Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xui_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N TYR 169.A O no hydrogen 2.931 N/A TRP 7.A N VAL 167.A O no hydrogen 3.134 N/A TRP 7.A NE1 LEU 129.A O no hydrogen 2.572 N/A ARG 8.A N ASP 6.A OD1 no hydrogen 3.263 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 2.721 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 3.074 N/A ARG 8.A NH2 ASP 6.A OD2 no hydrogen 2.636 N/A ALA 9.A N ASP 6.A O no hydrogen 2.893 N/A GLY 11.A N ARG 8.A O no hydrogen 2.714 N/A ALA 12.A N TRP 7.A O no hydrogen 2.981 N/A THR 14.A OG1 GLU 35.A OE1 no hydrogen 2.649 N/A GLN 19.A N SER 183.A O no hydrogen 2.935 N/A GLN 19.A NE2 CYS 22.A O no hydrogen 2.387 N/A GLY 20.A N ASP 18.A OD1 no hydrogen 3.090 N/A CYS 22.A N GLY 20.A O no hydrogen 2.624 N/A CYS 22.A SG TYR 91.A OH no hydrogen 3.682 N/A SER 24.A N CYS 22.A O no hydrogen 2.671 N/A SER 24.A OG CYS 22.A O no hydrogen 3.374 N/A SER 24.A OG TYR 91.A OH no hydrogen 2.827 N/A CYS 25.A SG HIS 162.A ND1 no hydrogen 3.320 N/A TRP 26.A NE1 GLY 62.A O no hydrogen 3.041 N/A ALA 27.A N SER 24.A O no hydrogen 2.866 N/A PHE 28.A N SER 24.A O no hydrogen 3.072 N/A SER 29.A N CYS 25.A O no hydrogen 2.849 N/A SER 29.A OG VAL 164.A O no hydrogen 2.615 N/A ALA 30.A N TRP 26.A O no hydrogen 3.019 N/A ILE 31.A N ALA 27.A O no hydrogen 2.897 N/A GLY 32.A N PHE 28.A O no hydrogen 2.886 N/A ASN 33.A N SER 29.A O no hydrogen 2.959 N/A ASN 33.A ND2 SER 211.A OG no hydrogen 2.927 N/A VAL 34.A N ALA 30.A O no hydrogen 2.933 N/A GLU 35.A N ILE 31.A O no hydrogen 2.832 N/A CYS 36.A N GLY 32.A O no hydrogen 3.002 N/A CYS 36.A SG ALA 12.A O no hydrogen 3.194 N/A CYS 36.A SG GLY 32.A O no hydrogen 3.351 N/A GLN 37.A N ASN 33.A O no hydrogen 2.872 N/A GLN 37.A NE2 ASN 132.A O no hydrogen 3.226 N/A GLN 37.A NE2 PRO 134.A O no hydrogen 3.453 N/A TRP 38.A N VAL 34.A O no hydrogen 2.877 N/A PHE 39.A N GLU 35.A O no hydrogen 2.977 N/A LEU 40.A N CYS 36.A O no hydrogen 3.247 N/A GLY 42.A N PHE 39.A O no hydrogen 2.870 N/A HIS 43.A N PHE 39.A O no hydrogen 3.148 N/A THR 46.A OG1 PRO 44.A O no hydrogen 3.179 N/A LEU 48.A N GLU 35.A OE2 no hydrogen 2.852 N/A SER 49.A N TYR 84.A O no hydrogen 3.298 N/A SER 49.A OG TYR 89.A O no hydrogen 2.164 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.833 N/A GLN 51.A N SER 49.A OG no hydrogen 3.243 N/A GLN 51.A NE2 GLN 51.A O no hydrogen 3.057 N/A GLN 51.A NE2 SER 98.A OG no hydrogen 3.354 N/A VAL 54.A N GLU 50.A O no hydrogen 2.876 N/A SER 55.A N GLN 51.A O no hydrogen 2.900 N/A SER 55.A OG SER 98.A OG no hydrogen 3.127 N/A SER 55.A OG PRO 99.A O no hydrogen 2.554 N/A CYS 56.A N MET 52.A O no hydrogen 2.878 N/A CYS 56.A SG TYR 89.A OH no hydrogen 3.726 N/A ASP 57.A N LEU 53.A O no hydrogen 2.875 N/A LYS 58.A NZ SER 55.A O no hydrogen 2.745 N/A THR 59.A N ASP 57.A OD1 no hydrogen 2.869 N/A THR 59.A OG1 ASP 57.A OD1 no hydrogen 2.257 N/A THR 59.A OG1 ASP 57.A OD2 no hydrogen 3.381 N/A SER 61.A N GLY 65.A O no hydrogen 2.954 N/A SER 64.A N SER 61.A O no hydrogen 2.859 N/A GLY 65.A N GLY 62.A O no hydrogen 3.096 N/A LEU 67.A N ASP 60.A OD1 no hydrogen 3.286 N/A ASN 70.A ND2 THR 59.A O no hydrogen 3.424 N/A ASN 70.A ND2 ASP 60.A OD1 no hydrogen 3.311 N/A PHE 72.A N MET 68.A O no hydrogen 2.939 N/A GLU 73.A N ASN 69.A O no hydrogen 2.942 N/A TRP 74.A N ASN 70.A O no hydrogen 2.902 N/A ILE 75.A N ALA 71.A O no hydrogen 2.915 N/A VAL 76.A N PHE 72.A O no hydrogen 2.990 N/A GLN 77.A N GLU 73.A O no hydrogen 2.901 N/A GLU 78.A N TRP 74.A O no hydrogen 2.889 N/A ASN 79.A N TRP 74.A O no hydrogen 3.299 N/A ASN 79.A ND2 ALA 82.A O no hydrogen 2.431 N/A GLY 81.A N ILE 75.A O no hydrogen 2.897 N/A ALA 82.A N ASN 79.A O no hydrogen 2.862 N/A VAL 83.A N ALA 110.A O no hydrogen 2.971 N/A THR 85.A N THR 107.A O no hydrogen 2.614 N/A THR 85.A OG1 SER 88.A OG no hydrogen 2.544 N/A THR 85.A OG1 THR 107.A O no hydrogen 3.091 N/A GLU 86.A N ASN 47.A O no hydrogen 2.705 N/A SER 88.A OG THR 85.A OG1 no hydrogen 2.544 N/A SER 88.A OG THR 107.A O no hydrogen 3.562 N/A TYR 89.A N GLU 86.A O no hydrogen 3.087 N/A TYR 91.A OH GLN 19.A O no hydrogen 2.244 N/A TYR 91.A OH SER 24.A OG no hydrogen 2.827 N/A ALA 92.A N GLN 51.A OE1 no hydrogen 2.801 N/A SER 93.A OG GLN 51.A OE1 no hydrogen 2.687 N/A SER 93.A OG ILE 97.A O no hydrogen 3.542 N/A SER 98.A OG SER 55.A OG no hydrogen 3.127 N/A SER 98.A OG PRO 99.A O no hydrogen 3.335 N/A CYS 101.A SG THR 102.A O no hydrogen 3.840 N/A THR 102.A OG1 HIS 106.A NE2 no hydrogen 3.230 N/A HIS 106.A ND1 SER 88.A O no hydrogen 2.237 N/A HIS 106.A NE2 THR 102.A OG1 no hydrogen 3.230 N/A THR 107.A N SER 88.A OG no hydrogen 2.676 N/A GLY 109.A N VAL 83.A O no hydrogen 2.683 N/A ALA 110.A N VAL 83.A O no hydrogen 2.976 N/A ILE 112.A N GLY 81.A O no hydrogen 3.068 N/A THR 113.A N VAL 213.A O no hydrogen 3.212 N/A THR 113.A OG1 GLY 215.A O no hydrogen 3.504 N/A VAL 116.A N SER 211.A O no hydrogen 2.870 N/A LEU 118.A N ALA 209.A O no hydrogen 2.892 N/A ASP 121.A N PRO 119.A O no hydrogen 2.568 N/A GLN 124.A N ASP 121.A OD1 no hydrogen 2.490 N/A ILE 125.A N ASP 121.A O no hydrogen 2.933 N/A ALA 126.A N GLU 122.A O no hydrogen 2.893 N/A ALA 127.A N ALA 123.A O no hydrogen 2.902 N/A TRP 128.A N GLN 124.A O no hydrogen 2.906 N/A LEU 129.A N ILE 125.A O no hydrogen 2.881 N/A ALA 130.A N ALA 126.A O no hydrogen 2.871 N/A VAL 131.A N ALA 127.A O no hydrogen 2.988 N/A ASN 132.A N TRP 128.A O no hydrogen 2.813 N/A GLY 133.A N LEU 129.A O no hydrogen 3.018 N/A VAL 135.A N LEU 166.A O no hydrogen 2.960 N/A VAL 137.A N VAL 164.A O no hydrogen 2.969 N/A ALA 138.A N GLU 208.A O no hydrogen 3.086 N/A VAL 139.A N HIS 162.A O no hydrogen 2.967 N/A ASP 140.A N CYS 203.A O no hydrogen 2.944 N/A ALA 141.A N ASP 161.A OD1 no hydrogen 2.487 N/A ALA 141.A N ASP 161.A OD2 no hydrogen 3.242 N/A SER 142.A N ASP 140.A OD1 no hydrogen 2.830 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.583 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 3.264 N/A TRP 144.A N ALA 141.A O no hydrogen 3.146 N/A THR 146.A OG1 SER 143.A O no hydrogen 2.910 N/A TYR 147.A N TRP 144.A O no hydrogen 3.137 N/A TYR 147.A OH GLY 150.A O no hydrogen 2.299 N/A GLY 150.A N GLU 190.A OE2 no hydrogen 2.619 N/A MET 152.A N ARG 195.A O no hydrogen 3.125 N/A CYS 155.A N GLN 202.A OE1 no hydrogen 3.162 N/A VAL 156.A N SER 143.A OG no hydrogen 3.324 N/A SER 157.A OG CYS 155.A O no hydrogen 3.189 N/A GLU 158.A N ASP 140.A OD2 no hydrogen 2.979 N/A GLN 159.A N ASP 140.A OD2 no hydrogen 3.384 N/A LEU 160.A N GLN 159.A OE1 no hydrogen 2.691 N/A ASP 161.A N VAL 139.A O no hydrogen 2.681 N/A HIS 162.A N VAL 139.A O no hydrogen 2.954 N/A HIS 162.A NE2 ASN 182.A OD1 no hydrogen 3.184 N/A GLY 163.A N HIS 162.A ND1 no hydrogen 2.886 N/A VAL 164.A N VAL 137.A O no hydrogen 2.910 N/A LEU 165.A N LYS 181.A O no hydrogen 3.013 N/A LEU 166.A N VAL 135.A O no hydrogen 2.854 N/A VAL 167.A N ILE 179.A O no hydrogen 2.901 N/A TYR 169.A N VAL 5.A O no hydrogen 2.910 N/A TYR 169.A OH PRO 2.A O no hydrogen 2.693 N/A ASN 170.A N TYR 177.A O no hydrogen 3.002 N/A ASN 170.A ND2 TYR 177.A OH no hydrogen 3.428 N/A ASP 171.A N ALA 3.A O no hydrogen 2.572 N/A SER 172.A N ASN 170.A OD1 no hydrogen 2.944 N/A ALA 173.A N ASN 170.A OD1 no hydrogen 3.305 N/A TYR 177.A N ASN 170.A O no hydrogen 3.034 N/A TRP 178.A N ILE 196.A O no hydrogen 2.885 N/A TRP 178.A NE1 GLU 122.A OE1 no hydrogen 2.958 N/A ILE 179.A N GLY 168.A O no hydrogen 2.554 N/A ILE 180.A N ILE 194.A O no hydrogen 2.885 N/A LYS 181.A N LEU 165.A O no hydrogen 2.782 N/A LYS 181.A NZ THR 14.A O no hydrogen 2.447 N/A LYS 181.A NZ ALA 15.A O no hydrogen 3.431 N/A ASN 182.A N GLY 192.A O no hydrogen 3.222 N/A SER 183.A N ASN 182.A OD1 no hydrogen 2.765 N/A SER 183.A OG GLN 19.A OE1 no hydrogen 2.919 N/A TRP 184.A NE1 GLN 19.A OE1 no hydrogen 2.968 N/A THR 185.A OG1 GLN 187.A OE1 no hydrogen 3.207 N/A GLN 187.A N THR 185.A OG1 no hydrogen 2.895 N/A TRP 188.A N THR 185.A O no hydrogen 3.205 N/A GLU 190.A N TYR 193.A O no hydrogen 2.460 N/A GLY 192.A N TRP 188.A O no hydrogen 2.672 N/A TYR 193.A N GLU 190.A O no hydrogen 2.922 N/A ILE 194.A N ILE 180.A O no hydrogen 2.917 N/A ARG 195.A N TYR 147.A OH no hydrogen 3.489 N/A ARG 195.A NE GLU 190.A OE1 no hydrogen 2.606 N/A ARG 195.A NE GLU 190.A OE2 no hydrogen 3.338 N/A ARG 195.A NH2 GLU 190.A OE2 no hydrogen 2.845 N/A ALA 197.A N MET 152.A O no hydrogen 3.130 N/A LYS 198.A N PRO 176.A O no hydrogen 2.814 N/A LYS 198.A NZ ASP 171.A OD1 no hydrogen 3.049 N/A LYS 198.A NZ ASP 171.A OD2 no hydrogen 3.337 N/A GLY 199.A N GLU 122.A OE1 no hydrogen 3.129 N/A ASN 201.A N GLU 122.A OE2 no hydrogen 3.051 N/A GLN 202.A NE2 SER 200.A OG no hydrogen 2.467 N/A CYS 203.A N SER 157.A OG no hydrogen 2.690 N/A LEU 204.A N ASN 201.A O no hydrogen 3.302 N/A VAL 205.A N GLN 202.A O no hydrogen 3.115 N/A LYS 206.A N ASN 201.A OD1 no hydrogen 2.827 N/A GLU 207.A N LEU 204.A O no hydrogen 3.226 N/A SER 210.A N ALA 136.A O no hydrogen 3.041 N/A SER 210.A OG ASN 69.A OD1 no hydrogen 2.702 N/A SER 211.A N VAL 116.A O no hydrogen 2.990 N/A SER 211.A OG ASN 33.A OD1 no hydrogen 2.975 N/A SER 211.A OG ALA 212.A O no hydrogen 3.045 N/A ALA 212.A N ASN 33.A OD1 no hydrogen 2.424 N/A VAL 213.A N GLY 114.A O no hydrogen 2.847 N/A