Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e18_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 26.A O no hydrogen 3.249 N/A TYR 4.A N ASN 27.A O no hydrogen 3.150 N/A GLN 5.A N ASP 65.A OD2 no hydrogen 2.818 N/A GLN 5.A NE2 LYS 3.A O no hydrogen 2.871 N/A LEU 6.A N GLU 29.A O no hydrogen 2.910 N/A VAL 7.A N ALA 66.A O no hydrogen 2.950 N/A ILE 8.A N GLY 32.A O no hydrogen 2.897 N/A VAL 9.A N LEU 68.A O no hydrogen 2.786 N/A GLY 10.A N PHE 34.A O no hydrogen 2.868 N/A TYR 11.A N ASP 35.A OD2 no hydrogen 2.657 N/A SER 16.A N GLY 12.A O no hydrogen 2.938 N/A SER 16.A OG GLY 12.A O no hydrogen 2.834 N/A SER 16.A OG GLY 13.A O no hydrogen 3.030 N/A HIS 18.A N MET 14.A O no hydrogen 2.867 N/A HIS 18.A N GLY 15.A O no hydrogen 3.224 N/A HIS 18.A ND1 TYR 306.A OH no hydrogen 2.691 N/A HIS 18.A NE2 GLU 93.A OE2 no hydrogen 2.712 N/A LEU 21.A N TYR 17.A O no hydrogen 3.096 N/A ALA 22.A N HIS 18.A O no hydrogen 2.830 N/A SER 23.A N VAL 19.A O no hydrogen 3.195 N/A SER 23.A OG VAL 19.A O no hydrogen 2.798 N/A ALA 24.A N LEU 21.A O no hydrogen 3.312 N/A ALA 25.A N ALA 22.A O no hydrogen 3.168 N/A ASP 26.A N ASN 307.A OD1 no hydrogen 2.919 N/A GLU 29.A N TYR 4.A O no hydrogen 2.906 N/A HIS 31.A N LEU 6.A O no hydrogen 2.759 N/A HIS 31.A ND1 GLN 5.A OE1 no hydrogen 2.814 N/A VAL 33.A N LYS 50.A O no hydrogen 2.756 N/A PHE 34.A N ILE 8.A O no hydrogen 2.757 N/A LEU 37.A N ASP 35.A OD1 no hydrogen 2.953 N/A ARG 41.A N LEU 37.A O no hydrogen 3.128 N/A ARG 41.A NH1 ASP 35.A O no hydrogen 2.828 N/A ARG 41.A NH1 ILE 36.A O no hydrogen 3.374 N/A GLU 42.A N ALA 38.A O no hydrogen 2.932 N/A ALA 43.A N GLU 39.A O no hydrogen 3.095 N/A ALA 44.A N LYS 40.A O no hydrogen 3.135 N/A ALA 45.A N ARG 41.A O no hydrogen 3.041 N/A GLN 46.A N GLU 42.A O no hydrogen 2.890 N/A LYS 47.A N ALA 44.A O no hydrogen 2.996 N/A GLY 48.A N ALA 45.A O no hydrogen 2.870 N/A LEU 49.A N ALA 44.A O no hydrogen 3.231 N/A TYR 52.A N VAL 33.A O no hydrogen 2.986 N/A TYR 52.A OH ASP 61.A OD2 no hydrogen 2.539 N/A TYR 55.A OH LEU 79.A O no hydrogen 2.554 N/A ALA 57.A N SER 54.A O no hydrogen 3.200 N/A ALA 57.A N SER 54.A OG no hydrogen 2.921 N/A VAL 58.A N SER 54.A O no hydrogen 3.328 N/A LEU 59.A N TYR 55.A O no hydrogen 3.087 N/A ALA 60.A N GLU 56.A O no hydrogen 2.945 N/A ASP 61.A N VAL 58.A O no hydrogen 3.206 N/A LYS 63.A N ASP 61.A OD1 no hydrogen 3.032 N/A VAL 64.A N ASP 61.A O no hydrogen 3.182 N/A ASP 65.A N GLN 5.A O no hydrogen 2.918 N/A ALA 66.A N GLN 5.A O no hydrogen 3.110 N/A VAL 67.A N HIS 89.A O no hydrogen 2.881 N/A LEU 68.A N VAL 7.A O no hydrogen 2.820 N/A ILE 69.A N VAL 91.A O no hydrogen 2.716 N/A ALA 70.A N VAL 9.A O no hydrogen 2.822 N/A THR 71.A OG1 PRO 72.A O no hydrogen 3.440 N/A THR 71.A OG1 SER 75.A OG no hydrogen 2.663 N/A ASN 73.A ND2 GLY 168.A O no hydrogen 2.873 N/A SER 75.A N PRO 72.A O no hydrogen 3.201 N/A SER 75.A OG THR 71.A OG1 no hydrogen 2.663 N/A SER 75.A OG PRO 72.A O no hydrogen 2.882 N/A HIS 76.A N ASN 73.A O no hydrogen 3.452 N/A HIS 76.A ND1 PRO 95.A O no hydrogen 2.973 N/A HIS 76.A ND1 VAL 96.A O no hydrogen 2.936 N/A HIS 76.A NE2 THR 71.A O no hydrogen 2.680 N/A LYS 77.A NZ ASP 102.A OD1 no hydrogen 3.188 N/A LEU 79.A N SER 75.A O no hydrogen 3.367 N/A ALA 80.A N HIS 76.A O no hydrogen 2.980 N/A ILE 81.A N LYS 77.A O no hydrogen 2.970 N/A SER 82.A N GLU 78.A O no hydrogen 2.952 N/A SER 82.A OG GLU 78.A O no hydrogen 2.980 N/A ALA 83.A N LEU 79.A O no hydrogen 3.030 N/A LEU 84.A N ALA 80.A O no hydrogen 2.916 N/A GLU 85.A N ILE 81.A O no hydrogen 2.946 N/A ALA 86.A N SER 82.A O no hydrogen 3.099 N/A GLY 87.A N LEU 84.A O no hydrogen 2.757 N/A LYS 88.A N ALA 83.A O no hydrogen 2.950 N/A LYS 88.A NZ ASP 61.A O no hydrogen 2.758 N/A LYS 88.A NZ VAL 64.A O no hydrogen 3.118 N/A HIS 89.A N ASP 65.A O no hydrogen 3.089 N/A VAL 90.A N HIS 116.A O no hydrogen 2.820 N/A VAL 91.A N VAL 67.A O no hydrogen 2.829 N/A CYS 92.A N MET 118.A O no hydrogen 2.968 N/A CYS 92.A SG GLU 93.A O no hydrogen 3.530 N/A CYS 92.A SG VAL 96.A O no hydrogen 3.815 N/A GLU 93.A N ILE 69.A O no hydrogen 3.013 N/A LYS 94.A N GLU 93.A OE1 no hydrogen 3.006 N/A LYS 94.A NZ.A ASP 174.A OD1 no hydrogen 3.246 N/A LYS 94.A NZ.B ASP 174.A O no hydrogen 2.955 N/A LYS 94.A NZ.B ASP 174.A OD1 no hydrogen 3.469 N/A THR 97.A OG1 THR 99.A O no hydrogen 2.761 N/A SER 100.A N GLU 334.A OE2 no hydrogen 2.819 N/A SER 100.A OG GLU 334.A OE1 no hydrogen 2.802 N/A SER 100.A OG GLU 334.A OE2 no hydrogen 3.360 N/A ASP 102.A N THR 99.A OG1 no hydrogen 3.025 N/A LEU 103.A N SER 100.A O no hydrogen 3.210 N/A LEU 104.A N SER 100.A O no hydrogen 3.194 N/A ALA 105.A N GLU 101.A O no hydrogen 3.077 N/A ILE 106.A N ASP 102.A O no hydrogen 3.212 N/A MET 107.A N LEU 103.A O no hydrogen 2.800 N/A ASP 108.A N LEU 104.A O no hydrogen 2.974 N/A VAL 109.A N ALA 105.A O no hydrogen 3.043 N/A ALA 110.A N ILE 106.A O no hydrogen 2.866 N/A LYS 111.A N MET 107.A O no hydrogen 3.035 N/A ARG 112.A N ASP 108.A O no hydrogen 3.001 N/A VAL 113.A N VAL 109.A O no hydrogen 2.935 N/A ASN 114.A N LYS 111.A O no hydrogen 3.292 N/A LYS 115.A N ALA 110.A O no hydrogen 3.015 N/A HIS 116.A N HIS 89.A ND1 no hydrogen 2.931 N/A MET 118.A N VAL 90.A O no hydrogen 2.883 N/A HIS 120.A N CYS 92.A O no hydrogen 2.936 N/A HIS 120.A ND1 GLU 93.A OE2 no hydrogen 2.765 N/A GLN 121.A N VAL 119.A O no hydrogen 2.914 N/A ARG 123.A NH1 ASP 126.A OD2 no hydrogen 2.836 N/A ARG 124.A N GLN 121.A O no hydrogen 3.356 N/A ARG 124.A NE ASP 181.A OD2 no hydrogen 2.788 N/A ARG 124.A NH1 GLU 325.A OE1 no hydrogen 2.760 N/A ARG 124.A NH2 ASP 181.A OD1 no hydrogen 2.775 N/A ARG 124.A NH2 GLU 325.A OE1 no hydrogen 2.859 N/A TRP 125.A N ASN 122.A O no hydrogen 3.159 N/A TRP 125.A NE1 PRO 303.A O no hydrogen 3.107 N/A ASP 126.A N ARG 123.A O no hydrogen 3.164 N/A LEU 130.A N ASP 126.A O no hydrogen 2.966 N/A ILE 131.A N GLU 127.A O no hydrogen 2.942 N/A ILE 132.A N ASP 128.A O no hydrogen 3.317 N/A LYS 133.A N PHE 129.A O no hydrogen 2.891 N/A LYS 133.A NZ GLU 137.A OE2 no hydrogen 2.772 N/A GLU 134.A N LEU 130.A O no hydrogen 2.801 N/A MET 135.A N ILE 131.A O no hydrogen 2.938 N/A PHE 136.A N ILE 132.A O no hydrogen 2.762 N/A GLU 137.A N LYS 133.A O no hydrogen 2.971 N/A GLN 138.A N GLU 134.A O no hydrogen 2.859 N/A THR 140.A N MET 135.A O no hydrogen 3.070 N/A GLY 142.A N LYS 139.A O no hydrogen 2.868 N/A GLU 143.A N THR 242.A OG1 no hydrogen 3.101 N/A PHE 145.A N LYS 240.A O no hydrogen 2.953 N/A HIS 146.A N LYS 240.A O no hydrogen 3.310 N/A HIS 146.A ND1 THR 221.A OG1 no hydrogen 2.644 N/A HIS 146.A NE2 GLU 148.A OE2 no hydrogen 2.653 N/A LEU 147.A N THR 221.A O no hydrogen 3.075 N/A GLU 148.A N TYR 238.A O no hydrogen 2.789 N/A SER 149.A N GLN 223.A O no hydrogen 3.021 N/A ARG 150.A N ARG 236.A O no hydrogen 2.944 N/A ARG 150.A NE GLU 225.A OE2 no hydrogen 3.346 N/A ARG 150.A NH1 GLU 148.A OE1 no hydrogen 2.823 N/A ARG 150.A NH2 GLU 148.A OE1 no hydrogen 2.878 N/A VAL 151.A N GLU 225.A O no hydrogen 3.035 N/A HIS 152.A NE2 GLU 225.A OE2 no hydrogen 2.588 N/A GLY 153.A N GLY 227.A O no hydrogen 3.025 N/A GLY 156.A N THR 228.A O no hydrogen 3.136 N/A ARG 162.A N ASP 160.A OD1 no hydrogen 3.058 N/A HIS 163.A N ASP 160.A O no hydrogen 3.030 N/A HIS 163.A ND1 ASP 204.A OD1 no hydrogen 3.371 N/A LEU 164.A N TRP 161.A O no hydrogen 3.202 N/A LYS 165.A N GLU 205.A OE2 no hydrogen 2.972 N/A LYS 165.A NZ GLU 205.A O no hydrogen 3.249 N/A HIS 167.A N LEU 164.A O no hydrogen 3.395 N/A HIS 167.A ND1 ASP 74.A OD1 no hydrogen 2.898 N/A GLY 168.A N LYS 165.A O no hydrogen 3.200 N/A GLY 169.A N LEU 164.A O no hydrogen 3.059 N/A GLY 170.A N ARG 162.A O no hydrogen 2.856 N/A MET 171.A N ASP 207.A O no hydrogen 3.064 N/A VAL 172.A N ASP 207.A OD2 no hydrogen 2.929 N/A ASP 174.A N MET 171.A O no hydrogen 3.292 N/A TRP 175.A N MET 171.A O no hydrogen 2.945 N/A GLY 176.A N MET 171.A O no hydrogen 2.868 N/A LEU 179.A N TRP 175.A O no hydrogen 3.144 N/A LEU 180.A N GLY 176.A O no hydrogen 2.798 N/A ASP 181.A N VAL 177.A O no hydrogen 2.988 N/A GLN 182.A N HIS 178.A O no hydrogen 3.027 N/A GLN 182.A NE2 ARG 123.A O no hydrogen 2.916 N/A LEU 183.A N LEU 179.A O no hydrogen 3.123 N/A LEU 184.A N LEU 180.A O no hydrogen 2.957 N/A PHE 185.A N ASP 181.A O no hydrogen 2.821 N/A LEU 186.A N GLN 182.A O no hydrogen 2.920 N/A VAL 187.A N LEU 183.A O no hydrogen 2.958 N/A LYS 192.A N THR 215.A O no hydrogen 2.745 N/A SER 193.A N THR 215.A O no hydrogen 3.142 N/A VAL 194.A N VAL 346.A O no hydrogen 2.964 N/A SER 195.A N PHE 213.A O no hydrogen 3.127 N/A ASN 197.A N VAL 211.A O no hydrogen 3.043 N/A SER 199.A N GLY 209.A O no hydrogen 2.727 N/A SER 199.A OG ASP 208.A OD1 no hydrogen 2.643 N/A LEU 202.A N ASP 208.A OD2 no hydrogen 2.836 N/A GLY 203.A N PHE 200.A O no hydrogen 3.140 N/A ASP 208.A N SER 199.A O no hydrogen 2.845 N/A PHE 210.A N VAL 226.A O no hydrogen 2.978 N/A VAL 211.A N ASN 197.A O no hydrogen 3.021 N/A THR 212.A N ILE 224.A O no hydrogen 2.976 N/A THR 212.A OG1 SER 195.A O no hydrogen 2.945 N/A PHE 213.A N SER 195.A O no hydrogen 2.966 N/A ILE 214.A N ALA 222.A O no hydrogen 2.821 N/A THR 215.A N SER 193.A O no hydrogen 2.998 N/A PHE 216.A N ILE 220.A O no hydrogen 2.886 N/A GLU 217.A N ASN 190.A O no hydrogen 2.877 N/A ASN 218.A N SER 189.A OG no hydrogen 3.230 N/A GLY 219.A N PHE 216.A O no hydrogen 3.079 N/A ILE 220.A N ASN 218.A OD1 no hydrogen 3.214 N/A THR 221.A N PHE 145.A O no hydrogen 2.987 N/A THR 221.A OG1 HIS 146.A ND1 no hydrogen 2.644 N/A ALA 222.A N ILE 214.A O no hydrogen 2.901 N/A GLN 223.A N LEU 147.A O no hydrogen 2.969 N/A GLN 223.A NE2 GLU 225.A OE1 no hydrogen 2.916 N/A ILE 224.A N THR 212.A O no hydrogen 3.058 N/A GLU 225.A N SER 149.A O no hydrogen 2.966 N/A VAL 226.A N PHE 210.A O no hydrogen 3.112 N/A GLY 227.A N VAL 151.A O no hydrogen 2.907 N/A THR 228.A OG1 ASP 208.A O no hydrogen 2.560 N/A THR 229.A N ASN 230.A OD1 no hydrogen 3.217 N/A ASN 230.A N GLY 153.A O no hydrogen 2.825 N/A LYS 233.A NZ.B HIS 152.A O no hydrogen 2.634 N/A LEU 234.A N HIS 152.A ND1 no hydrogen 3.191 N/A ARG 236.A N HIS 249.A O no hydrogen 2.985 N/A ARG 236.A NH1 SER 149.A OG no hydrogen 2.755 N/A ARG 236.A NH1 ARG 236.A O no hydrogen 3.095 N/A ARG 236.A NH2 GLN 182.A OE1 no hydrogen 3.043 N/A TRP 237.A N ILE 248.A O no hydrogen 2.992 N/A TRP 237.A NE1 ASP 128.A OD2 no hydrogen 2.876 N/A TYR 238.A N GLU 148.A O no hydrogen 2.956 N/A VAL 239.A N GLY 246.A O no hydrogen 2.962 N/A LYS 240.A N HIS 146.A O no hydrogen 2.876 N/A GLY 241.A N GLY 244.A O no hydrogen 2.921 N/A THR 242.A N GLU 143.A O no hydrogen 3.070 N/A GLU 243.A N ILE 141.A O no hydrogen 2.918 N/A THR 245.A N VAL 258.A O no hydrogen 3.031 N/A GLY 246.A N VAL 239.A O no hydrogen 2.925 N/A ILE 247.A N GLU 256.A O no hydrogen 3.052 N/A ILE 248.A N TRP 237.A O no hydrogen 3.055 N/A HIS 249.A N SER 254.A O no hydrogen 2.842 N/A LEU 253.A N ASP 250.A O no hydrogen 3.063 N/A SER 254.A N ASP 252.A OD1 no hydrogen 3.289 N/A SER 254.A OG ASP 252.A OD1 no hydrogen 3.151 N/A GLU 256.A N ILE 247.A O no hydrogen 3.180 N/A ILE 257.A N LEU 293.A O no hydrogen 2.930 N/A VAL 258.A N THR 245.A O no hydrogen 3.020 N/A LYS 259.A N ASN 291.A O no hydrogen 2.905 N/A LYS 259.A NZ THR 140.A O no hydrogen 2.981 N/A LYS 259.A NZ GLU 243.A O no hydrogen 2.953 N/A THR 261.A N ALA 289.A O no hydrogen 2.877 N/A THR 261.A OG1 GLU 288.A O no hydrogen 2.819 N/A LEU 263.A N THR 261.A OG1 no hydrogen 3.014 N/A ALA 264.A N THR 261.A O no hydrogen 3.310 N/A THR 266.A OG1 LEU 263.A O no hydrogen 3.461 N/A SER 267.A OG ALA 264.A O no hydrogen 3.357 N/A SER 267.A OG SER 286.A OG no hydrogen 2.993 N/A ILE 272.A N THR 279.A O no hydrogen 3.274 N/A ALA 274.A N GLY 277.A O no hydrogen 2.878 N/A GLY 277.A N ALA 274.A O no hydrogen 3.236 N/A THR 279.A N ILE 272.A O no hydrogen 3.118 N/A LYS 280.A NZ PRO 269.A O no hydrogen 2.890 N/A MET 282.A N THR 279.A OG1 no hydrogen 3.108 N/A ALA 283.A N LYS 280.A O no hydrogen 3.192 N/A SER 286.A OG SER 267.A OG no hydrogen 2.993 N/A GLU 288.A N GLU 288.A OE1 no hydrogen 2.835 N/A ALA 289.A N SER 286.A O no hydrogen 2.944 N/A ASN 291.A N LYS 259.A O no hydrogen 2.825 N/A LEU 293.A N ILE 257.A O no hydrogen 2.783 N/A ALA 299.A N LEU 130.A O no hydrogen 3.014 N/A TYR 306.A OH HIS 18.A ND1 no hydrogen 2.691 N/A ASN 307.A N SER 304.A OG no hydrogen 3.244 N/A ASN 308.A N SER 304.A O no hydrogen 2.912 N/A ASN 308.A ND2 GLU 318.A O no hydrogen 3.274 N/A PHE 309.A N PHE 305.A O no hydrogen 2.880 N/A VAL 310.A N TYR 306.A O no hydrogen 3.132 N/A ASP 311.A N ASN 307.A O no hydrogen 2.970 N/A VAL 312.A N ASN 308.A O no hydrogen 2.866 N/A LEU 313.A N PHE 309.A O no hydrogen 2.952 N/A ASN 314.A N VAL 310.A O no hydrogen 2.818 N/A ASN 315.A N VAL 312.A O no hydrogen 3.013 N/A THR 316.A N ASP 311.A O no hydrogen 2.864 N/A THR 316.A OG1 ASP 311.A O no hydrogen 3.194 N/A SER 317.A OG GLU 318.A O no hydrogen 3.268 N/A ILE 320.A N ASN 308.A OD1 no hydrogen 2.942 N/A GLN 322.A N GLU 325.A OE1 no hydrogen 3.203 N/A ASN 323.A ND2 PHE 117.A O no hydrogen 2.893 N/A VAL 326.A N GLN 322.A O no hydrogen 3.151 N/A TYR 327.A N ASN 323.A O no hydrogen 2.852 N/A GLN 328.A N GLU 324.A O no hydrogen 3.158 N/A GLN 328.A NE2 GLU 324.A OE1.B no hydrogen 2.818 N/A VAL 329.A N GLU 325.A O no hydrogen 3.061 N/A LEU 330.A N VAL 326.A O no hydrogen 3.033 N/A LYS 331.A N TYR 327.A O no hydrogen 2.929 N/A LEU 332.A N GLN 328.A O no hydrogen 2.967 N/A ILE 333.A N VAL 329.A O no hydrogen 2.877 N/A GLU 334.A N LEU 330.A O no hydrogen 3.034 N/A ALA 335.A N LYS 331.A O no hydrogen 2.977 N/A ILE 336.A N LEU 332.A O no hydrogen 2.880 N/A PHE 337.A N ILE 333.A O no hydrogen 2.992 N/A GLU 338.A N GLU 334.A O no hydrogen 3.020 N/A ALA 339.A N ALA 335.A O no hydrogen 2.827 N/A ALA 340.A N ILE 336.A O no hydrogen 2.972 N/A GLU 341.A N PHE 337.A O no hydrogen 2.969 N/A THR 342.A N GLU 338.A O no hydrogen 2.951 N/A THR 342.A OG1 GLU 338.A O no hydrogen 2.792 N/A ARG 344.A N ALA 339.A O no hydrogen 3.135 N/A VAL 346.A N VAL 194.A O no hydrogen 2.823 N/A SER 348.A N LYS 192.A O no hydrogen 2.924 N/A