Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xqy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N ASN 5.A OD1 no hydrogen 2.642 N/A TYR 6.A OH ARG 65.A O no hydrogen 2.573 N/A ALA 7.A N ILE 14.A O no hydrogen 2.650 N/A VAL 9.A N ILE 12.A O no hydrogen 2.685 N/A ILE 12.A N VAL 9.A O no hydrogen 3.272 N/A TYR 13.A N GLU 67.A OE2 no hydrogen 2.555 N/A ILE 14.A N ALA 7.A O no hydrogen 2.724 N/A TYR 15.A N SER 66.A OG no hydrogen 2.662 N/A TYR 15.A OH GLU 4.A OE1 no hydrogen 3.421 N/A TYR 16.A N ASN 5.A O no hydrogen 3.076 N/A LYS 17.A N PHE 57.A O no hydrogen 3.172 N/A LYS 17.A NZ GLU 4.A OE1 no hydrogen 3.433 N/A LYS 17.A NZ TYR 15.A OH no hydrogen 3.143 N/A CYS 19.A N VAL 55.A O no hydrogen 3.355 N/A LYS 25.A N GLY 52.A O no hydrogen 2.979 N/A LYS 27.A NZ GLU 24.A OE1 no hydrogen 2.561 N/A LEU 28.A N THR 54.A O no hydrogen 3.053 N/A MET 29.A N PHE 97.A O no hydrogen 2.540 N/A THR 30.A N LEU 56.A O no hydrogen 3.196 N/A THR 30.A OG1 LEU 56.A O no hydrogen 2.668 N/A MET 31.A N MET 99.A O no hydrogen 2.542 N/A GLY 33.A N TYR 41.A OH no hydrogen 2.797 N/A SER 38.A OG SER 192.A OG no hydrogen 2.623 N/A HIS 39.A ND1 ASP 59.A OD2 no hydrogen 2.649 N/A ASP 40.A N SER 38.A OG no hydrogen 3.012 N/A LEU 42.A N HIS 39.A O no hydrogen 2.558 N/A SER 44.A OG MET 271.A O no hydrogen 3.023 N/A LEU 45.A N LEU 42.A O no hydrogen 3.176 N/A ARG 46.A N LEU 43.A O no hydrogen 2.851 N/A ASP 47.A N SER 44.A O no hydrogen 3.225 N/A MET 48.A N LEU 45.A O no hydrogen 2.832 N/A THR 49.A N ARG 46.A O no hydrogen 2.886 N/A THR 49.A OG1 ARG 46.A O no hydrogen 3.486 N/A GLU 51.A N MET 48.A O no hydrogen 3.179 N/A ILE 53.A N MET 48.A O no hydrogen 3.086 N/A THR 54.A N ALA 26.A O no hydrogen 2.892 N/A THR 54.A OG1 GLU 24.A OE1 no hydrogen 2.506 N/A THR 54.A OG1 GLU 24.A OE2 no hydrogen 2.959 N/A THR 54.A OG1 ALA 26.A O no hydrogen 2.729 N/A LEU 56.A N LEU 28.A O no hydrogen 3.094 N/A PHE 57.A N LYS 17.A O no hydrogen 2.479 N/A PHE 61.A N GLU 82.A OE1 no hydrogen 2.749 N/A GLY 62.A N GLU 67.A O no hydrogen 2.879 N/A CYS 63.A N GLN 60.A O no hydrogen 2.682 N/A CYS 63.A SG HIS 32.A NE2 no hydrogen 3.864 N/A CYS 63.A SG PHE 61.A O no hydrogen 3.107 N/A ARG 65.A N ASP 59.A OD1 no hydrogen 3.066 N/A ARG 65.A NH1 ASP 40.A OD1 no hydrogen 2.999 N/A ARG 65.A NH2 ASP 40.A OD1 no hydrogen 3.246 N/A ARG 65.A NH2 ASP 59.A OD1 no hydrogen 3.448 N/A SER 66.A N CYS 63.A O no hydrogen 2.969 N/A SER 66.A OG ASP 59.A O no hydrogen 2.991 N/A GLU 67.A N TYR 13.A O no hydrogen 3.082 N/A SER 72.A N ASP 70.A OD1 no hydrogen 3.133 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 2.752 N/A LYS 73.A N ASP 70.A O no hydrogen 3.163 N/A GLY 79.A N THR 75.A O no hydrogen 3.481 N/A VAL 80.A N ILE 76.A O no hydrogen 3.084 N/A GLU 82.A N TYR 78.A O no hydrogen 3.258 N/A ALA 83.A N GLY 79.A O no hydrogen 3.107 N/A GLU 84.A N VAL 80.A O no hydrogen 3.216 N/A ALA 85.A N GLU 81.A O no hydrogen 2.543 N/A LEU 86.A N GLU 82.A O no hydrogen 2.684 N/A ARG 87.A N ALA 83.A O no hydrogen 2.761 N/A ARG 87.A NE GLU 84.A OE1 no hydrogen 2.534 N/A ARG 87.A NH2 GLY 92.A O no hydrogen 2.899 N/A SER 88.A N GLU 84.A O no hydrogen 2.785 N/A SER 88.A OG GLU 84.A O no hydrogen 3.213 N/A SER 88.A OG ALA 85.A O no hydrogen 3.087 N/A LYS 89.A N ALA 85.A O no hydrogen 3.307 N/A LEU 90.A N LEU 86.A O no hydrogen 2.782 N/A LEU 90.A N ARG 87.A O no hydrogen 2.791 N/A PHE 91.A N ARG 87.A O no hydrogen 2.915 N/A GLY 92.A N SER 88.A O no hydrogen 2.644 N/A PHE 97.A N LYS 27.A O no hydrogen 2.657 N/A LEU 98.A N GLY 121.A O no hydrogen 3.429 N/A MET 99.A N MET 29.A O no hydrogen 2.680 N/A GLY 100.A N ILE 123.A O no hydrogen 3.107 N/A SER 101.A N MET 31.A O no hydrogen 2.527 N/A GLY 104.A N SER 101.A O no hydrogen 2.868 N/A GLY 105.A N ALA 102.A O no hydrogen 2.611 N/A ALA 106.A N ALA 102.A O no hydrogen 2.966 N/A LEU 107.A N TYR 103.A O no hydrogen 2.668 N/A ALA 108.A N GLY 104.A O no hydrogen 2.575 N/A LEU 109.A N GLY 105.A O no hydrogen 2.588 N/A ALA 110.A N ALA 106.A O no hydrogen 2.728 N/A TYR 111.A N LEU 107.A O no hydrogen 2.705 N/A TYR 111.A OH GLU 84.A OE1 no hydrogen 2.480 N/A TYR 111.A OH GLU 84.A OE2 no hydrogen 2.560 N/A ALA 112.A N ALA 108.A O no hydrogen 2.725 N/A VAL 113.A N LEU 109.A O no hydrogen 2.942 N/A TYR 115.A OH GLU 81.A OE2 no hydrogen 3.133 N/A LEU 119.A N GLN 116.A O no hydrogen 2.929 N/A LYS 120.A N VAL 96.A O no hydrogen 3.012 N/A LYS 120.A NZ HIS 289.A O no hydrogen 2.609 N/A ILE 123.A N LEU 98.A O no hydrogen 2.657 N/A VAL 124.A N LEU 234.A O no hydrogen 2.818 N/A SER 125.A N GLY 100.A O no hydrogen 3.346 N/A SER 125.A OG TYR 278.A OH no hydrogen 2.619 N/A GLY 126.A N THR 236.A O no hydrogen 2.797 N/A SER 129.A OG THR 223.A OG1 no hydrogen 3.425 N/A VAL 131.A N TRP 220.A O no hydrogen 3.097 N/A LEU 133.A N SER 130.A OG no hydrogen 3.288 N/A THR 134.A N SER 130.A O no hydrogen 3.129 N/A THR 134.A OG1 SER 130.A O no hydrogen 3.206 N/A VAL 135.A N VAL 131.A O no hydrogen 2.966 N/A LYS 136.A N PRO 132.A O no hydrogen 2.756 N/A GLU 137.A N LEU 133.A O no hydrogen 2.833 N/A MET 138.A N THR 134.A O no hydrogen 2.961 N/A ASN 139.A N VAL 135.A O no hydrogen 3.149 N/A ASN 139.A ND2 LYS 136.A O no hydrogen 3.082 N/A LEU 141.A N GLU 137.A O no hydrogen 3.227 N/A ILE 142.A N MET 138.A O no hydrogen 2.691 N/A ASP 143.A N ASN 139.A O no hydrogen 2.559 N/A GLU 144.A N ARG 140.A O no hydrogen 2.794 N/A LEU 145.A N LEU 141.A O no hydrogen 3.076 N/A LEU 145.A N ILE 142.A O no hydrogen 2.683 N/A TYR 149.A N PRO 146.A O no hydrogen 2.697 N/A ARG 150.A N PRO 146.A O no hydrogen 3.168 N/A ARG 150.A NH1 ASP 143.A O no hydrogen 2.827 N/A ASP 151.A N ALA 147.A O no hydrogen 2.633 N/A ALA 152.A N LYS 148.A O no hydrogen 3.296 N/A ILE 153.A N TYR 149.A O no hydrogen 2.990 N/A LYS 154.A NZ ASP 143.A OD1 no hydrogen 3.347 N/A LYS 155.A N ASP 151.A O no hydrogen 3.174 N/A TYR 156.A N ALA 152.A O no hydrogen 2.894 N/A GLY 157.A N ILE 153.A O no hydrogen 2.665 N/A SER 158.A N LYS 154.A O no hydrogen 2.838 N/A SER 158.A OG LYS 154.A O no hydrogen 2.707 N/A SER 159.A N TYR 156.A O no hydrogen 3.274 N/A SER 159.A OG LYS 155.A O no hydrogen 3.041 N/A SER 159.A OG TYR 156.A O no hydrogen 2.806 N/A GLY 160.A N TYR 156.A O no hydrogen 3.042 N/A GLY 160.A N GLY 157.A O no hydrogen 3.390 N/A SER 161.A N TYR 156.A O no hydrogen 3.073 N/A ASN 164.A N SER 161.A O no hydrogen 2.965 N/A GLN 168.A N ASN 164.A O no hydrogen 3.323 N/A GLN 168.A NE2 GLU 163.A O no hydrogen 3.347 N/A GLU 169.A N PRO 165.A O no hydrogen 2.935 N/A ALA 170.A N TYR 167.A O no hydrogen 2.804 N/A VAL 171.A N TYR 167.A O no hydrogen 3.111 N/A ASN 172.A N GLN 168.A O no hydrogen 2.903 N/A TYR 173.A N GLU 169.A O no hydrogen 3.443 N/A PHE 174.A N ALA 170.A O no hydrogen 2.557 N/A TYR 175.A N VAL 171.A O no hydrogen 2.708 N/A HIS 176.A N ASN 172.A O no hydrogen 2.960 N/A GLN 177.A NE2 HIS 176.A O no hydrogen 2.795 N/A HIS 178.A N PHE 174.A O no hydrogen 3.039 N/A LEU 179.A N TYR 175.A O no hydrogen 2.964 N/A LEU 180.A N TYR 175.A O no hydrogen 2.772 N/A ARG 181.A N SER 267.A OG no hydrogen 2.879 N/A ARG 181.A NH1 GLN 177.A O no hydrogen 2.660 N/A ARG 181.A NH2 GLN 177.A O no hydrogen 3.408 N/A LEU 190.A N PRO 186.A O no hydrogen 3.151 N/A LYS 191.A N PRO 187.A O no hydrogen 3.210 N/A SER 192.A N GLU 188.A O no hydrogen 3.398 N/A SER 192.A OG SER 38.A O no hydrogen 3.170 N/A SER 192.A OG SER 38.A OG no hydrogen 2.623 N/A LEU 193.A N VAL 189.A O no hydrogen 2.957 N/A GLU 194.A N LEU 190.A O no hydrogen 2.620 N/A TYR 195.A N LYS 191.A O no hydrogen 2.834 N/A ALA 196.A N SER 192.A O no hydrogen 3.330 N/A GLU 197.A N LEU 193.A O no hydrogen 3.165 N/A ARG 199.A N TYR 195.A O no hydrogen 2.756 N/A ARG 199.A NE GLY 62.A O no hydrogen 2.688 N/A ARG 199.A NH1 GLY 62.A O no hydrogen 3.044 N/A ARG 203.A NE ASN 200.A OD1 no hydrogen 3.548 N/A ILE 204.A N VAL 201.A O no hydrogen 2.682 N/A MET 205.A N VAL 201.A O no hydrogen 2.868 N/A GLY 207.A N TYR 202.A O no hydrogen 2.976 N/A THR 212.A OG1 ASN 209.A OD1 no hydrogen 2.793 N/A GLY 215.A N ASN 206.A O no hydrogen 2.577 N/A THR 216.A N ILE 204.A O no hydrogen 3.133 N/A THR 216.A OG1 ILE 204.A O no hydrogen 3.375 N/A ILE 217.A N GLY 215.A O no hydrogen 2.735 N/A LYS 218.A NZ LYS 218.A O no hydrogen 2.908 N/A ILE 222.A N SER 129.A O no hydrogen 3.009 N/A THR 223.A N ASP 221.A OD2 no hydrogen 3.040 N/A THR 223.A OG1 SER 129.A OG no hydrogen 3.425 N/A THR 223.A OG1 ASP 221.A OD2 no hydrogen 2.623 N/A ILE 226.A N ILE 222.A O no hydrogen 3.373 N/A SER 227.A N ASP 224.A O no hydrogen 3.312 N/A SER 227.A OG ASP 224.A O no hydrogen 2.527 N/A ALA 228.A N LYS 225.A O no hydrogen 3.036 N/A ILE 229.A N ILE 226.A O no hydrogen 2.634 N/A THR 233.A OG1 ILE 231.A O no hydrogen 3.005 N/A LEU 234.A N LEU 122.A O no hydrogen 2.966 N/A THR 236.A N VAL 124.A O no hydrogen 2.799 N/A THR 236.A OG1 VAL 124.A O no hydrogen 2.949 N/A GLU 239.A N PHE 263.A O no hydrogen 3.328 N/A ASP 241.A N GLY 238.A O no hydrogen 3.328 N/A GLU 242.A N HIS 178.A O no hydrogen 2.893 N/A THR 244.A OG1 GLU 137.A OE2 no hydrogen 2.670 N/A ASN 246.A N THR 244.A OG1 no hydrogen 2.854 N/A VAL 247.A N THR 244.A O no hydrogen 2.920 N/A ARG 249.A N PRO 245.A O no hydrogen 3.189 N/A HIS 252.A N ALA 248.A O no hydrogen 2.937 N/A GLU 253.A N ARG 249.A O no hydrogen 2.414 N/A LYS 254.A N VAL 250.A O no hydrogen 2.472 N/A ILE 255.A N ILE 251.A O no hydrogen 2.889 N/A SER 258.A OG HIS 252.A O no hydrogen 3.042 N/A SER 258.A OG ILE 255.A O no hydrogen 2.433 N/A HIS 261.A N ILE 235.A O no hydrogen 3.059 N/A HIS 261.A ND1 LEU 260.A O no hydrogen 2.705 N/A PHE 263.A N VAL 237.A O no hydrogen 2.527 N/A CYS 266.A SG ARG 264.A O no hydrogen 3.886 N/A SER 267.A N GLU 273.A OE1 no hydrogen 3.012 N/A SER 267.A N GLU 273.A OE2 no hydrogen 3.184 N/A SER 267.A OG LEU 179.A O no hydrogen 2.843 N/A SER 267.A OG GLU 273.A OE1 no hydrogen 2.505 N/A SER 267.A OG GLU 273.A OE2 no hydrogen 2.641 N/A HIS 268.A N LEU 179.A O no hydrogen 2.980 N/A HIS 268.A ND1 ASP 241.A OD1 no hydrogen 3.346 N/A HIS 268.A ND1 ASP 241.A OD2 no hydrogen 2.574 N/A LEU 269.A N LEU 179.A O no hydrogen 3.113 N/A THR 270.A N HIS 268.A O no hydrogen 2.546 N/A THR 270.A OG1 HIS 268.A O no hydrogen 3.542 N/A TRP 272.A N LEU 269.A O no hydrogen 2.749 N/A TRP 272.A NE1 TYR 41.A O no hydrogen 2.739 N/A GLU 273.A N LEU 269.A O no hydrogen 3.486 N/A ARG 275.A NE ASP 47.A OD2 no hydrogen 2.698 N/A ARG 275.A NH1 SER 44.A O no hydrogen 3.492 N/A ARG 275.A NH1 ASP 47.A OD1 no hydrogen 2.634 N/A ARG 275.A NH1 ASP 47.A OD2 no hydrogen 2.810 N/A GLU 276.A N GLU 276.A OE2 no hydrogen 2.686 N/A GLY 277.A N ASP 274.A O no hydrogen 2.934 N/A TYR 278.A N ASP 274.A O no hydrogen 2.821 N/A TYR 278.A OH SER 125.A OG no hydrogen 2.619 N/A ASN 279.A N ARG 275.A O no hydrogen 3.431 N/A ASN 279.A ND2 SER 44.A O no hydrogen 3.365 N/A LYS 280.A NZ GLU 276.A O no hydrogen 3.220 N/A SER 283.A N ASN 279.A O no hydrogen 2.872 N/A SER 283.A OG ASN 279.A O no hydrogen 3.354 N/A SER 283.A OG LYS 280.A O no hydrogen 2.291 N/A ASP 284.A N LYS 280.A O no hydrogen 2.593 N/A PHE 285.A N LEU 281.A O no hydrogen 2.733 N/A ILE 286.A N LEU 282.A O no hydrogen 2.749 N/A LEU 287.A N SER 283.A O no hydrogen 2.821 N/A HIS 289.A N PHE 285.A O no hydrogen 3.443 N/A LEU 290.A N LYS 288.A O no hydrogen 2.638 N/A