Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ccl_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NE PRO 6.A O no hydrogen 3.465 N/A ARG 7.A NE GLY 9.A O no hydrogen 2.834 N/A ARG 7.A NH2 THR 250.A O no hydrogen 2.896 N/A GLY 12.A N SER 10.A OG no hydrogen 2.980 N/A ARG 16.A NH1 SER 10.A O no hydrogen 2.599 N/A LYS 17.A N PRO 15.A O no hydrogen 2.917 N/A SER 19.A N TYR 259.A O no hydrogen 2.994 N/A SER 19.A OG SER 21.A O no hydrogen 3.002 N/A ARG 25.A N GLN 261.A OE1 no hydrogen 2.877 N/A ARG 25.A NH1 VAL 161.A O no hydrogen 3.199 N/A GLY 37.A N GLY 167.A O no hydrogen 2.775 N/A GLN 39.A N ARG 165.A O no hydrogen 2.911 N/A PHE 41.A N PHE 311.A O no hydrogen 3.192 N/A GLY 43.A N VAL 309.A O no hydrogen 3.183 N/A TYR 44.A N GLU 75.A O no hydrogen 2.924 N/A TYR 44.A OH THR 146.A OG1 no hydrogen 2.778 N/A TYR 44.A OH ASP 160.A OD2 no hydrogen 2.609 N/A LYS 45.A N ARG 307.A O no hydrogen 3.023 N/A LYS 45.A NZ VAL 301.A O no hydrogen 2.892 N/A LYS 45.A NZ GLY 303.A O no hydrogen 2.924 N/A ALA 46.A N VAL 73.A O no hydrogen 2.870 N/A GLY 47.A N VAL 73.A O no hydrogen 3.331 N/A THR 49.A N VAL 71.A O no hydrogen 2.930 N/A VAL 51.A N VAL 69.A O no hydrogen 2.772 N/A VAL 52.A N TYR 329.A O no hydrogen 2.657 N/A LEU 53.A N GLU 67.A O no hydrogen 2.732 N/A VAL 54.A N GLU 326.A O no hydrogen 3.201 N/A ASN 55.A N MET 65.A O no hydrogen 3.091 N/A ASN 55.A ND2 SER 60.A OG no hydrogen 3.309 N/A ASN 55.A ND2 GLU 67.A OE2 no hydrogen 2.949 N/A SER 60.A N GLU 57.A O no hydrogen 3.262 N/A ARG 62.A N SER 60.A OG no hydrogen 3.082 N/A ARG 62.A NH2 GLU 66.A O no hydrogen 2.618 N/A GLU 63.A N SER 60.A O no hydrogen 3.118 N/A GLY 64.A N ASN 55.A O no hydrogen 3.155 N/A MET 65.A N ARG 62.A O no hydrogen 2.892 N/A VAL 69.A N VAL 51.A O no hydrogen 2.721 N/A VAL 71.A N THR 49.A O no hydrogen 2.721 N/A THR 72.A N VAL 297.A O no hydrogen 2.827 N/A THR 72.A OG1 GLY 299.A O no hydrogen 2.497 N/A VAL 73.A N GLY 47.A O no hydrogen 2.538 N/A ILE 74.A N THR 295.A O no hydrogen 2.878 N/A GLU 75.A N TYR 44.A O no hydrogen 2.970 N/A THR 76.A N PRO 293.A O no hydrogen 2.744 N/A THR 76.A OG1 THR 295.A OG1 no hydrogen 2.697 N/A MET 79.A N HIS 188.A O no hydrogen 2.892 N/A ARG 80.A N HIS 145.A O no hydrogen 3.158 N/A ALA 81.A N GLY 186.A O no hydrogen 2.619 N/A VAL 82.A N ILE 143.A O no hydrogen 2.943 N/A LEU 84.A N VAL 100.A O no hydrogen 2.862 N/A ARG 85.A N ARG 141.A O no hydrogen 2.974 N/A ARG 85.A NH1 GLU 163.A OE1 no hydrogen 2.722 N/A ALA 86.A N THR 98.A O no hydrogen 2.923 N/A TYR 87.A N ASP 139.A O no hydrogen 3.124 N/A TYR 87.A OH GLU 163.A OE1 no hydrogen 3.023 N/A TYR 87.A OH GLU 163.A OE2 no hydrogen 2.543 N/A GLU 88.A N ARG 95.A O no hydrogen 2.919 N/A ASP 89.A N ASP 136.A O no hydrogen 2.727 N/A THR 90.A N GLY 93.A O no hydrogen 3.187 N/A THR 90.A OG1 GLY 93.A O no hydrogen 2.756 N/A TYR 92.A N THR 90.A OG1 no hydrogen 3.112 N/A GLY 93.A N THR 90.A O no hydrogen 2.965 N/A ARG 95.A N GLU 88.A O no hydrogen 3.308 N/A LEU 97.A N ALA 86.A O no hydrogen 2.710 N/A VAL 100.A N LEU 84.A O no hydrogen 2.900 N/A TRP 101.A N HIS 119.A NE2 no hydrogen 3.180 N/A TRP 101.A NE1 GLU 99.A OE1 no hydrogen 2.765 N/A THR 102.A OG1 VAL 82.A O no hydrogen 3.547 N/A SER 107.A OG GLU 108.A OE1 no hydrogen 3.521 N/A LEU 109.A N HIS 106.A O no hydrogen 2.978 N/A ARG 111.A N GLU 108.A O no hydrogen 3.272 N/A THR 112.A N LEU 109.A O no hydrogen 3.236 N/A THR 112.A OG1 PRO 159.A O no hydrogen 3.201 N/A LEU 113.A N LEU 109.A O no hydrogen 3.106 N/A ALA 123.A N ASP 120.A OD1 no hydrogen 3.228 N/A ALA 124.A N ASP 120.A O no hydrogen 3.433 N/A GLU 125.A N PRO 121.A O no hydrogen 2.989 N/A GLU 126.A N ASP 122.A O no hydrogen 2.798 N/A GLN 127.A N ALA 123.A O no hydrogen 2.834 N/A ILE 128.A N ALA 124.A O no hydrogen 2.985 N/A ARG 129.A N GLU 125.A O no hydrogen 2.929 N/A ARG 129.A NH1 GLU 125.A OE2 no hydrogen 2.823 N/A ARG 129.A NH2 ASP 176.A OD1 no hydrogen 2.947 N/A ARG 129.A NH2 ASP 176.A OD2 no hydrogen 3.496 N/A ASP 130.A N GLU 126.A O no hydrogen 2.776 N/A ALA 131.A N GLN 127.A O no hydrogen 3.122 N/A HIS 132.A N ILE 128.A O no hydrogen 2.988 N/A GLU 133.A N ARG 129.A O no hydrogen 2.924 N/A ALA 134.A N ASP 130.A O no hydrogen 2.996 N/A GLY 135.A N HIS 132.A O no hydrogen 2.944 N/A ASP 136.A N ALA 131.A O no hydrogen 3.031 N/A GLY 138.A N TYR 87.A O no hydrogen 2.541 N/A ARG 141.A N ARG 85.A O no hydrogen 3.174 N/A ARG 141.A NE ASP 139.A OD1 no hydrogen 3.510 N/A ARG 141.A NE ASP 139.A OD2 no hydrogen 3.000 N/A LEU 142.A N THR 164.A O no hydrogen 2.734 N/A ILE 143.A N ALA 83.A O no hydrogen 3.056 N/A THR 144.A N MET 162.A O no hydrogen 2.803 N/A THR 144.A OG1 LEU 142.A O no hydrogen 3.276 N/A HIS 145.A N ARG 80.A O no hydrogen 3.015 N/A THR 146.A N ASP 160.A O no hydrogen 3.179 N/A THR 146.A OG1 TYR 44.A OH no hydrogen 2.778 N/A ALA 150.A N VAL 147.A O no hydrogen 2.876 N/A VAL 151.A N PRO 148.A O no hydrogen 3.199 N/A LYS 156.A NZ ASP 160.A OD1 no hydrogen 2.793 N/A LYS 156.A NZ ASP 160.A OD2 no hydrogen 3.037 N/A LYS 158.A NZ ARG 111.A O no hydrogen 3.269 N/A ASP 160.A N THR 146.A OG1 no hydrogen 3.240 N/A MET 162.A N THR 144.A O no hydrogen 2.623 N/A THR 164.A N LEU 142.A O no hydrogen 2.907 N/A ARG 165.A NE ASP 139.A OD2 no hydrogen 3.095 N/A ARG 165.A NH1 ASP 32.A OD1 no hydrogen 2.917 N/A ARG 165.A NH1 GLN 39.A OE1 no hydrogen 2.959 N/A ARG 165.A NH2 ASP 32.A OD1 no hydrogen 3.217 N/A ARG 165.A NH2 ASP 32.A OD2 no hydrogen 3.210 N/A VAL 166.A N LEU 140.A O no hydrogen 2.795 N/A GLY 167.A N GLY 37.A O no hydrogen 3.141 N/A SER 170.A OG ASP 173.A OD2 no hydrogen 3.109 N/A SER 172.A OG HIS 132.A NE2 no hydrogen 2.741 N/A ASP 173.A N SER 170.A OG no hydrogen 3.112 N/A ARG 174.A N SER 170.A O no hydrogen 3.011 N/A LEU 175.A N VAL 171.A O no hydrogen 3.110 N/A LEU 175.A N SER 172.A O no hydrogen 3.251 N/A ASP 176.A N SER 172.A O no hydrogen 3.135 N/A HIS 177.A N ASP 173.A O no hydrogen 2.922 N/A ALA 178.A N ARG 174.A O no hydrogen 2.888 N/A LEU 179.A N LEU 175.A O no hydrogen 2.994 N/A ASP 180.A N ASP 176.A O no hydrogen 2.993 N/A ILE 181.A N HIS 177.A O no hydrogen 3.256 N/A VAL 182.A N ALA 178.A O no hydrogen 3.133 N/A GLU 183.A N LEU 179.A O no hydrogen 2.877 N/A GLY 186.A N ILE 181.A O no hydrogen 3.173 N/A HIS 188.A N MET 79.A O no hydrogen 3.212 N/A HIS 188.A ND1 GLY 186.A O no hydrogen 2.751 N/A ALA 189.A N ASP 192.A OD1 no hydrogen 3.378 N/A ASP 192.A N ALA 189.A O no hydrogen 2.906 N/A ILE 193.A N MET 190.A O no hydrogen 3.183 N/A PHE 194.A N MET 190.A O no hydrogen 2.771 N/A GLY 197.A N LEU 269.A O no hydrogen 2.632 N/A GLU 198.A N ARG 195.A O no hydrogen 3.103 N/A ALA 200.A N LYS 267.A O no hydrogen 2.751 N/A ASP 201.A N ARG 312.A O no hydrogen 2.709 N/A VAL 202.A N GLU 264.A O no hydrogen 2.927 N/A ALA 203.A N ARG 310.A O no hydrogen 2.918 N/A GLY 204.A N ARG 262.A O no hydrogen 2.769 N/A THR 206.A N HIS 260.A O no hydrogen 2.736 N/A THR 206.A OG1 HIS 260.A O no hydrogen 3.066 N/A LYS 209.A N THR 257.A O no hydrogen 3.083 N/A GLN 212.A N GLY 255.A O no hydrogen 2.857 N/A GLN 212.A NE2 LYS 209.A O no hydrogen 2.781 N/A ARG 217.A N GLY 213.A O no hydrogen 2.828 N/A ARG 217.A NE GLN 256.A O no hydrogen 2.979 N/A ARG 217.A NH1 GLN 253.A O no hydrogen 2.853 N/A ARG 217.A NH2 GLN 256.A O no hydrogen 2.856 N/A TRP 218.A N PRO 214.A O no hydrogen 2.642 N/A TRP 218.A NE1 GLN 253.A O no hydrogen 2.959 N/A GLY 219.A N VAL 215.A O no hydrogen 2.877 N/A VAL 220.A N PRO 214.A O no hydrogen 3.494 N/A ARG 223.A N ARG 233.A O no hydrogen 2.866 N/A ARG 223.A NE ARG 235.A O no hydrogen 2.981 N/A ARG 223.A NH2 ARG 235.A O no hydrogen 3.384 N/A ARG 223.A NH2 ILE 236.A O no hydrogen 3.092 N/A HIS 227.A N LYS 224.A O no hydrogen 3.025 N/A ALA 228.A N GLY 225.A O no hydrogen 3.298 N/A ARG 229.A N LYS 226.A O no hydrogen 3.246 N/A GLN 230.A N HIS 227.A O no hydrogen 3.391 N/A GLN 230.A NE2 LYS 226.A O no hydrogen 2.627 N/A SER 245.A OG TRP 242.A O no hydrogen 3.298 N/A SER 245.A OG ASN 243.A OD1 no hydrogen 3.422 N/A ARG 246.A N PRO 244.A O no hydrogen 2.747 N/A VAL 251.A N ARG 248.A O no hydrogen 3.304 N/A GLY 255.A N GLN 212.A O no hydrogen 3.116 N/A THR 257.A N GLY 210.A O no hydrogen 2.971 N/A THR 257.A OG1 GLY 210.A O no hydrogen 3.436 N/A TYR 259.A N LYS 207.A O no hydrogen 3.203 N/A TYR 259.A OH GLU 22.A OE1 no hydrogen 2.884 N/A HIS 260.A N THR 206.A OG1 no hydrogen 2.907 N/A GLN 261.A NE2 ARG 25.A O no hydrogen 3.298 N/A ARG 262.A N GLY 204.A O no hydrogen 2.783 N/A ARG 262.A NH1 GLN 261.A O no hydrogen 3.059 N/A GLU 264.A N VAL 202.A O no hydrogen 2.722 N/A ASN 266.A N ASP 201.A OD1 no hydrogen 3.149 N/A ASN 266.A ND2 ARG 316.A O no hydrogen 2.964 N/A LYS 267.A N ALA 200.A O no hydrogen 2.664 N/A LYS 267.A NZ SER 300.A O no hydrogen 2.681 N/A ARG 268.A NH1 ASP 56.A OD2 no hydrogen 3.288 N/A ARG 268.A NH2 ARG 322.A O no hydrogen 2.773 N/A LEU 269.A N GLU 198.A O no hydrogen 2.980 N/A ILE 270.A N LEU 296.A O no hydrogen 2.878 N/A GLY 273.A N TYR 294.A O no hydrogen 3.064 N/A GLY 275.A N GLY 292.A O no hydrogen 2.778 N/A THR 279.A N ASP 276.A O no hydrogen 3.279 N/A THR 279.A OG1 ASP 276.A O no hydrogen 3.548 N/A THR 279.A OG1 VAL 290.A O no hydrogen 2.488 N/A ASP 281.A N ASN 332.A O no hydrogen 2.777 N/A GLY 283.A N VAL 280.A O no hydrogen 3.019 N/A PHE 284.A N GLY 288.A O no hydrogen 2.831 N/A TYR 287.A N PHE 284.A O no hydrogen 3.135 N/A TYR 287.A OH GLU 75.A OE2 no hydrogen 2.662 N/A GLY 288.A N PHE 284.A O no hydrogen 3.139 N/A GLY 292.A N GLY 275.A O no hydrogen 2.768 N/A TYR 294.A N GLY 273.A O no hydrogen 2.766 N/A THR 295.A N ILE 74.A O no hydrogen 2.725 N/A THR 295.A OG1 THR 76.A OG1 no hydrogen 2.697 N/A LEU 296.A N ASP 271.A O no hydrogen 2.836 N/A VAL 297.A N THR 72.A O no hydrogen 2.912 N/A LYS 298.A N ARG 268.A O no hydrogen 2.820 N/A GLY 299.A N PRO 70.A O no hydrogen 3.033 N/A LYS 306.A N LYS 45.A O no hydrogen 2.683 N/A ARG 307.A N PRO 304.A O no hydrogen 3.270 N/A ARG 307.A NE VAL 205.A O no hydrogen 2.566 N/A ARG 307.A NH2 THR 206.A O no hydrogen 3.569 N/A VAL 309.A N GLY 43.A O no hydrogen 3.012 N/A ARG 310.A N ALA 203.A O no hydrogen 3.004 N/A ARG 310.A NE PRO 24.A O no hydrogen 3.317 N/A ARG 310.A NH1 GLU 163.A O no hydrogen 3.292 N/A ARG 310.A NH1 THR 164.A OG1 no hydrogen 3.193 N/A PHE 311.A N PHE 41.A O no hydrogen 2.706 N/A ARG 312.A NH1 ASP 201.A OD2 no hydrogen 2.641 N/A ALA 314.A N TYR 199.A O no hydrogen 3.091 N/A VAL 315.A N ASP 201.A OD2 no hydrogen 3.094 N/A ASP 324.A N ALA 196.A O no hydrogen 2.876 N/A ARG 328.A N VAL 52.A O no hydrogen 2.979 N/A ARG 328.A NE GLU 326.A OE2 no hydrogen 2.929 N/A TYR 329.A N VAL 52.A O no hydrogen 3.412 N/A SER 331.A N HIS 50.A O no hydrogen 3.207 N/A GLU 333.A N SER 331.A OG no hydrogen 3.379 N/A SER 334.A OG ASP 281.A O no hydrogen 3.151 N/A SER 334.A OG GLN 336.A O no hydrogen 3.203 N/A ASN 335.A ND2 MET 48.A O no hydrogen 3.195 N/A GLN 336.A N SER 334.A OG no hydrogen 3.023 N/A