Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u1u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N PRO 1.A O no hydrogen 3.171 N/A VAL 6.A N PRO 112.A O no hydrogen 2.777 N/A SER 7.A N GLU 11.A OE1 no hydrogen 2.805 N/A LEU 8.A N GLU 11.A OE1 no hydrogen 2.921 N/A GLU 11.A N LEU 8.A O no hydrogen 3.064 N/A LEU 12.A N LEU 8.A O no hydrogen 3.316 N/A ASN 13.A N PRO 9.A O no hydrogen 2.832 N/A ASN 13.A ND2.A PRO 9.A O no hydrogen 3.698 N/A ARG 14.A N GLU 11.A O no hydrogen 3.199 N/A ARG 14.A NE ASN 118.A OD1 no hydrogen 3.308 N/A ARG 14.A NH2 ASN 118.A OD1 no hydrogen 2.731 N/A VAL 15.A N LEU 12.A O no hydrogen 3.075 N/A ARG 16.A N ASN 13.A O no hydrogen 3.153 N/A ARG 16.A NE ASN 13.A OD1.A no hydrogen 2.440 N/A ARG 16.A NE ASN 13.A OD1.B no hydrogen 3.214 N/A ARG 16.A NH1 ASN 92.A O no hydrogen 3.343 N/A LEU 17.A N PHE 38.A O no hydrogen 2.831 N/A ARG 19.A NH1 VAL 90.A O no hydrogen 2.752 N/A HIS 20.A N ASN 92.A OD1 no hydrogen 2.985 N/A LYS 21.A N SER 18.A OG no hydrogen 2.985 N/A LEU 22.A N SER 18.A O no hydrogen 3.141 N/A GLU 23.A N ARG 19.A O no hydrogen 2.946 N/A ARG 24.A N HIS 20.A O no hydrogen 3.011 N/A ARG 24.A NH1.B GLU 126.A OE1 no hydrogen 3.427 N/A ARG 24.A NH1.B GLU 126.A OE2 no hydrogen 2.838 N/A ARG 24.A NH2.B GLU 126.A OE1 no hydrogen 2.790 N/A TRP 25.A N LYS 21.A O no hydrogen 3.034 N/A TRP 25.A NE1 GLU 126.A OE1 no hydrogen 3.343 N/A CYS 26.A SG GLU 23.A O no hydrogen 3.534 N/A THR 33.A N PHE 29.A O no hydrogen 2.952 N/A THR 33.A OG1 PHE 29.A O no hydrogen 2.733 N/A VAL 34.A N PHE 30.A O no hydrogen 3.042 N/A THR 35.A N ALA 31.A O no hydrogen 2.984 N/A THR 35.A OG1 ALA 31.A O no hydrogen 2.707 N/A GLY 36.A N ILE 53.A O no hydrogen 2.879 N/A CYS 37.A N VAL 34.A O no hydrogen 2.979 N/A CYS 37.A SG THR 33.A O no hydrogen 3.829 N/A PHE 38.A N VAL 15.A O no hydrogen 2.956 N/A VAL 39.A N ALA 51.A O no hydrogen 2.789 N/A ARG 40.A NE GLU 99.A OE1 no hydrogen 2.812 N/A ARG 40.A NH1 SER 91.A OG no hydrogen 3.038 N/A ARG 40.A NH2 GLU 99.A OE2 no hydrogen 2.887 N/A ILE 41.A N ARG 49.A O no hydrogen 2.906 N/A GLY 42.A N PHE 89.A O no hydrogen 2.897 N/A ILE 43.A N VAL 47.A O no hydrogen 2.955 N/A VAL 47.A N GLY 44.A O no hydrogen 2.670 N/A ARG 49.A N ILE 41.A O no hydrogen 2.890 N/A ALA 51.A N VAL 39.A O no hydrogen 2.998 N/A GLU 52.A N ARG 77.A O no hydrogen 2.917 N/A ILE 53.A N CYS 37.A O no hydrogen 2.806 N/A THR 54.A N GLN 75.A O no hydrogen 2.760 N/A THR 54.A OG1 GLN 75.A O no hydrogen 3.335 N/A VAL 57.A N GLY 73.A O no hydrogen 2.885 N/A THR 59.A N ASN 71.A O no hydrogen 2.861 N/A THR 59.A OG1 ASN 71.A O no hydrogen 2.822 N/A LYS 61.A N THR 59.A OG1 no hydrogen 3.330 N/A TYR 63.A N THR 70.A O no hydrogen 2.824 N/A TYR 63.A OH LYS 72.A O no hydrogen 2.522 N/A GLN 64.A NE2 GLY 66.A O no hydrogen 2.632 N/A LEU 65.A N THR 68.A O no hydrogen 2.918 N/A GLY 67.A N GLU 23.A OE2 no hydrogen 2.766 N/A THR 68.A N LEU 65.A O no hydrogen 3.050 N/A THR 68.A OG1 HIS 27.A NE2.B no hydrogen 2.872 N/A THR 68.A OG1 ARG 69.A O no hydrogen 3.465 N/A THR 70.A N TYR 63.A O no hydrogen 3.054 N/A ASN 71.A ND2 GLU 58.A OE2 no hydrogen 3.114 N/A LYS 72.A N THR 70.A OG1 no hydrogen 3.103 N/A GLY 73.A N VAL 57.A O no hydrogen 2.820 N/A LEU 74.A N PHE 85.A O no hydrogen 2.850 N/A GLN 75.A N GLY 55.A O no hydrogen 2.925 N/A LEU 76.A N ARG 83.A O no hydrogen 2.808 N/A ARG 77.A N GLU 52.A O no hydrogen 2.804 N/A ARG 77.A NE.A GLY 79.A O no hydrogen 3.302 N/A ARG 77.A NH1.B GLY 79.A O no hydrogen 3.281 N/A HIS 78.A N ASP 81.A O no hydrogen 2.866 N/A HIS 78.A ND1 VAL 50.A O no hydrogen 2.673 N/A ASP 81.A N HIS 78.A O no hydrogen 3.035 N/A ARG 83.A N LEU 76.A O no hydrogen 3.044 N/A ARG 83.A NE ASP 81.A OD1 no hydrogen 2.937 N/A ARG 83.A NE ASP 81.A OD2 no hydrogen 3.340 N/A ARG 83.A NH2 ASP 81.A OD1 no hydrogen 3.107 N/A PHE 85.A N LEU 74.A O no hydrogen 2.937 N/A ARG 86.A NE GLU 88.A OE2 no hydrogen 2.868 N/A LEU 87.A N TYR 63.A OH no hydrogen 3.008 N/A PHE 89.A N ARG 86.A O no hydrogen 3.219 N/A VAL 90.A N LEU 87.A O no hydrogen 3.116 N/A SER 91.A N ARG 40.A O no hydrogen 2.815 N/A GLN 93.A N SER 91.A OG no hydrogen 3.003 N/A THR 96.A N GLU 99.A OE1 no hydrogen 3.092 N/A GLU 99.A N THR 96.A OG1 no hydrogen 3.038 N/A PHE 100.A N THR 96.A O no hydrogen 2.992 N/A TRP 102.A N GLU 99.A O no hydrogen 3.021 N/A LYS 103.A N PHE 100.A O no hydrogen 3.028 N/A ALA 105.A N LYS 101.A O no hydrogen 3.010 N/A SER 107.A N GLU 104.A O no hydrogen 2.952 N/A ALA 108.A N ALA 105.A O no hydrogen 2.970 N/A GLY 109.A N PHE 106.A O no hydrogen 3.013 N/A THR 113.A N GLU 116.A OE1 no hydrogen 2.924 N/A LEU 114.A N GLN 4.A O no hydrogen 2.853 N/A ASP 115.A N LYS 2.A O no hydrogen 2.805 N/A GLU 116.A N THR 113.A OG1 no hydrogen 3.105 N/A ILE 117.A N.A THR 113.A O no hydrogen 3.009 N/A ILE 117.A N.B THR 113.A O no hydrogen 3.038 N/A ASN 118.A N LEU 114.A O no hydrogen 2.875 N/A LYS 119.A N ASP 115.A O no hydrogen 2.892 N/A LYS 119.A NZ ASP 115.A OD2 no hydrogen 2.861 N/A LYS 120.A N GLU 116.A O no hydrogen 3.008 N/A LYS 120.A NZ LYS 32.A O no hydrogen 3.495 N/A LYS 120.A NZ THR 33.A O no hydrogen 2.836 N/A LYS 120.A NZ THR 35.A O no hydrogen 2.808 N/A GLU 121.A N ILE 117.A O.A no hydrogen 2.820 N/A GLU 121.A N ILE 117.A O.B no hydrogen 2.859 N/A LEU 122.A N ASN 118.A O no hydrogen 2.911 N/A SER 123.A N LYS 119.A O no hydrogen 3.060 N/A SER 123.A OG LYS 120.A O no hydrogen 2.781 N/A ILE 124.A N LYS 120.A O no hydrogen 3.064 N/A ILE 124.A N GLU 121.A O no hydrogen 3.161 N/A LYS 125.A N LEU 122.A O no hydrogen 3.318 N/A