Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ems_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ILE 19.A O no hydrogen 2.881 N/A VAL 6.A N PHE 17.A O no hydrogen 3.074 N/A ARG 7.A N LEU 75.A O no hydrogen 2.760 N/A ARG 7.A NE GLU 14.A OE1 no hydrogen 2.492 N/A VAL 8.A N LEU 15.A O no hydrogen 2.908 N/A THR 9.A N PHE 77.A O no hydrogen 3.049 N/A THR 10.A N ALA 13.A O no hydrogen 2.602 N/A THR 10.A OG1 ALA 13.A O no hydrogen 3.189 N/A LEU 15.A N VAL 8.A O no hydrogen 2.752 N/A PHE 17.A N VAL 6.A O no hydrogen 3.016 N/A ILE 19.A N ILE 4.A O no hydrogen 2.914 N/A GLN 20.A N THR 23.A OG1 no hydrogen 3.101 N/A THR 23.A N GLN 20.A O no hydrogen 3.317 N/A THR 24.A N GLN 27.A OE1 no hydrogen 3.089 N/A GLY 25.A N LYS 62.A O no hydrogen 3.399 N/A LYS 26.A N LEU 60.A O no hydrogen 2.784 N/A LYS 26.A NZ ASP 30.A OD2 no hydrogen 3.329 N/A GLN 27.A N THR 24.A OG1 no hydrogen 3.210 N/A LEU 28.A N THR 24.A O no hydrogen 3.436 N/A PHE 29.A N GLY 25.A O no hydrogen 3.043 N/A ASP 30.A N LYS 26.A O no hydrogen 2.817 N/A GLN 31.A N GLN 27.A O no hydrogen 2.977 N/A GLN 31.A NE2 GLN 31.A O no hydrogen 3.141 N/A GLN 31.A NE2 THR 35.A OG1 no hydrogen 2.828 N/A VAL 32.A N LEU 28.A O no hydrogen 2.935 N/A VAL 33.A N PHE 29.A O no hydrogen 2.803 N/A LYS 34.A N ASP 30.A O no hydrogen 3.031 N/A THR 35.A N GLN 31.A O no hydrogen 2.726 N/A THR 35.A OG1 GLN 31.A O no hydrogen 3.317 N/A VAL 36.A N VAL 32.A O no hydrogen 2.880 N/A GLY 37.A N VAL 33.A O no hydrogen 2.822 N/A LEU 38.A N VAL 33.A O no hydrogen 3.080 N/A VAL 41.A N ARG 39.A O no hydrogen 2.640 N/A PHE 43.A N GLU 40.A O no hydrogen 3.423 N/A PHE 44.A N VAL 41.A O no hydrogen 3.017 N/A GLY 45.A N ARG 80.A O no hydrogen 3.324 N/A GLN 47.A N LYS 78.A O no hydrogen 3.155 N/A TYR 48.A N THR 56.A O no hydrogen 2.867 N/A ASP 50.A N TYR 54.A O no hydrogen 2.930 N/A SER 51.A N ASP 68.A O no hydrogen 3.050 N/A SER 51.A OG ASP 68.A OD1 no hydrogen 2.155 N/A SER 51.A OG ASP 68.A OD2 no hydrogen 2.997 N/A TYR 54.A N ASP 50.A OD1 no hydrogen 2.831 N/A TYR 54.A N LYS 52.A O no hydrogen 2.907 N/A THR 56.A N TYR 48.A O no hydrogen 2.917 N/A LEU 58.A N LEU 46.A O no hydrogen 2.839 N/A LYS 59.A N GLN 67.A OE1 no hydrogen 2.944 N/A VAL 64.A N THR 23.A O no hydrogen 2.896 N/A THR 65.A OG1 PRO 21.A O no hydrogen 2.471 N/A GLN 67.A NE2 LYS 59.A O no hydrogen 2.887 N/A GLN 67.A NE2 LYS 63.A O no hydrogen 3.036 N/A VAL 69.A N GLN 67.A O no hydrogen 2.677 N/A LYS 70.A N VAL 49.A O no hydrogen 2.895 N/A LEU 75.A N ASN 5.A O no hydrogen 2.975 N/A PHE 77.A N ARG 7.A O no hydrogen 2.792 N/A LYS 78.A N GLN 47.A O no hydrogen 3.039 N/A PHE 79.A N THR 9.A O no hydrogen 2.804 N/A ARG 80.A N GLY 45.A O no hydrogen 3.228 N/A ALA 81.A N GLN 104.A OE1 no hydrogen 2.556 N/A LYS 82.A N PHE 43.A O no hydrogen 2.552 N/A PHE 83.A N PHE 43.A O no hydrogen 3.016 N/A GLU 86.A N GLU 91.A OE1 no hydrogen 3.194 N/A VAL 88.A N GLN 195.A OE1 no hydrogen 2.644 N/A SER 89.A N ASP 87.A OD2 no hydrogen 2.910 N/A GLU 90.A N ASP 87.A O no hydrogen 3.316 N/A ILE 93.A N GLU 40.A OE1 no hydrogen 3.205 N/A ILE 93.A N GLU 40.A OE2 no hydrogen 3.288 N/A GLN 94.A N GLU 40.A OE1 no hydrogen 3.334 N/A THR 97.A OG1 GLU 40.A OE1 no hydrogen 2.907 N/A GLN 98.A N GLN 94.A O no hydrogen 2.659 N/A ARG 99.A N GLU 95.A O no hydrogen 2.913 N/A LEU 100.A N ILE 96.A O no hydrogen 3.141 N/A PHE 102.A N GLN 98.A O no hydrogen 3.259 N/A LEU 103.A N ARG 99.A O no hydrogen 3.108 N/A GLN 104.A N LEU 100.A O no hydrogen 2.934 N/A GLN 104.A NE2 ALA 81.A O no hydrogen 3.001 N/A VAL 105.A N PHE 101.A O no hydrogen 2.751 N/A LYS 106.A N PHE 102.A O no hydrogen 2.802 N/A GLU 107.A N LEU 103.A O no hydrogen 3.102 N/A ALA 108.A N GLN 104.A O no hydrogen 3.315 N/A ILE 109.A N VAL 105.A O no hydrogen 3.067 N/A LEU 110.A N LYS 106.A O no hydrogen 2.916 N/A ASN 111.A N ALA 108.A O no hydrogen 3.315 N/A ASP 112.A N ILE 109.A O no hydrogen 3.098 N/A GLU 113.A N ALA 108.A O no hydrogen 2.864 N/A ILE 114.A N ALA 108.A O no hydrogen 3.307 N/A CYS 116.A SG PRO 117.A O no hydrogen 3.567 N/A ALA 121.A N PRO 117.A O no hydrogen 2.912 N/A VAL 122.A N PRO 118.A O no hydrogen 2.922 N/A LEU 123.A N GLU 119.A O no hydrogen 2.904 N/A LEU 124.A N THR 120.A O no hydrogen 2.813 N/A ALA 125.A N ALA 121.A O no hydrogen 2.793 N/A SER 126.A N VAL 122.A O no hydrogen 3.029 N/A SER 126.A OG LEU 123.A O no hydrogen 2.469 N/A SER 126.A OG HIS 178.A NE2 no hydrogen 2.508 N/A TYR 127.A N LEU 123.A O no hydrogen 3.103 N/A ALA 128.A N LEU 124.A O no hydrogen 3.142 N/A VAL 129.A N ALA 125.A O no hydrogen 2.746 N/A GLN 130.A N SER 126.A O no hydrogen 2.879 N/A GLN 130.A NE2 ASP 135.A OD2 no hydrogen 3.023 N/A GLN 130.A NE2 MET 181.A O no hydrogen 2.810 N/A ALA 131.A N TYR 127.A O no hydrogen 2.892 N/A LYS 132.A N ALA 128.A O no hydrogen 2.742 N/A LYS 132.A NZ TYR 133.A OH no hydrogen 3.152 N/A LYS 132.A NZ ASP 149.A OD1 no hydrogen 2.788 N/A LYS 132.A NZ ASP 149.A OD2 no hydrogen 3.486 N/A TYR 133.A N VAL 129.A O no hydrogen 3.201 N/A TYR 133.A OH ASP 149.A OD1 no hydrogen 3.253 N/A TYR 133.A OH ASP 149.A OD2 no hydrogen 2.416 N/A GLY 134.A N GLN 130.A O no hydrogen 2.687 N/A ILE 140.A N ASN 137.A O no hydrogen 3.291 N/A HIS 141.A N ASN 137.A O no hydrogen 3.147 N/A LYS 142.A N ILE 140.A O no hydrogen 2.935 N/A TYR 145.A OH HIS 175.A ND1 no hydrogen 2.784 N/A ALA 147.A N GLY 144.A O no hydrogen 3.071 N/A ASP 149.A N LEU 146.A O no hydrogen 3.435 N/A ARG 150.A NH1 GLU 107.A OE2 no hydrogen 3.477 N/A ARG 150.A NH2 LEU 110.A O no hydrogen 3.087 N/A ARG 150.A NH2 ASN 111.A OD1 no hydrogen 2.502 N/A GLN 154.A N ASP 112.A OD2 no hydrogen 3.242 N/A ARG 155.A N ASP 112.A OD1 no hydrogen 3.138 N/A LEU 157.A N GLN 154.A O no hydrogen 2.653 N/A GLU 158.A N GLN 154.A O no hydrogen 3.098 N/A HIS 160.A ND1 VAL 156.A O no hydrogen 3.002 N/A GLN 166.A N THR 163.A OG1 no hydrogen 3.227 N/A TRP 167.A N THR 163.A O no hydrogen 3.322 N/A GLU 168.A N LYS 164.A O no hydrogen 2.798 N/A GLU 169.A N GLU 165.A O no hydrogen 2.676 N/A ARG 170.A N GLN 166.A O no hydrogen 3.037 N/A ARG 170.A N TRP 167.A O no hydrogen 2.870 N/A ARG 170.A NH1 GLU 119.A OE1 no hydrogen 2.645 N/A ARG 170.A NH2 GLU 119.A OE1 no hydrogen 3.521 N/A ILE 171.A N TRP 167.A O no hydrogen 3.180 N/A GLN 172.A N GLU 168.A O no hydrogen 2.779 N/A GLN 172.A NE2 TYR 136.A OH no hydrogen 3.155 N/A ASN 173.A N GLU 169.A O no hydrogen 2.978 N/A ASN 173.A ND2 GLU 176.A OE2 no hydrogen 3.466 N/A TRP 174.A N ARG 170.A O no hydrogen 3.074 N/A HIS 175.A N ILE 171.A O no hydrogen 2.684 N/A HIS 175.A ND1 TYR 145.A OH no hydrogen 2.784 N/A HIS 175.A NE2 GLY 134.A O no hydrogen 2.812 N/A GLU 176.A N GLN 172.A O no hydrogen 3.184 N/A GLU 177.A N TRP 174.A O no hydrogen 2.785 N/A HIS 178.A N TRP 174.A O no hydrogen 3.426 N/A HIS 178.A N HIS 175.A O no hydrogen 3.309 N/A HIS 178.A NE2 SER 126.A OG no hydrogen 2.508 N/A GLY 180.A N ASP 135.A OD1 no hydrogen 3.238 N/A GLY 180.A N ASP 135.A OD2 no hydrogen 3.028 N/A GLU 184.A N GLU 184.A OE2 no hydrogen 2.383 N/A SER 186.A N LEU 182.A O no hydrogen 3.019 N/A SER 186.A OG TYR 127.A O no hydrogen 2.549 N/A MET 187.A N ARG 183.A O no hydrogen 2.807 N/A MET 188.A N GLU 184.A O no hydrogen 2.995 N/A GLU 189.A N ASP 185.A O no hydrogen 2.643 N/A TYR 190.A N SER 186.A O no hydrogen 3.195 N/A LEU 191.A N MET 187.A O no hydrogen 3.157 N/A LYS 192.A N MET 188.A O no hydrogen 2.753 N/A ILE 193.A N GLU 189.A O no hydrogen 3.337 N/A ALA 194.A N TYR 190.A O no hydrogen 2.993 N/A GLN 195.A N LEU 191.A O no hydrogen 2.830 N/A GLN 195.A NE2 LYS 192.A O no hydrogen 3.424 N/A ASP 196.A N ILE 193.A O no hydrogen 3.117 N/A LEU 197.A N ALA 194.A O no hydrogen 2.899 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.851 N/A TYR 200.A N LEU 197.A O no hydrogen 3.229 N/A VAL 202.A N MET 199.A O no hydrogen 3.052 N/A ASN 203.A N VAL 219.A O no hydrogen 3.074 N/A TYR 204.A OH LYS 232.A O no hydrogen 2.626 N/A PHE 205.A N LEU 217.A O no hydrogen 2.969 N/A ILE 207.A N LEU 215.A O no hydrogen 2.914 N/A LYS 208.A N TYR 269.A O no hydrogen 2.868 N/A ASN 209.A N THR 213.A O no hydrogen 3.216 N/A GLY 212.A N ASN 209.A OD1 no hydrogen 3.280 N/A THR 213.A N ASN 209.A OD1 no hydrogen 2.760 N/A THR 213.A OG1 ASN 209.A OD1 no hydrogen 3.046 N/A LEU 215.A N ILE 207.A O no hydrogen 2.784 N/A TRP 216.A N TYR 227.A O no hydrogen 3.276 N/A TRP 216.A NE1 HIS 229.A O no hydrogen 3.166 N/A LEU 217.A N PHE 205.A O no hydrogen 3.159 N/A GLY 218.A N ASN 225.A O no hydrogen 2.788 N/A VAL 219.A N ASN 203.A O no hydrogen 2.939 N/A ASP 220.A N GLY 223.A O no hydrogen 3.063 N/A LEU 222.A N ASP 220.A OD2 no hydrogen 2.807 N/A GLY 223.A N ASP 220.A OD2 no hydrogen 2.899 N/A LEU 224.A N PHE 239.A O no hydrogen 3.005 N/A ASN 225.A N GLY 218.A O no hydrogen 3.090 N/A ILE 226.A N ILE 237.A O no hydrogen 2.759 N/A TYR 227.A N TRP 216.A O no hydrogen 2.751 N/A ASP 231.A N GLU 228.A O no hydrogen 2.752 N/A LEU 233.A N ASP 231.A OD2 no hydrogen 3.103 N/A THR 234.A N ASP 231.A OD2 no hydrogen 2.920 N/A LYS 236.A N ILE 226.A O no hydrogen 2.881 N/A ILE 237.A N ILE 226.A O no hydrogen 3.242 N/A PHE 239.A N LEU 224.A O no hydrogen 2.965 N/A TRP 241.A N LEU 222.A O no hydrogen 3.020 N/A TRP 241.A NE1 ALA 221.A O no hydrogen 2.937 N/A GLU 243.A N PRO 240.A O no hydrogen 3.111 N/A ILE 244.A N TRP 241.A O no hydrogen 3.263 N/A ARG 245.A N LYS 257.A O no hydrogen 2.991 N/A SER 248.A N VAL 255.A O no hydrogen 3.398 N/A ASN 250.A N LYS 253.A O no hydrogen 2.900 N/A PHE 254.A N PHE 268.A O no hydrogen 3.291 N/A VAL 255.A N SER 248.A O no hydrogen 3.138 N/A ILE 256.A N PHE 266.A O no hydrogen 2.767 N/A LYS 257.A N ASN 246.A O no hydrogen 3.057 N/A ILE 259.A N GLU 243.A O no hydrogen 2.775 N/A ALA 263.A N ASP 260.A O no hydrogen 3.047 N/A PHE 266.A N ILE 256.A O no hydrogen 3.117 N/A PHE 268.A N PHE 254.A O no hydrogen 3.219 N/A TYR 269.A N LYS 208.A O no hydrogen 2.481 N/A ALA 270.A N LYS 252.A O no hydrogen 3.011 N/A ARG 274.A NH1 ASP 50.A OD2 no hydrogen 2.479 N/A ARG 274.A NH1 ASP 68.A OD1 no hydrogen 3.201 N/A ARG 274.A NH2 ASP 68.A OD1 no hydrogen 3.276 N/A ILE 275.A N ARG 272.A O no hydrogen 2.916 N/A ASN 276.A ND2 ASP 251.A O no hydrogen 3.320 N/A LYS 277.A N LEU 273.A O no hydrogen 3.331 N/A ARG 278.A N ARG 274.A O no hydrogen 3.081 N/A ARG 278.A NH1 ASP 50.A OD2 no hydrogen 2.841 N/A ARG 278.A NH2 ASP 50.A OD2 no hydrogen 3.079 N/A ILE 279.A N ILE 275.A O no hydrogen 2.813 N/A LEU 280.A N ASN 276.A O no hydrogen 3.041 N/A ALA 281.A N LYS 277.A O no hydrogen 2.893 N/A LEU 282.A N ARG 278.A O no hydrogen 3.055 N/A CYS 283.A N ILE 279.A O no hydrogen 3.011 N/A CYS 283.A SG ILE 279.A O no hydrogen 3.190 N/A MET 284.A N LEU 280.A O no hydrogen 3.056 N/A GLY 285.A N ALA 281.A O no hydrogen 3.296 N/A ASN 286.A N LEU 282.A O no hydrogen 3.022 N/A HIS 287.A N CYS 283.A O no hydrogen 3.124 N/A GLU 288.A N MET 284.A O no hydrogen 2.629 N/A LEU 289.A N GLY 285.A O no hydrogen 3.013 N/A TYR 290.A N ASN 286.A O no hydrogen 2.659 N/A MET 291.A N HIS 287.A O no hydrogen 3.047 N/A MET 291.A N GLU 288.A O no hydrogen 3.160 N/A ARG 292.A N GLU 288.A O no hydrogen 3.142 N/A ARG 293.A N LEU 289.A O no hydrogen 3.077 N/A ARG 293.A NE GLU 91.A OE2 no hydrogen 3.223 N/A ARG 293.A NH1 GLU 86.A OE2 no hydrogen 2.894 N/A ARG 294.A N MET 291.A O no hydrogen 2.643 N/A ARG 294.A NH1 GLU 86.A OE2 no hydrogen 2.741 N/A ARG 294.A NH1 TYR 290.A O no hydrogen 2.675 N/A ARG 294.A NH2 GLU 86.A OE1 no hydrogen 3.039 N/A ARG 294.A NH2 GLU 86.A OE2 no hydrogen 2.944 N/A GLN 302.A N THR 298.A O no hydrogen 2.825 N/A GLN 303.A N ILE 299.A O no hydrogen 2.989 N/A MET 304.A N GLU 300.A O no hydrogen 3.101 N/A MET 304.A N VAL 301.A O no hydrogen 3.221 N/A LYS 305.A N VAL 301.A O no hydrogen 3.035 N/A LYS 305.A NZ ASP 297.A OD2 no hydrogen 2.997 N/A ALA 306.A N GLN 302.A O no hydrogen 2.964 N/A GLN 307.A N GLN 303.A O no hydrogen 2.831 N/A ALA 308.A N MET 304.A O no hydrogen 2.793 N/A ARG 309.A N LYS 305.A O no hydrogen 3.108 N/A ARG 309.A N ALA 306.A O no hydrogen 2.752 N/A ARG 309.A NE LYS 305.A O no hydrogen 3.258 N/A ASP 311.A N ALA 308.A O no hydrogen 3.206 N/A