Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ice_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 8.A N ASN 7.A OD1.B no hydrogen 2.740 N/A ASN 10.A N GLU 9.A OE1 no hydrogen 2.983 N/A SER 12.A OG.A ASN 10.A OD1 no hydrogen 2.478 N/A SER 13.A N ASN 10.A O no hydrogen 3.528 N/A SER 13.A N ASN 10.A OD1 no hydrogen 2.948 N/A SER 13.A OG.B ASN 10.A O no hydrogen 3.054 N/A GLN 14.A N ASN 10.A O no hydrogen 3.487 N/A ALA 15.A N LEU 11.A O no hydrogen 2.850 N/A LYS 16.A N SER 12.A O no hydrogen 2.944 N/A LEU 17.A N SER 13.A O no hydrogen 3.337 N/A TRP 18.A N GLN 14.A O no hydrogen 3.013 N/A ASN 19.A N ALA 15.A O no hydrogen 2.837 N/A PHE 20.A N LYS 16.A O no hydrogen 3.055 N/A ILE 21.A N LEU 17.A O no hydrogen 2.784 N/A TYR 22.A N TRP 18.A O no hydrogen 2.989 N/A GLY 23.A N PHE 20.A O no hydrogen 3.015 N/A ALA 25.A N TYR 22.A O no hydrogen 2.857 N/A ASP 26.A N GLY 23.A O no hydrogen 2.995 N/A LEU 28.A N PHE 24.A O no hydrogen 2.884 N/A VAL 29.A N ALA 25.A O no hydrogen 2.794 N/A LEU 30.A N ASP 26.A O no hydrogen 2.999 N/A LYS 31.A N SER 27.A O no hydrogen 2.971 N/A LYS 31.A NZ THR 117.A O no hydrogen 2.791 N/A SER 32.A N LEU 28.A O no hydrogen 3.171 N/A SER 32.A OG VAL 29.A O no hydrogen 2.652 N/A ALA 33.A N VAL 29.A O no hydrogen 2.938 N/A VAL 34.A N LEU 30.A O no hydrogen 2.996 N/A GLN 35.A N LYS 31.A O no hydrogen 2.884 N/A LEU 36.A N SER 32.A O no hydrogen 2.903 N/A ASP 37.A N VAL 34.A O no hydrogen 3.013 N/A LEU 38.A N ALA 33.A O no hydrogen 3.297 N/A ASN 40.A N ASP 37.A O no hydrogen 3.143 N/A ILE 41.A N ASP 37.A O no hydrogen 3.071 N/A ILE 42.A N LEU 38.A O no hydrogen 3.065 N/A HIS 43.A N ALA 39.A O no hydrogen 2.912 N/A ASN 44.A N ASN 40.A O no hydrogen 2.912 N/A HIS 45.A N ILE 41.A O no hydrogen 3.022 N/A GLY 46.A N ILE 42.A O no hydrogen 2.968 N/A MET 49.A N TYR 92.A O no hydrogen 2.963 N/A THR 50.A N GLU 53.A OE1 no hydrogen 2.894 N/A THR 50.A OG1 SER 52.A OG.B no hydrogen 3.390 N/A SER 52.A OG.B THR 50.A OG1 no hydrogen 3.390 N/A GLU 53.A N THR 50.A OG1 no hydrogen 3.103 N/A LEU 54.A N THR 50.A O no hydrogen 2.947 N/A SER 55.A N LEU 51.A O no hydrogen 2.998 N/A SER 55.A OG.A LEU 51.A O no hydrogen 2.829 N/A SER 55.A OG.B GLN 65.A OE1 no hydrogen 3.566 N/A LEU 56.A N SER 52.A O no hydrogen 3.100 N/A HIS 57.A N LEU 54.A O no hydrogen 2.948 N/A HIS 57.A ND1 GLU 53.A O no hydrogen 2.906 N/A LEU 58.A N SER 55.A O no hydrogen 3.368 N/A GLN 61.A NE2 SER 55.A O no hydrogen 2.940 N/A ALA 67.A N ASN 64.A OD1 no hydrogen 3.054 N/A LEU 68.A N ASN 64.A O no hydrogen 3.081 N/A TYR 69.A N GLN 65.A O no hydrogen 2.887 N/A ARG 70.A N ASP 66.A O no hydrogen 3.074 N/A ARG 70.A NH1 ASP 66.A OD2 no hydrogen 2.904 N/A VAL 71.A N ALA 67.A O no hydrogen 3.006 N/A LEU 72.A N LEU 68.A O no hydrogen 2.892 N/A ARG 73.A N TYR 69.A O no hydrogen 2.856 N/A TYR 74.A N ARG 70.A O no hydrogen 3.275 N/A TYR 74.A OH ASP 26.A OD1 no hydrogen 2.633 N/A LEU 75.A N VAL 71.A O no hydrogen 2.925 N/A VAL 76.A N LEU 72.A O no hydrogen 2.804 N/A HIS 77.A N ARG 73.A O no hydrogen 3.163 N/A MET 78.A N TYR 74.A O no hydrogen 2.990 N/A LYS 79.A N VAL 76.A O no hydrogen 2.909 N/A LEU 80.A N LEU 75.A O no hydrogen 3.268 N/A PHE 81.A N LEU 75.A O no hydrogen 3.368 N/A THR 82.A N GLY 93.A O no hydrogen 2.833 N/A LYS 83.A NZ TYR 69.A OH no hydrogen 3.044 N/A SER 84.A N ARG 91.A O no hydrogen 3.031 N/A ILE 86.A N GLU 89.A O no hydrogen 2.700 N/A GLU 89.A N ILE 86.A O no hydrogen 3.017 N/A ARG 91.A N SER 84.A O no hydrogen 2.853 N/A ARG 91.A NH1 ILE 86.A O no hydrogen 3.075 N/A TYR 92.A N MET 49.A O no hydrogen 2.701 N/A GLY 93.A N THR 82.A O no hydrogen 3.004 N/A ALA 95.A N LEU 80.A O no hydrogen 2.966 N/A ALA 98.A N ALA 95.A O no hydrogen 2.949 N/A LYS 99.A N PRO 96.A O no hydrogen 3.158 N/A LYS 99.A NZ PRO 96.A O no hydrogen 2.891 N/A PHE 100.A N PRO 97.A O no hydrogen 3.269 N/A LEU 101.A N ALA 98.A O no hydrogen 2.813 N/A VAL 102.A N LYS 99.A O no hydrogen 3.163 N/A LYS 103.A NZ ASP 37.A OD1 no hydrogen 3.125 N/A LYS 103.A NZ ASP 37.A OD2 no hydrogen 2.932 N/A TRP 105.A NE1 LYS 99.A O no hydrogen 2.994 N/A CYS 108.A N TRP 105.A O no hydrogen 3.175 N/A CYS 108.A SG VAL 102.A O no hydrogen 3.443 N/A MET 109.A N PHE 100.A O no hydrogen 2.762 N/A ILE 113.A N MET 109.A O no hydrogen 3.067 N/A LEU 114.A N LEU 110.A O no hydrogen 3.041 N/A THR 115.A N GLY 111.A O no hydrogen 3.057 N/A THR 115.A OG1 GLY 111.A O no hydrogen 3.059 N/A THR 115.A OG1 LEU 163.A O no hydrogen 2.825 N/A ILE 116.A N ALA 112.A O no hydrogen 2.905 N/A THR 117.A N ILE 113.A O no hydrogen 2.994 N/A THR 117.A OG1 ILE 113.A O no hydrogen 2.689 N/A ASP 118.A N THR 115.A O no hydrogen 3.401 N/A PHE 121.A N ASP 118.A OD2 no hydrogen 3.020 N/A MET 122.A N ASP 118.A O no hydrogen 2.911 N/A MET 122.A N LYS 119.A O no hydrogen 3.154 N/A ALA 123.A N ASP 120.A O no hydrogen 3.075 N/A TRP 125.A N MET 122.A O no hydrogen 3.053 N/A HIS 126.A N ALA 123.A O no hydrogen 3.043 N/A TYR 127.A N PRO 124.A O no hydrogen 2.958 N/A GLY 131.A N LEU 128.A O no hydrogen 2.907 N/A ILE 132.A N LYS 129.A O no hydrogen 3.012 N/A LEU 133.A N LYS 129.A O no hydrogen 2.866 N/A SER 137.A N ASN 134.A O no hydrogen 2.755 N/A SER 137.A OG SER 139.A OG no hydrogen 3.036 N/A SER 139.A N SER 137.A OG no hydrogen 3.114 N/A SER 139.A OG SER 137.A OG no hydrogen 3.036 N/A PHE 142.A N LEU 311.A O no hydrogen 2.978 N/A GLU 143.A N THR 140.A OG1 no hydrogen 3.145 N/A LYS 144.A N THR 140.A O no hydrogen 3.006 N/A LYS 144.A NZ.B SER 139.A O no hydrogen 3.251 N/A LYS 144.A NZ.B SER 139.A OG no hydrogen 2.825 N/A ALA 145.A N ALA 141.A O no hydrogen 2.915 N/A LEU 146.A N PHE 142.A O no hydrogen 2.782 N/A GLY 147.A N GLU 143.A O no hydrogen 2.747 N/A ASN 149.A N THR 148.A OG1 no hydrogen 2.769 N/A TYR 153.A N ASN 149.A O no hydrogen 2.899 N/A MET 154.A N ILE 150.A O no hydrogen 2.958 N/A ALA 155.A N TRP 151.A O no hydrogen 3.063 N/A GLU 156.A N TYR 153.A O no hydrogen 2.982 N/A HIS 157.A N MET 154.A O no hydrogen 3.326 N/A HIS 157.A ND1 TYR 153.A O no hydrogen 2.806 N/A LYS 160.A NZ ASP 118.A OD2 no hydrogen 2.832 N/A LYS 160.A NZ ASP 120.A OD2 no hydrogen 3.041 N/A ASN 161.A N HIS 157.A O no hydrogen 2.795 N/A ASN 161.A ND2 HIS 223.A O no hydrogen 3.043 N/A GLN 162.A N PRO 158.A O no hydrogen 2.986 N/A GLN 162.A NE2 ASP 227.A OD1 no hydrogen 3.067 N/A LEU 163.A N GLU 159.A O no hydrogen 2.963 N/A PHE 164.A N LYS 160.A O no hydrogen 2.884 N/A ASN 165.A N ASN 161.A O no hydrogen 2.875 N/A ASN 165.A ND2 ASN 161.A OD1 no hydrogen 3.176 N/A ASN 165.A ND2 ASP 227.A OD2 no hydrogen 2.941 N/A GLU 166.A N GLN 162.A O no hydrogen 2.952 N/A GLY 167.A N LEU 163.A O no hydrogen 3.108 N/A MET 168.A N PHE 164.A O no hydrogen 2.958 N/A ALA 169.A N ASN 165.A O no hydrogen 2.855 N/A ASN 170.A N GLU 166.A O no hydrogen 2.913 N/A ASP 171.A N GLY 167.A O no hydrogen 2.882 N/A THR 172.A N MET 168.A O no hydrogen 2.953 N/A THR 172.A OG1 MET 168.A O no hydrogen 3.093 N/A ARG 173.A N ALA 169.A O no hydrogen 2.922 N/A ARG 173.A NH1 GLU 166.A OE2 no hydrogen 2.844 N/A ARG 173.A NH2 GLU 166.A OE2 no hydrogen 3.227 N/A LEU 174.A N ASN 170.A O no hydrogen 3.119 N/A ILE 175.A N THR 172.A O no hydrogen 3.033 N/A MET 176.A N THR 172.A O no hydrogen 3.195 N/A SER 177.A OG.A ASP 106.A OD2 no hydrogen 3.292 N/A LEU 179.A N ILE 175.A O no hydrogen 2.919 N/A VAL 180.A N MET 176.A O no hydrogen 2.905 N/A LYS 181.A N SER 177.A O no hydrogen 3.120 N/A GLU 182.A N ALA 178.A O no hydrogen 2.890 N/A CYS 183.A N LEU 179.A O no hydrogen 2.970 N/A SER 184.A N LYS 181.A O no hydrogen 3.430 N/A SER 184.A OG.A LYS 181.A O no hydrogen 3.416 N/A MET 186.A N CYS 183.A O no hydrogen 3.028 N/A PHE 187.A N SER 184.A O no hydrogen 3.044 N/A ASP 188.A N SER 185.A O no hydrogen 3.221 N/A ILE 190.A N PHE 187.A O no hydrogen 3.348 N/A THR 191.A N ASP 249.A OD2 no hydrogen 2.754 N/A THR 191.A OG1 ASP 249.A OD2 no hydrogen 2.649 N/A ILE 193.A N LYS 215.A O no hydrogen 3.110 N/A VAL 194.A N ALA 250.A O no hydrogen 3.147 N/A ASP 195.A N THR 217.A O no hydrogen 2.791 N/A VAL 196.A N MET 252.A O no hydrogen 2.910 N/A GLY 198.A N TYR 219.A O no hydrogen 3.086 N/A GLY 199.A N ASP 220.A OD2 no hydrogen 2.851 N/A GLY 201.A N GLY 198.A O no hydrogen 3.334 N/A ARG 205.A N GLY 201.A O no hydrogen 2.890 N/A ARG 205.A NH1 THR 200.A O no hydrogen 2.816 N/A ASN 206.A N THR 202.A O no hydrogen 3.144 N/A ASN 206.A ND2 THR 202.A O no hydrogen 2.823 N/A ILE 207.A N ALA 203.A O no hydrogen 2.895 N/A ALA 208.A N VAL 204.A O no hydrogen 2.841 N/A LYS 209.A N ARG 205.A O no hydrogen 3.118 N/A ALA 210.A N ASN 206.A O no hydrogen 3.076 N/A PHE 211.A N ILE 207.A O no hydrogen 2.792 N/A ILE 214.A N PHE 211.A O no hydrogen 3.066 N/A LYS 215.A N THR 191.A O no hydrogen 2.925 N/A LYS 215.A NZ GLU 233.A O no hydrogen 2.961 N/A CYS 216.A SG ILE 214.A O no hydrogen 3.679 N/A THR 217.A N ILE 193.A O no hydrogen 2.858 N/A VAL 218.A N ASN 235.A O no hydrogen 2.855 N/A TYR 219.A N ASP 195.A O no hydrogen 3.098 N/A TYR 219.A OH TYR 244.A O no hydrogen 2.698 N/A ASP 220.A N ILE 237.A O no hydrogen 3.291 N/A LEU 221.A N ASP 220.A OD1 no hydrogen 2.644 N/A HIS 223.A ND1 ASN 161.A OD1 no hydrogen 3.267 N/A VAL 224.A N LEU 221.A O no hydrogen 2.958 N/A ILE 225.A N LEU 221.A O no hydrogen 3.102 N/A ALA 226.A N PRO 222.A O no hydrogen 2.883 N/A ASP 227.A N VAL 224.A O no hydrogen 2.934 N/A SER 228.A N ILE 225.A O no hydrogen 3.106 N/A SER 228.A OG VAL 224.A O no hydrogen 2.848 N/A ASN 235.A N CYS 216.A O no hydrogen 2.997 N/A ILE 237.A N VAL 218.A O no hydrogen 2.935 N/A GLY 239.A N ASP 220.A O no hydrogen 2.983 N/A PHE 242.A N ASP 240.A OD1 no hydrogen 3.092 N/A LYS 243.A N ASP 240.A O no hydrogen 2.926 N/A TYR 244.A N ASP 240.A O no hydrogen 3.042 N/A ALA 248.A N ALA 275.A O no hydrogen 3.161 N/A ASP 249.A N THR 192.A OG1 no hydrogen 2.880 N/A ALA 250.A N THR 192.A O no hydrogen 3.324 N/A ILE 251.A N LYS 282.A O no hydrogen 3.154 N/A MET 252.A N VAL 194.A O no hydrogen 2.959 N/A MET 253.A N ILE 284.A O no hydrogen 2.788 N/A LYS 254.A NZ ASP 171.A OD2 no hydrogen 2.785 N/A LYS 254.A NZ THR 172.A OG1 no hydrogen 3.027 N/A CYS 255.A N ILE 286.A O no hydrogen 2.829 N/A CYS 255.A SG ASP 171.A OD2 no hydrogen 3.746 N/A HIS 258.A N ASP 287.A OD2 no hydrogen 3.219 N/A HIS 258.A ND1 GLU 317.A OE2 no hydrogen 2.623 N/A ASP 259.A N ILE 256.A O no hydrogen 2.851 N/A TRP 260.A N LEU 257.A O no hydrogen 3.202 N/A ASP 261.A N GLU 264.A OE1 no hydrogen 2.996 N/A GLU 264.A N ASP 261.A OD1 no hydrogen 2.873 N/A CYS 265.A N ASP 261.A O no hydrogen 2.896 N/A CYS 265.A SG LEU 257.A O no hydrogen 3.156 N/A CYS 265.A SG TRP 260.A O no hydrogen 3.440 N/A CYS 265.A SG ASP 261.A O no hydrogen 3.396 N/A ILE 266.A N ASP 262.A O no hydrogen 2.880 N/A GLU 267.A N LYS 263.A O no hydrogen 3.126 N/A ILE 268.A N GLU 264.A O no hydrogen 2.934 N/A LEU 269.A N CYS 265.A O no hydrogen 2.804 N/A LYS 270.A N ILE 266.A O no hydrogen 2.878 N/A ARG 271.A N GLU 267.A O no hydrogen 3.161 N/A ARG 271.A NH2 PHE 242.A O no hydrogen 3.123 N/A CYS 272.A N ILE 268.A O no hydrogen 2.940 N/A CYS 272.A SG ILE 268.A O no hydrogen 3.367 N/A LYS 273.A N LEU 269.A O no hydrogen 2.906 N/A LYS 273.A NZ GLY 331.A O no hydrogen 3.325 N/A ASP 274.A N LYS 270.A O no hydrogen 3.150 N/A ALA 275.A N CYS 272.A O no hydrogen 2.981 N/A GLY 281.A N PRO 277.A O no hydrogen 2.974 N/A LYS 282.A NZ MET 186.A O no hydrogen 2.826 N/A VAL 283.A N ALA 349.A O no hydrogen 2.995 N/A ILE 284.A N ILE 251.A O no hydrogen 2.670 N/A ILE 285.A N ILE 347.A O no hydrogen 2.818 N/A ILE 286.A N MET 253.A O no hydrogen 2.857 N/A ASP 287.A N SER 345.A O no hydrogen 3.167 N/A LEU 290.A N ARG 318.A O no hydrogen 2.902 N/A LYS 293.A N ASP 291.A OD1 no hydrogen 2.821 N/A SER 294.A N ASP 291.A OD1 no hydrogen 3.142 N/A SER 294.A OG.A ASP 291.A OD2 no hydrogen 2.910 N/A HIS 296.A N THR 299.A OG1 no hydrogen 2.769 N/A THR 299.A N HIS 296.A O no hydrogen 3.051 N/A THR 299.A OG1 HIS 296.A O no hydrogen 3.225 N/A ARG 302.A N TYR 298.A O no hydrogen 2.888 N/A ARG 302.A NE VAL 343.A O no hydrogen 2.923 N/A ARG 302.A NH2 ALA 342.A O no hydrogen 2.977 N/A ARG 302.A NH2 VAL 343.A O no hydrogen 3.109 N/A LEU 303.A N THR 299.A O no hydrogen 3.007 N/A THR 304.A N LYS 300.A O no hydrogen 2.994 N/A THR 304.A OG1 LYS 300.A O no hydrogen 2.823 N/A LEU 305.A N MET 301.A O.A no hydrogen 2.824 N/A LEU 305.A N MET 301.A O.B no hydrogen 2.809 N/A ASP 306.A N ARG 302.A O no hydrogen 3.061 N/A LEU 307.A N LEU 303.A O no hydrogen 3.353 N/A ASP 308.A N THR 304.A O no hydrogen 2.836 N/A MET 309.A N LEU 305.A O no hydrogen 2.833 N/A MET 310.A N ASP 306.A O no hydrogen 3.041 N/A LEU 311.A N LEU 307.A O no hydrogen 2.900 N/A ASN 312.A N ASP 308.A O no hydrogen 2.808 N/A THR 313.A N MET 309.A O no hydrogen 2.974 N/A THR 313.A OG1 ASP 259.A O no hydrogen 3.530 N/A THR 313.A OG1 MET 309.A O no hydrogen 3.058 N/A GLY 314.A N MET 309.A O no hydrogen 2.870 N/A GLY 315.A N THR 313.A OG1 no hydrogen 3.134 N/A LYS 316.A N HIS 258.A O no hydrogen 2.978 N/A LYS 316.A NZ GLU 322.A OE2 no hydrogen 2.927 N/A GLU 317.A N ASP 306.A OD1 no hydrogen 2.923 N/A ARG 318.A NH1 LEU 257.A O no hydrogen 3.009 N/A ARG 318.A NH1 TRP 260.A O no hydrogen 3.554 N/A ARG 318.A NH2 TRP 260.A O no hydrogen 2.932 N/A ARG 318.A NH2 ASP 262.A OD1 no hydrogen 2.892 N/A THR 319.A N GLU 322.A OE1 no hydrogen 2.984 N/A THR 319.A OG1 GLU 322.A OE1 no hydrogen 3.411 N/A GLU 322.A N THR 319.A OG1 no hydrogen 3.182 N/A TRP 323.A N THR 319.A O no hydrogen 2.940 N/A TRP 323.A NE1 ILE 288.A O no hydrogen 2.990 N/A LYS 324.A N GLU 320.A O no hydrogen 2.801 N/A LYS 325.A N GLU 321.A O no hydrogen 3.078 N/A LYS 325.A NZ ASP 329.A OD2 no hydrogen 3.271 N/A LEU 326.A N GLU 322.A O no hydrogen 3.036 N/A ILE 327.A N TRP 323.A O no hydrogen 2.896 N/A HIS 328.A N LYS 324.A O no hydrogen 2.853 N/A HIS 328.A ND1 ASP 329.A OD1 no hydrogen 2.794 N/A ASP 329.A N LYS 325.A O no hydrogen 2.862 N/A ALA 330.A N LEU 326.A O no hydrogen 3.060 N/A GLY 331.A N HIS 328.A O no hydrogen 2.954 N/A TYR 332.A N ILE 327.A O no hydrogen 3.290 N/A TYR 332.A OH LEU 269.A O no hydrogen 2.658 N/A LYS 333.A N TYR 350.A O no hydrogen 2.794 N/A GLY 334.A N TYR 350.A O no hydrogen 3.419 N/A TYR 335.A OH GLU 320.A OE2 no hydrogen 2.747 N/A LYS 336.A N GLU 348.A O no hydrogen 2.863 N/A THR 338.A N VAL 346.A O no hydrogen 2.759 N/A SER 345.A N ASP 287.A O no hydrogen 2.887 N/A SER 345.A OG HIS 339.A ND1 no hydrogen 3.053 N/A VAL 346.A N THR 338.A O no hydrogen 2.881 N/A ILE 347.A N ILE 285.A O no hydrogen 2.656 N/A GLU 348.A N LYS 336.A O no hydrogen 2.813 N/A ALA 349.A N VAL 283.A O no hydrogen 2.798 N/A TYR 350.A N GLY 334.A O no hydrogen 2.873 N/A