Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1duo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 6.A OE2 no hydrogen 2.597 N/A GLU 6.A N SER 3.A O no hydrogen 3.014 N/A GLU 6.A N SER 3.A OG no hydrogen 3.177 N/A TRP 7.A N SER 3.A O no hydrogen 3.064 N/A GLN 8.A N GLU 4.A O no hydrogen 2.882 N/A GLN 8.A NE2 GLU 4.A OE2 no hydrogen 3.178 N/A LEU 9.A N GLY 5.A O no hydrogen 3.200 N/A VAL 10.A N GLU 6.A O no hydrogen 3.009 N/A VAL 10.A N TRP 7.A O no hydrogen 3.030 N/A LEU 11.A N TRP 7.A O no hydrogen 3.014 N/A HIS 12.A N GLN 8.A O no hydrogen 2.767 N/A HIS 12.A NE2 ASP 122.A OD2 no hydrogen 3.122 N/A VAL 13.A N LEU 9.A O no hydrogen 3.146 N/A TRP 14.A N VAL 10.A O no hydrogen 2.864 N/A ALA 15.A N LEU 11.A O no hydrogen 3.371 N/A LYS 16.A N VAL 13.A O no hydrogen 3.080 N/A VAL 17.A N VAL 13.A O no hydrogen 3.380 N/A GLU 18.A N TRP 14.A O no hydrogen 2.898 N/A ALA 19.A N LYS 16.A O no hydrogen 2.985 N/A ASP 20.A N VAL 17.A O no hydrogen 3.032 N/A GLY 23.A N ASP 20.A OD2 no hydrogen 2.978 N/A HIS 24.A N ASP 20.A O no hydrogen 2.873 N/A HIS 24.A ND1 ASP 20.A O no hydrogen 2.693 N/A HIS 24.A NE2 HIS 119.A NE2 no hydrogen 2.669 N/A GLY 25.A N VAL 21.A O no hydrogen 2.654 N/A GLN 26.A N ALA 22.A O no hydrogen 3.165 N/A ASP 27.A N GLY 23.A O no hydrogen 3.271 N/A ILE 28.A N HIS 24.A O no hydrogen 3.092 N/A LEU 29.A N GLY 25.A O no hydrogen 2.938 N/A ILE 30.A N GLN 26.A O no hydrogen 2.882 N/A ARG 31.A N ASP 27.A O no hydrogen 2.830 N/A LEU 32.A N ILE 28.A O no hydrogen 3.066 N/A PHE 33.A N LEU 29.A O no hydrogen 2.998 N/A LYS 34.A N ILE 30.A O no hydrogen 2.952 N/A SER 35.A N ARG 31.A O no hydrogen 2.902 N/A SER 35.A OG ARG 31.A O no hydrogen 2.649 N/A HIS 36.A N LEU 32.A O no hydrogen 3.100 N/A GLU 38.A N GLU 38.A OE2 no hydrogen 2.570 N/A THR 39.A N HIS 36.A O no hydrogen 3.005 N/A THR 39.A OG1 HIS 36.A O no hydrogen 2.708 N/A LEU 40.A N PRO 37.A O no hydrogen 2.829 N/A GLU 41.A N GLU 38.A O no hydrogen 3.356 N/A LYS 42.A N THR 39.A O no hydrogen 3.033 N/A LYS 42.A NZ HIS 97.A O no hydrogen 3.208 N/A LYS 42.A NZ LYS 98.A O no hydrogen 2.851 N/A PHE 43.A N LEU 40.A O no hydrogen 2.815 N/A PHE 46.A N PHE 43.A O no hydrogen 3.204 N/A LYS 47.A N PHE 43.A O no hydrogen 3.021 N/A LEU 49.A N PHE 46.A O no hydrogen 2.628 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.187 N/A MET 55.A N THR 51.A O no hydrogen 2.792 N/A LYS 56.A N GLU 52.A O no hydrogen 2.813 N/A ALA 57.A N ALA 53.A O no hydrogen 3.081 N/A SER 58.A N MET 55.A O no hydrogen 3.183 N/A LEU 61.A N SER 58.A OG no hydrogen 2.764 N/A LYS 62.A N SER 58.A O no hydrogen 3.071 N/A LYS 63.A N GLU 59.A O no hydrogen 2.751 N/A HIS 64.A N ASP 60.A O no hydrogen 2.878 N/A GLY 65.A N LEU 61.A O no hydrogen 2.910 N/A VAL 66.A N LYS 62.A O no hydrogen 3.239 N/A THR 67.A N LYS 63.A O no hydrogen 3.243 N/A THR 67.A OG1 LYS 63.A O no hydrogen 3.360 N/A VAL 68.A N HIS 64.A O no hydrogen 3.008 N/A LEU 69.A N GLY 65.A O no hydrogen 2.745 N/A THR 70.A N VAL 66.A O no hydrogen 2.813 N/A THR 70.A OG1 VAL 66.A O no hydrogen 2.659 N/A ALA 71.A N THR 67.A O no hydrogen 3.206 N/A LEU 72.A N VAL 68.A O no hydrogen 2.966 N/A GLY 73.A N LEU 69.A O no hydrogen 2.970 N/A ALA 74.A N THR 70.A O no hydrogen 2.911 N/A ILE 75.A N ALA 71.A O no hydrogen 2.991 N/A LEU 76.A N LEU 72.A O no hydrogen 2.854 N/A LYS 77.A N GLY 73.A O no hydrogen 3.123 N/A LYS 77.A NZ GLU 18.A OE1 no hydrogen 2.584 N/A LYS 78.A N ILE 75.A O no hydrogen 2.970 N/A LYS 78.A NZ HIS 81.A O no hydrogen 2.775 N/A LYS 79.A N LEU 76.A O no hydrogen 3.080 N/A LYS 79.A NZ GLU 4.A OE2 no hydrogen 3.182 N/A HIS 81.A N LYS 78.A O no hydrogen 2.908 N/A HIS 82.A N GLY 80.A O no hydrogen 3.028 N/A HIS 82.A NE2 ASP 141.A OD2 no hydrogen 2.445 N/A LEU 86.A N HIS 82.A O no hydrogen 2.745 N/A LYS 87.A N GLU 83.A O no hydrogen 2.901 N/A LEU 89.A N LEU 86.A O no hydrogen 3.078 N/A ALA 90.A N LEU 86.A O no hydrogen 3.118 N/A GLN 91.A N LYS 87.A O no hydrogen 2.898 N/A SER 92.A N PRO 88.A O no hydrogen 2.867 N/A SER 92.A OG LEU 89.A O no hydrogen 3.561 N/A GLY 93.A N LEU 89.A O no hydrogen 2.786 N/A ALA 94.A N ALA 90.A O no hydrogen 2.727 N/A THR 95.A N GLN 91.A O no hydrogen 2.752 N/A THR 95.A OG1 GLN 91.A O no hydrogen 3.142 N/A LYS 96.A N SER 92.A O no hydrogen 2.922 N/A HIS 97.A N SER 92.A O no hydrogen 2.990 N/A LYS 98.A NZ ALA 94.A O no hydrogen 2.633 N/A ILE 99.A N GLY 93.A O no hydrogen 3.103 N/A ILE 101.A N GLN 152.A OE1 no hydrogen 3.329 N/A LEU 104.A N PRO 100.A O no hydrogen 3.228 N/A GLU 105.A N ILE 101.A O no hydrogen 2.698 N/A PHE 106.A N LYS 102.A O no hydrogen 2.959 N/A ILE 107.A N TYR 103.A O no hydrogen 3.034 N/A SER 108.A N LEU 104.A O no hydrogen 3.051 N/A SER 108.A OG LEU 104.A O no hydrogen 2.613 N/A GLU 109.A N GLU 105.A O no hydrogen 2.973 N/A ALA 110.A N PHE 106.A O no hydrogen 3.008 N/A ILE 111.A N ILE 107.A O no hydrogen 2.720 N/A ILE 112.A N SER 108.A O no hydrogen 3.062 N/A HIS 113.A N GLU 109.A O no hydrogen 3.086 N/A VAL 114.A N ALA 110.A O no hydrogen 3.051 N/A LEU 115.A N ILE 111.A O no hydrogen 3.023 N/A HIS 116.A N ILE 112.A O no hydrogen 2.772 N/A HIS 116.A ND1 PHE 123.A O no hydrogen 3.127 N/A SER 117.A N HIS 113.A O no hydrogen 2.888 N/A SER 117.A OG HIS 113.A O no hydrogen 3.021 N/A ARG 118.A N VAL 114.A O no hydrogen 2.782 N/A ARG 118.A NH1 ASP 27.A OD2 no hydrogen 2.502 N/A ARG 118.A NH2 ASP 20.A OD1 no hydrogen 3.432 N/A HIS 119.A N LEU 115.A O no hydrogen 2.991 N/A HIS 119.A NE2 HIS 24.A NE2 no hydrogen 2.669 N/A ASP 122.A N HIS 119.A O no hydrogen 2.669 N/A PHE 123.A N PRO 120.A O no hydrogen 2.843 N/A ALA 127.A N ASP 126.A OD2 no hydrogen 2.564 N/A GLN 128.A N GLY 124.A O no hydrogen 2.760 N/A GLY 129.A N ALA 125.A O no hydrogen 2.938 N/A ALA 130.A N ASP 126.A O no hydrogen 3.098 N/A MET 131.A N ALA 127.A O no hydrogen 2.744 N/A ASN 132.A N GLN 128.A O no hydrogen 2.881 N/A LYS 133.A N GLY 129.A O no hydrogen 3.187 N/A LYS 133.A NZ VAL 1.A O no hydrogen 3.199 N/A ALA 134.A N ALA 130.A O no hydrogen 3.065 N/A LEU 135.A N MET 131.A O no hydrogen 2.819 N/A GLU 136.A N ASN 132.A O no hydrogen 2.938 N/A LEU 137.A N LYS 133.A O no hydrogen 2.786 N/A PHE 138.A N ALA 134.A O no hydrogen 3.149 N/A ARG 139.A N LEU 135.A O no hydrogen 3.153 N/A LYS 140.A N GLU 136.A O no hydrogen 3.041 N/A ASP 141.A N LEU 137.A O no hydrogen 3.065 N/A ILE 142.A N PHE 138.A O no hydrogen 2.850 N/A ALA 143.A N ARG 139.A O no hydrogen 2.921 N/A ALA 144.A N LYS 140.A O no hydrogen 3.211 N/A LYS 145.A N ASP 141.A O no hydrogen 3.129 N/A TYR 146.A N ILE 142.A O no hydrogen 2.779 N/A TYR 146.A OH ILE 99.A O no hydrogen 2.683 N/A LYS 147.A N ALA 143.A O no hydrogen 3.188 N/A GLU 148.A N ALA 144.A O no hydrogen 3.017 N/A LEU 149.A N LYS 145.A O no hydrogen 3.297 N/A LEU 149.A N TYR 146.A O no hydrogen 3.089 N/A GLY 150.A N LYS 147.A O no hydrogen 2.755 N/A TYR 151.A N TYR 146.A O no hydrogen 2.812 N/A