.862 N/A THR 300.A OG1 PHE 296.A O no hydrogen 2.625 N/A TRP 301.A N ILE 297.A O no hydrogen 2.888 N/A TRP 301.A NE1 PRO 129.A O no hydrogen 2.935 N/A LEU 302.A N VAL 298.A O no hydrogen 2.795 N/A PHE 303.A N VAL 299.A O no hydrogen 2.960 N/A LEU 304.A N THR 300.A O no hydrogen 2.829 N/A PHE 305.A N TRP 301.A O no hydrogen 2.851 N/A ALA 306.A N LEU 302.A O no hydrogen 3.047 N/A GLY 307.A N PHE 303.A O no hydrogen 3.199 N/A GLY 307.A N LEU 304.A O no hydrogen 3.279 N/A MET 309.A N ALA 306.A O no hydrogen 2.793 N/A PHE 310.A N GLY 307.A O no hydrogen 3.000 N/A ILE 313.A N PHE 310.A O no hydrogen 3.407 N/A GLN 315.A NE2 PHE 255.A O no hydrogen 3.567 N/A VAL 316.A N PHE 255.A O no hydrogen 2.807 N/A THR 318.A OG1 GLY 127.A O no hydrogen 2.649 N/A ALA 321.A N THR 318.A O no hydrogen 3.210 N/A GLY 322.A N ASN 327.A OD1 no hydrogen 3.144 N/A THR 323.A OG1 ASP 326.A OD2 no hydrogen 2.494 N/A GLU 325.A N GLU 325.A OE1 no hydrogen 2.642 N/A ASP 326.A N THR 323.A OG1 no hydrogen 3.125 N/A ASN 327.A N THR 323.A O no hydrogen 3.001 N/A ASN 327.A ND2 GLY 253.A O no hydrogen 2.858 N/A ASN 327.A ND2 ILE 254.A O no hydrogen 3.138 N/A ASN 327.A ND2 GLY 322.A O no hydrogen 3.139 N/A LEU 328.A N PRO 324.A O no hydrogen 3.333 N/A ARG 329.A N GLU 325.A O no hydrogen 3.133 N/A ARG 329.A NH1 ASP 326.A OD1 no hydrogen 2.735 N/A SER 330.A N ASP 326.A O no hydrogen 2.906 N/A LEU 331.A N ASN 327.A O no hydrogen 3.005 N/A ALA 332.A N LEU 328.A O no hydrogen 3.232 N/A ILE 333.A N SER 330.A O no hydrogen 2.921 N/A