Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3juw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LEU 11.A O no hydrogen 2.910 N/A THR 6.A N LEU 9.A O no hydrogen 2.823 N/A THR 6.A OG1 GLU 106.A OE2 no hydrogen 2.399 N/A ARG 8.A N THR 6.A OG1 no hydrogen 3.299 N/A ARG 8.A N GLU 106.A OE2 no hydrogen 2.928 N/A ARG 8.A NE GLU 106.A OE1 no hydrogen 2.708 N/A ARG 8.A NH1 ARG 101.A O no hydrogen 2.929 N/A ARG 8.A NH2 ARG 101.A O no hydrogen 2.974 N/A ARG 8.A NH2 GLU 106.A OE1 no hydrogen 3.036 N/A VAL 10.A N LEU 61.A O no hydrogen 2.796 N/A LEU 11.A N LEU 4.A O no hydrogen 2.818 N/A GLU 12.A N TYR 59.A O no hydrogen 3.027 N/A GLN 14.A N PHE 57.A O no hydrogen 2.858 N/A GLN 14.A NE2 TYR 58.A O no hydrogen 3.541 N/A GLN 14.A NE2 GLU 70.A OE1 no hydrogen 2.843 N/A ARG 17.A N SER 15.A O no hydrogen 3.364 N/A ARG 17.A NE GLU 12.A OE2 no hydrogen 3.028 N/A ARG 17.A NH1 GLN 20.A OE1 no hydrogen 2.894 N/A ARG 17.A NH2 GLU 12.A OE1 no hydrogen 3.329 N/A GLN 20.A NE2 GLY 66.A O no hydrogen 3.256 N/A TRP 21.A N ARG 17.A O no hydrogen 2.977 N/A TRP 21.A NE1 GLU 70.A OE1 no hydrogen 2.813 N/A PHE 22.A N PHE 18.A O no hydrogen 2.863 N/A ALA 23.A N ASP 19.A O no hydrogen 3.118 N/A ARG 25.A N PHE 22.A O no hydrogen 3.073 N/A ARG 27.A NE GLU 29.A OE1 no hydrogen 3.200 N/A ARG 27.A NH2 GLU 29.A OE1 no hydrogen 2.959 N/A GLY 31.A N ASP 34.A OD1 no hydrogen 2.870 N/A HIS 32.A N GLU 29.A O no hydrogen 3.062 N/A HIS 32.A ND1 GLU 24.A OE2 no hydrogen 2.670 N/A ARG 33.A N GLU 29.A O no hydrogen 3.182 N/A ARG 33.A NH1 ASP 28.A OD1 no hydrogen 2.981 N/A LEU 35.A N HIS 32.A O no hydrogen 3.460 N/A THR 36.A N GLN 39.A OE1 no hydrogen 2.987 N/A GLN 39.A N THR 36.A OG1 no hydrogen 2.968 N/A ALA 40.A N THR 36.A O no hydrogen 3.035 N/A TRP 41.A N GLU 37.A O no hydrogen 2.846 N/A LEU 42.A N ASP 38.A O no hydrogen 2.851 N/A ARG 43.A N GLN 39.A O no hydrogen 2.945 N/A ARG 43.A NH1 GLU 24.A OE1 no hydrogen 2.781 N/A ARG 43.A NH1 GLY 31.A O no hydrogen 3.027 N/A ARG 43.A NH1 HIS 32.A ND1 no hydrogen 3.431 N/A ARG 43.A NH2 GLY 31.A O no hydrogen 3.392 N/A LEU 44.A N ALA 40.A O no hydrogen 2.959 N/A CYS 45.A N TRP 41.A O no hydrogen 2.882 N/A CYS 45.A SG TRP 41.A O no hydrogen 3.348 N/A ALA 46.A N LEU 42.A O no hydrogen 2.978 N/A ARG 47.A N ARG 43.A O no hydrogen 3.076 N/A ARG 47.A NH1 GLN 14.A OE1 no hydrogen 2.964 N/A ARG 47.A NH1 GLU 70.A OE1 no hydrogen 2.905 N/A GLN 48.A N LEU 44.A O no hydrogen 3.086 N/A GLY 49.A N CYS 45.A O no hydrogen 2.949 N/A TRP 50.A NE1 PHE 57.A O no hydrogen 2.978 N/A ASP 51.A N GLN 48.A O no hydrogen 3.030 N/A ALA 52.A N GLY 49.A O no hydrogen 2.931 N/A ALA 54.A N TRP 50.A O no hydrogen 2.993 N/A TYR 58.A N ALA 71.A O no hydrogen 2.707 N/A TYR 59.A N GLU 12.A O no hydrogen 2.716 N/A TYR 59.A OH SER 15.A O no hydrogen 2.642 N/A LEU 60.A N GLY 69.A O no hydrogen 2.950 N/A LEU 61.A N VAL 10.A O no hydrogen 2.658 N/A ASP 62.A N GLU 67.A O no hydrogen 2.932 N/A VAL 64.A N ASP 62.A OD1 no hydrogen 3.232 N/A SER 65.A N ASP 62.A OD2 no hydrogen 2.736 N/A SER 65.A OG ASP 62.A OD2 no hydrogen 2.461 N/A GLY 66.A N ASP 62.A O no hydrogen 2.771 N/A GLU 67.A N SER 65.A OG no hydrogen 3.387 N/A GLU 70.A N ALA 93.A O no hydrogen 3.026 N/A ALA 71.A N TYR 58.A O no hydrogen 3.118 N/A GLY 72.A N ALA 91.A O no hydrogen 3.072 N/A PHE 73.A N GLY 56.A O no hydrogen 3.202 N/A GLN 74.A N GLU 89.A O no hydrogen 2.882 N/A GLN 74.A NE2 GLU 89.A OE2 no hydrogen 3.193 N/A ARG 76.A NH2 GLN 74.A OE1 no hydrogen 3.006 N/A ARG 77.A NE ASN 86.A OD1 no hydrogen 2.743 N/A ARG 77.A NH2 ASN 86.A OD1 no hydrogen 3.193 N/A ARG 78.A NH1 GLU 89.A OE1 no hydrogen 2.520 N/A ARG 78.A NH1 GLU 89.A OE2 no hydrogen 3.225 N/A ARG 78.A NH2 GLU 89.A OE2 no hydrogen 2.812 N/A GLY 79.A N ASP 85.A OD2 no hydrogen 2.680 N/A PHE 80.A N ASP 85.A OD1 no hydrogen 2.962 N/A PHE 84.A N GLY 81.A O no hydrogen 2.982 N/A ASP 85.A N GLY 81.A O no hydrogen 2.769 N/A ASN 86.A N ARG 76.A O no hydrogen 3.084 N/A HIS 87.A NE2 PRO 82.A O no hydrogen 2.617 N/A GLU 89.A N GLN 74.A O no hydrogen 2.911 N/A ALA 90.A N VAL 124.A O no hydrogen 2.725 N/A ALA 91.A N GLY 72.A O no hydrogen 2.997 N/A ALA 93.A N GLU 70.A O no hydrogen 2.956 N/A ALA 95.A N ARG 68.A O no hydrogen 2.879 N/A HIS 98.A N ALA 95.A O no hydrogen 2.978 N/A GLN 99.A N SER 96.A O no hydrogen 3.258 N/A GLN 99.A NE2 VAL 94.A O no hydrogen 2.794 N/A GLU 106.A N GLY 102.A O no hydrogen 3.081 N/A ALA 107.A N LEU 103.A O no hydrogen 2.941 N/A ALA 109.A N GLU 106.A O no hydrogen 3.328 N/A LEU 110.A N ALA 107.A O no hydrogen 2.952 N/A ALA 112.A N GLN 108.A O no hydrogen 3.126 N/A HIS 113.A N ALA 109.A O no hydrogen 3.137 N/A HIS 114.A N LEU 110.A O no hydrogen 2.932 N/A HIS 114.A NE2 GLN 121.A OE1 no hydrogen 3.023 N/A ASP 115.A N LEU 111.A O no hydrogen 2.924 N/A ARG 116.A N ALA 112.A O no hydrogen 3.270 N/A SER 117.A N HIS 113.A O no hydrogen 3.133 N/A SER 117.A OG HIS 113.A O no hydrogen 3.566 N/A SER 118.A N HIS 114.A O no hydrogen 3.169 N/A SER 118.A OG HIS 114.A O no hydrogen 3.230 N/A ARG 122.A NE GLU 160.A OE1 no hydrogen 3.024 N/A ARG 122.A NH1 GLY 83.A O no hydrogen 2.761 N/A ARG 122.A NH2 GLY 83.A O no hydrogen 3.093 N/A ARG 122.A NH2 TYR 146.A OH no hydrogen 3.346 N/A ARG 122.A NH2 GLU 160.A OE1 no hydrogen 2.891 N/A VAL 123.A N ARG 161.A O no hydrogen 3.175 N/A VAL 124.A N PRO 88.A O no hydrogen 2.932 N/A ALA 125.A N LEU 159.A O no hydrogen 3.026 N/A ILE 127.A N LEU 157.A O no hydrogen 3.162 N/A ARG 129.A N ALA 155.A O no hydrogen 3.066 N/A ASN 131.A N ALA 128.A O no hydrogen 2.877 N/A LEU 135.A N ASN 131.A O no hydrogen 2.959 N/A ARG 136.A N LEU 132.A O no hydrogen 2.989 N/A ARG 136.A N PRO 133.A O no hydrogen 3.035 N/A LEU 137.A N PRO 133.A O no hydrogen 2.979 N/A ALA 138.A N SER 134.A O no hydrogen 2.927 N/A GLU 139.A N LEU 135.A O no hydrogen 2.918 N/A ARG 140.A N ARG 136.A O no hydrogen 2.909 N/A LEU 141.A N LEU 137.A O no hydrogen 2.946 N/A LEU 141.A N ALA 138.A O no hydrogen 3.155 N/A GLY 142.A N GLU 139.A O no hydrogen 3.032 N/A PHE 143.A N ALA 138.A O no hydrogen 2.934 N/A ARG 144.A N GLU 160.A O no hydrogen 2.935 N/A ARG 144.A NH2 GLU 139.A O no hydrogen 2.812 N/A ARG 144.A NH2 PHE 143.A O no hydrogen 3.116 N/A TYR 146.A N LEU 158.A O no hydrogen 3.037 N/A VAL 149.A N HIS 156.A O no hydrogen 2.800 N/A PHE 151.A N ALA 154.A O no hydrogen 2.984 N/A ALA 154.A N PHE 151.A O no hydrogen 3.028 N/A HIS 156.A N VAL 149.A O no hydrogen 2.753 N/A HIS 156.A ND1 ALA 154.A O no hydrogen 2.804 N/A LEU 157.A N ILE 127.A O no hydrogen 2.781 N/A LEU 158.A N SER 147.A O no hydrogen 2.763 N/A LEU 159.A N ALA 125.A O no hydrogen 2.954 N/A GLU 160.A N ARG 144.A O no hydrogen 2.833 N/A ARG 161.A N VAL 123.A O no hydrogen 2.843 N/A ARG 161.A NE LEU 141.A O no hydrogen 3.244 N/A ARG 161.A NH1 ASP 115.A OD1 no hydrogen 3.155 N/A ARG 161.A NH1 ASP 115.A OD2 no hydrogen 3.417 N/A ARG 161.A NH2 ASP 115.A OD2 no hydrogen 3.342 N/A