Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pi8_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLU 6.A OE2 no hydrogen 3.027 N/A GLU 6.A N THR 3.A OG1 no hydrogen 3.202 N/A LYS 7.A N THR 3.A O no hydrogen 2.858 N/A LYS 7.A NZ LEU 2.A O no hydrogen 3.521 N/A ALA 8.A N ALA 4.A O no hydrogen 3.085 N/A ALA 9.A N GLU 5.A O no hydrogen 3.076 N/A VAL 10.A N GLU 6.A O no hydrogen 3.053 N/A THR 11.A N LYS 7.A O no hydrogen 2.932 N/A THR 11.A OG1 LYS 7.A O no hydrogen 2.704 N/A ALA 12.A N ALA 8.A O no hydrogen 2.947 N/A PHE 13.A N ALA 9.A O no hydrogen 3.062 N/A TRP 14.A N VAL 10.A O no hydrogen 3.036 N/A TRP 14.A NE1 SER 71.A OG no hydrogen 2.864 N/A GLY 15.A N THR 11.A O no hydrogen 3.341 N/A GLY 15.A N ALA 12.A O no hydrogen 3.369 N/A LYS 16.A N PHE 13.A O no hydrogen 3.065 N/A LYS 16.A NZ GLU 120.A OE2 no hydrogen 2.898 N/A VAL 17.A N TRP 14.A O no hydrogen 3.125 N/A VAL 22.A N LYS 18.A O no hydrogen 3.062 N/A GLY 23.A N VAL 19.A O no hydrogen 3.058 N/A GLY 24.A N ASP 20.A O no hydrogen 3.256 N/A GLU 25.A N GLU 21.A O no hydrogen 3.148 N/A ALA 26.A N VAL 22.A O no hydrogen 2.996 N/A LEU 27.A N GLY 23.A O no hydrogen 2.972 N/A GLY 28.A N GLY 24.A O no hydrogen 2.899 N/A ARG 29.A N GLU 25.A O no hydrogen 2.737 N/A ARG 29.A NE GLU 25.A OE2 no hydrogen 2.724 N/A LEU 30.A N ALA 26.A O no hydrogen 2.885 N/A LEU 31.A N LEU 27.A O no hydrogen 3.171 N/A VAL 32.A N GLY 28.A O no hydrogen 3.036 N/A VAL 32.A N ARG 29.A O no hydrogen 3.236 N/A VAL 33.A N ARG 29.A O no hydrogen 2.760 N/A TYR 34.A N LEU 30.A O no hydrogen 2.943 N/A TRP 36.A NE1 ASN 101.A OD1 no hydrogen 2.957 N/A THR 37.A N TYR 34.A O no hydrogen 3.001 N/A THR 37.A OG1 LEU 30.A O no hydrogen 3.222 N/A THR 37.A OG1 TYR 34.A O no hydrogen 2.706 N/A GLN 38.A N PRO 35.A O no hydrogen 3.129 N/A GLN 38.A NE2 LEU 31.A O no hydrogen 2.716 N/A ARG 39.A N TRP 36.A O no hydrogen 3.053 N/A PHE 40.A N THR 37.A O no hydrogen 3.245 N/A PHE 41.A N GLN 38.A O no hydrogen 2.795 N/A GLU 42.A N ARG 39.A O no hydrogen 3.343 N/A PHE 44.A N PHE 41.A O no hydrogen 2.895 N/A SER 48.A N ASP 46.A OD1 no hydrogen 3.231 N/A SER 48.A OG ASP 46.A OD1 no hydrogen 2.768 N/A ALA 52.A N THR 49.A OG1 no hydrogen 3.158 N/A VAL 53.A N THR 49.A O no hydrogen 2.935 N/A MET 54.A N ALA 50.A O no hydrogen 2.928 N/A ASN 55.A N ASP 51.A O no hydrogen 2.984 N/A ASN 56.A N VAL 53.A O no hydrogen 3.196 N/A ASN 56.A ND2 PHE 44.A O no hydrogen 2.985 N/A ASN 56.A ND2 ASP 46.A O no hydrogen 3.084 N/A LYS 58.A N ASN 56.A OD1 no hydrogen 3.045 N/A LYS 58.A NZ SER 43.A O no hydrogen 3.387 N/A VAL 59.A N ASN 56.A OD1 no hydrogen 3.355 N/A LYS 60.A N ASN 56.A O no hydrogen 3.141 N/A ALA 61.A N PRO 57.A O no hydrogen 2.964 N/A HIS 62.A N LYS 58.A O no hydrogen 2.934 N/A GLY 63.A N VAL 59.A O no hydrogen 2.878 N/A LYS 64.A N LYS 60.A O no hydrogen 3.236 N/A LYS 64.A NZ ASP 68.A OD1 no hydrogen 3.486 N/A LYS 64.A NZ ASP 68.A OD2 no hydrogen 2.798 N/A VAL 66.A N HIS 62.A O no hydrogen 2.999 N/A LEU 67.A N GLY 63.A O no hydrogen 2.911 N/A ASP 68.A N LYS 64.A O no hydrogen 2.844 N/A SER 69.A N LYS 65.A O no hydrogen 3.106 N/A SER 69.A OG VAL 66.A O no hydrogen 2.727 N/A PHE 70.A N VAL 66.A O no hydrogen 2.989 N/A SER 71.A N LEU 67.A O no hydrogen 2.840 N/A SER 71.A OG LEU 67.A O no hydrogen 3.219 N/A ASN 72.A N ASP 68.A O no hydrogen 3.050 N/A GLY 73.A N SER 69.A O no hydrogen 3.014 N/A MET 74.A N PHE 70.A O no hydrogen 2.877 N/A LYS 75.A N ASN 72.A O no hydrogen 2.981 N/A HIS 76.A N GLY 73.A O no hydrogen 2.966 N/A ASP 78.A N ASP 78.A OD1 no hydrogen 2.660 N/A ASP 79.A N HIS 76.A O no hydrogen 3.003 N/A GLY 82.A N ASP 79.A OD1 no hydrogen 3.073 N/A THR 83.A N ASP 79.A O no hydrogen 3.073 N/A THR 83.A OG1 ASP 79.A O no hydrogen 2.656 N/A PHE 84.A N LEU 80.A O no hydrogen 2.932 N/A ALA 85.A N GLY 82.A O no hydrogen 3.477 N/A SER 88.A N PHE 84.A O no hydrogen 2.747 N/A SER 88.A OG ALA 139.A O no hydrogen 3.570 N/A SER 88.A OG LEU 140.A O no hydrogen 2.691 N/A GLU 89.A N ALA 85.A O no hydrogen 3.204 N/A LEU 90.A N ALA 86.A O no hydrogen 3.075 N/A HIS 91.A N LEU 87.A O no hydrogen 3.011 N/A HIS 91.A ND1 LEU 87.A O no hydrogen 2.665 N/A CYS 92.A N SER 88.A O no hydrogen 3.212 N/A CYS 92.A SG ASP 93.A OD1 no hydrogen 3.633 N/A ASP 93.A N GLU 89.A O no hydrogen 2.930 N/A LYS 94.A N LEU 90.A O no hydrogen 3.112 N/A LEU 95.A N LEU 90.A O no hydrogen 3.040 N/A HIS 96.A N CYS 92.A O no hydrogen 3.051 N/A VAL 97.A N HIS 91.A O no hydrogen 2.955 N/A GLU 100.A N ASP 98.A OD1 no hydrogen 3.053 N/A ASN 101.A N ASP 98.A O no hydrogen 3.032 N/A ASN 101.A ND2 ASP 98.A O no hydrogen 3.161 N/A PHE 102.A N PRO 99.A O no hydrogen 3.014 N/A LEU 104.A N GLU 100.A O no hydrogen 3.247 N/A LEU 105.A N ASN 101.A O no hydrogen 3.073 N/A GLY 106.A N PHE 102.A O no hydrogen 3.040 N/A ASN 107.A N LYS 103.A O no hydrogen 2.975 N/A VAL 108.A N LEU 104.A O no hydrogen 2.855 N/A LEU 109.A N LEU 105.A O no hydrogen 2.790 N/A VAL 110.A N GLY 106.A O no hydrogen 3.133 N/A VAL 111.A N ASN 107.A O no hydrogen 2.974 N/A VAL 112.A N VAL 108.A O no hydrogen 2.877 N/A LEU 113.A N LEU 109.A O no hydrogen 2.945 N/A ALA 114.A N VAL 110.A O no hydrogen 3.039 N/A ARG 115.A N VAL 111.A O no hydrogen 2.987 N/A ARG 115.A NE GLU 25.A OE2 no hydrogen 2.775 N/A ARG 115.A NH2 GLU 25.A OE1 no hydrogen 2.973 N/A ASN 116.A N VAL 112.A O no hydrogen 2.925 N/A ASN 116.A ND2 GLU 25.A OE1 no hydrogen 3.028 N/A ASN 116.A ND2 VAL 112.A O no hydrogen 2.819 N/A PHE 117.A N LEU 113.A O no hydrogen 2.904 N/A GLY 118.A N ALA 114.A O no hydrogen 2.807 N/A GLU 120.A N PHE 117.A O no hydrogen 3.104 N/A PHE 121.A N GLY 118.A O no hydrogen 3.154 N/A LEU 125.A N THR 122.A OG1 no hydrogen 3.109 N/A GLN 126.A N THR 122.A O no hydrogen 2.860 N/A GLN 126.A NE2 GLN 130.A OE1 no hydrogen 3.152 N/A ALA 127.A N PRO 123.A O no hydrogen 2.934 N/A ASP 128.A N VAL 124.A O no hydrogen 3.005 N/A PHE 129.A N LEU 125.A O no hydrogen 3.052 N/A GLN 130.A N GLN 126.A O no hydrogen 2.807 N/A LYS 131.A N ALA 127.A O no hydrogen 3.288 N/A LYS 131.A N ASP 128.A O no hydrogen 3.200 N/A VAL 132.A N ASP 128.A O no hydrogen 3.234 N/A VAL 133.A N PHE 129.A O no hydrogen 3.033 N/A ALA 134.A N GLN 130.A O no hydrogen 3.111 N/A GLY 135.A N LYS 131.A O no hydrogen 2.794 N/A VAL 136.A N VAL 132.A O no hydrogen 2.785 N/A ALA 137.A N VAL 133.A O no hydrogen 2.870 N/A ASN 138.A N ALA 134.A O no hydrogen 3.010 N/A ALA 139.A N GLY 135.A O no hydrogen 3.055 N/A LEU 140.A N VAL 136.A O no hydrogen 2.922 N/A ALA 141.A N ALA 137.A O no hydrogen 3.079 N/A ALA 141.A N ASN 138.A O no hydrogen 3.258 N/A HIS 142.A N ALA 139.A O no hydrogen 3.445 N/A TYR 144.A N ALA 141.A O no hydrogen 2.847 N/A HIS 145.A N HIS 142.A O no hydrogen 3.120 N/A