Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7e12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N PHE 1.A O no hydrogen 3.086 N/A ALA 5.A N PHE 1.A O no hydrogen 2.957 N/A PHE 9.A N ALA 5.A O no hydrogen 3.203 N/A LEU 10.A N LYS 6.A O no hydrogen 3.315 N/A LYS 11.A N GLU 7.A O no hydrogen 2.975 N/A LYS 12.A N ASP 8.A O no hydrogen 3.197 N/A LYS 12.A NZ ASP 8.A OD1 no hydrogen 2.679 N/A LYS 12.A NZ ASP 8.A OD2 no hydrogen 3.335 N/A TRP 13.A N PHE 9.A O no hydrogen 2.893 N/A GLU 14.A N LEU 10.A O no hydrogen 3.356 N/A THR 20.A N SER 92.A O no hydrogen 3.082 N/A THR 20.A OG1 SER 92.A O no hydrogen 3.335 N/A GLN 22.A N GLN 25.A OE1 no hydrogen 2.919 N/A GLN 25.A N GLN 22.A O no hydrogen 3.262 N/A GLN 25.A NE2 HIS 45.A NE2 no hydrogen 3.602 N/A PHE 26.A N LEU 23.A O no hydrogen 3.360 N/A ASP 27.A N LYS 44.A O no hydrogen 2.836 N/A ILE 29.A N LEU 42.A O no hydrogen 3.209 N/A LEU 32.A N VAL 40.A O no hydrogen 2.645 N/A GLY 33.A N VAL 40.A O no hydrogen 3.080 N/A GLY 35.A N GLY 38.A O no hydrogen 3.142 N/A ARG 39.A N ILE 56.A O no hydrogen 3.088 N/A ARG 39.A NH2 THR 31.A OG1 no hydrogen 2.930 N/A ARG 39.A NH2 GLU 313.A O no hydrogen 3.184 N/A VAL 40.A N GLY 33.A O no hydrogen 2.814 N/A MET 41.A N MET 54.A O no hydrogen 3.090 N/A LEU 42.A N LYS 30.A O no hydrogen 2.528 N/A VAL 43.A N TYR 52.A O no hydrogen 2.649 N/A LYS 44.A N ASP 27.A O no hydrogen 2.893 N/A HIS 45.A N ASN 50.A O no hydrogen 2.718 N/A HIS 45.A ND1 SER 48.A OG no hydrogen 3.003 N/A LYS 46.A N GLN 25.A O no hydrogen 3.110 N/A SER 48.A N HIS 45.A ND1 no hydrogen 3.304 N/A SER 48.A OG HIS 45.A ND1 no hydrogen 3.003 N/A GLY 49.A N HIS 45.A O no hydrogen 2.697 N/A ASN 50.A N SER 48.A OG no hydrogen 3.355 N/A TYR 52.A N VAL 43.A O no hydrogen 2.525 N/A ALA 53.A N MET 103.A O no hydrogen 3.056 N/A MET 54.A N MET 41.A O no hydrogen 2.967 N/A LYS 55.A N MET 101.A O no hydrogen 2.728 N/A LYS 55.A NZ GLU 74.A OE2 no hydrogen 3.266 N/A ILE 56.A N ARG 39.A O no hydrogen 2.714 N/A LEU 57.A N LEU 99.A O no hydrogen 3.019 N/A ASP 58.A N PHE 37.A O no hydrogen 2.923 N/A LYS 59.A N SER 97.A O no hydrogen 2.837 N/A LYS 59.A NZ ASP 95.A O no hydrogen 3.011 N/A LYS 59.A NZ LYS 323.A O no hydrogen 3.172 N/A VAL 62.A N ASP 58.A O no hydrogen 3.293 N/A VAL 63.A N LYS 59.A O no hydrogen 3.046 N/A LYS 64.A N GLN 60.A O no hydrogen 2.763 N/A LEU 65.A N LYS 61.A O no hydrogen 2.882 N/A LYS 66.A N VAL 63.A O no hydrogen 3.378 N/A GLN 67.A N VAL 62.A O no hydrogen 2.825 N/A GLN 67.A NE2 HIS 70.A ND1 no hydrogen 3.118 N/A THR 71.A N GLN 67.A O no hydrogen 3.105 N/A THR 71.A OG1 GLN 67.A O no hydrogen 3.304 N/A THR 71.A OG1 ILE 68.A O no hydrogen 2.894 N/A LEU 72.A N ILE 68.A O no hydrogen 2.928 N/A ASN 73.A N GLU 69.A O no hydrogen 3.050 N/A GLU 74.A N HIS 70.A O no hydrogen 3.044 N/A LYS 75.A N THR 71.A O no hydrogen 3.176 N/A ARG 76.A N LEU 72.A O no hydrogen 3.163 N/A ARG 76.A NE TRP 13.A O no hydrogen 2.564 N/A ARG 76.A NH2 TRP 13.A O no hydrogen 2.566 N/A ILE 77.A N ASN 73.A O no hydrogen 2.835 N/A LEU 78.A N GLU 74.A O no hydrogen 3.209 N/A GLN 79.A N LYS 75.A O no hydrogen 3.148 N/A GLN 79.A NE2 LYS 12.A O no hydrogen 3.238 N/A ALA 80.A N ILE 77.A O no hydrogen 2.822 N/A ASN 82.A N TYR 139.A OH no hydrogen 2.830 N/A LEU 86.A N PHE 83.A O no hydrogen 3.078 N/A VAL 87.A N VAL 165.A O no hydrogen 2.902 N/A GLU 90.A N VAL 102.A O no hydrogen 2.818 N/A PHE 91.A N VAL 102.A O no hydrogen 3.153 N/A SER 92.A N THR 20.A OG1 no hydrogen 3.025 N/A PHE 93.A N TYR 100.A O no hydrogen 3.193 N/A LYS 94.A NZ PHE 328.A O no hydrogen 2.359 N/A ASP 95.A N ASN 98.A O no hydrogen 3.123 N/A SER 97.A N ASP 95.A OD1 no hydrogen 3.374 N/A ASN 98.A N ASP 95.A OD1 no hydrogen 2.874 N/A ASN 98.A ND2 TYR 100.A OH no hydrogen 3.034 N/A LEU 99.A N LEU 57.A O no hydrogen 2.810 N/A TYR 100.A N PHE 93.A O no hydrogen 3.015 N/A TYR 100.A OH ASP 95.A OD1 no hydrogen 3.311 N/A TYR 100.A OH ASP 95.A OD2 no hydrogen 2.521 N/A MET 101.A N LYS 55.A O no hydrogen 2.999 N/A VAL 102.A N PHE 91.A O no hydrogen 2.815 N/A MET 103.A N ALA 53.A O no hydrogen 2.816 N/A GLU 104.A N LYS 88.A O no hydrogen 3.124 N/A TYR 105.A OH ASP 305.A O no hydrogen 2.678 N/A MET 111.A N LEU 155.A O no hydrogen 2.741 N/A PHE 112.A N PRO 152.A O no hydrogen 3.300 N/A HIS 114.A NE2 GLY 108.A O no hydrogen 2.851 N/A LEU 115.A N MET 111.A O no hydrogen 2.831 N/A ARG 116.A N PHE 112.A O no hydrogen 3.021 N/A ARG 116.A NH2 GLU 212.A OE2 no hydrogen 2.817 N/A ARG 117.A N SER 113.A O no hydrogen 2.982 N/A ARG 117.A NE HIS 114.A ND1 no hydrogen 3.221 N/A ILE 118.A N HIS 114.A O no hydrogen 3.075 N/A GLY 119.A N LEU 115.A O no hydrogen 2.869 N/A PHE 121.A N MET 213.A O no hydrogen 2.871 N/A HIS 125.A NE2 TYR 129.A OH no hydrogen 3.107 N/A ALA 126.A N SER 122.A O no hydrogen 2.731 N/A ARG 127.A N GLU 123.A O no hydrogen 2.707 N/A ARG 127.A NH1 TRP 278.A O no hydrogen 3.137 N/A PHE 128.A N PRO 124.A O no hydrogen 2.968 N/A TYR 129.A OH HIS 125.A NE2 no hydrogen 3.107 N/A ALA 130.A N ALA 126.A O no hydrogen 3.093 N/A ALA 131.A N ARG 127.A O no hydrogen 3.048 N/A GLN 132.A NE2 PHE 128.A O no hydrogen 2.952 N/A ILE 133.A N TYR 129.A O no hydrogen 3.190 N/A VAL 134.A N ALA 130.A O no hydrogen 2.829 N/A LEU 135.A N ALA 131.A O no hydrogen 3.062 N/A THR 136.A N GLN 132.A O no hydrogen 2.969 N/A THR 136.A OG1 GLN 132.A O no hydrogen 2.797 N/A PHE 137.A N ILE 133.A O no hydrogen 2.853 N/A GLU 138.A N VAL 134.A O no hydrogen 2.974 N/A TYR 139.A N LEU 135.A O no hydrogen 3.078 N/A LEU 140.A N THR 136.A O no hydrogen 2.867 N/A HIS 141.A N PHE 137.A O no hydrogen 3.003 N/A HIS 141.A NE2 ASP 202.A OD2 no hydrogen 3.166 N/A SER 142.A N GLU 138.A O no hydrogen 3.223 N/A SER 142.A OG GLU 138.A O no hydrogen 2.603 N/A ASP 144.A N HIS 141.A O no hydrogen 3.031 N/A LEU 145.A N LEU 140.A O no hydrogen 2.928 N/A ILE 146.A N LYS 172.A O no hydrogen 2.903 N/A TYR 147.A N ASP 202.A OD2 no hydrogen 3.122 N/A TYR 147.A OH ASP 149.A O no hydrogen 3.415 N/A TYR 147.A OH THR 166.A O no hydrogen 2.569 N/A TYR 147.A OH ASP 167.A O no hydrogen 3.271 N/A ARG 148.A NE PHE 170.A O no hydrogen 3.059 N/A ARG 148.A NH1 TYR 197.A OH no hydrogen 2.961 N/A ARG 148.A NH2 PHE 170.A O no hydrogen 2.936 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.603 N/A ASN 154.A N LYS 151.A O no hydrogen 2.887 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.844 N/A ASN 154.A ND2 ASP 149.A OD2 no hydrogen 3.044 N/A LEU 155.A N PRO 152.A O no hydrogen 3.315 N/A LEU 156.A N GLN 164.A O no hydrogen 2.971 N/A ILE 157.A N GLY 109.A O no hydrogen 2.992 N/A ASP 158.A N TYR 162.A O no hydrogen 2.905 N/A GLY 161.A N ASP 158.A O no hydrogen 3.189 N/A TYR 162.A N ASP 158.A OD1 no hydrogen 2.565 N/A TYR 162.A OH VAL 292.A O no hydrogen 2.665 N/A ILE 163.A N GLN 132.A OE1 no hydrogen 2.544 N/A GLN 164.A N LEU 156.A O no hydrogen 2.639 N/A GLN 164.A NE2 ILE 163.A O no hydrogen 3.480 N/A VAL 165.A N PHE 85.A O no hydrogen 2.724 N/A THR 166.A N ASN 154.A O no hydrogen 3.096 N/A ASP 167.A N THR 166.A OG1 no hydrogen 2.560 N/A ALA 171.A N PHE 168.A O no hydrogen 3.450 N/A LYS 172.A N ILE 146.A O no hydrogen 3.329 N/A LYS 172.A NZ THR 178.A OG1 no hydrogen 2.813 N/A VAL 174.A N ASP 144.A O no hydrogen 2.922 N/A THR 178.A N TYR 197.A O no hydrogen 3.016 N/A TRP 179.A N THR 178.A OG1 no hydrogen 2.791 N/A THR 183.A OG1 ASP 149.A OD1 no hydrogen 2.651 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.846 N/A TYR 186.A N THR 183.A O no hydrogen 2.692 N/A TYR 186.A OH GLU 212.A OE1 no hydrogen 2.265 N/A LEU 187.A N PRO 184.A O no hydrogen 3.496 N/A GLU 190.A N GLU 190.A OE2 no hydrogen 2.807 N/A ILE 191.A N ALA 188.A O no hydrogen 2.961 N/A ILE 192.A N ALA 188.A O no hydrogen 3.319 N/A LEU 193.A N PRO 189.A O no hydrogen 3.142 N/A SER 194.A N ILE 191.A O no hydrogen 3.405 N/A LYS 195.A N GLU 190.A O no hydrogen 3.170 N/A TYR 197.A N THR 178.A O no hydrogen 3.219 N/A ASN 198.A ND2 ASN 265.A OD1 no hydrogen 2.869 N/A ALA 200.A N ASN 198.A OD1 no hydrogen 3.270 N/A VAL 201.A N ASN 198.A O no hydrogen 3.531 N/A ASP 202.A N LYS 199.A O no hydrogen 3.250 N/A TRP 204.A N ALA 200.A O no hydrogen 3.339 N/A ALA 205.A N VAL 201.A O no hydrogen 3.012 N/A LEU 206.A N ASP 202.A O no hydrogen 2.933 N/A GLY 207.A N TRP 203.A O no hydrogen 3.030 N/A VAL 208.A N TRP 204.A O no hydrogen 3.105 N/A LEU 209.A N ALA 205.A O no hydrogen 3.041 N/A ILE 210.A N LEU 206.A O no hydrogen 2.929 N/A TYR 211.A N GLY 207.A O no hydrogen 3.045 N/A TYR 211.A OH ARG 238.A O no hydrogen 2.527 N/A GLU 212.A N VAL 208.A O no hydrogen 2.972 N/A MET 213.A N LEU 209.A O no hydrogen 2.945 N/A ALA 214.A N ILE 210.A O no hydrogen 3.124 N/A ALA 215.A N TYR 211.A O no hydrogen 2.916 N/A GLY 216.A N GLU 212.A O no hydrogen 2.853 N/A GLN 227.A N GLN 224.A O no hydrogen 3.181 N/A TYR 229.A N PRO 225.A O no hydrogen 3.110 N/A GLU 230.A N ILE 226.A O no hydrogen 3.228 N/A LYS 231.A N GLN 227.A O no hydrogen 3.187 N/A LYS 231.A N ILE 228.A O no hydrogen 3.087 N/A LYS 231.A NZ PHE 221.A O no hydrogen 3.221 N/A ILE 232.A N ILE 228.A O no hydrogen 2.959 N/A VAL 233.A N TYR 229.A O no hydrogen 3.181 N/A SER 234.A OG LYS 231.A O no hydrogen 3.332 N/A LYS 236.A N SER 234.A OG no hydrogen 3.229 N/A PHE 243.A N PRO 240.A O no hydrogen 3.344 N/A SER 244.A N GLU 123.A OE1 no hydrogen 3.006 N/A SER 244.A OG GLU 123.A OE2 no hydrogen 3.503 N/A LEU 247.A N SER 244.A OG no hydrogen 2.295 N/A LYS 248.A N SER 244.A O no hydrogen 2.862 N/A ASP 249.A N SER 245.A O no hydrogen 3.087 N/A LEU 250.A N ASP 246.A O no hydrogen 3.424 N/A LEU 251.A N LEU 247.A O no hydrogen 3.021 N/A ARG 252.A N LYS 248.A O no hydrogen 2.981 N/A ASN 253.A N ASP 249.A O no hydrogen 3.184 N/A ASN 253.A N LEU 250.A O no hydrogen 3.078 N/A LEU 254.A N LEU 250.A O no hydrogen 2.915 N/A LEU 255.A N LEU 251.A O no hydrogen 2.720 N/A ASP 258.A N GLN 256.A OE1 no hydrogen 3.276 N/A THR 260.A N ASP 258.A OD1 no hydrogen 3.281 N/A LYS 261.A N ASP 258.A O no hydrogen 2.909 N/A ARG 262.A NE GLN 256.A O no hydrogen 2.962 N/A ARG 262.A NH1 GLU 190.A OE1 no hydrogen 3.003 N/A ARG 262.A NH1 ALA 200.A O no hydrogen 2.787 N/A ARG 262.A NH2 GLU 190.A OE1 no hydrogen 3.136 N/A ARG 262.A NH2 GLU 190.A OE2 no hydrogen 2.852 N/A ARG 262.A NH2 GLN 256.A O no hydrogen 3.236 N/A PHE 263.A N ASN 253.A O no hydrogen 3.073 N/A ASN 265.A N ARG 262.A O no hydrogen 3.130 N/A ASN 265.A ND2 LEU 259.A O no hydrogen 2.411 N/A GLY 269.A N LEU 266.A O no hydrogen 3.182 N/A ASN 271.A N ASN 268.A O no hydrogen 3.308 N/A ASN 271.A ND2 ASN 268.A O no hydrogen 3.237 N/A ASP 272.A N GLY 269.A O no hydrogen 3.267 N/A ILE 273.A N VAL 270.A O no hydrogen 3.047 N/A LYS 274.A N VAL 270.A O no hydrogen 2.976 N/A LYS 274.A NZ GLU 138.A OE2 no hydrogen 3.227 N/A ASN 275.A N ASN 271.A O no hydrogen 2.928 N/A HIS 276.A N ILE 273.A O no hydrogen 3.161 N/A HIS 276.A NE2 ASP 249.A OD2 no hydrogen 2.762 N/A TRP 278.A N HIS 276.A ND1 no hydrogen 3.036 N/A TRP 278.A NE1 GLU 123.A OE2 no hydrogen 2.972 N/A PHE 279.A N HIS 276.A O no hydrogen 3.056 N/A ALA 280.A N LYS 277.A O no hydrogen 3.165 N/A THR 282.A N PHE 279.A O no hydrogen 3.270 N/A ILE 287.A N ASP 283.A O no hydrogen 2.983 N/A TYR 288.A N TRP 284.A O no hydrogen 2.982 N/A GLN 289.A N ILE 285.A O no hydrogen 2.900 N/A ARG 290.A N ILE 287.A O no hydrogen 3.026 N/A ARG 290.A NH2 ASP 158.A OD2 no hydrogen 2.777 N/A LYS 291.A N ALA 286.A O no hydrogen 2.795 N/A VAL 292.A N TYR 162.A OH no hydrogen 3.033 N/A ASP 305.A N GLY 302.A O no hydrogen 3.371 N/A SER 307.A OG ASP 305.A OD1 no hydrogen 2.786 N/A SER 307.A OG ASP 305.A OD2 no hydrogen 3.429 N/A ASN 308.A ND2 ALA 107.A O no hydrogen 2.869 N/A ASN 308.A ND2 LYS 299.A O no hydrogen 3.047 N/A PHE 309.A N THR 306.A O no hydrogen 3.202 N/A LYS 323.A N ASN 96.A O no hydrogen 2.959 N/A THR 329.A OG1 LYS 326.A O no hydrogen 3.509 N/A